A0A087Y1S0_POEFO Loading...

Gastrin/cholecystokinin type B receptor

Receptor for gastrin and cholecystokinin. The CCK-B receptors occur throughout the central nervous system where they modulate anxiety, analgesia, arousal, and neuroleptic activity. This receptor mediates its action by association with G proteins that activate a phosphatidylinositol-calcium second messenger system.

AlphaFold DB , UniProt , Accession A0A087Y1S0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 447 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	29.9	Very low	236 Å²	236	160.7 Å²	160.7	100%	1.163	82%	0.82	S	S	*	*				0	92.2	0	-176.6	-175.4	-73	0	0	105.4
2	E	23.3	Very low	30.2	Very low	184 Å²	184	156.3 Å²	156.3	86%	0.86	80%	0.8	S	S	*	*			trans	-173.4	114.9	168	-109.3	164.7	-165.6	0	0	109.8
3	T	27	Very low	31.2	Very low	130 Å²	130	150.6 Å²	150.6	80%	0.798	78%	0.783	S	S	*	*			trans	33	95.7	144	35.7	0	0	0	0	119.8
4	I	27.3	Very low	32.2	Very low	168 Å²	168	145.2 Å²	145.2	86%	0.862	76%	0.759	S	S	*	*			trans	-89.1	110.2	158.1	-65.1	172.5	0	0	0	108.1
5	T	29.2	Very low	32.9	Very low	116 Å²	116	142.5 Å²	142.5	71%	0.712	75%	0.746	S	S	*	*			trans	-66.9	131.2	179.4	32.8	0	0	0	0	113.2	Y7	T5-Y7 PolarHBondContact O-N 2.88Å; T5-Y7 VanDerWaalsContact O-N 3.07Å
6	T	28.5	Very low	33.7	Very low	143 Å²	143	138.9 Å²	138.9	88%	0.877	73%	0.727	S	S	*	*			trans	-67.6	79	174.6	43.1	0	0	0	0	113.2
7	Y	27.1	Very low	34.2	Very low	188 Å²	188	134.8 Å²	134.8	74%	0.737	71%	0.706	S	S	*	*			trans	-121.4	1.4	176.6	-120.6	-88.4	0	0	0	116.2	T5	T5-Y7 PolarHBondContact O-N 2.88Å; T5-Y7 VanDerWaalsContact O-N 3.07Å
8	N	28.5	Very low	34.8	Very low	164 Å²	164	132.7 Å²	132.7	88%	0.877	70%	0.696	S	S	*	*	S	Bend	trans	-118.2	26.3	-172.6	-79.5	-24.6	0	0	0	116.1
9	F	28.5	Very low	35.7	Very low	176 Å²	176	129.7 Å²	129.7	77%	0.772	68%	0.684	S	S	*	*			trans	-137.8	44.1	170.9	-148.1	-99.4	0	0	0	112.9	I11	F9-I11 VanDerWaalsContact C-N 3.33Å; F9-I11 HydrophobicContact CD1-CD1 4.25Å; F9-I11 HydrophobicContact CD1-CG1 4.22Å; F9-I11 HydrophobicContact CE1-CD1 3.43Å; F9-I11 VanDerWaalsContact CE1-CD1 3.43Å; F9-I11 HydrophobicContact CE1-CG1 3.82Å; F9-I11 HydrophobicContact CZ-CD1 3.74Å; F9-I11 HydrophobicContact CZ-CG1 4.12Å; F9-I11 PolarHBondContact O-N 3.2Å
10	L	32	Very low	36.1	Very low	154 Å²	154	126 Å²	126	81%	0.806	66%	0.661	S	S	*	*			trans	-80.6	87.9	159.4	-74.5	167	0	0	0	107.6	N12	L10-N12 PolarHBondContact O-N 3.48Å
11	I	37.3	Very low	36.4	Very low	109 Å²	109	122.5 Å²	122.5	56%	0.559	65%	0.647	S	S	*	*			trans	-57.5	122.1	158.4	-68.2	175.7	0	0	0	106.5	F9 S13	F9-I11 VanDerWaalsContact C-N 3.33Å; F9-I11 HydrophobicContact CD1-CD1 4.25Å; F9-I11 HydrophobicContact CD1-CG1 4.22Å; F9-I11 HydrophobicContact CE1-CD1 3.43Å; F9-I11 VanDerWaalsContact CE1-CD1 3.43Å; F9-I11 HydrophobicContact CE1-CG1 3.82Å; F9-I11 HydrophobicContact CZ-CD1 3.74Å; F9-I11 HydrophobicContact CZ-CG1 4.12Å; F9-I11 PolarHBondContact O-N 3.2Å; I11-S13 PolarHBondContact O-N 3.19Å
12	N	33.4	Very low	36.7	Very low	108 Å²	108	122.2 Å²	122.2	58%	0.578	63%	0.633	S	S	*	*			trans	-35.6	113.6	-178.7	-123.2	-5.4	0	0	0	112.7	L10 T14 D15	L10-N12 PolarHBondContact O-N 3.48Å; N12-T14 PolarHBondContact O-N 3.29Å; N12-T14 VanDerWaalsContact O-N 3.1Å; N12-D15 PolarHBondContact O-N 3.28Å
13	S	43.4	Very low	37.5	Very low	82 Å²	82	121 Å²	121	57%	0.573	63%	0.626	S	S	*	*	H	α-helix	trans	-60.9	-18.9	-179.9	59.8	0	0	0	0	113.6	I11 N17	I11-S13 PolarHBondContact O-N 3.19Å; S13-N17 WeakPolarHBondContact O-CB 3.46Å; S13-N17 VanDerWaalsContact O-CG 3.27Å; S13-N17 PolarHBondContact O-N 3.35Å; S13-N17 PolarHBondContact O-ND2 3.13Å
14	T	45.4	Very low	37.8	Very low	75 Å²	75	118.1 Å²	118.1	46%	0.46	62%	0.622	S	S	.	*	H	α-helix	trans	-72	-34.7	179.9	43.7	0	0	0	0	113.4	N12 N18	N12-T14 PolarHBondContact O-N 3.29Å; N12-T14 VanDerWaalsContact O-N 3.1Å; T14-N18 WeakPolarHBondContact O-CB 3.34Å; T14-N18 PolarHBondContact O-N 3.48Å; T14-N18 VanDerWaalsContact O-N 3.12Å; T14-N18 PolarHBondContact O-ND2 2.97Å
15	D	43	Very low	38.5	Very low	105 Å²	105	112.5 Å²	112.5	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-78.4	-38.7	180	-93.7	-32.3	0	0	0	112.5	N12 N18 V19	N12-D15 PolarHBondContact O-N 3.28Å; D15-N18 PolarHBondContact O-N 3.46Å; D15-V19 VanDerWaalsContact O-CG2 3.3Å; D15-V19 WeakPolarHBondContact O-CG2 3.49Å; D15-V19 PolarHBondContact O-N 3.12Å
16	L	45.2	Very low	38.6	Very low	85 Å²	85	113.2 Å²	113.2	45%	0.445	59%	0.592	S	S	.	*	H	α-helix	trans	-65	-42.4	174.2	-98.5	152.1	0	0	0	111.3	N18 V19 F20	L16-N18 VanDerWaalsContact C-N 3.33Å; L16-N18 PolarHBondContact O-N 3.35Å; L16-V19 PolarHBondContact O-N 3.49Å; L16-F20 HydrophobicContact CB-CD2 4.35Å; L16-F20 HydrophobicContact CB-CE2 4.14Å; L16-F20 HydrophobicContact CD2-CD2 4.16Å; L16-F20 HydrophobicContact CD2-CE2 3.31Å; L16-F20 HydrophobicContact CD2-CZ 3.71Å; L16-F20 HydrophobicContact CG-CE2 4.33Å; L16-F20 WeakPolarHBondContact O-CD2 3.33Å; L16-F20 WeakPolarHBondContact O-CG 3.44Å; L16-F20 PolarHBondContact O-N 3.46Å
17	N	42.9	Very low	39.2	Very low	68 Å²	68	109.9 Å²	109.9	36%	0.364	57%	0.568	S	S	.	*	H	α-helix	trans	-64.6	-35.8	175.9	-77.7	-17.5	0	0	0	112.5	S13 F20 S21	S13-N17 WeakPolarHBondContact O-CB 3.46Å; S13-N17 VanDerWaalsContact O-CG 3.27Å; S13-N17 PolarHBondContact O-N 3.35Å; S13-N17 PolarHBondContact O-ND2 3.13Å; N17-F20 PolarHBondContact O-N 3.24Å; N17-S21 WeakPolarHBondContact O-CB 3.5Å; N17-S21 PolarHBondContact O-N 3.48Å; N17-S21 PolarHBondContact O-OG 3.49Å
18	N	43.9	Very low	39.7	Very low	98 Å²	98	104.4 Å²	104.4	52%	0.524	56%	0.557	S	S	.	*	H	α-helix	trans	-69.9	-30.7	173.4	-82	-24.3	0	0	0	113.5	T14 D15 L16 S21 R22	T14-N18 WeakPolarHBondContact O-CB 3.34Å; T14-N18 PolarHBondContact O-N 3.48Å; T14-N18 VanDerWaalsContact O-N 3.12Å; T14-N18 PolarHBondContact O-ND2 2.97Å; D15-N18 PolarHBondContact O-N 3.46Å; L16-N18 VanDerWaalsContact C-N 3.33Å; L16-N18 PolarHBondContact O-N 3.35Å; N18-S21 WeakPolarHBondContact CA-OG 3.37Å; N18-S21 PolarHBondContact O-OG 3.07Å; N18-S21 VanDerWaalsContact O-OG 3.06Å; N18-R22 PolarHBondContact O-N 3.25Å
19	V	51.6	Low	39.8	Very low	76 Å²	76	104 Å²	104	46%	0.461	56%	0.555	S	S	.	*	H	α-helix	trans	-72.2	-44.7	172.3	172	0	0	0	0	110.4	D15 L16 R22 F23	D15-V19 VanDerWaalsContact O-CG2 3.3Å; D15-V19 WeakPolarHBondContact O-CG2 3.49Å; D15-V19 PolarHBondContact O-N 3.12Å; L16-V19 PolarHBondContact O-N 3.49Å; V19-R22 PolarHBondContact O-N 3.17Å; V19-F23 HydrophobicContact CG1-CD2 4.29Å; V19-F23 HydrophobicContact CG1-CE2 4.25Å; V19-F23 VanDerWaalsContact O-CD2 3.26Å; V19-F23 WeakPolarHBondContact O-CD2 3.5Å; V19-F23 PolarHBondContact O-N 3.35Å
20	F	45.1	Very low	40.2	Very low	54 Å²	54	105.7 Å²	105.7	24%	0.237	56%	0.558	C	S	.	*	H	α-helix	trans	-67.3	-35.3	178.9	-71.8	-55.9	0	0	0	113.2	L16 N17 R22 F23 G24 I25 I27	L16-F20 HydrophobicContact CB-CD2 4.35Å; L16-F20 HydrophobicContact CB-CE2 4.14Å; L16-F20 HydrophobicContact CD2-CD2 4.16Å; L16-F20 HydrophobicContact CD2-CE2 3.31Å; L16-F20 HydrophobicContact CD2-CZ 3.71Å; L16-F20 HydrophobicContact CG-CE2 4.33Å; L16-F20 WeakPolarHBondContact O-CD2 3.33Å; L16-F20 WeakPolarHBondContact O-CG 3.44Å; L16-F20 PolarHBondContact O-N 3.46Å; N17-F20 PolarHBondContact O-N 3.24Å; F20-R22 PolarHBondContact O-N 3.09Å; F20-F23 CarbonylContact O-C 3.32Å; F20-F23 WeakPolarHBondContact O-CA 3.35Å; F20-F23 PolarHBondContact O-N 2.95Å; F20-G24 PolarHBondContact O-N 3.47Å; F20-G24 VanDerWaalsContact O-N 3.08Å; F20-I25 CarbonylContact C-O 3.07Å; F20-I25 VanDerWaalsContact C-O 3.32Å; F20-I25 HydrophobicContact CB-CB 4.17Å; F20-I25 WeakPolarHBondContact CB-O 3.49Å; F20-I25 HydrophobicContact CD1-CD1 4.39Å; F20-I25 PolarHBondContact O-N 3.18Å; F20-I27 HydrophobicContact CD2-CD1 3.94Å; F20-I27 HydrophobicContact CE2-CD1 4.27Å; F20-I27 HydrophobicContact CG-CD1 4.29Å
21	S	41.7	Very low	39.9	Very low	53 Å²	53	106.2 Å²	106.2	37%	0.371	56%	0.557	S	S	.	*	H	α-helix	trans	-66.7	-34.7	175.1	68.2	0	0	0	0	112.5	N17 N18 F23 G24	N17-S21 WeakPolarHBondContact O-CB 3.5Å; N17-S21 PolarHBondContact O-N 3.48Å; N17-S21 PolarHBondContact O-OG 3.49Å; N18-S21 WeakPolarHBondContact CA-OG 3.37Å; N18-S21 PolarHBondContact O-OG 3.07Å; N18-S21 VanDerWaalsContact O-OG 3.06Å; S21-F23 PolarHBondContact O-N 3.46Å; S21-G24 PolarHBondContact O-N 3Å
22	R	45.6	Very low	39.8	Very low	230 Å²	230	105.7 Å²	105.7	87%	0.868	56%	0.56	S	S	*	*	H	α-helix	trans	-63.8	-24.1	169.6	-80.5	-173.7	177.5	-164.7	1.3	113.6	N18 V19 F20	N18-R22 PolarHBondContact O-N 3.25Å; V19-R22 PolarHBondContact O-N 3.17Å; F20-R22 PolarHBondContact O-N 3.09Å
23	F	41.6	Very low	39.7	Very low	160 Å²	160	112 Å²	112	70%	0.702	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	7.5	172.7	-73.6	-74.6	0	0	0	113.5	V19 F20 S21	V19-F23 HydrophobicContact CG1-CD2 4.29Å; V19-F23 HydrophobicContact CG1-CE2 4.25Å; V19-F23 VanDerWaalsContact O-CD2 3.26Å; V19-F23 WeakPolarHBondContact O-CD2 3.5Å; V19-F23 PolarHBondContact O-N 3.35Å; F20-F23 CarbonylContact O-C 3.32Å; F20-F23 WeakPolarHBondContact O-CA 3.35Å; F20-F23 PolarHBondContact O-N 2.95Å; S21-F23 PolarHBondContact O-N 3.46Å
24	G	33.2	Very low	39.3	Very low	69 Å²	69	119.6 Å²	119.6	71%	0.711	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.7	20.1	176.9	0	0	0	0	0	115.2	F20 S21	F20-G24 PolarHBondContact O-N 3.47Å; F20-G24 VanDerWaalsContact O-N 3.08Å; S21-G24 PolarHBondContact O-N 3Å
25	I	40.6	Very low	38.8	Very low	49 Å²	49	118.9 Å²	118.9	25%	0.251	60%	0.599	S	S	.	*			trans	-108.7	102.4	178.8	-55	174.2	0	0	0	108.2	F20 I27 L344	F20-I25 CarbonylContact C-O 3.07Å; F20-I25 VanDerWaalsContact C-O 3.32Å; F20-I25 HydrophobicContact CB-CB 4.17Å; F20-I25 WeakPolarHBondContact CB-O 3.49Å; F20-I25 HydrophobicContact CD1-CD1 4.39Å; F20-I25 PolarHBondContact O-N 3.18Å; I25-I27 HydrophobicContact CG2-CD1 4.25Å; I25-I27 HydrophobicContact CG2-CG1 3.93Å; I25-L344 HydrophobicContact CD1-CD1 4.06Å
26	N	32.7	Very low	38.6	Very low	132 Å²	132	119.5 Å²	119.5	71%	0.706	61%	0.609	S	S	*	*			trans	-90.2	116.1	173.4	-114.6	2	0	0	0	109.9
27	I	41.6	Very low	37.8	Very low	72 Å²	72	120 Å²	120	37%	0.369	62%	0.619	S	S	.	*			trans	-106.5	45.2	177.5	-48.5	175.6	0	0	0	109.6	F20 I25	F20-I27 HydrophobicContact CD2-CD1 3.94Å; F20-I27 HydrophobicContact CE2-CD1 4.27Å; F20-I27 HydrophobicContact CG-CD1 4.29Å; I25-I27 HydrophobicContact CG2-CD1 4.25Å; I25-I27 HydrophobicContact CG2-CG1 3.93Å
28	S	35.8	Very low	38	Very low	73 Å²	73	122.3 Å²	122.3	51%	0.51	64%	0.638	S	S	.	*			trans	-132.7	105.5	172.1	56.5	0	0	0	0	109.2
29	D	32.1	Very low	37.8	Very low	156 Å²	156	125.1 Å²	125.1	83%	0.834	65%	0.653	S	S	*	*			trans	137.9	107.1	146.8	-69.4	-17.6	0	0	0	111.8	E31	D29-E31 PolarHBondContact O-N 3.18Å
30	Y	35.8	Very low	37.3	Very low	211 Å²	211	126.5 Å²	126.5	83%	0.827	67%	0.666	S	S	*	*			trans	-79.3	94.1	163.1	176.4	-98.7	0	0	0	107.2
31	E	27.1	Very low	37.4	Very low	166 Å²	166	132.6 Å²	132.6	78%	0.776	69%	0.693	S	S	*	*			trans	-110.6	135.2	154.1	-98.3	-143	139	0	0	109.1	D29 R33	D29-E31 PolarHBondContact O-N 3.18Å; E31-R33 PolarHBondContact O-N 3.43Å
32	P	33.7	Very low	38.2	Very low	98 Å²	98	133.3 Å²	133.3	64%	0.636	69%	0.692	S	S	*	*			trans	-70.3	102	174.2	28.8	-29.8	0	0	0	109	R34	P32-R34 PolarHBondContact O-N 3.18Å
33	R	31.1	Very low	39.1	Very low	239 Å²	239	128.3 Å²	128.3	90%	0.902	68%	0.683	S	S	*	*			trans	-58.9	108.1	175	-84.1	-173.1	-162.3	-119.2	-0.6	110.8	E31	E31-R33 PolarHBondContact O-N 3.43Å
34	R	34.8	Very low	40.6	Very low	243 Å²	243	121.7 Å²	121.7	92%	0.917	66%	0.657	S	S	*	*			trans	-64.9	124.4	152.4	-67.1	-179.2	-165.4	169.7	5.1	108.3	P32	P32-R34 PolarHBondContact O-N 3.18Å
35	G	35.2	Very low	42.9	Very low	59 Å²	59	121.2 Å²	121.2	61%	0.608	64%	0.636	S	S	*	*	S	Bend	trans	57	140.8	156.4	0	0	0	0	0	118.7	S37	G35-S37 PolarHBondContact O-N 3.33Å
36	P	38.9	Very low	45.1	Very low	118 Å²	118	122.3 Å²	122.3	77%	0.766	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-70.8	116.9	168.9	29.2	-28.6	0	0	0	109.5
37	S	29.8	Very low	47.7	Very low	95 Å²	95	119.4 Å²	119.4	66%	0.664	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-67.2	138.8	164.2	51.7	0	0	0	0	110	G35	G35-S37 PolarHBondContact O-N 3.33Å
38	P	46.8	Very low	49.8	Very low	117 Å²	117	116.2 Å²	116.2	76%	0.76	62%	0.616	S	S	*	*	S	Bend	trans	-74.4	138.7	178.9	26.6	-21.6	0	0	0	110.6
39	D	40.3	Very low	52.4	Low	157 Å²	157	115.8 Å²	115.8	84%	0.84	61%	0.607	S	S	*	*			trans	63.6	55.3	159.3	-58.4	-27.7	0	0	0	119.8	K41	D39-K41 PolarHBondContact O-N 2.92Å
40	S	41.1	Very low	55.2	Low	105 Å²	105	113 Å²	113	73%	0.734	59%	0.592	S	S	*	*			trans	-73.8	105.4	141	65.1	0	0	0	0	107.7	D42	S40-D42 PolarHBondContact O-N 2.87Å
41	K	45.8	Very low	57.9	Low	183 Å²	183	106 Å²	106	80%	0.796	57%	0.568	S	S	*	*			trans	-49.4	103.6	168.1	-79.6	177.7	178.6	173	0	108.5	D39 N43	D39-K41 PolarHBondContact O-N 2.92Å; K41-N43 PolarHBondContact O-N 2.75Å
42	D	58.6	Low	60.9	Low	67 Å²	67	98.1 Å²	98.1	36%	0.358	53%	0.531	S	S	.	.			trans	-71.6	84.1	178.5	-178.1	13	0	0	0	108.2	S40 S44 Q45	S40-D42 PolarHBondContact O-N 2.87Å; D42-S44 VanDerWaalsContact CG-OG 3.23Å; D42-S44 PolarHBondContact O-N 3.4Å; D42-S44 VanDerWaalsContact OD1-CB 3.25Å; D42-S44 WeakPolarHBondContact OD1-CB 3.37Å; D42-S44 PolarHBondContact OD1-N 3.08Å; D42-S44 PolarHBondContact OD1-OG 3.33Å; D42-S44 PolarHBondContact OD2-OG 2.94Å; D42-Q45 HydrophobicContact CB-CG 4.09Å; D42-Q45 PolarHBondContact O-N 3.16Å; D42-Q45 WeakPolarHBondContact OD2-CG 3.22Å
43	N	64.2	Low	63.8	Low	126 Å²	126	95.8 Å²	95.8	67%	0.674	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-14.3	177.8	-69.7	-22.1	0	0	0	112.4	K41 V47	K41-N43 PolarHBondContact O-N 2.75Å; N43-V47 WeakPolarHBondContact O-CG2 3.31Å
44	S	72.6	Confident	66.8	Low	21 Å²	21	88.3 Å²	88.3	15%	0.147	49%	0.494	C	S	.	.	H	α-helix	trans	-76.7	-22.9	176.4	84.3	0	0	0	0	113.8	D42 R48	D42-S44 VanDerWaalsContact CG-OG 3.23Å; D42-S44 PolarHBondContact O-N 3.4Å; D42-S44 VanDerWaalsContact OD1-CB 3.25Å; D42-S44 WeakPolarHBondContact OD1-CB 3.37Å; D42-S44 PolarHBondContact OD1-N 3.08Å; D42-S44 PolarHBondContact OD1-OG 3.33Å; D42-S44 PolarHBondContact OD2-OG 2.94Å; S44-R48 VanDerWaalsContact O-CB 3.26Å; S44-R48 WeakPolarHBondContact O-CB 3.27Å; S44-R48 PolarHBondContact O-N 3.14Å
45	Q	81.6	Confident	69.7	Low	59 Å²	59	77.3 Å²	77.3	28%	0.276	45%	0.453	S	S	.	.	H	α-helix	trans	-64.3	-54.8	179.1	-66.9	-156.4	-0.4	0	0	114.1	D42 V47 R48 I49	D42-Q45 HydrophobicContact CB-CG 4.09Å; D42-Q45 PolarHBondContact O-N 3.16Å; D42-Q45 WeakPolarHBondContact OD2-CG 3.22Å; Q45-V47 VanDerWaalsContact C-N 3.28Å; Q45-V47 PolarHBondContact O-N 3.2Å; Q45-R48 WeakPolarHBondContact O-CB 3.35Å; Q45-R48 PolarHBondContact O-N 3Å; Q45-R48 VanDerWaalsContact O-N 3.16Å; Q45-I49 WeakPolarHBondContact O-CG1 3.32Å; Q45-I49 PolarHBondContact O-N 3.26Å
46	P	87.5	Confident	72.5	Confident	71 Å²	71	77.2 Å²	77.2	46%	0.461	44%	0.436	S	S	.	.	H	α-helix	trans	-61.6	-39.1	179.8	23.3	-33.7	0	0	0	111.5	R48 I49 I50	P46-R48 PolarHBondContact O-N 3.31Å; P46-I49 PolarHBondContact O-N 2.96Å; P46-I50 VanDerWaalsContact O-CG1 3.27Å; P46-I50 WeakPolarHBondContact O-CG1 3.31Å; P46-I50 PolarHBondContact O-N 3.49Å
47	V	88.1	Confident	75.2	Confident	71 Å²	71	76 Å²	76	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-58.8	-46.7	174.8	175.6	0	0	0	0	110.9	N43 Q45 I49 I50 L51	N43-V47 WeakPolarHBondContact O-CG2 3.31Å; Q45-V47 VanDerWaalsContact C-N 3.28Å; Q45-V47 PolarHBondContact O-N 3.2Å; V47-I49 PolarHBondContact O-N 3.37Å; V47-I50 PolarHBondContact O-N 2.83Å; V47-L51 HydrophobicContact CG1-CD1 3.76Å; V47-L51 HydrophobicContact CG1-CG 4.36Å; V47-L51 WeakPolarHBondContact O-CB 3.33Å; V47-L51 VanDerWaalsContact O-CG 3.25Å; V47-L51 WeakPolarHBondContact O-CG 3.33Å; V47-L51 PolarHBondContact O-N 3.49Å
48	R	84.9	Confident	78.4	Confident	6 Å²	6	75.2 Å²	75.2	2%	0.023	41%	0.411	C	S	.	.	H	α-helix	trans	-59.2	-47.7	176.8	178.4	172.3	64.9	-120.2	4.8	111.7	S44 Q45 P46 I50 L51 Y52 N109 S350	S44-R48 VanDerWaalsContact O-CB 3.26Å; S44-R48 WeakPolarHBondContact O-CB 3.27Å; S44-R48 PolarHBondContact O-N 3.14Å; Q45-R48 WeakPolarHBondContact O-CB 3.35Å; Q45-R48 PolarHBondContact O-N 3Å; Q45-R48 VanDerWaalsContact O-N 3.16Å; P46-R48 PolarHBondContact O-N 3.31Å; R48-I50 VanDerWaalsContact C-N 3.35Å; R48-I50 PolarHBondContact O-N 3.01Å; R48-L51 PolarHBondContact O-N 3.07Å; R48-Y52 HydrophobicContact CG-CD2 3.48Å; R48-Y52 VanDerWaalsContact CG-CD2 3.48Å; R48-Y52 HydrophobicContact CG-CE2 3.54Å; R48-Y52 VanDerWaalsContact O-CD2 3.31Å; R48-Y52 WeakPolarHBondContact O-CD2 3.26Å; R48-Y52 PolarHBondContact O-N 3.46Å; R48-N109 PolarHBondContact NH2-O 2.89Å; R48-N109 VanDerWaalsContact NH2-O 3.09Å; R48-S350 WeakPolarHBondContact CD-OG 3.25Å
49	I	89.9	Confident	80.7	Confident	64 Å²	64	69.7 Å²	69.7	33%	0.328	38%	0.375	S	S	.	.	H	α-helix	trans	-59.8	-47	180	-66.3	166.6	0	0	0	110.6	Q45 P46 V47 L51 S53 L106 V110	Q45-I49 WeakPolarHBondContact O-CG1 3.32Å; Q45-I49 PolarHBondContact O-N 3.26Å; P46-I49 PolarHBondContact O-N 2.96Å; V47-I49 PolarHBondContact O-N 3.37Å; I49-L51 PolarHBondContact O-N 3.21Å; I49-S53 VanDerWaalsContact O-CB 3.27Å; I49-S53 WeakPolarHBondContact O-CB 3Å; I49-S53 PolarHBondContact O-N 3.44Å; I49-S53 PolarHBondContact O-OG 2.88Å; I49-L106 HydrophobicContact CG1-CD1 4.37Å; I49-V110 HydrophobicContact CD1-CG1 4.39Å; I49-V110 HydrophobicContact CD1-CG2 3.96Å; I49-V110 HydrophobicContact CG1-CG2 3.78Å
50	I	92.2	Very high	83.4	Confident	98 Å²	98	64.5 Å²	64.5	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-59.6	-48.8	178.2	-68.6	166	0	0	0	110.3	P46 V47 R48 S53 I54	P46-I50 VanDerWaalsContact O-CG1 3.27Å; P46-I50 WeakPolarHBondContact O-CG1 3.31Å; P46-I50 PolarHBondContact O-N 3.49Å; V47-I50 PolarHBondContact O-N 2.83Å; R48-I50 VanDerWaalsContact C-N 3.35Å; R48-I50 PolarHBondContact O-N 3.01Å; I50-S53 PolarHBondContact O-N 2.93Å; I50-I54 HydrophobicContact CG2-CD1 3.72Å; I50-I54 HydrophobicContact CG2-CG1 4.45Å; I50-I54 VanDerWaalsContact O-CG1 3.31Å; I50-I54 WeakPolarHBondContact O-CG1 3.4Å; I50-I54 PolarHBondContact O-N 3.15Å
51	L	91.8	Very high	85.9	Confident	62 Å²	62	64.1 Å²	64.1	33%	0.325	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-45.7	-178.1	-68.5	170.6	0	0	0	112.8	V47 R48 I49 S53 I54 I55 F351 L354	V47-L51 HydrophobicContact CG1-CD1 3.76Å; V47-L51 HydrophobicContact CG1-CG 4.36Å; V47-L51 WeakPolarHBondContact O-CB 3.33Å; V47-L51 VanDerWaalsContact O-CG 3.25Å; V47-L51 WeakPolarHBondContact O-CG 3.33Å; V47-L51 PolarHBondContact O-N 3.49Å; R48-L51 PolarHBondContact O-N 3.07Å; I49-L51 PolarHBondContact O-N 3.21Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 2.98Å; L51-I54 PolarHBondContact O-N 2.93Å; L51-I55 WeakPolarHBondContact O-CG1 3.19Å; L51-I55 PolarHBondContact O-N 3.01Å; L51-F351 HydrophobicContact CD1-CE1 4.02Å; L51-L354 HydrophobicContact CB-CD1 4.07Å; L51-L354 HydrophobicContact CB-CD2 3.69Å; L51-L354 HydrophobicContact CB-CG 4.47Å; L51-L354 HydrophobicContact CD1-CD2 3.61Å; L51-L354 HydrophobicContact CG-CD2 4.24Å
52	Y	91	Very high	88.2	Confident	1 Å²	1	56 Å²	56	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-38.8	175.5	-89.2	-76.4	0	0	0	111.7	R48 I55 F56 I102 L106 S350 L354 Y357	R48-Y52 HydrophobicContact CG-CD2 3.48Å; R48-Y52 VanDerWaalsContact CG-CD2 3.48Å; R48-Y52 HydrophobicContact CG-CE2 3.54Å; R48-Y52 VanDerWaalsContact O-CD2 3.31Å; R48-Y52 WeakPolarHBondContact O-CD2 3.26Å; R48-Y52 PolarHBondContact O-N 3.46Å; Y52-I55 PolarHBondContact O-N 3.3Å; Y52-F56 WeakPolarHBondContact O-CB 3.1Å; Y52-F56 PolarHBondContact O-N 2.99Å; Y52-I102 HydrophobicContact CD1-CG2 3.9Å; Y52-L106 HydrophobicContact CD2-CD1 3.78Å; Y52-L106 HydrophobicContact CG-CD1 3.97Å; Y52-S350 PolarHBondContact OH-O 2.85Å; Y52-L354 HydrophobicContact CD1-CD1 3.75Å; Y52-L354 HydrophobicContact CD2-CD1 3.55Å; Y52-L354 HydrophobicContact CE1-CD1 3.9Å; Y52-L354 HydrophobicContact CE2-CB 4.33Å; Y52-L354 HydrophobicContact CE2-CD1 3.66Å; Y52-L354 HydrophobicContact CG-CD1 3.59Å; Y52-Y357 HydrophobicContact CD1-CD2 4.47Å; Y52-Y357 AromaticContact CE1-CD2 3.53Å; Y52-Y357 HydrophobicContact CE1-CD2 3.53Å; Y52-Y357 AromaticContact CE1-CE2 3.79Å; Y52-Y357 HydrophobicContact CE1-CE2 3.79Å
53	S	93.4	Very high	89.9	Confident	49 Å²	49	52.9 Å²	52.9	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-43.6	177.9	-58.4	0	0	0	0	111.5	I49 I50 L51 F56 L57	I49-S53 VanDerWaalsContact O-CB 3.27Å; I49-S53 WeakPolarHBondContact O-CB 3Å; I49-S53 PolarHBondContact O-N 3.44Å; I49-S53 PolarHBondContact O-OG 2.88Å; I50-S53 PolarHBondContact O-N 2.93Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 2.98Å; S53-F56 PolarHBondContact O-N 3.47Å; S53-L57 WeakPolarHBondContact O-CB 3.37Å; S53-L57 VanDerWaalsContact O-CG 3.3Å; S53-L57 WeakPolarHBondContact O-CG 3.49Å; S53-L57 PolarHBondContact O-N 3.09Å
54	I	94.8	Very high	91.2	Very high	82 Å²	82	48.6 Å²	48.6	42%	0.421	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-49.1	175.4	-70	168.3	0	0	0	110.4	I50 L51 F56 L57 L58	I50-I54 HydrophobicContact CG2-CD1 3.72Å; I50-I54 HydrophobicContact CG2-CG1 4.45Å; I50-I54 VanDerWaalsContact O-CG1 3.31Å; I50-I54 WeakPolarHBondContact O-CG1 3.4Å; I50-I54 PolarHBondContact O-N 3.15Å; L51-I54 PolarHBondContact O-N 2.93Å; I54-F56 VanDerWaalsContact C-N 3.33Å; I54-F56 PolarHBondContact O-N 2.69Å; I54-L57 PolarHBondContact O-N 3.35Å; I54-L58 HydrophobicContact CG2-CD1 3.63Å; I54-L58 HydrophobicContact CG2-CG 4.19Å; I54-L58 WeakPolarHBondContact O-CB 3.5Å; I54-L58 VanDerWaalsContact O-CG 3.26Å; I54-L58 WeakPolarHBondContact O-CG 3.36Å; I54-L58 PolarHBondContact O-N 3.02Å
55	I	95	Very high	92.1	Very high	12 Å²	12	49.4 Å²	49.4	6%	0.062	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-43.7	179.3	-71.7	160.8	0	0	0	110.8	L51 Y52 L58 S59 I102 L354 T358	L51-I55 WeakPolarHBondContact O-CG1 3.19Å; L51-I55 PolarHBondContact O-N 3.01Å; Y52-I55 PolarHBondContact O-N 3.3Å; I55-L58 PolarHBondContact O-N 3.48Å; I55-S59 WeakPolarHBondContact O-CB 3.33Å; I55-S59 PolarHBondContact O-N 3.41Å; I55-I102 HydrophobicContact CG2-CD1 3.99Å; I55-L354 HydrophobicContact CD1-CD1 3.48Å; I55-L354 VanDerWaalsContact CD1-CD1 3.48Å; I55-L354 HydrophobicContact CD1-CG 3.77Å; I55-T358 WeakPolarHBondContact CD1-OG1 3.44Å
56	F	95.2	Very high	92.5	Very high	57 Å²	57	46.7 Å²	46.7	25%	0.25	26%	0.257	C	S	.	.	H	α-helix	trans	-57.1	-52.6	176.1	173.9	-99.3	0	0	0	111.4	Y52 S53 I54 S59 L60 S98 I102	Y52-F56 WeakPolarHBondContact O-CB 3.1Å; Y52-F56 PolarHBondContact O-N 2.99Å; S53-F56 PolarHBondContact O-N 3.47Å; I54-F56 VanDerWaalsContact C-N 3.33Å; I54-F56 PolarHBondContact O-N 2.69Å; F56-S59 PolarHBondContact O-N 3.24Å; F56-L60 HydrophobicContact CE1-CD2 4.02Å; F56-L60 HydrophobicContact CZ-CD2 3.96Å; F56-L60 WeakPolarHBondContact O-CB 3.41Å; F56-L60 PolarHBondContact O-N 2.74Å; F56-S98 VanDerWaalsContact CD2-O 3.25Å; F56-S98 WeakPolarHBondContact CD2-O 2.96Å; F56-S98 WeakPolarHBondContact CE2-O 3.34Å; F56-I102 HydrophobicContact CB-CG2 4.11Å; F56-I102 HydrophobicContact CD2-CB 4.5Å; F56-I102 HydrophobicContact CD2-CG2 4.3Å
57	L	95.8	Very high	92.5	Very high	93 Å²	93	44.8 Å²	44.8	49%	0.487	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-46.2	-179.2	-70.1	173.7	0	0	0	111.9	S53 I54 S59 L60 I61	S53-L57 WeakPolarHBondContact O-CB 3.37Å; S53-L57 VanDerWaalsContact O-CG 3.3Å; S53-L57 WeakPolarHBondContact O-CG 3.49Å; S53-L57 PolarHBondContact O-N 3.09Å; I54-L57 PolarHBondContact O-N 3.35Å; L57-S59 PolarHBondContact O-N 3.47Å; L57-L60 PolarHBondContact O-N 2.88Å; L57-I61 VanDerWaalsContact O-CB 3.29Å; L57-I61 WeakPolarHBondContact O-CB 3.17Å; L57-I61 VanDerWaalsContact O-CG1 3.22Å; L57-I61 WeakPolarHBondContact O-CG1 3.28Å; L57-I61 PolarHBondContact O-N 2.94Å
58	L	95.6	Very high	92.4	Very high	79 Å²	79	45.7 Å²	45.7	41%	0.414	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-43.3	178.3	-70.2	176.1	0	0	0	111.7	I54 I55 G62 C361 I365	I54-L58 HydrophobicContact CG2-CD1 3.63Å; I54-L58 HydrophobicContact CG2-CG 4.19Å; I54-L58 WeakPolarHBondContact O-CB 3.5Å; I54-L58 VanDerWaalsContact O-CG 3.26Å; I54-L58 WeakPolarHBondContact O-CG 3.36Å; I54-L58 PolarHBondContact O-N 3.02Å; I55-L58 PolarHBondContact O-N 3.48Å; L58-G62 WeakPolarHBondContact O-CA 3.5Å; L58-G62 PolarHBondContact O-N 3.42Å; L58-C361 HydrophobicContact CB-CB 3.79Å; L58-I365 HydrophobicContact CD1-CD1 4.48Å
59	S	95.7	Very high	92.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-46.6	177.8	-169.9	0	0	0	0	111.2	I55 F56 L57 N63 S360	I55-S59 WeakPolarHBondContact O-CB 3.33Å; I55-S59 PolarHBondContact O-N 3.41Å; F56-S59 PolarHBondContact O-N 3.24Å; L57-S59 PolarHBondContact O-N 3.47Å; S59-N63 VanDerWaalsContact O-CB 3.3Å; S59-N63 WeakPolarHBondContact O-CB 3.4Å; S59-N63 PolarHBondContact O-N 2.93Å; S59-N63 VanDerWaalsContact O-N 3.07Å; S59-N63 PolarHBondContact O-ND2 3.46Å; S59-N63 PolarHBondContact OG-ND2 2.91Å; S59-S360 WeakPolarHBondContact CB-OG 3.31Å; S59-S360 WeakPolarHBondContact OG-CB 3.14Å; S59-S360 PolarHBondContact OG-OG 3Å
60	L	95.9	Very high	91.9	Very high	49 Å²	49	45.2 Å²	45.2	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-64	-52.5	-178.8	-177.9	63.7	0	0	0	111	F56 L57 S64 L95 L99	F56-L60 HydrophobicContact CE1-CD2 4.02Å; F56-L60 HydrophobicContact CZ-CD2 3.96Å; F56-L60 WeakPolarHBondContact O-CB 3.41Å; F56-L60 PolarHBondContact O-N 2.74Å; L57-L60 PolarHBondContact O-N 2.88Å; L60-S64 WeakPolarHBondContact O-CB 3.22Å; L60-S64 PolarHBondContact O-N 3.44Å; L60-S64 PolarHBondContact O-OG 3.1Å; L60-L95 HydrophobicContact CD1-CD2 3.86Å; L60-L99 HydrophobicContact CD1-CD2 3.83Å; L60-L99 HydrophobicContact CD1-CG 4.41Å
61	I	94.3	Very high	91.2	Very high	96 Å²	96	44.4 Å²	44.4	49%	0.492	24%	0.239	S	C	.	.	H	α-helix	trans	-66	-49.7	-178.2	-65	167.9	0	0	0	110.1	L57 S64 I65	L57-I61 VanDerWaalsContact O-CB 3.29Å; L57-I61 WeakPolarHBondContact O-CB 3.17Å; L57-I61 VanDerWaalsContact O-CG1 3.22Å; L57-I61 WeakPolarHBondContact O-CG1 3.28Å; L57-I61 PolarHBondContact O-N 2.94Å; I61-S64 PolarHBondContact O-N 3.38Å; I61-I65 HydrophobicContact CG2-CD1 3.72Å; I61-I65 HydrophobicContact CG2-CG1 4.43Å; I61-I65 VanDerWaalsContact O-CG1 3.27Å; I61-I65 WeakPolarHBondContact O-CG1 3.45Å; I61-I65 PolarHBondContact O-N 3.33Å
62	G	93.6	Very high	89.9	Confident	13 Å²	13	44.1 Å²	44.1	13%	0.134	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-50.2	-175.9	0	0	0	0	0	112.8	L58 I65 I66	L58-G62 WeakPolarHBondContact O-CA 3.5Å; L58-G62 PolarHBondContact O-N 3.42Å; G62-I65 PolarHBondContact O-N 3.05Å; G62-I66 WeakPolarHBondContact O-CG1 3.47Å; G62-I66 PolarHBondContact O-N 3.37Å; G62-I66 VanDerWaalsContact O-N 3.13Å
63	N	94.8	Very high	88.1	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-72	-33.1	-179.8	-68.8	-62.7	0	0	0	112.2	S59 I65 I66 I67 A91 D94 L95 S360 P364	S59-N63 VanDerWaalsContact O-CB 3.3Å; S59-N63 WeakPolarHBondContact O-CB 3.4Å; S59-N63 PolarHBondContact O-N 2.93Å; S59-N63 VanDerWaalsContact O-N 3.07Å; S59-N63 PolarHBondContact O-ND2 3.46Å; S59-N63 PolarHBondContact OG-ND2 2.91Å; N63-I65 PolarHBondContact O-N 3.37Å; N63-I66 WeakPolarHBondContact O-CB 3.3Å; N63-I66 PolarHBondContact O-N 3.49Å; N63-I67 WeakPolarHBondContact O-CG1 3.29Å; N63-I67 PolarHBondContact O-N 3.1Å; N63-A91 HydrophobicContact CB-CB 4.11Å; N63-D94 WeakPolarHBondContact ND2-CB 3.12Å; N63-L95 HydrophobicContact CB-CD2 3.86Å; N63-L95 HydrophobicContact CB-CG 3.78Å; N63-S360 PolarHBondContact ND2-O 2.99Å; N63-P364 WeakPolarHBondContact OD1-CG 3.47Å
64	S	92.7	Very high	86.1	Confident	36 Å²	36	48.3 Å²	48.3	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-41.2	171.9	-62.9	0	0	0	0	112.1	L60 I61 I67 I68	L60-S64 WeakPolarHBondContact O-CB 3.22Å; L60-S64 PolarHBondContact O-N 3.44Å; L60-S64 PolarHBondContact O-OG 3.1Å; I61-S64 PolarHBondContact O-N 3.38Å; S64-I67 PolarHBondContact O-N 3.07Å; S64-I68 WeakPolarHBondContact O-CB 3.47Å; S64-I68 VanDerWaalsContact O-CG1 3.25Å; S64-I68 WeakPolarHBondContact O-CG1 3.41Å; S64-I68 PolarHBondContact O-N 3.43Å
65	I	89.6	Confident	83.7	Confident	38 Å²	38	56.6 Å²	56.6	20%	0.195	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-44.3	174.8	-70.7	167.6	0	0	0	110.6	I61 G62 N63 I67 I68 V69 F374 I378 F382	I61-I65 HydrophobicContact CG2-CD1 3.72Å; I61-I65 HydrophobicContact CG2-CG1 4.43Å; I61-I65 VanDerWaalsContact O-CG1 3.27Å; I61-I65 WeakPolarHBondContact O-CG1 3.45Å; I61-I65 PolarHBondContact O-N 3.33Å; G62-I65 PolarHBondContact O-N 3.05Å; N63-I65 PolarHBondContact O-N 3.37Å; I65-I67 VanDerWaalsContact C-N 3.31Å; I65-I67 PolarHBondContact O-N 3.25Å; I65-I68 PolarHBondContact O-N 3.01Å; I65-V69 HydrophobicContact CG2-CG2 4.04Å; I65-V69 VanDerWaalsContact O-CB 3.3Å; I65-V69 WeakPolarHBondContact O-CB 3.48Å; I65-V69 WeakPolarHBondContact O-CG2 3.34Å; I65-V69 PolarHBondContact O-N 2.76Å; I65-F374 HydrophobicContact CG2-CZ 4.44Å; I65-I378 HydrophobicContact CG2-CD1 3.97Å; I65-I378 HydrophobicContact CG2-CG1 3.94Å; I65-F382 HydrophobicContact CD1-CE2 4.48Å; I65-F382 HydrophobicContact CD1-CZ 4.19Å; I65-F382 HydrophobicContact CG1-CZ 4.32Å; I65-F382 HydrophobicContact CG2-CE2 4.47Å
66	I	89.9	Confident	81.5	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.015	34%	0.337	C	S	.	.	H	α-helix	trans	-55.7	-49.6	175.6	-67.5	171.1	0	0	0	110.2	G62 N63 V69 L70 A91 P364 Y367 F374	G62-I66 WeakPolarHBondContact O-CG1 3.47Å; G62-I66 PolarHBondContact O-N 3.37Å; G62-I66 VanDerWaalsContact O-N 3.13Å; N63-I66 WeakPolarHBondContact O-CB 3.3Å; N63-I66 PolarHBondContact O-N 3.49Å; I66-V69 PolarHBondContact O-N 2.92Å; I66-L70 HydrophobicContact CG2-CD1 3.61Å; I66-L70 HydrophobicContact CG2-CG 4.26Å; I66-L70 VanDerWaalsContact O-CB 3.26Å; I66-L70 WeakPolarHBondContact O-CB 3.36Å; I66-L70 VanDerWaalsContact O-CG 3.27Å; I66-L70 WeakPolarHBondContact O-CG 3.31Å; I66-L70 PolarHBondContact O-N 2.99Å; I66-A91 HydrophobicContact CB-CB 4.1Å; I66-A91 HydrophobicContact CD1-CB 4.47Å; I66-A91 HydrophobicContact CG2-CB 3.84Å; I66-P364 HydrophobicContact CD1-CB 3.97Å; I66-P364 HydrophobicContact CD1-CG 3.76Å; I66-Y367 HydrophobicContact CD1-CD2 3.89Å; I66-Y367 HydrophobicContact CD1-CE2 4.33Å; I66-F374 HydrophobicContact CB-CE2 4.44Å; I66-F374 HydrophobicContact CB-CZ 4.35Å; I66-F374 HydrophobicContact CG1-CE1 4.41Å; I66-F374 HydrophobicContact CG1-CE2 3.94Å; I66-F374 HydrophobicContact CG1-CZ 3.5Å; I66-F374 VanDerWaalsContact CG1-CZ 3.5Å
