A0A087YHP0_POEFO Loading...

Serine incorporator 5

AlphaFold DB , UniProt , Accession A0A087YHP0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 459 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	51.3	Low	221 Å²	221	86.1 Å²	86.1	100%	1.089	50%	0.504	S	S	*	.				0	-2.7	0	-79.7	175.6	166.3	0	0	114.4
2	C	50.2	Low	51.7	Low	97 Å²	97	80 Å²	80	66%	0.655	47%	0.469	S	S	*	.			trans	-91.8	-21.7	-177.3	-60.7	0	0	0	0	116.2	C6	C2-C6 PolarHBondContact O-N 3.19Å; C2-C6 PolarHBondContact O-SG 3.49Å
3	T	52.8	Low	51.9	Low	111 Å²	111	77.7 Å²	77.7	68%	0.681	46%	0.459	S	S	*	.	H	α-helix	trans	-65.5	-45.7	-176.6	33.4	0	0	0	0	115.1	C5 C6 V7	T3-C5 VanDerWaalsContact C-N 3.34Å; T3-C5 PolarHBondContact O-N 3.32Å; T3-C6 PolarHBondContact O-N 3.08Å; T3-V7 VanDerWaalsContact O-CG2 3.26Å; T3-V7 WeakPolarHBondContact O-CG2 2.94Å; T3-V7 PolarHBondContact O-N 3.37Å
4	P	53.6	Low	51.7	Low	59 Å²	59	76.9 Å²	76.9	38%	0.383	46%	0.459	S	S	.	.	H	α-helix	trans	-69.7	-30.2	179.8	25.4	-32.6	0	0	0	113	V7 S8	P4-V7 PolarHBondContact O-N 3.29Å; P4-S8 WeakPolarHBondContact O-CB 3.48Å; P4-S8 PolarHBondContact O-N 2.87Å; P4-S8 PolarHBondContact O-OG 3.48Å
5	C	47.8	Very low	52.1	Low	29 Å²	29	73 Å²	73	20%	0.196	44%	0.44	C	S	.	.	H	α-helix	trans	-70.9	-41.6	172.9	165.3	0	0	0	0	112.3	T3 V7 S8 Q9 C22	T3-C5 VanDerWaalsContact C-N 3.34Å; T3-C5 PolarHBondContact O-N 3.32Å; C5-V7 VanDerWaalsContact C-N 3.28Å; C5-V7 PolarHBondContact O-N 2.99Å; C5-S8 WeakPolarHBondContact CA-OG 3.36Å; C5-S8 PolarHBondContact O-N 2.7Å; C5-S8 PolarHBondContact O-OG 2.97Å; C5-Q9 WeakPolarHBondContact O-CB 3.46Å; C5-Q9 WeakPolarHBondContact O-CG 3.44Å; C5-Q9 PolarHBondContact O-N 3.28Å; C5-C22 VanDerWaalsContact CA-SG 3.57Å; C5-C22 HydrophobicContact CB-CB 3.89Å; C5-C22 WeakPolarHBondContact CB-SG 3.44Å; C5-C22 WeakPolarHBondContact SG-CB 3.43Å; C5-C22 CovalentContact SG-SG 2.03Å; C5-C22 PolarHBondContact SG-SG 3.19Å
6	C	48.4	Very low	52.3	Low	65 Å²	65	73.1 Å²	73.1	44%	0.439	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-37.1	173.6	-70.8	0	0	0	0	111.4	C2 T3 L10	C2-C6 PolarHBondContact O-N 3.19Å; C2-C6 PolarHBondContact O-SG 3.49Å; T3-C6 PolarHBondContact O-N 3.08Å; C6-L10 WeakPolarHBondContact O-CB 3.4Å; C6-L10 WeakPolarHBondContact O-CD1 3.27Å; C6-L10 WeakPolarHBondContact O-CG 2.92Å; C6-L10 PolarHBondContact O-N 3.39Å
7	V	53.8	Low	52.5	Low	96 Å²	96	70.8 Å²	70.8	58%	0.582	44%	0.436	S	S	*	.	H	α-helix	trans	-69.9	-40.3	176	173.6	0	0	0	0	111.5	T3 P4 C5 L10 A11	T3-V7 VanDerWaalsContact O-CG2 3.26Å; T3-V7 WeakPolarHBondContact O-CG2 2.94Å; T3-V7 PolarHBondContact O-N 3.37Å; P4-V7 PolarHBondContact O-N 3.29Å; C5-V7 VanDerWaalsContact C-N 3.28Å; C5-V7 PolarHBondContact O-N 2.99Å; V7-L10 PolarHBondContact O-N 3.3Å; V7-A11 WeakPolarHBondContact O-CB 2.99Å; V7-A11 PolarHBondContact O-N 3.32Å
8	S	54.9	Low	52.6	Low	27 Å²	27	67.4 Å²	67.4	19%	0.189	42%	0.416	C	S	.	.	H	α-helix	trans	-68.2	-37.2	175.6	67	0	0	0	0	112.3	P4 C5 A11 C12	P4-S8 WeakPolarHBondContact O-CB 3.48Å; P4-S8 PolarHBondContact O-N 2.87Å; P4-S8 PolarHBondContact O-OG 3.48Å; C5-S8 WeakPolarHBondContact CA-OG 3.36Å; C5-S8 PolarHBondContact O-N 2.7Å; C5-S8 PolarHBondContact O-OG 2.97Å; S8-A11 PolarHBondContact O-N 3.08Å; S8-C12 WeakPolarHBondContact O-CB 3.36Å; S8-C12 PolarHBondContact O-N 3.42Å
9	Q	55.5	Low	52.8	Low	97 Å²	97	65.2 Å²	65.2	45%	0.453	40%	0.403	S	S	.	.	H	α-helix	trans	-70.5	-38.4	172.6	-72.4	-167.5	-11.3	0	0	112.6	C5 A11 C12 C13	C5-Q9 WeakPolarHBondContact O-CB 3.46Å; C5-Q9 WeakPolarHBondContact O-CG 3.44Å; C5-Q9 PolarHBondContact O-N 3.28Å; Q9-A11 VanDerWaalsContact C-N 3.34Å; Q9-C12 PolarHBondContact O-N 3.08Å; Q9-C13 VanDerWaalsContact O-CB 3.23Å; Q9-C13 WeakPolarHBondContact O-CB 3.5Å; Q9-C13 PolarHBondContact O-N 3.12Å; Q9-C13 PolarHBondContact O-SG 3.2Å
10	L	51.8	Low	53	Low	107 Å²	107	62.8 Å²	62.8	56%	0.56	39%	0.389	S	S	*	.	H	α-helix	trans	-66.7	-35.5	172.1	-79.9	161.3	0	0	0	111.5	C6 V7 C14	C6-L10 WeakPolarHBondContact O-CB 3.4Å; C6-L10 WeakPolarHBondContact O-CD1 3.27Å; C6-L10 WeakPolarHBondContact O-CG 2.92Å; C6-L10 PolarHBondContact O-N 3.39Å; V7-L10 PolarHBondContact O-N 3.3Å; L10-C14 WeakPolarHBondContact O-CA 3.24Å; L10-C14 VanDerWaalsContact O-CB 3.24Å; L10-C14 WeakPolarHBondContact O-CB 3.25Å; L10-C14 PolarHBondContact O-N 3.42Å
11	A	54.6	Low	52.9	Low	38 Å²	38	63.2 Å²	63.2	31%	0.314	39%	0.394	S	S	.	.	H	α-helix	trans	-72.7	-32.2	175.1	0	0	0	0	0	112.7	V7 S8 Q9 G15 A17	V7-A11 WeakPolarHBondContact O-CB 2.99Å; V7-A11 PolarHBondContact O-N 3.32Å; S8-A11 PolarHBondContact O-N 3.08Å; Q9-A11 VanDerWaalsContact C-N 3.34Å; A11-G15 CarbonylContact O-C 3.5Å; A11-G15 VanDerWaalsContact O-C 3.29Å; A11-G15 WeakPolarHBondContact O-CA 3.32Å; A11-G15 PolarHBondContact O-N 1.99Å; A11-A17 HydrophobicContact CB-CB 4.49Å
12	C	56.4	Low	53.4	Low	13 Å²	13	54.9 Å²	54.9	9%	0.088	36%	0.357	C	S	.	.	H	α-helix	trans	-70.2	-46.3	169.2	143	0	0	0	0	111	S8 Q9 C19 W127	S8-C12 WeakPolarHBondContact O-CB 3.36Å; S8-C12 PolarHBondContact O-N 3.42Å; Q9-C12 PolarHBondContact O-N 3.08Å; C12-C19 HydrophobicContact CB-CB 3.99Å; C12-C19 WeakPolarHBondContact CB-SG 3.31Å; C12-C19 VanDerWaalsContact SG-CA 3.52Å; C12-C19 WeakPolarHBondContact SG-CB 3.34Å; C12-C19 CovalentContact SG-SG 2.04Å; C12-C19 PolarHBondContact SG-SG 3.3Å; C12-W127 VanDerWaalsContact O-CD1 3.24Å
13	C	53.8	Low	53.2	Low	50 Å²	50	53.1 Å²	53.1	34%	0.338	34%	0.344	S	S	.	.	H	α-helix	trans	-69.6	-41.1	-179.4	-74.1	0	0	0	0	113	Q9 W127 L128	Q9-C13 VanDerWaalsContact O-CB 3.23Å; Q9-C13 WeakPolarHBondContact O-CB 3.5Å; Q9-C13 PolarHBondContact O-N 3.12Å; Q9-C13 PolarHBondContact O-SG 3.2Å; C13-W127 PolarHBondContact O-N 3.11Å; C13-L128 HydrophobicContact CB-CB 4.2Å; C13-L128 WeakPolarHBondContact O-CB 3.49Å; C13-L128 PolarHBondContact O-N 3.37Å
14	C	49.2	Very low	53.1	Low	67 Å²	67	53.7 Å²	53.7	45%	0.453	34%	0.343	S	S	.	.	H	α-helix	trans	-116.8	-4	-170.3	-58.5	0	0	0	0	114.7	L10 F126	L10-C14 WeakPolarHBondContact O-CA 3.24Å; L10-C14 VanDerWaalsContact O-CB 3.24Å; L10-C14 WeakPolarHBondContact O-CB 3.25Å; L10-C14 PolarHBondContact O-N 3.42Å; C14-F126 WeakPolarHBondContact O-CD1 3.48Å; C14-F126 WeakPolarHBondContact O-CE1 3.49Å
15	G	57.5	Low	52.8	Low	18 Å²	18	56.6 Å²	56.6	19%	0.186	36%	0.364	C	S	.	.	S	Bend	trans	-121.3	-176.9	-176.8	0	0	0	0	0	114	A11 A17 F126	A11-G15 CarbonylContact O-C 3.5Å; A11-G15 VanDerWaalsContact O-C 3.29Å; A11-G15 WeakPolarHBondContact O-CA 3.32Å; A11-G15 PolarHBondContact O-N 1.99Å; G15-A17 VanDerWaalsContact C-N 3.28Å; G15-A17 PolarHBondContact O-N 3.26Å; G15-F126 PolarHBondContact O-N 3.12Å
16	S	56.1	Low	53.1	Low	74 Å²	74	57.5 Å²	57.5	52%	0.517	37%	0.37	S	S	.	.	S	Bend	trans	-81.1	-4.8	179.6	54	0	0	0	0	114
17	A	55.5	Low	53.8	Low	34 Å²	34	59 Å²	59	28%	0.281	38%	0.379	S	S	.	.	S	Bend	trans	-72.7	142.8	-177.3	0	0	0	0	0	111.3	A11 G15	A11-A17 HydrophobicContact CB-CB 4.49Å; G15-A17 VanDerWaalsContact C-N 3.28Å; G15-A17 PolarHBondContact O-N 3.26Å
18	A	55.3	Low	54.3	Low	10 Å²	10	58.8 Å²	58.8	8%	0.083	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-65.4	147.1	172.5	0	0	0	0	0	110.8	S20 Q31 V377 Y379	A18-S20 PolarHBondContact O-N 3.23Å; A18-Q31 HydrophobicContact CB-CG 4.03Å; A18-V377 HydrophobicContact CB-CG1 3.76Å; A18-V377 HydrophobicContact CB-CG2 4.42Å; A18-Y379 HydrophobicContact CB-CE1 4.48Å
19	C	54.9	Low	54.9	Low	26 Å²	26	59 Å²	59	18%	0.176	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-73.2	120.5	179.7	-69.9	0	0	0	0	112	C12 W127	C12-C19 HydrophobicContact CB-CB 3.99Å; C12-C19 WeakPolarHBondContact CB-SG 3.31Å; C12-C19 VanDerWaalsContact SG-CA 3.52Å; C12-C19 WeakPolarHBondContact SG-CB 3.34Å; C12-C19 CovalentContact SG-SG 2.04Å; C12-C19 PolarHBondContact SG-SG 3.3Å; C19-W127 PolarHBondContact SG-NE1 3.48Å
20	S	56.7	Low	55.8	Low	16 Å²	16	57 Å²	57	11%	0.112	36%	0.359	C	S	.	.			trans	-106.1	140	169.3	65.5	0	0	0	0	110.2	A18 Q375	A18-S20 PolarHBondContact O-N 3.23Å; S20-Q375 VanDerWaalsContact CB-O 3.28Å; S20-Q375 WeakPolarHBondContact CB-O 3.09Å
21	C	51.4	Low	57	Low	73 Å²	73	52.4 Å²	52.4	49%	0.493	33%	0.334	S	S	.	.			trans	-73.2	138.3	168.3	-69.3	0	0	0	0	108.9	C23 Q375	C21-C23 PolarHBondContact O-N 3.46Å; C21-Q375 VanDerWaalsContact CB-OE1 3.31Å; C21-Q375 VanDerWaalsContact O-CB 3.31Å; C21-Q375 WeakPolarHBondContact O-CB 3.26Å; C21-Q375 PolarHBondContact O-N 3.08Å
22	C	51.9	Low	58	Low	46 Å²	46	50.6 Å²	50.6	31%	0.311	32%	0.32	S	S	.	.	S	Bend	trans	-71	15.1	179.3	-72.4	0	0	0	0	114.9	C5	C5-C22 VanDerWaalsContact CA-SG 3.57Å; C5-C22 HydrophobicContact CB-CB 3.89Å; C5-C22 WeakPolarHBondContact CB-SG 3.44Å; C5-C22 WeakPolarHBondContact SG-CB 3.43Å; C5-C22 CovalentContact SG-SG 2.03Å; C5-C22 PolarHBondContact SG-SG 3.19Å
23	C	46.1	Very low	58.8	Low	59 Å²	59	52 Å²	52	40%	0.399	33%	0.328	S	S	.	.			trans	-101.1	117.4	179.8	-173.2	0	0	0	0	109.7	C21 C25 C26	C21-C23 PolarHBondContact O-N 3.46Å; C23-C25 PolarHBondContact O-N 3.46Å; C23-C26 HydrophobicContact CB-CB 4.42Å; C23-C26 WeakPolarHBondContact O-CB 3.2Å; C23-C26 PolarHBondContact O-N 3.29Å; C23-C26 VanDerWaalsContact O-N 3.16Å
24	N	48.7	Very low	59.9	Low	123 Å²	123	50.3 Å²	50.3	66%	0.658	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.7	174	-80.8	-0.5	0	0	0	113.1	G374	N24-G374 PolarHBondContact OD1-N 3.42Å; N24-G374 VanDerWaalsContact OD1-N 3.14Å
25	C	48.8	Very low	61.5	Low	121 Å²	121	47.2 Å²	47.2	82%	0.818	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.1	175.3	-59.2	0	0	0	0	113.2	C23	C23-C25 PolarHBondContact O-N 3.46Å
26	C	54.1	Low	62.6	Low	47 Å²	47	47.6 Å²	47.6	32%	0.318	29%	0.294	S	S	.	.	S	Bend	trans	-80.3	135.7	176.6	-74.3	0	0	0	0	110.8	C23 Q375	C23-C26 HydrophobicContact CB-CB 4.42Å; C23-C26 WeakPolarHBondContact O-CB 3.2Å; C23-C26 PolarHBondContact O-N 3.29Å; C23-C26 VanDerWaalsContact O-N 3.16Å; C26-Q375 HydrophobicContact CB-CB 4.36Å; C26-Q375 HydrophobicContact CB-CG 4.08Å
27	P	62.4	Low	63.8	Low	98 Å²	98	47.6 Å²	47.6	64%	0.636	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-63.3	160.6	178.5	27.7	-34.9	0	0	0	111.4	I29 Q375	P27-I29 PolarHBondContact O-N 3.46Å; P27-Q375 WeakPolarHBondContact O-CG 2.91Å; P27-Q375 PolarHBondContact O-NE2 3.49Å
28	K	64.8	Low	65.1	Low	90 Å²	90	48 Å²	48	39%	0.391	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-56.1	140.3	178.6	-52.1	-163	175.1	179.4	0	110.7	E368 S376 V378	K28-E368 IonicContact NZ-OE1 2.87Å; K28-E368 PolarHBondContact NZ-OE1 3.4Å; K28-S376 VanDerWaalsContact CG-OG 3.29Å; K28-S376 WeakPolarHBondContact CG-OG 3.32Å; K28-V378 HydrophobicContact CB-CG2 4.43Å; K28-V378 HydrophobicContact CD-CG2 4.44Å
29	I	67.6	Low	66.7	Low	33 Å²	33	47.5 Å²	47.5	17%	0.169	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.8	176.5	-168.4	167	0	0	0	110.9	P27 I37 Q375 S376 V377 V378	P27-I29 PolarHBondContact O-N 3.46Å; I29-I37 HydrophobicContact CD1-CD1 4.45Å; I29-Q375 HydrophobicContact CG2-CG 4.32Å; I29-S376 PolarHBondContact N-O 3.28Å; I29-V377 HydrophobicContact CG2-CG2 4.12Å; I29-V377 WeakPolarHBondContact O-CA 3.27Å; I29-V378 PolarHBondContact O-N 3.24Å
30	K	74	Confident	68	Low	54 Å²	54	47 Å²	47	24%	0.235	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.9	171.5	-64.9	-173.3	-173.3	-176.7	0	109.9	S32 T33 G34 D362 V378 D380	K30-S32 VanDerWaalsContact C-N 3.25Å; K30-S32 PolarHBondContact O-N 3.45Å; K30-T33 WeakPolarHBondContact O-CB 3.39Å; K30-T33 PolarHBondContact O-N 3.43Å; K30-G34 PolarHBondContact O-N 3.38Å; K30-D362 IonicContact NZ-OD2 2.77Å; K30-D362 PolarHBondContact NZ-OD2 3.23Å; K30-V378 WeakPolarHBondContact CA-O 3.32Å; K30-V378 HydrophobicContact CG-CB 4.41Å; K30-D380 HydrophobicContact CB-CB 4.49Å; K30-D380 WeakPolarHBondContact CB-OD2 3.41Å; K30-D380 HydrophobicContact CD-CB 4.4Å
31	Q	77.6	Confident	69.4	Low	10 Å²	10	50.4 Å²	50.4	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-54	-43.8	178.9	-179.9	-174.8	24.3	0	0	111.1	A18 T33 G34 T35 N124 V377 V378 Y379 D380	A18-Q31 HydrophobicContact CB-CG 4.03Å; Q31-T33 PolarHBondContact O-N 3.28Å; Q31-G34 PolarHBondContact O-N 2.76Å; Q31-T35 HydrophobicContact CG-CG2 4.25Å; Q31-T35 WeakPolarHBondContact O-CG2 3.34Å; Q31-T35 PolarHBondContact O-N 3.21Å; Q31-T35 PolarHBondContact O-OG1 3.47Å; Q31-T35 VanDerWaalsContact O-OG1 3.1Å; Q31-N124 HydrophobicContact CG-CB 4.47Å; Q31-N124 VanDerWaalsContact NE2-CB 3.33Å; Q31-V377 HydrophobicContact CB-CG1 4.18Å; Q31-V378 PolarHBondContact N-O 3.18Å; Q31-Y379 HydrophobicContact CB-CD1 4.41Å; Q31-Y379 HydrophobicContact CG-CD1 4.45Å; Q31-D380 PolarHBondContact N-OD1 3.01Å
32	S	74.5	Confident	71.2	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-35	177.4	73.7	0	0	0	0	112.6	K30 T35 R36 D380	K30-S32 VanDerWaalsContact C-N 3.25Å; K30-S32 PolarHBondContact O-N 3.45Å; S32-T35 PolarHBondContact O-OG1 3.19Å; S32-R36 VanDerWaalsContact O-CG 3.25Å; S32-R36 WeakPolarHBondContact O-CG 3.29Å; S32-R36 PolarHBondContact O-NE 3.35Å; S32-D380 WeakPolarHBondContact CB-OD1 3.17Å; S32-D380 WeakPolarHBondContact CB-OD2 3.2Å; S32-D380 PolarHBondContact N-OD1 2.72Å; S32-D380 PolarHBondContact OG-OD1 3.04Å; S32-D380 PolarHBondContact OG-OD2 3.05Å