67	I	89.4	Confident	79.4	Confident	30 Å²	30	69.8 Å²	69.8	15%	0.154	35%	0.354	C	S	.	.	H	α-helix	trans	-61.3	-48.5	179.8	-68.4	178.6	0	0	0	110.8	N63 S64 I65 V69 L70 L71 L88 A91 V92 L95	N63-I67 WeakPolarHBondContact O-CG1 3.29Å; N63-I67 PolarHBondContact O-N 3.1Å; S64-I67 PolarHBondContact O-N 3.07Å; I65-I67 VanDerWaalsContact C-N 3.31Å; I65-I67 PolarHBondContact O-N 3.25Å; I67-V69 VanDerWaalsContact C-N 3.33Å; I67-V69 PolarHBondContact O-N 3.36Å; I67-L70 PolarHBondContact O-N 3.48Å; I67-L71 HydrophobicContact CG2-CD1 3.34Å; I67-L71 HydrophobicContact CG2-CG 3.82Å; I67-L71 WeakPolarHBondContact O-CA 3.39Å; I67-L71 WeakPolarHBondContact O-CB 3.31Å; I67-L71 VanDerWaalsContact O-CG 3.27Å; I67-L71 WeakPolarHBondContact O-CG 3.46Å; I67-L71 PolarHBondContact O-N 2.99Å; I67-L88 HydrophobicContact CB-CD1 4.25Å; I67-L88 HydrophobicContact CG1-CD1 3.86Å; I67-L88 HydrophobicContact CG2-CD1 4.27Å; I67-A91 HydrophobicContact CD1-CB 4.32Å; I67-A91 HydrophobicContact CG1-CB 3.89Å; I67-V92 HydrophobicContact CD1-CG2 4.09Å; I67-L95 HydrophobicContact CD1-CD1 3.4Å; I67-L95 HydrophobicContact CD1-CG 4.42Å
68	I	86.1	Confident	77.2	Confident	91 Å²	91	76.2 Å²	76.2	47%	0.467	37%	0.372	S	S	.	.	H	α-helix	trans	-61.9	-40.2	-179.4	-69.7	164.6	0	0	0	111.7	S64 I65 T381	S64-I68 WeakPolarHBondContact O-CB 3.47Å; S64-I68 VanDerWaalsContact O-CG1 3.25Å; S64-I68 WeakPolarHBondContact O-CG1 3.41Å; S64-I68 PolarHBondContact O-N 3.43Å; I65-I68 PolarHBondContact O-N 3.01Å; I68-T381 HydrophobicContact CG2-CG2 4.35Å
69	V	82.1	Confident	75.1	Confident	26 Å²	26	79.2 Å²	79.2	16%	0.158	38%	0.384	C	S	.	.	H	α-helix	trans	-73.7	-36.8	-178.9	171.3	0	0	0	0	111.7	I65 I66 I67 F374 A377 I378 T381	I65-V69 HydrophobicContact CG2-CG2 4.04Å; I65-V69 VanDerWaalsContact O-CB 3.3Å; I65-V69 WeakPolarHBondContact O-CB 3.48Å; I65-V69 WeakPolarHBondContact O-CG2 3.34Å; I65-V69 PolarHBondContact O-N 2.76Å; I66-V69 PolarHBondContact O-N 2.92Å; I67-V69 VanDerWaalsContact C-N 3.33Å; I67-V69 PolarHBondContact O-N 3.36Å; V69-F374 HydrophobicContact CB-CE2 4.43Å; V69-F374 HydrophobicContact CG1-CD2 4.47Å; V69-F374 HydrophobicContact CG1-CE2 4.27Å; V69-A377 HydrophobicContact CG1-CB 3.4Å; V69-I378 HydrophobicContact CG2-CG1 4.12Å; V69-T381 HydrophobicContact CG2-CG2 4.23Å
70	L	80.7	Confident	73.5	Confident	33 Å²	33	83 Å²	83	17%	0.173	40%	0.4	C	S	.	.	H	α-helix	trans	-92.4	-23.5	-176	-62.8	-175.9	0	0	0	113.8	I66 I67 P72 N84 L87	I66-L70 HydrophobicContact CG2-CD1 3.61Å; I66-L70 HydrophobicContact CG2-CG 4.26Å; I66-L70 VanDerWaalsContact O-CB 3.26Å; I66-L70 WeakPolarHBondContact O-CB 3.36Å; I66-L70 VanDerWaalsContact O-CG 3.27Å; I66-L70 WeakPolarHBondContact O-CG 3.31Å; I66-L70 PolarHBondContact O-N 2.99Å; I67-L70 PolarHBondContact O-N 3.48Å; L70-P72 WeakPolarHBondContact O-CD 3.18Å; L70-N84 HydrophobicContact CD1-CB 4.43Å; L70-N84 HydrophobicContact CD2-CB 4.19Å; L70-L87 HydrophobicContact CD1-CB 3.83Å; L70-L87 HydrophobicContact CD1-CD1 4.48Å
71	L	78.6	Confident	72.6	Confident	81 Å²	81	83.2 Å²	83.2	42%	0.424	40%	0.404	S	S	.	.	S	Bend	trans	-78.5	116.4	170.6	-71.9	-174.9	0	0	0	109.5	I67 V73 L88	I67-L71 HydrophobicContact CG2-CD1 3.34Å; I67-L71 HydrophobicContact CG2-CG 3.82Å; I67-L71 WeakPolarHBondContact O-CA 3.39Å; I67-L71 WeakPolarHBondContact O-CB 3.31Å; I67-L71 VanDerWaalsContact O-CG 3.27Å; I67-L71 WeakPolarHBondContact O-CG 3.46Å; I67-L71 PolarHBondContact O-N 2.99Å; L71-V73 PolarHBondContact O-N 3.21Å; L71-V73 VanDerWaalsContact O-N 3.08Å; L71-L88 HydrophobicContact CD2-CD1 3.99Å; L71-L88 HydrophobicContact CD2-CD2 3.71Å; L71-L88 HydrophobicContact CG-CD1 4.01Å
72	P	63.3	Low	72.1	Confident	56 Å²	56	79.9 Å²	79.9	36%	0.364	39%	0.387	S	S	.	.			trans	-75.3	107.5	-177.8	22.3	-20.8	0	0	0	110.8	L70 G74	L70-P72 WeakPolarHBondContact O-CD 3.18Å; P72-G74 VanDerWaalsContact C-N 3.26Å; P72-G74 PolarHBondContact O-N 3.29Å; P72-G74 VanDerWaalsContact O-N 3.07Å
73	V	54.6	Low	71.6	Confident	87 Å²	87	79.8 Å²	79.8	53%	0.527	38%	0.384	S	S	.	.			trans	-79	79.1	161.4	-173.9	0	0	0	0	108.1	L71 R390	L71-V73 PolarHBondContact O-N 3.21Å; L71-V73 VanDerWaalsContact O-N 3.08Å; V73-R390 HydrophobicContact CG1-CB 4.36Å
74	G	51.4	Low	71.1	Confident	52 Å²	52	81.4 Å²	81.4	54%	0.536	39%	0.393	S	S	.	.	S	Bend	trans	122.5	-172.8	169.8	0	0	0	0	0	117.2	P72 R76	P72-G74 VanDerWaalsContact C-N 3.26Å; P72-G74 PolarHBondContact O-N 3.29Å; P72-G74 VanDerWaalsContact O-N 3.07Å; G74-R76 PolarHBondContact O-N 3.19Å
75	R	43	Very low	71	Confident	255 Å²	255	81 Å²	81	96%	0.962	39%	0.388	S	S	*	.	S	Bend	trans	-67.8	25.6	-171.8	-118.8	-177.8	-164.3	169.5	2.7	115.6
76	R	50.1	Low	71.1	Confident	216 Å²	216	79.6 Å²	79.6	82%	0.815	38%	0.38	S	S	*	.			trans	-105.4	71.4	168.4	-96.8	176.8	-179.8	166.8	1.1	109.4	G74 W78	G74-R76 PolarHBondContact O-N 3.19Å; R76-W78 PolarHBondContact O-N 3.33Å; R76-W78 VanDerWaalsContact O-N 3.14Å
77	Q	50.1	Low	71.1	Confident	131 Å²	131	79.9 Å²	79.9	61%	0.612	38%	0.382	S	S	*	.			trans	-64.6	-6.8	171.7	-163.7	95.8	-22.5	0	0	113	Q79	Q77-Q79 VanDerWaalsContact C-N 3.32Å; Q77-Q79 PolarHBondContact O-N 2.62Å; Q77-Q79 VanDerWaalsContact O-N 3.13Å
78	W	49	Very low	71.2	Confident	228 Å²	228	80.3 Å²	80.3	86%	0.864	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-2	-158.9	-74.8	82.2	0	0	0	116.8	R76	R76-W78 PolarHBondContact O-N 3.33Å; R76-W78 VanDerWaalsContact O-N 3.14Å
79	Q	51.5	Low	71.6	Confident	141 Å²	141	76.4 Å²	76.4	66%	0.659	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	18.9	-178.9	-65.1	-162.2	1.7	0	0	115.9	Q77 T81 N84	Q77-Q79 VanDerWaalsContact C-N 3.32Å; Q77-Q79 PolarHBondContact O-N 2.62Å; Q77-Q79 VanDerWaalsContact O-N 3.13Å; Q79-T81 PolarHBondContact O-N 3.24Å; Q79-N84 PolarHBondContact O-ND2 3.19Å
80	K	62	Low	72.2	Confident	79 Å²	79	75.2 Å²	75.2	34%	0.343	36%	0.357	S	S	.	.			trans	-72.8	83.1	169.6	-66.9	-171.6	-174.8	178.3	0	109.8	K162	K80-K162 WeakPolarHBondContact O-CE 3Å; K80-K162 PolarHBondContact O-NZ 3.04Å
81	T	78.3	Confident	72.9	Confident	55 Å²	55	73.7 Å²	73.7	34%	0.337	35%	0.349	S	S	.	.			trans	-75.6	159.8	165.3	61.5	0	0	0	0	109.3	Q79 T83 N84 L85	Q79-T81 PolarHBondContact O-N 3.24Å; T81-T83 VanDerWaalsContact C-N 3.3Å; T81-T83 PolarHBondContact O-N 2.84Å; T81-N84 PolarHBondContact O-N 2.9Å; T81-N84 VanDerWaalsContact O-N 3.15Å; T81-N84 WeakPolarHBondContact OG1-CB 3.25Å; T81-N84 PolarHBondContact OG1-N 3.36Å; T81-N84 PolarHBondContact OG1-ND2 3.47Å; T81-N84 PolarHBondContact OG1-OD1 2.91Å; T81-L85 PolarHBondContact O-N 3.47Å
82	I	82.4	Confident	73.7	Confident	26 Å²	26	72.8 Å²	72.8	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-44.3	177.7	-72.4	165.8	0	0	0	110.6	N84 L85 F86 E145 Q160 K162 A165	I82-N84 VanDerWaalsContact C-N 3.25Å; I82-N84 PolarHBondContact O-N 2.85Å; I82-L85 WeakPolarHBondContact O-CB 3.49Å; I82-L85 PolarHBondContact O-N 3.46Å; I82-F86 HydrophobicContact CG2-CD2 4.01Å; I82-F86 HydrophobicContact CG2-CE2 3.55Å; I82-F86 WeakPolarHBondContact O-CD2 3.38Å; I82-F86 PolarHBondContact O-N 3.47Å; I82-E145 HydrophobicContact CG2-CG 3.95Å; I82-Q160 HydrophobicContact CD1-CB 3.73Å; I82-Q160 WeakPolarHBondContact CD1-O 3.47Å; I82-K162 HydrophobicContact CG1-CG 4.25Å; I82-A165 HydrophobicContact CB-CB 4.46Å; I82-A165 HydrophobicContact CG1-CB 4.33Å; I82-A165 HydrophobicContact CG2-CB 3.69Å
83	T	83.2	Confident	75.3	Confident	11 Å²	11	70.1 Å²	70.1	7%	0.067	33%	0.33	C	S	.	.	H	α-helix	trans	-54	-41.5	173.9	-34.5	0	0	0	0	112.5	T81 L85 F86 L87 E145 R146	T81-T83 VanDerWaalsContact C-N 3.3Å; T81-T83 PolarHBondContact O-N 2.84Å; T83-L85 PolarHBondContact O-N 3.47Å; T83-F86 PolarHBondContact O-N 3.08Å; T83-F86 VanDerWaalsContact O-N 3.12Å; T83-L87 HydrophobicContact CG2-CD1 4.35Å; T83-L87 HydrophobicContact CG2-CG 4.3Å; T83-L87 WeakPolarHBondContact O-CG 3.38Å; T83-L87 PolarHBondContact O-N 3.3Å; T83-E145 PolarHBondContact N-OE1 2.57Å; T83-E145 PolarHBondContact OG1-OE1 2.85Å; T83-R146 PolarHBondContact OG1-NH1 3.01Å; T83-R146 PolarHBondContact OG1-NH2 3.36Å
84	N	85.7	Confident	77.3	Confident	35 Å²	35	66.1 Å²	66.1	19%	0.187	31%	0.306	C	S	.	.	H	α-helix	trans	-64.4	-26.3	-178.9	-70.1	-3.8	0	0	0	112.6	L70 Q79 T81 I82 L88	L70-N84 HydrophobicContact CD1-CB 4.43Å; L70-N84 HydrophobicContact CD2-CB 4.19Å; Q79-N84 PolarHBondContact O-ND2 3.19Å; T81-N84 PolarHBondContact O-N 2.9Å; T81-N84 VanDerWaalsContact O-N 3.15Å; T81-N84 WeakPolarHBondContact OG1-CB 3.25Å; T81-N84 PolarHBondContact OG1-N 3.36Å; T81-N84 PolarHBondContact OG1-ND2 3.47Å; T81-N84 PolarHBondContact OG1-OD1 2.91Å; I82-N84 VanDerWaalsContact C-N 3.25Å; I82-N84 PolarHBondContact O-N 2.85Å; N84-L88 WeakPolarHBondContact O-CB 3.08Å; N84-L88 PolarHBondContact O-N 3.19Å; N84-L88 VanDerWaalsContact O-N 3.1Å
85	L	89.5	Confident	79.4	Confident	28 Å²	28	64.8 Å²	64.8	15%	0.147	29%	0.286	C	S	.	.	H	α-helix	trans	-71.1	-43.2	173	-62.5	174.7	0	0	0	111.4	T81 I82 T83 L88 S89 K162 A165 K166 I169	T81-L85 PolarHBondContact O-N 3.47Å; I82-L85 WeakPolarHBondContact O-CB 3.49Å; I82-L85 PolarHBondContact O-N 3.46Å; T83-L85 PolarHBondContact O-N 3.47Å; L85-L88 PolarHBondContact O-N 3.49Å; L85-S89 PolarHBondContact O-N 3.1Å; L85-K162 HydrophobicContact CD1-CB 4.48Å; L85-A165 HydrophobicContact CD1-CB 4.13Å; L85-K166 HydrophobicContact CD1-CG 4.31Å; L85-I169 HydrophobicContact CB-CD1 3.76Å
86	F	91.6	Very high	81.9	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-40.4	175.9	-69	-63.4	0	0	0	112	I82 T83 L88 S89 L90 A141 I142 E145 A165 V168 I169	I82-F86 HydrophobicContact CG2-CD2 4.01Å; I82-F86 HydrophobicContact CG2-CE2 3.55Å; I82-F86 WeakPolarHBondContact O-CD2 3.38Å; I82-F86 PolarHBondContact O-N 3.47Å; T83-F86 PolarHBondContact O-N 3.08Å; T83-F86 VanDerWaalsContact O-N 3.12Å; F86-L88 VanDerWaalsContact C-N 3.31Å; F86-L88 PolarHBondContact O-N 3.47Å; F86-S89 PolarHBondContact O-N 2.79Å; F86-L90 WeakPolarHBondContact O-CB 3.47Å; F86-L90 PolarHBondContact O-N 3.31Å; F86-A141 HydrophobicContact CD1-CB 4.12Å; F86-A141 HydrophobicContact CE1-CB 3.63Å; F86-A141 HydrophobicContact CZ-CB 4.01Å; F86-I142 HydrophobicContact CB-CD1 3.92Å; F86-I142 HydrophobicContact CB-CG1 3.54Å; F86-I142 HydrophobicContact CD2-CG1 4.39Å; F86-I142 HydrophobicContact CG-CG1 4.03Å; F86-E145 HydrophobicContact CE2-CB 4.41Å; F86-E145 HydrophobicContact CE2-CG 4.49Å; F86-A165 HydrophobicContact CE2-CB 4.28Å; F86-A165 HydrophobicContact CZ-CB 4.24Å; F86-V168 HydrophobicContact CE1-CB 4.3Å; F86-V168 HydrophobicContact CE1-CG1 3.89Å; F86-V168 HydrophobicContact CZ-CB 4.37Å; F86-V168 HydrophobicContact CZ-CG1 4.19Å; F86-I169 HydrophobicContact CD1-CD1 4.03Å; F86-I169 HydrophobicContact CD1-CG1 3.71Å; F86-I169 HydrophobicContact CE1-CD1 4.31Å; F86-I169 HydrophobicContact CE1-CG1 3.75Å
87	L	90.6	Very high	84	Confident	9 Å²	9	44.5 Å²	44.5	5%	0.047	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-38.4	174.4	-66.6	-179.4	0	0	0	112.3	L70 T83 L90 A91 Y367	L70-L87 HydrophobicContact CD1-CB 3.83Å; L70-L87 HydrophobicContact CD1-CD1 4.48Å; T83-L87 HydrophobicContact CG2-CD1 4.35Å; T83-L87 HydrophobicContact CG2-CG 4.3Å; T83-L87 WeakPolarHBondContact O-CG 3.38Å; T83-L87 PolarHBondContact O-N 3.3Å; L87-L90 PolarHBondContact O-N 3.34Å; L87-A91 WeakPolarHBondContact O-CB 3.46Å; L87-A91 PolarHBondContact O-N 3.46Å; L87-Y367 HydrophobicContact CD2-CE1 3.68Å; L87-Y367 HydrophobicContact CD2-CE2 3.69Å; L87-Y367 WeakPolarHBondContact CD2-OH 3.35Å
88	L	92	Very high	86.1	Confident	39 Å²	39	38.2 Å²	38.2	20%	0.204	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-44.2	175	-175.7	72.3	0	0	0	111.2	I67 L71 N84 L85 F86 L90 A91 V92	I67-L88 HydrophobicContact CB-CD1 4.25Å; I67-L88 HydrophobicContact CG1-CD1 3.86Å; I67-L88 HydrophobicContact CG2-CD1 4.27Å; L71-L88 HydrophobicContact CD2-CD1 3.99Å; L71-L88 HydrophobicContact CD2-CD2 3.71Å; L71-L88 HydrophobicContact CG-CD1 4.01Å; N84-L88 WeakPolarHBondContact O-CB 3.08Å; N84-L88 PolarHBondContact O-N 3.19Å; N84-L88 VanDerWaalsContact O-N 3.1Å; L85-L88 PolarHBondContact O-N 3.49Å; F86-L88 VanDerWaalsContact C-N 3.31Å; F86-L88 PolarHBondContact O-N 3.47Å; L88-L90 VanDerWaalsContact C-N 3.32Å; L88-L90 PolarHBondContact O-N 2.96Å; L88-A91 PolarHBondContact O-N 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.36Å; L88-V92 PolarHBondContact O-N 3.29Å
89	S	94.6	Very high	88.3	Confident	8 Å²	8	31.7 Å²	31.7	6%	0.056	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-42.2	176.3	-172.7	0	0	0	0	111.9	L85 F86 V92 S93 N138 W173	L85-S89 PolarHBondContact O-N 3.1Å; F86-S89 PolarHBondContact O-N 2.79Å; S89-V92 PolarHBondContact O-N 2.9Å; S89-S93 PolarHBondContact O-N 3.01Å; S89-S93 VanDerWaalsContact O-N 3.09Å; S89-N138 PolarHBondContact OG-ND2 3.34Å; S89-W173 PolarHBondContact OG-NE1 3.01Å
90	L	94.3	Very high	90.2	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-46.3	176.8	-169.6	64.3	0	0	0	111.2	F86 L87 L88 V92 S93 D94 N138 L139 N363	F86-L90 WeakPolarHBondContact O-CB 3.47Å; F86-L90 PolarHBondContact O-N 3.31Å; L87-L90 PolarHBondContact O-N 3.34Å; L88-L90 VanDerWaalsContact C-N 3.32Å; L88-L90 PolarHBondContact O-N 2.96Å; L90-V92 VanDerWaalsContact C-N 3.3Å; L90-V92 PolarHBondContact O-N 3.46Å; L90-S93 WeakPolarHBondContact O-CB 3.47Å; L90-S93 PolarHBondContact O-N 2.9Å; L90-S93 VanDerWaalsContact O-N 3.15Å; L90-D94 PolarHBondContact O-N 3.17Å; L90-N138 HydrophobicContact CD1-CB 4.48Å; L90-L139 HydrophobicContact CD2-CD2 4.36Å; L90-N363 HydrophobicContact CD2-CB 4.29Å
91	A	95.3	Very high	91.7	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-35.2	177.5	0	0	0	0	0	113.2	N63 I66 I67 L87 L88 L95	N63-A91 HydrophobicContact CB-CB 4.11Å; I66-A91 HydrophobicContact CB-CB 4.1Å; I66-A91 HydrophobicContact CD1-CB 4.47Å; I66-A91 HydrophobicContact CG2-CB 3.84Å; I67-A91 HydrophobicContact CD1-CB 4.32Å; I67-A91 HydrophobicContact CG1-CB 3.89Å; L87-A91 WeakPolarHBondContact O-CB 3.46Å; L87-A91 PolarHBondContact O-N 3.46Å; L88-A91 PolarHBondContact O-N 3.26Å; A91-L95 WeakPolarHBondContact O-CB 3.4Å; A91-L95 WeakPolarHBondContact O-CG 3.25Å; A91-L95 PolarHBondContact O-N 2.9Å
92	V	95.7	Very high	92.3	Very high	62 Å²	62	20.3 Å²	20.3	38%	0.376	11%	0.112	S	C	.	.	H	α-helix	trans	-67.1	-43.6	174.6	173	0	0	0	0	111.2	I67 L88 S89 L90 L95 L96 W173	I67-V92 HydrophobicContact CD1-CG2 4.09Å; L88-V92 WeakPolarHBondContact O-CG2 3.36Å; L88-V92 PolarHBondContact O-N 3.29Å; S89-V92 PolarHBondContact O-N 2.9Å; L90-V92 VanDerWaalsContact C-N 3.3Å; L90-V92 PolarHBondContact O-N 3.46Å; V92-L95 PolarHBondContact O-N 3.26Å; V92-L96 PolarHBondContact O-N 3.22Å; V92-W173 HydrophobicContact CB-CZ2 4.26Å; V92-W173 HydrophobicContact CG1-CH2 3.84Å; V92-W173 HydrophobicContact CG1-CZ2 3.8Å
93	S	96.7	Very high	92.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.5	-44.2	176.6	-172	0	0	0	0	112.3	S89 L90 L96 V97 S131 S135	S89-S93 PolarHBondContact O-N 3.01Å; S89-S93 VanDerWaalsContact O-N 3.09Å; L90-S93 WeakPolarHBondContact O-CB 3.47Å; L90-S93 PolarHBondContact O-N 2.9Å; L90-S93 VanDerWaalsContact O-N 3.15Å; S93-L96 WeakPolarHBondContact O-CB 3.47Å; S93-L96 PolarHBondContact O-N 3.08Å; S93-V97 PolarHBondContact O-N 3.46Å; S93-V97 VanDerWaalsContact O-N 3.16Å; S93-S131 PolarHBondContact O-OG 2.86Å; S93-S131 VanDerWaalsContact OG-CA 3.28Å; S93-S131 WeakPolarHBondContact OG-CA 3.42Å; S93-S131 PolarHBondContact OG-O 3.45Å; S93-S135 WeakPolarHBondContact CB-OG 3.21Å; S93-S135 PolarHBondContact OG-OG 3.5Å
94	D	96.1	Very high	93.1	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-70.8	-32.5	179.9	-68.1	-17	0	0	0	111.7	N63 L90 V97 S98 S135 N363	N63-D94 WeakPolarHBondContact ND2-CB 3.12Å; L90-D94 PolarHBondContact O-N 3.17Å; D94-V97 PolarHBondContact O-N 3.12Å; D94-S98 PolarHBondContact O-N 3.05Å; D94-S135 PolarHBondContact OD1-OG 3.4Å; D94-N363 PolarHBondContact OD2-ND2 3.4Å
95	L	95.9	Very high	93.2	Very high	24 Å²	24	22.1 Å²	22.1	13%	0.126	12%	0.122	C	C	.	.	H	α-helix	trans	-65.5	-39.9	170.1	-81	-174.7	0	0	0	112.3	L60 N63 I67 A91 V92 V97 S98 L99	L60-L95 HydrophobicContact CD1-CD2 3.86Å; N63-L95 HydrophobicContact CB-CD2 3.86Å; N63-L95 HydrophobicContact CB-CG 3.78Å; I67-L95 HydrophobicContact CD1-CD1 3.4Å; I67-L95 HydrophobicContact CD1-CG 4.42Å; A91-L95 WeakPolarHBondContact O-CB 3.4Å; A91-L95 WeakPolarHBondContact O-CG 3.25Å; A91-L95 PolarHBondContact O-N 2.9Å; V92-L95 PolarHBondContact O-N 3.26Å; L95-V97 VanDerWaalsContact C-N 3.3Å; L95-V97 PolarHBondContact O-N 2.98Å; L95-S98 WeakPolarHBondContact CA-OG 3.46Å; L95-S98 PolarHBondContact O-N 3.37Å; L95-S98 VanDerWaalsContact O-N 3.11Å; L95-S98 PolarHBondContact O-OG 3.41Å; L95-L99 WeakPolarHBondContact O-CB 3.34Å; L95-L99 WeakPolarHBondContact O-CG 3.14Å; L95-L99 PolarHBondContact O-N 3.28Å
96	L	95.3	Very high	93.1	Very high	34 Å²	34	22 Å²	22	18%	0.178	12%	0.121	C	C	.	.	H	α-helix	trans	-59.4	-41.7	175.2	178	62.6	0	0	0	111.1	V92 S93 V100 F127 S131	V92-L96 PolarHBondContact O-N 3.22Å; S93-L96 WeakPolarHBondContact O-CB 3.47Å; S93-L96 PolarHBondContact O-N 3.08Å; L96-V100 HydrophobicContact CD1-CB 4.13Å; L96-V100 HydrophobicContact CD1-CG2 3.68Å; L96-V100 WeakPolarHBondContact O-CB 3.5Å; L96-V100 PolarHBondContact O-N 3.29Å; L96-F127 HydrophobicContact CD1-CB 4.22Å; L96-F127 HydrophobicContact CD1-CD1 4.17Å; L96-F127 HydrophobicContact CD1-CG 4.13Å; L96-F127 HydrophobicContact CD2-CB 4.25Å; L96-F127 HydrophobicContact CD2-CD1 3.78Å; L96-F127 HydrophobicContact CD2-CG 4.31Å; L96-F127 HydrophobicContact CG-CB 4.26Å; L96-F127 HydrophobicContact CG-CD1 4.44Å; L96-S131 WeakPolarHBondContact CB-OG 3.49Å; L96-S131 VanDerWaalsContact CD2-OG 3.31Å; L96-S131 WeakPolarHBondContact CD2-OG 3.41Å; L96-S131 WeakPolarHBondContact CG-OG 3.43Å
97	V	94.3	Very high	93	Very high	10 Å²	10	24.8 Å²	24.8	6%	0.061	14%	0.135	C	C	.	.	I	π-helix	trans	-58.7	-49.7	171.2	178.4	0	0	0	0	110.9	S93 D94 L95 L99 C101 I102 Y357	S93-V97 PolarHBondContact O-N 3.46Å; S93-V97 VanDerWaalsContact O-N 3.16Å; D94-V97 PolarHBondContact O-N 3.12Å; L95-V97 VanDerWaalsContact C-N 3.3Å; L95-V97 PolarHBondContact O-N 2.98Å; V97-L99 PolarHBondContact O-N 3.35Å; V97-C101 HydrophobicContact CG1-CB 4.21Å; V97-C101 WeakPolarHBondContact O-CA 3.35Å; V97-C101 VanDerWaalsContact O-CB 3.23Å; V97-C101 WeakPolarHBondContact O-CB 3.32Å; V97-C101 PolarHBondContact O-N 3.05Å; V97-I102 HydrophobicContact CG1-CG1 4.33Å; V97-I102 PolarHBondContact O-N 3.36Å; V97-Y357 HydrophobicContact CG1-CD1 3.62Å; V97-Y357 HydrophobicContact CG1-CE1 4.08Å
98	S	94.9	Very high	92.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-64.9	-40.9	-175.3	68.1	0	0	0	0	113.5	F56 D94 L95 P103	F56-S98 VanDerWaalsContact CD2-O 3.25Å; F56-S98 WeakPolarHBondContact CD2-O 2.96Å; F56-S98 WeakPolarHBondContact CE2-O 3.34Å; D94-S98 PolarHBondContact O-N 3.05Å; L95-S98 WeakPolarHBondContact CA-OG 3.46Å; L95-S98 PolarHBondContact O-N 3.37Å; L95-S98 VanDerWaalsContact O-N 3.11Å; L95-S98 PolarHBondContact O-OG 3.41Å; S98-P103 WeakPolarHBondContact O-CD 3.36Å
99	L	94.4	Very high	92.3	Very high	91 Å²	91	25.7 Å²	25.7	48%	0.476	14%	0.142	S	C	.	.	I	π-helix	trans	-84.7	-34.2	-174.5	-66.4	174.5	0	0	0	112.9	L60 L95 V97 P103	L60-L99 HydrophobicContact CD1-CD2 3.83Å; L60-L99 HydrophobicContact CD1-CG 4.41Å; L95-L99 WeakPolarHBondContact O-CB 3.34Å; L95-L99 WeakPolarHBondContact O-CG 3.14Å; L95-L99 PolarHBondContact O-N 3.28Å; V97-L99 PolarHBondContact O-N 3.35Å; L99-P103 VanDerWaalsContact O-CG 3.31Å; L99-P103 WeakPolarHBondContact O-CG 3.28Å
100	V	91.9	Very high	91.8	Very high	34 Å²	34	27.5 Å²	27.5	21%	0.206	15%	0.152	C	C	.	.	I	π-helix	trans	-108.8	-31.3	-171.5	-178.2	0	0	0	0	112.6	L96 F104 F127	L96-V100 HydrophobicContact CD1-CB 4.13Å; L96-V100 HydrophobicContact CD1-CG2 3.68Å; L96-V100 WeakPolarHBondContact O-CB 3.5Å; L96-V100 PolarHBondContact O-N 3.29Å; V100-F104 WeakPolarHBondContact O-CD2 3.37Å; V100-F127 HydrophobicContact CG1-CB 4.25Å; V100-F127 HydrophobicContact CG1-CD2 4.08Å
101	C	92.2	Very high	91.4	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	I	π-helix	trans	-95.4	-49.8	-174.3	-54.4	0	0	0	0	111.8	V97 T105 M128 Y357	V97-C101 HydrophobicContact CG1-CB 4.21Å; V97-C101 WeakPolarHBondContact O-CA 3.35Å; V97-C101 VanDerWaalsContact O-CB 3.23Å; V97-C101 WeakPolarHBondContact O-CB 3.32Å; V97-C101 PolarHBondContact O-N 3.05Å; C101-T105 VanDerWaalsContact O-CB 3.26Å; C101-T105 WeakPolarHBondContact O-CB 3.32Å; C101-T105 PolarHBondContact O-N 3.3Å; C101-T105 PolarHBondContact O-OG1 2.95Å; C101-M128 VanDerWaalsContact SG-CA 3.53Å; C101-Y357 HydrophobicContact CB-CE1 4.12Å
102	I	92.1	Very high	90.8	Very high	2 Å²	2	38 Å²	38	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-56.7	-173.4	-65.4	-179.4	0	0	0	113.3	Y52 I55 F56 V97 F104 T105 L106 Y357	Y52-I102 HydrophobicContact CD1-CG2 3.9Å; I55-I102 HydrophobicContact CG2-CD1 3.99Å; F56-I102 HydrophobicContact CB-CG2 4.11Å; F56-I102 HydrophobicContact CD2-CB 4.5Å; F56-I102 HydrophobicContact CD2-CG2 4.3Å; V97-I102 HydrophobicContact CG1-CG1 4.33Å; V97-I102 PolarHBondContact O-N 3.36Å; I102-F104 VanDerWaalsContact C-N 3.35Å; I102-F104 PolarHBondContact O-N 3.26Å; I102-T105 PolarHBondContact O-N 2.97Å; I102-T105 VanDerWaalsContact O-N 3.17Å; I102-L106 WeakPolarHBondContact O-CB 3.26Å; I102-L106 PolarHBondContact O-N 3.21Å; I102-Y357 HydrophobicContact CG1-CD1 4.23Å; I102-Y357 HydrophobicContact CG1-CG 4.16Å
103	P	91.5	Very high	90.4	Very high	36 Å²	36	36 Å²	36	23%	0.234	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-39.9	-176.2	22.1	-32.4	0	0	0	112.5	S98 L99 T105 L106 I107	S98-P103 WeakPolarHBondContact O-CD 3.36Å; L99-P103 VanDerWaalsContact O-CG 3.31Å; L99-P103 WeakPolarHBondContact O-CG 3.28Å; P103-T105 PolarHBondContact O-N 2.89Å; P103-L106 PolarHBondContact O-N 3.32Å; P103-I107 WeakPolarHBondContact O-CG1 3.31Å; P103-I107 PolarHBondContact O-N 3.49Å
104	F	90.5	Very high	90.1	Very high	49 Å²	49	36.7 Å²	36.7	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-77	-8.3	179.6	-64.5	-81.1	0	0	0	113.8	V100 I102 P108 F116 M120 V124	V100-F104 WeakPolarHBondContact O-CD2 3.37Å; I102-F104 VanDerWaalsContact C-N 3.35Å; I102-F104 PolarHBondContact O-N 3.26Å; F104-P108 WeakPolarHBondContact O-CD 3.45Å; F104-P108 VanDerWaalsContact O-CG 3.24Å; F104-P108 WeakPolarHBondContact O-CG 3.44Å; F104-F116 AromaticContact CD1-CD1 3.89Å; F104-F116 HydrophobicContact CD1-CD1 3.89Å; F104-F116 AromaticContact CD1-CD2 3.79Å; F104-F116 HydrophobicContact CD1-CD2 3.79Å; F104-F116 AromaticContact CD1-CE1 3.89Å; F104-F116 HydrophobicContact CD1-CE1 3.89Å; F104-F116 AromaticContact CD1-CE2 3.79Å; F104-F116 HydrophobicContact CD1-CE2 3.79Å; F104-F116 AromaticContact CD1-CG 3.83Å; F104-F116 HydrophobicContact CD1-CG 3.83Å; F104-F116 AromaticContact CD1-CZ 3.84Å; F104-F116 HydrophobicContact CD1-CZ 3.84Å; F104-F116 AromaticContact CE1-CD1 3.69Å; F104-F116 HydrophobicContact CE1-CD1 3.69Å; F104-F116 HydrophobicContact CE1-CD2 4.44Å; F104-F116 AromaticContact CE1-CE1 3.69Å; F104-F116 HydrophobicContact CE1-CE1 3.69Å; F104-F116 HydrophobicContact CE1-CE2 4.44Å; F104-F116 HydrophobicContact CE1-CG 4.07Å; F104-F116 HydrophobicContact CE1-CZ 4.08Å; F104-M120 HydrophobicContact CD1-CE 3.74Å; F104-M120 HydrophobicContact CD2-CE 4.1Å; F104-M120 HydrophobicContact CE1-CE 3.51Å; F104-M120 HydrophobicContact CE2-CE 3.88Å; F104-M120 HydrophobicContact CG-CE 4.02Å; F104-M120 HydrophobicContact CZ-CE 3.57Å; F104-V124 HydrophobicContact CB-CG1 4.39Å; F104-V124 HydrophobicContact CB-CG2 3.54Å; F104-V124 HydrophobicContact CD2-CG2 4.4Å; F104-V124 HydrophobicContact CG-CG2 3.98Å
105	T	87.3	Confident	89.9	Confident	24 Å²	24	41.4 Å²	41.4	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-94.5	-39.1	167.4	-57.2	0	0	0	0	110.9	C101 I102 P103 N109 Y357	C101-T105 VanDerWaalsContact O-CB 3.26Å; C101-T105 WeakPolarHBondContact O-CB 3.32Å; C101-T105 PolarHBondContact O-N 3.3Å; C101-T105 PolarHBondContact O-OG1 2.95Å; I102-T105 PolarHBondContact O-N 2.97Å; I102-T105 VanDerWaalsContact O-N 3.17Å; P103-T105 PolarHBondContact O-N 2.89Å; T105-N109 WeakPolarHBondContact O-CB 3.34Å; T105-N109 PolarHBondContact O-N 2.89Å; T105-N109 PolarHBondContact O-ND2 2.93Å; T105-Y357 HydrophobicContact CG2-CE2 4.16Å; T105-Y357 PolarHBondContact OG1-OH 2.72Å
106	L	87.8	Confident	89.7	Confident	26 Å²	26	43.1 Å²	43.1	14%	0.136	22%	0.222	C	C	.	.	H	α-helix	trans	-66.9	-50.1	-179.2	177	62.2	0	0	0	112.2	I49 Y52 I102 P103 N109 V110	I49-L106 HydrophobicContact CG1-CD1 4.37Å; Y52-L106 HydrophobicContact CD2-CD1 3.78Å; Y52-L106 HydrophobicContact CG-CD1 3.97Å; I102-L106 WeakPolarHBondContact O-CB 3.26Å; I102-L106 PolarHBondContact O-N 3.21Å; P103-L106 PolarHBondContact O-N 3.32Å; L106-N109 WeakPolarHBondContact O-CB 3.48Å; L106-N109 PolarHBondContact O-N 3.36Å; L106-N109 VanDerWaalsContact O-N 3.12Å; L106-V110 HydrophobicContact CD1-CG2 3.94Å; L106-V110 HydrophobicContact CG-CG2 4.4Å; L106-V110 WeakPolarHBondContact O-CG2 3.32Å; L106-V110 PolarHBondContact O-N 3.43Å
107	I	89.1	Confident	89.6	Confident	66 Å²	66	42.8 Å²	42.8	34%	0.338	23%	0.227	S	C	.	.	H	α-helix	trans	-59.1	-49.3	-174.1	-66	163.9	0	0	0	111.1	P103 N109 V110 M111 F116	P103-I107 WeakPolarHBondContact O-CG1 3.31Å; P103-I107 PolarHBondContact O-N 3.49Å; I107-N109 VanDerWaalsContact C-N 3.3Å; I107-N109 PolarHBondContact O-N 2.94Å; I107-V110 PolarHBondContact O-N 2.74Å; I107-V110 VanDerWaalsContact O-N 3.15Å; I107-M111 HydrophobicContact CG2-CG 4.02Å; I107-M111 WeakPolarHBondContact O-CB 3.34Å; I107-M111 WeakPolarHBondContact O-CG 3.25Å; I107-M111 PolarHBondContact O-N 3Å; I107-F116 HydrophobicContact CB-CE2 4.03Å; I107-F116 HydrophobicContact CB-CZ 3.99Å; I107-F116 HydrophobicContact CD1-CZ 3.75Å; I107-F116 HydrophobicContact CG1-CZ 4.48Å; I107-F116 HydrophobicContact CG2-CE2 3.94Å; I107-F116 HydrophobicContact CG2-CZ 3.78Å
108	P	86.1	Confident	89.6	Confident	18 Å²	18	46.2 Å²	46.2	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-29.8	177.1	-22.7	36.9	0	0	0	113.7	F104 V110 K112 D113 F114 F116	F104-P108 WeakPolarHBondContact O-CD 3.45Å; F104-P108 VanDerWaalsContact O-CG 3.24Å; F104-P108 WeakPolarHBondContact O-CG 3.44Å; P108-V110 VanDerWaalsContact C-N 3.29Å; P108-V110 PolarHBondContact O-N 3.14Å; P108-K112 WeakPolarHBondContact O-CA 3.3Å; P108-K112 PolarHBondContact O-N 3.3Å; P108-D113 VanDerWaalsContact CA-O 3.29Å; P108-D113 WeakPolarHBondContact CA-O 3.49Å; P108-D113 WeakPolarHBondContact CB-O 3.16Å; P108-D113 PolarHBondContact O-N 2.66Å; P108-F114 HydrophobicContact CB-CB 4.37Å; P108-F114 HydrophobicContact CB-CD2 3.94Å; P108-F114 HydrophobicContact CG-CD2 3.47Å; P108-F114 VanDerWaalsContact CG-CD2 3.47Å; P108-F114 HydrophobicContact CG-CE2 3.95Å; P108-F114 HydrophobicContact CG-CG 4.33Å; P108-F116 HydrophobicContact CG-CD2 4.24Å; P108-F116 HydrophobicContact CG-CE2 3.98Å
109	N	82.4	Confident	89.6	Confident	50 Å²	50	48.3 Å²	48.3	27%	0.267	27%	0.266	S	S	.	.	H	α-helix	trans	-68.6	-28.4	174.9	-81.1	-28.1	0	0	0	113	R48 T105 L106 I107	R48-N109 PolarHBondContact NH2-O 2.89Å; R48-N109 VanDerWaalsContact NH2-O 3.09Å; T105-N109 WeakPolarHBondContact O-CB 3.34Å; T105-N109 PolarHBondContact O-N 2.89Å; T105-N109 PolarHBondContact O-ND2 2.93Å; L106-N109 WeakPolarHBondContact O-CB 3.48Å; L106-N109 PolarHBondContact O-N 3.36Å; L106-N109 VanDerWaalsContact O-N 3.12Å; I107-N109 VanDerWaalsContact C-N 3.3Å; I107-N109 PolarHBondContact O-N 2.94Å
110	V	84.6	Confident	89.5	Confident	46 Å²	46	46 Å²	46	28%	0.279	25%	0.253	S	S	.	.	H	α-helix	trans	-84.6	-51.9	175.9	175.4	0	0	0	0	110.4	I49 L106 I107 P108 K112	I49-V110 HydrophobicContact CD1-CG1 4.39Å; I49-V110 HydrophobicContact CD1-CG2 3.96Å; I49-V110 HydrophobicContact CG1-CG2 3.78Å; L106-V110 HydrophobicContact CD1-CG2 3.94Å; L106-V110 HydrophobicContact CG-CG2 4.4Å; L106-V110 WeakPolarHBondContact O-CG2 3.32Å; L106-V110 PolarHBondContact O-N 3.43Å; I107-V110 PolarHBondContact O-N 2.74Å; I107-V110 VanDerWaalsContact O-N 3.15Å; P108-V110 VanDerWaalsContact C-N 3.29Å; P108-V110 PolarHBondContact O-N 3.14Å; V110-K112 PolarHBondContact O-N 2.92Å
111	M	84.8	Confident	89.6	Confident	116 Å²	116	44.3 Å²	44.3	57%	0.571	24%	0.243	S	C	*	.	H	α-helix	trans	-69.2	-14	-179.3	-64.4	-61.4	-67.1	0	0	113.3	I107 D113	I107-M111 HydrophobicContact CG2-CG 4.02Å; I107-M111 WeakPolarHBondContact O-CB 3.34Å; I107-M111 WeakPolarHBondContact O-CG 3.25Å; I107-M111 PolarHBondContact O-N 3Å; M111-D113 HydrophobicContact CB-CB 4.42Å; M111-D113 PolarHBondContact O-N 3.49Å; M111-D113 VanDerWaalsContact O-N 3.15Å
112	K	84.2	Confident	89.8	Confident	107 Å²	107	47.1 Å²	47.1	47%	0.465	26%	0.255	S	S	.	.	S	Bend	trans	54.2	26.5	-168.4	-56.2	-61.2	-174.1	179.9	0	112.5	P108 V110 F192	P108-K112 WeakPolarHBondContact O-CA 3.3Å; P108-K112 PolarHBondContact O-N 3.3Å; V110-K112 PolarHBondContact O-N 2.92Å; K112-F192 WeakPolarHBondContact O-CZ 3.43Å
113	D	85.5	Confident	89.9	Confident	18 Å²	18	51.3 Å²	51.3	10%	0.096	28%	0.276	C	S	.	.	S	Bend	trans	-153.3	135.9	-175.1	-171.6	37.1	0	0	0	112.2	P108 M111 I115 R194 G200 H201	P108-D113 VanDerWaalsContact CA-O 3.29Å; P108-D113 WeakPolarHBondContact CA-O 3.49Å; P108-D113 WeakPolarHBondContact CB-O 3.16Å; P108-D113 PolarHBondContact O-N 2.66Å; M111-D113 HydrophobicContact CB-CB 4.42Å; M111-D113 PolarHBondContact O-N 3.49Å; M111-D113 VanDerWaalsContact O-N 3.15Å; D113-I115 HydrophobicContact CB-CG2 4.38Å; D113-I115 PolarHBondContact O-N 3.34Å; D113-I115 WeakPolarHBondContact OD2-CG2 3.16Å; D113-R194 VanDerWaalsContact CB-NH2 3.29Å; D113-R194 IonicContact OD1-NH2 3.33Å; D113-R194 PolarHBondContact OD1-NH2 2.97Å; D113-R194 IonicContact OD2-CZ 3.93Å; D113-R194 IonicContact OD2-NH2 2.66Å; D113-R194 PolarHBondContact OD2-NH2 3.42Å; D113-G200 WeakPolarHBondContact OD1-CA 3.45Å; D113-H201 PolarHBondContact OD1-N 3.15Å
114	F	91	Very high	90	Very high	15 Å²	15	50 Å²	50	7%	0.066	27%	0.267	C	S	.	.			trans	-94.9	87.9	176.1	-165.1	-83.3	0	0	0	110.8	P108 F116 G117 M120 C121 L189 H201 C203	P108-F114 HydrophobicContact CB-CB 4.37Å; P108-F114 HydrophobicContact CB-CD2 3.94Å; P108-F114 HydrophobicContact CG-CD2 3.47Å; P108-F114 VanDerWaalsContact CG-CD2 3.47Å; P108-F114 HydrophobicContact CG-CE2 3.95Å; P108-F114 HydrophobicContact CG-CG 4.33Å; F114-F116 VanDerWaalsContact C-N 3.33Å; F114-F116 HydrophobicContact CD1-CB 4.33Å; F114-F116 HydrophobicContact CE1-CB 3.63Å; F114-F116 HydrophobicContact CE1-CD2 4.34Å; F114-F116 HydrophobicContact CE2-CD2 4.14Å; F114-F116 HydrophobicContact CZ-CB 3.88Å; F114-F116 HydrophobicContact CZ-CD2 4.05Å; F114-F116 HydrophobicContact CZ-CG 4.46Å; F114-F116 PolarHBondContact O-N 2.87Å; F114-G117 VanDerWaalsContact CE1-O 3.32Å; F114-G117 WeakPolarHBondContact CE1-O 3.09Å; F114-M120 HydrophobicContact CE1-CB 4.3Å; F114-M120 HydrophobicContact CZ-CB 4.13Å; F114-C121 HydrophobicContact CD1-CB 4.49Å; F114-C121 HydrophobicContact CE1-CB 3.85Å; F114-C121 HydrophobicContact CZ-CB 4.06Å; F114-L189 HydrophobicContact CB-CD1 4.09Å; F114-L189 HydrophobicContact CD1-CD1 3.68Å; F114-L189 HydrophobicContact CG-CD1 4.16Å; F114-H201 WeakPolarHBondContact CB-O 3.34Å; F114-H201 PolarHBondContact N-O 3.28Å; F114-C203 HydrophobicContact CD1-CB 4.44Å; F114-C203 HydrophobicContact CD2-CB 3.95Å; F114-C203 HydrophobicContact CE2-CB 4.2Å; F114-C203 HydrophobicContact CG-CB 4.09Å
115	I	91.6	Very high	90.1	Very high	103 Å²	103	50 Å²	50	53%	0.528	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-9.1	-176.3	62.3	170.9	0	0	0	114.8	D113 G117	D113-I115 HydrophobicContact CB-CG2 4.38Å; D113-I115 PolarHBondContact O-N 3.34Å; D113-I115 WeakPolarHBondContact OD2-CG2 3.16Å; I115-G117 VanDerWaalsContact C-N 3.29Å; I115-G117 PolarHBondContact O-N 3.03Å
116	F	92.3	Very high	90.5	Very high	60 Å²	60	51 Å²	51	26%	0.263	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.7	-170	-56.4	-75.3	0	0	0	114.8	F104 I107 P108 F114 M120	F104-F116 AromaticContact CD1-CD1 3.89Å; F104-F116 HydrophobicContact CD1-CD1 3.89Å; F104-F116 AromaticContact CD1-CD2 3.79Å; F104-F116 HydrophobicContact CD1-CD2 3.79Å; F104-F116 AromaticContact CD1-CE1 3.89Å; F104-F116 HydrophobicContact CD1-CE1 3.89Å; F104-F116 AromaticContact CD1-CE2 3.79Å; F104-F116 HydrophobicContact CD1-CE2 3.79Å; F104-F116 AromaticContact CD1-CG 3.83Å; F104-F116 HydrophobicContact CD1-CG 3.83Å; F104-F116 AromaticContact CD1-CZ 3.84Å; F104-F116 HydrophobicContact CD1-CZ 3.84Å; F104-F116 AromaticContact CE1-CD1 3.69Å; F104-F116 HydrophobicContact CE1-CD1 3.69Å; F104-F116 HydrophobicContact CE1-CD2 4.44Å; F104-F116 AromaticContact CE1-CE1 3.69Å; F104-F116 HydrophobicContact CE1-CE1 3.69Å; F104-F116 HydrophobicContact CE1-CE2 4.44Å; F104-F116 HydrophobicContact CE1-CG 4.07Å; F104-F116 HydrophobicContact CE1-CZ 4.08Å; I107-F116 HydrophobicContact CB-CE2 4.03Å; I107-F116 HydrophobicContact CB-CZ 3.99Å; I107-F116 HydrophobicContact CD1-CZ 3.75Å; I107-F116 HydrophobicContact CG1-CZ 4.48Å; I107-F116 HydrophobicContact CG2-CE2 3.94Å; I107-F116 HydrophobicContact CG2-CZ 3.78Å; P108-F116 HydrophobicContact CG-CD2 4.24Å; P108-F116 HydrophobicContact CG-CE2 3.98Å; F114-F116 VanDerWaalsContact C-N 3.33Å; F114-F116 HydrophobicContact CD1-CB 4.33Å; F114-F116 HydrophobicContact CE1-CB 3.63Å; F114-F116 HydrophobicContact CE1-CD2 4.34Å; F114-F116 HydrophobicContact CE2-CD2 4.14Å; F114-F116 HydrophobicContact CZ-CB 3.88Å; F114-F116 HydrophobicContact CZ-CD2 4.05Å; F114-F116 HydrophobicContact CZ-CG 4.46Å; F114-F116 PolarHBondContact O-N 2.87Å; F116-M120 HydrophobicContact CB-CB 3.56Å; F116-M120 HydrophobicContact CB-CG 3.82Å
117	G	93.6	Very high	90.8	Very high	28 Å²	28	52.9 Å²	52.9	29%	0.289	28%	0.277	S	S	.	.	H	α-helix	trans	75.8	177.1	176.9	0	0	0	0	0	115.6	F114 I115 G119 M120 C121	F114-G117 VanDerWaalsContact CE1-O 3.32Å; F114-G117 WeakPolarHBondContact CE1-O 3.09Å; I115-G117 VanDerWaalsContact C-N 3.29Å; I115-G117 PolarHBondContact O-N 3.03Å; G117-G119 PolarHBondContact O-N 2.93Å; G117-M120 PolarHBondContact O-N 3.23Å; G117-C121 PolarHBondContact O-N 3.44Å
118	L	94	Very high	91	Very high	82 Å²	82	51.3 Å²	51.3	43%	0.429	27%	0.269	S	S	.	.	H	α-helix	trans	-61.5	-40	-171.4	-177.5	62.8	0	0	0	113.6	M120 C121 K122 L189	L118-M120 PolarHBondContact O-N 2.93Å; L118-C121 WeakPolarHBondContact O-CB 3Å; L118-C121 PolarHBondContact O-N 3.22Å; L118-K122 HydrophobicContact CD1-CG 4.44Å; L118-K122 HydrophobicContact CG-CD 4.38Å; L118-K122 WeakPolarHBondContact O-CG 3.03Å; L118-K122 PolarHBondContact O-N 3.28Å; L118-L189 HydrophobicContact CD1-CB 4.3Å
119	G	94.4	Very high	91.4	Very high	44 Å²	44	50.9 Å²	50.9	45%	0.454	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-47	-178.3	0	0	0	0	0	112.6	G117 K122 M123	G117-G119 PolarHBondContact O-N 2.93Å; G119-K122 PolarHBondContact O-N 2.97Å; G119-M123 WeakPolarHBondContact O-CG 3.34Å; G119-M123 PolarHBondContact O-N 3.4Å
120	M	93.5	Very high	92.1	Very high	41 Å²	41	48.6 Å²	48.6	20%	0.202	26%	0.256	C	S	.	.	H	α-helix	trans	-68.3	-36.5	177.7	-70.6	-57.1	-49.4	0	0	112.2	F104 F114 F116 G117 L118 K122 M123 V124	F104-M120 HydrophobicContact CD1-CE 3.74Å; F104-M120 HydrophobicContact CD2-CE 4.1Å; F104-M120 HydrophobicContact CE1-CE 3.51Å; F104-M120 HydrophobicContact CE2-CE 3.88Å; F104-M120 HydrophobicContact CG-CE 4.02Å; F104-M120 HydrophobicContact CZ-CE 3.57Å; F114-M120 HydrophobicContact CE1-CB 4.3Å; F114-M120 HydrophobicContact CZ-CB 4.13Å; F116-M120 HydrophobicContact CB-CB 3.56Å; F116-M120 HydrophobicContact CB-CG 3.82Å; G117-M120 PolarHBondContact O-N 3.23Å; L118-M120 PolarHBondContact O-N 2.93Å; M120-K122 VanDerWaalsContact C-N 3.34Å; M120-K122 PolarHBondContact O-N 3.37Å; M120-M123 HydrophobicContact CE-CE 4.3Å; M120-M123 HydrophobicContact CG-CE 4.47Å; M120-M123 PolarHBondContact O-N 2.92Å; M120-M123 HydrophobicContact SD-CE 3.28Å; M120-M123 WeakPolarHBondContact SD-CE 3.47Å; M120-V124 HydrophobicContact CE-CG2 4.03Å; M120-V124 WeakPolarHBondContact O-CB 3.2Å; M120-V124 WeakPolarHBondContact O-CG2 3.48Å; M120-V124 PolarHBondContact O-N 3.09Å
121	C	94.1	Very high	92.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.2	-48.5	173.5	170.6	0	0	0	0	111.4	F114 G117 L118 M125 C203	F114-C121 HydrophobicContact CD1-CB 4.49Å; F114-C121 HydrophobicContact CE1-CB 3.85Å; F114-C121 HydrophobicContact CZ-CB 4.06Å; G117-C121 PolarHBondContact O-N 3.44Å; L118-C121 WeakPolarHBondContact O-CB 3Å; L118-C121 PolarHBondContact O-N 3.22Å; C121-M125 WeakPolarHBondContact O-CB 3.35Å; C121-M125 WeakPolarHBondContact O-CG 3.39Å; C121-M125 PolarHBondContact O-N 3.27Å; C121-C203 WeakPolarHBondContact CA-SG 3.36Å; C121-C203 HydrophobicContact CB-CB 3.75Å; C121-C203 WeakPolarHBondContact CB-SG 3.39Å; C121-C203 VanDerWaalsContact SG-CA 3.59Å; C121-C203 WeakPolarHBondContact SG-CB 3.26Å; C121-C203 CovalentContact SG-SG 2.03Å; C121-C203 PolarHBondContact SG-SG 3.44Å
122	K	95.3	Very high	93.1	Very high	59 Å²	59	41.4 Å²	41.4	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-45.8	177.3	-66.4	-178.2	177.9	-64.2	0	112.4	L118 G119 M120 Y126 P184 S187	L118-K122 HydrophobicContact CD1-CG 4.44Å; L118-K122 HydrophobicContact CG-CD 4.38Å; L118-K122 WeakPolarHBondContact O-CG 3.03Å; L118-K122 PolarHBondContact O-N 3.28Å; G119-K122 PolarHBondContact O-N 2.97Å; M120-K122 VanDerWaalsContact C-N 3.34Å; M120-K122 PolarHBondContact O-N 3.37Å; K122-Y126 VanDerWaalsContact O-CB 3.29Å; K122-Y126 WeakPolarHBondContact O-CB 3.37Å; K122-Y126 PolarHBondContact O-N 3.21Å; K122-P184 HydrophobicContact CB-CB 4.14Å; K122-P184 VanDerWaalsContact CD-O 3.3Å; K122-P184 WeakPolarHBondContact CD-O 3.44Å; K122-P184 WeakPolarHBondContact CG-O 3.39Å; K122-P184 PolarHBondContact NZ-O 3.38Å; K122-S187 WeakPolarHBondContact CA-OG 3.2Å; K122-S187 WeakPolarHBondContact CG-OG 3.12Å; K122-S187 PolarHBondContact NZ-O 3.04Å
123	M	94.5	Very high	93.7	Very high	89 Å²	89	36.3 Å²	36.3	44%	0.438	20%	0.196	S	C	.	.	H	α-helix	trans	-65.7	-44.1	-178.2	-73.6	-164.6	-63.9	0	0	113.1	G119 M120 Y126 F127	G119-M123 WeakPolarHBondContact O-CG 3.34Å; G119-M123 PolarHBondContact O-N 3.4Å; M120-M123 HydrophobicContact CE-CE 4.3Å; M120-M123 HydrophobicContact CG-CE 4.47Å; M120-M123 PolarHBondContact O-N 2.92Å; M120-M123 HydrophobicContact SD-CE 3.28Å; M120-M123 WeakPolarHBondContact SD-CE 3.47Å; M123-Y126 PolarHBondContact O-N 2.99Å; M123-F127 HydrophobicContact CB-CD2 4.31Å; M123-F127 HydrophobicContact CB-CE2 4.41Å; M123-F127 WeakPolarHBondContact O-CB 3.3Å; M123-F127 VanDerWaalsContact O-CD2 3.25Å; M123-F127 WeakPolarHBondContact O-CD2 3.32Å; M123-F127 PolarHBondContact O-N 3.08Å
124	V	92.7	Very high	94.3	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.048	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-46.8	-179.7	172.1	0	0	0	0	110.5	F104 M120 Y126 M128	F104-V124 HydrophobicContact CB-CG1 4.39Å; F104-V124 HydrophobicContact CB-CG2 3.54Å; F104-V124 HydrophobicContact CD2-CG2 4.4Å; F104-V124 HydrophobicContact CG-CG2 3.98Å; M120-V124 HydrophobicContact CE-CG2 4.03Å; M120-V124 WeakPolarHBondContact O-CB 3.2Å; M120-V124 WeakPolarHBondContact O-CG2 3.48Å; M120-V124 PolarHBondContact O-N 3.09Å; V124-Y126 VanDerWaalsContact C-N 3.34Å; V124-Y126 PolarHBondContact O-N 3.41Å; V124-M128 WeakPolarHBondContact O-CB 3.47Å; V124-M128 PolarHBondContact O-N 3.04Å
125	M	92.7	Very high	94.5	Very high	49 Å²	49	35.1 Å²	35.1	24%	0.241	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-41.8	177.9	-69.2	-65.7	-179.7	0	0	111.8	C121 G129 Y183 C203	C121-M125 WeakPolarHBondContact O-CB 3.35Å; C121-M125 WeakPolarHBondContact O-CG 3.39Å; C121-M125 PolarHBondContact O-N 3.27Å; M125-G129 PolarHBondContact O-N 3.45Å; M125-Y183 HydrophobicContact CB-CD1 4.27Å; M125-C203 HydrophobicContact CE-CB 4.48Å
126	Y	96	Very high	94.7	Very high	45 Å²	45	30.2 Å²	30.2	18%	0.176	17%	0.166	C	C	.	.	H	α-helix	trans	-64.7	-56.1	177.3	-179.9	-117.6	0	0	0	112.3	K122 M123 V124 M128 G129 V130 S177 M180 L181 P184	K122-Y126 VanDerWaalsContact O-CB 3.29Å; K122-Y126 WeakPolarHBondContact O-CB 3.37Å; K122-Y126 PolarHBondContact O-N 3.21Å; M123-Y126 PolarHBondContact O-N 2.99Å; V124-Y126 VanDerWaalsContact C-N 3.34Å; V124-Y126 PolarHBondContact O-N 3.41Å; Y126-M128 VanDerWaalsContact C-N 3.28Å; Y126-M128 PolarHBondContact O-N 3.21Å; Y126-G129 PolarHBondContact O-N 3.43Å; Y126-G129 VanDerWaalsContact O-N 3.12Å; Y126-V130 HydrophobicContact CD1-CG2 4.35Å; Y126-V130 HydrophobicContact CD2-CG2 4.06Å; Y126-V130 HydrophobicContact CE1-CG2 4Å; Y126-V130 HydrophobicContact CE2-CG2 3.7Å; Y126-V130 HydrophobicContact CG-CG2 4.39Å; Y126-V130 WeakPolarHBondContact O-CG2 3.39Å; Y126-V130 PolarHBondContact O-N 3.42Å; Y126-S177 WeakPolarHBondContact OH-CB 3.42Å; Y126-S177 PolarHBondContact OH-O 2.71Å; Y126-M180 HydrophobicContact CD2-CB 4.08Å; Y126-M180 WeakPolarHBondContact CD2-O 3.35Å; Y126-M180 HydrophobicContact CE2-CB 3.98Å; Y126-L181 HydrophobicContact CE2-CD2 4.23Å; Y126-P184 HydrophobicContact CD2-CG 3.77Å; Y126-P184 HydrophobicContact CE2-CG 4.46Å; Y126-P184 HydrophobicContact CG-CG 4.1Å
127	F	95.3	Very high	94.9	Very high	66 Å²	66	29.2 Å²	29.2	29%	0.289	16%	0.162	S	C	.	.	H	α-helix	trans	-67.6	-29.4	-176.3	-74.3	-56.2	0	0	0	112.8	L96 V100 M123 V130 S131	L96-F127 HydrophobicContact CD1-CB 4.22Å; L96-F127 HydrophobicContact CD1-CD1 4.17Å; L96-F127 HydrophobicContact CD1-CG 4.13Å; L96-F127 HydrophobicContact CD2-CB 4.25Å; L96-F127 HydrophobicContact CD2-CD1 3.78Å; L96-F127 HydrophobicContact CD2-CG 4.31Å; L96-F127 HydrophobicContact CG-CB 4.26Å; L96-F127 HydrophobicContact CG-CD1 4.44Å; V100-F127 HydrophobicContact CG1-CB 4.25Å; V100-F127 HydrophobicContact CG1-CD2 4.08Å; M123-F127 HydrophobicContact CB-CD2 4.31Å; M123-F127 HydrophobicContact CB-CE2 4.41Å; M123-F127 WeakPolarHBondContact O-CB 3.3Å; M123-F127 VanDerWaalsContact O-CD2 3.25Å; M123-F127 WeakPolarHBondContact O-CD2 3.32Å; M123-F127 PolarHBondContact O-N 3.08Å; F127-V130 PolarHBondContact O-N 3.14Å; F127-S131 VanDerWaalsContact O-CB 3.31Å; F127-S131 WeakPolarHBondContact O-CB 3.27Å; F127-S131 PolarHBondContact O-N 3.47Å; F127-S131 PolarHBondContact O-OG 3.35Å
128	M	93.1	Very high	95	Very high	33 Å²	33	27.9 Å²	27.9	16%	0.163	15%	0.148	C	C	.	.	H	α-helix	trans	-58.2	-52.8	169.5	-177	172.5	178.9	0	0	110.5	C101 V124 Y126 V130 S131 V132 Y357	C101-M128 VanDerWaalsContact SG-CA 3.53Å; V124-M128 WeakPolarHBondContact O-CB 3.47Å; V124-M128 PolarHBondContact O-N 3.04Å; Y126-M128 VanDerWaalsContact C-N 3.28Å; Y126-M128 PolarHBondContact O-N 3.21Å; M128-V130 PolarHBondContact O-N 3.45Å; M128-S131 PolarHBondContact O-N 2.89Å; M128-V132 VanDerWaalsContact O-CG2 3.23Å; M128-V132 WeakPolarHBondContact O-CG2 3.38Å; M128-V132 PolarHBondContact O-N 3.34Å; M128-Y357 HydrophobicContact CE-CE1 3.89Å; M128-Y357 WeakPolarHBondContact CE-OH 3.43Å; M128-Y357 HydrophobicContact SD-CE1 4.35Å; M128-Y357 PolarHBondContact SD-OH 3.41Å
129	G	93.8	Very high	95	Very high	9 Å²	9	24.3 Å²	24.3	9%	0.093	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-43.9	177.9	0	0	0	0	0	113.4	M125 Y126 V132 S133 M180	M125-G129 PolarHBondContact O-N 3.45Å; Y126-G129 PolarHBondContact O-N 3.43Å; Y126-G129 VanDerWaalsContact O-N 3.12Å; G129-V132 PolarHBondContact O-N 3.12Å; G129-S133 WeakPolarHBondContact O-CB 3.17Å; G129-S133 PolarHBondContact O-N 3.4Å; G129-S133 VanDerWaalsContact O-N 3.07Å; G129-S133 PolarHBondContact O-OG 3.16Å; G129-M180 WeakPolarHBondContact CA-SD 3.38Å
130	V	97.3	Very high	95.1	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.018	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-48.5	180	173.4	0	0	0	0	110.8	Y126 F127 M128 V132 S133 V134 M180	Y126-V130 HydrophobicContact CD1-CG2 4.35Å; Y126-V130 HydrophobicContact CD2-CG2 4.06Å; Y126-V130 HydrophobicContact CE1-CG2 4Å; Y126-V130 HydrophobicContact CE2-CG2 3.7Å; Y126-V130 HydrophobicContact CG-CG2 4.39Å; Y126-V130 WeakPolarHBondContact O-CG2 3.39Å; Y126-V130 PolarHBondContact O-N 3.42Å; F127-V130 PolarHBondContact O-N 3.14Å; M128-V130 PolarHBondContact O-N 3.45Å; V130-V132 VanDerWaalsContact C-N 3.33Å; V130-V132 PolarHBondContact O-N 3.22Å; V130-S133 PolarHBondContact O-N 3.06Å; V130-V134 HydrophobicContact CG1-CG2 4.14Å; V130-V134 WeakPolarHBondContact O-CB 3.46Å; V130-V134 VanDerWaalsContact O-CG2 3.32Å; V130-V134 WeakPolarHBondContact O-CG2 3.45Å; V130-V134 PolarHBondContact O-N 3.23Å; V130-M180 HydrophobicContact CG2-CB 3.69Å; V130-M180 HydrophobicContact CG2-CG 4.06Å
131	S	95.4	Very high	95.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-57.7	-45.4	178.9	-82.2	0	0	0	0	112.2	S93 L96 F127 M128 S133 V134 S135	S93-S131 PolarHBondContact O-OG 2.86Å; S93-S131 VanDerWaalsContact OG-CA 3.28Å; S93-S131 WeakPolarHBondContact OG-CA 3.42Å; S93-S131 PolarHBondContact OG-O 3.45Å; L96-S131 WeakPolarHBondContact CB-OG 3.49Å; L96-S131 VanDerWaalsContact CD2-OG 3.31Å; L96-S131 WeakPolarHBondContact CD2-OG 3.41Å; L96-S131 WeakPolarHBondContact CG-OG 3.43Å; F127-S131 VanDerWaalsContact O-CB 3.31Å; F127-S131 WeakPolarHBondContact O-CB 3.27Å; F127-S131 PolarHBondContact O-N 3.47Å; F127-S131 PolarHBondContact O-OG 3.35Å; M128-S131 PolarHBondContact O-N 2.89Å; S131-S133 VanDerWaalsContact C-N 3.32Å; S131-S133 PolarHBondContact O-N 3.49Å; S131-V134 PolarHBondContact O-N 3.4Å; S131-S135 WeakPolarHBondContact O-CB 3.39Å; S131-S135 PolarHBondContact O-N 2.86Å; S131-S135 PolarHBondContact O-OG 3.28Å; S131-S135 VanDerWaalsContact O-OG 3.11Å
132	V	94.4	Very high	95.1	Very high	11 Å²	11	21.6 Å²	21.6	7%	0.067	11%	0.107	C	C	.	.	H	α-helix	trans	-62.7	-43.3	179.9	177	0	0	0	0	111.2	M128 G129 V130 S135 T136 W324	M128-V132 VanDerWaalsContact O-CG2 3.23Å; M128-V132 WeakPolarHBondContact O-CG2 3.38Å; M128-V132 PolarHBondContact O-N 3.34Å; G129-V132 PolarHBondContact O-N 3.12Å; V130-V132 VanDerWaalsContact C-N 3.33Å; V130-V132 PolarHBondContact O-N 3.22Å; V132-S135 PolarHBondContact O-N 3.38Å; V132-T136 WeakPolarHBondContact O-CB 3.44Å; V132-T136 PolarHBondContact O-N 3.19Å; V132-T136 PolarHBondContact O-OG1 2.82Å; V132-W324 HydrophobicContact CB-CH2 4.06Å; V132-W324 HydrophobicContact CB-CZ2 4.34Å; V132-W324 HydrophobicContact CB-CZ3 4.36Å; V132-W324 HydrophobicContact CG1-CD2 4.3Å; V132-W324 HydrophobicContact CG1-CE3 4.02Å; V132-W324 HydrophobicContact CG1-CH2 3.83Å; V132-W324 HydrophobicContact CG1-CZ2 4.01Å; V132-W324 HydrophobicContact CG1-CZ3 3.77Å; V132-W324 HydrophobicContact CG2-CH2 3.01Å; V132-W324 HydrophobicContact CG2-CZ2 3.52Å; V132-W324 HydrophobicContact CG2-CZ3 3.59Å
133	S	97	Very high	95	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-47.1	178.5	-56.3	0	0	0	0	111.6	G129 V130 S131 S135 T136 F137 S176 M180 L224	G129-S133 WeakPolarHBondContact O-CB 3.17Å; G129-S133 PolarHBondContact O-N 3.4Å; G129-S133 VanDerWaalsContact O-N 3.07Å; G129-S133 PolarHBondContact O-OG 3.16Å; V130-S133 PolarHBondContact O-N 3.06Å; S131-S133 VanDerWaalsContact C-N 3.32Å; S131-S133 PolarHBondContact O-N 3.49Å; S133-S135 PolarHBondContact O-N 3.48Å; S133-T136 PolarHBondContact O-N 2.92Å; S133-F137 VanDerWaalsContact O-CD2 3.29Å; S133-F137 WeakPolarHBondContact O-CD2 2.91Å; S133-F137 WeakPolarHBondContact O-CG 3.01Å; S133-F137 PolarHBondContact O-N 3.18Å; S133-S176 WeakPolarHBondContact CB-OG 3.4Å; S133-M180 WeakPolarHBondContact OG-CE 3.3Å; S133-L224 WeakPolarHBondContact OG-CD1 3.26Å
134	V	97.4	Very high	94.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.6	-45.7	177.5	171	0	0	0	0	110.8	V130 S131 T136 N138 W173 S176	V130-V134 HydrophobicContact CG1-CG2 4.14Å; V130-V134 WeakPolarHBondContact O-CB 3.46Å; V130-V134 VanDerWaalsContact O-CG2 3.32Å; V130-V134 WeakPolarHBondContact O-CG2 3.45Å; V130-V134 PolarHBondContact O-N 3.23Å; S131-V134 PolarHBondContact O-N 3.4Å; V134-T136 VanDerWaalsContact C-N 3.34Å; V134-T136 PolarHBondContact O-N 3.24Å; V134-N138 WeakPolarHBondContact CG1-ND2 3.41Å; V134-N138 VanDerWaalsContact O-CB 3.32Å; V134-N138 WeakPolarHBondContact O-CB 3.5Å; V134-N138 PolarHBondContact O-N 2.92Å; V134-N138 PolarHBondContact O-ND2 3.48Å; V134-W173 HydrophobicContact CG1-CD2 4.17Å; V134-W173 HydrophobicContact CG1-CH2 4.45Å; V134-W173 HydrophobicContact CG1-CZ2 3.89Å; V134-W173 HydrophobicContact CG2-CD2 3.97Å; V134-W173 HydrophobicContact CG2-CE3 3.99Å; V134-W173 HydrophobicContact CG2-CG 4.33Å; V134-W173 HydrophobicContact CG2-CZ3 4.39Å; V134-S176 VanDerWaalsContact CG2-CB 3.47Å; V134-S176 WeakPolarHBondContact CG2-OG 3.09Å; V134-S176 PolarHBondContact N-OG 2.85Å
135	S	95.5	Very high	94.8	Very high	8 Å²	8	17.1 Å²	17.1	6%	0.056	9%	0.087	C	C	.	.	H	α-helix	trans	-62.2	-43.2	179.1	-66.2	0	0	0	0	111.1	S93 D94 S131 V132 S133 N138 L139	S93-S135 WeakPolarHBondContact CB-OG 3.21Å; S93-S135 PolarHBondContact OG-OG 3.5Å; D94-S135 PolarHBondContact OD1-OG 3.4Å; S131-S135 WeakPolarHBondContact O-CB 3.39Å; S131-S135 PolarHBondContact O-N 2.86Å; S131-S135 PolarHBondContact O-OG 3.28Å; S131-S135 VanDerWaalsContact O-OG 3.11Å; V132-S135 PolarHBondContact O-N 3.38Å; S133-S135 PolarHBondContact O-N 3.48Å; S135-N138 PolarHBondContact O-N 3.49Å; S135-L139 WeakPolarHBondContact O-CG 3.02Å; S135-L139 PolarHBondContact O-N 2.92Å
136	T	96.4	Very high	94.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61	-53.4	177.1	-55.6	0	0	0	0	112.1	V132 S133 V134 N138 L139 V140 L224 P228 F320	V132-T136 WeakPolarHBondContact O-CB 3.44Å; V132-T136 PolarHBondContact O-N 3.19Å; V132-T136 PolarHBondContact O-OG1 2.82Å; S133-T136 PolarHBondContact O-N 2.92Å; V134-T136 VanDerWaalsContact C-N 3.34Å; V134-T136 PolarHBondContact O-N 3.24Å; T136-N138 VanDerWaalsContact C-N 3.27Å; T136-N138 PolarHBondContact O-N 2.59Å; T136-L139 PolarHBondContact O-N 3.3Å; T136-L139 VanDerWaalsContact O-N 3.11Å; T136-V140 PolarHBondContact O-N 3.45Å; T136-L224 VanDerWaalsContact CG2-O 3.26Å; T136-L224 WeakPolarHBondContact CG2-O 3.27Å; T136-P228 HydrophobicContact CG2-CB 3.63Å; T136-P228 HydrophobicContact CG2-CG 3.57Å; T136-F320 HydrophobicContact CG2-CZ 4.12Å; T136-F320 VanDerWaalsContact OG1-CZ 3.23Å; T136-F320 WeakPolarHBondContact OG1-CZ 3.46Å
137	F	97.1	Very high	94.5	Very high	39 Å²	39	18.3 Å²	18.3	17%	0.171	9%	0.089	C	C	.	.	H	α-helix	trans	-66.2	-31.1	-178.9	-62.7	-37	0	0	0	112.3	S133 V140 A141 T172 V175 S176 L179 V223 L224	S133-F137 VanDerWaalsContact O-CD2 3.29Å; S133-F137 WeakPolarHBondContact O-CD2 2.91Å; S133-F137 WeakPolarHBondContact O-CG 3.01Å; S133-F137 PolarHBondContact O-N 3.18Å; F137-V140 PolarHBondContact O-N 3.09Å; F137-A141 WeakPolarHBondContact O-CB 3.28Å; F137-A141 PolarHBondContact O-N 2.94Å; F137-T172 HydrophobicContact CB-CG2 3.71Å; F137-V175 HydrophobicContact CE2-CG1 4.07Å; F137-S176 WeakPolarHBondContact CD2-OG 3.22Å; F137-L179 HydrophobicContact CE2-CD2 4.49Å; F137-L179 HydrophobicContact CZ-CD2 4.31Å; F137-V223 HydrophobicContact CE1-CG1 4.37Å; F137-V223 HydrophobicContact CZ-CG1 4.03Å; F137-L224 HydrophobicContact CE1-CD2 4.09Å; F137-L224 HydrophobicContact CE2-CD2 4.27Å; F137-L224 HydrophobicContact CZ-CD2 3.72Å
138	N	95.3	Very high	94.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-66	-39.5	171.5	-82.4	-61.9	0	0	0	112.3	S89 L90 V134 S135 T136 A141 I142	S89-N138 PolarHBondContact OG-ND2 3.34Å; L90-N138 HydrophobicContact CD1-CB 4.48Å; V134-N138 WeakPolarHBondContact CG1-ND2 3.41Å; V134-N138 VanDerWaalsContact O-CB 3.32Å; V134-N138 WeakPolarHBondContact O-CB 3.5Å; V134-N138 PolarHBondContact O-N 2.92Å; V134-N138 PolarHBondContact O-ND2 3.48Å; S135-N138 PolarHBondContact O-N 3.49Å; T136-N138 VanDerWaalsContact C-N 3.27Å; T136-N138 PolarHBondContact O-N 2.59Å; N138-A141 PolarHBondContact O-N 3.4Å; N138-I142 WeakPolarHBondContact O-CB 3.14Å; N138-I142 WeakPolarHBondContact O-CD1 3.45Å; N138-I142 WeakPolarHBondContact O-CG1 3.3Å; N138-I142 PolarHBondContact O-N 3.41Å
139	L	94.5	Very high	93.8	Very high	7 Å²	7	18.8 Å²	18.8	4%	0.037	10%	0.095	C	C	.	.	H	α-helix	trans	-64.1	-40.5	175.1	-71	175.1	0	0	0	112.1	L90 S135 T136 I142 S143 M232 I316 F320	L90-L139 HydrophobicContact CD2-CD2 4.36Å; S135-L139 WeakPolarHBondContact O-CG 3.02Å; S135-L139 PolarHBondContact O-N 2.92Å; T136-L139 PolarHBondContact O-N 3.3Å; T136-L139 VanDerWaalsContact O-N 3.11Å; L139-I142 PolarHBondContact O-N 2.86Å; L139-S143 WeakPolarHBondContact O-CB 3.49Å; L139-S143 PolarHBondContact O-N 2.91Å; L139-S143 PolarHBondContact O-OG 3.07Å; L139-M232 HydrophobicContact CB-SD 3.84Å; L139-I316 HydrophobicContact CD2-CG2 3.64Å; L139-F320 HydrophobicContact CD1-CB 3.96Å; L139-F320 HydrophobicContact CD1-CD1 4.41Å; L139-F320 HydrophobicContact CD1-CD2 3.47Å; L139-F320 VanDerWaalsContact CD1-CD2 3.47Å; L139-F320 HydrophobicContact CD1-CE2 4.07Å; L139-F320 HydrophobicContact CD1-CG 3.68Å
140	V	96.4	Very high	93.4	Very high	13 Å²	13	20 Å²	20	8%	0.079	10%	0.099	C	C	.	.	H	α-helix	trans	-61.3	-47.8	172.4	175.1	0	0	0	0	110.7	T136 F137 I142 S143 I144 P228 M231 M232	T136-V140 PolarHBondContact O-N 3.45Å; F137-V140 PolarHBondContact O-N 3.09Å; V140-I142 VanDerWaalsContact C-N 3.34Å; V140-I142 PolarHBondContact O-N 3.3Å; V140-S143 WeakPolarHBondContact O-CB 3.34Å; V140-S143 PolarHBondContact O-N 3.46Å; V140-S143 VanDerWaalsContact O-N 3.09Å; V140-I144 HydrophobicContact CG1-CD1 3.83Å; V140-I144 HydrophobicContact CG1-CG1 4.42Å; V140-I144 WeakPolarHBondContact O-CG1 3.42Å; V140-I144 PolarHBondContact O-N 3.37Å; V140-P228 HydrophobicContact CG2-CB 3.61Å; V140-P228 HydrophobicContact CG2-CG 4.38Å; V140-M231 HydrophobicContact CG1-CB 4.33Å; V140-M231 HydrophobicContact CG1-CE 3.49Å; V140-M231 VanDerWaalsContact CG1-CE 3.49Å; V140-M231 HydrophobicContact CG1-SD 4.02Å; V140-M232 HydrophobicContact CG2-CG 4.18Å; V140-M232 HydrophobicContact CG2-SD 4.48Å
141	A	94.4	Very high	92.9	Very high	12 Å²	12	21.1 Å²	21.1	10%	0.099	11%	0.107	C	C	.	.	H	α-helix	trans	-61	-40.8	178.7	0	0	0	0	0	112.4	F86 F137 N138 S143 I144 E145 V168	F86-A141 HydrophobicContact CD1-CB 4.12Å; F86-A141 HydrophobicContact CE1-CB 3.63Å; F86-A141 HydrophobicContact CZ-CB 4.01Å; F137-A141 WeakPolarHBondContact O-CB 3.28Å; F137-A141 PolarHBondContact O-N 2.94Å; N138-A141 PolarHBondContact O-N 3.4Å; A141-S143 VanDerWaalsContact C-N 3.33Å; A141-I144 PolarHBondContact O-N 3.49Å; A141-E145 WeakPolarHBondContact O-CB 3.39Å; A141-E145 PolarHBondContact O-N 3.22Å; A141-V168 HydrophobicContact CB-CG1 4Å
142	I	93	Very high	92.4	Very high	2 Å²	2	23 Å²	23	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-62.2	-42.1	173.6	-68.7	163	0	0	0	110.5	F86 N138 L139 V140 E145 R146 L313	F86-I142 HydrophobicContact CB-CD1 3.92Å; F86-I142 HydrophobicContact CB-CG1 3.54Å; F86-I142 HydrophobicContact CD2-CG1 4.39Å; F86-I142 HydrophobicContact CG-CG1 4.03Å; N138-I142 WeakPolarHBondContact O-CB 3.14Å; N138-I142 WeakPolarHBondContact O-CD1 3.45Å; N138-I142 WeakPolarHBondContact O-CG1 3.3Å; N138-I142 PolarHBondContact O-N 3.41Å; L139-I142 PolarHBondContact O-N 2.86Å; V140-I142 VanDerWaalsContact C-N 3.34Å; V140-I142 PolarHBondContact O-N 3.3Å; I142-E145 PolarHBondContact O-N 3.33Å; I142-R146 HydrophobicContact CG2-CG 4.4Å; I142-R146 WeakPolarHBondContact O-CB 3.41Å; I142-R146 WeakPolarHBondContact O-CG 3.39Å; I142-R146 PolarHBondContact O-N 2.86Å; I142-L313 HydrophobicContact CG2-CD2 3.73Å
143	S	93.4	Very high	91.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-44.1	179	-55.6	0	0	0	0	111.8	L139 V140 A141 R146 Y147 M232 Y236	L139-S143 WeakPolarHBondContact O-CB 3.49Å; L139-S143 PolarHBondContact O-N 2.91Å; L139-S143 PolarHBondContact O-OG 3.07Å; V140-S143 WeakPolarHBondContact O-CB 3.34Å; V140-S143 PolarHBondContact O-N 3.46Å; V140-S143 VanDerWaalsContact O-N 3.09Å; A141-S143 VanDerWaalsContact C-N 3.33Å; S143-R146 PolarHBondContact O-N 3.47Å; S143-Y147 WeakPolarHBondContact O-CB 3.32Å; S143-Y147 PolarHBondContact O-N 3.26Å; S143-M232 WeakPolarHBondContact OG-CG 3.3Å; S143-Y236 WeakPolarHBondContact CA-OH 3.3Å; S143-Y236 WeakPolarHBondContact OG-CE2 3.43Å; S143-Y236 VanDerWaalsContact OG-CZ 3.29Å; S143-Y236 PolarHBondContact OG-OH 2.66Å
144	I	92.2	Very high	90.8	Very high	47 Å²	47	33 Å²	33	24%	0.241	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-45.1	177	-67.7	172.5	0	0	0	111	V140 A141 R146 Y147 Y148 W159 M231	V140-I144 HydrophobicContact CG1-CD1 3.83Å; V140-I144 HydrophobicContact CG1-CG1 4.42Å; V140-I144 WeakPolarHBondContact O-CG1 3.42Å; V140-I144 PolarHBondContact O-N 3.37Å; A141-I144 PolarHBondContact O-N 3.49Å; I144-R146 PolarHBondContact O-N 2.9Å; I144-Y147 WeakPolarHBondContact O-CB 3.29Å; I144-Y147 PolarHBondContact O-N 3.45Å; I144-Y147 VanDerWaalsContact O-N 3.14Å; I144-Y148 HydrophobicContact CG2-CD2 3.63Å; I144-Y148 HydrophobicContact CG2-CE2 3.56Å; I144-Y148 VanDerWaalsContact O-CD2 3.31Å; I144-Y148 WeakPolarHBondContact O-CD2 3.19Å; I144-Y148 PolarHBondContact O-N 3.12Å; I144-W159 HydrophobicContact CG2-CH2 4.02Å; I144-W159 HydrophobicContact CG2-CZ3 3.69Å; I144-M231 HydrophobicContact CD1-CE 3.82Å
145	E	90.1	Very high	89.8	Confident	15 Å²	15	34.7 Å²	34.7	7%	0.07	19%	0.19	C	C	.	.	H	α-helix	trans	-54.6	-44.1	174.4	-177.6	-103.2	-148.8	0	0	110.7	I82 T83 F86 A141 I142 Y147 Y148 A149 Q160	I82-E145 HydrophobicContact CG2-CG 3.95Å; T83-E145 PolarHBondContact N-OE1 2.57Å; T83-E145 PolarHBondContact OG1-OE1 2.85Å; F86-E145 HydrophobicContact CE2-CB 4.41Å; F86-E145 HydrophobicContact CE2-CG 4.49Å; A141-E145 WeakPolarHBondContact O-CB 3.39Å; A141-E145 PolarHBondContact O-N 3.22Å; I142-E145 PolarHBondContact O-N 3.33Å; E145-Y147 PolarHBondContact O-N 2.95Å; E145-Y148 PolarHBondContact O-N 2.87Å; E145-A149 WeakPolarHBondContact O-CB 3.36Å; E145-A149 PolarHBondContact O-N 3.49Å; E145-Q160 PolarHBondContact O-NE2 3.21Å
146	R	90.6	Very high	89	Confident	44 Å²	44	35.2 Å²	35.2	17%	0.166	19%	0.194	C	C	.	.	H	α-helix	trans	-69.6	-36.5	179.7	-68.7	-75.6	-175.5	-120	8.6	112.6	T83 I142 S143 I144 I150 I239 L313	T83-R146 PolarHBondContact OG1-NH1 3.01Å; T83-R146 PolarHBondContact OG1-NH2 3.36Å; I142-R146 HydrophobicContact CG2-CG 4.4Å; I142-R146 WeakPolarHBondContact O-CB 3.41Å; I142-R146 WeakPolarHBondContact O-CG 3.39Å; I142-R146 PolarHBondContact O-N 2.86Å; S143-R146 PolarHBondContact O-N 3.47Å; I144-R146 PolarHBondContact O-N 2.9Å; R146-I150 WeakPolarHBondContact O-CG1 3.42Å; R146-I150 PolarHBondContact O-N 3.31Å; R146-I239 HydrophobicContact CB-CD1 4.14Å; R146-L313 HydrophobicContact CB-CD1 4.28Å; R146-L313 HydrophobicContact CG-CD1 3.47Å; R146-L313 VanDerWaalsContact CG-CD1 3.47Å
147	Y	91.3	Very high	87.9	Confident	75 Å²	75	42.6 Å²	42.6	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-52.5	175	172	-99.2	0	0	0	111.3	S143 I144 E145 A149 I150 C151 R238 I239	S143-Y147 WeakPolarHBondContact O-CB 3.32Å; S143-Y147 PolarHBondContact O-N 3.26Å; I144-Y147 WeakPolarHBondContact O-CB 3.29Å; I144-Y147 PolarHBondContact O-N 3.45Å; I144-Y147 VanDerWaalsContact O-N 3.14Å; E145-Y147 PolarHBondContact O-N 2.95Å; Y147-A149 PolarHBondContact O-N 3.42Å; Y147-I150 PolarHBondContact O-N 3.38Å; Y147-C151 HydrophobicContact CD2-CB 3.89Å; Y147-C151 HydrophobicContact CE2-CB 3.61Å; Y147-C151 VanDerWaalsContact O-CB 3.31Å; Y147-C151 WeakPolarHBondContact O-CB 3.38Å; Y147-C151 PolarHBondContact O-N 2.91Å; Y147-R238 HydrophobicContact CD2-CB 4.2Å; Y147-R238 HydrophobicContact CE2-CB 3.83Å; Y147-R238 HydrophobicContact CE2-CG 4.4Å; Y147-I239 HydrophobicContact CD2-CG1 4.22Å
148	Y	89.4	Confident	86.7	Confident	71 Å²	71	46.3 Å²	46.3	28%	0.278	26%	0.256	S	S	.	.	H	α-helix	trans	-65.6	-40.9	-178.6	-78.7	-73	0	0	0	112.4	I144 E145 I150 S152 A155 S156 W159	I144-Y148 HydrophobicContact CG2-CD2 3.63Å; I144-Y148 HydrophobicContact CG2-CE2 3.56Å; I144-Y148 VanDerWaalsContact O-CD2 3.31Å; I144-Y148 WeakPolarHBondContact O-CD2 3.19Å; I144-Y148 PolarHBondContact O-N 3.12Å; E145-Y148 PolarHBondContact O-N 2.87Å; Y148-I150 PolarHBondContact O-N 3.08Å; Y148-S152 CarbonylContact O-C 3.54Å; Y148-S152 PolarHBondContact O-N 3.05Å; Y148-A155 HydrophobicContact CD1-CB 4.38Å; Y148-S156 WeakPolarHBondContact O-CB 3.36Å; Y148-W159 AromaticContact CD2-CE3 3.56Å; Y148-W159 HydrophobicContact CD2-CE3 3.56Å; Y148-W159 HydrophobicContact CD2-CH2 4.39Å; Y148-W159 AromaticContact CD2-CZ3 3.3Å; Y148-W159 HydrophobicContact CD2-CZ3 3.3Å; Y148-W159 AromaticContact CE2-CE3 3.63Å; Y148-W159 HydrophobicContact CE2-CE3 3.63Å; Y148-W159 AromaticContact CE2-CH2 3.83Å; Y148-W159 HydrophobicContact CE2-CH2 3.83Å; Y148-W159 AromaticContact CE2-CZ3 3.12Å; Y148-W159 HydrophobicContact CE2-CZ3 3.12Å; Y148-W159 HydrophobicContact CG-CE3 4.05Å; Y148-W159 HydrophobicContact CG-CZ3 4.23Å; Y148-W159 AromaticContact CZ-CZ3 3.96Å
149	A	85.9	Confident	85.5	Confident	37 Å²	37	51.5 Å²	51.5	31%	0.306	28%	0.276	S	S	.	.	H	α-helix	trans	-61.4	-27.9	179.7	0	0	0	0	0	113.5	E145 Y147	E145-A149 WeakPolarHBondContact O-CB 3.36Å; E145-A149 PolarHBondContact O-N 3.49Å; Y147-A149 PolarHBondContact O-N 3.42Å
150	I	85.4	Confident	84.6	Confident	34 Å²	34	53.1 Å²	53.1	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-109.6	-44.9	-172.3	-58.8	177.4	0	0	0	112.2	R146 Y147 Y148 I239 N306 I310	R146-I150 WeakPolarHBondContact O-CG1 3.42Å; R146-I150 PolarHBondContact O-N 3.31Å; Y147-I150 PolarHBondContact O-N 3.38Å; Y148-I150 PolarHBondContact O-N 3.08Å; I150-I239 HydrophobicContact CD1-CG2 4.14Å; I150-I239 HydrophobicContact CG2-CG2 4.42Å; I150-N306 HydrophobicContact CD1-CB 4.46Å; I150-I310 HydrophobicContact CD1-CD1 3.7Å; I150-I310 HydrophobicContact CD1-CG1 3.9Å
151	C	86.7	Confident	84.1	Confident	28 Å²	28	55.6 Å²	55.6	19%	0.189	30%	0.298	C	S	.	.	H	α-helix	trans	-88.7	-25.9	-174.6	-64	0	0	0	0	113	Y147	Y147-C151 HydrophobicContact CD2-CB 3.89Å; Y147-C151 HydrophobicContact CE2-CB 3.61Å; Y147-C151 VanDerWaalsContact O-CB 3.31Å; Y147-C151 WeakPolarHBondContact O-CB 3.38Å; Y147-C151 PolarHBondContact O-N 2.91Å