33	T	74.6	Confident	73	Confident	43 Å²	43	46 Å²	46	26%	0.264	26%	0.261	S	S	.	.	H	α-helix	trans	-77.3	-44	179.1	-60.2	0	0	0	0	111.3	K30 Q31 T35 R36 I37	K30-T33 WeakPolarHBondContact O-CB 3.39Å; K30-T33 PolarHBondContact O-N 3.43Å; Q31-T33 PolarHBondContact O-N 3.28Å; T33-T35 VanDerWaalsContact C-N 3.35Å; T33-T35 PolarHBondContact O-N 3.49Å; T33-R36 PolarHBondContact O-N 3.37Å; T33-R36 PolarHBondContact OG1-NH2 3.29Å; T33-R36 VanDerWaalsContact OG1-NH2 3.12Å; T33-I37 HydrophobicContact CG2-CD1 3.9Å; T33-I37 WeakPolarHBondContact O-CG1 3.39Å; T33-I37 PolarHBondContact O-N 3.02Å
34	G	76.5	Confident	74.8	Confident	14 Å²	14	45.4 Å²	45.4	14%	0.144	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-44.2	177.6	0	0	0	0	0	112.6	K30 Q31 R36 I37 M38	K30-G34 PolarHBondContact O-N 3.38Å; Q31-G34 PolarHBondContact O-N 2.76Å; G34-R36 PolarHBondContact O-N 3.14Å; G34-I37 PolarHBondContact O-N 3.15Å; G34-M38 WeakPolarHBondContact O-CG 3.39Å; G34-M38 PolarHBondContact O-N 3.07Å
35	T	81.9	Confident	76.7	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-63.3	-43	-179.7	55.5	0	0	0	0	112.3	Q31 S32 T33 M38 Y39 N124 W127 Y387	Q31-T35 HydrophobicContact CG-CG2 4.25Å; Q31-T35 WeakPolarHBondContact O-CG2 3.34Å; Q31-T35 PolarHBondContact O-N 3.21Å; Q31-T35 PolarHBondContact O-OG1 3.47Å; Q31-T35 VanDerWaalsContact O-OG1 3.1Å; S32-T35 PolarHBondContact O-OG1 3.19Å; T33-T35 VanDerWaalsContact C-N 3.35Å; T33-T35 PolarHBondContact O-N 3.49Å; T35-M38 PolarHBondContact O-N 2.87Å; T35-Y39 WeakPolarHBondContact O-CD2 3.42Å; T35-Y39 PolarHBondContact O-N 3.34Å; T35-Y39 VanDerWaalsContact O-N 3.14Å; T35-N124 HydrophobicContact CG2-CB 3.83Å; T35-N124 WeakPolarHBondContact CG2-OD1 3.48Å; T35-W127 HydrophobicContact CG2-CH2 4.44Å; T35-W127 HydrophobicContact CG2-CZ2 3.98Å; T35-W127 WeakPolarHBondContact O-CH2 3.34Å; T35-Y387 PolarHBondContact OG1-OH 3.46Å
36	R	82.1	Confident	78.7	Confident	26 Å²	26	37.7 Å²	37.7	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-40.8	176.6	-68.3	-178.7	-76.9	146	1.4	112.5	S32 T33 G34 M38 Y39 A40 T332 Y387 F392	S32-R36 VanDerWaalsContact O-CG 3.25Å; S32-R36 WeakPolarHBondContact O-CG 3.29Å; S32-R36 PolarHBondContact O-NE 3.35Å; T33-R36 PolarHBondContact O-N 3.37Å; T33-R36 PolarHBondContact OG1-NH2 3.29Å; T33-R36 VanDerWaalsContact OG1-NH2 3.12Å; G34-R36 PolarHBondContact O-N 3.14Å; R36-M38 VanDerWaalsContact C-N 3.34Å; R36-Y39 PolarHBondContact O-N 2.9Å; R36-A40 WeakPolarHBondContact O-CB 3.44Å; R36-A40 PolarHBondContact O-N 3.44Å; R36-T332 WeakPolarHBondContact CD-O 3.09Å; R36-T332 PolarHBondContact NH1-O 3.18Å; R36-T332 VanDerWaalsContact NH1-O 3.07Å; R36-Y387 HydrophobicContact CG-CE1 4.15Å; R36-Y387 HydrophobicContact CG-CE2 4.24Å; R36-F392 HydrophobicContact CB-CE2 3.97Å; R36-F392 HydrophobicContact CB-CZ 4.24Å; R36-F392 HydrophobicContact CG-CD2 4.15Å; R36-F392 HydrophobicContact CG-CE2 3.49Å; R36-F392 VanDerWaalsContact CG-CE2 3.49Å; R36-F392 HydrophobicContact CG-CZ 3.96Å
37	I	79.6	Confident	80.2	Confident	74 Å²	74	35.6 Å²	35.6	38%	0.379	19%	0.189	S	C	.	.	H	α-helix	trans	-60.8	-45.1	175	-70.5	168.7	0	0	0	110.3	I29 T33 G34 Y39 A40 L41	I29-I37 HydrophobicContact CD1-CD1 4.45Å; T33-I37 HydrophobicContact CG2-CD1 3.9Å; T33-I37 WeakPolarHBondContact O-CG1 3.39Å; T33-I37 PolarHBondContact O-N 3.02Å; G34-I37 PolarHBondContact O-N 3.15Å; I37-Y39 PolarHBondContact O-N 3.06Å; I37-A40 WeakPolarHBondContact O-CB 3.24Å; I37-A40 PolarHBondContact O-N 3.15Å; I37-L41 HydrophobicContact CG2-CD1 4.21Å; I37-L41 HydrophobicContact CG2-CG 4.4Å; I37-L41 WeakPolarHBondContact O-CG 3.47Å; I37-L41 PolarHBondContact O-N 3.26Å
38	M	84.3	Confident	81.2	Confident	42 Å²	42	33.6 Å²	33.6	21%	0.207	18%	0.175	C	C	.	.	H	α-helix	trans	-62.6	-44.4	-179.6	-71.9	-62.4	-67.8	0	0	112.9	G34 T35 R36 A40 L41 Y42 W127	G34-M38 WeakPolarHBondContact O-CG 3.39Å; G34-M38 PolarHBondContact O-N 3.07Å; T35-M38 PolarHBondContact O-N 2.87Å; R36-M38 VanDerWaalsContact C-N 3.34Å; M38-A40 VanDerWaalsContact C-N 3.32Å; M38-A40 PolarHBondContact O-N 3.43Å; M38-L41 WeakPolarHBondContact O-CB 3.47Å; M38-L41 PolarHBondContact O-N 3.38Å; M38-L41 HydrophobicContact SD-CD1 4.13Å; M38-Y42 PolarHBondContact O-N 2.92Å; M38-Y42 VanDerWaalsContact O-N 3.08Å; M38-W127 HydrophobicContact CB-CD2 4.01Å; M38-W127 HydrophobicContact CB-CE3 3.66Å; M38-W127 HydrophobicContact CB-CH2 3.36Å; M38-W127 HydrophobicContact CB-CZ2 3.7Å; M38-W127 HydrophobicContact CB-CZ3 3.33Å; M38-W127 HydrophobicContact CE-CB 4.14Å; M38-W127 HydrophobicContact CE-CD2 3.88Å; M38-W127 HydrophobicContact CE-CE3 4.14Å; M38-W127 HydrophobicContact CE-CG 3.88Å; M38-W127 HydrophobicContact CG-CD2 4.16Å; M38-W127 HydrophobicContact CG-CE3 4.31Å; M38-W127 HydrophobicContact CG-CH2 4.12Å; M38-W127 HydrophobicContact CG-CZ2 3.92Å; M38-W127 HydrophobicContact CG-CZ3 4.3Å
39	Y	87.8	Confident	82.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-36.2	173.8	-76.2	-66.1	0	0	0	112.6	T35 R36 I37 L41 Y42 F43 F101 F102 H123 W127 K130 F392 H393	T35-Y39 WeakPolarHBondContact O-CD2 3.42Å; T35-Y39 PolarHBondContact O-N 3.34Å; T35-Y39 VanDerWaalsContact O-N 3.14Å; R36-Y39 PolarHBondContact O-N 2.9Å; I37-Y39 PolarHBondContact O-N 3.06Å; Y39-L41 VanDerWaalsContact C-N 3.31Å; Y39-L41 PolarHBondContact O-N 2.77Å; Y39-Y42 HydrophobicContact CD1-CD2 4.42Å; Y39-Y42 PolarHBondContact O-N 3.26Å; Y39-F43 PolarHBondContact O-N 3.06Å; Y39-F101 HydrophobicContact CD1-CE1 4.33Å; Y39-F101 HydrophobicContact CE1-CE1 4.28Å; Y39-F101 HydrophobicContact CE1-CZ 4.28Å; Y39-F102 AromaticContact CD1-CE1 3.99Å; Y39-F102 HydrophobicContact CD1-CE1 3.99Å; Y39-F102 HydrophobicContact CG-CE1 4.5Å; Y39-H123 AromaticContact CE2-CE1 3.44Å; Y39-H123 VanDerWaalsContact CE2-CE1 3.44Å; Y39-H123 WeakPolarHBondContact CE2-CE1 3.19Å; Y39-H123 AromaticContact CE2-ND1 3.56Å; Y39-H123 AromaticContact CZ-ND1 3.8Å; Y39-H123 PolarHBondContact OH-ND1 3.43Å; Y39-H123 PolarHBondContact OH-O 2.81Å; Y39-W127 HydrophobicContact CD1-CZ3 4.3Å; Y39-W127 AromaticContact CD2-CH2 3.92Å; Y39-W127 HydrophobicContact CD2-CH2 3.92Å; Y39-W127 HydrophobicContact CD2-CZ3 4.04Å; Y39-W127 HydrophobicContact CE1-CZ3 4.15Å; Y39-W127 AromaticContact CE2-CH2 3.71Å; Y39-W127 HydrophobicContact CE2-CH2 3.71Å; Y39-W127 AromaticContact CE2-CZ3 3.88Å; Y39-W127 HydrophobicContact CE2-CZ3 3.88Å; Y39-W127 HydrophobicContact CG-CZ3 4.23Å; Y39-W127 AromaticContact CZ-CZ3 3.94Å; Y39-K130 HydrophobicContact CE1-CD 4.2Å; Y39-K130 WeakPolarHBondContact OH-CE 3.48Å; Y39-K130 PolarHBondContact OH-NZ 2.88Å; Y39-K130 VanDerWaalsContact OH-NZ 3.08Å; Y39-F392 AromaticContact CD2-CE1 3.68Å; Y39-F392 HydrophobicContact CD2-CE1 3.68Å; Y39-F392 HydrophobicContact CD2-CZ 4.05Å; Y39-F392 HydrophobicContact CE2-CE1 4.4Å; Y39-F392 AromaticContact CG-CE1 3.96Å; Y39-F392 HydrophobicContact CG-CE1 3.96Å; Y39-F392 HydrophobicContact CG-CZ 4.27Å; Y39-H393 AromaticContact CD1-CE1 3.87Å; Y39-H393 AromaticContact CE1-CE1 3.55Å; Y39-H393 AromaticContact CE2-CE1 3.73Å; Y39-H393 AromaticContact CZ-CE1 3.47Å; Y39-H393 VanDerWaalsContact CZ-CE1 3.47Å; Y39-H393 AromaticContact CZ-NE2 3.95Å
40	A	83.4	Confident	83	Confident	16 Å²	16	30.9 Å²	30.9	13%	0.132	16%	0.164	C	C	.	.	H	α-helix	trans	-62.9	-38.5	173	0	0	0	0	0	111.6	R36 I37 M38 F43 L44 L329 F396	R36-A40 WeakPolarHBondContact O-CB 3.44Å; R36-A40 PolarHBondContact O-N 3.44Å; I37-A40 WeakPolarHBondContact O-CB 3.24Å; I37-A40 PolarHBondContact O-N 3.15Å; M38-A40 VanDerWaalsContact C-N 3.32Å; M38-A40 PolarHBondContact O-N 3.43Å; A40-F43 PolarHBondContact O-N 3.4Å; A40-L44 WeakPolarHBondContact O-CB 3.47Å; A40-L44 PolarHBondContact O-N 3.28Å; A40-L329 HydrophobicContact CB-CD2 3.45Å; A40-L329 VanDerWaalsContact CB-CD2 3.45Å; A40-L329 HydrophobicContact CB-CG 4.3Å; A40-F396 HydrophobicContact CB-CZ 4.17Å
41	L	84.5	Confident	83.2	Confident	86 Å²	86	31.7 Å²	31.7	45%	0.45	17%	0.174	S	C	.	.	H	α-helix	trans	-63.9	-37.8	174.3	-70.4	173.2	0	0	0	112.4	I37 M38 Y39 L44 L45	I37-L41 HydrophobicContact CG2-CD1 4.21Å; I37-L41 HydrophobicContact CG2-CG 4.4Å; I37-L41 WeakPolarHBondContact O-CG 3.47Å; I37-L41 PolarHBondContact O-N 3.26Å; M38-L41 WeakPolarHBondContact O-CB 3.47Å; M38-L41 PolarHBondContact O-N 3.38Å; M38-L41 HydrophobicContact SD-CD1 4.13Å; Y39-L41 VanDerWaalsContact C-N 3.31Å; Y39-L41 PolarHBondContact O-N 2.77Å; L41-L44 HydrophobicContact CD2-CD2 4.28Å; L41-L44 WeakPolarHBondContact O-CB 3.31Å; L41-L44 PolarHBondContact O-N 3.29Å; L41-L45 VanDerWaalsContact O-CB 3.3Å; L41-L45 WeakPolarHBondContact O-CB 3.08Å; L41-L45 PolarHBondContact O-N 3.32Å
42	Y	90.8	Very high	83.3	Confident	19 Å²	19	35.5 Å²	35.5	8%	0.075	19%	0.194	C	C	.	.	H	α-helix	trans	-64.4	-46.2	173.7	-72.1	-6.8	0	0	0	112.5	M38 Y39 L44 L45 V46 F101 W127 K130 F131 L134	M38-Y42 PolarHBondContact O-N 2.92Å; M38-Y42 VanDerWaalsContact O-N 3.08Å; Y39-Y42 HydrophobicContact CD1-CD2 4.42Å; Y39-Y42 PolarHBondContact O-N 3.26Å; Y42-L44 VanDerWaalsContact C-N 3.3Å; Y42-L44 PolarHBondContact O-N 3.36Å; Y42-L45 PolarHBondContact O-N 3.03Å; Y42-V46 PolarHBondContact O-N 3.47Å; Y42-F101 HydrophobicContact CD2-CE1 4.45Å; Y42-F101 HydrophobicContact CD2-CZ 4.25Å; Y42-W127 AromaticContact CE2-CE3 3.97Å; Y42-W127 HydrophobicContact CE2-CE3 3.97Å; Y42-W127 HydrophobicContact CE2-CZ3 4.41Å; Y42-W127 VanDerWaalsContact OH-C 3.29Å; Y42-W127 WeakPolarHBondContact OH-CA 3.35Å; Y42-W127 WeakPolarHBondContact OH-CB 3.4Å; Y42-W127 PolarHBondContact OH-O 3.28Å; Y42-K130 HydrophobicContact CE2-CB 3.86Å; Y42-F131 HydrophobicContact CE1-CB 4.34Å; Y42-F131 HydrophobicContact CE1-CD2 4.16Å; Y42-L134 HydrophobicContact CD2-CD2 4.4Å; Y42-L134 HydrophobicContact CG-CD2 4.14Å
43	F	88.6	Confident	83.3	Confident	9 Å²	9	36.2 Å²	36.2	4%	0.039	20%	0.197	C	C	.	.	H	α-helix	trans	-59.7	-44.1	175.5	-174.4	-87.8	0	0	0	111.6	Y39 A40 T47 M98 F102 I324 F396 V403	Y39-F43 PolarHBondContact O-N 3.06Å; A40-F43 PolarHBondContact O-N 3.4Å; F43-T47 WeakPolarHBondContact O-CB 3.34Å; F43-T47 PolarHBondContact O-N 3.29Å; F43-T47 PolarHBondContact O-OG1 3.4Å; F43-M98 HydrophobicContact CD2-CE 4.15Å; F43-M98 HydrophobicContact CD2-CG 4.48Å; F43-M98 HydrophobicContact CD2-SD 3.6Å; F43-M98 VanDerWaalsContact CD2-SD 3.6Å; F43-M98 HydrophobicContact CE2-CE 3.92Å; F43-M98 HydrophobicContact CE2-SD 4Å; F43-M98 HydrophobicContact CG-SD 4.14Å; F43-M98 HydrophobicContact CZ-CE 4.41Å; F43-F102 HydrophobicContact CB-CE2 4.19Å; F43-F102 HydrophobicContact CB-CZ 4.09Å; F43-F102 HydrophobicContact CD2-CD2 4.47Å; F43-F102 AromaticContact CD2-CE2 3.82Å; F43-F102 HydrophobicContact CD2-CE2 3.82Å; F43-F102 HydrophobicContact CD2-CZ 4.37Å; F43-I324 HydrophobicContact CE1-CG2 3.92Å; F43-F396 HydrophobicContact CB-CD1 3.87Å; F43-F396 HydrophobicContact CB-CE1 3.73Å; F43-F396 HydrophobicContact CD1-CE1 4.49Å; F43-F396 AromaticContact CD2-CD1 3.54Å; F43-F396 HydrophobicContact CD2-CD1 3.54Å; F43-F396 HydrophobicContact CD2-CE1 4.14Å; F43-F396 HydrophobicContact CE2-CD1 4.2Å; F43-F396 AromaticContact CG-CD1 3.77Å; F43-F396 HydrophobicContact CG-CD1 3.77Å; F43-F396 AromaticContact CG-CE1 3.87Å; F43-F396 HydrophobicContact CG-CE1 3.87Å; F43-V403 HydrophobicContact CE1-CG2 3.84Å; F43-V403 HydrophobicContact CZ-CB 4.44Å; F43-V403 HydrophobicContact CZ-CG2 3.55Å
44	L	84.7	Confident	83.3	Confident	46 Å²	46	36.2 Å²	36.2	24%	0.241	20%	0.195	C	C	.	.	H	α-helix	trans	-57.8	-52.6	176.9	-168.6	83.8	0	0	0	111.2	A40 L41 Y42 V46 T47 V48 F321 I325	A40-L44 WeakPolarHBondContact O-CB 3.47Å; A40-L44 PolarHBondContact O-N 3.28Å; L41-L44 HydrophobicContact CD2-CD2 4.28Å; L41-L44 WeakPolarHBondContact O-CB 3.31Å; L41-L44 PolarHBondContact O-N 3.29Å; Y42-L44 VanDerWaalsContact C-N 3.3Å; Y42-L44 PolarHBondContact O-N 3.36Å; L44-V46 PolarHBondContact O-N 3.36Å; L44-T47 WeakPolarHBondContact O-CB 3.21Å; L44-T47 PolarHBondContact O-N 3.21Å; L44-T47 VanDerWaalsContact O-N 3.14Å; L44-V48 WeakPolarHBondContact O-CG2 3.46Å; L44-V48 PolarHBondContact O-N 2.99Å; L44-F321 HydrophobicContact CD1-CD1 4.19Å; L44-F321 HydrophobicContact CD1-CE1 3.23Å; L44-F321 HydrophobicContact CD1-CE2 3.9Å; L44-F321 HydrophobicContact CD1-CZ 3.04Å; L44-F321 HydrophobicContact CG-CE1 3.93Å; L44-F321 HydrophobicContact CG-CZ 3.51Å; L44-I325 HydrophobicContact CD1-CD1 3.26Å; L44-I325 HydrophobicContact CD1-CG1 3.41Å; L44-I325 VanDerWaalsContact CD1-CG1 3.41Å
45	L	88.9	Confident	83	Confident	77 Å²	77	37.5 Å²	37.5	40%	0.403	20%	0.202	S	C	.	.	H	α-helix	trans	-56.2	-50.2	-176.9	178.1	69	0	0	0	111.2	L41 Y42 T47 V48 I49 F131	L41-L45 VanDerWaalsContact O-CB 3.3Å; L41-L45 WeakPolarHBondContact O-CB 3.08Å; L41-L45 PolarHBondContact O-N 3.32Å; Y42-L45 PolarHBondContact O-N 3.03Å; L45-T47 VanDerWaalsContact C-N 3.33Å; L45-T47 PolarHBondContact O-N 2.97Å; L45-V48 PolarHBondContact O-N 2.9Å; L45-I49 HydrophobicContact CD1-CD1 4.45Å; L45-I49 HydrophobicContact CG-CD1 4.2Å; L45-I49 VanDerWaalsContact O-CG1 3.31Å; L45-I49 WeakPolarHBondContact O-CG1 3.49Å; L45-I49 PolarHBondContact O-N 3.45Å; L45-F131 HydrophobicContact CD2-CD2 4.47Å; L45-F131 HydrophobicContact CD2-CE2 3.57Å; L45-F131 HydrophobicContact CD2-CZ 4.38Å