152	S	83.8	Confident	83.6	Confident	40 Å²	40	59.9 Å²	59.9	28%	0.28	32%	0.315	S	S	.	.			trans	-138.1	67.3	-176.9	-169.2	0	0	0	0	112.2	Y148 L154 A155 S156	Y148-S152 CarbonylContact O-C 3.54Å; Y148-S152 PolarHBondContact O-N 3.05Å; S152-L154 VanDerWaalsContact C-N 3.33Å; S152-L154 PolarHBondContact O-N 3.45Å; S152-A155 PolarHBondContact O-N 3.41Å; S152-A155 WeakPolarHBondContact OG-CB 3.35Å; S152-S156 PolarHBondContact O-N 3.31Å
153	P	79.8	Confident	83.3	Confident	76 Å²	76	63.2 Å²	63.2	49%	0.494	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-36.7	-171.5	23.7	-33.9	0	0	0	113.5	S156 M157	P153-S156 WeakPolarHBondContact O-CB 3.18Å; P153-S156 PolarHBondContact O-N 2.94Å; P153-S156 PolarHBondContact O-OG 2.96Å; P153-M157 PolarHBondContact O-N 3.46Å
154	L	78.6	Confident	83	Confident	145 Å²	145	66 Å²	66	76%	0.759	35%	0.351	S	S	*	.	H	α-helix	trans	-66.3	-43.2	179	-64.4	174.1	0	0	0	112.1	S152 S156 M157	S152-L154 VanDerWaalsContact C-N 3.33Å; S152-L154 PolarHBondContact O-N 3.45Å; L154-S156 VanDerWaalsContact C-N 3.27Å; L154-S156 PolarHBondContact O-N 3.23Å; L154-M157 PolarHBondContact O-N 3.09Å
155	A	76.2	Confident	82.9	Confident	35 Å²	35	63.9 Å²	63.9	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-67.5	-29.4	173.4	0	0	0	0	0	112.3	Y148 S152 M157 T158 W159	Y148-A155 HydrophobicContact CD1-CB 4.38Å; S152-A155 PolarHBondContact O-N 3.41Å; S152-A155 WeakPolarHBondContact OG-CB 3.35Å; A155-M157 VanDerWaalsContact C-N 3.25Å; A155-M157 PolarHBondContact O-N 2.88Å; A155-T158 PolarHBondContact O-N 3.17Å; A155-T158 PolarHBondContact O-OG1 3.08Å; A155-T158 VanDerWaalsContact O-OG1 3.05Å; A155-W159 WeakPolarHBondContact O-CB 3.32Å; A155-W159 PolarHBondContact O-N 3.24Å
156	S	77.9	Confident	83	Confident	18 Å²	18	69.1 Å²	69.1	13%	0.126	36%	0.363	C	S	.	.	H	α-helix	trans	-63.8	-32	177.9	83.7	0	0	0	0	112.3	Y148 S152 P153 L154 T158 Q160	Y148-S156 WeakPolarHBondContact O-CB 3.36Å; S152-S156 PolarHBondContact O-N 3.31Å; P153-S156 WeakPolarHBondContact O-CB 3.18Å; P153-S156 PolarHBondContact O-N 2.94Å; P153-S156 PolarHBondContact O-OG 2.96Å; L154-S156 VanDerWaalsContact C-N 3.27Å; L154-S156 PolarHBondContact O-N 3.23Å; S156-T158 VanDerWaalsContact C-N 3.32Å; S156-T158 PolarHBondContact O-N 3.14Å; S156-Q160 WeakPolarHBondContact O-CA 3.23Å; S156-Q160 WeakPolarHBondContact O-CB 3.39Å; S156-Q160 PolarHBondContact O-N 3.41Å
157	M	73.3	Confident	83.1	Confident	155 Å²	155	74 Å²	74	76%	0.764	39%	0.385	S	S	*	.	H	α-helix	trans	-68.5	-30.4	-179.2	-63	-167.5	76	0	0	113	P153 L154 A155	P153-M157 PolarHBondContact O-N 3.46Å; L154-M157 PolarHBondContact O-N 3.09Å; A155-M157 VanDerWaalsContact C-N 3.25Å; A155-M157 PolarHBondContact O-N 2.88Å
158	T	72.2	Confident	83.2	Confident	117 Å²	117	72 Å²	72	72%	0.718	38%	0.381	S	S	*	.	H	α-helix	trans	-89.3	-35.1	177.4	54.1	0	0	0	0	112.3	A155 S156	A155-T158 PolarHBondContact O-N 3.17Å; A155-T158 PolarHBondContact O-OG1 3.08Å; A155-T158 VanDerWaalsContact O-OG1 3.05Å; S156-T158 VanDerWaalsContact C-N 3.32Å; S156-T158 PolarHBondContact O-N 3.14Å
159	W	70.6	Confident	83.5	Confident	109 Å²	109	69.8 Å²	69.8	41%	0.413	37%	0.374	S	S	.	.	H	α-helix	trans	-94.2	-30	-171.6	-152.2	57.3	0	0	0	114.1	I144 Y148 A155 T161 H164	I144-W159 HydrophobicContact CG2-CH2 4.02Å; I144-W159 HydrophobicContact CG2-CZ3 3.69Å; Y148-W159 AromaticContact CD2-CE3 3.56Å; Y148-W159 HydrophobicContact CD2-CE3 3.56Å; Y148-W159 HydrophobicContact CD2-CH2 4.39Å; Y148-W159 AromaticContact CD2-CZ3 3.3Å; Y148-W159 HydrophobicContact CD2-CZ3 3.3Å; Y148-W159 AromaticContact CE2-CE3 3.63Å; Y148-W159 HydrophobicContact CE2-CE3 3.63Å; Y148-W159 AromaticContact CE2-CH2 3.83Å; Y148-W159 HydrophobicContact CE2-CH2 3.83Å; Y148-W159 AromaticContact CE2-CZ3 3.12Å; Y148-W159 HydrophobicContact CE2-CZ3 3.12Å; Y148-W159 HydrophobicContact CG-CE3 4.05Å; Y148-W159 HydrophobicContact CG-CZ3 4.23Å; Y148-W159 AromaticContact CZ-CZ3 3.96Å; A155-W159 WeakPolarHBondContact O-CB 3.32Å; A155-W159 PolarHBondContact O-N 3.24Å; W159-T161 PolarHBondContact O-N 2.95Å; W159-T161 VanDerWaalsContact O-N 3.16Å; W159-H164 AromaticContact CE2-CE1 3.83Å; W159-H164 AromaticContact CZ2-CE1 3.94Å; W159-H164 AromaticContact NE1-NE2 3.92Å; W159-H164 PolarHBondContact O-ND1 3.24Å
160	Q	75.8	Confident	84	Confident	42 Å²	42	72.2 Å²	72.2	20%	0.196	39%	0.385	C	S	.	.			trans	-92.1	72.7	-176.8	-59.3	-166.8	-16	0	0	112.3	I82 E145 S156	I82-Q160 HydrophobicContact CD1-CB 3.73Å; I82-Q160 WeakPolarHBondContact CD1-O 3.47Å; E145-Q160 PolarHBondContact O-NE2 3.21Å; S156-Q160 WeakPolarHBondContact O-CA 3.23Å; S156-Q160 WeakPolarHBondContact O-CB 3.39Å; S156-Q160 PolarHBondContact O-N 3.41Å
161	T	84.7	Confident	84.5	Confident	64 Å²	64	73.5 Å²	73.5	39%	0.393	40%	0.397	S	S	.	.			trans	-101.8	154.9	169.7	71.2	0	0	0	0	111.6	W159 S163 H164 A165	W159-T161 PolarHBondContact O-N 2.95Å; W159-T161 VanDerWaalsContact O-N 3.16Å; T161-S163 PolarHBondContact O-N 3.03Å; T161-H164 PolarHBondContact O-N 2.71Å; T161-H164 WeakPolarHBondContact OG1-CB 3.46Å; T161-H164 PolarHBondContact OG1-N 2.88Å; T161-H164 VanDerWaalsContact OG1-N 3.12Å; T161-A165 PolarHBondContact O-N 2.85Å
162	K	84	Confident	85	Confident	102 Å²	102	72.6 Å²	72.6	44%	0.443	39%	0.391	S	S	.	.	H	α-helix	trans	-63.3	-28.5	174.5	-59.3	-175.9	-164.2	-172.8	0	112.3	K80 I82 L85 K166	K80-K162 WeakPolarHBondContact O-CE 3Å; K80-K162 PolarHBondContact O-NZ 3.04Å; I82-K162 HydrophobicContact CG1-CG 4.25Å; L85-K162 HydrophobicContact CD1-CB 4.48Å; K162-K166 WeakPolarHBondContact O-CG 3.39Å; K162-K166 PolarHBondContact O-N 3.31Å
163	S	87.2	Confident	85.7	Confident	72 Å²	72	73.9 Å²	73.9	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-67.5	-48.3	175.1	-175	0	0	0	0	110.5	T161 A165 K166 K167	T161-S163 PolarHBondContact O-N 3.03Å; S163-A165 VanDerWaalsContact C-N 3.35Å; S163-A165 PolarHBondContact O-N 3.37Å; S163-K166 PolarHBondContact O-N 3.24Å; S163-K167 WeakPolarHBondContact O-CG 3.24Å; S163-K167 PolarHBondContact O-N 2.84Å
164	H	88.4	Confident	86.6	Confident	60 Å²	60	74 Å²	74	28%	0.278	39%	0.388	S	S	.	.	H	α-helix	trans	-57.9	-47.2	175.4	-174.8	-103.3	0	0	0	111.5	W159 T161 K166 K167 V168	W159-H164 AromaticContact CE2-CE1 3.83Å; W159-H164 AromaticContact CZ2-CE1 3.94Å; W159-H164 AromaticContact NE1-NE2 3.92Å; W159-H164 PolarHBondContact O-ND1 3.24Å; T161-H164 PolarHBondContact O-N 2.71Å; T161-H164 WeakPolarHBondContact OG1-CB 3.46Å; T161-H164 PolarHBondContact OG1-N 2.88Å; T161-H164 VanDerWaalsContact OG1-N 3.12Å; H164-K166 VanDerWaalsContact C-N 3.32Å; H164-K166 PolarHBondContact O-N 3.43Å; H164-K167 WeakPolarHBondContact O-CB 3.41Å; H164-K167 PolarHBondContact O-N 2.9Å; H164-V168 WeakPolarHBondContact O-CG2 3.15Å; H164-V168 PolarHBondContact O-N 3.28Å
165	A	89.8	Confident	87.5	Confident	2 Å²	2	70.6 Å²	70.6	2%	0.017	37%	0.374	C	S	.	.	H	α-helix	trans	-56.9	-42.1	177.4	0	0	0	0	0	113.3	I82 L85 F86 T161 S163 V168 I169	I82-A165 HydrophobicContact CB-CB 4.46Å; I82-A165 HydrophobicContact CG1-CB 4.33Å; I82-A165 HydrophobicContact CG2-CB 3.69Å; L85-A165 HydrophobicContact CD1-CB 4.13Å; F86-A165 HydrophobicContact CE2-CB 4.28Å; F86-A165 HydrophobicContact CZ-CB 4.24Å; T161-A165 PolarHBondContact O-N 2.85Å; S163-A165 VanDerWaalsContact C-N 3.35Å; S163-A165 PolarHBondContact O-N 3.37Å; A165-V168 PolarHBondContact O-N 3.24Å; A165-I169 VanDerWaalsContact O-CG1 3.32Å; A165-I169 WeakPolarHBondContact O-CG1 3.24Å; A165-I169 PolarHBondContact O-N 2.64Å
166	K	90.7	Very high	88.5	Confident	126 Å²	126	69 Å²	69	55%	0.548	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-39.1	175.2	-72.3	176.8	-176.2	-177.9	0	112.5	L85 K162 S163 H164 I169 T170	L85-K166 HydrophobicContact CD1-CG 4.31Å; K162-K166 WeakPolarHBondContact O-CG 3.39Å; K162-K166 PolarHBondContact O-N 3.31Å; S163-K166 PolarHBondContact O-N 3.24Å; H164-K166 VanDerWaalsContact C-N 3.32Å; H164-K166 PolarHBondContact O-N 3.43Å; K166-I169 PolarHBondContact O-N 3.4Å; K166-T170 WeakPolarHBondContact O-CB 3.45Å; K166-T170 PolarHBondContact O-N 2.98Å; K166-T170 PolarHBondContact O-OG1 3.12Å
167	K	93	Very high	89.5	Confident	145 Å²	145	69.7 Å²	69.7	63%	0.63	37%	0.365	S	S	*	.	H	α-helix	trans	-62.5	-46.4	174.7	-70	-178.4	-179.8	-173.5	0	110.8	S163 H164 T170 S171	S163-K167 WeakPolarHBondContact O-CG 3.24Å; S163-K167 PolarHBondContact O-N 2.84Å; H164-K167 WeakPolarHBondContact O-CB 3.41Å; H164-K167 PolarHBondContact O-N 2.9Å; K167-T170 PolarHBondContact O-N 2.98Å; K167-S171 WeakPolarHBondContact O-CB 3.34Å; K167-S171 PolarHBondContact O-N 2.86Å; K167-S171 PolarHBondContact O-OG 3.42Å
168	V	94.4	Very high	90.6	Very high	34 Å²	34	67.3 Å²	67.3	21%	0.206	36%	0.355	C	S	.	.	H	α-helix	trans	-57.4	-52.5	175.1	175.7	0	0	0	0	110.1	F86 A141 H164 A165 T170 S171 T172	F86-V168 HydrophobicContact CE1-CB 4.3Å; F86-V168 HydrophobicContact CE1-CG1 3.89Å; F86-V168 HydrophobicContact CZ-CB 4.37Å; F86-V168 HydrophobicContact CZ-CG1 4.19Å; A141-V168 HydrophobicContact CB-CG1 4Å; H164-V168 WeakPolarHBondContact O-CG2 3.15Å; H164-V168 PolarHBondContact O-N 3.28Å; A165-V168 PolarHBondContact O-N 3.24Å; V168-T170 PolarHBondContact O-N 3.11Å; V168-S171 WeakPolarHBondContact CA-OG 3.38Å; V168-S171 PolarHBondContact O-N 3.4Å; V168-S171 VanDerWaalsContact O-N 3.13Å; V168-S171 PolarHBondContact O-OG 3.06Å; V168-T172 HydrophobicContact CG1-CG2 4.35Å; V168-T172 WeakPolarHBondContact O-CG2 3.49Å; V168-T172 PolarHBondContact O-N 3.3Å
169	I	95.4	Very high	91.8	Very high	25 Å²	25	63.8 Å²	63.8	13%	0.128	33%	0.331	C	S	.	.	H	α-helix	trans	-55.7	-51.9	178.1	-69.1	164.9	0	0	0	110.6	L85 F86 A165 K166 S171 T172 W173	L85-I169 HydrophobicContact CB-CD1 3.76Å; F86-I169 HydrophobicContact CD1-CD1 4.03Å; F86-I169 HydrophobicContact CD1-CG1 3.71Å; F86-I169 HydrophobicContact CE1-CD1 4.31Å; F86-I169 HydrophobicContact CE1-CG1 3.75Å; A165-I169 VanDerWaalsContact O-CG1 3.32Å; A165-I169 WeakPolarHBondContact O-CG1 3.24Å; A165-I169 PolarHBondContact O-N 2.64Å; K166-I169 PolarHBondContact O-N 3.4Å; I169-S171 VanDerWaalsContact C-N 3.28Å; I169-S171 PolarHBondContact O-N 2.87Å; I169-T172 PolarHBondContact O-N 3.18Å; I169-T172 PolarHBondContact O-OG1 3.25Å; I169-W173 VanDerWaalsContact O-CD1 3.26Å; I169-W173 PolarHBondContact O-N 3.41Å; I169-W173 VanDerWaalsContact O-N 3.1Å
170	T	96.3	Very high	93.1	Very high	87 Å²	87	58.7 Å²	58.7	53%	0.534	31%	0.312	S	S	.	.	H	α-helix	trans	-56.5	-43.6	179.2	-51.6	0	0	0	0	111.4	K166 K167 V168 T172 W173 V174	K166-T170 WeakPolarHBondContact O-CB 3.45Å; K166-T170 PolarHBondContact O-N 2.98Å; K166-T170 PolarHBondContact O-OG1 3.12Å; K167-T170 PolarHBondContact O-N 2.98Å; V168-T170 PolarHBondContact O-N 3.11Å; T170-T172 PolarHBondContact O-N 3.3Å; T170-W173 PolarHBondContact O-N 3.4Å; T170-V174 WeakPolarHBondContact O-CG2 3.32Å; T170-V174 PolarHBondContact O-N 2.94Å
171	S	96.3	Very high	94	Very high	61 Å²	61	60.7 Å²	60.7	43%	0.427	32%	0.323	S	S	.	.	H	α-helix	trans	-63.1	-40	176.1	72.2	0	0	0	0	112.5	K167 V168 I169 W173 V174 V175	K167-S171 WeakPolarHBondContact O-CB 3.34Å; K167-S171 PolarHBondContact O-N 2.86Å; K167-S171 PolarHBondContact O-OG 3.42Å; V168-S171 WeakPolarHBondContact CA-OG 3.38Å; V168-S171 PolarHBondContact O-N 3.4Å; V168-S171 VanDerWaalsContact O-N 3.13Å; V168-S171 PolarHBondContact O-OG 3.06Å; I169-S171 VanDerWaalsContact C-N 3.28Å; I169-S171 PolarHBondContact O-N 2.87Å; S171-W173 VanDerWaalsContact C-N 3.33Å; S171-W173 PolarHBondContact O-N 2.93Å; S171-V174 PolarHBondContact O-N 3.02Å; S171-V175 WeakPolarHBondContact O-CB 3.47Å; S171-V175 VanDerWaalsContact O-CG2 3.28Å; S171-V175 WeakPolarHBondContact O-CG2 3.43Å; S171-V175 PolarHBondContact O-N 3.08Å
172	T	96.8	Very high	94.6	Very high	10 Å²	10	59 Å²	59	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-62.3	-40	177.6	60.8	0	0	0	0	112	F137 V168 I169 T170 S176	F137-T172 HydrophobicContact CB-CG2 3.71Å; V168-T172 HydrophobicContact CG1-CG2 4.35Å; V168-T172 WeakPolarHBondContact O-CG2 3.49Å; V168-T172 PolarHBondContact O-N 3.3Å; I169-T172 PolarHBondContact O-N 3.18Å; I169-T172 PolarHBondContact O-OG1 3.25Å; T170-T172 PolarHBondContact O-N 3.3Å; T172-S176 WeakPolarHBondContact O-CB 3.32Å; T172-S176 PolarHBondContact O-N 3.48Å; T172-S176 PolarHBondContact O-OG 3.35Å
173	W	98.1	Very high	95.1	Very high	67 Å²	67	55.7 Å²	55.7	25%	0.254	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-45.3	175.9	-79.7	89.8	0	0	0	112.1	S89 V92 V134 I169 T170 S171 S177	S89-W173 PolarHBondContact OG-NE1 3.01Å; V92-W173 HydrophobicContact CB-CZ2 4.26Å; V92-W173 HydrophobicContact CG1-CH2 3.84Å; V92-W173 HydrophobicContact CG1-CZ2 3.8Å; V134-W173 HydrophobicContact CG1-CD2 4.17Å; V134-W173 HydrophobicContact CG1-CH2 4.45Å; V134-W173 HydrophobicContact CG1-CZ2 3.89Å; V134-W173 HydrophobicContact CG2-CD2 3.97Å; V134-W173 HydrophobicContact CG2-CE3 3.99Å; V134-W173 HydrophobicContact CG2-CG 4.33Å; V134-W173 HydrophobicContact CG2-CZ3 4.39Å; I169-W173 VanDerWaalsContact O-CD1 3.26Å; I169-W173 PolarHBondContact O-N 3.41Å; I169-W173 VanDerWaalsContact O-N 3.1Å; T170-W173 PolarHBondContact O-N 3.4Å; S171-W173 VanDerWaalsContact C-N 3.33Å; S171-W173 PolarHBondContact O-N 2.93Å; W173-S177 WeakPolarHBondContact O-CB 2.98Å; W173-S177 PolarHBondContact O-N 3.27Å; W173-S177 PolarHBondContact O-OG 3.45Å
174	V	98.2	Very high	95.5	Very high	77 Å²	77	53.8 Å²	53.8	47%	0.467	29%	0.285	S	S	.	.	H	α-helix	trans	-64.4	-51.2	179.3	171.7	0	0	0	0	111	T170 S171 S176 S177 I178	T170-V174 WeakPolarHBondContact O-CG2 3.32Å; T170-V174 PolarHBondContact O-N 2.94Å; S171-V174 PolarHBondContact O-N 3.02Å; V174-S176 VanDerWaalsContact C-N 3.33Å; V174-S176 PolarHBondContact O-N 3.06Å; V174-S177 PolarHBondContact O-N 2.86Å; V174-I178 HydrophobicContact CG1-CD1 3.72Å; V174-I178 WeakPolarHBondContact O-CG1 3.4Å; V174-I178 PolarHBondContact O-N 2.97Å
175	V	97.6	Very high	95.8	Very high	75 Å²	75	57.2 Å²	57.2	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-60.5	-43.4	179	172.2	0	0	0	0	111	F137 S171 S177 I178 L179	F137-V175 HydrophobicContact CE2-CG1 4.07Å; S171-V175 WeakPolarHBondContact O-CB 3.47Å; S171-V175 VanDerWaalsContact O-CG2 3.28Å; S171-V175 WeakPolarHBondContact O-CG2 3.43Å; S171-V175 PolarHBondContact O-N 3.08Å; V175-S177 PolarHBondContact O-N 3.23Å; V175-I178 PolarHBondContact O-N 3.1Å; V175-L179 WeakPolarHBondContact O-CB 3.42Å; V175-L179 PolarHBondContact O-N 3.35Å
176	S	98.3	Very high	95.9	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-40.1	177.5	-62	0	0	0	0	112.7	S133 V134 F137 T172 V174 M180	S133-S176 WeakPolarHBondContact CB-OG 3.4Å; V134-S176 VanDerWaalsContact CG2-CB 3.47Å; V134-S176 WeakPolarHBondContact CG2-OG 3.09Å; V134-S176 PolarHBondContact N-OG 2.85Å; F137-S176 WeakPolarHBondContact CD2-OG 3.22Å; T172-S176 WeakPolarHBondContact O-CB 3.32Å; T172-S176 PolarHBondContact O-N 3.48Å; T172-S176 PolarHBondContact O-OG 3.35Å; V174-S176 VanDerWaalsContact C-N 3.33Å; V174-S176 PolarHBondContact O-N 3.06Å; S176-M180 WeakPolarHBondContact O-CB 3.47Å; S176-M180 WeakPolarHBondContact O-CG 3.25Å; S176-M180 PolarHBondContact O-N 3.48Å
177	S	97.5	Very high	96.1	Very high	34 Å²	34	52 Å²	52	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-46.9	177.2	-60.1	0	0	0	0	110.9	Y126 W173 V174 V175 M180 L181	Y126-S177 WeakPolarHBondContact OH-CB 3.42Å; Y126-S177 PolarHBondContact OH-O 2.71Å; W173-S177 WeakPolarHBondContact O-CB 2.98Å; W173-S177 PolarHBondContact O-N 3.27Å; W173-S177 PolarHBondContact O-OG 3.45Å; V174-S177 PolarHBondContact O-N 2.86Å; V175-S177 PolarHBondContact O-N 3.23Å; S177-M180 PolarHBondContact O-N 3.31Å; S177-L181 WeakPolarHBondContact O-CG 3.41Å; S177-L181 PolarHBondContact O-N 2.8Å
178	I	97.9	Very high	96.1	Very high	105 Å²	105	47.6 Å²	47.6	54%	0.538	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-47.3	177.9	-66.7	168.1	0	0	0	111	V174 V175 M180 L181	V174-I178 HydrophobicContact CG1-CD1 3.72Å; V174-I178 WeakPolarHBondContact O-CG1 3.4Å; V174-I178 PolarHBondContact O-N 2.97Å; V175-I178 PolarHBondContact O-N 3.1Å; I178-M180 PolarHBondContact O-N 2.95Å; I178-M180 VanDerWaalsContact O-N 3.13Å; I178-L181 WeakPolarHBondContact O-CB 3.44Å; I178-L181 WeakPolarHBondContact O-CG 3.47Å; I178-L181 PolarHBondContact O-N 3.11Å
179	L	96.9	Very high	96.1	Very high	43 Å²	43	47.8 Å²	47.8	23%	0.225	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-28.4	179.9	-177.8	65.5	0	0	0	112.1	F137 V175 W216 V223 L224	F137-L179 HydrophobicContact CE2-CD2 4.49Å; F137-L179 HydrophobicContact CZ-CD2 4.31Å; V175-L179 WeakPolarHBondContact O-CB 3.42Å; V175-L179 PolarHBondContact O-N 3.35Å; L179-W216 WeakPolarHBondContact O-CH2 3.45Å; L179-W216 WeakPolarHBondContact O-CZ2 3.23Å; L179-V223 HydrophobicContact CD2-CG1 4Å; L179-L224 HydrophobicContact CD2-CD1 4.46Å; L179-L224 HydrophobicContact CD2-CD2 3.89Å; L179-L224 HydrophobicContact CD2-CG 4.29Å
180	M	96.9	Very high	95.9	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	0.9	-174.6	-64.7	-72.6	128.6	0	0	113.9	Y126 G129 V130 S133 S176 S177 I178 P182 Y183 P184 L220 L224	Y126-M180 HydrophobicContact CD2-CB 4.08Å; Y126-M180 WeakPolarHBondContact CD2-O 3.35Å; Y126-M180 HydrophobicContact CE2-CB 3.98Å; G129-M180 WeakPolarHBondContact CA-SD 3.38Å; V130-M180 HydrophobicContact CG2-CB 3.69Å; V130-M180 HydrophobicContact CG2-CG 4.06Å; S133-M180 WeakPolarHBondContact OG-CE 3.3Å; S176-M180 WeakPolarHBondContact O-CB 3.47Å; S176-M180 WeakPolarHBondContact O-CG 3.25Å; S176-M180 PolarHBondContact O-N 3.48Å; S177-M180 PolarHBondContact O-N 3.31Å; I178-M180 PolarHBondContact O-N 2.95Å; I178-M180 VanDerWaalsContact O-N 3.13Å; M180-P182 VanDerWaalsContact C-CD 3.4Å; M180-P182 VanDerWaalsContact C-N 3.31Å; M180-Y183 WeakPolarHBondContact O-CB 3.3Å; M180-Y183 PolarHBondContact O-N 3.03Å; M180-Y183 VanDerWaalsContact O-N 3.12Å; M180-Y183 HydrophobicContact SD-CD2 3.99Å; M180-Y183 HydrophobicContact SD-CE2 3.74Å; M180-P184 WeakPolarHBondContact O-CD 3.38Å; M180-L220 HydrophobicContact CE-CD1 4.48Å; M180-L220 HydrophobicContact CE-CD2 3.38Å; M180-L224 HydrophobicContact CE-CD1 3.76Å
181	L	96.4	Very high	95.7	Very high	84 Å²	84	48.9 Å²	48.9	44%	0.44	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-32.3	180	-70.2	175.8	0	0	0	115.4	Y126 S177 I178 Y183 P184	Y126-L181 HydrophobicContact CE2-CD2 4.23Å; S177-L181 WeakPolarHBondContact O-CG 3.41Å; S177-L181 PolarHBondContact O-N 2.8Å; I178-L181 WeakPolarHBondContact O-CB 3.44Å; I178-L181 WeakPolarHBondContact O-CG 3.47Å; I178-L181 PolarHBondContact O-N 3.11Å; L181-Y183 PolarHBondContact O-N 2.96Å; L181-P184 WeakPolarHBondContact O-CD 3.49Å; L181-P184 VanDerWaalsContact O-CG 3.28Å; L181-P184 WeakPolarHBondContact O-CG 3.41Å
182	P	95.8	Very high	95.3	Very high	30 Å²	30	49 Å²	49	20%	0.195	27%	0.268	C	S	.	.	H	α-helix	trans	-66.9	-20.6	178.4	-29.8	42.3	0	0	0	114.9	M180 S186 W207 W216	M180-P182 VanDerWaalsContact C-CD 3.4Å; M180-P182 VanDerWaalsContact C-N 3.31Å; P182-S186 VanDerWaalsContact O-CB 3.3Å; P182-S186 WeakPolarHBondContact O-CB 3.41Å; P182-S186 PolarHBondContact O-N 3.48Å; P182-S186 PolarHBondContact O-OG 3.24Å; P182-W207 HydrophobicContact CB-CH2 3.98Å; P182-W207 HydrophobicContact CB-CZ3 3.91Å; P182-W216 HydrophobicContact CB-CH2 3.9Å; P182-W216 HydrophobicContact CB-CZ2 3.99Å; P182-W216 HydrophobicContact CB-CZ3 4.26Å; P182-W216 HydrophobicContact CG-CH2 3.36Å; P182-W216 HydrophobicContact CG-CZ2 3.94Å; P182-W216 HydrophobicContact CG-CZ3 3.71Å
183	Y	94.2	Very high	95	Very high	32 Å²	32	53.3 Å²	53.3	13%	0.125	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-58.1	178	-83.1	-106.2	0	0	0	113	M125 M180 L181 I185 S186 S187 L205 W216 L220	M125-Y183 HydrophobicContact CB-CD1 4.27Å; M180-Y183 WeakPolarHBondContact O-CB 3.3Å; M180-Y183 PolarHBondContact O-N 3.03Å; M180-Y183 VanDerWaalsContact O-N 3.12Å; M180-Y183 HydrophobicContact SD-CD2 3.99Å; M180-Y183 HydrophobicContact SD-CE2 3.74Å; L181-Y183 PolarHBondContact O-N 2.96Å; Y183-I185 PolarHBondContact O-N 3.4Å; Y183-S186 PolarHBondContact O-N 3.02Å; Y183-S187 VanDerWaalsContact O-CB 3.28Å; Y183-S187 WeakPolarHBondContact O-CB 3.32Å; Y183-S187 PolarHBondContact O-N 2.84Å; Y183-S187 PolarHBondContact O-OG 3.12Å; Y183-L205 HydrophobicContact CD1-CD1 4.39Å; Y183-L205 HydrophobicContact CD1-CD2 4.23Å; Y183-L205 HydrophobicContact CE1-CD2 4.01Å; Y183-W216 HydrophobicContact CD2-CZ2 4.1Å; Y183-W216 AromaticContact CE2-CE2 3.89Å; Y183-W216 AromaticContact CE2-CZ2 3.87Å; Y183-W216 HydrophobicContact CE2-CZ2 3.87Å; Y183-W216 AromaticContact CE2-NE1 3.3Å; Y183-W216 VanDerWaalsContact CE2-NE1 3.3Å; Y183-W216 AromaticContact CZ-NE1 3.89Å; Y183-L220 HydrophobicContact CE2-CD1 4.01Å; Y183-L220 WeakPolarHBondContact OH-CD1 3.39Å
184	P	95.6	Very high	94.4	Very high	32 Å²	32	53.4 Å²	53.4	21%	0.208	29%	0.294	C	S	.	.	H	α-helix	trans	-65.1	-24.7	-179.5	24.4	-35.1	0	0	0	112.9	K122 Y126 M180 L181	K122-P184 HydrophobicContact CB-CB 4.14Å; K122-P184 VanDerWaalsContact CD-O 3.3Å; K122-P184 WeakPolarHBondContact CD-O 3.44Å; K122-P184 WeakPolarHBondContact CG-O 3.39Å; K122-P184 PolarHBondContact NZ-O 3.38Å; Y126-P184 HydrophobicContact CD2-CG 3.77Å; Y126-P184 HydrophobicContact CE2-CG 4.46Å; Y126-P184 HydrophobicContact CG-CG 4.1Å; M180-P184 WeakPolarHBondContact O-CD 3.38Å; L181-P184 WeakPolarHBondContact O-CD 3.49Å; L181-P184 VanDerWaalsContact O-CG 3.28Å; L181-P184 WeakPolarHBondContact O-CG 3.41Å
185	I	94.9	Very high	93.8	Very high	132 Å²	132	56 Å²	56	68%	0.677	31%	0.312	S	S	*	.	H	α-helix	trans	-69.3	-48.6	174.6	-60.9	171.2	0	0	0	109.8	Y183	Y183-I185 PolarHBondContact O-N 3.4Å
186	S	93.5	Very high	93.3	Very high	18 Å²	18	57.5 Å²	57.5	13%	0.126	32%	0.318	C	S	.	.	H	α-helix	trans	-90.1	-15.1	-170.1	-50.3	0	0	0	0	114	P182 Y183 I206 W207	P182-S186 VanDerWaalsContact O-CB 3.3Å; P182-S186 WeakPolarHBondContact O-CB 3.41Å; P182-S186 PolarHBondContact O-N 3.48Å; P182-S186 PolarHBondContact O-OG 3.24Å; Y183-S186 PolarHBondContact O-N 3.02Å; S186-I206 WeakPolarHBondContact CB-O 3.15Å; S186-I206 PolarHBondContact O-N 2.82Å; S186-W207 WeakPolarHBondContact OG-CZ3 3.41Å
187	S	94.1	Very high	92.8	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	128.6	175.9	60.9	0	0	0	0	110.6	K122 Y183 R204	K122-S187 WeakPolarHBondContact CA-OG 3.2Å; K122-S187 WeakPolarHBondContact CG-OG 3.12Å; K122-S187 PolarHBondContact NZ-O 3.04Å; Y183-S187 VanDerWaalsContact O-CB 3.28Å; Y183-S187 WeakPolarHBondContact O-CB 3.32Å; Y183-S187 PolarHBondContact O-N 2.84Å; Y183-S187 PolarHBondContact O-OG 3.12Å; S187-R204 WeakPolarHBondContact CA-O 3.34Å
188	T	93.4	Very high	92.4	Very high	52 Å²	52	64.3 Å²	64.3	32%	0.319	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	163.9	178.6	-166.5	0	0	0	0	111.3	I190 R204 I206	T188-I190 HydrophobicContact CG2-CG1 4.15Å; T188-R204 PolarHBondContact N-O 3.16Å; T188-R204 PolarHBondContact O-N 3.36Å; T188-I206 HydrophobicContact CG2-CD1 3.33Å; T188-I206 HydrophobicContact CG2-CG1 3.85Å
189	L	93.6	Very high	92.1	Very high	38 Å²	38	63.5 Å²	63.5	20%	0.199	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.5	177	-164.3	70.6	0	0	0	108.6	F114 L118 H201 C203	F114-L189 HydrophobicContact CB-CD1 4.09Å; F114-L189 HydrophobicContact CD1-CD1 3.68Å; F114-L189 HydrophobicContact CG-CD1 4.16Å; L118-L189 HydrophobicContact CD1-CB 4.3Å; L189-H201 HydrophobicContact CD1-CB 3.84Å; L189-H201 HydrophobicContact CD2-CB 3.88Å; L189-H201 HydrophobicContact CG-CB 3.8Å; L189-C203 HydrophobicContact CD1-CB 4.5Å
190	I	91	Very high	91.7	Very high	54 Å²	54	61.4 Å²	61.4	28%	0.277	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.9	-180	-53	177.7	0	0	0	108.6	T188 H201 M202 R204 I206	T188-I190 HydrophobicContact CG2-CG1 4.15Å; I190-H201 WeakPolarHBondContact O-CA 3.28Å; I190-M202 HydrophobicContact CB-CG 4.06Å; I190-M202 PolarHBondContact N-O 2.94Å; I190-M202 PolarHBondContact O-N 3.45Å; I190-R204 HydrophobicContact CD1-CB 3.83Å; I190-R204 HydrophobicContact CD1-CG 4.16Å; I190-R204 HydrophobicContact CG1-CB 4.46Å; I190-I206 HydrophobicContact CD1-CD1 3.62Å; I190-I206 HydrophobicContact CD1-CG1 4.18Å; I190-I206 HydrophobicContact CG1-CD1 4.05Å
191	P	92.7	Very high	91.5	Very high	82 Å²	82	64.7 Å²	64.7	53%	0.532	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	148.5	172.7	31.3	-33.6	0	0	0	111.3	T199 G200	P191-T199 HydrophobicContact CB-CG2 3.81Å; P191-G200 CarbonylContact C-O 3.47Å; P191-G200 VanDerWaalsContact CA-O 3.24Å; P191-G200 WeakPolarHBondContact CA-O 3.2Å
192	F	88.9	Confident	91.1	Very high	64 Å²	64	63.3 Å²	63.3	28%	0.281	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	149.7	172.5	70	-83.7	0	0	0	110.9	K112 R194 G200 M202	K112-F192 WeakPolarHBondContact O-CZ 3.43Å; F192-R194 HydrophobicContact CD2-CG 4.42Å; F192-R194 HydrophobicContact CE2-CG 3.78Å; F192-R194 HydrophobicContact CZ-CG 4.34Å; F192-G200 VanDerWaalsContact CD1-C 3.47Å; F192-G200 WeakPolarHBondContact CD1-O 3.35Å; F192-G200 VanDerWaalsContact CE1-C 3.42Å; F192-G200 PolarHBondContact N-O 3Å; F192-G200 PolarHBondContact O-N 3.46Å; F192-M202 HydrophobicContact CB-CE 3.62Å; F192-M202 HydrophobicContact CD1-CB 4.43Å; F192-M202 HydrophobicContact CD1-CE 3.4Å; F192-M202 HydrophobicContact CD1-CG 4.39Å; F192-M202 HydrophobicContact CD2-CE 4.49Å; F192-M202 HydrophobicContact CE1-CB 4.39Å; F192-M202 HydrophobicContact CE1-CE 4.17Å; F192-M202 HydrophobicContact CG-CE 3.59Å
193	T	90.1	Very high	90.9	Very high	100 Å²	100	63 Å²	63	61%	0.613	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	129.1	177.4	-46.2	0	0	0	0	110.2
194	R	85.6	Confident	90.6	Very high	69 Å²	69	67.7 Å²	67.7	26%	0.26	37%	0.367	S	S	.	.			trans	-85.8	166	176.5	-70	-167	-160.8	150.7	5.4	111.7	D113 F192 D196 N197 S198	D113-R194 VanDerWaalsContact CB-NH2 3.29Å; D113-R194 IonicContact OD1-NH2 3.33Å; D113-R194 PolarHBondContact OD1-NH2 2.97Å; D113-R194 IonicContact OD2-CZ 3.93Å; D113-R194 IonicContact OD2-NH2 2.66Å; D113-R194 PolarHBondContact OD2-NH2 3.42Å; F192-R194 HydrophobicContact CD2-CG 4.42Å; F192-R194 HydrophobicContact CE2-CG 3.78Å; F192-R194 HydrophobicContact CZ-CG 4.34Å; R194-D196 WeakPolarHBondContact CB-OD1 3.49Å; R194-D196 PolarHBondContact O-N 3.38Å; R194-N197 PolarHBondContact O-N 2.91Å; R194-S198 WeakPolarHBondContact CB-O 3.22Å; R194-S198 WeakPolarHBondContact CD-OG 3.15Å; R194-S198 PolarHBondContact N-O 2.92Å
195	P	85.3	Confident	90.4	Very high	130 Å²	130	67.5 Å²	67.5	84%	0.844	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-26	176	-23.7	34.6	0	0	0	114.3	N197	P195-N197 PolarHBondContact O-N 3.23Å
196	D	88	Confident	90.1	Very high	107 Å²	107	65.4 Å²	65.4	57%	0.572	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	12.8	176	64.8	-4.8	0	0	0	113.1	R194 S198	R194-D196 WeakPolarHBondContact CB-OD1 3.49Å; R194-D196 PolarHBondContact O-N 3.38Å; D196-S198 PolarHBondContact O-N 3.24Å; D196-S198 VanDerWaalsContact O-N 3.12Å; D196-S198 VanDerWaalsContact OD1-CB 3.28Å; D196-S198 WeakPolarHBondContact OD1-CB 3.43Å; D196-S198 PolarHBondContact OD1-N 3.43Å; D196-S198 PolarHBondContact OD1-OG 3.1Å; D196-S198 PolarHBondContact OD2-OG 3.24Å
197	N	86.8	Confident	90	Very high	140 Å²	140	65.3 Å²	65.3	75%	0.749	35%	0.35	S	S	*	.	S	Bend	trans	61.3	12.6	-176.2	-148.7	35.6	0	0	0	114.6	R194 P195	R194-N197 PolarHBondContact O-N 2.91Å; P195-N197 PolarHBondContact O-N 3.23Å
198	S	90	Very high	89.8	Confident	37 Å²	37	69.9 Å²	69.9	26%	0.259	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-84.3	159.1	171.9	74.8	0	0	0	0	111.6	R194 D196	R194-S198 WeakPolarHBondContact CB-O 3.22Å; R194-S198 WeakPolarHBondContact CD-OG 3.15Å; R194-S198 PolarHBondContact N-O 2.92Å; D196-S198 PolarHBondContact O-N 3.24Å; D196-S198 VanDerWaalsContact O-N 3.12Å; D196-S198 VanDerWaalsContact OD1-CB 3.28Å; D196-S198 WeakPolarHBondContact OD1-CB 3.43Å; D196-S198 PolarHBondContact OD1-N 3.43Å; D196-S198 PolarHBondContact OD1-OG 3.1Å; D196-S198 PolarHBondContact OD2-OG 3.24Å
199	T	90.3	Very high	89.8	Confident	88 Å²	88	72.7 Å²	72.7	54%	0.54	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.5	175.9	-55.4	0	0	0	0	110.1	P191	P191-T199 HydrophobicContact CB-CG2 3.81Å
200	G	89.3	Confident	89.5	Confident	0 Å²	0	74 Å²	74	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	168.4	167.7	0	0	0	0	0	112.2	D113 P191 F192	D113-G200 WeakPolarHBondContact OD1-CA 3.45Å; P191-G200 CarbonylContact C-O 3.47Å; P191-G200 VanDerWaalsContact CA-O 3.24Å; P191-G200 WeakPolarHBondContact CA-O 3.2Å; F192-G200 VanDerWaalsContact CD1-C 3.47Å; F192-G200 WeakPolarHBondContact CD1-O 3.35Å; F192-G200 VanDerWaalsContact CE1-C 3.42Å; F192-G200 PolarHBondContact N-O 3Å; F192-G200 PolarHBondContact O-N 3.46Å
201	H	91.4	Very high	89.6	Confident	69 Å²	69	76.2 Å²	76.2	32%	0.319	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.6	-178.7	-63.3	88.1	0	0	0	111	D113 F114 L189 I190	D113-H201 PolarHBondContact OD1-N 3.15Å; F114-H201 WeakPolarHBondContact CB-O 3.34Å; F114-H201 PolarHBondContact N-O 3.28Å; L189-H201 HydrophobicContact CD1-CB 3.84Å; L189-H201 HydrophobicContact CD2-CB 3.88Å; L189-H201 HydrophobicContact CG-CB 3.8Å; I190-H201 WeakPolarHBondContact O-CA 3.28Å
202	M	89.1	Confident	89.6	Confident	55 Å²	55	76.5 Å²	76.5	27%	0.271	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.6	174.1	65.1	178.8	96.2	0	0	111.2	I190 F192 R204	I190-M202 HydrophobicContact CB-CG 4.06Å; I190-M202 PolarHBondContact N-O 2.94Å; I190-M202 PolarHBondContact O-N 3.45Å; F192-M202 HydrophobicContact CB-CE 3.62Å; F192-M202 HydrophobicContact CD1-CB 4.43Å; F192-M202 HydrophobicContact CD1-CE 3.4Å; F192-M202 HydrophobicContact CD1-CG 4.39Å; F192-M202 HydrophobicContact CD2-CE 4.49Å; F192-M202 HydrophobicContact CE1-CB 4.39Å; F192-M202 HydrophobicContact CE1-CE 4.17Å; F192-M202 HydrophobicContact CG-CE 3.59Å; M202-R204 HydrophobicContact CG-CG 4.14Å; M202-R204 PolarHBondContact O-N 3.23Å; M202-R204 HydrophobicContact SD-CG 4.19Å; M202-R204 PolarHBondContact SD-NE 2.84Å
203	C	91.1	Very high	89.6	Confident	25 Å²	25	74 Å²	74	17%	0.169	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	117.9	174.1	179.2	0	0	0	0	109.2	F114 C121 M125 L189	F114-C203 HydrophobicContact CD1-CB 4.44Å; F114-C203 HydrophobicContact CD2-CB 3.95Å; F114-C203 HydrophobicContact CE2-CB 4.2Å; F114-C203 HydrophobicContact CG-CB 4.09Å; C121-C203 WeakPolarHBondContact CA-SG 3.36Å; C121-C203 HydrophobicContact CB-CB 3.75Å; C121-C203 WeakPolarHBondContact CB-SG 3.39Å; C121-C203 VanDerWaalsContact SG-CA 3.59Å; C121-C203 WeakPolarHBondContact SG-CB 3.26Å; C121-C203 CovalentContact SG-SG 2.03Å; C121-C203 PolarHBondContact SG-SG 3.44Å; M125-C203 HydrophobicContact CE-CB 4.48Å; L189-C203 HydrophobicContact CD1-CB 4.5Å