46	V	90.7	Very high	82.2	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.03	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-40.5	178.8	177.7	0	0	0	0	111	Y42 L44 V48 I49 C50 M94 M98 L134	Y42-V46 PolarHBondContact O-N 3.47Å; L44-V46 PolarHBondContact O-N 3.36Å; V46-V48 PolarHBondContact O-N 2.98Å; V46-I49 PolarHBondContact O-N 3.34Å; V46-C50 PolarHBondContact O-N 3.14Å; V46-C50 PolarHBondContact O-SG 2.98Å; V46-M94 HydrophobicContact CG1-CE 4.26Å; V46-M98 HydrophobicContact CB-SD 3.7Å; V46-M98 HydrophobicContact CG1-CB 4.07Å; V46-M98 HydrophobicContact CG1-CE 4.17Å; V46-M98 HydrophobicContact CG1-SD 3.85Å; V46-M98 HydrophobicContact CG2-SD 4.35Å; V46-L134 HydrophobicContact CG2-CD1 4.31Å; V46-L134 HydrophobicContact CG2-CD2 3.92Å; V46-L134 HydrophobicContact CG2-CG 4.26Å
47	T	85.2	Confident	81.6	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.018	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-41.9	177.4	-56.5	0	0	0	0	111.9	F43 L44 L45 I49 C50 V51 F321 V403 I407	F43-T47 WeakPolarHBondContact O-CB 3.34Å; F43-T47 PolarHBondContact O-N 3.29Å; F43-T47 PolarHBondContact O-OG1 3.4Å; L44-T47 WeakPolarHBondContact O-CB 3.21Å; L44-T47 PolarHBondContact O-N 3.21Å; L44-T47 VanDerWaalsContact O-N 3.14Å; L45-T47 VanDerWaalsContact C-N 3.33Å; L45-T47 PolarHBondContact O-N 2.97Å; T47-I49 VanDerWaalsContact C-N 3.32Å; T47-I49 PolarHBondContact O-N 3.41Å; T47-C50 WeakPolarHBondContact O-CB 3.34Å; T47-C50 PolarHBondContact O-N 3.15Å; T47-V51 WeakPolarHBondContact O-CG2 3.21Å; T47-V51 PolarHBondContact O-N 3.45Å; T47-F321 HydrophobicContact CG2-CD2 4.08Å; T47-F321 HydrophobicContact CG2-CE2 3.64Å; T47-V403 HydrophobicContact CG2-CG1 3.75Å; T47-V403 HydrophobicContact CG2-CG2 4.32Å; T47-I407 HydrophobicContact CG2-CD1 4.35Å
48	V	82.9	Confident	81.2	Confident	55 Å²	55	43.1 Å²	43.1	33%	0.333	24%	0.244	S	C	.	.	H	α-helix	trans	-60.3	-44.4	174.1	173.3	0	0	0	0	110.5	L44 L45 V46 C50 V51 I52 F321	L44-V48 WeakPolarHBondContact O-CG2 3.46Å; L44-V48 PolarHBondContact O-N 2.99Å; L45-V48 PolarHBondContact O-N 2.9Å; V46-V48 PolarHBondContact O-N 2.98Å; V48-C50 VanDerWaalsContact C-N 3.33Å; V48-C50 PolarHBondContact O-N 3.41Å; V48-V51 PolarHBondContact O-N 3.08Å; V48-I52 HydrophobicContact CG1-CD1 3.69Å; V48-I52 HydrophobicContact CG1-CG1 4.26Å; V48-I52 VanDerWaalsContact O-CG1 3.32Å; V48-I52 WeakPolarHBondContact O-CG1 3.39Å; V48-I52 PolarHBondContact O-N 2.82Å; V48-F321 HydrophobicContact CG2-CE1 4.16Å; V48-F321 HydrophobicContact CG2-CE2 4.09Å; V48-F321 HydrophobicContact CG2-CZ 3.42Å; V48-F321 VanDerWaalsContact CG2-CZ 3.42Å
49	I	86.7	Confident	80.3	Confident	66 Å²	66	42.5 Å²	42.5	34%	0.338	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-44.9	177.1	-64.1	164.5	0	0	0	110.2	L45 V46 T47 V51 I52 M53 M94	L45-I49 HydrophobicContact CD1-CD1 4.45Å; L45-I49 HydrophobicContact CG-CD1 4.2Å; L45-I49 VanDerWaalsContact O-CG1 3.31Å; L45-I49 WeakPolarHBondContact O-CG1 3.49Å; L45-I49 PolarHBondContact O-N 3.45Å; V46-I49 PolarHBondContact O-N 3.34Å; T47-I49 VanDerWaalsContact C-N 3.32Å; T47-I49 PolarHBondContact O-N 3.41Å; I49-V51 VanDerWaalsContact C-N 3.32Å; I49-V51 PolarHBondContact O-N 3.09Å; I49-I52 PolarHBondContact O-N 2.97Å; I49-M53 HydrophobicContact CG2-CG 4.31Å; I49-M53 HydrophobicContact CG2-SD 3.88Å; I49-M53 WeakPolarHBondContact O-CG 3.39Å; I49-M53 PolarHBondContact O-N 2.77Å; I49-M94 HydrophobicContact CB-CE 4.35Å; I49-M94 HydrophobicContact CG2-CE 3.76Å
50	C	84.8	Confident	79.4	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-40.4	175.9	-66.4	0	0	0	0	112.9	V46 T47 V48 M53 M54 V91 M94 C95 I407	V46-C50 PolarHBondContact O-N 3.14Å; V46-C50 PolarHBondContact O-SG 2.98Å; T47-C50 WeakPolarHBondContact O-CB 3.34Å; T47-C50 PolarHBondContact O-N 3.15Å; V48-C50 VanDerWaalsContact C-N 3.33Å; V48-C50 PolarHBondContact O-N 3.41Å; C50-M53 PolarHBondContact O-N 3.38Å; C50-M54 WeakPolarHBondContact O-CG 3.12Å; C50-M54 PolarHBondContact O-N 3.49Å; C50-V91 HydrophobicContact CB-CG1 4.3Å; C50-V91 HydrophobicContact CB-CG2 4.3Å; C50-M94 VanDerWaalsContact SG-CB 3.52Å; C50-C95 VanDerWaalsContact SG-SG 3.69Å; C50-I407 HydrophobicContact CB-CD1 3.62Å
51	V	77.2	Confident	78.8	Confident	71 Å²	71	51 Å²	51	43%	0.43	28%	0.281	S	S	.	.	H	α-helix	trans	-67.5	-41.8	176.1	173.5	0	0	0	0	111.2	T47 V48 I49 M53 M54 S55 I407	T47-V51 WeakPolarHBondContact O-CG2 3.21Å; T47-V51 PolarHBondContact O-N 3.45Å; V48-V51 PolarHBondContact O-N 3.08Å; I49-V51 VanDerWaalsContact C-N 3.32Å; I49-V51 PolarHBondContact O-N 3.09Å; V51-M53 VanDerWaalsContact C-N 3.27Å; V51-M53 PolarHBondContact O-N 3.16Å; V51-M54 WeakPolarHBondContact O-CB 3.44Å; V51-M54 PolarHBondContact O-N 3.07Å; V51-M54 VanDerWaalsContact O-N 3.13Å; V51-S55 PolarHBondContact O-N 3.46Å; V51-I407 HydrophobicContact CG2-CD1 3.88Å; V51-I407 HydrophobicContact CG2-CG1 4.39Å
52	I	79.4	Confident	78	Confident	90 Å²	90	49.1 Å²	49.1	46%	0.462	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-39.4	175.6	-71.3	170.3	0	0	0	110.6	V48 I49 M54 S55 V58	V48-I52 HydrophobicContact CG1-CD1 3.69Å; V48-I52 HydrophobicContact CG1-CG1 4.26Å; V48-I52 VanDerWaalsContact O-CG1 3.32Å; V48-I52 WeakPolarHBondContact O-CG1 3.39Å; V48-I52 PolarHBondContact O-N 2.82Å; I49-I52 PolarHBondContact O-N 2.97Å; I52-M54 PolarHBondContact O-N 3.32Å; I52-S55 WeakPolarHBondContact O-CB 3.4Å; I52-S55 PolarHBondContact O-N 3.44Å; I52-V58 HydrophobicContact CG2-CG2 3.76Å; I52-V58 WeakPolarHBondContact O-CB 3.15Å; I52-V58 VanDerWaalsContact O-CG2 3.25Å; I52-V58 WeakPolarHBondContact O-CG2 3.3Å
53	M	75.6	Confident	76.9	Confident	17 Å²	17	52.7 Å²	52.7	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-19.6	177.9	-69.2	172.4	81.6	0	0	114	I49 C50 V51 M62 A90 M94 F142	I49-M53 HydrophobicContact CG2-CG 4.31Å; I49-M53 HydrophobicContact CG2-SD 3.88Å; I49-M53 WeakPolarHBondContact O-CG 3.39Å; I49-M53 PolarHBondContact O-N 2.77Å; C50-M53 PolarHBondContact O-N 3.38Å; V51-M53 VanDerWaalsContact C-N 3.27Å; V51-M53 PolarHBondContact O-N 3.16Å; M53-M62 HydrophobicContact CE-CE 4.14Å; M53-A90 HydrophobicContact CE-CB 3.3Å; M53-M94 HydrophobicContact CE-CG 4.12Å; M53-M94 HydrophobicContact SD-CG 3.69Å; M53-F142 HydrophobicContact CE-CE1 4.41Å; M53-F142 HydrophobicContact CE-CZ 3.94Å
54	M	73.1	Confident	76	Confident	42 Å²	42	58.3 Å²	58.3	21%	0.207	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-0	173.2	-70.3	-81.1	-63	0	0	112.8	C50 V51 I52 Y88 V91 I407	C50-M54 WeakPolarHBondContact O-CG 3.12Å; C50-M54 PolarHBondContact O-N 3.49Å; V51-M54 WeakPolarHBondContact O-CB 3.44Å; V51-M54 PolarHBondContact O-N 3.07Å; V51-M54 VanDerWaalsContact O-N 3.13Å; I52-M54 PolarHBondContact O-N 3.32Å; M54-Y88 HydrophobicContact CE-CD1 3.84Å; M54-Y88 HydrophobicContact CE-CE1 3.37Å; M54-Y88 HydrophobicContact SD-CD1 3.53Å; M54-Y88 VanDerWaalsContact SD-CD1 3.53Å; M54-Y88 HydrophobicContact SD-CE1 3.72Å; M54-V91 HydrophobicContact CG-CG2 3.58Å; M54-V91 HydrophobicContact SD-CG2 3.94Å; M54-I407 HydrophobicContact CE-CG2 4.25Å; M54-I407 WeakPolarHBondContact CE-O 3.48Å; M54-I407 HydrophobicContact CG-CG2 3.58Å; M54-I407 HydrophobicContact SD-CG2 4.27Å
55	S	70.2	Confident	75.5	Confident	42 Å²	42	61.7 Å²	61.7	29%	0.294	34%	0.335	S	S	.	.	S	Bend	trans	-75.3	136.6	176.9	-179.1	0	0	0	0	110.1	V51 I52 T57 V58 E59	V51-S55 PolarHBondContact O-N 3.46Å; I52-S55 WeakPolarHBondContact O-CB 3.4Å; I52-S55 PolarHBondContact O-N 3.44Å; S55-T57 PolarHBondContact O-N 2.94Å; S55-T57 VanDerWaalsContact O-N 3.08Å; S55-V58 PolarHBondContact O-N 2.94Å; S55-E59 PolarHBondContact O-N 3.16Å; S55-E59 VanDerWaalsContact O-N 3.15Å
56	P	66.2	Low	74.6	Confident	82 Å²	82	61.4 Å²	61.4	53%	0.532	33%	0.333	S	S	.	.	H	α-helix	trans	-56.5	-30.7	178.7	22	-33.5	0	0	0	112.8	V58 E59 D60	P56-V58 PolarHBondContact O-N 3.34Å; P56-E59 PolarHBondContact O-N 3.25Å; P56-D60 PolarHBondContact O-N 3.4Å
57	T	69.8	Low	73	Confident	100 Å²	100	66.8 Å²	66.8	61%	0.613	37%	0.368	S	S	*	.	H	α-helix	trans	-64.2	-38.3	177.2	-46.4	0	0	0	0	112.8	S55 M61	S55-T57 PolarHBondContact O-N 2.94Å; S55-T57 VanDerWaalsContact O-N 3.08Å; T57-M61 VanDerWaalsContact O-CG 3.31Å; T57-M61 WeakPolarHBondContact O-CG 3.35Å; T57-M61 PolarHBondContact O-N 3.4Å
58	V	70.4	Confident	72.1	Confident	37 Å²	37	73.2 Å²	73.2	22%	0.224	40%	0.396	C	S	.	.	H	α-helix	trans	-78.2	-35.7	179.8	177.6	0	0	0	0	110.4	I52 S55 P56 M61 M62	I52-V58 HydrophobicContact CG2-CG2 3.76Å; I52-V58 WeakPolarHBondContact O-CB 3.15Å; I52-V58 VanDerWaalsContact O-CG2 3.25Å; I52-V58 WeakPolarHBondContact O-CG2 3.3Å; S55-V58 PolarHBondContact O-N 2.94Å; P56-V58 PolarHBondContact O-N 3.34Å; V58-M61 PolarHBondContact O-N 3.33Å; V58-M62 HydrophobicContact CG1-CE 4.25Å; V58-M62 HydrophobicContact CG1-CG 4.36Å; V58-M62 WeakPolarHBondContact O-CB 3.5Å; V58-M62 WeakPolarHBondContact O-CG 3.28Å; V58-M62 PolarHBondContact O-N 3.06Å
59	E	66.5	Low	71.4	Confident	29 Å²	29	71.2 Å²	71.2	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-60.2	-44.8	174.7	-66.7	-177.3	176.9	0	0	112.2	S55 P56 M62 K63	S55-E59 PolarHBondContact O-N 3.16Å; S55-E59 VanDerWaalsContact O-N 3.15Å; P56-E59 PolarHBondContact O-N 3.25Å; E59-M62 PolarHBondContact O-N 2.87Å; E59-K63 PolarHBondContact O-N 3.25Å
60	D	68.7	Low	70.4	Confident	74 Å²	74	73.8 Å²	73.8	40%	0.396	40%	0.397	S	S	.	.	H	α-helix	trans	-67.8	-41.4	177.7	-74.3	-30.4	0	0	0	111.7	P56 M62 K63 D64 K83	P56-D60 PolarHBondContact O-N 3.4Å; D60-M62 VanDerWaalsContact C-N 3.31Å; D60-M62 PolarHBondContact O-N 3.25Å; D60-K63 PolarHBondContact O-N 3.37Å; D60-D64 PolarHBondContact O-N 2.79Å; D60-K83 IonicContact OD1-NZ 2.72Å; D60-K83 PolarHBondContact OD1-NZ 3.39Å
61	M	69.1	Low	69.6	Low	120 Å²	120	78 Å²	78	59%	0.591	42%	0.417	S	S	*	.	H	α-helix	trans	-61.8	-36.7	173.3	-76.2	-111.5	-67.5	0	0	113.1	T57 V58 N65	T57-M61 VanDerWaalsContact O-CG 3.31Å; T57-M61 WeakPolarHBondContact O-CG 3.35Å; T57-M61 PolarHBondContact O-N 3.4Å; V58-M61 PolarHBondContact O-N 3.33Å; M61-N65 WeakPolarHBondContact O-CB 3.46Å; M61-N65 PolarHBondContact O-N 3.34Å; M61-N65 VanDerWaalsContact O-N 3.15Å; M61-N65 PolarHBondContact O-ND2 3.37Å
62	M	69	Low	69.1	Low	47 Å²	47	77 Å²	77	23%	0.232	41%	0.409	C	S	.	.	H	α-helix	trans	-67.6	-40	176.7	-82.1	-169	169.9	0	0	111.7	M53 V58 E59 D60 D64 I66	M53-M62 HydrophobicContact CE-CE 4.14Å; V58-M62 HydrophobicContact CG1-CE 4.25Å; V58-M62 HydrophobicContact CG1-CG 4.36Å; V58-M62 WeakPolarHBondContact O-CB 3.5Å; V58-M62 WeakPolarHBondContact O-CG 3.28Å; V58-M62 PolarHBondContact O-N 3.06Å; E59-M62 PolarHBondContact O-N 2.87Å; D60-M62 VanDerWaalsContact C-N 3.31Å; D60-M62 PolarHBondContact O-N 3.25Å; M62-D64 VanDerWaalsContact C-N 3.32Å; M62-D64 PolarHBondContact O-N 3.07Å; M62-I66 HydrophobicContact CB-CD1 3.77Å; M62-I66 HydrophobicContact CB-CG1 4.48Å; M62-I66 HydrophobicContact CG-CD1 3.82Å; M62-I66 WeakPolarHBondContact O-CB 3.39Å; M62-I66 WeakPolarHBondContact O-CG1 3.25Å; M62-I66 PolarHBondContact O-N 2.75Å; M62-I66 HydrophobicContact SD-CD1 4.25Å
63	K	67.1	Low	68.6	Low	94 Å²	94	73.7 Å²	73.7	41%	0.409	39%	0.394	S	S	.	.	H	α-helix	trans	-60.4	-42.9	176.3	-179	-178.7	174.6	-167.6	0	111.9	E59 D60 Y69	E59-K63 PolarHBondContact O-N 3.25Å; D60-K63 PolarHBondContact O-N 3.37Å; K63-Y69 HydrophobicContact CB-CE1 4.22Å; K63-Y69 HydrophobicContact CB-CE2 4.28Å; K63-Y69 HydrophobicContact CD-CE1 4.46Å; K63-Y69 HydrophobicContact CG-CD1 4.12Å; K63-Y69 HydrophobicContact CG-CE1 3.89Å
64	D	70.6	Confident	68.1	Low	127 Å²	127	79.9 Å²	79.9	68%	0.679	42%	0.422	S	S	*	.	H	α-helix	trans	-81	-26.1	-172.8	-66.1	-17.3	0	0	0	113	D60 M62	D60-D64 PolarHBondContact O-N 2.79Å; M62-D64 VanDerWaalsContact C-N 3.32Å; M62-D64 PolarHBondContact O-N 3.07Å
65	N	73.6	Confident	67.7	Low	118 Å²	118	84.5 Å²	84.5	63%	0.631	44%	0.441	S	S	*	.	H	α-helix	trans	-108.9	-11.5	-174.3	-65.2	-69.9	0	0	0	115.2	M61 P67	M61-N65 WeakPolarHBondContact O-CB 3.46Å; M61-N65 PolarHBondContact O-N 3.34Å; M61-N65 VanDerWaalsContact O-N 3.15Å; M61-N65 PolarHBondContact O-ND2 3.37Å; N65-P67 VanDerWaalsContact O-CD 3.31Å; N65-P67 WeakPolarHBondContact O-CD 3.22Å
66	I	70.5	Confident	67.3	Low	70 Å²	70	82.7 Å²	82.7	36%	0.359	43%	0.428	S	S	.	.			trans	-94.6	110.1	179.2	-61.5	175.2	0	0	0	110.2	M62 F68 Y69	M62-I66 HydrophobicContact CB-CD1 3.77Å; M62-I66 HydrophobicContact CB-CG1 4.48Å; M62-I66 HydrophobicContact CG-CD1 3.82Å; M62-I66 WeakPolarHBondContact O-CB 3.39Å; M62-I66 WeakPolarHBondContact O-CG1 3.25Å; M62-I66 PolarHBondContact O-N 2.75Å; M62-I66 HydrophobicContact SD-CD1 4.25Å; I66-F68 PolarHBondContact O-N 2.58Å; I66-F68 VanDerWaalsContact O-N 3.12Å; I66-Y69 WeakPolarHBondContact O-CB 3.13Å; I66-Y69 PolarHBondContact O-N 3.38Å
67	P	57.3	Low	67.1	Low	118 Å²	118	84.9 Å²	84.9	77%	0.766	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.4	-174.6	22.6	-31.4	0	0	0	114.7	N65	N65-P67 VanDerWaalsContact O-CD 3.31Å; N65-P67 WeakPolarHBondContact O-CD 3.22Å
68	F	65	Low	66.5	Low	138 Å²	138	80.5 Å²	80.5	61%	0.605	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	12.7	-179.3	-67.6	-82.1	0	0	0	114.2	I66 N70 E71 L72	I66-F68 PolarHBondContact O-N 2.58Å; I66-F68 VanDerWaalsContact O-N 3.12Å; F68-N70 PolarHBondContact O-N 3.42Å; F68-E71 PolarHBondContact O-N 3.42Å; F68-L72 PolarHBondContact O-N 3.13Å; F68-L72 VanDerWaalsContact O-N 3.12Å
69	Y	68.6	Low	66.1	Low	14 Å²	14	81.8 Å²	81.8	6%	0.055	43%	0.43	C	S	.	.	H	α-helix	trans	-60	-45.2	-174.3	-171.2	-91.7	0	0	0	113.1	K63 I66 E71 L72 C73 K83 V86	K63-Y69 HydrophobicContact CB-CE1 4.22Å; K63-Y69 HydrophobicContact CB-CE2 4.28Å; K63-Y69 HydrophobicContact CD-CE1 4.46Å; K63-Y69 HydrophobicContact CG-CD1 4.12Å; K63-Y69 HydrophobicContact CG-CE1 3.89Å; I66-Y69 WeakPolarHBondContact O-CB 3.13Å; I66-Y69 PolarHBondContact O-N 3.38Å; Y69-E71 PolarHBondContact O-N 2.8Å; Y69-L72 WeakPolarHBondContact O-CB 3.33Å; Y69-L72 PolarHBondContact O-N 3.49Å; Y69-C73 PolarHBondContact O-N 2.89Å; Y69-C73 VanDerWaalsContact O-N 3.08Å; Y69-C73 PolarHBondContact O-SG 3.06Å; Y69-K83 WeakPolarHBondContact OH-CA 3.5Å; Y69-K83 WeakPolarHBondContact OH-CG 3.47Å; Y69-V86 HydrophobicContact CD2-CG2 4.44Å; Y69-V86 HydrophobicContact CE2-CB 4.25Å; Y69-V86 HydrophobicContact CE2-CG1 4.1Å; Y69-V86 HydrophobicContact CE2-CG2 3.8Å
70	N	66.3	Low	65.7	Low	119 Å²	119	89.1 Å²	89.1	64%	0.636	47%	0.465	S	S	*	.	H	α-helix	trans	-67.4	-37	-178.8	-66.4	-27	0	0	0	112.6	F68 L72 C73 E74	F68-N70 PolarHBondContact O-N 3.42Å; N70-L72 VanDerWaalsContact C-N 3.33Å; N70-C73 WeakPolarHBondContact O-CB 3.26Å; N70-C73 PolarHBondContact O-N 3.28Å; N70-E74 PolarHBondContact O-N 3.15Å
71	E	67.1	Low	65.4	Low	88 Å²	88	88.3 Å²	88.3	41%	0.411	46%	0.46	S	S	.	.	H	α-helix	trans	-69	-34.1	177.2	-161.7	-169.9	149.2	0	0	111.6	F68 Y69 K75	F68-E71 PolarHBondContact O-N 3.42Å; Y69-E71 PolarHBondContact O-N 2.8Å; E71-K75 WeakPolarHBondContact O-CB 3.4Å; E71-K75 WeakPolarHBondContact O-CG 3.42Å; E71-K75 PolarHBondContact O-N 3.39Å; E71-K75 IonicContact OE1-NZ 2.7Å; E71-K75 PolarHBondContact OE1-NZ 3.44Å
72	L	67	Low	65.4	Low	50 Å²	50	83 Å²	83	26%	0.262	44%	0.435	S	S	.	.	H	α-helix	trans	-63.5	-44.8	172.8	-151.4	98.7	0	0	0	110.8	F68 Y69 N70 K75 M76 V86	F68-L72 PolarHBondContact O-N 3.13Å; F68-L72 VanDerWaalsContact O-N 3.12Å; Y69-L72 WeakPolarHBondContact O-CB 3.33Å; Y69-L72 PolarHBondContact O-N 3.49Å; N70-L72 VanDerWaalsContact C-N 3.33Å; L72-K75 PolarHBondContact O-N 2.95Å; L72-M76 HydrophobicContact CD2-CE 3.59Å; L72-M76 HydrophobicContact CG-CE 3.95Å; L72-M76 WeakPolarHBondContact O-CB 3.35Å; L72-M76 WeakPolarHBondContact O-CE 3.42Å; L72-M76 WeakPolarHBondContact O-CG 3.22Å; L72-M76 PolarHBondContact O-N 2.88Å; L72-M76 VanDerWaalsContact O-N 3.08Å; L72-V86 HydrophobicContact CD2-CG1 4.39Å; L72-V86 HydrophobicContact CD2-CG2 3.85Å
73	C	68.6	Low	65.2	Low	21 Å²	21	84.2 Å²	84.2	14%	0.142	44%	0.439	C	S	.	.	H	α-helix	trans	-61.3	-45.6	177	-64.8	0	0	0	0	113.1	Y69 N70 M76 N77 A78 C82	Y69-C73 PolarHBondContact O-N 2.89Å; Y69-C73 VanDerWaalsContact O-N 3.08Å; Y69-C73 PolarHBondContact O-SG 3.06Å; N70-C73 WeakPolarHBondContact O-CB 3.26Å; N70-C73 PolarHBondContact O-N 3.28Å; C73-M76 PolarHBondContact O-N 3.18Å; C73-N77 PolarHBondContact O-N 3.01Å; C73-A78 PolarHBondContact O-N 3.31Å; C73-C82 WeakPolarHBondContact CA-SG 3.49Å; C73-C82 HydrophobicContact CB-CB 3.64Å; C73-C82 WeakPolarHBondContact CB-SG 3.25Å; C73-C82 WeakPolarHBondContact SG-CB 3.45Å; C73-C82 CovalentContact SG-SG 1.99Å; C73-C82 PolarHBondContact SG-SG 3Å
74	E	65.6	Low	65.1	Low	147 Å²	147	81.6 Å²	81.6	69%	0.687	43%	0.431	S	S	*	.	H	α-helix	trans	-66	-45.4	178.3	-75.9	-175	170.6	0	0	111.3	N70 M76 N77	N70-E74 PolarHBondContact O-N 3.15Å; E74-M76 PolarHBondContact O-N 3.33Å; E74-N77 PolarHBondContact O-N 2.97Å; E74-N77 VanDerWaalsContact O-N 3.08Å; E74-N77 PolarHBondContact O-OD1 3.28Å
75	K	64.6	Low	65.1	Low	139 Å²	139	76.7 Å²	76.7	60%	0.604	40%	0.404	S	S	*	.	H	α-helix	trans	-58.7	-32.3	175.4	-84.9	174	172.5	156	0	112.4	E71 L72 K148	E71-K75 WeakPolarHBondContact O-CB 3.4Å; E71-K75 WeakPolarHBondContact O-CG 3.42Å; E71-K75 PolarHBondContact O-N 3.39Å; E71-K75 IonicContact OE1-NZ 2.7Å; E71-K75 PolarHBondContact OE1-NZ 3.44Å; L72-K75 PolarHBondContact O-N 2.95Å; K75-K148 WeakPolarHBondContact O-CE 3.17Å; K75-K148 PolarHBondContact O-NZ 2.82Å
76	M	62	Low	65.2	Low	5 Å²	5	71.7 Å²	71.7	3%	0.025	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-6.6	179.7	-71.1	-169.5	-66.3	0	0	114.9	L72 C73 E74 A78 L85 V86 K148 Y413	L72-M76 HydrophobicContact CD2-CE 3.59Å; L72-M76 HydrophobicContact CG-CE 3.95Å; L72-M76 WeakPolarHBondContact O-CB 3.35Å; L72-M76 WeakPolarHBondContact O-CE 3.42Å; L72-M76 WeakPolarHBondContact O-CG 3.22Å; L72-M76 PolarHBondContact O-N 2.88Å; L72-M76 VanDerWaalsContact O-N 3.08Å; C73-M76 PolarHBondContact O-N 3.18Å; E74-M76 PolarHBondContact O-N 3.33Å; M76-A78 HydrophobicContact CB-CB 4.18Å; M76-A78 PolarHBondContact O-N 2.95Å; M76-L85 HydrophobicContact CB-CD2 3.84Å; M76-L85 HydrophobicContact CE-CD2 4.06Å; M76-L85 HydrophobicContact CE-CG 4.31Å; M76-L85 HydrophobicContact CG-CD2 4.29Å; M76-L85 HydrophobicContact SD-CD2 3.62Å; M76-L85 HydrophobicContact SD-CG 3.94Å; M76-V86 HydrophobicContact CE-CG2 4.13Å; M76-K148 VanDerWaalsContact CA-CE 3.44Å; M76-Y413 PolarHBondContact O-OH 3.29Å
77	N	61.3	Low	65.5	Low	128 Å²	128	68.5 Å²	68.5	68%	0.684	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	37.6	-171	-72.1	-11.3	0	0	0	112.5	C73 E74 G79	C73-N77 PolarHBondContact O-N 3.01Å; E74-N77 PolarHBondContact O-N 2.97Å; E74-N77 VanDerWaalsContact O-N 3.08Å; E74-N77 PolarHBondContact O-OD1 3.28Å; N77-G79 PolarHBondContact O-N 3.35Å
78	A	58.3	Low	66.5	Low	7 Å²	7	63.5 Å²	63.5	6%	0.058	33%	0.328	C	S	.	.			trans	-81.3	-10	-165.3	0	0	0	0	0	115	C73 M76 C82 L85	C73-A78 PolarHBondContact O-N 3.31Å; M76-A78 HydrophobicContact CB-CB 4.18Å; M76-A78 PolarHBondContact O-N 2.95Å; A78-C82 HydrophobicContact CB-CB 3.97Å; A78-L85 HydrophobicContact CB-CD2 3.69Å
79	G	61.8	Low	67.3	Low	65 Å²	65	57.1 Å²	57.1	67%	0.67	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	59.2	-144.3	-176.3	0	0	0	0	0	112.6	N77 N81	N77-G79 PolarHBondContact O-N 3.35Å; G79-N81 PolarHBondContact O-N 3.48Å
80	E	58.5	Low	68.1	Low	183 Å²	183	56.7 Å²	56.7	86%	0.855	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-67.2	-17.9	-177.1	-68.4	-175.3	159.1	0	0	114.3
81	N	61.9	Low	69.1	Low	57 Å²	57	51 Å²	51	31%	0.305	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-101	24.7	-173.9	-70.9	-43.3	0	0	0	113.7	G79 K83 T84 I418	G79-N81 PolarHBondContact O-N 3.48Å; N81-K83 PolarHBondContact O-N 2.77Å; N81-T84 PolarHBondContact O-N 3.34Å; N81-I418 HydrophobicContact CB-CB 4.37Å; N81-I418 HydrophobicContact CB-CG2 3.44Å; N81-I418 VanDerWaalsContact CB-CG2 3.44Å; N81-I418 WeakPolarHBondContact ND2-CB 3.41Å; N81-I418 VanDerWaalsContact ND2-CG2 3.25Å; N81-I418 WeakPolarHBondContact ND2-CG2 3.46Å
82	C	69.3	Low	70.2	Confident	8 Å²	8	47.4 Å²	47.4	5%	0.054	25%	0.253	C	S	.	.	H	α-helix	trans	-56.4	-33.4	177.5	-177.9	0	0	0	0	113.2	C73 A78 T84 L85 V86	C73-C82 WeakPolarHBondContact CA-SG 3.49Å; C73-C82 HydrophobicContact CB-CB 3.64Å; C73-C82 WeakPolarHBondContact CB-SG 3.25Å; C73-C82 WeakPolarHBondContact SG-CB 3.45Å; C73-C82 CovalentContact SG-SG 1.99Å; C73-C82 PolarHBondContact SG-SG 3Å; A78-C82 HydrophobicContact CB-CB 3.97Å; C82-T84 PolarHBondContact O-N 3.13Å; C82-L85 PolarHBondContact O-N 3.27Å; C82-V86 VanDerWaalsContact O-CG2 3.24Å; C82-V86 WeakPolarHBondContact O-CG2 3.13Å; C82-V86 PolarHBondContact O-N 3.47Å
83	K	65.1	Low	71.4	Confident	72 Å²	72	45.5 Å²	45.5	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-53.3	-52.2	-178.3	-62.1	-170.7	168.9	-161.7	0	113.6	D60 Y69 N81 L85 V86 G87	D60-K83 IonicContact OD1-NZ 2.72Å; D60-K83 PolarHBondContact OD1-NZ 3.39Å; Y69-K83 WeakPolarHBondContact OH-CA 3.5Å; Y69-K83 WeakPolarHBondContact OH-CG 3.47Å; N81-K83 PolarHBondContact O-N 2.77Å; K83-L85 PolarHBondContact O-N 3.41Å; K83-V86 PolarHBondContact O-N 3.29Å; K83-G87 PolarHBondContact O-N 3.15Å
84	T	64.8	Low	72.5	Confident	40 Å²	40	45.4 Å²	45.4	25%	0.245	24%	0.24	C	C	.	.	H	α-helix	trans	-71.2	-32.9	-177.7	-49.2	0	0	0	0	111.9	N81 C82 G87 Y88 L421	N81-T84 PolarHBondContact O-N 3.34Å; C82-T84 PolarHBondContact O-N 3.13Å; T84-G87 PolarHBondContact O-N 2.89Å; T84-Y88 HydrophobicContact CG2-CD1 4.28Å; T84-Y88 HydrophobicContact CG2-CE1 3.6Å; T84-Y88 HydrophobicContact CG2-CE2 4.15Å; T84-Y88 WeakPolarHBondContact O-CD1 3.48Å; T84-Y88 PolarHBondContact O-N 2.78Å; T84-L421 HydrophobicContact CG2-CD2 4.32Å
85	L	70.9	Confident	73.8	Confident	23 Å²	23	38.5 Å²	38.5	12%	0.12	21%	0.207	C	C	.	.	H	α-helix	trans	-68.4	-35.9	178.8	-167.3	66.5	0	0	0	112.1	M76 A78 C82 K83 Y88 S89	M76-L85 HydrophobicContact CB-CD2 3.84Å; M76-L85 HydrophobicContact CE-CD2 4.06Å; M76-L85 HydrophobicContact CE-CG 4.31Å; M76-L85 HydrophobicContact CG-CD2 4.29Å; M76-L85 HydrophobicContact SD-CD2 3.62Å; M76-L85 HydrophobicContact SD-CG 3.94Å; A78-L85 HydrophobicContact CB-CD2 3.69Å; C82-L85 PolarHBondContact O-N 3.27Å; K83-L85 PolarHBondContact O-N 3.41Å; L85-Y88 PolarHBondContact O-N 3.11Å; L85-S89 WeakPolarHBondContact O-CB 3.33Å; L85-S89 PolarHBondContact O-N 3.42Å
86	V	75.5	Confident	75.3	Confident	14 Å²	14	33.8 Å²	33.8	9%	0.085	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-45.5	172.9	176.7	0	0	0	0	110.2	Y69 L72 M76 C82 K83 Y88 S89 A90	Y69-V86 HydrophobicContact CD2-CG2 4.44Å; Y69-V86 HydrophobicContact CE2-CB 4.25Å; Y69-V86 HydrophobicContact CE2-CG1 4.1Å; Y69-V86 HydrophobicContact CE2-CG2 3.8Å; L72-V86 HydrophobicContact CD2-CG1 4.39Å; L72-V86 HydrophobicContact CD2-CG2 3.85Å; M76-V86 HydrophobicContact CE-CG2 4.13Å; C82-V86 VanDerWaalsContact O-CG2 3.24Å; C82-V86 WeakPolarHBondContact O-CG2 3.13Å; C82-V86 PolarHBondContact O-N 3.47Å; K83-V86 PolarHBondContact O-N 3.29Å; V86-Y88 PolarHBondContact O-N 2.96Å; V86-S89 PolarHBondContact O-N 3.39Å; V86-A90 WeakPolarHBondContact O-CB 3.33Å; V86-A90 PolarHBondContact O-N 3.26Å
87	G	76.4	Confident	76.9	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-57.2	-46	174.5	0	0	0	0	0	112.3	K83 T84 A90 V91	K83-G87 PolarHBondContact O-N 3.15Å; T84-G87 PolarHBondContact O-N 2.89Å; G87-A90 PolarHBondContact O-N 3.5Å; G87-V91 WeakPolarHBondContact O-CG2 3.33Å; G87-V91 PolarHBondContact O-N 2.75Å
88	Y	78.3	Confident	78.5	Confident	14 Å²	14	27.5 Å²	27.5	6%	0.055	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-47.4	177.3	-68.3	0.9	0	0	0	111.6	M54 T84 L85 V86 A90 V91 Y92 T408 F411 L421	M54-Y88 HydrophobicContact CE-CD1 3.84Å; M54-Y88 HydrophobicContact CE-CE1 3.37Å; M54-Y88 HydrophobicContact SD-CD1 3.53Å; M54-Y88 VanDerWaalsContact SD-CD1 3.53Å; M54-Y88 HydrophobicContact SD-CE1 3.72Å; T84-Y88 HydrophobicContact CG2-CD1 4.28Å; T84-Y88 HydrophobicContact CG2-CE1 3.6Å; T84-Y88 HydrophobicContact CG2-CE2 4.15Å; T84-Y88 WeakPolarHBondContact O-CD1 3.48Å; T84-Y88 PolarHBondContact O-N 2.78Å; L85-Y88 PolarHBondContact O-N 3.11Å; V86-Y88 PolarHBondContact O-N 2.96Å; Y88-A90 PolarHBondContact O-N 2.85Å; Y88-V91 PolarHBondContact O-N 3.42Å; Y88-Y92 VanDerWaalsContact O-CD2 3.3Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.35Å; Y88-Y92 PolarHBondContact O-N 3.48Å; Y88-T408 HydrophobicContact CD1-CG2 4.35Å; Y88-T408 HydrophobicContact CG-CG2 4.35Å; Y88-F411 HydrophobicContact CD2-CG 4.38Å; Y88-F411 HydrophobicContact CE2-CB 4.42Å; Y88-F411 AromaticContact CE2-CD2 3.92Å; Y88-F411 HydrophobicContact CE2-CD2 3.92Å; Y88-F411 HydrophobicContact CE2-CE2 4.35Å; Y88-F411 HydrophobicContact CE2-CG 4.09Å; Y88-L421 HydrophobicContact CE2-CD2 3.93Å; Y88-L421 WeakPolarHBondContact OH-CD2 3.41Å
89	S	82.1	Confident	80.3	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-55.1	-42.9	177.1	-177.2	0	0	0	0	111.6	L85 V86 Y92 K93	L85-S89 WeakPolarHBondContact O-CB 3.33Å; L85-S89 PolarHBondContact O-N 3.42Å; V86-S89 PolarHBondContact O-N 3.39Å; S89-Y92 PolarHBondContact O-N 3.41Å; S89-K93 WeakPolarHBondContact O-CG 3.4Å; S89-K93 PolarHBondContact O-N 3.32Å
90	A	85.5	Confident	82	Confident	6 Å²	6	26.2 Å²	26.2	5%	0.05	13%	0.134	C	C	.	.	H	α-helix	trans	-67.6	-41.1	-180	0	0	0	0	0	112.5	M53 V86 G87 Y88 K93 M94 F142	M53-A90 HydrophobicContact CE-CB 3.3Å; V86-A90 WeakPolarHBondContact O-CB 3.33Å; V86-A90 PolarHBondContact O-N 3.26Å; G87-A90 PolarHBondContact O-N 3.5Å; Y88-A90 PolarHBondContact O-N 2.85Å; A90-K93 PolarHBondContact O-N 3.28Å; A90-M94 WeakPolarHBondContact O-CG 3.3Å; A90-M94 PolarHBondContact O-N 2.91Å; A90-F142 HydrophobicContact CB-CE1 4.16Å