204	R	88.9	Confident	89.7	Confident	129 Å²	129	72.4 Å²	72.4	49%	0.487	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150	178	-70.7	-148.9	-174.3	-163.2	5.5	112.1	S187 T188 I190 M202	S187-R204 WeakPolarHBondContact CA-O 3.34Å; T188-R204 PolarHBondContact N-O 3.16Å; T188-R204 PolarHBondContact O-N 3.36Å; I190-R204 HydrophobicContact CD1-CB 3.83Å; I190-R204 HydrophobicContact CD1-CG 4.16Å; I190-R204 HydrophobicContact CG1-CB 4.46Å; M202-R204 HydrophobicContact CG-CG 4.14Å; M202-R204 PolarHBondContact O-N 3.23Å; M202-R204 HydrophobicContact SD-CG 4.19Å; M202-R204 PolarHBondContact SD-NE 2.84Å
205	L	89.6	Confident	90.1	Very high	29 Å²	29	72.4 Å²	72.4	15%	0.152	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.1	170.5	-166	65	0	0	0	108.6	Y183 W207	Y183-L205 HydrophobicContact CD1-CD1 4.39Å; Y183-L205 HydrophobicContact CD1-CD2 4.23Å; Y183-L205 HydrophobicContact CE1-CD2 4.01Å; L205-W207 HydrophobicContact CD1-CH2 4.42Å; L205-W207 HydrophobicContact CD1-CZ2 4.19Å; L205-W207 HydrophobicContact CD2-CH2 4.26Å; L205-W207 HydrophobicContact CD2-CZ2 3.35Å; L205-W207 HydrophobicContact CG-CD2 4.47Å; L205-W207 HydrophobicContact CG-CZ2 3.82Å
206	I	90	Very high	90.5	Very high	87 Å²	87	67.9 Å²	67.9	45%	0.446	37%	0.369	S	S	.	.			trans	-113.1	115.7	178.3	-52.9	-178.3	0	0	0	108	S186 T188 I190	S186-I206 WeakPolarHBondContact CB-O 3.15Å; S186-I206 PolarHBondContact O-N 2.82Å; T188-I206 HydrophobicContact CG2-CD1 3.33Å; T188-I206 HydrophobicContact CG2-CG1 3.85Å; I190-I206 HydrophobicContact CD1-CD1 3.62Å; I190-I206 HydrophobicContact CD1-CG1 4.18Å; I190-I206 HydrophobicContact CG1-CD1 4.05Å
207	W	91.1	Very high	90.8	Very high	17 Å²	17	63.5 Å²	63.5	6%	0.064	35%	0.345	C	S	.	.			trans	-91.4	149.1	174.6	-61.5	111.2	0	0	0	110.5	P182 S186 L205 N209 F212 E213 W216 Y217	P182-W207 HydrophobicContact CB-CH2 3.98Å; P182-W207 HydrophobicContact CB-CZ3 3.91Å; S186-W207 WeakPolarHBondContact OG-CZ3 3.41Å; L205-W207 HydrophobicContact CD1-CH2 4.42Å; L205-W207 HydrophobicContact CD1-CZ2 4.19Å; L205-W207 HydrophobicContact CD2-CH2 4.26Å; L205-W207 HydrophobicContact CD2-CZ2 3.35Å; L205-W207 HydrophobicContact CG-CD2 4.47Å; L205-W207 HydrophobicContact CG-CZ2 3.82Å; W207-N209 PolarHBondContact O-N 3.13Å; W207-F212 HydrophobicContact CB-CD1 4.44Å; W207-F212 AromaticContact CD2-CD1 3.99Å; W207-F212 HydrophobicContact CD2-CD1 3.99Å; W207-F212 HydrophobicContact CD2-CE1 4.23Å; W207-F212 AromaticContact CE3-CD1 3.45Å; W207-F212 HydrophobicContact CE3-CD1 3.45Å; W207-F212 VanDerWaalsContact CE3-CD1 3.45Å; W207-F212 AromaticContact CE3-CE1 3.34Å; W207-F212 HydrophobicContact CE3-CE1 3.34Å; W207-F212 HydrophobicContact CG-CD1 4.45Å; W207-F212 HydrophobicContact CH2-CE1 4.26Å; W207-F212 AromaticContact CZ3-CD1 3.99Å; W207-F212 HydrophobicContact CZ3-CD1 3.99Å; W207-F212 AromaticContact CZ3-CE1 3.38Å; W207-F212 HydrophobicContact CZ3-CE1 3.38Å; W207-F212 HydrophobicContact CZ3-CZ 4.43Å; W207-E213 HydrophobicContact CB-CB 3.87Å; W207-E213 VanDerWaalsContact CD1-CG 3.43Å; W207-E213 HydrophobicContact CG-CB 3.85Å; W207-E213 HydrophobicContact CG-CG 4.26Å; W207-W216 AromaticContact CH2-CD1 3.55Å; W207-W216 AromaticContact CH2-CD2 3.94Å; W207-W216 HydrophobicContact CH2-CD2 3.94Å; W207-W216 AromaticContact CH2-CE2 3.82Å; W207-W216 AromaticContact CH2-CG 3.76Å; W207-W216 HydrophobicContact CH2-CG 3.76Å; W207-W216 AromaticContact CH2-NE1 3.51Å; W207-W216 HydrophobicContact CZ2-CB 4.31Å; W207-W216 AromaticContact CZ2-CD1 3.14Å; W207-W216 HydrophobicContact CZ2-CD2 4.29Å; W207-W216 AromaticContact CZ2-CG 3.66Å; W207-W216 HydrophobicContact CZ2-CG 3.66Å; W207-W216 AromaticContact CZ2-NE1 3.45Å; W207-Y217 AromaticContact NE1-CZ 3.94Å
208	P	90.8	Very high	91.2	Very high	95 Å²	95	59.3 Å²	59.3	62%	0.617	32%	0.322	S	S	*	.	S	Bend	trans	-63.2	-43	-177.1	23.6	-33	0	0	0	112.1	F212	P208-F212 HydrophobicContact CG-CB 4.35Å; P208-F212 HydrophobicContact CG-CD1 4.49Å; P208-F212 HydrophobicContact CG-CG 4.29Å
209	N	91.4	Very high	91.4	Very high	112 Å²	112	59.5 Å²	59.5	60%	0.599	33%	0.326	S	S	*	.	S	Bend	trans	-135.9	152.7	-174.9	-60.6	-31.2	0	0	0	110.7	W207 V211 F212 E213	W207-N209 PolarHBondContact O-N 3.13Å; N209-V211 VanDerWaalsContact C-N 3.32Å; N209-V211 PolarHBondContact O-N 3.28Å; N209-F212 HydrophobicContact CB-CB 4.47Å; N209-F212 WeakPolarHBondContact O-CB 3.28Å; N209-F212 PolarHBondContact O-N 3.37Å; N209-F212 VanDerWaalsContact O-N 3.1Å; N209-E213 PolarHBondContact O-N 3.16Å
210	A	89.3	Confident	91.7	Very high	64 Å²	64	55.8 Å²	55.8	53%	0.529	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-38.9	177.2	0	0	0	0	0	112.8	F212 E213 Q214	A210-F212 VanDerWaalsContact C-N 3.26Å; A210-F212 PolarHBondContact O-N 3.12Å; A210-E213 PolarHBondContact O-N 3.4Å; A210-Q214 WeakPolarHBondContact O-CB 3.45Å; A210-Q214 WeakPolarHBondContact O-CG 3.32Å; A210-Q214 PolarHBondContact O-N 2.65Å
211	V	91.7	Very high	91.9	Very high	102 Å²	102	57.4 Å²	57.4	62%	0.618	31%	0.311	S	S	*	.	H	α-helix	trans	-60.7	-37.9	175.7	179.6	0	0	0	0	111.2	N209 S215	N209-V211 VanDerWaalsContact C-N 3.32Å; N209-V211 PolarHBondContact O-N 3.28Å; V211-S215 VanDerWaalsContact O-CB 3.22Å; V211-S215 WeakPolarHBondContact O-CB 3.23Å; V211-S215 PolarHBondContact O-N 3.3Å; V211-S215 PolarHBondContact O-OG 3.03Å
212	F	92.1	Very high	92.2	Very high	87 Å²	87	57.7 Å²	57.7	38%	0.382	32%	0.315	S	S	.	.	H	α-helix	trans	-70.1	-45.6	177.3	-166.5	-82.8	0	0	0	111.1	W207 P208 N209 A210 Q214 S215 W216	W207-F212 HydrophobicContact CB-CD1 4.44Å; W207-F212 AromaticContact CD2-CD1 3.99Å; W207-F212 HydrophobicContact CD2-CD1 3.99Å; W207-F212 HydrophobicContact CD2-CE1 4.23Å; W207-F212 AromaticContact CE3-CD1 3.45Å; W207-F212 HydrophobicContact CE3-CD1 3.45Å; W207-F212 VanDerWaalsContact CE3-CD1 3.45Å; W207-F212 AromaticContact CE3-CE1 3.34Å; W207-F212 HydrophobicContact CE3-CE1 3.34Å; W207-F212 HydrophobicContact CG-CD1 4.45Å; W207-F212 HydrophobicContact CH2-CE1 4.26Å; W207-F212 AromaticContact CZ3-CD1 3.99Å; W207-F212 HydrophobicContact CZ3-CD1 3.99Å; W207-F212 AromaticContact CZ3-CE1 3.38Å; W207-F212 HydrophobicContact CZ3-CE1 3.38Å; W207-F212 HydrophobicContact CZ3-CZ 4.43Å; P208-F212 HydrophobicContact CG-CB 4.35Å; P208-F212 HydrophobicContact CG-CD1 4.49Å; P208-F212 HydrophobicContact CG-CG 4.29Å; N209-F212 HydrophobicContact CB-CB 4.47Å; N209-F212 WeakPolarHBondContact O-CB 3.28Å; N209-F212 PolarHBondContact O-N 3.37Å; N209-F212 VanDerWaalsContact O-N 3.1Å; A210-F212 VanDerWaalsContact C-N 3.26Å; A210-F212 PolarHBondContact O-N 3.12Å; F212-Q214 VanDerWaalsContact C-N 3.32Å; F212-Q214 PolarHBondContact O-N 3.07Å; F212-S215 PolarHBondContact O-N 3.38Å; F212-W216 WeakPolarHBondContact O-CB 3.48Å; F212-W216 PolarHBondContact O-N 3.33Å
213	E	89.8	Confident	92.6	Very high	11 Å²	11	57.5 Å²	57.5	5%	0.051	32%	0.317	C	S	.	.	H	α-helix	trans	-54.4	-48.2	173.9	180	163.5	-158.7	0	0	111.1	W207 N209 A210 Y217 K334 K338	W207-E213 HydrophobicContact CB-CB 3.87Å; W207-E213 VanDerWaalsContact CD1-CG 3.43Å; W207-E213 HydrophobicContact CG-CB 3.85Å; W207-E213 HydrophobicContact CG-CG 4.26Å; N209-E213 PolarHBondContact O-N 3.16Å; A210-E213 PolarHBondContact O-N 3.4Å; E213-Y217 HydrophobicContact CG-CD2 3.85Å; E213-Y217 HydrophobicContact CG-CE2 3.54Å; E213-Y217 VanDerWaalsContact O-CD2 3.22Å; E213-Y217 WeakPolarHBondContact O-CD2 3.28Å; E213-Y217 PolarHBondContact O-N 3.18Å; E213-Y217 VanDerWaalsContact O-N 3.11Å; E213-K334 VanDerWaalsContact OE1-CE 3.28Å; E213-K334 WeakPolarHBondContact OE1-CE 3.29Å; E213-K334 IonicContact OE1-NZ 2.82Å; E213-K334 PolarHBondContact OE1-NZ 2.99Å; E213-K338 IonicContact OE1-NZ 3.48Å; E213-K338 IonicContact OE2-NZ 3.83Å; E213-K338 PolarHBondContact OE2-NZ 3.48Å
214	Q	92.6	Very high	92.8	Very high	67 Å²	67	56.5 Å²	56.5	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-62.2	-55.3	177.9	-76.9	172.2	-8.4	0	0	112.5	A210 F212 W216 Y217 I218 A335	A210-Q214 WeakPolarHBondContact O-CB 3.45Å; A210-Q214 WeakPolarHBondContact O-CG 3.32Å; A210-Q214 PolarHBondContact O-N 2.65Å; F212-Q214 VanDerWaalsContact C-N 3.32Å; F212-Q214 PolarHBondContact O-N 3.07Å; Q214-W216 PolarHBondContact O-N 2.92Å; Q214-Y217 PolarHBondContact O-N 3.41Å; Q214-I218 WeakPolarHBondContact O-CB 3.44Å; Q214-I218 VanDerWaalsContact O-CG1 3.3Å; Q214-I218 WeakPolarHBondContact O-CG1 3.47Å; Q214-I218 PolarHBondContact O-N 2.9Å; Q214-A335 HydrophobicContact CB-CB 4.39Å; Q214-A335 HydrophobicContact CG-CB 3.98Å; Q214-A335 WeakPolarHBondContact CG-O 3.45Å; Q214-A335 PolarHBondContact NE2-O 2.85Å
215	S	93.8	Very high	93.1	Very high	70 Å²	70	51.4 Å²	51.4	49%	0.49	29%	0.291	S	S	.	.	H	α-helix	trans	-57.4	-39.3	-178.7	-59.9	0	0	0	0	110.9	V211 F212 A219	V211-S215 VanDerWaalsContact O-CB 3.22Å; V211-S215 WeakPolarHBondContact O-CB 3.23Å; V211-S215 PolarHBondContact O-N 3.3Å; V211-S215 PolarHBondContact O-OG 3.03Å; F212-S215 PolarHBondContact O-N 3.38Å; S215-A219 WeakPolarHBondContact O-CB 3.27Å; S215-A219 PolarHBondContact O-N 3.19Å
216	W	94.3	Very high	93.4	Very high	35 Å²	35	53.7 Å²	53.7	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-52.8	178.6	-171.2	-102.3	0	0	0	112.7	L179 P182 Y183 W207 F212 Q214 I218 A219 L220	L179-W216 WeakPolarHBondContact O-CH2 3.45Å; L179-W216 WeakPolarHBondContact O-CZ2 3.23Å; P182-W216 HydrophobicContact CB-CH2 3.9Å; P182-W216 HydrophobicContact CB-CZ2 3.99Å; P182-W216 HydrophobicContact CB-CZ3 4.26Å; P182-W216 HydrophobicContact CG-CH2 3.36Å; P182-W216 HydrophobicContact CG-CZ2 3.94Å; P182-W216 HydrophobicContact CG-CZ3 3.71Å; Y183-W216 HydrophobicContact CD2-CZ2 4.1Å; Y183-W216 AromaticContact CE2-CE2 3.89Å; Y183-W216 AromaticContact CE2-CZ2 3.87Å; Y183-W216 HydrophobicContact CE2-CZ2 3.87Å; Y183-W216 AromaticContact CE2-NE1 3.3Å; Y183-W216 VanDerWaalsContact CE2-NE1 3.3Å; Y183-W216 AromaticContact CZ-NE1 3.89Å; W207-W216 AromaticContact CH2-CD1 3.55Å; W207-W216 AromaticContact CH2-CD2 3.94Å; W207-W216 HydrophobicContact CH2-CD2 3.94Å; W207-W216 AromaticContact CH2-CE2 3.82Å; W207-W216 AromaticContact CH2-CG 3.76Å; W207-W216 HydrophobicContact CH2-CG 3.76Å; W207-W216 AromaticContact CH2-NE1 3.51Å; W207-W216 HydrophobicContact CZ2-CB 4.31Å; W207-W216 AromaticContact CZ2-CD1 3.14Å; W207-W216 HydrophobicContact CZ2-CD2 4.29Å; W207-W216 AromaticContact CZ2-CG 3.66Å; W207-W216 HydrophobicContact CZ2-CG 3.66Å; W207-W216 AromaticContact CZ2-NE1 3.45Å; F212-W216 WeakPolarHBondContact O-CB 3.48Å; F212-W216 PolarHBondContact O-N 3.33Å; Q214-W216 PolarHBondContact O-N 2.92Å; W216-I218 VanDerWaalsContact C-N 3.32Å; W216-I218 PolarHBondContact O-N 3.18Å; W216-A219 PolarHBondContact O-N 3.17Å; W216-L220 HydrophobicContact CZ2-CD2 4.29Å; W216-L220 WeakPolarHBondContact O-CG 3.31Å; W216-L220 PolarHBondContact O-N 3.3Å
217	Y	93.3	Very high	93.7	Very high	15 Å²	15	53.8 Å²	53.8	6%	0.059	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-36.4	-179.4	-71.2	-48.4	0	0	0	112.5	W207 E213 Q214 L221 N331 K334 A335	W207-Y217 AromaticContact NE1-CZ 3.94Å; E213-Y217 HydrophobicContact CG-CD2 3.85Å; E213-Y217 HydrophobicContact CG-CE2 3.54Å; E213-Y217 VanDerWaalsContact O-CD2 3.22Å; E213-Y217 WeakPolarHBondContact O-CD2 3.28Å; E213-Y217 PolarHBondContact O-N 3.18Å; E213-Y217 VanDerWaalsContact O-N 3.11Å; Q214-Y217 PolarHBondContact O-N 3.41Å; Y217-L221 WeakPolarHBondContact O-CB 3.39Å; Y217-L221 PolarHBondContact O-N 3.23Å; Y217-N331 HydrophobicContact CD1-CB 3.96Å; Y217-N331 HydrophobicContact CE1-CB 4.36Å; Y217-N331 HydrophobicContact CG-CB 4.28Å; Y217-K334 HydrophobicContact CE2-CD 4.44Å; Y217-A335 HydrophobicContact CD2-CB 4.28Å
218	I	94.7	Very high	94	Very high	51 Å²	51	53.1 Å²	53.1	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-67.8	-43.5	173.7	-63.4	-60.1	0	0	0	111.3	Q214 W216 L220 L221 L222 F336	Q214-I218 WeakPolarHBondContact O-CB 3.44Å; Q214-I218 VanDerWaalsContact O-CG1 3.3Å; Q214-I218 WeakPolarHBondContact O-CG1 3.47Å; Q214-I218 PolarHBondContact O-N 2.9Å; W216-I218 VanDerWaalsContact C-N 3.32Å; W216-I218 PolarHBondContact O-N 3.18Å; I218-L220 VanDerWaalsContact C-N 3.32Å; I218-L220 PolarHBondContact O-N 3.13Å; I218-L221 HydrophobicContact CD1-CD2 4.49Å; I218-L221 WeakPolarHBondContact O-CB 3.38Å; I218-L221 PolarHBondContact O-N 3.47Å; I218-L222 HydrophobicContact CG2-CD1 4.12Å; I218-L222 HydrophobicContact CG2-CG 4.41Å; I218-L222 WeakPolarHBondContact O-CG 3.41Å; I218-L222 PolarHBondContact O-N 3.36Å; I218-F336 HydrophobicContact CD1-CE2 3.76Å; I218-F336 HydrophobicContact CD1-CZ 3.88Å; I218-F336 HydrophobicContact CG1-CZ 4.4Å
219	A	95.8	Very high	94.3	Very high	42 Å²	42	49.2 Å²	49.2	35%	0.347	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-43.6	176.2	0	0	0	0	0	111.5	S215 W216 L222 V223	S215-A219 WeakPolarHBondContact O-CB 3.27Å; S215-A219 PolarHBondContact O-N 3.19Å; W216-A219 PolarHBondContact O-N 3.17Å; A219-L222 PolarHBondContact O-N 2.84Å; A219-V223 WeakPolarHBondContact O-CB 3.12Å; A219-V223 VanDerWaalsContact O-CG2 3.3Å; A219-V223 WeakPolarHBondContact O-CG2 3.49Å; A219-V223 PolarHBondContact O-N 3.08Å
220	L	95	Very high	94.5	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-42.1	175.7	-67.6	-173.8	0	0	0	112.7	M180 Y183 W216 I218 L222 V223 L224	M180-L220 HydrophobicContact CE-CD1 4.48Å; M180-L220 HydrophobicContact CE-CD2 3.38Å; Y183-L220 HydrophobicContact CE2-CD1 4.01Å; Y183-L220 WeakPolarHBondContact OH-CD1 3.39Å; W216-L220 HydrophobicContact CZ2-CD2 4.29Å; W216-L220 WeakPolarHBondContact O-CG 3.31Å; W216-L220 PolarHBondContact O-N 3.3Å; I218-L220 VanDerWaalsContact C-N 3.32Å; I218-L220 PolarHBondContact O-N 3.13Å; L220-L222 VanDerWaalsContact C-N 3.29Å; L220-L222 PolarHBondContact O-N 3.34Å; L220-V223 PolarHBondContact O-N 3.49Å; L220-L224 HydrophobicContact CD2-CD1 4Å; L220-L224 WeakPolarHBondContact O-CA 3.27Å; L220-L224 VanDerWaalsContact O-CB 3.3Å; L220-L224 WeakPolarHBondContact O-CB 3.11Å; L220-L224 PolarHBondContact O-N 3.32Å
221	L	95.3	Very high	94.8	Very high	34 Å²	34	49.6 Å²	49.6	18%	0.178	27%	0.269	C	S	.	.	H	α-helix	trans	-57.5	-43.1	173.6	175.6	70.2	0	0	0	111.2	Y217 I218 F225 L226 Y328 A332	Y217-L221 WeakPolarHBondContact O-CB 3.39Å; Y217-L221 PolarHBondContact O-N 3.23Å; I218-L221 HydrophobicContact CD1-CD2 4.49Å; I218-L221 WeakPolarHBondContact O-CB 3.38Å; I218-L221 PolarHBondContact O-N 3.47Å; L221-F225 HydrophobicContact CD1-CB 4.3Å; L221-F225 HydrophobicContact CD1-CD1 4Å; L221-F225 HydrophobicContact CD1-CG 4.41Å; L221-F225 WeakPolarHBondContact O-CA 3.43Å; L221-F225 VanDerWaalsContact O-CB 3.25Å; L221-F225 WeakPolarHBondContact O-CB 3.47Å; L221-F225 PolarHBondContact O-N 2.83Å; L221-L226 HydrophobicContact CD2-CD1 4.49Å; L221-L226 HydrophobicContact CG-CD1 4.25Å; L221-L226 HydrophobicContact CG-CG 4.37Å; L221-L226 PolarHBondContact O-N 3.21Å; L221-Y328 HydrophobicContact CD1-CD1 4.26Å; L221-Y328 HydrophobicContact CD1-CG 4.23Å; L221-A332 HydrophobicContact CD2-CB 4.38Å
222	L	96.6	Very high	95	Very high	75 Å²	75	44.8 Å²	44.8	39%	0.393	24%	0.239	S	C	.	.	I	π-helix	trans	-68.7	-52.6	178.8	-67.3	174.6	0	0	0	111.7	I218 A219 L220 L226 I227	I218-L222 HydrophobicContact CG2-CD1 4.12Å; I218-L222 HydrophobicContact CG2-CG 4.41Å; I218-L222 WeakPolarHBondContact O-CG 3.41Å; I218-L222 PolarHBondContact O-N 3.36Å; A219-L222 PolarHBondContact O-N 2.84Å; L220-L222 VanDerWaalsContact C-N 3.29Å; L220-L222 PolarHBondContact O-N 3.34Å; L222-L226 HydrophobicContact CD2-CB 4.48Å; L222-L226 HydrophobicContact CD2-CD1 3.73Å; L222-L226 PolarHBondContact O-N 3.02Å; L222-I227 WeakPolarHBondContact O-CB 3.33Å; L222-I227 WeakPolarHBondContact O-CG1 3.44Å; L222-I227 PolarHBondContact O-N 2.87Å
223	V	96.8	Very high	95.1	Very high	52 Å²	52	43.7 Å²	43.7	32%	0.315	25%	0.247	S	C	.	.	I	π-helix	trans	-75	-36.4	-170.4	173.1	0	0	0	0	112.8	F137 L179 A219 L220 P228	F137-V223 HydrophobicContact CE1-CG1 4.37Å; F137-V223 HydrophobicContact CZ-CG1 4.03Å; L179-V223 HydrophobicContact CD2-CG1 4Å; A219-V223 WeakPolarHBondContact O-CB 3.12Å; A219-V223 VanDerWaalsContact O-CG2 3.3Å; A219-V223 WeakPolarHBondContact O-CG2 3.49Å; A219-V223 PolarHBondContact O-N 3.08Å; L220-V223 PolarHBondContact O-N 3.49Å; V223-P228 WeakPolarHBondContact O-CD 3.14Å; V223-P228 WeakPolarHBondContact O-CG 3.3Å
224	L	96.1	Very high	95.3	Very high	4 Å²	4	47 Å²	47	2%	0.021	27%	0.268	C	S	.	.	I	π-helix	trans	-104.7	-7.2	-174	-60.3	-177	0	0	0	114	S133 T136 F137 L179 M180 L220 Y328	S133-L224 WeakPolarHBondContact OG-CD1 3.26Å; T136-L224 VanDerWaalsContact CG2-O 3.26Å; T136-L224 WeakPolarHBondContact CG2-O 3.27Å; F137-L224 HydrophobicContact CE1-CD2 4.09Å; F137-L224 HydrophobicContact CE2-CD2 4.27Å; F137-L224 HydrophobicContact CZ-CD2 3.72Å; L179-L224 HydrophobicContact CD2-CD1 4.46Å; L179-L224 HydrophobicContact CD2-CD2 3.89Å; L179-L224 HydrophobicContact CD2-CG 4.29Å; M180-L224 HydrophobicContact CE-CD1 3.76Å; L220-L224 HydrophobicContact CD2-CD1 4Å; L220-L224 WeakPolarHBondContact O-CA 3.27Å; L220-L224 VanDerWaalsContact O-CB 3.3Å; L220-L224 WeakPolarHBondContact O-CB 3.11Å; L220-L224 PolarHBondContact O-N 3.32Å; L224-Y328 WeakPolarHBondContact CB-OH 3.26Å
225	F	95.5	Very high	95.4	Very high	22 Å²	22	44.3 Å²	44.3	10%	0.096	26%	0.257	C	S	.	.	I	π-helix	trans	-131.3	-62.8	-177.8	-170.2	-94.8	0	0	0	112.8	L221 G229 F321 W324 T325 Y328	L221-F225 HydrophobicContact CD1-CB 4.3Å; L221-F225 HydrophobicContact CD1-CD1 4Å; L221-F225 HydrophobicContact CD1-CG 4.41Å; L221-F225 WeakPolarHBondContact O-CA 3.43Å; L221-F225 VanDerWaalsContact O-CB 3.25Å; L221-F225 WeakPolarHBondContact O-CB 3.47Å; L221-F225 PolarHBondContact O-N 2.83Å; F225-G229 PolarHBondContact O-N 2.87Å; F225-F321 HydrophobicContact CD1-CE1 4.4Å; F225-F321 AromaticContact CD2-CD1 3.92Å; F225-F321 HydrophobicContact CD2-CD1 3.92Å; F225-F321 AromaticContact CD2-CE1 3.86Å; F225-F321 HydrophobicContact CD2-CE1 3.86Å; F225-F321 HydrophobicContact CE1-CD1 4.13Å; F225-F321 HydrophobicContact CE1-CE1 4.31Å; F225-F321 AromaticContact CE2-CD1 3.35Å; F225-F321 HydrophobicContact CE2-CD1 3.35Å; F225-F321 AromaticContact CE2-CE1 3.78Å; F225-F321 HydrophobicContact CE2-CE1 3.78Å; F225-F321 HydrophobicContact CE2-CG 4.46Å; F225-F321 HydrophobicContact CG-CE1 4.19Å; F225-F321 AromaticContact CZ-CD1 3.46Å; F225-F321 HydrophobicContact CZ-CD1 3.46Å; F225-F321 VanDerWaalsContact CZ-CD1 3.46Å; F225-F321 HydrophobicContact CZ-CE1 4.01Å; F225-W324 HydrophobicContact CD2-CB 4.33Å; F225-W324 HydrophobicContact CE2-CB 4.21Å; F225-T325 HydrophobicContact CZ-CG2 4.31Å; F225-T325 VanDerWaalsContact CZ-OG1 3.27Å; F225-T325 WeakPolarHBondContact CZ-OG1 3.12Å; F225-Y328 HydrophobicContact CB-CD2 3.94Å; F225-Y328 HydrophobicContact CB-CE1 4.5Å; F225-Y328 HydrophobicContact CB-CE2 3.93Å; F225-Y328 HydrophobicContact CB-CG 4.26Å; F225-Y328 AromaticContact CD2-CD2 3.38Å; F225-Y328 HydrophobicContact CD2-CD2 3.38Å; F225-Y328 AromaticContact CD2-CE2 3.71Å; F225-Y328 HydrophobicContact CD2-CE2 3.71Å; F225-Y328 HydrophobicContact CD2-CG 4.24Å; F225-Y328 HydrophobicContact CE2-CD2 4.02Å; F225-Y328 AromaticContact CG-CD2 3.83Å; F225-Y328 HydrophobicContact CG-CD2 3.83Å; F225-Y328 HydrophobicContact CG-CE2 4.18Å; F225-Y328 HydrophobicContact CG-CG 4.28Å
226	L	96.1	Very high	95.4	Very high	77 Å²	77	41.6 Å²	41.6	40%	0.403	24%	0.236	S	C	.	.	I	π-helix	trans	-69.7	-52.8	-173.3	-67.1	179.6	0	0	0	113.3	L221 L222 G229 I230	L221-L226 HydrophobicContact CD2-CD1 4.49Å; L221-L226 HydrophobicContact CG-CD1 4.25Å; L221-L226 HydrophobicContact CG-CG 4.37Å; L221-L226 PolarHBondContact O-N 3.21Å; L222-L226 HydrophobicContact CD2-CB 4.48Å; L222-L226 HydrophobicContact CD2-CD1 3.73Å; L222-L226 PolarHBondContact O-N 3.02Å; L226-G229 PolarHBondContact O-N 3.39Å; L226-I230 WeakPolarHBondContact O-CG1 3.43Å; L226-I230 PolarHBondContact O-N 3.42Å
227	I	96.9	Very high	95.3	Very high	88 Å²	88	41.5 Å²	41.5	45%	0.451	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-51	179.8	-65.8	167.4	0	0	0	110.7	L222 G229 I230 M231	L222-I227 WeakPolarHBondContact O-CB 3.33Å; L222-I227 WeakPolarHBondContact O-CG1 3.44Å; L222-I227 PolarHBondContact O-N 2.87Å; I227-G229 VanDerWaalsContact C-N 3.28Å; I227-G229 PolarHBondContact O-N 3.47Å; I227-I230 PolarHBondContact O-N 2.88Å; I227-M231 HydrophobicContact CG2-CG 4.41Å; I227-M231 HydrophobicContact CG2-SD 3.95Å; I227-M231 VanDerWaalsContact O-CG 3.31Å; I227-M231 WeakPolarHBondContact O-CG 3.13Å; I227-M231 PolarHBondContact O-N 3.39Å
228	P	96.8	Very high	95.3	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.019	27%	0.274	C	S	.	.	H	α-helix	trans	-54.5	-41.9	173	-30.1	38.5	0	0	0	113.2	T136 V140 V223 M231 M232	T136-P228 HydrophobicContact CG2-CB 3.63Å; T136-P228 HydrophobicContact CG2-CG 3.57Å; V140-P228 HydrophobicContact CG2-CB 3.61Å; V140-P228 HydrophobicContact CG2-CG 4.38Å; V223-P228 WeakPolarHBondContact O-CD 3.14Å; V223-P228 WeakPolarHBondContact O-CG 3.3Å; P228-M231 PolarHBondContact O-N 3.03Å; P228-M232 HydrophobicContact CB-CE 4.04Å; P228-M232 WeakPolarHBondContact O-CB 3.46Å; P228-M232 WeakPolarHBondContact O-CE 3.36Å; P228-M232 VanDerWaalsContact O-CG 3.25Å; P228-M232 WeakPolarHBondContact O-CG 3.25Å; P228-M232 PolarHBondContact O-N 3.41Å
229	G	96.1	Very high	95.2	Very high	13 Å²	13	46.4 Å²	46.4	13%	0.134	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-46.1	178.4	0	0	0	0	0	113.3	F225 L226 I227 M231 M232 A233	F225-G229 PolarHBondContact O-N 2.87Å; L226-G229 PolarHBondContact O-N 3.39Å; I227-G229 VanDerWaalsContact C-N 3.28Å; I227-G229 PolarHBondContact O-N 3.47Å; G229-M231 PolarHBondContact O-N 3.1Å; G229-M232 PolarHBondContact O-N 3.26Å; G229-A233 WeakPolarHBondContact O-CB 3.25Å; G229-A233 PolarHBondContact O-N 3.48Å
230	I	96.1	Very high	94.9	Very high	110 Å²	110	46.8 Å²	46.8	56%	0.564	26%	0.261	S	S	*	.	H	α-helix	trans	-63.8	-43.2	176.5	-65	164.5	0	0	0	110.4	L226 I227 M232 A233 T234	L226-I230 WeakPolarHBondContact O-CG1 3.43Å; L226-I230 PolarHBondContact O-N 3.42Å; I227-I230 PolarHBondContact O-N 2.88Å; I230-M232 PolarHBondContact O-N 3.36Å; I230-A233 PolarHBondContact O-N 2.84Å; I230-T234 HydrophobicContact CG2-CG2 4.28Å; I230-T234 WeakPolarHBondContact O-CB 3.48Å; I230-T234 VanDerWaalsContact O-CG2 3.26Å; I230-T234 WeakPolarHBondContact O-CG2 3.4Å; I230-T234 PolarHBondContact O-N 3.4Å; I230-T234 PolarHBondContact O-OG1 3.13Å
231	M	96.3	Very high	94.7	Very high	75 Å²	75	51.2 Å²	51.2	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-43.7	177.6	-69.9	178.3	72.5	0	0	112.1	V140 I144 I227 P228 G229 T234 A235	V140-M231 HydrophobicContact CG1-CB 4.33Å; V140-M231 HydrophobicContact CG1-CE 3.49Å; V140-M231 VanDerWaalsContact CG1-CE 3.49Å; V140-M231 HydrophobicContact CG1-SD 4.02Å; I144-M231 HydrophobicContact CD1-CE 3.82Å; I227-M231 HydrophobicContact CG2-CG 4.41Å; I227-M231 HydrophobicContact CG2-SD 3.95Å; I227-M231 VanDerWaalsContact O-CG 3.31Å; I227-M231 WeakPolarHBondContact O-CG 3.13Å; I227-M231 PolarHBondContact O-N 3.39Å; P228-M231 PolarHBondContact O-N 3.03Å; G229-M231 PolarHBondContact O-N 3.1Å; M231-T234 PolarHBondContact O-OG1 2.85Å; M231-A235 VanDerWaalsContact O-CB 3.28Å; M231-A235 WeakPolarHBondContact O-CB 3.26Å; M231-A235 PolarHBondContact O-N 3.32Å; M231-A235 VanDerWaalsContact O-N 3.08Å
232	M	95.4	Very high	94.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-70.1	-44.6	178.6	-68.1	-173.5	-80.3	0	0	111.4	L139 V140 S143 P228 G229 I230 T234 A235 Y236 V317 F321	L139-M232 HydrophobicContact CB-SD 3.84Å; V140-M232 HydrophobicContact CG2-CG 4.18Å; V140-M232 HydrophobicContact CG2-SD 4.48Å; S143-M232 WeakPolarHBondContact OG-CG 3.3Å; P228-M232 HydrophobicContact CB-CE 4.04Å; P228-M232 WeakPolarHBondContact O-CB 3.46Å; P228-M232 WeakPolarHBondContact O-CE 3.36Å; P228-M232 VanDerWaalsContact O-CG 3.25Å; P228-M232 WeakPolarHBondContact O-CG 3.25Å; P228-M232 PolarHBondContact O-N 3.41Å; G229-M232 PolarHBondContact O-N 3.26Å; I230-M232 PolarHBondContact O-N 3.36Å; M232-T234 PolarHBondContact O-N 3.27Å; M232-A235 PolarHBondContact O-N 2.85Å; M232-Y236 HydrophobicContact CB-CD2 4.3Å; M232-Y236 HydrophobicContact CB-CE2 4.27Å; M232-Y236 WeakPolarHBondContact O-CD2 3.2Å; M232-Y236 PolarHBondContact O-N 3.39Å; M232-V317 HydrophobicContact CB-CG1 4.04Å; M232-V317 HydrophobicContact CE-CG1 4.33Å; M232-V317 HydrophobicContact SD-CG1 4.01Å; M232-V317 HydrophobicContact SD-CG2 3.85Å; M232-F321 HydrophobicContact CE-CE2 3.6Å; M232-F321 HydrophobicContact CE-CZ 3.58Å
233	A	94.4	Very high	94	Very high	65 Å²	65	52.4 Å²	52.4	54%	0.537	29%	0.286	S	S	.	.	H	α-helix	trans	-61.2	-44.7	179.1	0	0	0	0	0	111.8	G229 I230 G237	G229-A233 WeakPolarHBondContact O-CB 3.25Å; G229-A233 PolarHBondContact O-N 3.48Å; I230-A233 PolarHBondContact O-N 2.84Å; A233-G237 PolarHBondContact O-N 3.29Å
234	T	94.6	Very high	93.6	Very high	81 Å²	81	57.1 Å²	57.1	50%	0.497	30%	0.299	S	S	.	.	H	α-helix	trans	-65.3	-45.5	177.1	51.9	0	0	0	0	111.7	I230 M231 M232 G237 R238	I230-T234 HydrophobicContact CG2-CG2 4.28Å; I230-T234 WeakPolarHBondContact O-CB 3.48Å; I230-T234 VanDerWaalsContact O-CG2 3.26Å; I230-T234 WeakPolarHBondContact O-CG2 3.4Å; I230-T234 PolarHBondContact O-N 3.4Å; I230-T234 PolarHBondContact O-OG1 3.13Å; M231-T234 PolarHBondContact O-OG1 2.85Å; M232-T234 PolarHBondContact O-N 3.27Å; T234-G237 PolarHBondContact O-N 2.82Å; T234-R238 WeakPolarHBondContact O-CG 3.35Å; T234-R238 PolarHBondContact O-N 3.1Å
235	A	94.1	Very high	93.3	Very high	9 Å²	9	63 Å²	63	7%	0.074	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-53.9	176.8	0	0	0	0	0	111.8	M231 M232 G237 R238 I239	M231-A235 VanDerWaalsContact O-CB 3.28Å; M231-A235 WeakPolarHBondContact O-CB 3.26Å; M231-A235 PolarHBondContact O-N 3.32Å; M231-A235 VanDerWaalsContact O-N 3.08Å; M232-A235 PolarHBondContact O-N 2.85Å; A235-G237 PolarHBondContact O-N 2.65Å; A235-R238 PolarHBondContact O-N 2.64Å; A235-I239 WeakPolarHBondContact O-CD1 3.3Å; A235-I239 WeakPolarHBondContact O-CG1 3.37Å; A235-I239 PolarHBondContact O-N 3.03Å
236	Y	92.9	Very high	92.8	Very high	13 Å²	13	63.1 Å²	63.1	5%	0.051	33%	0.331	C	S	.	.	H	α-helix	trans	-69.6	-31.7	-178.8	-69.1	-58.6	0	0	0	113.3	S143 M232 I239 S240 I310 L313 I314 V317	S143-Y236 WeakPolarHBondContact CA-OH 3.3Å; S143-Y236 WeakPolarHBondContact OG-CE2 3.43Å; S143-Y236 VanDerWaalsContact OG-CZ 3.29Å; S143-Y236 PolarHBondContact OG-OH 2.66Å; M232-Y236 HydrophobicContact CB-CD2 4.3Å; M232-Y236 HydrophobicContact CB-CE2 4.27Å; M232-Y236 WeakPolarHBondContact O-CD2 3.2Å; M232-Y236 PolarHBondContact O-N 3.39Å; Y236-I239 HydrophobicContact CD1-CD1 3.96Å; Y236-I239 HydrophobicContact CE1-CD1 4.33Å; Y236-I239 PolarHBondContact O-N 2.86Å; Y236-S240 VanDerWaalsContact O-CB 3.27Å; Y236-S240 WeakPolarHBondContact O-CB 3.45Å; Y236-S240 PolarHBondContact O-N 3.06Å; Y236-S240 PolarHBondContact O-OG 3.37Å; Y236-I310 HydrophobicContact CD1-CG2 4.41Å; Y236-L313 HydrophobicContact CE1-CB 3.7Å; Y236-L313 HydrophobicContact CE1-CD1 4.08Å; Y236-L313 WeakPolarHBondContact OH-CB 3.35Å; Y236-I314 HydrophobicContact CD1-CG1 4.17Å; Y236-I314 HydrophobicContact CG-CG1 4.05Å; Y236-V317 HydrophobicContact CD2-CG2 4.06Å; Y236-V317 HydrophobicContact CE2-CB 4.45Å; Y236-V317 HydrophobicContact CE2-CG2 3.37Å
237	G	92.9	Very high	92.3	Very high	34 Å²	34	61.5 Å²	61.5	35%	0.351	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-49.6	171.9	0	0	0	0	0	111.6	A233 T234 A235 I239 S240 L241	A233-G237 PolarHBondContact O-N 3.29Å; T234-G237 PolarHBondContact O-N 2.82Å; A235-G237 PolarHBondContact O-N 2.65Å; G237-I239 PolarHBondContact O-N 3.21Å; G237-S240 PolarHBondContact O-N 2.98Å; G237-L241 WeakPolarHBondContact O-CG 3.32Å; G237-L241 PolarHBondContact O-N 3.33Å
238	R	93.6	Very high	91.8	Very high	169 Å²	169	63.5 Å²	63.5	64%	0.638	33%	0.328	S	S	*	.	H	α-helix	trans	-62.6	-42.9	177	-66.2	-72.8	-176.9	147.9	0.1	112.2	Y147 T234 A235 L241 K242	Y147-R238 HydrophobicContact CD2-CB 4.2Å; Y147-R238 HydrophobicContact CE2-CB 3.83Å; Y147-R238 HydrophobicContact CE2-CG 4.4Å; T234-R238 WeakPolarHBondContact O-CG 3.35Å; T234-R238 PolarHBondContact O-N 3.1Å; A235-R238 PolarHBondContact O-N 2.64Å; R238-L241 PolarHBondContact O-N 3.48Å; R238-K242 PolarHBondContact O-N 2.74Å
239	I	91.6	Very high	91.3	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60.2	-46.8	176.2	-67.9	164.1	0	0	0	110.8	R146 Y147 I150 A235 Y236 G237 L241 K242 L243 I310	R146-I239 HydrophobicContact CB-CD1 4.14Å; Y147-I239 HydrophobicContact CD2-CG1 4.22Å; I150-I239 HydrophobicContact CD1-CG2 4.14Å; I150-I239 HydrophobicContact CG2-CG2 4.42Å; A235-I239 WeakPolarHBondContact O-CD1 3.3Å; A235-I239 WeakPolarHBondContact O-CG1 3.37Å; A235-I239 PolarHBondContact O-N 3.03Å; Y236-I239 HydrophobicContact CD1-CD1 3.96Å; Y236-I239 HydrophobicContact CE1-CD1 4.33Å; Y236-I239 PolarHBondContact O-N 2.86Å; G237-I239 PolarHBondContact O-N 3.21Å; I239-L241 PolarHBondContact O-N 2.9Å; I239-K242 PolarHBondContact O-N 3.02Å; I239-L243 WeakPolarHBondContact O-CB 3.44Å; I239-L243 PolarHBondContact O-N 3.21Å; I239-I310 HydrophobicContact CG2-CB 4.46Å; I239-I310 HydrophobicContact CG2-CD1 3.23Å; I239-I310 HydrophobicContact CG2-CG1 3.64Å; I239-I310 HydrophobicContact CG2-CG2 3.97Å
240	S	90.6	Very high	90.7	Very high	49 Å²	49	72 Å²	72	34%	0.343	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-41.6	-178.9	-60.4	0	0	0	0	111.6	Y236 G237 L243 Y244	Y236-S240 VanDerWaalsContact O-CB 3.27Å; Y236-S240 WeakPolarHBondContact O-CB 3.45Å; Y236-S240 PolarHBondContact O-N 3.06Å; Y236-S240 PolarHBondContact O-OG 3.37Å; G237-S240 PolarHBondContact O-N 2.98Å; S240-L243 PolarHBondContact O-N 3.48Å; S240-Y244 VanDerWaalsContact O-CB 3.31Å; S240-Y244 WeakPolarHBondContact O-CB 3.14Å; S240-Y244 PolarHBondContact O-N 3.07Å
241	L	91.1	Very high	90.1	Very high	102 Å²	102	73 Å²	73	53%	0.534	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-45.3	175	-71.7	170.3	0	0	0	112.4	G237 R238 I239 L243 Y244 K245	G237-L241 WeakPolarHBondContact O-CG 3.32Å; G237-L241 PolarHBondContact O-N 3.33Å; R238-L241 PolarHBondContact O-N 3.48Å; I239-L241 PolarHBondContact O-N 2.9Å; L241-L243 VanDerWaalsContact C-N 3.33Å; L241-L243 PolarHBondContact O-N 3.47Å; L241-Y244 PolarHBondContact O-N 3.43Å; L241-K245 WeakPolarHBondContact O-CB 3.38Å; L241-K245 WeakPolarHBondContact O-CG 3.48Å; L241-K245 PolarHBondContact O-N 2.88Å
242	K	89.3	Confident	89.4	Confident	117 Å²	117	72.5 Å²	72.5	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-44.7	178.1	-175.7	70.6	177.3	-164.9	0	110.9	R238 I239 G246	R238-K242 PolarHBondContact O-N 2.74Å; I239-K242 PolarHBondContact O-N 3.02Å; K242-G246 PolarHBondContact O-N 3.39Å
243	L	87.6	Confident	88.7	Confident	18 Å²	18	78.2 Å²	78.2	9%	0.094	40%	0.398	C	S	.	.	H	α-helix	trans	-65.1	-45	179	-176.7	71	0	0	0	111.8	I239 S240 L241 G246 I247 L303 K307 I310	I239-L243 WeakPolarHBondContact O-CB 3.44Å; I239-L243 PolarHBondContact O-N 3.21Å; S240-L243 PolarHBondContact O-N 3.48Å; L241-L243 VanDerWaalsContact C-N 3.33Å; L241-L243 PolarHBondContact O-N 3.47Å; L243-G246 PolarHBondContact O-N 3.39Å; L243-I247 HydrophobicContact CD1-CD1 4.46Å; L243-I247 HydrophobicContact CG-CD1 4.1Å; L243-I247 WeakPolarHBondContact O-CG1 3.31Å; L243-I247 PolarHBondContact O-N 2.83Å; L243-L303 HydrophobicContact CD1-CB 4.3Å; L243-L303 HydrophobicContact CD1-CD2 4.09Å; L243-L303 HydrophobicContact CD1-CG 4.15Å; L243-K307 HydrophobicContact CD2-CB 3.67Å; L243-K307 HydrophobicContact CD2-CG 3.84Å; L243-I310 HydrophobicContact CD2-CD1 3.87Å
244	Y	87.8	Confident	87.9	Confident	151 Å²	151	82.3 Å²	82.3	59%	0.592	40%	0.404	S	S	*	.	H	α-helix	trans	-60.4	-47.9	177.8	177.5	-99.1	0	0	0	111.7	S240 L241 G246 I247 K248	S240-Y244 VanDerWaalsContact O-CB 3.31Å; S240-Y244 WeakPolarHBondContact O-CB 3.14Å; S240-Y244 PolarHBondContact O-N 3.07Å; L241-Y244 PolarHBondContact O-N 3.43Å; Y244-G246 VanDerWaalsContact C-N 3.29Å; Y244-G246 PolarHBondContact O-N 3.24Å; Y244-I247 PolarHBondContact O-N 3.43Å; Y244-K248 PolarHBondContact O-N 2.88Å
245	K	89	Confident	86.9	Confident	127 Å²	127	81.6 Å²	81.6	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-59.7	-39.7	175	-71.8	-179.8	-179.6	-176.2	0	111.9	L241 R249	L241-K245 WeakPolarHBondContact O-CB 3.38Å; L241-K245 WeakPolarHBondContact O-CG 3.48Å; L241-K245 PolarHBondContact O-N 2.88Å; K245-R249 WeakPolarHBondContact O-CG 3.38Å; K245-R249 PolarHBondContact O-N 2.97Å; K245-R249 VanDerWaalsContact O-N 3.08Å
246	G	86.1	Confident	85.6	Confident	24 Å²	24	83.4 Å²	83.4	25%	0.247	41%	0.414	C	S	.	.	H	α-helix	trans	-64.2	-42.6	176.7	0	0	0	0	0	113.3	K242 L243 Y244 A250	K242-G246 PolarHBondContact O-N 3.39Å; L243-G246 PolarHBondContact O-N 3.39Å; Y244-G246 VanDerWaalsContact C-N 3.29Å; Y244-G246 PolarHBondContact O-N 3.24Å; G246-A250 PolarHBondContact O-N 3.04Å; G246-A250 VanDerWaalsContact O-N 3.07Å
247	I	85.1	Confident	84.2	Confident	44 Å²	44	85.8 Å²	85.8	23%	0.226	43%	0.433	C	S	.	.	H	α-helix	trans	-66	-44.9	176.3	-66.1	169.4	0	0	0	110.7	L243 Y244 R249 A250 Q251 L303 K307	L243-I247 HydrophobicContact CD1-CD1 4.46Å; L243-I247 HydrophobicContact CG-CD1 4.1Å; L243-I247 WeakPolarHBondContact O-CG1 3.31Å; L243-I247 PolarHBondContact O-N 2.83Å; Y244-I247 PolarHBondContact O-N 3.43Å; I247-R249 VanDerWaalsContact C-N 3.33Å; I247-R249 PolarHBondContact O-N 3.17Å; I247-A250 PolarHBondContact O-N 3.19Å; I247-A250 VanDerWaalsContact O-N 3.16Å; I247-Q251 HydrophobicContact CG2-CG 4.42Å; I247-Q251 WeakPolarHBondContact O-CG 3.48Å; I247-Q251 PolarHBondContact O-N 3.09Å; I247-L303 HydrophobicContact CG1-CD2 3.86Å; I247-K307 HydrophobicContact CD1-CD 4.23Å
248	K	87.5	Confident	82.6	Confident	129 Å²	129	88.3 Å²	88.3	56%	0.561	45%	0.445	S	S	*	.	H	α-helix	trans	-58.8	-43.5	178.7	-173.2	173.5	-179	175.9	0	111.8	Y244 Q251 S252	Y244-K248 PolarHBondContact O-N 2.88Å; K248-Q251 PolarHBondContact O-N 2.94Å; K248-S252 PolarHBondContact O-N 2.95Å; K248-S252 PolarHBondContact O-OG 2.79Å
249	R	86.3	Confident	80.8	Confident	168 Å²	168	86.2 Å²	86.2	63%	0.634	44%	0.442	S	S	*	.	H	α-helix	trans	-64.3	-40	175.2	-72.3	175.6	-176.8	-178.3	-2.2	112.8	K245 I247 Q251 S252 L253	K245-R249 WeakPolarHBondContact O-CG 3.38Å; K245-R249 PolarHBondContact O-N 2.97Å; K245-R249 VanDerWaalsContact O-N 3.08Å; I247-R249 VanDerWaalsContact C-N 3.33Å; I247-R249 PolarHBondContact O-N 3.17Å; R249-Q251 VanDerWaalsContact C-N 3.31Å; R249-Q251 PolarHBondContact O-N 3.19Å; R249-S252 WeakPolarHBondContact CA-OG 3.32Å; R249-S252 PolarHBondContact O-N 3.2Å; R249-S252 PolarHBondContact O-OG 2.93Å; R249-L253 WeakPolarHBondContact O-CD1 3.43Å; R249-L253 WeakPolarHBondContact O-CG 3.3Å; R249-L253 PolarHBondContact O-N 3.33Å; R249-L253 VanDerWaalsContact O-N 3.09Å
250	A	82.6	Confident	79	Confident	28 Å²	28	95 Å²	95	23%	0.231	48%	0.475	C	S	.	.	H	α-helix	trans	-65.7	-36.2	176.9	0	0	0	0	0	112	G246 I247 K254	G246-A250 PolarHBondContact O-N 3.04Å; G246-A250 VanDerWaalsContact O-N 3.07Å; I247-A250 PolarHBondContact O-N 3.19Å; I247-A250 VanDerWaalsContact O-N 3.16Å; A250-K254 PolarHBondContact O-N 3.33Å
251	Q	82.7	Confident	77.1	Confident	129 Å²	129	100.4 Å²	100.4	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-69.4	-42.8	175.6	-72.8	173.8	-33.4	0	0	112.2	I247 K248 R249 L253 K254 S255	I247-Q251 HydrophobicContact CG2-CG 4.42Å; I247-Q251 WeakPolarHBondContact O-CG 3.48Å; I247-Q251 PolarHBondContact O-N 3.09Å; K248-Q251 PolarHBondContact O-N 2.94Å; R249-Q251 VanDerWaalsContact C-N 3.31Å; R249-Q251 PolarHBondContact O-N 3.19Å; Q251-L253 VanDerWaalsContact C-N 3.34Å; Q251-L253 PolarHBondContact O-N 3.02Å; Q251-K254 WeakPolarHBondContact O-CB 3.11Å; Q251-K254 PolarHBondContact O-N 3.47Å; Q251-S255 PolarHBondContact O-N 3.11Å
252	S	82	Confident	75.2	Confident	65 Å²	65	99.4 Å²	99.4	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-34.2	178	65	0	0	0	0	113.3	K248 R249 K254 S255 S256	K248-S252 PolarHBondContact O-N 2.95Å; K248-S252 PolarHBondContact O-OG 2.79Å; R249-S252 WeakPolarHBondContact CA-OG 3.32Å; R249-S252 PolarHBondContact O-N 3.2Å; R249-S252 PolarHBondContact O-OG 2.93Å; S252-K254 VanDerWaalsContact C-N 3.29Å; S252-K254 PolarHBondContact O-N 3.48Å; S252-S255 PolarHBondContact O-OG 3Å; S252-S256 PolarHBondContact O-N 3.05Å
253	L	80.4	Confident	73.3	Confident	121 Å²	121	98.6 Å²	98.6	63%	0.634	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-34.8	174	-75.3	164.1	0	0	0	111.8	R249 Q251 S257	R249-L253 WeakPolarHBondContact O-CD1 3.43Å; R249-L253 WeakPolarHBondContact O-CG 3.3Å; R249-L253 PolarHBondContact O-N 3.33Å; R249-L253 VanDerWaalsContact O-N 3.09Å; Q251-L253 VanDerWaalsContact C-N 3.34Å; Q251-L253 PolarHBondContact O-N 3.02Å; L253-S257 PolarHBondContact O-N 2.97Å; L253-S257 PolarHBondContact O-OG 3.15Å
254	K	77.6	Confident	71.5	Confident	151 Å²	151	103.6 Å²	103.6	66%	0.657	54%	0.542	S	S	*	.	H	α-helix	trans	-71	-37.4	178.6	-167.9	-178.5	178.2	-167.9	0	112.6	A250 Q251 S252 S257 S258	A250-K254 PolarHBondContact O-N 3.33Å; Q251-K254 WeakPolarHBondContact O-CB 3.11Å; Q251-K254 PolarHBondContact O-N 3.47Å; S252-K254 VanDerWaalsContact C-N 3.29Å; S252-K254 PolarHBondContact O-N 3.48Å; K254-S257 PolarHBondContact O-OG 3.4Å; K254-S258 PolarHBondContact O-N 3.32Å
255	S	73.9	Confident	69.7	Low	66 Å²	66	99.7 Å²	99.7	46%	0.462	55%	0.548	S	S	.	.	H	α-helix	trans	-67.4	-44.6	176.5	60.5	0	0	0	0	111.5	Q251 S252 S257 S258 E259	Q251-S255 PolarHBondContact O-N 3.11Å; S252-S255 PolarHBondContact O-OG 3Å; S255-S257 PolarHBondContact O-N 3.1Å; S255-S258 WeakPolarHBondContact O-CB 3.38Å; S255-S258 PolarHBondContact O-N 3.09Å; S255-S258 VanDerWaalsContact O-N 3.12Å; S255-E259 PolarHBondContact O-N 3.33Å
256	S	68	Low	67.7	Low	47 Å²	47	98.5 Å²	98.5	33%	0.329	56%	0.555	S	S	.	*	H	α-helix	trans	-66.3	-34.7	179.7	-171.8	0	0	0	0	113.6	S252 S258 E259 R260	S252-S256 PolarHBondContact O-N 3.05Å; S256-S258 VanDerWaalsContact C-N 3.3Å; S256-S258 PolarHBondContact O-N 3.3Å; S256-E259 PolarHBondContact O-N 3.1Å; S256-R260 PolarHBondContact O-N 3.14Å
257	S	63.6	Low	65.8	Low	62 Å²	62	104.3 Å²	104.3	43%	0.434	59%	0.586	S	S	.	*	H	α-helix	trans	-67.3	-30.7	173.1	54.8	0	0	0	0	113.2	L253 K254 S255 H261	L253-S257 PolarHBondContact O-N 2.97Å; L253-S257 PolarHBondContact O-OG 3.15Å; K254-S257 PolarHBondContact O-OG 3.4Å; S255-S257 PolarHBondContact O-N 3.1Å; S257-H261 PolarHBondContact O-CD2 2.99Å
258	S	59.2	Low	64.1	Low	87 Å²	87	110.9 Å²	110.9	61%	0.608	61%	0.613	S	S	*	*	H	α-helix	trans	-73	-32.7	178.8	-151.9	0	0	0	0	111.8	K254 S255 S256	K254-S258 PolarHBondContact O-N 3.32Å; S255-S258 WeakPolarHBondContact O-CB 3.38Å; S255-S258 PolarHBondContact O-N 3.09Å; S255-S258 VanDerWaalsContact O-N 3.12Å; S256-S258 VanDerWaalsContact C-N 3.3Å; S256-S258 PolarHBondContact O-N 3.3Å
259	E	55.4	Low	62	Low	126 Å²	126	110.7 Å²	110.7	59%	0.589	62%	0.624	S	S	*	*	H	α-helix	trans	-74.9	-33.9	177.2	-73.8	169.1	172.3	0	0	113.1	S255 S256 H261 A262 S263	S255-E259 PolarHBondContact O-N 3.33Å; S256-E259 PolarHBondContact O-N 3.1Å; E259-H261 PolarHBondContact O-N 2.64Å; E259-A262 PolarHBondContact O-N 3.37Å; E259-S263 PolarHBondContact O-N 3.07Å; E259-S263 PolarHBondContact O-OG 2.79Å
260	R	53.3	Low	59.7	Low	183 Å²	183	107.6 Å²	107.6	69%	0.691	64%	0.635	S	S	*	*	H	α-helix	trans	-65.7	-36.2	176.7	-72.5	-176.9	-167.7	-166.4	0.7	112.8	S256 A262 S263 T264	S256-R260 PolarHBondContact O-N 3.14Å; R260-A262 VanDerWaalsContact C-N 3.31Å; R260-A262 PolarHBondContact O-N 3.1Å; R260-S263 PolarHBondContact O-N 3.47Å; R260-T264 PolarHBondContact O-OG1 3Å; R260-T264 VanDerWaalsContact O-OG1 3.13Å
261	H	51.4	Low	57.9	Low	164 Å²	164	114.3 Å²	114.3	76%	0.759	67%	0.667	S	S	*	*	H	α-helix	trans	-70.9	-25.9	174.3	-81.9	-71	0	0	0	113.3	S257 E259	S257-H261 PolarHBondContact O-CD2 2.99Å; E259-H261 PolarHBondContact O-N 2.64Å
262	A	50.3	Low	55.7	Low	81 Å²	81	111.8 Å²	111.8	67%	0.669	68%	0.676	S	S	*	*	H	α-helix	trans	-77.4	-21.1	174.4	0	0	0	0	0	113.4	E259 R260	E259-A262 PolarHBondContact O-N 3.37Å; R260-A262 VanDerWaalsContact C-N 3.31Å; R260-A262 PolarHBondContact O-N 3.1Å
263	S	49.9	Very low	53.8	Low	100 Å²	100	117 Å²	117	70%	0.699	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-3.6	-172.2	-53.5	0	0	0	0	114.8	E259 R260	E259-S263 PolarHBondContact O-N 3.07Å; E259-S263 PolarHBondContact O-OG 2.79Å; R260-S263 PolarHBondContact O-N 3.47Å
264	T	49.9	Very low	51.6	Low	123 Å²	123	115 Å²	115	76%	0.755	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	8.5	179.8	-12.5	0	0	0	0	113.9	R260	R260-T264 PolarHBondContact O-OG1 3Å; R260-T264 VanDerWaalsContact O-OG1 3.13Å
265	G	50.2	Low	49.6	Very low	69 Å²	69	113.5 Å²	113.5	71%	0.711	71%	0.714	S	S	*	*	S	Bend	trans	-113.2	49.3	-175.4	0	0	0	0	0	114.2
266	S	45.9	Very low	47.6	Very low	101 Å²	101	117.1 Å²	117.1	71%	0.706	73%	0.728	S	S	*	*			trans	-161.9	77.9	162.5	-143.6	0	0	0	0	112.3
267	V	46.1	Very low	45.7	Very low	146 Å²	146	119.8 Å²	119.8	89%	0.885	75%	0.747	S	S	*	*			trans	-105.4	100.9	152.2	179.7	0	0	0	0	105.5
268	K	50	Low	44.2	Very low	183 Å²	183	121.9 Å²	121.9	80%	0.796	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-69.1	128.9	171	-76.8	-179.8	174.3	179.4	0	108.7
269	P	42.6	Very low	43.1	Very low	124 Å²	124	126.7 Å²	126.7	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-80	130.6	159.9	13.8	2.1	0	0	0	108.8
270	A	39.6	Very low	42	Very low	103 Å²	103	126 Å²	126	85%	0.851	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.5	140.9	167.6	0	0	0	0	0	109.9
271	N	43.3	Very low	41.5	Very low	170 Å²	170	126.9 Å²	126.9	91%	0.909	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-57.2	141.6	-179.2	-88.5	-11.8	0	0	0	114
272	G	36.2	Very low	40.7	Very low	76 Å²	76	130.3 Å²	130.3	78%	0.784	80%	0.798	S	S	*	*			trans	-165.1	117.4	162.5	0	0	0	0	0	110.8
273	N	42.3	Very low	40.3	Very low	175 Å²	175	133.5 Å²	133.5	94%	0.936	81%	0.81	S	S	*	*			trans	-60.7	150.4	-172.5	-64.5	-27.1	0	0	0	114.6
274	G	34.7	Very low	39.5	Very low	79 Å²	79	140 Å²	140	81%	0.814	82%	0.819	S	S	*	*			trans	168.7	109.9	163.5	0	0	0	0	0	114
275	C	35.2	Very low	38.7	Very low	119 Å²	119	145 Å²	145	80%	0.804	82%	0.824	S	S	*	*			trans	-74.3	139	174.8	-141.4	0	0	0	0	111.1
276	N	31.6	Very low	38.1	Very low	141 Å²	141	149.6 Å²	149.6	75%	0.754	83%	0.832	S	S	*	*				157.2	132.9	123.8	-80.7	-13.2	0	0	0	114.5
277	S	30	Very low	37.5	Very low	104 Å²	104	156 Å²	156	73%	0.727	84%	0.841	S	S	*	*			trans	78.9	126.3	140.6	-60.1	0	0	0	0	122.3
278	S	31.1	Very low	37	Very low	105 Å²	105	154.7 Å²	154.7	73%	0.734	84%	0.839	S	S	*	*			trans	72	101.7	139.5	41.3	0	0	0	0	119.8
279	E	36.8	Very low	36.1	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.883	83%	0.83	S	S	*	*				59.2	105.2	116.1	-158.1	162.4	-152.1	0	0	118.9
280	S	32.2	Very low	35.7	Very low	112 Å²	112	152 Å²	152	78%	0.783	83%	0.834	S	S	*	*			trans	-161.3	113.8	131.7	-162.6	0	0	0	0	111.1	R282	S280-R282 PolarHBondContact O-N 2.88Å
281	K	42.8	Very low	35.4	Very low	200 Å²	200	154.7 Å²	154.7	87%	0.87	83%	0.833	S	S	*	*			trans	-58.6	119.6	164.2	-77.2	171.4	177	167.5	0	109.2
282	R	32.8	Very low	34.9	Very low	236 Å²	236	150.9 Å²	150.9	89%	0.891	82%	0.817	S	S	*	*			trans	-147.1	97.1	150.5	-124.9	171.3	167.9	172.6	-2.9	111.3	S280 R284	S280-R282 PolarHBondContact O-N 2.88Å; R282-R284 PolarHBondContact O-N 2.99Å; R282-R284 VanDerWaalsContact O-N 3.07Å
283	T	42.7	Very low	34.9	Very low	148 Å²	148	156 Å²	156	91%	0.908	82%	0.821	S	S	*	*			trans	-42.7	106.4	163.8	-9.9	0	0	0	0	110.1
284	R	33.8	Very low	34.8	Very low	238 Å²	238	153.5 Å²	153.5	90%	0.898	81%	0.812	S	S	*	*			trans	-115.4	85.7	167.6	-146.3	174.6	-172.3	176.7	1.6	109.5	R282 N286	R282-R284 PolarHBondContact O-N 2.99Å; R282-R284 VanDerWaalsContact O-N 3.07Å; R284-N286 PolarHBondContact O-N 3.13Å
285	R	33.3	Very low	34.9	Very low	227 Å²	227	154 Å²	154	86%	0.857	80%	0.803	S	S	*	*			trans	-17.1	116.6	155.3	-161.2	172	-175.3	170.9	1.4	111.8	R287	R285-R287 VanDerWaalsContact C-N 3.35Å; R285-R287 PolarHBondContact O-N 2.9Å
286	N	36	Very low	35.4	Very low	165 Å²	165	157.3 Å²	157.3	88%	0.882	80%	0.799	S	S	*	*			trans	-51.1	101.3	161.4	-93.8	-15	0	0	0	108.1	R284	R284-N286 PolarHBondContact O-N 3.13Å
287	R	33.8	Very low	36.3	Very low	236 Å²	236	154.3 Å²	154.3	89%	0.891	78%	0.783	S	S	*	*			trans	-98.8	95.4	161.6	-137.9	179.4	-167.4	-169.5	3.5	104.6	R285 G289	R285-R287 VanDerWaalsContact C-N 3.35Å; R285-R287 PolarHBondContact O-N 2.9Å; R287-G289 PolarHBondContact O-N 3.44Å
288	S	35.6	Very low	37.5	Very low	119 Å²	119	154.4 Å²	154.4	83%	0.832	78%	0.781	S	S	*	*			trans	-53.1	81.4	149.6	36.7	0	0	0	0	107.6	E290	S288-E290 PolarHBondContact O-N 3.01Å; S288-E290 VanDerWaalsContact O-N 3.14Å
289	G	31.1	Very low	39.1	Very low	59 Å²	59	152.4 Å²	152.4	61%	0.608	77%	0.767	S	S	*	*			trans	-74.6	90	159.5	0	0	0	0	0	106	R287 L291	R287-G289 PolarHBondContact O-N 3.44Å; G289-L291 PolarHBondContact O-N 3.27Å
290	E	35.2	Very low	40.5	Very low	190 Å²	190	147.8 Å²	147.8	89%	0.888	75%	0.745	S	S	*	*			trans	-49.8	95.9	147.6	-102.5	176.3	134.5	0	0	106.4	S288	S288-E290 PolarHBondContact O-N 3.01Å; S288-E290 VanDerWaalsContact O-N 3.14Å
291	L	32.9	Very low	42.2	Very low	160 Å²	160	148.9 Å²	148.9	84%	0.838	74%	0.736	S	S	*	*			trans	-56.2	122.4	157.5	-93.3	145.8	0	0	0	104.9	G289 E293	G289-L291 PolarHBondContact O-N 3.27Å; L291-E293 PolarHBondContact O-N 3.41Å
292	P	33.3	Very low	43.6	Very low	90 Å²	90	145.2 Å²	145.2	58%	0.584	72%	0.722	S	S	*	*			trans	-57.3	134.1	178.8	23.3	-30	0	0	0	107.3	T294	P292-T294 HydrophobicContact CB-CG2 3.96Å; P292-T294 HydrophobicContact CG-CG2 4.42Å; P292-T294 PolarHBondContact O-N 2.91Å; P292-T294 PolarHBondContact O-OG1 3.36Å
293	E	35.2	Very low	45.5	Very low	185 Å²	185	136 Å²	136	86%	0.864	69%	0.69	S	S	*	*			trans	-64.8	45.4	173.3	-134.6	-166.7	170.2	0	0	110.5	L291 S295	L291-E293 PolarHBondContact O-N 3.41Å; E293-S295 VanDerWaalsContact C-N 3.28Å; E293-S295 PolarHBondContact O-N 3.4Å; E293-S295 VanDerWaalsContact O-N 3.09Å
294	T	39.6	Very low	46.9	Very low	122 Å²	122	132 Å²	132	75%	0.748	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	63.6	-177.8	41.7	0	0	0	0	110	P292	P292-T294 HydrophobicContact CB-CG2 3.96Å; P292-T294 HydrophobicContact CG-CG2 4.42Å; P292-T294 PolarHBondContact O-N 2.91Å; P292-T294 PolarHBondContact O-OG1 3.36Å
295	S	38.6	Very low	48.7	Very low	88 Å²	88	122.9 Å²	122.9	62%	0.615	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.3	41.8	157.9	-170.8	0	0	0	0	113.2	E293 N297	E293-S295 VanDerWaalsContact C-N 3.28Å; E293-S295 PolarHBondContact O-N 3.4Å; E293-S295 VanDerWaalsContact O-N 3.09Å; S295-N297 PolarHBondContact O-N 3.02Å; S295-N297 PolarHBondContact OG-OD1 3.14Å
296	R	44.6	Very low	50.8	Low	189 Å²	189	114.4 Å²	114.4	71%	0.713	61%	0.612	S	S	*	*	S	Bend	trans	-69.7	87.8	150	-84.1	-177.5	175.5	171.4	-0.9	107.5
297	N	51.4	Low	53.1	Low	79 Å²	79	112.3 Å²	112.3	42%	0.422	60%	0.596	S	S	.	*			trans	-37.6	119.5	-178.8	-82.6	-24.7	0	0	0	111.4	S295 S299 Q300	S295-N297 PolarHBondContact O-N 3.02Å; S295-N297 PolarHBondContact OG-OD1 3.14Å; N297-S299 PolarHBondContact O-N 3.45Å; N297-S299 VanDerWaalsContact O-N 3.1Å; N297-Q300 HydrophobicContact CB-CB 4.48Å; N297-Q300 PolarHBondContact O-N 3.41Å
298	P	55.3	Low	55.4	Low	106 Å²	106	107.4 Å²	107.4	69%	0.688	58%	0.577	S	S	*	*	H	α-helix	trans	-53.9	-32.1	179.5	7	-16.8	0	0	0	112.6	Q300 K301 E302	P298-Q300 VanDerWaalsContact C-N 3.33Å; P298-Q300 PolarHBondContact O-N 3Å; P298-K301 PolarHBondContact O-N 3.46Å; P298-E302 PolarHBondContact O-N 2.87Å; P298-E302 VanDerWaalsContact O-N 3.1Å
299	S	64.9	Low	57.6	Low	62 Å²	62	104 Å²	104	43%	0.434	55%	0.551	S	S	.	*	H	α-helix	trans	-58.1	-39	173.8	62.7	0	0	0	0	113.2	N297 E302 L303	N297-S299 PolarHBondContact O-N 3.45Å; N297-S299 VanDerWaalsContact O-N 3.1Å; S299-E302 PolarHBondContact O-N 3.04Å; S299-L303 WeakPolarHBondContact O-CD1 3.2Å; S299-L303 PolarHBondContact O-N 2.85Å
300	Q	65	Low	60.2	Low	93 Å²	93	101.4 Å²	101.4	44%	0.435	52%	0.523	S	S	.	.	H	α-helix	trans	-71.8	-38.3	-178.8	-168.7	-179.9	-24	0	0	112	N297 P298 E302 L303 V304	N297-Q300 HydrophobicContact CB-CB 4.48Å; N297-Q300 PolarHBondContact O-N 3.41Å; P298-Q300 VanDerWaalsContact C-N 3.33Å; P298-Q300 PolarHBondContact O-N 3Å; Q300-E302 VanDerWaalsContact C-N 3.31Å; Q300-L303 PolarHBondContact O-N 3.4Å; Q300-V304 VanDerWaalsContact O-CG2 3.32Å; Q300-V304 WeakPolarHBondContact O-CG2 3.47Å; Q300-V304 PolarHBondContact O-N 2.89Å
301	K	67.4	Low	62.7	Low	134 Å²	134	97.8 Å²	97.8	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-39.2	174.4	-69.4	-178.5	-178.1	172.1	0	111	P298 A305	P298-K301 PolarHBondContact O-N 3.46Å; K301-A305 WeakPolarHBondContact O-CB 3.43Å; K301-A305 PolarHBondContact O-N 3.36Å; K301-A305 VanDerWaalsContact O-N 3.08Å
302	E	72.5	Confident	65.3	Low	124 Å²	124	90.5 Å²	90.5	58%	0.579	47%	0.468	S	S	*	.	H	α-helix	trans	-66.9	-44.8	176.1	-167.7	175.9	174.3	0	0	112.3	P298 S299 Q300 V304 A305 N306	P298-E302 PolarHBondContact O-N 2.87Å; P298-E302 VanDerWaalsContact O-N 3.1Å; S299-E302 PolarHBondContact O-N 3.04Å; Q300-E302 VanDerWaalsContact C-N 3.31Å; E302-V304 PolarHBondContact O-N 3.13Å; E302-A305 PolarHBondContact O-N 2.89Å; E302-N306 WeakPolarHBondContact O-CB 3.33Å; E302-N306 VanDerWaalsContact O-CG 3.29Å; E302-N306 PolarHBondContact O-N 2.93Å; E302-N306 PolarHBondContact O-ND2 3.34Å
303	L	72.7	Confident	67.9	Low	42 Å²	42	86.5 Å²	86.5	22%	0.22	44%	0.442	C	S	.	.	H	α-helix	trans	-59.2	-44	174.7	-93.8	95	0	0	0	112.5	L243 I247 S299 Q300 A305 N306 K307	L243-L303 HydrophobicContact CD1-CB 4.3Å; L243-L303 HydrophobicContact CD1-CD2 4.09Å; L243-L303 HydrophobicContact CD1-CG 4.15Å; I247-L303 HydrophobicContact CG1-CD2 3.86Å; S299-L303 WeakPolarHBondContact O-CD1 3.2Å; S299-L303 PolarHBondContact O-N 2.85Å; Q300-L303 PolarHBondContact O-N 3.4Å; L303-A305 VanDerWaalsContact C-N 3.34Å; L303-A305 PolarHBondContact O-N 3.49Å; L303-N306 PolarHBondContact O-N 3.49Å; L303-K307 PolarHBondContact O-N 3.07Å
304	V	72.3	Confident	70.6	Confident	63 Å²	63	80.3 Å²	80.3	38%	0.382	41%	0.414	S	S	.	.	H	α-helix	trans	-66.7	-36.3	178.4	173.1	0	0	0	0	111.6	Q300 E302 R308	Q300-V304 VanDerWaalsContact O-CG2 3.32Å; Q300-V304 WeakPolarHBondContact O-CG2 3.47Å; Q300-V304 PolarHBondContact O-N 2.89Å; E302-V304 PolarHBondContact O-N 3.13Å; V304-R308 WeakPolarHBondContact O-CG 3.39Å; V304-R308 PolarHBondContact O-N 2.89Å
305	A	71.3	Confident	73.2	Confident	48 Å²	48	76.5 Å²	76.5	40%	0.397	39%	0.39	S	S	.	.	H	α-helix	trans	-66.1	-45.4	174.5	0	0	0	0	0	111.4	K301 E302 L303 K307 R308 V309	K301-A305 WeakPolarHBondContact O-CB 3.43Å; K301-A305 PolarHBondContact O-N 3.36Å; K301-A305 VanDerWaalsContact O-N 3.08Å; E302-A305 PolarHBondContact O-N 2.89Å; L303-A305 VanDerWaalsContact C-N 3.34Å; L303-A305 PolarHBondContact O-N 3.49Å; A305-K307 PolarHBondContact O-N 3.42Å; A305-R308 PolarHBondContact O-N 3.33Å; A305-V309 PolarHBondContact O-N 2.9Å
306	N	78.7	Confident	75.7	Confident	48 Å²	48	72.3 Å²	72.3	26%	0.257	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-42.1	177.5	-71.2	-15.9	0	0	0	111.5	I150 E302 L303 R308 V309 I310	I150-N306 HydrophobicContact CD1-CB 4.46Å; E302-N306 WeakPolarHBondContact O-CB 3.33Å; E302-N306 VanDerWaalsContact O-CG 3.29Å; E302-N306 PolarHBondContact O-N 2.93Å; E302-N306 PolarHBondContact O-ND2 3.34Å; L303-N306 PolarHBondContact O-N 3.49Å; N306-R308 VanDerWaalsContact C-N 3.29Å; N306-R308 PolarHBondContact O-N 3.44Å; N306-V309 PolarHBondContact O-N 3.46Å; N306-V309 VanDerWaalsContact O-N 3.17Å; N306-I310 HydrophobicContact CB-CD1 4.42Å; N306-I310 WeakPolarHBondContact O-CD1 3.38Å; N306-I310 VanDerWaalsContact O-CG1 3.22Å; N306-I310 WeakPolarHBondContact O-CG1 3.31Å; N306-I310 PolarHBondContact O-N 2.87Å
307	K	82.8	Confident	77.9	Confident	122 Å²	122	64 Å²	64	53%	0.53	33%	0.331	S	S	.	.	H	α-helix	trans	-51.6	-46.7	175.1	-172.1	173.4	177.8	179.9	0	112.7	L243 I247 L303 A305 I310 H311	L243-K307 HydrophobicContact CD2-CB 3.67Å; L243-K307 HydrophobicContact CD2-CG 3.84Å; I247-K307 HydrophobicContact CD1-CD 4.23Å; L303-K307 PolarHBondContact O-N 3.07Å; A305-K307 PolarHBondContact O-N 3.42Å; K307-I310 PolarHBondContact O-N 3.42Å; K307-H311 WeakPolarHBondContact O-CB 3.39Å; K307-H311 PolarHBondContact O-N 3.38Å
308	R	82.9	Confident	80	Confident	132 Å²	132	63.8 Å²	63.8	50%	0.498	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-41.5	-177.9	-65.1	174	-168.7	-126	5.3	111.8	V304 A305 N306 M312	V304-R308 WeakPolarHBondContact O-CG 3.39Å; V304-R308 PolarHBondContact O-N 2.89Å; A305-R308 PolarHBondContact O-N 3.33Å; N306-R308 VanDerWaalsContact C-N 3.29Å; N306-R308 PolarHBondContact O-N 3.44Å; R308-M312 PolarHBondContact O-N 2.85Å; R308-M312 VanDerWaalsContact O-N 3.14Å
309	V	82.1	Confident	81.8	Confident	48 Å²	48	61.2 Å²	61.2	29%	0.291	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-42.8	178	176.4	0	0	0	0	110.7	A305 N306 M312 L313	A305-V309 PolarHBondContact O-N 2.9Å; N306-V309 PolarHBondContact O-N 3.46Å; N306-V309 VanDerWaalsContact O-N 3.17Å; V309-M312 WeakPolarHBondContact O-CB 3.31Å; V309-M312 PolarHBondContact O-N 3.29Å; V309-L313 HydrophobicContact CG1-CD1 4.19Å; V309-L313 VanDerWaalsContact O-CG 3.31Å; V309-L313 WeakPolarHBondContact O-CG 3.23Å; V309-L313 PolarHBondContact O-N 3.41Å; V309-L313 VanDerWaalsContact O-N 3.12Å
310	I	84.5	Confident	83.1	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-45.8	178.4	-64.1	157.1	0	0	0	110.9	I150 Y236 I239 L243 N306 K307 M312 L313 I314	I150-I310 HydrophobicContact CD1-CD1 3.7Å; I150-I310 HydrophobicContact CD1-CG1 3.9Å; Y236-I310 HydrophobicContact CD1-CG2 4.41Å; I239-I310 HydrophobicContact CG2-CB 4.46Å; I239-I310 HydrophobicContact CG2-CD1 3.23Å; I239-I310 HydrophobicContact CG2-CG1 3.64Å; I239-I310 HydrophobicContact CG2-CG2 3.97Å; L243-I310 HydrophobicContact CD2-CD1 3.87Å; N306-I310 HydrophobicContact CB-CD1 4.42Å; N306-I310 WeakPolarHBondContact O-CD1 3.38Å; N306-I310 VanDerWaalsContact O-CG1 3.22Å; N306-I310 WeakPolarHBondContact O-CG1 3.31Å; N306-I310 PolarHBondContact O-N 2.87Å; K307-I310 PolarHBondContact O-N 3.42Å; I310-M312 VanDerWaalsContact C-N 3.28Å; I310-M312 PolarHBondContact O-N 2.99Å; I310-L313 WeakPolarHBondContact O-CB 3.18Å; I310-L313 PolarHBondContact O-N 2.98Å; I310-I314 HydrophobicContact CG2-CD1 3.81Å; I310-I314 HydrophobicContact CG2-CG1 4.26Å; I310-I314 WeakPolarHBondContact O-CG1 3.39Å; I310-I314 PolarHBondContact O-N 3.38Å
311	H	88.1	Confident	84.5	Confident	115 Å²	115	56.4 Å²	56.4	53%	0.532	28%	0.283	S	S	.	.	H	α-helix	trans	-58.6	-42.2	178.8	-169.6	-103	0	0	0	111.7	K307 L313 I314 V315 M370	K307-H311 WeakPolarHBondContact O-CB 3.39Å; K307-H311 PolarHBondContact O-N 3.38Å; H311-L313 VanDerWaalsContact C-N 3.32Å; H311-L313 PolarHBondContact O-N 3.38Å; H311-I314 PolarHBondContact O-N 3.27Å; H311-V315 WeakPolarHBondContact O-CG2 3.48Å; H311-V315 PolarHBondContact O-N 2.8Å; H311-M370 VanDerWaalsContact ND1-CE 3.29Å; H311-M370 WeakPolarHBondContact ND1-CE 3.38Å
312	M	88.8	Confident	85.8	Confident	7 Å²	7	55 Å²	55	3%	0.034	28%	0.281	C	S	.	.	H	α-helix	trans	-57.2	-44.6	172.4	177.8	-172.3	82	0	0	112.4	R308 V309 I310 V315 I316 V366 Y367 M370 N371	R308-M312 PolarHBondContact O-N 2.85Å; R308-M312 VanDerWaalsContact O-N 3.14Å; V309-M312 WeakPolarHBondContact O-CB 3.31Å; V309-M312 PolarHBondContact O-N 3.29Å; I310-M312 VanDerWaalsContact C-N 3.28Å; I310-M312 PolarHBondContact O-N 2.99Å; M312-V315 PolarHBondContact O-N 3.46Å; M312-I316 HydrophobicContact CG-CD1 4.24Å; M312-I316 WeakPolarHBondContact O-CG1 3.37Å; M312-I316 PolarHBondContact O-N 3.13Å; M312-I316 VanDerWaalsContact O-N 3.08Å; M312-V366 HydrophobicContact CG-CG1 3.69Å; M312-Y367 HydrophobicContact CE-CD1 3.91Å; M312-Y367 HydrophobicContact CE-CE1 3.95Å; M312-Y367 HydrophobicContact SD-CD1 3.86Å; M312-Y367 HydrophobicContact SD-CE1 4.41Å; M312-M370 HydrophobicContact CB-CB 3.83Å; M312-M370 HydrophobicContact CB-CE 4.07Å; M312-M370 HydrophobicContact CB-SD 4.28Å; M312-M370 HydrophobicContact CG-CB 3.65Å; M312-M370 HydrophobicContact CG-SD 4.34Å; M312-M370 HydrophobicContact SD-CB 4.05Å; M312-N371 HydrophobicContact SD-CB 3.62Å
313	L	88.2	Confident	86.8	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-69.4	-38.5	-178.8	-67.7	169.6	0	0	0	112.9	I142 R146 Y236 V309 I310 H311 V315 I316 V317	I142-L313 HydrophobicContact CG2-CD2 3.73Å; R146-L313 HydrophobicContact CB-CD1 4.28Å; R146-L313 HydrophobicContact CG-CD1 3.47Å; R146-L313 VanDerWaalsContact CG-CD1 3.47Å; Y236-L313 HydrophobicContact CE1-CB 3.7Å; Y236-L313 HydrophobicContact CE1-CD1 4.08Å; Y236-L313 WeakPolarHBondContact OH-CB 3.35Å; V309-L313 HydrophobicContact CG1-CD1 4.19Å; V309-L313 VanDerWaalsContact O-CG 3.31Å; V309-L313 WeakPolarHBondContact O-CG 3.23Å; V309-L313 PolarHBondContact O-N 3.41Å; V309-L313 VanDerWaalsContact O-N 3.12Å; I310-L313 WeakPolarHBondContact O-CB 3.18Å; I310-L313 PolarHBondContact O-N 2.98Å; H311-L313 VanDerWaalsContact C-N 3.32Å; H311-L313 PolarHBondContact O-N 3.38Å; L313-V315 VanDerWaalsContact C-N 3.3Å; L313-V315 PolarHBondContact O-N 3.22Å; L313-I316 HydrophobicContact CD2-CD1 4.36Å; L313-I316 WeakPolarHBondContact O-CB 3.26Å; L313-I316 PolarHBondContact O-N 2.96Å; L313-V317 VanDerWaalsContact O-CG2 3.25Å; L313-V317 WeakPolarHBondContact O-CG2 3.47Å; L313-V317 PolarHBondContact O-N 3.41Å
314	I	91.3	Very high	87.8	Confident	55 Å²	55	48.3 Å²	48.3	28%	0.282	25%	0.248	S	C	.	.	H	α-helix	trans	-59.4	-44.7	172.8	-68.1	170	0	0	0	110	Y236 I310 H311 I316 V317 V318	Y236-I314 HydrophobicContact CD1-CG1 4.17Å; Y236-I314 HydrophobicContact CG-CG1 4.05Å; I310-I314 HydrophobicContact CG2-CD1 3.81Å; I310-I314 HydrophobicContact CG2-CG1 4.26Å; I310-I314 WeakPolarHBondContact O-CG1 3.39Å; I310-I314 PolarHBondContact O-N 3.38Å; H311-I314 PolarHBondContact O-N 3.27Å; I314-I316 VanDerWaalsContact C-N 3.32Å; I314-I316 PolarHBondContact O-N 3.22Å; I314-V317 PolarHBondContact O-N 2.89Å; I314-V318 HydrophobicContact CG2-CG2 4.34Å; I314-V318 WeakPolarHBondContact O-CG2 3.35Å; I314-V318 PolarHBondContact O-N 3.3Å
315	V	93.6	Very high	88.9	Confident	41 Å²	41	47.8 Å²	47.8	25%	0.248	25%	0.245	C	C	.	.	H	α-helix	trans	-58.3	-44.3	175.9	169.3	0	0	0	0	111.3	H311 M312 L313 V317 V318 L319 V366 M370	H311-V315 WeakPolarHBondContact O-CG2 3.48Å; H311-V315 PolarHBondContact O-N 2.8Å; M312-V315 PolarHBondContact O-N 3.46Å; L313-V315 VanDerWaalsContact C-N 3.3Å; L313-V315 PolarHBondContact O-N 3.22Å; V315-V317 VanDerWaalsContact C-N 3.34Å; V315-V317 PolarHBondContact O-N 3.03Å; V315-V318 PolarHBondContact O-N 3.2Å; V315-L319 HydrophobicContact CG1-CD1 3.68Å; V315-L319 HydrophobicContact CG1-CG 4.39Å; V315-L319 WeakPolarHBondContact O-CB 3.37Å; V315-L319 VanDerWaalsContact O-CG 3.28Å; V315-L319 WeakPolarHBondContact O-CG 3.43Å; V315-L319 PolarHBondContact O-N 3.28Å; V315-V366 HydrophobicContact CG1-CG1 4.31Å; V315-V366 HydrophobicContact CG1-CG2 4.19Å; V315-M370 HydrophobicContact CB-SD 4.26Å; V315-M370 HydrophobicContact CG1-SD 4.24Å; V315-M370 HydrophobicContact CG2-CE 4.07Å; V315-M370 HydrophobicContact CG2-SD 4.24Å
316	I	91.7	Very high	90	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-45.3	177.1	-67.7	165.5	0	0	0	111.1	L139 M312 L313 I314 L319 F320 V366 Y367	L139-I316 HydrophobicContact CD2-CG2 3.64Å; M312-I316 HydrophobicContact CG-CD1 4.24Å; M312-I316 WeakPolarHBondContact O-CG1 3.37Å; M312-I316 PolarHBondContact O-N 3.13Å; M312-I316 VanDerWaalsContact O-N 3.08Å; L313-I316 HydrophobicContact CD2-CD1 4.36Å; L313-I316 WeakPolarHBondContact O-CB 3.26Å; L313-I316 PolarHBondContact O-N 2.96Å; I314-I316 VanDerWaalsContact C-N 3.32Å; I314-I316 PolarHBondContact O-N 3.22Å; I316-L319 PolarHBondContact O-N 3.46Å; I316-F320 WeakPolarHBondContact O-CB 3.38Å; I316-F320 PolarHBondContact O-N 3.12Å; I316-V366 HydrophobicContact CD1-CB 4.48Å; I316-V366 HydrophobicContact CD1-CG1 3.96Å; I316-V366 HydrophobicContact CG1-CB 3.99Å; I316-V366 HydrophobicContact CG1-CG1 3.57Å; I316-V366 HydrophobicContact CG1-CG2 4.36Å; I316-Y367 HydrophobicContact CD1-CD1 4.07Å; I316-Y367 HydrophobicContact CD1-CE1 3.26Å
317	V	91	Very high	90.6	Very high	14 Å²	14	45.6 Å²	45.6	9%	0.085	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-45.9	-180	174.8	0	0	0	0	111.2	M232 Y236 L313 I314 V315 L319 F320 F321	M232-V317 HydrophobicContact CB-CG1 4.04Å; M232-V317 HydrophobicContact CE-CG1 4.33Å; M232-V317 HydrophobicContact SD-CG1 4.01Å; M232-V317 HydrophobicContact SD-CG2 3.85Å; Y236-V317 HydrophobicContact CD2-CG2 4.06Å; Y236-V317 HydrophobicContact CE2-CB 4.45Å; Y236-V317 HydrophobicContact CE2-CG2 3.37Å; L313-V317 VanDerWaalsContact O-CG2 3.25Å; L313-V317 WeakPolarHBondContact O-CG2 3.47Å; L313-V317 PolarHBondContact O-N 3.41Å; I314-V317 PolarHBondContact O-N 2.89Å; V315-V317 VanDerWaalsContact C-N 3.34Å; V315-V317 PolarHBondContact O-N 3.03Å; V317-L319 VanDerWaalsContact C-N 3.34Å; V317-L319 PolarHBondContact O-N 2.92Å; V317-F320 WeakPolarHBondContact O-CB 3.27Å; V317-F320 PolarHBondContact O-N 3.12Å; V317-F321 HydrophobicContact CG1-CD2 3.87Å; V317-F321 HydrophobicContact CG1-CE2 3.65Å; V317-F321 WeakPolarHBondContact O-CD2 3.13Å; V317-F321 PolarHBondContact O-N 3.39Å; V317-F321 VanDerWaalsContact O-N 3.09Å