91	V	86.9	Confident	83.8	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.9	-45.4	173.4	172	0	0	0	0	111.5	C50 M54 G87 Y88 K93 M94 C95 I407 T408	C50-V91 HydrophobicContact CB-CG1 4.3Å; C50-V91 HydrophobicContact CB-CG2 4.3Å; M54-V91 HydrophobicContact CG-CG2 3.58Å; M54-V91 HydrophobicContact SD-CG2 3.94Å; G87-V91 WeakPolarHBondContact O-CG2 3.33Å; G87-V91 PolarHBondContact O-N 2.75Å; Y88-V91 PolarHBondContact O-N 3.42Å; V91-K93 VanDerWaalsContact C-N 3.32Å; V91-K93 PolarHBondContact O-N 3.02Å; V91-M94 PolarHBondContact O-N 3.22Å; V91-C95 WeakPolarHBondContact O-CB 3.37Å; V91-C95 PolarHBondContact O-N 2.99Å; V91-C95 PolarHBondContact O-SG 2.98Å; V91-I407 HydrophobicContact CG1-CB 4.13Å; V91-I407 HydrophobicContact CG1-CG2 3.89Å; V91-I407 HydrophobicContact CG2-CG2 3.99Å; V91-T408 HydrophobicContact CB-CG2 4.19Å; V91-T408 HydrophobicContact CG1-CG2 3.92Å
92	Y	89.5	Confident	85.4	Confident	12 Å²	12	14.9 Å²	14.9	5%	0.047	8%	0.079	C	C	.	.	H	α-helix	trans	-58.3	-43.8	177.3	-91.7	-102.3	0	0	0	111.7	Y88 S89 F96 L151 W154 R155 M404 M405 T408	Y88-Y92 VanDerWaalsContact O-CD2 3.3Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.35Å; Y88-Y92 PolarHBondContact O-N 3.48Å; S89-Y92 PolarHBondContact O-N 3.41Å; Y92-F96 WeakPolarHBondContact O-CB 3.24Å; Y92-F96 PolarHBondContact O-N 3.22Å; Y92-L151 HydrophobicContact CD1-CD2 4.07Å; Y92-L151 HydrophobicContact CD2-CD2 4.07Å; Y92-L151 HydrophobicContact CG-CD2 3.64Å; Y92-W154 HydrophobicContact CD1-CB 3.91Å; Y92-W154 HydrophobicContact CE1-CB 4.22Å; Y92-R155 HydrophobicContact CE1-CB 4.27Å; Y92-M404 HydrophobicContact CD1-CE 4.1Å; Y92-M404 HydrophobicContact CD1-CG 3.91Å; Y92-M404 HydrophobicContact CD1-SD 3.46Å; Y92-M404 WeakPolarHBondContact CD1-SD 3.32Å; Y92-M404 HydrophobicContact CD2-CG 4.25Å; Y92-M404 HydrophobicContact CE1-CE 3.95Å; Y92-M404 HydrophobicContact CE1-CG 4.09Å; Y92-M404 HydrophobicContact CE1-SD 3.88Å; Y92-M404 HydrophobicContact CE2-CG 4.44Å; Y92-M404 HydrophobicContact CG-CG 3.99Å; Y92-M404 HydrophobicContact CG-SD 3.97Å; Y92-M405 PolarHBondContact OH-SD 3.08Å; Y92-T408 HydrophobicContact CD2-CG2 3.74Å; Y92-T408 HydrophobicContact CE2-CG2 3.47Å; Y92-T408 VanDerWaalsContact CE2-CG2 3.47Å
93	K	91.7	Very high	86.7	Confident	9 Å²	9	18.8 Å²	18.8	4%	0.039	10%	0.095	C	C	.	.	H	α-helix	trans	-65.8	-44.7	177.9	-73.9	169	162.9	-174.6	0	112.3	S89 A90 V91 F96 G97 A141 F142 E147 F150	S89-K93 WeakPolarHBondContact O-CG 3.4Å; S89-K93 PolarHBondContact O-N 3.32Å; A90-K93 PolarHBondContact O-N 3.28Å; V91-K93 VanDerWaalsContact C-N 3.32Å; V91-K93 PolarHBondContact O-N 3.02Å; K93-F96 PolarHBondContact O-N 3.37Å; K93-G97 PolarHBondContact O-N 3.36Å; K93-A141 HydrophobicContact CB-CB 4.06Å; K93-A141 WeakPolarHBondContact O-CB 3.31Å; K93-F142 HydrophobicContact CB-CE1 4.44Å; K93-F142 HydrophobicContact CB-CZ 4.48Å; K93-F142 HydrophobicContact CD-CD1 4.03Å; K93-F142 HydrophobicContact CD-CE1 4.4Å; K93-E147 IonicContact NZ-OE1 2.82Å; K93-E147 PolarHBondContact NZ-OE1 2.99Å; K93-F150 HydrophobicContact CG-CE1 3.92Å; K93-F150 HydrophobicContact CG-CZ 4.36Å
94	M	92.7	Very high	88.2	Confident	20 Å²	20	20.3 Å²	20.3	10%	0.099	10%	0.102	C	C	.	.	H	α-helix	trans	-62.9	-48	176.8	-73.2	-64.2	-69.4	0	0	112.2	V46 I49 C50 M53 A90 V91 F96 G97 M98 C138 F142	V46-M94 HydrophobicContact CG1-CE 4.26Å; I49-M94 HydrophobicContact CB-CE 4.35Å; I49-M94 HydrophobicContact CG2-CE 3.76Å; C50-M94 VanDerWaalsContact SG-CB 3.52Å; M53-M94 HydrophobicContact CE-CG 4.12Å; M53-M94 HydrophobicContact SD-CG 3.69Å; A90-M94 WeakPolarHBondContact O-CG 3.3Å; A90-M94 PolarHBondContact O-N 2.91Å; V91-M94 PolarHBondContact O-N 3.22Å; M94-F96 VanDerWaalsContact C-N 3.32Å; M94-F96 PolarHBondContact O-N 2.82Å; M94-G97 PolarHBondContact O-N 3.25Å; M94-M98 PolarHBondContact O-N 3.4Å; M94-M98 VanDerWaalsContact O-N 3.08Å; M94-C138 HydrophobicContact CE-CB 4.09Å; M94-C138 HydrophobicContact SD-CB 3.9Å; M94-F142 HydrophobicContact CG-CE2 4.09Å; M94-F142 HydrophobicContact CG-CZ 3.9Å; M94-F142 HydrophobicContact SD-CE2 3.53Å; M94-F142 VanDerWaalsContact SD-CE2 3.53Å; M94-F142 HydrophobicContact SD-CZ 3.89Å
95	C	93.3	Very high	89.6	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.007	9%	0.091	C	C	.	.	H	α-helix	trans	-66.3	-34.5	177.6	-70.7	0	0	0	0	112.1	C50 V91 M98 A99 M404	C50-C95 VanDerWaalsContact SG-SG 3.69Å; V91-C95 WeakPolarHBondContact O-CB 3.37Å; V91-C95 PolarHBondContact O-N 2.99Å; V91-C95 PolarHBondContact O-SG 2.98Å; C95-M98 PolarHBondContact O-N 3.48Å; C95-A99 VanDerWaalsContact O-CB 3.3Å; C95-A99 WeakPolarHBondContact O-CB 3.02Å; C95-A99 PolarHBondContact O-N 3.47Å; C95-M404 HydrophobicContact CB-CB 3.59Å; C95-M404 HydrophobicContact CB-CG 3.81Å; C95-M404 HydrophobicContact CB-SD 4.08Å
96	F	95.4	Very high	90.7	Very high	40 Å²	40	18 Å²	18	18%	0.175	9%	0.088	C	C	.	.	H	α-helix	trans	-61.5	-44.8	172.2	168.6	-103.1	0	0	0	112.2	Y92 K93 M94 M98 A99 C100 A141 I144 F150 W154	Y92-F96 WeakPolarHBondContact O-CB 3.24Å; Y92-F96 PolarHBondContact O-N 3.22Å; K93-F96 PolarHBondContact O-N 3.37Å; M94-F96 VanDerWaalsContact C-N 3.32Å; M94-F96 PolarHBondContact O-N 2.82Å; F96-M98 PolarHBondContact O-N 3.4Å; F96-A99 WeakPolarHBondContact O-CB 3.45Å; F96-A99 PolarHBondContact O-N 3.12Å; F96-C100 WeakPolarHBondContact CE2-SG 3.38Å; F96-C100 WeakPolarHBondContact CZ-SG 3.49Å; F96-C100 PolarHBondContact O-N 3.42Å; F96-C100 PolarHBondContact O-SG 3.25Å; F96-A141 HydrophobicContact CD1-CB 3.76Å; F96-A141 HydrophobicContact CE1-CB 4.4Å; F96-I144 HydrophobicContact CD1-CD1 3.89Å; F96-I144 HydrophobicContact CE1-CD1 3.52Å; F96-I144 HydrophobicContact CZ-CD1 4.29Å; F96-F150 HydrophobicContact CB-CZ 3.97Å; F96-F150 HydrophobicContact CD1-CE2 4.3Å; F96-F150 HydrophobicContact CD1-CZ 4.26Å; F96-F150 HydrophobicContact CD2-CE2 4.42Å; F96-F150 HydrophobicContact CG-CE2 4.17Å; F96-F150 AromaticContact CG-CZ 3.97Å; F96-F150 HydrophobicContact CG-CZ 3.97Å; F96-W154 AromaticContact CD2-CD2 3.94Å; F96-W154 HydrophobicContact CD2-CD2 3.94Å; F96-W154 AromaticContact CD2-CE2 3.39Å; F96-W154 HydrophobicContact CD2-CE3 4.16Å; F96-W154 AromaticContact CD2-CH2 3.44Å; F96-W154 HydrophobicContact CD2-CH2 3.44Å; F96-W154 VanDerWaalsContact CD2-CH2 3.44Å; F96-W154 AromaticContact CD2-CZ2 3.18Å; F96-W154 HydrophobicContact CD2-CZ2 3.18Å; F96-W154 AromaticContact CD2-CZ3 3.91Å; F96-W154 HydrophobicContact CD2-CZ3 3.91Å; F96-W154 AromaticContact CD2-NE1 3.97Å; F96-W154 AromaticContact CE2-CE2 3.62Å; F96-W154 AromaticContact CE2-CH2 3.59Å; F96-W154 HydrophobicContact CE2-CH2 3.59Å; F96-W154 AromaticContact CE2-CZ2 3.08Å; F96-W154 HydrophobicContact CE2-CZ2 3.08Å; F96-W154 HydrophobicContact CE2-CZ3 4.5Å; F96-W154 HydrophobicContact CG-CZ2 4.47Å; F96-W154 HydrophobicContact CZ-CZ2 4.33Å
97	G	95.9	Very high	91.6	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-59.9	-44.9	175.5	0	0	0	0	0	112.3	K93 M94 C100 F101 C137	K93-G97 PolarHBondContact O-N 3.36Å; M94-G97 PolarHBondContact O-N 3.25Å; G97-C100 PolarHBondContact O-N 2.88Å; G97-F101 PolarHBondContact O-N 3.24Å; G97-F101 VanDerWaalsContact O-N 3.09Å; G97-C137 WeakPolarHBondContact O-CB 3.3Å
98	M	95.3	Very high	92.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-42.4	173.5	179	168.3	62.7	0	0	112.5	F43 V46 M94 C95 F96 F101 F102 L134	F43-M98 HydrophobicContact CD2-CE 4.15Å; F43-M98 HydrophobicContact CD2-CG 4.48Å; F43-M98 HydrophobicContact CD2-SD 3.6Å; F43-M98 VanDerWaalsContact CD2-SD 3.6Å; F43-M98 HydrophobicContact CE2-CE 3.92Å; F43-M98 HydrophobicContact CE2-SD 4Å; F43-M98 HydrophobicContact CG-SD 4.14Å; F43-M98 HydrophobicContact CZ-CE 4.41Å; V46-M98 HydrophobicContact CB-SD 3.7Å; V46-M98 HydrophobicContact CG1-CB 4.07Å; V46-M98 HydrophobicContact CG1-CE 4.17Å; V46-M98 HydrophobicContact CG1-SD 3.85Å; V46-M98 HydrophobicContact CG2-SD 4.35Å; M94-M98 PolarHBondContact O-N 3.4Å; M94-M98 VanDerWaalsContact O-N 3.08Å; C95-M98 PolarHBondContact O-N 3.48Å; F96-M98 PolarHBondContact O-N 3.4Å; M98-F101 WeakPolarHBondContact O-CB 3.47Å; M98-F101 PolarHBondContact O-N 2.92Å; M98-F102 HydrophobicContact CG-CD2 3.76Å; M98-F102 HydrophobicContact CG-CE2 3.69Å; M98-F102 VanDerWaalsContact O-CD2 3.3Å; M98-F102 WeakPolarHBondContact O-CD2 3.36Å; M98-F102 PolarHBondContact O-N 3Å; M98-F102 VanDerWaalsContact O-N 3.1Å; M98-F102 HydrophobicContact SD-CE2 4.26Å; M98-L134 HydrophobicContact CB-CD1 4.49Å
99	A	96.4	Very high	92.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-46.2	177	0	0	0	0	0	111.2	C95 F96 F101 F102 F103 F397 S400 L401	C95-A99 VanDerWaalsContact O-CB 3.3Å; C95-A99 WeakPolarHBondContact O-CB 3.02Å; C95-A99 PolarHBondContact O-N 3.47Å; F96-A99 WeakPolarHBondContact O-CB 3.45Å; F96-A99 PolarHBondContact O-N 3.12Å; A99-F101 VanDerWaalsContact C-N 3.33Å; A99-F101 PolarHBondContact O-N 3.23Å; A99-F102 PolarHBondContact O-N 2.89Å; A99-F103 WeakPolarHBondContact O-CB 3.08Å; A99-F103 PolarHBondContact O-N 3.25Å; A99-F397 HydrophobicContact CB-CD2 3.88Å; A99-F397 HydrophobicContact CB-CE2 4Å; A99-F397 WeakPolarHBondContact O-CD2 3.33Å; A99-S400 WeakPolarHBondContact CA-OG 3.36Å; A99-S400 WeakPolarHBondContact CB-OG 3.4Å; A99-L401 HydrophobicContact CB-CD2 4.23Å
100	C	96.6	Very high	93.2	Very high	46 Å²	46	27.5 Å²	27.5	31%	0.311	14%	0.135	S	C	.	.	H	α-helix	trans	-59.7	-43.4	176.9	-69.8	0	0	0	0	112.1	F96 G97 F103 F104	F96-C100 WeakPolarHBondContact CE2-SG 3.38Å; F96-C100 WeakPolarHBondContact CZ-SG 3.49Å; F96-C100 PolarHBondContact O-N 3.42Å; F96-C100 PolarHBondContact O-SG 3.25Å; G97-C100 PolarHBondContact O-N 2.88Å; C100-F103 PolarHBondContact O-N 3.31Å; C100-F104 VanDerWaalsContact O-CB 3.29Å; C100-F104 WeakPolarHBondContact O-CB 3.49Å; C100-F104 PolarHBondContact O-N 3.37Å
101	F	97.1	Very high	93.1	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-58.1	-53.7	177.2	172.9	-92.9	0	0	0	111.7	Y39 Y42 G97 M98 A99 F103 F104 F105 K130 L133 L134	Y39-F101 HydrophobicContact CD1-CE1 4.33Å; Y39-F101 HydrophobicContact CE1-CE1 4.28Å; Y39-F101 HydrophobicContact CE1-CZ 4.28Å; Y42-F101 HydrophobicContact CD2-CE1 4.45Å; Y42-F101 HydrophobicContact CD2-CZ 4.25Å; G97-F101 PolarHBondContact O-N 3.24Å; G97-F101 VanDerWaalsContact O-N 3.09Å; M98-F101 WeakPolarHBondContact O-CB 3.47Å; M98-F101 PolarHBondContact O-N 2.92Å; A99-F101 VanDerWaalsContact C-N 3.33Å; A99-F101 PolarHBondContact O-N 3.23Å; F101-F103 PolarHBondContact O-N 3.33Å; F101-F104 PolarHBondContact O-N 2.91Å; F101-F105 HydrophobicContact CD1-CD2 4.38Å; F101-F105 HydrophobicContact CD2-CD2 4.17Å; F101-F105 AromaticContact CD2-CE2 3.99Å; F101-F105 HydrophobicContact CD2-CE2 3.99Å; F101-F105 HydrophobicContact CE1-CD2 4.05Å; F101-F105 HydrophobicContact CE1-CE2 4.31Å; F101-F105 AromaticContact CE2-CD2 3.84Å; F101-F105 HydrophobicContact CE2-CD2 3.84Å; F101-F105 AromaticContact CE2-CE2 3.38Å; F101-F105 HydrophobicContact CE2-CE2 3.38Å; F101-F105 HydrophobicContact CE2-CZ 4.46Å; F101-F105 HydrophobicContact CG-CD2 4.43Å; F101-F105 AromaticContact CZ-CD2 3.76Å; F101-F105 HydrophobicContact CZ-CD2 3.76Å; F101-F105 AromaticContact CZ-CE2 3.55Å; F101-F105 HydrophobicContact CZ-CE2 3.55Å; F101-F105 WeakPolarHBondContact O-CD2 3.48Å; F101-F105 PolarHBondContact O-N 1.98Å; F101-F105 VanDerWaalsContact O-N 3.1Å; F101-K130 HydrophobicContact CE2-CB 4.27Å; F101-K130 WeakPolarHBondContact CE2-O 3.31Å; F101-K130 HydrophobicContact CZ-CB 4.2Å; F101-L133 HydrophobicContact CD2-CD2 4.29Å; F101-L133 HydrophobicContact CD2-CG 4.22Å; F101-L133 HydrophobicContact CE2-CD2 4.28Å; F101-L133 HydrophobicContact CE2-CG 4.43Å; F101-L134 HydrophobicContact CB-CD1 3.77Å; F101-L134 HydrophobicContact CD1-CD1 4.05Å; F101-L134 HydrophobicContact CD2-CB 3.86Å; F101-L134 HydrophobicContact CD2-CD1 4.22Å; F101-L134 HydrophobicContact CE2-CB 3.98Å; F101-L134 HydrophobicContact CG-CB 4.26Å; F101-L134 HydrophobicContact CG-CD1 3.76Å
102	F	95.6	Very high	92.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.1	-35.1	-179.5	-75.9	-67.6	0	0	0	112.6	Y39 F43 M98 A99 F105 S106 H393 F396 F397	Y39-F102 AromaticContact CD1-CE1 3.99Å; Y39-F102 HydrophobicContact CD1-CE1 3.99Å; Y39-F102 HydrophobicContact CG-CE1 4.5Å; F43-F102 HydrophobicContact CB-CE2 4.19Å; F43-F102 HydrophobicContact CB-CZ 4.09Å; F43-F102 HydrophobicContact CD2-CD2 4.47Å; F43-F102 AromaticContact CD2-CE2 3.82Å; F43-F102 HydrophobicContact CD2-CE2 3.82Å; F43-F102 HydrophobicContact CD2-CZ 4.37Å; M98-F102 HydrophobicContact CG-CD2 3.76Å; M98-F102 HydrophobicContact CG-CE2 3.69Å; M98-F102 VanDerWaalsContact O-CD2 3.3Å; M98-F102 WeakPolarHBondContact O-CD2 3.36Å; M98-F102 PolarHBondContact O-N 3Å; M98-F102 VanDerWaalsContact O-N 3.1Å; M98-F102 HydrophobicContact SD-CE2 4.26Å; A99-F102 PolarHBondContact O-N 2.89Å; F102-F105 PolarHBondContact O-N 3.23Å; F102-S106 WeakPolarHBondContact O-CB 2.78Å; F102-S106 PolarHBondContact O-N 3.1Å; F102-H393 AromaticContact CD1-ND1 3.67Å; F102-F396 HydrophobicContact CB-CB 4.15Å; F102-F396 HydrophobicContact CD1-CB 3.43Å; F102-F396 VanDerWaalsContact CD1-CB 3.43Å; F102-F396 HydrophobicContact CD1-CG 4.06Å; F102-F396 HydrophobicContact CD2-CB 4.01Å; F102-F396 HydrophobicContact CE1-CB 3.7Å; F102-F396 HydrophobicContact CE1-CD1 4.13Å; F102-F396 HydrophobicContact CE1-CD2 4.35Å; F102-F396 AromaticContact CE1-CG 3.81Å; F102-F396 HydrophobicContact CE1-CG 3.81Å; F102-F396 HydrophobicContact CE2-CB 4.27Å; F102-F396 HydrophobicContact CE2-CD1 4.4Å; F102-F396 HydrophobicContact CG-CB 3.6Å; F102-F396 HydrophobicContact CZ-CB 4.12Å; F102-F396 AromaticContact CZ-CD1 3.98Å; F102-F396 HydrophobicContact CZ-CD1 3.98Å; F102-F396 HydrophobicContact CZ-CG 4.13Å; F102-F397 HydrophobicContact CB-CB 4.1Å
103	F	96.4	Very high	92.2	Very high	89 Å²	89	43.8 Å²	43.8	39%	0.39	20%	0.202	S	C	.	.	H	α-helix	trans	-64.8	-42.9	175.6	-172.5	-112.6	0	0	0	111.9	A99 C100 F101 F105 S106 I107 F397	A99-F103 WeakPolarHBondContact O-CB 3.08Å; A99-F103 PolarHBondContact O-N 3.25Å; C100-F103 PolarHBondContact O-N 3.31Å; F101-F103 PolarHBondContact O-N 3.33Å; F103-F105 PolarHBondContact O-N 2.94Å; F103-S106 WeakPolarHBondContact O-CB 3.17Å; F103-S106 PolarHBondContact O-N 3.5Å; F103-I107 HydrophobicContact CD1-CD1 4.02Å; F103-I107 HydrophobicContact CE1-CD1 3.53Å; F103-I107 HydrophobicContact CE2-CD1 4.47Å; F103-I107 HydrophobicContact CZ-CD1 3.78Å; F103-I107 HydrophobicContact CZ-CG1 4.48Å; F103-I107 PolarHBondContact O-N 3.32Å; F103-I107 VanDerWaalsContact O-N 3.1Å; F103-F397 HydrophobicContact CB-CD2 3.75Å; F103-F397 HydrophobicContact CB-CE2 4.16Å; F103-F397 HydrophobicContact CB-CG 4.16Å; F103-F397 HydrophobicContact CD2-CD1 4.17Å; F103-F397 HydrophobicContact CD2-CD2 4.28Å; F103-F397 HydrophobicContact CD2-CE1 4.22Å; F103-F397 HydrophobicContact CD2-CE2 4.31Å; F103-F397 HydrophobicContact CD2-CG 4.19Å; F103-F397 HydrophobicContact CD2-CZ 4.28Å; F103-F397 HydrophobicContact CG-CD2 4.35Å; F103-F397 HydrophobicContact CG-CE2 4.4Å
104	F	96.3	Very high	91.5	Very high	105 Å²	105	44.8 Å²	44.8	46%	0.461	21%	0.21	S	C	.	.	H	α-helix	trans	-57.4	-49	173.1	169.4	-98.5	0	0	0	111.4	C100 F101 S106 I107 F108 L133	C100-F104 VanDerWaalsContact O-CB 3.29Å; C100-F104 WeakPolarHBondContact O-CB 3.49Å; C100-F104 PolarHBondContact O-N 3.37Å; F101-F104 PolarHBondContact O-N 2.91Å; F104-S106 VanDerWaalsContact C-N 3.3Å; F104-S106 PolarHBondContact O-N 2.77Å; F104-I107 PolarHBondContact O-N 3.11Å; F104-F108 HydrophobicContact CE1-CB 4.44Å; F104-F108 HydrophobicContact CZ-CD2 4.4Å; F104-F108 VanDerWaalsContact O-CB 3.32Å; F104-F108 WeakPolarHBondContact O-CB 2.87Å; F104-F108 PolarHBondContact O-N 3.18Å; F104-L133 HydrophobicContact CE1-CD2 4.49Å
105	F	94.6	Very high	90.9	Very high	5 Å²	5	44.5 Å²	44.5	2%	0.022	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-31.9	177.9	-88.6	-77	0	0	0	113.1	F101 F102 F103 F108 T109 I122 K130 L133 H393	F101-F105 HydrophobicContact CD1-CD2 4.38Å; F101-F105 HydrophobicContact CD2-CD2 4.17Å; F101-F105 AromaticContact CD2-CE2 3.99Å; F101-F105 HydrophobicContact CD2-CE2 3.99Å; F101-F105 HydrophobicContact CE1-CD2 4.05Å; F101-F105 HydrophobicContact CE1-CE2 4.31Å; F101-F105 AromaticContact CE2-CD2 3.84Å; F101-F105 HydrophobicContact CE2-CD2 3.84Å; F101-F105 AromaticContact CE2-CE2 3.38Å; F101-F105 HydrophobicContact CE2-CE2 3.38Å; F101-F105 HydrophobicContact CE2-CZ 4.46Å; F101-F105 HydrophobicContact CG-CD2 4.43Å; F101-F105 AromaticContact CZ-CD2 3.76Å; F101-F105 HydrophobicContact CZ-CD2 3.76Å; F101-F105 AromaticContact CZ-CE2 3.55Å; F101-F105 HydrophobicContact CZ-CE2 3.55Å; F101-F105 WeakPolarHBondContact O-CD2 3.48Å; F101-F105 PolarHBondContact O-N 1.98Å; F101-F105 VanDerWaalsContact O-N 3.1Å; F102-F105 PolarHBondContact O-N 3.23Å; F103-F105 PolarHBondContact O-N 2.94Å; F105-F108 HydrophobicContact CD1-CD1 4.31Å; F105-F108 HydrophobicContact CE1-CD1 4.4Å; F105-F108 PolarHBondContact O-N 3.34Å; F105-T109 WeakPolarHBondContact O-CB 3.2Å; F105-T109 WeakPolarHBondContact O-CG2 2.89Å; F105-T109 PolarHBondContact O-N 2.95Å; F105-T109 PolarHBondContact O-OG1 3.21Å; F105-I122 HydrophobicContact CE1-CG2 4.29Å; F105-K130 HydrophobicContact CE2-CG 4.41Å; F105-K130 HydrophobicContact CZ-CD 4.26Å; F105-K130 HydrophobicContact CZ-CG 3.86Å; F105-L133 HydrophobicContact CE2-CD2 4.1Å; F105-H393 HydrophobicContact CB-CB 4.32Å
106	S	93.3	Very high	90.2	Very high	8 Å²	8	49.3 Å²	49.3	6%	0.056	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-43.2	173.1	-176.2	0	0	0	0	111.9	F102 F103 F104 S390	F102-S106 WeakPolarHBondContact O-CB 2.78Å; F102-S106 PolarHBondContact O-N 3.1Å; F103-S106 WeakPolarHBondContact O-CB 3.17Å; F103-S106 PolarHBondContact O-N 3.5Å; F104-S106 VanDerWaalsContact C-N 3.3Å; F104-S106 PolarHBondContact O-N 2.77Å; S106-S390 VanDerWaalsContact O-CB 3.27Å; S106-S390 WeakPolarHBondContact O-CB 3.41Å; S106-S390 PolarHBondContact O-OG 2.67Å; S106-S390 PolarHBondContact OG-O 3.14Å; S106-S390 PolarHBondContact OG-OG 3.16Å
107	I	94.4	Very high	89.6	Confident	92 Å²	92	49.1 Å²	49.1	47%	0.472	25%	0.248	S	C	.	.	H	α-helix	trans	-71.2	-45.6	176	-64.1	171.6	0	0	0	110.8	F103 F104 T109 L110	F103-I107 HydrophobicContact CD1-CD1 4.02Å; F103-I107 HydrophobicContact CE1-CD1 3.53Å; F103-I107 HydrophobicContact CE2-CD1 4.47Å; F103-I107 HydrophobicContact CZ-CD1 3.78Å; F103-I107 HydrophobicContact CZ-CG1 4.48Å; F103-I107 PolarHBondContact O-N 3.32Å; F103-I107 VanDerWaalsContact O-N 3.1Å; F104-I107 PolarHBondContact O-N 3.11Å; I107-T109 PolarHBondContact O-N 3.44Å; I107-L110 HydrophobicContact CB-CD1 4.5Å; I107-L110 HydrophobicContact CG2-CD1 4.2Å; I107-L110 WeakPolarHBondContact O-CB 3.43Å; I107-L110 WeakPolarHBondContact O-CD1 3.49Å; I107-L110 VanDerWaalsContact O-CG 3.26Å; I107-L110 WeakPolarHBondContact O-CG 3.43Å; I107-L110 PolarHBondContact O-N 3.41Å; I107-L110 VanDerWaalsContact O-N 3.16Å
108	F	93.6	Very high	89.1	Confident	54 Å²	54	53.9 Å²	53.9	24%	0.237	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-35.2	-177.8	-178.8	-103.9	0	0	0	112.8	F104 F105 R119 I122	F104-F108 HydrophobicContact CE1-CB 4.44Å; F104-F108 HydrophobicContact CZ-CD2 4.4Å; F104-F108 VanDerWaalsContact O-CB 3.32Å; F104-F108 WeakPolarHBondContact O-CB 2.87Å; F104-F108 PolarHBondContact O-N 3.18Å; F105-F108 HydrophobicContact CD1-CD1 4.31Å; F105-F108 HydrophobicContact CE1-CD1 4.4Å; F105-F108 PolarHBondContact O-N 3.34Å; F108-R119 HydrophobicContact CE1-CB 3.93Å; F108-R119 HydrophobicContact CE1-CG 4.23Å; F108-R119 HydrophobicContact CE2-CG 4.13Å; F108-R119 HydrophobicContact CZ-CB 3.93Å; F108-R119 HydrophobicContact CZ-CG 3.74Å; F108-I122 HydrophobicContact CE1-CB 3.98Å; F108-I122 HydrophobicContact CE1-CD1 4.39Å; F108-I122 HydrophobicContact CE1-CG2 3.8Å; F108-I122 HydrophobicContact CZ-CB 4.26Å; F108-I122 HydrophobicContact CZ-CD1 3.79Å; F108-I122 HydrophobicContact CZ-CG2 4.19Å
109	T	89.2	Confident	88.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.006	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	13.3	-178.3	60.7	0	0	0	0	114.5	F105 I107 R111 I112 H123 S390	F105-T109 WeakPolarHBondContact O-CB 3.2Å; F105-T109 WeakPolarHBondContact O-CG2 2.89Å; F105-T109 PolarHBondContact O-N 2.95Å; F105-T109 PolarHBondContact O-OG1 3.21Å; I107-T109 PolarHBondContact O-N 3.44Å; T109-R111 PolarHBondContact O-N 3.39Å; T109-I112 HydrophobicContact CG2-CD1 4.1Å; T109-H123 HydrophobicContact CG2-CB 4.13Å; T109-S390 VanDerWaalsContact OG1-CA 3.31Å; T109-S390 WeakPolarHBondContact OG1-CA 3.49Å; T109-S390 PolarHBondContact OG1-N 2.87Å
110	L	88	Confident	88.2	Confident	87 Å²	87	59.4 Å²	59.4	46%	0.455	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	131.5	175.3	-76	168.9	0	0	0	112	I107 I112 R119 S390	I107-L110 HydrophobicContact CB-CD1 4.5Å; I107-L110 HydrophobicContact CG2-CD1 4.2Å; I107-L110 WeakPolarHBondContact O-CB 3.43Å; I107-L110 WeakPolarHBondContact O-CD1 3.49Å; I107-L110 VanDerWaalsContact O-CG 3.26Å; I107-L110 WeakPolarHBondContact O-CG 3.43Å; I107-L110 PolarHBondContact O-N 3.41Å; I107-L110 VanDerWaalsContact O-N 3.16Å; L110-I112 VanDerWaalsContact C-N 3.3Å; L110-I112 PolarHBondContact O-N 3.26Å; L110-R119 PolarHBondContact O-NH1 2.84Å; L110-S390 WeakPolarHBondContact CD2-OG 3.29Å
111	R	82.7	Confident	87.6	Confident	216 Å²	216	58.6 Å²	58.6	82%	0.815	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	37.5	176.4	-57.5	-178.1	-179.9	167.4	-0.3	114.1	T109 H113	T109-R111 PolarHBondContact O-N 3.39Å; R111-H113 PolarHBondContact O-CD2 3.08Å
112	I	83.1	Confident	87.2	Confident	17 Å²	17	61.2 Å²	61.2	9%	0.087	31%	0.312	C	S	.	.			trans	-84.4	126	166.3	-62.2	-179.3	0	0	0	108	T109 L110 S114 R119 A120 T385 Y389	T109-I112 HydrophobicContact CG2-CD1 4.1Å; L110-I112 VanDerWaalsContact C-N 3.3Å; L110-I112 PolarHBondContact O-N 3.26Å; I112-S114 WeakPolarHBondContact CG2-O 3.32Å; I112-R119 HydrophobicContact CD1-CB 3.76Å; I112-A120 HydrophobicContact CG2-CB 3.84Å; I112-T385 HydrophobicContact CG2-CG2 4.06Å; I112-Y389 HydrophobicContact CB-CD2 4.01Å; I112-Y389 HydrophobicContact CB-CE2 4.49Å; I112-Y389 HydrophobicContact CD1-CD2 4.17Å; I112-Y389 HydrophobicContact CG2-CD2 3.78Å; I112-Y389 HydrophobicContact CG2-CE2 3.76Å
113	H	73.8	Confident	86.8	Confident	127 Å²	127	61.2 Å²	61.2	59%	0.588	31%	0.312	S	S	*	.			trans	-118	-11.9	-177.2	-66.8	-69.8	0	0	0	113.7	R111 R384 T385	R111-H113 PolarHBondContact O-CD2 3.08Å; H113-R384 CarbonylContact O-C 3.29Å; H113-R384 VanDerWaalsContact O-CA 3.25Å; H113-R384 WeakPolarHBondContact O-CA 3.33Å; H113-T385 PolarHBondContact O-N 3.31Å
114	S	77.3	Confident	86.3	Confident	29 Å²	29	57 Å²	57	20%	0.203	29%	0.293	C	S	.	.			trans	-144.9	153.8	177.9	155.4	0	0	0	0	109.9	I112 T116 A120 E382	I112-S114 WeakPolarHBondContact CG2-O 3.32Å; S114-T116 VanDerWaalsContact C-N 3.33Å; S114-T116 PolarHBondContact OG-N 2.97Å; S114-T116 PolarHBondContact OG-OG1 3.33Å; S114-A120 WeakPolarHBondContact O-CB 3.32Å; S114-E382 WeakPolarHBondContact CB-O 3.29Å; S114-E382 PolarHBondContact OG-O 3.29Å
115	S	80.6	Confident	85.6	Confident	15 Å²	15	52 Å²	52	11%	0.105	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-6.9	179.9	74.8	0	0	0	0	115	G117 A120 E381 E382	S115-G117 PolarHBondContact O-N 3.32Å; S115-A120 WeakPolarHBondContact O-CB 3.46Å; S115-E381 VanDerWaalsContact CB-O 3.25Å; S115-E381 WeakPolarHBondContact CB-O 3.27Å; S115-E381 PolarHBondContact N-O 2.94Å; S115-E381 VanDerWaalsContact OG-C 3.22Å; S115-E381 PolarHBondContact OG-O 2.98Å; S115-E381 VanDerWaalsContact OG-O 3.06Å; S115-E382 VanDerWaalsContact OG-CA 3.29Å; S115-E382 WeakPolarHBondContact OG-CA 2.88Å; S115-E382 PolarHBondContact OG-N 2.78Å
116	T	79.1	Confident	85.2	Confident	102 Å²	102	54.6 Å²	54.6	63%	0.626	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-20	-175.7	57.1	0	0	0	0	114.3	S114 E382	S114-T116 VanDerWaalsContact C-N 3.33Å; S114-T116 PolarHBondContact OG-N 2.97Å; S114-T116 PolarHBondContact OG-OG1 3.33Å; T116-E382 HydrophobicContact CG2-CG 3.8Å
117	G	83.5	Confident	84.8	Confident	35 Å²	35	54.4 Å²	54.4	36%	0.361	28%	0.281	S	S	.	.	S	Bend	trans	-74.2	151.6	-177.8	0	0	0	0	0	113.5	S115 R119 A120 A121	S115-G117 PolarHBondContact O-N 3.32Å; G117-R119 VanDerWaalsContact C-N 3.28Å; G117-R119 PolarHBondContact O-N 3.36Å; G117-A120 WeakPolarHBondContact O-CA 3.49Å; G117-A120 WeakPolarHBondContact O-CB 3.21Å; G117-A120 PolarHBondContact O-N 2.9Å; G117-A121 PolarHBondContact O-N 3.45Å
118	C	85.1	Confident	84.5	Confident	102 Å²	102	53.7 Å²	53.7	69%	0.689	28%	0.278	S	S	*	.	H	α-helix	trans	-52.3	-42	178	176.9	0	0	0	0	113.6	A120 A121 I122	C118-A120 VanDerWaalsContact C-N 3.31Å; C118-A120 PolarHBondContact O-N 3.25Å; C118-A121 WeakPolarHBondContact O-CB 3.33Å; C118-A121 PolarHBondContact O-N 3.18Å; C118-I122 WeakPolarHBondContact O-CG1 3.33Å; C118-I122 PolarHBondContact O-N 2.89Å
119	R	87.6	Confident	84.3	Confident	115 Å²	115	56.2 Å²	56.2	43%	0.434	29%	0.293	S	S	.	.	H	α-helix	trans	-65.3	-34.2	176.5	-63.8	-177	-69.4	161.1	1.1	112.7	F108 L110 I112 G117 I122 H123	F108-R119 HydrophobicContact CE1-CB 3.93Å; F108-R119 HydrophobicContact CE1-CG 4.23Å; F108-R119 HydrophobicContact CE2-CG 4.13Å; F108-R119 HydrophobicContact CZ-CB 3.93Å; F108-R119 HydrophobicContact CZ-CG 3.74Å; L110-R119 PolarHBondContact O-NH1 2.84Å; I112-R119 HydrophobicContact CD1-CB 3.76Å; G117-R119 VanDerWaalsContact C-N 3.28Å; G117-R119 PolarHBondContact O-N 3.36Å; R119-I122 PolarHBondContact O-N 3.18Å; R119-H123 PolarHBondContact O-N 3.46Å
120	A	84.9	Confident	84.4	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-75.4	-36.3	177.4	0	0	0	0	0	111.5	I112 S114 S115 G117 C118 I122 H123 N124 Y389	I112-A120 HydrophobicContact CG2-CB 3.84Å; S114-A120 WeakPolarHBondContact O-CB 3.32Å; S115-A120 WeakPolarHBondContact O-CB 3.46Å; G117-A120 WeakPolarHBondContact O-CA 3.49Å; G117-A120 WeakPolarHBondContact O-CB 3.21Å; G117-A120 PolarHBondContact O-N 2.9Å; C118-A120 VanDerWaalsContact C-N 3.31Å; C118-A120 PolarHBondContact O-N 3.25Å; A120-I122 VanDerWaalsContact C-N 3.3Å; A120-I122 PolarHBondContact O-N 3.2Å; A120-H123 WeakPolarHBondContact O-CB 3.29Å; A120-H123 PolarHBondContact O-N 2.88Å; A120-H123 VanDerWaalsContact O-N 3.1Å; A120-N124 WeakPolarHBondContact O-CB 3.4Å; A120-N124 PolarHBondContact O-N 2.7Å; A120-N124 PolarHBondContact O-ND2 3.01Å; A120-Y389 HydrophobicContact CB-CE2 4.25Å