318	V	94.1	Very high	91	Very high	75 Å²	75	40.6 Å²	40.6	46%	0.455	21%	0.207	S	C	.	.	H	α-helix	trans	-59.5	-46.3	176.9	170.4	0	0	0	0	110.7	I314 V315 F320 F321 L322	I314-V318 HydrophobicContact CG2-CG2 4.34Å; I314-V318 WeakPolarHBondContact O-CG2 3.35Å; I314-V318 PolarHBondContact O-N 3.3Å; V315-V318 PolarHBondContact O-N 3.2Å; V318-F320 VanDerWaalsContact C-N 3.33Å; V318-F320 PolarHBondContact O-N 3.32Å; V318-F321 PolarHBondContact O-N 2.73Å; V318-L322 HydrophobicContact CG1-CD1 3.87Å; V318-L322 HydrophobicContact CG1-CG 4.33Å; V318-L322 WeakPolarHBondContact O-CG 3.48Å; V318-L322 PolarHBondContact O-N 2.95Å
319	L	94.4	Very high	91.4	Very high	52 Å²	52	38.4 Å²	38.4	27%	0.272	21%	0.208	S	C	.	.	H	α-helix	trans	-66.2	-35.3	179.7	-69	168.4	0	0	0	112.5	V315 I316 V317 L322 C323 V362 V366	V315-L319 HydrophobicContact CG1-CD1 3.68Å; V315-L319 HydrophobicContact CG1-CG 4.39Å; V315-L319 WeakPolarHBondContact O-CB 3.37Å; V315-L319 VanDerWaalsContact O-CG 3.28Å; V315-L319 WeakPolarHBondContact O-CG 3.43Å; V315-L319 PolarHBondContact O-N 3.28Å; I316-L319 PolarHBondContact O-N 3.46Å; V317-L319 VanDerWaalsContact C-N 3.34Å; V317-L319 PolarHBondContact O-N 2.92Å; L319-L322 HydrophobicContact CD2-CD1 4.3Å; L319-L322 PolarHBondContact O-N 2.9Å; L319-C323 WeakPolarHBondContact O-CB 3.4Å; L319-C323 PolarHBondContact O-N 3.48Å; L319-C323 PolarHBondContact O-SG 3.47Å; L319-V362 HydrophobicContact CB-CG1 3.81Å; L319-V362 HydrophobicContact CD1-CG1 3.41Å; L319-V362 VanDerWaalsContact CD1-CG1 3.41Å; L319-V362 HydrophobicContact CG-CG1 4.16Å; L319-V366 HydrophobicContact CD1-CG2 3.79Å
320	F	92.9	Very high	91.8	Very high	11 Å²	11	37.1 Å²	37.1	5%	0.048	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-51.9	171.3	175.9	-91.2	0	0	0	110.6	T136 L139 I316 V317 V318 L322 C323 W324	T136-F320 HydrophobicContact CG2-CZ 4.12Å; T136-F320 VanDerWaalsContact OG1-CZ 3.23Å; T136-F320 WeakPolarHBondContact OG1-CZ 3.46Å; L139-F320 HydrophobicContact CD1-CB 3.96Å; L139-F320 HydrophobicContact CD1-CD1 4.41Å; L139-F320 HydrophobicContact CD1-CD2 3.47Å; L139-F320 VanDerWaalsContact CD1-CD2 3.47Å; L139-F320 HydrophobicContact CD1-CE2 4.07Å; L139-F320 HydrophobicContact CD1-CG 3.68Å; I316-F320 WeakPolarHBondContact O-CB 3.38Å; I316-F320 PolarHBondContact O-N 3.12Å; V317-F320 WeakPolarHBondContact O-CB 3.27Å; V317-F320 PolarHBondContact O-N 3.12Å; V318-F320 VanDerWaalsContact C-N 3.33Å; V318-F320 PolarHBondContact O-N 3.32Å; F320-L322 PolarHBondContact O-N 3.35Å; F320-C323 PolarHBondContact O-N 3.43Å; F320-W324 AromaticContact CD2-CD1 3.36Å; F320-W324 HydrophobicContact CD2-CG 4.5Å; F320-W324 AromaticContact CD2-NE1 3.6Å; F320-W324 AromaticContact CE2-CD1 3.26Å; F320-W324 HydrophobicContact CE2-CG 4.14Å; F320-W324 AromaticContact CE2-NE1 3.37Å; F320-W324 AromaticContact CG-CD1 3.85Å; F320-W324 AromaticContact CZ-CD1 3.66Å; F320-W324 HydrophobicContact CZ-CG 4.15Å; F320-W324 WeakPolarHBondContact O-CB 3.31Å; F320-W324 PolarHBondContact O-N 2.95Å
321	F	92.5	Very high	92	Very high	43 Å²	43	38.7 Å²	38.7	19%	0.189	21%	0.209	C	C	.	.	H	α-helix	trans	-60.7	-44.2	177.7	-76.2	-68.8	0	0	0	112.3	F225 M232 V317 V318 C323 W324 T325	F225-F321 HydrophobicContact CD1-CE1 4.4Å; F225-F321 AromaticContact CD2-CD1 3.92Å; F225-F321 HydrophobicContact CD2-CD1 3.92Å; F225-F321 AromaticContact CD2-CE1 3.86Å; F225-F321 HydrophobicContact CD2-CE1 3.86Å; F225-F321 HydrophobicContact CE1-CD1 4.13Å; F225-F321 HydrophobicContact CE1-CE1 4.31Å; F225-F321 AromaticContact CE2-CD1 3.35Å; F225-F321 HydrophobicContact CE2-CD1 3.35Å; F225-F321 AromaticContact CE2-CE1 3.78Å; F225-F321 HydrophobicContact CE2-CE1 3.78Å; F225-F321 HydrophobicContact CE2-CG 4.46Å; F225-F321 HydrophobicContact CG-CE1 4.19Å; F225-F321 AromaticContact CZ-CD1 3.46Å; F225-F321 HydrophobicContact CZ-CD1 3.46Å; F225-F321 VanDerWaalsContact CZ-CD1 3.46Å; F225-F321 HydrophobicContact CZ-CE1 4.01Å; M232-F321 HydrophobicContact CE-CE2 3.6Å; M232-F321 HydrophobicContact CE-CZ 3.58Å; V317-F321 HydrophobicContact CG1-CD2 3.87Å; V317-F321 HydrophobicContact CG1-CE2 3.65Å; V317-F321 WeakPolarHBondContact O-CD2 3.13Å; V317-F321 PolarHBondContact O-N 3.39Å; V317-F321 VanDerWaalsContact O-N 3.09Å; V318-F321 PolarHBondContact O-N 2.73Å; F321-C323 VanDerWaalsContact C-N 3.32Å; F321-C323 PolarHBondContact O-N 3.3Å; F321-W324 PolarHBondContact O-N 3.01Å; F321-T325 VanDerWaalsContact O-CB 3.32Å; F321-T325 WeakPolarHBondContact O-CB 3.2Å; F321-T325 PolarHBondContact O-N 3.04Å; F321-T325 PolarHBondContact O-OG1 3.22Å
322	L	94.8	Very high	92.1	Very high	105 Å²	105	34 Å²	34	55%	0.55	19%	0.19	S	C	.	.	H	α-helix	trans	-60.2	-39.8	178	-70.2	172.3	0	0	0	112.9	V318 L319 F320 P326	V318-L322 HydrophobicContact CG1-CD1 3.87Å; V318-L322 HydrophobicContact CG1-CG 4.33Å; V318-L322 WeakPolarHBondContact O-CG 3.48Å; V318-L322 PolarHBondContact O-N 2.95Å; L319-L322 HydrophobicContact CD2-CD1 4.3Å; L319-L322 PolarHBondContact O-N 2.9Å; F320-L322 PolarHBondContact O-N 3.35Å; L322-P326 WeakPolarHBondContact O-CD 3.47Å
323	C	95	Very high	92	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-73.1	-36.4	179.7	-64.8	0	0	0	0	112.7	L319 F320 F321 L355 S356	L319-C323 WeakPolarHBondContact O-CB 3.4Å; L319-C323 PolarHBondContact O-N 3.48Å; L319-C323 PolarHBondContact O-SG 3.47Å; F320-C323 PolarHBondContact O-N 3.43Å; F321-C323 VanDerWaalsContact C-N 3.32Å; F321-C323 PolarHBondContact O-N 3.3Å; C323-L355 WeakPolarHBondContact CB-O 2.98Å; C323-S356 WeakPolarHBondContact O-CA 3.34Å
324	W	93.9	Very high	91.8	Very high	18 Å²	18	39.8 Å²	39.8	7%	0.068	21%	0.213	C	C	.	.	H	α-helix	trans	-94.6	-24.5	-172.1	-73.6	102.3	0	0	0	114.5	V132 F225 F320 F321 I327 Y328 S359	V132-W324 HydrophobicContact CB-CH2 4.06Å; V132-W324 HydrophobicContact CB-CZ2 4.34Å; V132-W324 HydrophobicContact CB-CZ3 4.36Å; V132-W324 HydrophobicContact CG1-CD2 4.3Å; V132-W324 HydrophobicContact CG1-CE3 4.02Å; V132-W324 HydrophobicContact CG1-CH2 3.83Å; V132-W324 HydrophobicContact CG1-CZ2 4.01Å; V132-W324 HydrophobicContact CG1-CZ3 3.77Å; V132-W324 HydrophobicContact CG2-CH2 3.01Å; V132-W324 HydrophobicContact CG2-CZ2 3.52Å; V132-W324 HydrophobicContact CG2-CZ3 3.59Å; F225-W324 HydrophobicContact CD2-CB 4.33Å; F225-W324 HydrophobicContact CE2-CB 4.21Å; F320-W324 AromaticContact CD2-CD1 3.36Å; F320-W324 HydrophobicContact CD2-CG 4.5Å; F320-W324 AromaticContact CD2-NE1 3.6Å; F320-W324 AromaticContact CE2-CD1 3.26Å; F320-W324 HydrophobicContact CE2-CG 4.14Å; F320-W324 AromaticContact CE2-NE1 3.37Å; F320-W324 AromaticContact CG-CD1 3.85Å; F320-W324 AromaticContact CZ-CD1 3.66Å; F320-W324 HydrophobicContact CZ-CG 4.15Å; F320-W324 WeakPolarHBondContact O-CB 3.31Å; F320-W324 PolarHBondContact O-N 2.95Å; F321-W324 PolarHBondContact O-N 3.01Å; W324-I327 HydrophobicContact CE3-CG2 3.67Å; W324-I327 HydrophobicContact CZ3-CG2 4.1Å; W324-I327 WeakPolarHBondContact O-CG2 3.27Å; W324-I327 PolarHBondContact O-N 2.7Å; W324-Y328 HydrophobicContact CB-CD2 4Å; W324-Y328 HydrophobicContact CB-CE2 3.94Å; W324-Y328 HydrophobicContact CD2-CE2 4.49Å; W324-Y328 HydrophobicContact CE3-CE2 4.07Å; W324-Y328 HydrophobicContact CG-CE2 4.46Å; W324-Y328 VanDerWaalsContact O-CD2 3.24Å; W324-Y328 WeakPolarHBondContact O-CD2 3.33Å; W324-Y328 PolarHBondContact O-N 3.06Å; W324-S359 WeakPolarHBondContact CZ2-OG 3.21Å; W324-S359 PolarHBondContact NE1-OG 3.25Å; W324-S359 VanDerWaalsContact NE1-OG 3.1Å
325	T	93.9	Very high	91.4	Very high	52 Å²	52	37.5 Å²	37.5	32%	0.319	20%	0.202	S	C	.	.	H	α-helix	trans	-52.6	-48.7	-178	-58.1	0	0	0	0	112.3	F225 F321 I327 Y328 V329	F225-T325 HydrophobicContact CZ-CG2 4.31Å; F225-T325 VanDerWaalsContact CZ-OG1 3.27Å; F225-T325 WeakPolarHBondContact CZ-OG1 3.12Å; F321-T325 VanDerWaalsContact O-CB 3.32Å; F321-T325 WeakPolarHBondContact O-CB 3.2Å; F321-T325 PolarHBondContact O-N 3.04Å; F321-T325 PolarHBondContact O-OG1 3.22Å; T325-I327 PolarHBondContact O-N 3.16Å; T325-Y328 PolarHBondContact O-N 3.39Å; T325-V329 HydrophobicContact CG2-CG2 3.9Å; T325-V329 VanDerWaalsContact O-CG2 3.3Å; T325-V329 WeakPolarHBondContact O-CG2 3.45Å; T325-V329 PolarHBondContact O-N 2.79Å
326	P	94.6	Very high	91.1	Very high	40 Å²	40	42.7 Å²	42.7	26%	0.26	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-38.9	-172.1	-28.6	42.5	0	0	0	113.1	L322 V329 V330 I352 L355	L322-P326 WeakPolarHBondContact O-CD 3.47Å; P326-V329 PolarHBondContact O-N 3.11Å; P326-V330 WeakPolarHBondContact O-CG2 3.25Å; P326-V330 PolarHBondContact O-N 3.43Å; P326-I352 HydrophobicContact CB-CG1 4.43Å; P326-I352 HydrophobicContact CB-CG2 4.14Å; P326-L355 HydrophobicContact CB-CD2 4.44Å; P326-L355 HydrophobicContact CG-CD2 3.71Å
327	I	90.9	Very high	90.8	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.051	24%	0.236	C	C	.	.	H	α-helix	trans	-70.4	-38	178.5	-172.1	63.7	0	0	0	111.7	W324 T325 V330 N331 I352	W324-I327 HydrophobicContact CE3-CG2 3.67Å; W324-I327 HydrophobicContact CZ3-CG2 4.1Å; W324-I327 WeakPolarHBondContact O-CG2 3.27Å; W324-I327 PolarHBondContact O-N 2.7Å; T325-I327 PolarHBondContact O-N 3.16Å; I327-V330 PolarHBondContact O-N 3.4Å; I327-N331 WeakPolarHBondContact O-CB 3.27Å; I327-N331 PolarHBondContact O-N 2.88Å; I327-N331 PolarHBondContact O-ND2 2.96Å; I327-I352 HydrophobicContact CB-CG2 3.88Å; I327-I352 HydrophobicContact CD1-CG2 3.93Å
328	Y	92.7	Very high	90.1	Very high	18 Å²	18	49.4 Å²	49.4	7%	0.071	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-37.7	175.3	-80.8	-64.5	0	0	0	112.3	L221 L224 F225 W324 T325 N331 A332	L221-Y328 HydrophobicContact CD1-CD1 4.26Å; L221-Y328 HydrophobicContact CD1-CG 4.23Å; L224-Y328 WeakPolarHBondContact CB-OH 3.26Å; F225-Y328 HydrophobicContact CB-CD2 3.94Å; F225-Y328 HydrophobicContact CB-CE1 4.5Å; F225-Y328 HydrophobicContact CB-CE2 3.93Å; F225-Y328 HydrophobicContact CB-CG 4.26Å; F225-Y328 AromaticContact CD2-CD2 3.38Å; F225-Y328 HydrophobicContact CD2-CD2 3.38Å; F225-Y328 AromaticContact CD2-CE2 3.71Å; F225-Y328 HydrophobicContact CD2-CE2 3.71Å; F225-Y328 HydrophobicContact CD2-CG 4.24Å; F225-Y328 HydrophobicContact CE2-CD2 4.02Å; F225-Y328 AromaticContact CG-CD2 3.83Å; F225-Y328 HydrophobicContact CG-CD2 3.83Å; F225-Y328 HydrophobicContact CG-CE2 4.18Å; F225-Y328 HydrophobicContact CG-CG 4.28Å; W324-Y328 HydrophobicContact CB-CD2 4Å; W324-Y328 HydrophobicContact CB-CE2 3.94Å; W324-Y328 HydrophobicContact CD2-CE2 4.49Å; W324-Y328 HydrophobicContact CE3-CE2 4.07Å; W324-Y328 HydrophobicContact CG-CE2 4.46Å; W324-Y328 VanDerWaalsContact O-CD2 3.24Å; W324-Y328 WeakPolarHBondContact O-CD2 3.33Å; W324-Y328 PolarHBondContact O-N 3.06Å; T325-Y328 PolarHBondContact O-N 3.39Å; Y328-N331 PolarHBondContact O-N 2.91Å; Y328-A332 WeakPolarHBondContact O-CB 3.3Å; Y328-A332 PolarHBondContact O-N 3.46Å
329	V	91.3	Very high	89.2	Confident	86 Å²	86	52.1 Å²	52.1	52%	0.521	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-46.8	174.2	169.9	0	0	0	0	110.8	T325 P326 N331 A332 W333	T325-V329 HydrophobicContact CG2-CG2 3.9Å; T325-V329 VanDerWaalsContact O-CG2 3.3Å; T325-V329 WeakPolarHBondContact O-CG2 3.45Å; T325-V329 PolarHBondContact O-N 2.79Å; P326-V329 PolarHBondContact O-N 3.11Å; V329-N331 PolarHBondContact O-N 3.04Å; V329-A332 PolarHBondContact O-N 3.49Å; V329-W333 WeakPolarHBondContact O-CB 3.48Å; V329-W333 PolarHBondContact O-N 2.86Å
330	V	89.3	Confident	88.5	Confident	20 Å²	20	51.3 Å²	51.3	12%	0.121	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-39.6	177.6	171.8	0	0	0	0	112.2	P326 I327 W333 K334 L344 I349 I352	P326-V330 WeakPolarHBondContact O-CG2 3.25Å; P326-V330 PolarHBondContact O-N 3.43Å; I327-V330 PolarHBondContact O-N 3.4Å; V330-W333 PolarHBondContact O-N 3.39Å; V330-K334 WeakPolarHBondContact O-CB 3.22Å; V330-K334 PolarHBondContact O-N 3.07Å; V330-L344 HydrophobicContact CG1-CD2 4.26Å; V330-L344 HydrophobicContact CG2-CD2 3.98Å; V330-I349 HydrophobicContact CG1-CD1 4.03Å; V330-I352 HydrophobicContact CG2-CD1 3.74Å
331	N	89.6	Confident	87.6	Confident	37 Å²	37	51.2 Å²	51.2	20%	0.198	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-40.6	176.4	-72.5	-22.4	0	0	0	112.1	Y217 I327 Y328 V329 K334 A335	Y217-N331 HydrophobicContact CD1-CB 3.96Å; Y217-N331 HydrophobicContact CE1-CB 4.36Å; Y217-N331 HydrophobicContact CG-CB 4.28Å; I327-N331 WeakPolarHBondContact O-CB 3.27Å; I327-N331 PolarHBondContact O-N 2.88Å; I327-N331 PolarHBondContact O-ND2 2.96Å; Y328-N331 PolarHBondContact O-N 2.91Å; V329-N331 PolarHBondContact O-N 3.04Å; N331-K334 PolarHBondContact O-N 2.85Å; N331-A335 PolarHBondContact O-N 2.98Å; N331-A335 VanDerWaalsContact O-N 3.1Å
332	A	88.6	Confident	86.6	Confident	18 Å²	18	52.6 Å²	52.6	15%	0.149	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-41.2	173.5	0	0	0	0	0	111.3	L221 Y328 V329 K334 A335 F336	L221-A332 HydrophobicContact CD2-CB 4.38Å; Y328-A332 WeakPolarHBondContact O-CB 3.3Å; Y328-A332 PolarHBondContact O-N 3.46Å; V329-A332 PolarHBondContact O-N 3.49Å; A332-K334 PolarHBondContact O-N 3.27Å; A332-A335 VanDerWaalsContact O-CB 3.28Å; A332-A335 WeakPolarHBondContact O-CB 3.27Å; A332-A335 PolarHBondContact O-N 2.76Å; A332-F336 WeakPolarHBondContact O-CD2 3.15Å; A332-F336 PolarHBondContact O-N 3.32Å
333	W	88.3	Confident	85.7	Confident	83 Å²	83	56 Å²	56	31%	0.314	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-45.9	175.8	-176.7	18	0	0	0	111.5	V329 V330 A335 F336 D337 A341	V329-W333 WeakPolarHBondContact O-CB 3.48Å; V329-W333 PolarHBondContact O-N 2.86Å; V330-W333 PolarHBondContact O-N 3.39Å; W333-A335 PolarHBondContact O-N 3.08Å; W333-F336 PolarHBondContact O-N 3.42Å; W333-F336 VanDerWaalsContact O-N 3.08Å; W333-D337 PolarHBondContact O-N 2.65Å; W333-A341 HydrophobicContact CD2-CB 4.35Å; W333-A341 HydrophobicContact CG-CB 4.48Å
334	K	82.4	Confident	84.6	Confident	51 Å²	51	56.9 Å²	56.9	22%	0.222	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-31.4	175.9	-174.6	-176.6	172.5	-159.1	0	112.7	E213 Y217 V330 N331 A332 A341	E213-K334 VanDerWaalsContact OE1-CE 3.28Å; E213-K334 WeakPolarHBondContact OE1-CE 3.29Å; E213-K334 IonicContact OE1-NZ 2.82Å; E213-K334 PolarHBondContact OE1-NZ 2.99Å; Y217-K334 HydrophobicContact CE2-CD 4.44Å; V330-K334 WeakPolarHBondContact O-CB 3.22Å; V330-K334 PolarHBondContact O-N 3.07Å; N331-K334 PolarHBondContact O-N 2.85Å; A332-K334 PolarHBondContact O-N 3.27Å; K334-A341 HydrophobicContact CB-CB 4.03Å; K334-A341 HydrophobicContact CG-CB 4.4Å
335	A	84.8	Confident	83.3	Confident	7 Å²	7	60.6 Å²	60.6	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-44.2	174.9	0	0	0	0	0	111.8	Q214 Y217 N331 A332 W333	Q214-A335 HydrophobicContact CB-CB 4.39Å; Q214-A335 HydrophobicContact CG-CB 3.98Å; Q214-A335 WeakPolarHBondContact CG-O 3.45Å; Q214-A335 PolarHBondContact NE2-O 2.85Å; Y217-A335 HydrophobicContact CD2-CB 4.28Å; N331-A335 PolarHBondContact O-N 2.98Å; N331-A335 VanDerWaalsContact O-N 3.1Å; A332-A335 VanDerWaalsContact O-CB 3.28Å; A332-A335 WeakPolarHBondContact O-CB 3.27Å; A332-A335 PolarHBondContact O-N 2.76Å; W333-A335 PolarHBondContact O-N 3.08Å
336	F	86.4	Confident	82.3	Confident	150 Å²	150	60.1 Å²	60.1	66%	0.658	31%	0.314	S	S	*	.	H	α-helix	trans	-88.1	-35.5	-176	-65.7	-72.2	0	0	0	114.1	I218 A332 W333	I218-F336 HydrophobicContact CD1-CE2 3.76Å; I218-F336 HydrophobicContact CD1-CZ 3.88Å; I218-F336 HydrophobicContact CG1-CZ 4.4Å; A332-F336 WeakPolarHBondContact O-CD2 3.15Å; A332-F336 PolarHBondContact O-N 3.32Å; W333-F336 PolarHBondContact O-N 3.42Å; W333-F336 VanDerWaalsContact O-N 3.08Å
337	D	84.4	Confident	81.2	Confident	59 Å²	59	59.5 Å²	59.5	32%	0.316	31%	0.312	S	S	.	.			trans	-140.2	84.2	-179.5	-175.2	-2	0	0	0	111.2	W333 N339 S340 A341	W333-D337 PolarHBondContact O-N 2.65Å; D337-N339 VanDerWaalsContact C-N 3.29Å; D337-N339 PolarHBondContact O-N 2.53Å; D337-N339 PolarHBondContact OD1-N 3.3Å; D337-S340 VanDerWaalsContact CG-OG 3.3Å; D337-S340 PolarHBondContact OD1-N 3.04Å; D337-S340 PolarHBondContact OD1-OG 2.93Å; D337-S340 WeakPolarHBondContact OD2-CB 3.39Å; D337-S340 PolarHBondContact OD2-OG 3.37Å; D337-A341 WeakPolarHBondContact O-CB 3.28Å; D337-A341 PolarHBondContact O-N 2.9Å
338	K	77.3	Confident	80.6	Confident	96 Å²	96	61.6 Å²	61.6	42%	0.417	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-34.2	179	-169.1	170.2	-174	161.8	0	112.5	E213 N342	E213-K338 IonicContact OE1-NZ 3.48Å; E213-K338 IonicContact OE2-NZ 3.83Å; E213-K338 PolarHBondContact OE2-NZ 3.48Å; K338-N342 VanDerWaalsContact O-CB 3.27Å; K338-N342 WeakPolarHBondContact O-CB 3.42Å; K338-N342 PolarHBondContact O-N 3.28Å; K338-N342 PolarHBondContact O-ND2 3.45Å; K338-N342 VanDerWaalsContact O-ND2 3.09Å
339	N	75.6	Confident	80	Confident	133 Å²	133	62.7 Å²	62.7	71%	0.711	33%	0.333	S	S	*	.	H	α-helix	trans	-72.1	-44.9	-174.1	-71.4	-21.5	0	0	0	111.4	D337	D337-N339 VanDerWaalsContact C-N 3.29Å; D337-N339 PolarHBondContact O-N 2.53Å; D337-N339 PolarHBondContact OD1-N 3.3Å
340	S	79	Confident	79.5	Confident	35 Å²	35	58.8 Å²	58.8	25%	0.245	31%	0.309	C	S	.	.	H	α-helix	trans	-71.3	-39.9	174.5	-56.6	0	0	0	0	111.7	D337 N342 R343	D337-S340 VanDerWaalsContact CG-OG 3.3Å; D337-S340 PolarHBondContact OD1-N 3.04Å; D337-S340 PolarHBondContact OD1-OG 2.93Å; D337-S340 WeakPolarHBondContact OD2-CB 3.39Å; D337-S340 PolarHBondContact OD2-OG 3.37Å; S340-N342 VanDerWaalsContact C-N 3.3Å; S340-N342 PolarHBondContact O-N 3.28Å; S340-R343 VanDerWaalsContact O-CB 3.24Å; S340-R343 WeakPolarHBondContact O-CB 3.28Å; S340-R343 WeakPolarHBondContact O-CG 3.3Å; S340-R343 PolarHBondContact O-N 3Å
341	A	74.1	Confident	79.4	Confident	9 Å²	9	61.4 Å²	61.4	7%	0.074	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-34.1	178.1	0	0	0	0	0	112.7	W333 K334 D337 R343 L344	W333-A341 HydrophobicContact CD2-CB 4.35Å; W333-A341 HydrophobicContact CG-CB 4.48Å; K334-A341 HydrophobicContact CB-CB 4.03Å; K334-A341 HydrophobicContact CG-CB 4.4Å; D337-A341 WeakPolarHBondContact O-CB 3.28Å; D337-A341 PolarHBondContact O-N 2.9Å; A341-R343 PolarHBondContact O-N 3.48Å; A341-R343 VanDerWaalsContact O-N 3.17Å; A341-L344 VanDerWaalsContact O-CB 3.31Å; A341-L344 WeakPolarHBondContact O-CB 3.43Å; A341-L344 PolarHBondContact O-N 2.93Å
342	N	72.4	Confident	79.4	Confident	71 Å²	71	61 Å²	61	38%	0.38	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.5	174.7	-75.5	-22.9	0	0	0	113.4	K338 S340 L344 T345	K338-N342 VanDerWaalsContact O-CB 3.27Å; K338-N342 WeakPolarHBondContact O-CB 3.42Å; K338-N342 PolarHBondContact O-N 3.28Å; K338-N342 PolarHBondContact O-ND2 3.45Å; K338-N342 VanDerWaalsContact O-ND2 3.09Å; S340-N342 VanDerWaalsContact C-N 3.3Å; S340-N342 PolarHBondContact O-N 3.28Å; N342-L344 VanDerWaalsContact C-N 3.26Å; N342-T345 WeakPolarHBondContact O-CG2 3.38Å
343	R	74.8	Confident	79.3	Confident	177 Å²	177	62.6 Å²	62.6	67%	0.668	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-24.7	170.6	-58.1	-178.9	178.7	178.1	-1	111.6	S340 A341 T345	S340-R343 VanDerWaalsContact O-CB 3.24Å; S340-R343 WeakPolarHBondContact O-CB 3.28Å; S340-R343 WeakPolarHBondContact O-CG 3.3Å; S340-R343 PolarHBondContact O-N 3Å; A341-R343 PolarHBondContact O-N 3.48Å; A341-R343 VanDerWaalsContact O-N 3.17Å; R343-T345 VanDerWaalsContact C-N 3.3Å; R343-T345 PolarHBondContact O-N 3.16Å
344	L	72.4	Confident	79.3	Confident	24 Å²	24	59.3 Å²	59.3	13%	0.126	31%	0.309	C	S	.	.			trans	-79	76.3	174.9	-163.7	73.1	0	0	0	110.4	I25 V330 A341 N342 P348 I352	I25-L344 HydrophobicContact CD1-CD1 4.06Å; V330-L344 HydrophobicContact CG1-CD2 4.26Å; V330-L344 HydrophobicContact CG2-CD2 3.98Å; A341-L344 VanDerWaalsContact O-CB 3.31Å; A341-L344 WeakPolarHBondContact O-CB 3.43Å; A341-L344 PolarHBondContact O-N 2.93Å; N342-L344 VanDerWaalsContact C-N 3.26Å; L344-P348 HydrophobicContact CD1-CB 3.64Å; L344-P348 HydrophobicContact CD1-CG 4.26Å; L344-P348 HydrophobicContact CG-CB 4.26Å; L344-I352 HydrophobicContact CD2-CD1 3.9Å
345	T	67.4	Low	79.8	Confident	96 Å²	96	60 Å²	60	59%	0.589	32%	0.316	S	S	*	.			trans	-118.3	161.6	178.9	52.9	0	0	0	0	111.7	N342 R343	N342-T345 WeakPolarHBondContact O-CG2 3.38Å; R343-T345 VanDerWaalsContact C-N 3.3Å; R343-T345 PolarHBondContact O-N 3.16Å
346	G	71.6	Confident	80.2	Confident	43 Å²	43	59.7 Å²	59.7	44%	0.443	31%	0.313	S	S	.	.	S	Bend	trans	80.6	-124.9	175.7	0	0	0	0	0	114	I349 S350	G346-I349 VanDerWaalsContact O-CG2 3.27Å; G346-I349 WeakPolarHBondContact O-CG2 3.46Å; G346-S350 PolarHBondContact O-N 3.46Å
347	A	71.5	Confident	80.6	Confident	27 Å²	27	52.8 Å²	52.8	22%	0.223	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-45.5	-170.3	0	0	0	0	0	114.4	I349 S350 F351	A347-I349 PolarHBondContact O-N 2.7Å; A347-S350 WeakPolarHBondContact O-CB 3.39Å; A347-S350 PolarHBondContact O-N 3.43Å; A347-S350 VanDerWaalsContact O-N 3.14Å; A347-F351 HydrophobicContact CB-CD2 4.42Å; A347-F351 HydrophobicContact CB-CE2 4.17Å; A347-F351 WeakPolarHBondContact O-CD2 3.22Å; A347-F351 PolarHBondContact O-N 2.92Å
348	P	79.4	Confident	81	Confident	53 Å²	53	51.8 Å²	51.8	34%	0.344	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-45.7	-175.8	-25.6	35.8	0	0	0	113.6	L344 S350 F351 I352	L344-P348 HydrophobicContact CD1-CB 3.64Å; L344-P348 HydrophobicContact CD1-CG 4.26Å; L344-P348 HydrophobicContact CG-CB 4.26Å; P348-S350 VanDerWaalsContact C-N 3.28Å; P348-S350 PolarHBondContact O-N 3.49Å; P348-F351 PolarHBondContact O-N 3.31Å; P348-I352 WeakPolarHBondContact O-CG1 3.45Å; P348-I352 PolarHBondContact O-N 2.96Å
349	I	80.1	Confident	81.8	Confident	41 Å²	41	47.8 Å²	47.8	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-36.1	177.6	-171	61.7	0	0	0	111.4	V330 G346 A347 I352 H353	V330-I349 HydrophobicContact CG1-CD1 4.03Å; G346-I349 VanDerWaalsContact O-CG2 3.27Å; G346-I349 WeakPolarHBondContact O-CG2 3.46Å; A347-I349 PolarHBondContact O-N 2.7Å; I349-I352 PolarHBondContact O-N 2.94Å; I349-H353 PolarHBondContact O-CD2 3.37Å; I349-H353 PolarHBondContact O-N 2.82Å
350	S	80.9	Confident	82.7	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.028	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-38	175.3	-173.3	0	0	0	0	112.7	R48 Y52 G346 A347 P348 H353 L354	R48-S350 WeakPolarHBondContact CD-OG 3.25Å; Y52-S350 PolarHBondContact OH-O 2.85Å; G346-S350 PolarHBondContact O-N 3.46Å; A347-S350 WeakPolarHBondContact O-CB 3.39Å; A347-S350 PolarHBondContact O-N 3.43Å; A347-S350 VanDerWaalsContact O-N 3.14Å; P348-S350 VanDerWaalsContact C-N 3.28Å; P348-S350 PolarHBondContact O-N 3.49Å; S350-H353 PolarHBondContact O-N 3.3Å; S350-L354 WeakPolarHBondContact O-CB 3.29Å; S350-L354 PolarHBondContact O-N 2.9Å
351	F	85.8	Confident	83.3	Confident	76 Å²	76	40 Å²	40	33%	0.333	22%	0.218	S	C	.	.	H	α-helix	trans	-68.2	-34.7	174.6	-75.9	-67.6	0	0	0	112.3	L51 A347 P348 L354 L355	L51-F351 HydrophobicContact CD1-CE1 4.02Å; A347-F351 HydrophobicContact CB-CD2 4.42Å; A347-F351 HydrophobicContact CB-CE2 4.17Å; A347-F351 WeakPolarHBondContact O-CD2 3.22Å; A347-F351 PolarHBondContact O-N 2.92Å; P348-F351 PolarHBondContact O-N 3.31Å; F351-L354 HydrophobicContact CD1-CD2 3.99Å; F351-L354 HydrophobicContact CE1-CD2 4.46Å; F351-L354 WeakPolarHBondContact O-CB 3.48Å; F351-L354 PolarHBondContact O-N 2.96Å; F351-L355 WeakPolarHBondContact O-CB 3.05Å; F351-L355 PolarHBondContact O-N 3.27Å
352	I	89.2	Confident	84.2	Confident	29 Å²	29	40.5 Å²	40.5	15%	0.149	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-45.4	172.6	-69.9	160.7	0	0	0	110.7	P326 I327 V330 L344 P348 I349 L355 S356	P326-I352 HydrophobicContact CB-CG1 4.43Å; P326-I352 HydrophobicContact CB-CG2 4.14Å; I327-I352 HydrophobicContact CB-CG2 3.88Å; I327-I352 HydrophobicContact CD1-CG2 3.93Å; V330-I352 HydrophobicContact CG2-CD1 3.74Å; L344-I352 HydrophobicContact CD2-CD1 3.9Å; P348-I352 WeakPolarHBondContact O-CG1 3.45Å; P348-I352 PolarHBondContact O-N 2.96Å; I349-I352 PolarHBondContact O-N 2.94Å; I352-L355 PolarHBondContact O-N 2.68Å; I352-S356 PolarHBondContact O-N 2.81Å; I352-S356 VanDerWaalsContact O-N 3.16Å
353	H	86.9	Confident	85.1	Confident	51 Å²	51	37.6 Å²	37.6	24%	0.236	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-44.6	173.6	-77.9	-67.2	0	0	0	112	I349 S350 L355 S356 Y357	I349-H353 PolarHBondContact O-CD2 3.37Å; I349-H353 PolarHBondContact O-N 2.82Å; S350-H353 PolarHBondContact O-N 3.3Å; H353-L355 VanDerWaalsContact C-N 3.3Å; H353-L355 PolarHBondContact O-N 2.98Å; H353-S356 PolarHBondContact O-N 3.27Å; H353-S356 VanDerWaalsContact O-N 3.12Å; H353-S356 PolarHBondContact O-OG 3.2Å; H353-Y357 HydrophobicContact CB-CE2 4.17Å; H353-Y357 WeakPolarHBondContact O-CD2 3.34Å; H353-Y357 PolarHBondContact O-N 2.91Å; H353-Y357 VanDerWaalsContact O-N 3.07Å
354	L	89.8	Confident	85.8	Confident	13 Å²	13	29.4 Å²	29.4	7%	0.068	18%	0.175	C	C	.	.	H	α-helix	trans	-54.7	-46.8	176.2	-175.8	77.7	0	0	0	111.6	L51 Y52 I55 S350 F351 S356 Y357 T358	L51-L354 HydrophobicContact CB-CD1 4.07Å; L51-L354 HydrophobicContact CB-CD2 3.69Å; L51-L354 HydrophobicContact CB-CG 4.47Å; L51-L354 HydrophobicContact CD1-CD2 3.61Å; L51-L354 HydrophobicContact CG-CD2 4.24Å; Y52-L354 HydrophobicContact CD1-CD1 3.75Å; Y52-L354 HydrophobicContact CD2-CD1 3.55Å; Y52-L354 HydrophobicContact CE1-CD1 3.9Å; Y52-L354 HydrophobicContact CE2-CB 4.33Å; Y52-L354 HydrophobicContact CE2-CD1 3.66Å; Y52-L354 HydrophobicContact CG-CD1 3.59Å; I55-L354 HydrophobicContact CD1-CD1 3.48Å; I55-L354 VanDerWaalsContact CD1-CD1 3.48Å; I55-L354 HydrophobicContact CD1-CG 3.77Å; S350-L354 WeakPolarHBondContact O-CB 3.29Å; S350-L354 PolarHBondContact O-N 2.9Å; F351-L354 HydrophobicContact CD1-CD2 3.99Å; F351-L354 HydrophobicContact CE1-CD2 4.46Å; F351-L354 WeakPolarHBondContact O-CB 3.48Å; F351-L354 PolarHBondContact O-N 2.96Å; L354-S356 VanDerWaalsContact C-N 3.3Å; L354-S356 PolarHBondContact O-N 2.95Å; L354-Y357 PolarHBondContact O-N 2.99Å; L354-Y357 VanDerWaalsContact O-N 3.1Å; L354-T358 PolarHBondContact O-N 2.98Å; L354-T358 PolarHBondContact O-OG1 3.37Å
355	L	92.4	Very high	86.7	Confident	67 Å²	67	31.4 Å²	31.4	35%	0.351	19%	0.185	S	C	.	.	H	α-helix	trans	-61.1	-38.9	178.3	-179.2	57.4	0	0	0	112	C323 P326 F351 I352 H353 Y357 T358	C323-L355 WeakPolarHBondContact CB-O 2.98Å; P326-L355 HydrophobicContact CB-CD2 4.44Å; P326-L355 HydrophobicContact CG-CD2 3.71Å; F351-L355 WeakPolarHBondContact O-CB 3.05Å; F351-L355 PolarHBondContact O-N 3.27Å; I352-L355 PolarHBondContact O-N 2.68Å; H353-L355 VanDerWaalsContact C-N 3.3Å; H353-L355 PolarHBondContact O-N 2.98Å; L355-Y357 VanDerWaalsContact C-N 3.34Å; L355-Y357 PolarHBondContact O-N 3.25Å; L355-T358 WeakPolarHBondContact O-CB 3.16Å; L355-T358 PolarHBondContact O-N 3.4Å
356	S	93.3	Very high	87.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-38.5	174.2	75.9	0	0	0	0	112.4	C323 I352 H353 L354 T358 S359	C323-S356 WeakPolarHBondContact O-CA 3.34Å; I352-S356 PolarHBondContact O-N 2.81Å; I352-S356 VanDerWaalsContact O-N 3.16Å; H353-S356 PolarHBondContact O-N 3.27Å; H353-S356 VanDerWaalsContact O-N 3.12Å; H353-S356 PolarHBondContact O-OG 3.2Å; L354-S356 VanDerWaalsContact C-N 3.3Å; L354-S356 PolarHBondContact O-N 2.95Å; S356-T358 VanDerWaalsContact C-N 3.35Å; S356-T358 PolarHBondContact O-N 2.84Å; S356-S359 WeakPolarHBondContact O-CB 3.24Å; S356-S359 PolarHBondContact O-N 3.27Å; S356-S359 PolarHBondContact O-OG 3.16Å
357	Y	93.4	Very high	88.4	Confident	5 Å²	5	25.5 Å²	25.5	2%	0.02	14%	0.139	C	C	.	.	H	α-helix	trans	-70.9	-27.4	177	-63.3	-50.7	0	0	0	113.4	Y52 V97 C101 I102 T105 M128 H353 L354 L355 S359 S360	Y52-Y357 HydrophobicContact CD1-CD2 4.47Å; Y52-Y357 AromaticContact CE1-CD2 3.53Å; Y52-Y357 HydrophobicContact CE1-CD2 3.53Å; Y52-Y357 AromaticContact CE1-CE2 3.79Å; Y52-Y357 HydrophobicContact CE1-CE2 3.79Å; V97-Y357 HydrophobicContact CG1-CD1 3.62Å; V97-Y357 HydrophobicContact CG1-CE1 4.08Å; C101-Y357 HydrophobicContact CB-CE1 4.12Å; I102-Y357 HydrophobicContact CG1-CD1 4.23Å; I102-Y357 HydrophobicContact CG1-CG 4.16Å; T105-Y357 HydrophobicContact CG2-CE2 4.16Å; T105-Y357 PolarHBondContact OG1-OH 2.72Å; M128-Y357 HydrophobicContact CE-CE1 3.89Å; M128-Y357 WeakPolarHBondContact CE-OH 3.43Å; M128-Y357 HydrophobicContact SD-CE1 4.35Å; M128-Y357 PolarHBondContact SD-OH 3.41Å; H353-Y357 HydrophobicContact CB-CE2 4.17Å; H353-Y357 WeakPolarHBondContact O-CD2 3.34Å; H353-Y357 PolarHBondContact O-N 2.91Å; H353-Y357 VanDerWaalsContact O-N 3.07Å; L354-Y357 PolarHBondContact O-N 2.99Å; L354-Y357 VanDerWaalsContact O-N 3.1Å; L355-Y357 VanDerWaalsContact C-N 3.34Å; L355-Y357 PolarHBondContact O-N 3.25Å; Y357-S359 PolarHBondContact O-N 2.89Å; Y357-S360 PolarHBondContact O-N 3.5Å; Y357-S360 PolarHBondContact O-OG 3.34Å
358	T	94.4	Very high	88.9	Confident	37 Å²	37	26.3 Å²	26.3	23%	0.227	14%	0.143	C	C	.	.	H	α-helix	trans	-54.9	-27.4	172.9	-56.8	0	0	0	0	112.2	I55 L354 L355 S356 S360 C361 V362	I55-T358 WeakPolarHBondContact CD1-OG1 3.44Å; L354-T358 PolarHBondContact O-N 2.98Å; L354-T358 PolarHBondContact O-OG1 3.37Å; L355-T358 WeakPolarHBondContact O-CB 3.16Å; L355-T358 PolarHBondContact O-N 3.4Å; S356-T358 VanDerWaalsContact C-N 3.35Å; S356-T358 PolarHBondContact O-N 2.84Å; T358-S360 PolarHBondContact O-N 2.89Å; T358-S360 VanDerWaalsContact O-N 3.13Å; T358-C361 PolarHBondContact O-N 2.91Å; T358-C361 PolarHBondContact O-SG 3.02Å; T358-V362 HydrophobicContact CG2-CG2 3.81Å; T358-V362 VanDerWaalsContact O-CG2 3.25Å; T358-V362 WeakPolarHBondContact O-CG2 3.15Å; T358-V362 PolarHBondContact O-N 3.45Å; T358-V362 VanDerWaalsContact O-N 3.13Å
359	S	93.1	Very high	89.1	Confident	13 Å²	13	31.2 Å²	31.2	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-57.1	-28.2	175.4	70.3	0	0	0	0	113.8	W324 S356 Y357 N363	W324-S359 WeakPolarHBondContact CZ2-OG 3.21Å; W324-S359 PolarHBondContact NE1-OG 3.25Å; W324-S359 VanDerWaalsContact NE1-OG 3.1Å; S356-S359 WeakPolarHBondContact O-CB 3.24Å; S356-S359 PolarHBondContact O-N 3.27Å; S356-S359 PolarHBondContact O-OG 3.16Å; Y357-S359 PolarHBondContact O-N 2.89Å; S359-N363 PolarHBondContact O-ND2 3.09Å
360	S	93.9	Very high	89.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-76.4	-26.1	-178.5	79.1	0	0	0	0	113.4	S59 N63 Y357 T358	S59-S360 WeakPolarHBondContact CB-OG 3.31Å; S59-S360 WeakPolarHBondContact OG-CB 3.14Å; S59-S360 PolarHBondContact OG-OG 3Å; N63-S360 PolarHBondContact ND2-O 2.99Å; Y357-S360 PolarHBondContact O-N 3.5Å; Y357-S360 PolarHBondContact O-OG 3.34Å; T358-S360 PolarHBondContact O-N 2.89Å; T358-S360 VanDerWaalsContact O-N 3.13Å
361	C	93.4	Very high	89	Confident	4 Å²	4	33.3 Å²	33.3	3%	0.027	17%	0.169	C	C	.	.	H	α-helix	trans	-97.8	-21.6	178.9	69.2	0	0	0	0	113.3	L58 T358 N363 P364 I365	L58-C361 HydrophobicContact CB-CB 3.79Å; T358-C361 PolarHBondContact O-N 2.91Å; T358-C361 PolarHBondContact O-SG 3.02Å; C361-N363 PolarHBondContact O-N 3.17Å; C361-P364 WeakPolarHBondContact O-CD 3.16Å; C361-I365 WeakPolarHBondContact O-CD1 3.25Å; C361-I365 VanDerWaalsContact O-CG1 3.3Å; C361-I365 WeakPolarHBondContact O-CG1 3.19Å