121	A	84.1	Confident	84.6	Confident	29 Å²	29	56.3 Å²	56.3	24%	0.24	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-40.9	169.7	0	0	0	0	0	111.6	G117 C118 N124 G125	G117-A121 PolarHBondContact O-N 3.45Å; C118-A121 WeakPolarHBondContact O-CB 3.33Å; C118-A121 PolarHBondContact O-N 3.18Å; A121-N124 PolarHBondContact O-N 3.02Å; A121-G125 PolarHBondContact O-N 2.98Å
122	I	87.9	Confident	85.1	Confident	57 Å²	57	50.7 Å²	50.7	29%	0.292	28%	0.275	S	S	.	.	H	α-helix	trans	-63.7	-43.2	172	-68.6	165.3	0	0	0	110.9	F105 F108 C118 R119 A120 N124 F126 K130	F105-I122 HydrophobicContact CE1-CG2 4.29Å; F108-I122 HydrophobicContact CE1-CB 3.98Å; F108-I122 HydrophobicContact CE1-CD1 4.39Å; F108-I122 HydrophobicContact CE1-CG2 3.8Å; F108-I122 HydrophobicContact CZ-CB 4.26Å; F108-I122 HydrophobicContact CZ-CD1 3.79Å; F108-I122 HydrophobicContact CZ-CG2 4.19Å; C118-I122 WeakPolarHBondContact O-CG1 3.33Å; C118-I122 PolarHBondContact O-N 2.89Å; R119-I122 PolarHBondContact O-N 3.18Å; A120-I122 VanDerWaalsContact C-N 3.3Å; A120-I122 PolarHBondContact O-N 3.2Å; I122-N124 VanDerWaalsContact C-N 3.33Å; I122-N124 PolarHBondContact O-N 3.4Å; I122-F126 HydrophobicContact CG1-CD2 4.4Å; I122-K130 WeakPolarHBondContact O-CE 3.2Å; I122-K130 PolarHBondContact O-NZ 3.48Å
123	H	88.1	Confident	85.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-38.8	177.1	175.7	66.8	0	0	0	112.8	Y39 T109 R119 A120 K130 Y387 Y389 H393	Y39-H123 AromaticContact CE2-CE1 3.44Å; Y39-H123 VanDerWaalsContact CE2-CE1 3.44Å; Y39-H123 WeakPolarHBondContact CE2-CE1 3.19Å; Y39-H123 AromaticContact CE2-ND1 3.56Å; Y39-H123 AromaticContact CZ-ND1 3.8Å; Y39-H123 PolarHBondContact OH-ND1 3.43Å; Y39-H123 PolarHBondContact OH-O 2.81Å; T109-H123 HydrophobicContact CG2-CB 4.13Å; R119-H123 PolarHBondContact O-N 3.46Å; A120-H123 WeakPolarHBondContact O-CB 3.29Å; A120-H123 PolarHBondContact O-N 2.88Å; A120-H123 VanDerWaalsContact O-N 3.1Å; H123-K130 VanDerWaalsContact C-NZ 3.33Å; H123-K130 PolarHBondContact O-NZ 2.93Å; H123-Y387 AromaticContact NE2-CZ 3.87Å; H123-Y387 PolarHBondContact NE2-OH 3.46Å; H123-Y389 HydrophobicContact CB-CD2 4.4Å; H123-Y389 HydrophobicContact CB-CE2 4.5Å; H123-Y389 AromaticContact CD2-CD1 3.88Å; H123-Y389 AromaticContact CD2-CD2 3.47Å; H123-Y389 VanDerWaalsContact CD2-CD2 3.47Å; H123-Y389 WeakPolarHBondContact CD2-CD2 3.39Å; H123-Y389 AromaticContact CD2-CE1 3.82Å; H123-Y389 AromaticContact CD2-CE2 3.42Å; H123-Y389 VanDerWaalsContact CD2-CE2 3.42Å; H123-Y389 WeakPolarHBondContact CD2-CE2 3.39Å; H123-Y389 AromaticContact CD2-CG 3.7Å; H123-Y389 AromaticContact CD2-CZ 3.58Å; H123-Y389 AromaticContact CG-CD2 3.96Å; H123-Y389 AromaticContact NE2-CD1 3.6Å; H123-Y389 AromaticContact NE2-CD2 3.97Å; H123-Y389 AromaticContact NE2-CE1 3.78Å; H123-Y389 AromaticContact NE2-CG 3.69Å; H123-H393 AromaticContact CE1-CE1 3.87Å; H123-H393 AromaticContact CE1-NE2 3.11Å; H123-H393 PolarHBondContact CE1-NE2 2.83Å; H123-H393 AromaticContact ND1-CD2 3.97Å; H123-H393 AromaticContact ND1-CE1 3.86Å; H123-H393 AromaticContact ND1-NE2 2.98Å; H123-H393 PolarHBondContact ND1-NE2 3.03Å
124	N	84.4	Confident	86.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-92.1	-17	-172.8	-66.5	-29.8	0	0	0	115.1	Q31 T35 A120 A121 I122 W127 Y389	Q31-N124 HydrophobicContact CG-CB 4.47Å; Q31-N124 VanDerWaalsContact NE2-CB 3.33Å; T35-N124 HydrophobicContact CG2-CB 3.83Å; T35-N124 WeakPolarHBondContact CG2-OD1 3.48Å; A120-N124 WeakPolarHBondContact O-CB 3.4Å; A120-N124 PolarHBondContact O-N 2.7Å; A120-N124 PolarHBondContact O-ND2 3.01Å; A121-N124 PolarHBondContact O-N 3.02Å; I122-N124 VanDerWaalsContact C-N 3.33Å; I122-N124 PolarHBondContact O-N 3.4Å; N124-W127 WeakPolarHBondContact O-CZ2 3.46Å; N124-Y389 PolarHBondContact ND2-OH 2.94Å
125	G	82.1	Confident	87.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	-128.5	-155.5	-178	0	0	0	0	0	114.1	A121 W127 K130	A121-G125 PolarHBondContact O-N 2.98Å; G125-W127 PolarHBondContact O-N 2.95Å; G125-K130 VanDerWaalsContact O-CE 3.27Å; G125-K130 WeakPolarHBondContact O-CE 3.3Å; G125-K130 PolarHBondContact O-NZ 2.87Å
126	F	86.1	Confident	88.3	Confident	58 Å²	58	49.6 Å²	49.6	25%	0.254	29%	0.286	S	S	.	.			trans	50.7	46.4	173.8	-59.2	-79.7	0	0	0	115	C14 G15 I122 L128 L129 K130	C14-F126 WeakPolarHBondContact O-CD1 3.48Å; C14-F126 WeakPolarHBondContact O-CE1 3.49Å; G15-F126 PolarHBondContact O-N 3.12Å; I122-F126 HydrophobicContact CG1-CD2 4.4Å; F126-L128 PolarHBondContact O-N 2.6Å; F126-L129 HydrophobicContact CB-CD1 4.37Å; F126-L129 HydrophobicContact CD1-CD1 4.02Å; F126-L129 PolarHBondContact O-N 3.48Å; F126-K130 WeakPolarHBondContact O-CG 3.43Å; F126-K130 PolarHBondContact O-N 3.05Å
127	W	86.2	Confident	89	Confident	5 Å²	5	46.5 Å²	46.5	2%	0.019	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-41.9	-173.4	-63.4	103.6	0	0	0	113.1	C12 C13 C19 T35 M38 Y39 Y42 N124 G125 L129 K130 F131	C12-W127 VanDerWaalsContact O-CD1 3.24Å; C13-W127 PolarHBondContact O-N 3.11Å; C19-W127 PolarHBondContact SG-NE1 3.48Å; T35-W127 HydrophobicContact CG2-CH2 4.44Å; T35-W127 HydrophobicContact CG2-CZ2 3.98Å; T35-W127 WeakPolarHBondContact O-CH2 3.34Å; M38-W127 HydrophobicContact CB-CD2 4.01Å; M38-W127 HydrophobicContact CB-CE3 3.66Å; M38-W127 HydrophobicContact CB-CH2 3.36Å; M38-W127 HydrophobicContact CB-CZ2 3.7Å; M38-W127 HydrophobicContact CB-CZ3 3.33Å; M38-W127 HydrophobicContact CE-CB 4.14Å; M38-W127 HydrophobicContact CE-CD2 3.88Å; M38-W127 HydrophobicContact CE-CE3 4.14Å; M38-W127 HydrophobicContact CE-CG 3.88Å; M38-W127 HydrophobicContact CG-CD2 4.16Å; M38-W127 HydrophobicContact CG-CE3 4.31Å; M38-W127 HydrophobicContact CG-CH2 4.12Å; M38-W127 HydrophobicContact CG-CZ2 3.92Å; M38-W127 HydrophobicContact CG-CZ3 4.3Å; Y39-W127 HydrophobicContact CD1-CZ3 4.3Å; Y39-W127 AromaticContact CD2-CH2 3.92Å; Y39-W127 HydrophobicContact CD2-CH2 3.92Å; Y39-W127 HydrophobicContact CD2-CZ3 4.04Å; Y39-W127 HydrophobicContact CE1-CZ3 4.15Å; Y39-W127 AromaticContact CE2-CH2 3.71Å; Y39-W127 HydrophobicContact CE2-CH2 3.71Å; Y39-W127 AromaticContact CE2-CZ3 3.88Å; Y39-W127 HydrophobicContact CE2-CZ3 3.88Å; Y39-W127 HydrophobicContact CG-CZ3 4.23Å; Y39-W127 AromaticContact CZ-CZ3 3.94Å; Y42-W127 AromaticContact CE2-CE3 3.97Å; Y42-W127 HydrophobicContact CE2-CE3 3.97Å; Y42-W127 HydrophobicContact CE2-CZ3 4.41Å; Y42-W127 VanDerWaalsContact OH-C 3.29Å; Y42-W127 WeakPolarHBondContact OH-CA 3.35Å; Y42-W127 WeakPolarHBondContact OH-CB 3.4Å; Y42-W127 PolarHBondContact OH-O 3.28Å; N124-W127 WeakPolarHBondContact O-CZ2 3.46Å; G125-W127 PolarHBondContact O-N 2.95Å; W127-L129 VanDerWaalsContact C-N 3.33Å; W127-L129 PolarHBondContact O-N 2.86Å; W127-K130 HydrophobicContact CE3-CD 4.01Å; W127-K130 HydrophobicContact CZ3-CD 4.22Å; W127-K130 WeakPolarHBondContact O-CB 3.11Å; W127-K130 PolarHBondContact O-N 3.32Å; W127-F131 PolarHBondContact O-N 3.05Å
128	L	86.8	Confident	89.5	Confident	77 Å²	77	45.1 Å²	45.1	40%	0.403	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-42.2	179.6	-177.4	63.1	0	0	0	112	C13 F126 K130 F131 I132	C13-L128 HydrophobicContact CB-CB 4.2Å; C13-L128 WeakPolarHBondContact O-CB 3.49Å; C13-L128 PolarHBondContact O-N 3.37Å; F126-L128 PolarHBondContact O-N 2.6Å; L128-K130 VanDerWaalsContact C-N 3.34Å; L128-K130 PolarHBondContact O-N 2.78Å; L128-F131 WeakPolarHBondContact O-CB 2.97Å; L128-F131 PolarHBondContact O-N 3.03Å; L128-I132 HydrophobicContact CD1-CD1 4.45Å; L128-I132 HydrophobicContact CG-CD1 4.12Å; L128-I132 WeakPolarHBondContact O-CG1 3.47Å; L128-I132 PolarHBondContact O-N 3.26Å
129	L	88.9	Confident	89.9	Confident	106 Å²	106	44.2 Å²	44.2	56%	0.555	24%	0.244	S	C	*	.	H	α-helix	trans	-64	-40.1	177.9	-66.5	178.7	0	0	0	111.6	F126 W127 I132 L133	F126-L129 HydrophobicContact CB-CD1 4.37Å; F126-L129 HydrophobicContact CD1-CD1 4.02Å; F126-L129 PolarHBondContact O-N 3.48Å; W127-L129 VanDerWaalsContact C-N 3.33Å; W127-L129 PolarHBondContact O-N 2.86Å; L129-I132 PolarHBondContact O-N 3.07Å; L129-L133 WeakPolarHBondContact O-CB 3.16Å; L129-L133 PolarHBondContact O-N 3.24Å
130	K	92.4	Very high	90.1	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-40.1	174	-69.5	172.4	-177	157.5	0	112.3	Y39 Y42 F101 F105 I122 H123 G125 F126 W127 L128 L133 L134	Y39-K130 HydrophobicContact CE1-CD 4.2Å; Y39-K130 WeakPolarHBondContact OH-CE 3.48Å; Y39-K130 PolarHBondContact OH-NZ 2.88Å; Y39-K130 VanDerWaalsContact OH-NZ 3.08Å; Y42-K130 HydrophobicContact CE2-CB 3.86Å; F101-K130 HydrophobicContact CE2-CB 4.27Å; F101-K130 WeakPolarHBondContact CE2-O 3.31Å; F101-K130 HydrophobicContact CZ-CB 4.2Å; F105-K130 HydrophobicContact CE2-CG 4.41Å; F105-K130 HydrophobicContact CZ-CD 4.26Å; F105-K130 HydrophobicContact CZ-CG 3.86Å; I122-K130 WeakPolarHBondContact O-CE 3.2Å; I122-K130 PolarHBondContact O-NZ 3.48Å; H123-K130 VanDerWaalsContact C-NZ 3.33Å; H123-K130 PolarHBondContact O-NZ 2.93Å; G125-K130 VanDerWaalsContact O-CE 3.27Å; G125-K130 WeakPolarHBondContact O-CE 3.3Å; G125-K130 PolarHBondContact O-NZ 2.87Å; F126-K130 WeakPolarHBondContact O-CG 3.43Å; F126-K130 PolarHBondContact O-N 3.05Å; W127-K130 HydrophobicContact CE3-CD 4.01Å; W127-K130 HydrophobicContact CZ3-CD 4.22Å; W127-K130 WeakPolarHBondContact O-CB 3.11Å; W127-K130 PolarHBondContact O-N 3.32Å; L128-K130 VanDerWaalsContact C-N 3.34Å; L128-K130 PolarHBondContact O-N 2.78Å; K130-L133 WeakPolarHBondContact O-CB 3.49Å; K130-L133 PolarHBondContact O-N 3.17Å; K130-L134 WeakPolarHBondContact O-CB 3.47Å; K130-L134 PolarHBondContact O-N 2.71Å
131	F	92.3	Very high	90.4	Very high	84 Å²	84	40.5 Å²	40.5	37%	0.368	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-45.6	176.7	179	-101.1	0	0	0	111.4	Y42 L45 W127 L128 L133 L134 A135	Y42-F131 HydrophobicContact CE1-CB 4.34Å; Y42-F131 HydrophobicContact CE1-CD2 4.16Å; L45-F131 HydrophobicContact CD2-CD2 4.47Å; L45-F131 HydrophobicContact CD2-CE2 3.57Å; L45-F131 HydrophobicContact CD2-CZ 4.38Å; W127-F131 PolarHBondContact O-N 3.05Å; L128-F131 WeakPolarHBondContact O-CB 2.97Å; L128-F131 PolarHBondContact O-N 3.03Å; F131-L133 VanDerWaalsContact C-N 3.32Å; F131-L133 PolarHBondContact O-N 3.01Å; F131-L134 PolarHBondContact O-N 3.45Å; F131-A135 WeakPolarHBondContact O-CB 3.41Å; F131-A135 PolarHBondContact O-N 3.49Å
132	I	93.7	Very high	90.5	Very high	99 Å²	99	42.9 Å²	42.9	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-60.4	-43.7	174.5	-67.4	166.9	0	0	0	110.5	L128 L129 A135 G136	L128-I132 HydrophobicContact CD1-CD1 4.45Å; L128-I132 HydrophobicContact CG-CD1 4.12Å; L128-I132 WeakPolarHBondContact O-CG1 3.47Å; L128-I132 PolarHBondContact O-N 3.26Å; L129-I132 PolarHBondContact O-N 3.07Å; I132-A135 PolarHBondContact O-N 3.38Å; I132-G136 PolarHBondContact O-N 3.44Å
133	L	94.8	Very high	90.6	Very high	74 Å²	74	48.1 Å²	48.1	39%	0.387	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-46.4	176.4	179.2	62.6	0	0	0	111.7	F101 F104 F105 L129 K130 F131 G136 C137	F101-L133 HydrophobicContact CD2-CD2 4.29Å; F101-L133 HydrophobicContact CD2-CG 4.22Å; F101-L133 HydrophobicContact CE2-CD2 4.28Å; F101-L133 HydrophobicContact CE2-CG 4.43Å; F104-L133 HydrophobicContact CE1-CD2 4.49Å; F105-L133 HydrophobicContact CE2-CD2 4.1Å; L129-L133 WeakPolarHBondContact O-CB 3.16Å; L129-L133 PolarHBondContact O-N 3.24Å; K130-L133 WeakPolarHBondContact O-CB 3.49Å; K130-L133 PolarHBondContact O-N 3.17Å; F131-L133 VanDerWaalsContact C-N 3.32Å; F131-L133 PolarHBondContact O-N 3.01Å; L133-G136 PolarHBondContact O-N 2.96Å; L133-C137 PolarHBondContact O-N 3.44Å; L133-C137 PolarHBondContact O-SG 3.31Å
134	L	95.6	Very high	90.4	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-47.9	177	176.3	62	0	0	0	111.6	Y42 V46 M98 F101 K130 F131 G136 C137 C138	Y42-L134 HydrophobicContact CD2-CD2 4.4Å; Y42-L134 HydrophobicContact CG-CD2 4.14Å; V46-L134 HydrophobicContact CG2-CD1 4.31Å; V46-L134 HydrophobicContact CG2-CD2 3.92Å; V46-L134 HydrophobicContact CG2-CG 4.26Å; M98-L134 HydrophobicContact CB-CD1 4.49Å; F101-L134 HydrophobicContact CB-CD1 3.77Å; F101-L134 HydrophobicContact CD1-CD1 4.05Å; F101-L134 HydrophobicContact CD2-CB 3.86Å; F101-L134 HydrophobicContact CD2-CD1 4.22Å; F101-L134 HydrophobicContact CE2-CB 3.98Å; F101-L134 HydrophobicContact CG-CB 4.26Å; F101-L134 HydrophobicContact CG-CD1 3.76Å; K130-L134 WeakPolarHBondContact O-CB 3.47Å; K130-L134 PolarHBondContact O-N 2.71Å; F131-L134 PolarHBondContact O-N 3.45Å; L134-G136 VanDerWaalsContact C-N 3.28Å; L134-G136 PolarHBondContact O-N 3.21Å; L134-C137 PolarHBondContact O-N 3.43Å; L134-C138 PolarHBondContact O-N 3.09Å; L134-C138 PolarHBondContact O-SG 3.03Å; L134-C138 VanDerWaalsContact O-SG 3.39Å