362	V	93.2	Very high	88.6	Confident	19 Å²	19	34.1 Å²	34.1	12%	0.115	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-38.9	178.4	164.5	0	0	0	0	112.4	L319 T358 I365 V366	L319-V362 HydrophobicContact CB-CG1 3.81Å; L319-V362 HydrophobicContact CD1-CG1 3.41Å; L319-V362 VanDerWaalsContact CD1-CG1 3.41Å; L319-V362 HydrophobicContact CG-CG1 4.16Å; T358-V362 HydrophobicContact CG2-CG2 3.81Å; T358-V362 VanDerWaalsContact O-CG2 3.25Å; T358-V362 WeakPolarHBondContact O-CG2 3.15Å; T358-V362 PolarHBondContact O-N 3.45Å; T358-V362 VanDerWaalsContact O-N 3.13Å; V362-I365 WeakPolarHBondContact O-CB 3.2Å; V362-I365 PolarHBondContact O-N 3.46Å; V362-V366 HydrophobicContact CG1-CG2 3.96Å; V362-V366 WeakPolarHBondContact O-CG2 3.43Å; V362-V366 PolarHBondContact O-N 3.12Å
363	N	89.9	Confident	87.8	Confident	11 Å²	11	41.8 Å²	41.8	6%	0.059	20%	0.2	C	C	.	.	H	α-helix	trans	-56.2	-56.7	-177.1	-66.1	-30.7	0	0	0	112	L90 D94 S359 C361 I365 V366 Y367	L90-N363 HydrophobicContact CD2-CB 4.29Å; D94-N363 PolarHBondContact OD2-ND2 3.4Å; S359-N363 PolarHBondContact O-ND2 3.09Å; C361-N363 PolarHBondContact O-N 3.17Å; N363-I365 VanDerWaalsContact C-N 3.34Å; N363-I365 PolarHBondContact O-N 3.03Å; N363-V366 PolarHBondContact O-N 3.35Å; N363-Y367 HydrophobicContact CB-CE2 4.06Å; N363-Y367 WeakPolarHBondContact O-CD2 3.39Å; N363-Y367 WeakPolarHBondContact O-CE2 3.2Å; N363-Y367 PolarHBondContact O-N 2.87Å; N363-Y367 VanDerWaalsContact O-N 3.09Å
364	P	90.3	Very high	87.1	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-54.3	-43.1	172.5	-23.9	27.6	0	0	0	114.9	N63 I66 C361 V366 Y367 C368	N63-P364 WeakPolarHBondContact OD1-CG 3.47Å; I66-P364 HydrophobicContact CD1-CB 3.97Å; I66-P364 HydrophobicContact CD1-CG 3.76Å; C361-P364 WeakPolarHBondContact O-CD 3.16Å; P364-V366 VanDerWaalsContact C-N 3.34Å; P364-V366 PolarHBondContact O-N 3.36Å; P364-Y367 PolarHBondContact O-N 3.22Å; P364-C368 WeakPolarHBondContact O-CB 3.44Å; P364-C368 PolarHBondContact O-N 3.3Å; P364-C368 PolarHBondContact O-SG 2.9Å
365	I	90.4	Very high	86.7	Confident	67 Å²	67	45.2 Å²	45.2	34%	0.344	21%	0.21	S	C	.	.	H	α-helix	trans	-58.7	-49.1	-179.2	-69.1	169.1	0	0	0	109.7	L58 C361 V362 N363 Y367 C368 F369	L58-I365 HydrophobicContact CD1-CD1 4.48Å; C361-I365 WeakPolarHBondContact O-CD1 3.25Å; C361-I365 VanDerWaalsContact O-CG1 3.3Å; C361-I365 WeakPolarHBondContact O-CG1 3.19Å; V362-I365 WeakPolarHBondContact O-CB 3.2Å; V362-I365 PolarHBondContact O-N 3.46Å; N363-I365 VanDerWaalsContact C-N 3.34Å; N363-I365 PolarHBondContact O-N 3.03Å; I365-Y367 VanDerWaalsContact C-N 3.34Å; I365-Y367 PolarHBondContact O-N 3.43Å; I365-C368 WeakPolarHBondContact O-CB 3.37Å; I365-C368 PolarHBondContact O-N 3.35Å; I365-F369 HydrophobicContact CG2-CD2 3.83Å; I365-F369 HydrophobicContact CG2-CE2 3.87Å; I365-F369 WeakPolarHBondContact O-CD2 3.05Å; I365-F369 PolarHBondContact O-N 3.15Å
366	V	89.4	Confident	86	Confident	10 Å²	10	50.3 Å²	50.3	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-42.1	178.9	176.4	0	0	0	0	111.3	M312 V315 I316 L319 V362 N363 P364 F369 M370	M312-V366 HydrophobicContact CG-CG1 3.69Å; V315-V366 HydrophobicContact CG1-CG1 4.31Å; V315-V366 HydrophobicContact CG1-CG2 4.19Å; I316-V366 HydrophobicContact CD1-CB 4.48Å; I316-V366 HydrophobicContact CD1-CG1 3.96Å; I316-V366 HydrophobicContact CG1-CB 3.99Å; I316-V366 HydrophobicContact CG1-CG1 3.57Å; I316-V366 HydrophobicContact CG1-CG2 4.36Å; L319-V366 HydrophobicContact CD1-CG2 3.79Å; V362-V366 HydrophobicContact CG1-CG2 3.96Å; V362-V366 WeakPolarHBondContact O-CG2 3.43Å; V362-V366 PolarHBondContact O-N 3.12Å; N363-V366 PolarHBondContact O-N 3.35Å; P364-V366 VanDerWaalsContact C-N 3.34Å; P364-V366 PolarHBondContact O-N 3.36Å; V366-F369 PolarHBondContact O-N 2.99Å; V366-M370 HydrophobicContact CG1-CG 4.39Å; V366-M370 HydrophobicContact CG1-SD 3.81Å; V366-M370 WeakPolarHBondContact O-CB 3.46Å; V366-M370 PolarHBondContact O-N 3.32Å
367	Y	85.3	Confident	85.1	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-41.5	175.7	-59.8	-46.4	0	0	0	112.5	I66 L87 M312 I316 N363 P364 I365 F369 N371	I66-Y367 HydrophobicContact CD1-CD2 3.89Å; I66-Y367 HydrophobicContact CD1-CE2 4.33Å; L87-Y367 HydrophobicContact CD2-CE1 3.68Å; L87-Y367 HydrophobicContact CD2-CE2 3.69Å; L87-Y367 WeakPolarHBondContact CD2-OH 3.35Å; M312-Y367 HydrophobicContact CE-CD1 3.91Å; M312-Y367 HydrophobicContact CE-CE1 3.95Å; M312-Y367 HydrophobicContact SD-CD1 3.86Å; M312-Y367 HydrophobicContact SD-CE1 4.41Å; I316-Y367 HydrophobicContact CD1-CD1 4.07Å; I316-Y367 HydrophobicContact CD1-CE1 3.26Å; N363-Y367 HydrophobicContact CB-CE2 4.06Å; N363-Y367 WeakPolarHBondContact O-CD2 3.39Å; N363-Y367 WeakPolarHBondContact O-CE2 3.2Å; N363-Y367 PolarHBondContact O-N 2.87Å; N363-Y367 VanDerWaalsContact O-N 3.09Å; P364-Y367 PolarHBondContact O-N 3.22Å; I365-Y367 VanDerWaalsContact C-N 3.34Å; I365-Y367 PolarHBondContact O-N 3.43Å; Y367-F369 PolarHBondContact O-N 3.1Å; Y367-N371 WeakPolarHBondContact O-CA 3.42Å; Y367-N371 WeakPolarHBondContact O-CB 3.33Å; Y367-N371 PolarHBondContact O-N 3.41Å
368	C	83.1	Confident	84.2	Confident	44 Å²	44	52.7 Å²	52.7	30%	0.297	24%	0.24	S	C	.	.	H	α-helix	trans	-58.7	-44.7	176.6	-77.5	0	0	0	0	111.7	P364 I365 R375	P364-C368 WeakPolarHBondContact O-CB 3.44Å; P364-C368 PolarHBondContact O-N 3.3Å; P364-C368 PolarHBondContact O-SG 2.9Å; I365-C368 WeakPolarHBondContact O-CB 3.37Å; I365-C368 PolarHBondContact O-N 3.35Å; C368-R375 WeakPolarHBondContact O-CD 3.44Å; C368-R375 WeakPolarHBondContact O-CG 3.41Å
369	F	83.7	Confident	83.4	Confident	156 Å²	156	53.1 Å²	53.1	68%	0.684	25%	0.248	S	C	*	.	H	α-helix	trans	-80.2	-43.5	-178.3	-74.3	-71.5	0	0	0	113	I365 V366 Y367	I365-F369 HydrophobicContact CG2-CD2 3.83Å; I365-F369 HydrophobicContact CG2-CE2 3.87Å; I365-F369 WeakPolarHBondContact O-CD2 3.05Å; I365-F369 PolarHBondContact O-N 3.15Å; V366-F369 PolarHBondContact O-N 2.99Å; Y367-F369 PolarHBondContact O-N 3.1Å
370	M	80.8	Confident	82.4	Confident	61 Å²	61	55 Å²	55	30%	0.3	27%	0.265	S	S	.	.	H	α-helix	trans	-102.6	-18.6	-164.9	-58.2	-177	75	0	0	114.1	H311 M312 V315 V366 K372	H311-M370 VanDerWaalsContact ND1-CE 3.29Å; H311-M370 WeakPolarHBondContact ND1-CE 3.38Å; M312-M370 HydrophobicContact CB-CB 3.83Å; M312-M370 HydrophobicContact CB-CE 4.07Å; M312-M370 HydrophobicContact CB-SD 4.28Å; M312-M370 HydrophobicContact CG-CB 3.65Å; M312-M370 HydrophobicContact CG-SD 4.34Å; M312-M370 HydrophobicContact SD-CB 4.05Å; V315-M370 HydrophobicContact CB-SD 4.26Å; V315-M370 HydrophobicContact CG1-SD 4.24Å; V315-M370 HydrophobicContact CG2-CE 4.07Å; V315-M370 HydrophobicContact CG2-SD 4.24Å; V366-M370 HydrophobicContact CG1-CG 4.39Å; V366-M370 HydrophobicContact CG1-SD 3.81Å; V366-M370 WeakPolarHBondContact O-CB 3.46Å; V366-M370 PolarHBondContact O-N 3.32Å; M370-K372 PolarHBondContact O-N 2.82Å
371	N	78	Confident	81.2	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.15	27%	0.274	C	S	.	.			trans	-96.9	96.8	179.9	-167.5	-21.9	0	0	0	112.3	M312 Y367 R373 F374 R375	M312-N371 HydrophobicContact SD-CB 3.62Å; Y367-N371 WeakPolarHBondContact O-CA 3.42Å; Y367-N371 WeakPolarHBondContact O-CB 3.33Å; Y367-N371 PolarHBondContact O-N 3.41Å; N371-R373 VanDerWaalsContact C-N 3.27Å; N371-R373 PolarHBondContact O-N 2.87Å; N371-R373 WeakPolarHBondContact OD1-CB 3.39Å; N371-R373 PolarHBondContact OD1-N 2.93Å; N371-R373 VanDerWaalsContact OD1-N 3.08Å; N371-F374 HydrophobicContact CB-CB 3.66Å; N371-F374 WeakPolarHBondContact O-CB 3.48Å; N371-F374 PolarHBondContact O-N 3.31Å; N371-F374 VanDerWaalsContact O-N 3.14Å; N371-F374 PolarHBondContact OD1-N 3.5Å; N371-R375 PolarHBondContact O-N 3.29Å
372	K	76	Confident	80.1	Confident	93 Å²	93	61.6 Å²	61.6	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-56.6	-35.9	177.3	-72.3	-173.9	173.1	-170.1	0	113.8	M370 R376	M370-K372 PolarHBondContact O-N 2.82Å; K372-R376 WeakPolarHBondContact O-CG 3.28Å; K372-R376 PolarHBondContact O-N 2.82Å
373	R	72	Confident	78.8	Confident	190 Å²	190	65.9 Å²	65.9	72%	0.717	33%	0.325	S	S	*	.	H	α-helix	trans	-68.8	-42.6	179.3	-67.7	-177.4	179.7	176.9	0.2	110.2	N371 R376 A377	N371-R373 VanDerWaalsContact C-N 3.27Å; N371-R373 PolarHBondContact O-N 2.87Å; N371-R373 WeakPolarHBondContact OD1-CB 3.39Å; N371-R373 PolarHBondContact OD1-N 2.93Å; N371-R373 VanDerWaalsContact OD1-N 3.08Å; R373-R376 PolarHBondContact O-N 2.03Å; R373-A377 PolarHBondContact O-N 2.81Å; R373-A377 VanDerWaalsContact O-N 3.08Å
374	F	73.7	Confident	77.2	Confident	12 Å²	12	69.5 Å²	69.5	5%	0.053	35%	0.345	C	S	.	.	H	α-helix	trans	-63	-45.9	176.5	-171.7	-113.8	0	0	0	112.1	I65 I66 V69 N371 R376 A377 I378	I65-F374 HydrophobicContact CG2-CZ 4.44Å; I66-F374 HydrophobicContact CB-CE2 4.44Å; I66-F374 HydrophobicContact CB-CZ 4.35Å; I66-F374 HydrophobicContact CG1-CE1 4.41Å; I66-F374 HydrophobicContact CG1-CE2 3.94Å; I66-F374 HydrophobicContact CG1-CZ 3.5Å; I66-F374 VanDerWaalsContact CG1-CZ 3.5Å; V69-F374 HydrophobicContact CB-CE2 4.43Å; V69-F374 HydrophobicContact CG1-CD2 4.47Å; V69-F374 HydrophobicContact CG1-CE2 4.27Å; N371-F374 HydrophobicContact CB-CB 3.66Å; N371-F374 WeakPolarHBondContact O-CB 3.48Å; N371-F374 PolarHBondContact O-N 3.31Å; N371-F374 VanDerWaalsContact O-N 3.14Å; N371-F374 PolarHBondContact OD1-N 3.5Å; F374-R376 VanDerWaalsContact C-N 3.33Å; F374-R376 PolarHBondContact O-N 3.07Å; F374-A377 CarbonylContact O-C 3.35Å; F374-A377 WeakPolarHBondContact O-CA 3.24Å; F374-A377 WeakPolarHBondContact O-CB 3.49Å; F374-A377 PolarHBondContact O-N 2.97Å; F374-I378 HydrophobicContact CD1-CD1 3.65Å; F374-I378 HydrophobicContact CD1-CG1 4.35Å; F374-I378 HydrophobicContact CE1-CD1 3.24Å; F374-I378 HydrophobicContact CE1-CG1 4.08Å; F374-I378 HydrophobicContact CG-CD1 4.46Å; F374-I378 HydrophobicContact CZ-CD1 3.71Å; F374-I378 HydrophobicContact CZ-CG1 4.15Å; F374-I378 PolarHBondContact O-N 3.35Å
375	R	80.4	Confident	75.1	Confident	125 Å²	125	77.6 Å²	77.6	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-56.8	-42.7	175	-76.7	-161.9	-78.3	150.7	-10.4	113.8	C368 N371 A377 I378 A379	C368-R375 WeakPolarHBondContact O-CD 3.44Å; C368-R375 WeakPolarHBondContact O-CG 3.41Å; N371-R375 PolarHBondContact O-N 3.29Å; R375-A377 VanDerWaalsContact C-N 3.3Å; R375-A377 PolarHBondContact O-N 2.88Å; R375-I378 PolarHBondContact O-N 3.23Å; R375-A379 WeakPolarHBondContact O-CB 3.32Å; R375-A379 PolarHBondContact O-N 3.36Å
376	R	77.9	Confident	73.2	Confident	173 Å²	173	80.6 Å²	80.6	65%	0.653	39%	0.39	S	S	*	.	H	α-helix	trans	-64.6	-37.4	175.3	-69.3	179.5	-155	152.1	-1	111.8	K372 R373 F374 A379 A380	K372-R376 WeakPolarHBondContact O-CG 3.28Å; K372-R376 PolarHBondContact O-N 2.82Å; R373-R376 PolarHBondContact O-N 2.03Å; F374-R376 VanDerWaalsContact C-N 3.33Å; F374-R376 PolarHBondContact O-N 3.07Å; R376-A379 PolarHBondContact O-N 3.45Å; R376-A380 VanDerWaalsContact O-CB 3.3Å; R376-A380 WeakPolarHBondContact O-CB 3.41Å; R376-A380 PolarHBondContact O-N 3.44Å
377	A	73.8	Confident	71.4	Confident	23 Å²	23	82.4 Å²	82.4	19%	0.19	40%	0.399	C	S	.	.	H	α-helix	trans	-68.5	-41.6	177.7	0	0	0	0	0	111.4	V69 R373 F374 R375 A380 T381	V69-A377 HydrophobicContact CG1-CB 3.4Å; R373-A377 PolarHBondContact O-N 2.81Å; R373-A377 VanDerWaalsContact O-N 3.08Å; F374-A377 CarbonylContact O-C 3.35Å; F374-A377 WeakPolarHBondContact O-CA 3.24Å; F374-A377 WeakPolarHBondContact O-CB 3.49Å; F374-A377 PolarHBondContact O-N 2.97Å; R375-A377 VanDerWaalsContact C-N 3.3Å; R375-A377 PolarHBondContact O-N 2.88Å; A377-A380 PolarHBondContact O-N 2.84Å; A377-T381 WeakPolarHBondContact O-CB 3.29Å; A377-T381 PolarHBondContact O-N 3.48Å; A377-T381 PolarHBondContact O-OG1 3.2Å
378	I	75.7	Confident	69.8	Low	32 Å²	32	88.3 Å²	88.3	16%	0.164	43%	0.43	C	S	.	.	H	α-helix	trans	-57.1	-54.3	169.1	-73.5	178.1	0	0	0	110.2	I65 V69 F374 R375 A380 T381 F382	I65-I378 HydrophobicContact CG2-CD1 3.97Å; I65-I378 HydrophobicContact CG2-CG1 3.94Å; V69-I378 HydrophobicContact CG2-CG1 4.12Å; F374-I378 HydrophobicContact CD1-CD1 3.65Å; F374-I378 HydrophobicContact CD1-CG1 4.35Å; F374-I378 HydrophobicContact CE1-CD1 3.24Å; F374-I378 HydrophobicContact CE1-CG1 4.08Å; F374-I378 HydrophobicContact CG-CD1 4.46Å; F374-I378 HydrophobicContact CZ-CD1 3.71Å; F374-I378 HydrophobicContact CZ-CG1 4.15Å; F374-I378 PolarHBondContact O-N 3.35Å; R375-I378 PolarHBondContact O-N 3.23Å; I378-A380 VanDerWaalsContact C-N 3.29Å; I378-A380 PolarHBondContact O-N 2.73Å; I378-T381 WeakPolarHBondContact O-CA 3.39Å; I378-T381 WeakPolarHBondContact O-CB 3.48Å; I378-T381 PolarHBondContact O-N 3.43Å; I378-F382 HydrophobicContact CG2-CD2 3.57Å; I378-F382 HydrophobicContact CG2-CE2 3.8Å; I378-F382 VanDerWaalsContact O-CD2 3.3Å; I378-F382 WeakPolarHBondContact O-CD2 3.43Å; I378-F382 PolarHBondContact O-N 2.85Å
379	A	76.8	Confident	68.2	Low	47 Å²	47	94.2 Å²	94.2	39%	0.388	45%	0.447	S	S	.	.	H	α-helix	trans	-57.6	-42.5	-179.8	0	0	0	0	0	111.8	R375 R376 T381 F382 C383	R375-A379 WeakPolarHBondContact O-CB 3.32Å; R375-A379 PolarHBondContact O-N 3.36Å; R376-A379 PolarHBondContact O-N 3.45Å; A379-T381 VanDerWaalsContact C-N 3.29Å; A379-T381 PolarHBondContact O-N 3.15Å; A379-F382 PolarHBondContact O-N 3.07Å; A379-C383 WeakPolarHBondContact O-CB 3.47Å; A379-C383 PolarHBondContact O-N 3.46Å; A379-C383 PolarHBondContact O-SG 2.88Å
380	A	72.5	Confident	66.6	Low	53 Å²	53	92.4 Å²	92.4	44%	0.438	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-33	176	0	0	0	0	0	113.2	R376 A377 I378 N384	R376-A380 VanDerWaalsContact O-CB 3.3Å; R376-A380 WeakPolarHBondContact O-CB 3.41Å; R376-A380 PolarHBondContact O-N 3.44Å; A377-A380 PolarHBondContact O-N 2.84Å; I378-A380 VanDerWaalsContact C-N 3.29Å; I378-A380 PolarHBondContact O-N 2.73Å; A380-N384 VanDerWaalsContact O-CB 3.32Å; A380-N384 WeakPolarHBondContact O-CB 3.41Å; A380-N384 PolarHBondContact O-N 3.44Å; A380-N384 PolarHBondContact O-ND2 2.86Å
381	T	68.6	Low	65.4	Low	32 Å²	32	93.7 Å²	93.7	20%	0.196	44%	0.442	C	S	.	.	H	α-helix	trans	-72.1	-46	176.5	-66.9	0	0	0	0	111.1	I68 V69 A377 I378 A379 N384 I387	I68-T381 HydrophobicContact CG2-CG2 4.35Å; V69-T381 HydrophobicContact CG2-CG2 4.23Å; A377-T381 WeakPolarHBondContact O-CB 3.29Å; A377-T381 PolarHBondContact O-N 3.48Å; A377-T381 PolarHBondContact O-OG1 3.2Å; I378-T381 WeakPolarHBondContact O-CA 3.39Å; I378-T381 WeakPolarHBondContact O-CB 3.48Å; I378-T381 PolarHBondContact O-N 3.43Å; A379-T381 VanDerWaalsContact C-N 3.29Å; A379-T381 PolarHBondContact O-N 3.15Å; T381-N384 CarbonylContact O-C 3.59Å; T381-N384 VanDerWaalsContact O-O 3.12Å; T381-I387 HydrophobicContact CG2-CD1 3.17Å
382	F	71.1	Confident	64.2	Low	109 Å²	109	101.9 Å²	101.9	48%	0.478	47%	0.471	S	S	.	.	H	α-helix	trans	-81.2	-36	-177.9	-74.9	-80.6	0	0	0	113.7	I65 I378 A379 N384 F385	I65-F382 HydrophobicContact CD1-CE2 4.48Å; I65-F382 HydrophobicContact CD1-CZ 4.19Å; I65-F382 HydrophobicContact CG1-CZ 4.32Å; I65-F382 HydrophobicContact CG2-CE2 4.47Å; I378-F382 HydrophobicContact CG2-CD2 3.57Å; I378-F382 HydrophobicContact CG2-CE2 3.8Å; I378-F382 VanDerWaalsContact O-CD2 3.3Å; I378-F382 WeakPolarHBondContact O-CD2 3.43Å; I378-F382 PolarHBondContact O-N 2.85Å; A379-F382 PolarHBondContact O-N 3.07Å; F382-N384 PolarHBondContact O-N 3.18Å; F382-F385 WeakPolarHBondContact O-CD2 3.36Å
383	C	64.7	Low	63	Low	110 Å²	110	102.1 Å²	102.1	74%	0.743	47%	0.472	S	S	*	.	H	α-helix	trans	-71.4	-20.2	174	-64.5	0	0	0	0	112.5	A379	A379-C383 WeakPolarHBondContact O-CB 3.47Å; A379-C383 PolarHBondContact O-N 3.46Å; A379-C383 PolarHBondContact O-SG 2.88Å
384	N	56.4	Low	62.1	Low	87 Å²	87	101.2 Å²	101.2	47%	0.465	47%	0.469	S	S	.	.			trans	-99.9	77.6	166.5	-69.9	-66.4	0	0	0	109.6	A380 T381 F382 K386	A380-N384 VanDerWaalsContact O-CB 3.32Å; A380-N384 WeakPolarHBondContact O-CB 3.41Å; A380-N384 PolarHBondContact O-N 3.44Å; A380-N384 PolarHBondContact O-ND2 2.86Å; T381-N384 CarbonylContact O-C 3.59Å; T381-N384 VanDerWaalsContact O-O 3.12Å; F382-N384 PolarHBondContact O-N 3.18Å; N384-K386 PolarHBondContact O-N 2.86Å
385	F	47.1	Very low	61.2	Low	173 Å²	173	107.6 Å²	107.6	76%	0.759	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	10.8	172.4	-118.5	-91.4	0	0	0	115.3	F382 I387	F382-F385 WeakPolarHBondContact O-CD2 3.36Å; F385-I387 PolarHBondContact O-N 3.34Å
386	K	50.6	Low	59.7	Low	130 Å²	130	110.2 Å²	110.2	57%	0.565	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	2.3	171.3	-74.7	-176.4	176.2	173.5	0	114	N384 W389 R390	N384-K386 PolarHBondContact O-N 2.86Å; K386-W389 CarbonylContact O-C 3.51Å; K386-W389 WeakPolarHBondContact O-CB 3.41Å; K386-W389 PolarHBondContact O-N 3.37Å; K386-R390 WeakPolarHBondContact O-CB 3.26Å; K386-R390 WeakPolarHBondContact O-CG 3.26Å; K386-R390 PolarHBondContact O-N 3.35Å
387	I	51.4	Low	58.3	Low	48 Å²	48	108.7 Å²	108.7	25%	0.246	50%	0.503	C	S	.	.	H	α-helix	trans	-69.1	-41.2	-178.9	-93.3	157.7	0	0	0	113.2	T381 F385 W389 R390 I391	T381-I387 HydrophobicContact CG2-CD1 3.17Å; F385-I387 PolarHBondContact O-N 3.34Å; I387-W389 VanDerWaalsContact C-N 3.28Å; I387-W389 PolarHBondContact O-N 2.94Å; I387-R390 PolarHBondContact O-N 3.35Å; I387-R390 VanDerWaalsContact O-N 3.1Å; I387-I391 HydrophobicContact CG2-CD1 4.09Å; I387-I391 WeakPolarHBondContact O-CG1 3.43Å; I387-I391 PolarHBondContact O-N 3.48Å
388	L	50.9	Low	57.1	Low	128 Å²	128	109.8 Å²	109.8	67%	0.67	52%	0.517	S	S	*	.	H	α-helix	trans	-61.2	-39.7	169.8	-85.1	154.6	0	0	0	111.2	R390 R392	L388-R390 VanDerWaalsContact C-N 3.31Å; L388-R390 PolarHBondContact O-N 3.38Å; L388-R392 VanDerWaalsContact O-CB 3.26Å; L388-R392 WeakPolarHBondContact O-CB 3.44Å; L388-R392 PolarHBondContact O-N 2.66Å
389	W	50	Low	55.8	Low	169 Å²	169	116.2 Å²	116.2	64%	0.64	54%	0.544	S	S	*	.	H	α-helix	trans	-65.5	-32	174.3	-147.5	83.2	0	0	0	112.7	K386 I387 K393	K386-W389 CarbonylContact O-C 3.51Å; K386-W389 WeakPolarHBondContact O-CB 3.41Å; K386-W389 PolarHBondContact O-N 3.37Å; I387-W389 VanDerWaalsContact C-N 3.28Å; I387-W389 PolarHBondContact O-N 2.94Å; W389-K393 HydrophobicContact CE3-CD 4.43Å; W389-K393 HydrophobicContact CZ3-CD 4.01Å; W389-K393 VanDerWaalsContact O-CB 3.26Å; W389-K393 WeakPolarHBondContact O-CB 3.48Å; W389-K393 PolarHBondContact O-N 3.33Å
390	R	50.3	Low	54.2	Low	117 Å²	117	120.8 Å²	120.8	44%	0.442	56%	0.555	S	S	.	*	H	α-helix	trans	-80.3	-36.7	179.4	-77.6	172.2	169.9	177.8	-0.5	113.5	V73 K386 I387 L388 R392 K393 W394	V73-R390 HydrophobicContact CG1-CB 4.36Å; K386-R390 WeakPolarHBondContact O-CB 3.26Å; K386-R390 WeakPolarHBondContact O-CG 3.26Å; K386-R390 PolarHBondContact O-N 3.35Å; I387-R390 PolarHBondContact O-N 3.35Å; I387-R390 VanDerWaalsContact O-N 3.1Å; L388-R390 VanDerWaalsContact C-N 3.31Å; L388-R390 PolarHBondContact O-N 3.38Å; R390-R392 VanDerWaalsContact C-N 3.34Å; R390-K393 PolarHBondContact O-N 3.43Å; R390-W394 WeakPolarHBondContact O-CB 3.17Å; R390-W394 PolarHBondContact O-N 3.45Å
391	I	55.4	Low	52.7	Low	89 Å²	89	126.4 Å²	126.4	46%	0.456	57%	0.569	S	S	.	*	H	α-helix	trans	-64.6	-43.5	171.3	-66.1	167.4	0	0	0	109.4	I387 K393 W394 F395	I387-I391 HydrophobicContact CG2-CD1 4.09Å; I387-I391 WeakPolarHBondContact O-CG1 3.43Å; I387-I391 PolarHBondContact O-N 3.48Å; I391-K393 VanDerWaalsContact C-N 3.35Å; I391-K393 PolarHBondContact O-N 2.84Å; I391-W394 WeakPolarHBondContact O-CB 2.98Å; I391-W394 PolarHBondContact O-N 2.8Å; I391-F395 PolarHBondContact O-N 3.05Å; I391-F395 VanDerWaalsContact O-N 3.13Å
392	R	53.7	Low	51.4	Low	199 Å²	199	134.3 Å²	134.3	75%	0.751	60%	0.596	S	S	*	*	H	α-helix	trans	-62.1	-39.7	174	-164	169.5	158.6	106.9	-2.5	112	L388 R390 Y396	L388-R392 VanDerWaalsContact O-CB 3.26Å; L388-R392 WeakPolarHBondContact O-CB 3.44Å; L388-R392 PolarHBondContact O-N 2.66Å; R390-R392 VanDerWaalsContact C-N 3.34Å; R392-Y396 WeakPolarHBondContact O-CB 3.28Å; R392-Y396 PolarHBondContact O-N 3.12Å
393	K	51.1	Low	50	Low	99 Å²	99	133.2 Å²	133.2	43%	0.43	60%	0.598	S	S	.	*	H	α-helix	trans	-69.6	-31.1	173.9	-164.8	172.4	-174.9	173.9	0	113.3	W389 R390 I391 Y396 Y397	W389-K393 HydrophobicContact CE3-CD 4.43Å; W389-K393 HydrophobicContact CZ3-CD 4.01Å; W389-K393 VanDerWaalsContact O-CB 3.26Å; W389-K393 WeakPolarHBondContact O-CB 3.48Å; W389-K393 PolarHBondContact O-N 3.33Å; R390-K393 PolarHBondContact O-N 3.43Å; I391-K393 VanDerWaalsContact C-N 3.35Å; I391-K393 PolarHBondContact O-N 2.84Å; K393-Y396 PolarHBondContact O-N 3.13Å; K393-Y397 HydrophobicContact CD-CE2 4.44Å; K393-Y397 HydrophobicContact CG-CD2 3.7Å; K393-Y397 HydrophobicContact CG-CE2 3.93Å; K393-Y397 WeakPolarHBondContact O-CD2 3.37Å; K393-Y397 PolarHBondContact O-N 3.01Å
394	W	51.8	Low	48.8	Very low	170 Å²	170	131.2 Å²	131.2	64%	0.644	59%	0.585	S	S	*	*	H	α-helix	trans	-67.9	-44.5	176.2	-178.3	81.3	0	0	0	112	R390 I391 Y396 Y397 G398	R390-W394 WeakPolarHBondContact O-CB 3.17Å; R390-W394 PolarHBondContact O-N 3.45Å; I391-W394 WeakPolarHBondContact O-CB 2.98Å; I391-W394 PolarHBondContact O-N 2.8Å; W394-Y396 VanDerWaalsContact C-N 3.29Å; W394-Y396 PolarHBondContact O-N 3.49Å; W394-Y397 PolarHBondContact O-N 2.93Å; W394-G398 PolarHBondContact O-N 3.4Å
395	F	55.7	Low	48.2	Very low	147 Å²	147	131.3 Å²	131.3	65%	0.645	59%	0.588	S	S	*	*	H	α-helix	trans	-60.3	-40.6	170.7	-100.7	-84.9	0	0	0	111.9	I391 K399	I391-F395 PolarHBondContact O-N 3.05Å; I391-F395 VanDerWaalsContact O-N 3.13Å; F395-K399 PolarHBondContact O-N 3.21Å
396	Y	48.9	Very low	47.6	Very low	180 Å²	180	133.2 Å²	133.2	71%	0.706	59%	0.591	S	S	*	*	H	α-helix	trans	-67.7	-40.3	-179.1	-154.2	-97.4	0	0	0	113.5	R392 K393 W394	R392-Y396 WeakPolarHBondContact O-CB 3.28Å; R392-Y396 PolarHBondContact O-N 3.12Å; K393-Y396 PolarHBondContact O-N 3.13Å; W394-Y396 VanDerWaalsContact C-N 3.29Å; W394-Y396 PolarHBondContact O-N 3.49Å
397	Y	48.3	Very low	47.1	Very low	140 Å²	140	134.2 Å²	134.2	55%	0.549	60%	0.597	S	S	.	*	H	α-helix	trans	-88.2	-23.2	179.6	-85.6	-92.8	0	0	0	114.3	K393 W394 K399 K400 K401	K393-Y397 HydrophobicContact CD-CE2 4.44Å; K393-Y397 HydrophobicContact CG-CD2 3.7Å; K393-Y397 HydrophobicContact CG-CE2 3.93Å; K393-Y397 WeakPolarHBondContact O-CD2 3.37Å; K393-Y397 PolarHBondContact O-N 3.01Å; W394-Y397 PolarHBondContact O-N 2.93Å; Y397-K399 VanDerWaalsContact C-N 3.34Å; Y397-K400 PolarHBondContact O-N 2.6Å; Y397-K401 PolarHBondContact O-N 3.16Å
398	G	47.4	Very low	46.4	Very low	46 Å²	46	138.8 Å²	138.8	47%	0.474	62%	0.615	S	S	.	*	H	α-helix	trans	-67.2	-33.1	173.6	0	0	0	0	0	112.9	W394	W394-G398 PolarHBondContact O-N 3.4Å
399	K	48.6	Very low	45.7	Very low	168 Å²	168	139.4 Å²	139.4	73%	0.73	62%	0.615	S	S	*	*	H	α-helix	trans	-70.5	-40.1	175.3	-133.5	176.7	-175.4	-178.6	0	112.1	F395 Y397 K401 R402 T403	F395-K399 PolarHBondContact O-N 3.21Å; Y397-K399 VanDerWaalsContact C-N 3.34Å; K399-K401 VanDerWaalsContact C-N 3.34Å; K399-K401 PolarHBondContact O-N 3.17Å; K399-R402 PolarHBondContact O-N 3.44Å; K399-T403 PolarHBondContact O-N 3.32Å
400	K	44.5	Very low	45.1	Very low	143 Å²	143	133.5 Å²	133.5	62%	0.622	61%	0.606	S	S	*	*	H	α-helix	trans	-69.3	-27.2	-175.7	-145.8	173.9	-172.8	179.3	0	113.9	Y397 T403 S404	Y397-K400 PolarHBondContact O-N 2.6Å; K400-T403 PolarHBondContact O-OG1 3.2Å; K400-S404 PolarHBondContact O-N 3.41Å
401	K	41.1	Very low	44.5	Very low	170 Å²	170	135 Å²	135	74%	0.739	62%	0.618	S	S	*	*	H	α-helix	trans	-80.6	-18.9	176	-146.9	179.1	-174.6	-174	0	113.1	Y397 K399 V405	Y397-K401 PolarHBondContact O-N 3.16Å; K399-K401 VanDerWaalsContact C-N 3.34Å; K399-K401 PolarHBondContact O-N 3.17Å; K401-V405 WeakPolarHBondContact O-CG2 3.46Å
402	R	41.1	Very low	43.5	Very low	199 Å²	199	140.1 Å²	140.1	75%	0.751	63%	0.631	S	S	*	*	H	α-helix	trans	-85.7	-30.3	176.4	-147.5	174.6	-162.8	171.8	2.9	111.9	K399	K399-R402 PolarHBondContact O-N 3.44Å
403	T	41.1	Very low	42.5	Very low	86 Å²	86	140.4 Å²	140.4	53%	0.528	63%	0.633	S	S	.	*	H	α-helix	trans	-82.3	-26.9	177.1	54.6	0	0	0	0	113.8	K399 K400 V405	K399-T403 PolarHBondContact O-N 3.32Å; K400-T403 PolarHBondContact O-OG1 3.2Å; T403-V405 VanDerWaalsContact C-N 3.33Å; T403-V405 PolarHBondContact O-N 3.34Å
404	S	40.4	Very low	41.6	Very low	68 Å²	68	146.3 Å²	146.3	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-78.3	-12.7	179.7	84.2	0	0	0	0	114.7	K400	K400-S404 PolarHBondContact O-N 3.41Å
405	V	42.3	Very low	40.7	Very low	88 Å²	88	144 Å²	144	53%	0.533	66%	0.657	S	S	.	*	H	α-helix	trans	-84.1	-27.9	179.3	175.5	0	0	0	0	111.4	K401 T403	K401-V405 WeakPolarHBondContact O-CG2 3.46Å; T403-V405 VanDerWaalsContact C-N 3.33Å; T403-V405 PolarHBondContact O-N 3.34Å
406	W	35.4	Very low	39.6	Very low	213 Å²	213	145.6 Å²	145.6	81%	0.807	67%	0.671	S	S	*	*	H	α-helix	trans	-76.4	-33.9	177.8	-74.7	93.1	0	0	0	113.2
407	H	39.5	Very low	38.8	Very low	152 Å²	152	142.2 Å²	142.2	70%	0.704	67%	0.674	S	S	*	*	H	α-helix	trans	-71.2	-29.8	175.7	-89.8	-78.5	0	0	0	113.4	H409	H407-H409 PolarHBondContact O-N 3.48Å
408	K	37	Very low	38	Very low	143 Å²	143	141.4 Å²	141.4	62%	0.622	69%	0.689	S	S	*	*	H	α-helix	trans	-84.8	-5.8	-175.6	-111.7	-179	-179.3	-177.9	0	115.6
409	H	36.7	Very low	37.1	Very low	142 Å²	142	142.6 Å²	142.6	66%	0.657	70%	0.702	S	S	*	*	H	α-helix	trans	-105.4	-10.2	176.4	-110.9	-71.1	0	0	0	113.9	H407	H407-H409 PolarHBondContact O-N 3.48Å
410	G	36.1	Very low	36.1	Very low	44 Å²	44	142.8 Å²	142.8	45%	0.454	71%	0.707	S	S	.	*	H	α-helix	trans	-85.4	-29.8	174.8	0	0	0	0	0	114.6
411	E	39.1	Very low	35.2	Very low	148 Å²	148	142 Å²	142	69%	0.692	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-88.6	-15.8	-175.4	-87.2	170.2	160.1	0	0	114.8	R413	E411-R413 VanDerWaalsContact C-N 3.34Å; E411-R413 PolarHBondContact O-N 3.48Å
412	R	33.9	Very low	34.6	Very low	198 Å²	198	140.2 Å²	140.2	75%	0.747	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-88.6	7.4	-179.9	-87.8	-169.3	-84.3	-165.9	-2.1	115
413	R	32.6	Very low	33.8	Very low	205 Å²	205	140.7 Å²	140.7	77%	0.774	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-108.9	-1.2	-179.1	-163.4	170.7	-75.2	-174.6	-3.4	114.2	E411	E411-R413 VanDerWaalsContact C-N 3.34Å; E411-R413 PolarHBondContact O-N 3.48Å
414	W	31.6	Very low	33.1	Very low	222 Å²	222	140.7 Å²	140.7	84%	0.841	71%	0.713	S	S	*	*	S	Bend	trans	-123.8	13	-171.4	-69.8	110.4	0	0	0	116.8
415	T	33.8	Very low	32.4	Very low	123 Å²	123	145.9 Å²	145.9	76%	0.755	73%	0.73	S	S	*	*	S	Bend	trans	-125.6	36.3	-179	57.1	0	0	0	0	114.3
416	L	33.1	Very low	31.5	Very low	179 Å²	179	146.4 Å²	146.4	94%	0.937	74%	0.738	S	S	*	*			trans	-133.2	65.9	170.9	-103.5	147	0	0	0	109.8
417	S	31.3	Very low	30.9	Very low	109 Å²	109	143.3 Å²	143.3	76%	0.762	73%	0.734	S	S	*	*			trans	-163.8	136.4	154.6	-164.1	0	0	0	0	108.9
418	S	31	Very low	30.3	Very low	123 Å²	123	145.4 Å²	145.4	86%	0.86	74%	0.736	S	S	*	*			trans	81.6	119.2	-173.3	-27.9	0	0	0	0	112.9
419	G	28.6	Very low	29.7	Very low	72 Å²	72	146.1 Å²	146.1	74%	0.742	74%	0.741	S	S	*	*			cis	133.3	116.1	15.5	0	0	0	0	0	108.6
420	M	27.1	Very low	29.1	Very low	172 Å²	172	144.6 Å²	144.6	85%	0.847	75%	0.746	S	S	*	*			trans	71	118.5	155.6	-81	164.3	73.6	0	0	122.4
421	N	26.4	Very low	28.9	Very low	125 Å²	125	148.5 Å²	148.5	67%	0.668	76%	0.762	S	S	*	*				85.4	124.9	121.9	-84.7	-3.4	0	0	0	123.6
422	I	27.9	Very low	28.6	Very low	133 Å²	133	147 Å²	147	68%	0.682	77%	0.765	S	S	*	*				107.6	127.9	122.8	-76.7	169	0	0	0	121.1
423	Y	25.1	Very low	28.2	Very low	209 Å²	209	143.6 Å²	143.6	82%	0.82	77%	0.77	S	S	*	*			trans	73.7	118.1	149.6	-90	-65.5	0	0	0	125.2
424	S	25.2	Very low	28.2	Very low	86 Å²	86	140 Å²	140	60%	0.601	77%	0.77	S	S	*	*			trans	58.5	146.5	130.5	55.5	0	0	0	0	126.7
425	Q	26.1	Very low	28.2	Very low	178 Å²	178	136 Å²	136	83%	0.832	77%	0.766	S	S	*	*			trans	80.4	110.4	145	-87.6	169.2	-24.7	0	0	117.3
426	S	23.5	Very low	27.9	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	76%	0.76	S	S	*	*				78	104.1	79.2	171.5	0	0	0	0	113.5
427	M	24.1	Very low	27.8	Very low	147 Å²	147	132.9 Å²	132.9	72%	0.724	76%	0.756	S	S	*	*				157.6	139.5	122.1	-86.4	-133.5	-142	0	0	111.5
428	R	25.3	Very low	27.9	Very low	197 Å²	197	134.5 Å²	134.5	74%	0.743	76%	0.755	S	S	*	*			trans	27.4	136	137.9	-77.1	176.1	-120.5	-134.4	-4.7	117.4
429	E	24.9	Very low	28.1	Very low	158 Å²	158	133.6 Å²	133.6	74%	0.738	75%	0.746	S	S	*	*			cis	-179.9	159.6	43.8	-131.6	152.3	-147.2	0	0	109.5
430	S	24.9	Very low	28	Very low	109 Å²	109	139 Å²	139	76%	0.762	75%	0.754	S	S	*	*			trans	78.2	97.8	146.3	63	0	0	0	0	120.8
431	T	32	Very low	28.2	Very low	127 Å²	127	136.2 Å²	136.2	78%	0.779	75%	0.746	S	S	*	*			trans	-74.6	154.8	140.4	43.2	0	0	0	0	109.6
432	P	31.9	Very low	28.3	Very low	115 Å²	115	139 Å²	139	75%	0.747	76%	0.755	S	S	*	*				-140.6	136.6	92.1	30.2	-12.4	0	0	0	114.4
433	C	26.2	Very low	28.4	Very low	128 Å²	128	138.2 Å²	138.2	87%	0.865	76%	0.761	S	S	*	*			trans	-84.4	128.3	152.5	-73.4	0	0	0	0	108.1
434	V	31.8	Very low	28.6	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	76%	0.758	S	S	*	*			trans	-120	113.7	166.9	174.9	0	0	0	0	108.8
435	N	31.6	Very low	28.8	Very low	139 Å²	139	138.2 Å²	138.2	74%	0.743	77%	0.771	S	S	*	*			trans	8.3	151	140.1	-77	-23.2	0	0	0	118.7
436	A	29.1	Very low	29.2	Very low	76 Å²	76	135.5 Å²	135.5	63%	0.628	77%	0.766	S	S	*	*				-168.3	133.7	53.3	0	0	0	0	0	113.9
437	N	30.8	Very low	30.5	Very low	161 Å²	161	140 Å²	140	86%	0.861	79%	0.793	S	S	*	*				162.8	107.3	108.7	-86.2	-21.7	0	0	0	112.1
438	I	32.4	Very low	30.8	Very low	143 Å²	143	139.7 Å²	139.7	73%	0.733	80%	0.796	S	S	*	*			trans	-77	173.2	169.8	-69.2	166.1	0	0	0	108.9
439	P	34.5	Very low	31.1	Very low	104 Å²	104	136.6 Å²	136.6	68%	0.675	80%	0.799	S	S	*	*			cis	-134.8	162.6	3.6	16.5	9.5	0	0	0	117.8
440	M	28	Very low	31.4	Very low	185 Å²	185	135.4 Å²	135.4	91%	0.911	80%	0.802	S	S	*	*				-143.9	100.3	126.5	-91.9	-165	-173.4	0	0	106.5
441	T	30.3	Very low	31.8	Very low	113 Å²	113	137 Å²	137	69%	0.693	81%	0.805	S	S	*	*				43.2	103	104.5	51.3	0	0	0	0	116.4
442	Q	29	Very low	31.8	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	81%	0.806	S	S	*	*			trans	53.8	120	135.7	-76.2	176.3	-24.1	0	0	121.2
443	C	29.7	Very low	31.8	Very low	118 Å²	118	139.1 Å²	139.1	80%	0.797	81%	0.81	S	S	*	*				171.9	100.9	116.3	-89.3	0	0	0	0	107.9
444	S	28.9	Very low	32.2	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	81%	0.807	S	S	*	*				86	101.2	95.7	-60.8	0	0	0	0	113.7
445	E	30.7	Very low	32.2	Very low	186 Å²	186	140.8 Å²	140.8	87%	0.869	81%	0.809	S	S	*	*				7.9	138.9	122.2	-80.2	-178.4	173.8	0	0	116.2
446	V	34.2	Very low	32.3	Very low	121 Å²	121	141 Å²	141	73%	0.733	81%	0.814	S	S	*	*			cis	176.4	172.5	34.7	141.6	0	0	0	0	105.1
447	P	50	Low	32.6	Very low	193 Å²	193	146.9 Å²	146.9	100%	1.253	83%	0.831	S	S	*	*			cis	-106.5	0	-12.8	13.1	8.6	0	0	0	114.4

Retrieved 447 of 447 residues in 277.9 ms (Link to these results)

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