135	A	94.3	Very high	90.1	Very high	41 Å²	41	55.1 Å²	55.1	34%	0.339	31%	0.31	S	S	.	.	H	α-helix	trans	-60.7	-39.5	176.4	0	0	0	0	0	111.7	F131 I132 C138 T139	F131-A135 WeakPolarHBondContact O-CB 3.41Å; F131-A135 PolarHBondContact O-N 3.49Å; I132-A135 PolarHBondContact O-N 3.38Å; A135-C138 PolarHBondContact O-N 3.4Å; A135-T139 WeakPolarHBondContact O-CB 3.33Å; A135-T139 PolarHBondContact O-N 3.39Å; A135-T139 PolarHBondContact O-OG1 3.1Å
136	G	95.5	Very high	89.9	Confident	45 Å²	45	61.7 Å²	61.7	46%	0.464	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-45.2	173.3	0	0	0	0	0	112.6	I132 L133 L134 T139 G140	I132-G136 PolarHBondContact O-N 3.44Å; L133-G136 PolarHBondContact O-N 2.96Å; L134-G136 VanDerWaalsContact C-N 3.28Å; L134-G136 PolarHBondContact O-N 3.21Å; G136-T139 PolarHBondContact O-N 3.1Å; G136-G140 WeakPolarHBondContact O-CA 3.28Å; G136-G140 PolarHBondContact O-N 2.88Å
137	C	95.4	Very high	89.4	Confident	38 Å²	38	60.6 Å²	60.6	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-45.2	175.3	-69.3	0	0	0	0	112.1	G97 L133 L134 A141	G97-C137 WeakPolarHBondContact O-CB 3.3Å; L133-C137 PolarHBondContact O-N 3.44Å; L133-C137 PolarHBondContact O-SG 3.31Å; L134-C137 PolarHBondContact O-N 3.43Å; C137-A141 PolarHBondContact O-N 3.3Å; C137-A141 VanDerWaalsContact O-N 3.15Å
138	C	94.2	Very high	88.9	Confident	6 Å²	6	64.8 Å²	64.8	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-44.4	178.3	-68.3	0	0	0	0	112.2	M94 L134 A135 A141 F142	M94-C138 HydrophobicContact CE-CB 4.09Å; M94-C138 HydrophobicContact SD-CB 3.9Å; L134-C138 PolarHBondContact O-N 3.09Å; L134-C138 PolarHBondContact O-SG 3.03Å; L134-C138 VanDerWaalsContact O-SG 3.39Å; A135-C138 PolarHBondContact O-N 3.4Å; C138-A141 WeakPolarHBondContact O-CB 3.34Å; C138-A141 PolarHBondContact O-N 3.44Å; C138-F142 VanDerWaalsContact O-CD2 3.26Å; C138-F142 WeakPolarHBondContact O-CD2 3.48Å
139	T	91.9	Very high	88.8	Confident	83 Å²	83	65.6 Å²	65.6	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-68.2	-41	178.2	-50.9	0	0	0	0	111	A135 G136 A141 F142 F143	A135-T139 WeakPolarHBondContact O-CB 3.33Å; A135-T139 PolarHBondContact O-N 3.39Å; A135-T139 PolarHBondContact O-OG1 3.1Å; G136-T139 PolarHBondContact O-N 3.1Å; T139-A141 PolarHBondContact O-N 2.88Å; T139-F142 PolarHBondContact O-N 2.59Å; T139-F142 VanDerWaalsContact O-N 3.13Å; T139-F143 HydrophobicContact CG2-CE2 4.28Å; T139-F143 WeakPolarHBondContact O-CD2 3.36Å
140	G	91.7	Very high	88.7	Confident	37 Å²	37	61.5 Å²	61.5	38%	0.381	34%	0.336	S	S	.	.	H	α-helix	trans	-56.8	-35.8	176.3	0	0	0	0	0	113.3	G136 F142 F143	G136-G140 WeakPolarHBondContact O-CA 3.28Å; G136-G140 PolarHBondContact O-N 2.88Å; G140-F142 PolarHBondContact O-N 3.41Å; G140-F143 PolarHBondContact O-N 3.35Å; G140-F143 VanDerWaalsContact O-N 3.16Å
141	A	91.4	Very high	88.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.008	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-26.9	178.3	0	0	0	0	0	113.8	K93 F96 C137 C138 T139 F143 I144	K93-A141 HydrophobicContact CB-CB 4.06Å; K93-A141 WeakPolarHBondContact O-CB 3.31Å; F96-A141 HydrophobicContact CD1-CB 3.76Å; F96-A141 HydrophobicContact CE1-CB 4.4Å; C137-A141 PolarHBondContact O-N 3.3Å; C137-A141 VanDerWaalsContact O-N 3.15Å; C138-A141 WeakPolarHBondContact O-CB 3.34Å; C138-A141 PolarHBondContact O-N 3.44Å; T139-A141 PolarHBondContact O-N 2.88Å; A141-F143 VanDerWaalsContact C-N 3.26Å; A141-F143 PolarHBondContact O-N 3.26Å; A141-I144 WeakPolarHBondContact O-CG1 3.42Å; A141-I144 PolarHBondContact O-N 2.97Å
142	F	87.9	Confident	87.8	Confident	79 Å²	79	64 Å²	64	35%	0.346	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-23.3	177.9	-73.5	-87.7	0	0	0	113.6	M53 A90 K93 M94 C138 T139 G140 I144	M53-F142 HydrophobicContact CE-CE1 4.41Å; M53-F142 HydrophobicContact CE-CZ 3.94Å; A90-F142 HydrophobicContact CB-CE1 4.16Å; K93-F142 HydrophobicContact CB-CE1 4.44Å; K93-F142 HydrophobicContact CB-CZ 4.48Å; K93-F142 HydrophobicContact CD-CD1 4.03Å; K93-F142 HydrophobicContact CD-CE1 4.4Å; M94-F142 HydrophobicContact CG-CE2 4.09Å; M94-F142 HydrophobicContact CG-CZ 3.9Å; M94-F142 HydrophobicContact SD-CE2 3.53Å; M94-F142 VanDerWaalsContact SD-CE2 3.53Å; M94-F142 HydrophobicContact SD-CZ 3.89Å; C138-F142 VanDerWaalsContact O-CD2 3.26Å; C138-F142 WeakPolarHBondContact O-CD2 3.48Å; T139-F142 PolarHBondContact O-N 2.59Å; T139-F142 VanDerWaalsContact O-N 3.13Å; G140-F142 PolarHBondContact O-N 3.41Å; F142-I144 VanDerWaalsContact C-N 3.26Å; F142-I144 PolarHBondContact O-N 3.26Å
143	F	88.1	Confident	87.6	Confident	166 Å²	166	62.7 Å²	62.7	73%	0.728	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	0.3	179.5	-63.8	-75	0	0	0	113.9	T139 G140 A141 P145	T139-F143 HydrophobicContact CG2-CE2 4.28Å; T139-F143 WeakPolarHBondContact O-CD2 3.36Å; G140-F143 PolarHBondContact O-N 3.35Å; G140-F143 VanDerWaalsContact O-N 3.16Å; A141-F143 VanDerWaalsContact C-N 3.26Å; A141-F143 PolarHBondContact O-N 3.26Å; F143-P145 VanDerWaalsContact O-CD 3.29Å; F143-P145 WeakPolarHBondContact O-CD 3.36Å
144	I	85.5	Confident	87.3	Confident	50 Å²	50	61.2 Å²	61.2	26%	0.256	34%	0.336	S	S	.	.			trans	-69.8	118	178.8	-62.2	172.9	0	0	0	109.7	F96 A141 F142 F150	F96-I144 HydrophobicContact CD1-CD1 3.89Å; F96-I144 HydrophobicContact CE1-CD1 3.52Å; F96-I144 HydrophobicContact CZ-CD1 4.29Å; A141-I144 WeakPolarHBondContact O-CG1 3.42Å; A141-I144 PolarHBondContact O-N 2.97Å; F142-I144 VanDerWaalsContact C-N 3.26Å; F142-I144 PolarHBondContact O-N 3.26Å; I144-F150 HydrophobicContact CD1-CD2 4.22Å; I144-F150 HydrophobicContact CD1-CE2 3.73Å; I144-F150 HydrophobicContact CD1-CZ 4.35Å; I144-F150 HydrophobicContact CG2-CD2 3.92Å; I144-F150 HydrophobicContact CG2-CE2 4.48Å; I144-F150 HydrophobicContact CG2-CG 4.37Å
145	P	76.9	Confident	86.8	Confident	98 Å²	98	62.9 Å²	62.9	64%	0.636	34%	0.342	S	S	*	.	S	Bend	trans	-76.1	166.7	176.3	33.3	-34.9	0	0	0	111.3	F143	F143-P145 VanDerWaalsContact O-CD 3.29Å; F143-P145 WeakPolarHBondContact O-CD 3.36Å
146	Q	78.2	Confident	86.5	Confident	138 Å²	138	67.1 Å²	67.1	65%	0.645	35%	0.35	S	S	*	.			trans	66.5	62.4	177.7	-52.5	176.7	4.9	0	0	114.5	K148 I149 F150	Q146-K148 VanDerWaalsContact C-N 3.34Å; Q146-K148 PolarHBondContact O-N 3.13Å; Q146-I149 HydrophobicContact CB-CD1 4.44Å; Q146-I149 PolarHBondContact O-N 3.33Å; Q146-F150 PolarHBondContact O-N 2.76Å
147	E	75.8	Confident	86.3	Confident	36 Å²	36	68.2 Å²	68.2	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-56.3	-39.9	-173.4	-55.1	-160.3	140.9	0	0	114.5	K93 I149 F150 L151	K93-E147 IonicContact NZ-OE1 2.82Å; K93-E147 PolarHBondContact NZ-OE1 2.99Å; E147-I149 PolarHBondContact O-N 3.48Å; E147-F150 PolarHBondContact O-N 3.46Å; E147-L151 WeakPolarHBondContact O-CB 3.23Å; E147-L151 VanDerWaalsContact O-CG 3.24Å; E147-L151 WeakPolarHBondContact O-CG 3.33Å; E147-L151 PolarHBondContact O-N 3.3Å
148	K	75.9	Confident	86.1	Confident	92 Å²	92	66.4 Å²	66.4	40%	0.4	33%	0.332	S	S	.	.	H	α-helix	trans	-58.6	-50.3	-179.4	-69	-173.8	178.6	172.3	0	112.4	K75 M76 Q146 L151 E152	K75-K148 WeakPolarHBondContact O-CE 3.17Å; K75-K148 PolarHBondContact O-NZ 2.82Å; M76-K148 VanDerWaalsContact CA-CE 3.44Å; Q146-K148 VanDerWaalsContact C-N 3.34Å; Q146-K148 PolarHBondContact O-N 3.13Å; K148-L151 PolarHBondContact O-N 2.84Å; K148-E152 WeakPolarHBondContact O-CB 3.49Å; K148-E152 PolarHBondContact O-N 3.26Å
149	I	83.6	Confident	85.7	Confident	95 Å²	95	67.5 Å²	67.5	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-67.2	-42.1	-178	-59.9	172.6	0	0	0	109.8	Q146 E147 E152 V153	Q146-I149 HydrophobicContact CB-CD1 4.44Å; Q146-I149 PolarHBondContact O-N 3.33Å; E147-I149 PolarHBondContact O-N 3.48Å; I149-E152 PolarHBondContact O-N 2.9Å; I149-V153 HydrophobicContact CG2-CG2 4.41Å; I149-V153 WeakPolarHBondContact O-CG2 3.4Å; I149-V153 PolarHBondContact O-N 2.92Å
150	F	87.2	Confident	85.7	Confident	19 Å²	19	66.2 Å²	66.2	8%	0.083	34%	0.339	C	S	.	.	H	α-helix	trans	-58	-51	176.5	174.5	-95.3	0	0	0	111.6	K93 F96 I144 Q146 E147 E152 V153 W154	K93-F150 HydrophobicContact CG-CE1 3.92Å; K93-F150 HydrophobicContact CG-CZ 4.36Å; F96-F150 HydrophobicContact CB-CZ 3.97Å; F96-F150 HydrophobicContact CD1-CE2 4.3Å; F96-F150 HydrophobicContact CD1-CZ 4.26Å; F96-F150 HydrophobicContact CD2-CE2 4.42Å; F96-F150 HydrophobicContact CG-CE2 4.17Å; F96-F150 AromaticContact CG-CZ 3.97Å; F96-F150 HydrophobicContact CG-CZ 3.97Å; I144-F150 HydrophobicContact CD1-CD2 4.22Å; I144-F150 HydrophobicContact CD1-CE2 3.73Å; I144-F150 HydrophobicContact CD1-CZ 4.35Å; I144-F150 HydrophobicContact CG2-CD2 3.92Å; I144-F150 HydrophobicContact CG2-CE2 4.48Å; I144-F150 HydrophobicContact CG2-CG 4.37Å; Q146-F150 PolarHBondContact O-N 2.76Å; E147-F150 PolarHBondContact O-N 3.46Å; F150-E152 PolarHBondContact O-N 3.28Å; F150-V153 PolarHBondContact O-N 2.95Å; F150-W154 AromaticContact CD2-CD1 3.33Å; F150-W154 HydrophobicContact CD2-CG 4.42Å; F150-W154 AromaticContact CD2-NE1 3.65Å; F150-W154 AromaticContact CE2-CD1 3.17Å; F150-W154 HydrophobicContact CE2-CG 4.03Å; F150-W154 AromaticContact CE2-NE1 3.27Å; F150-W154 VanDerWaalsContact CE2-NE1 3.27Å; F150-W154 AromaticContact CG-CD1 3.94Å; F150-W154 AromaticContact CZ-CD1 3.65Å; F150-W154 HydrophobicContact CZ-CG 4.09Å; F150-W154 WeakPolarHBondContact O-CB 3.29Å; F150-W154 VanDerWaalsContact O-CD1 3.29Å; F150-W154 PolarHBondContact O-N 3.17Å
151	L	83.1	Confident	85.6	Confident	28 Å²	28	64.7 Å²	64.7	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-40.3	-178.7	-66.9	172.5	0	0	0	112.2	Y92 E147 K148 R155	Y92-L151 HydrophobicContact CD1-CD2 4.07Å; Y92-L151 HydrophobicContact CD2-CD2 4.07Å; Y92-L151 HydrophobicContact CG-CD2 3.64Å; E147-L151 WeakPolarHBondContact O-CB 3.23Å; E147-L151 VanDerWaalsContact O-CG 3.24Å; E147-L151 WeakPolarHBondContact O-CG 3.33Å; E147-L151 PolarHBondContact O-N 3.3Å; K148-L151 PolarHBondContact O-N 2.84Å; L151-R155 WeakPolarHBondContact O-CB 3.37Å; L151-R155 PolarHBondContact O-N 2.89Å
152	E	83.1	Confident	85.3	Confident	114 Å²	114	64.6 Å²	64.6	53%	0.533	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-50	177.9	-172.7	-179.2	172.6	0	0	111.9	K148 I149 F150 R155 Y156	K148-E152 WeakPolarHBondContact O-CB 3.49Å; K148-E152 PolarHBondContact O-N 3.26Å; I149-E152 PolarHBondContact O-N 2.9Å; F150-E152 PolarHBondContact O-N 3.28Å; E152-R155 WeakPolarHBondContact O-CB 3.42Å; E152-R155 PolarHBondContact O-N 2.79Å; E152-Y156 HydrophobicContact CG-CE2 4.23Å; E152-Y156 WeakPolarHBondContact O-CD2 3.4Å; E152-Y156 PolarHBondContact O-N 2.63Å
153	V	89.2	Confident	85.3	Confident	72 Å²	72	63.3 Å²	63.3	44%	0.436	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-48.2	-179.9	172.7	0	0	0	0	111	I149 F150 R155 Y156 I157	I149-V153 HydrophobicContact CG2-CG2 4.41Å; I149-V153 WeakPolarHBondContact O-CG2 3.4Å; I149-V153 PolarHBondContact O-N 2.92Å; F150-V153 PolarHBondContact O-N 2.95Å; V153-R155 PolarHBondContact O-N 2.97Å; V153-Y156 PolarHBondContact O-N 3.4Å; V153-Y156 VanDerWaalsContact O-N 3.16Å; V153-I157 HydrophobicContact CG1-CD1 3.7Å; V153-I157 HydrophobicContact CG1-CG1 4.38Å; V153-I157 WeakPolarHBondContact O-CG1 3.41Å; V153-I157 PolarHBondContact O-N 2.87Å
154	W	89.5	Confident	85.3	Confident	44 Å²	44	59.5 Å²	59.5	17%	0.167	31%	0.313	C	S	.	.	H	α-helix	trans	-69.5	-22	-178	-82.3	95	0	0	0	113.4	Y92 F96 F150 I157 G158 L401 M404	Y92-W154 HydrophobicContact CD1-CB 3.91Å; Y92-W154 HydrophobicContact CE1-CB 4.22Å; F96-W154 AromaticContact CD2-CD2 3.94Å; F96-W154 HydrophobicContact CD2-CD2 3.94Å; F96-W154 AromaticContact CD2-CE2 3.39Å; F96-W154 HydrophobicContact CD2-CE3 4.16Å; F96-W154 AromaticContact CD2-CH2 3.44Å; F96-W154 HydrophobicContact CD2-CH2 3.44Å; F96-W154 VanDerWaalsContact CD2-CH2 3.44Å; F96-W154 AromaticContact CD2-CZ2 3.18Å; F96-W154 HydrophobicContact CD2-CZ2 3.18Å; F96-W154 AromaticContact CD2-CZ3 3.91Å; F96-W154 HydrophobicContact CD2-CZ3 3.91Å; F96-W154 AromaticContact CD2-NE1 3.97Å; F96-W154 AromaticContact CE2-CE2 3.62Å; F96-W154 AromaticContact CE2-CH2 3.59Å; F96-W154 HydrophobicContact CE2-CH2 3.59Å; F96-W154 AromaticContact CE2-CZ2 3.08Å; F96-W154 HydrophobicContact CE2-CZ2 3.08Å; F96-W154 HydrophobicContact CE2-CZ3 4.5Å; F96-W154 HydrophobicContact CG-CZ2 4.47Å; F96-W154 HydrophobicContact CZ-CZ2 4.33Å; F150-W154 AromaticContact CD2-CD1 3.33Å; F150-W154 HydrophobicContact CD2-CG 4.42Å; F150-W154 AromaticContact CD2-NE1 3.65Å; F150-W154 AromaticContact CE2-CD1 3.17Å; F150-W154 HydrophobicContact CE2-CG 4.03Å; F150-W154 AromaticContact CE2-NE1 3.27Å; F150-W154 VanDerWaalsContact CE2-NE1 3.27Å; F150-W154 AromaticContact CG-CD1 3.94Å; F150-W154 AromaticContact CZ-CD1 3.65Å; F150-W154 HydrophobicContact CZ-CG 4.09Å; F150-W154 WeakPolarHBondContact O-CB 3.29Å; F150-W154 VanDerWaalsContact O-CD1 3.29Å; F150-W154 PolarHBondContact O-N 3.17Å; W154-I157 HydrophobicContact CD2-CD1 4.5Å; W154-I157 HydrophobicContact CE3-CB 4.22Å; W154-I157 HydrophobicContact CE3-CG2 3.99Å; W154-I157 HydrophobicContact CH2-CG2 4.36Å; W154-I157 HydrophobicContact CZ2-CD1 4.49Å; W154-I157 HydrophobicContact CZ3-CB 4.46Å; W154-I157 HydrophobicContact CZ3-CG2 3.75Å; W154-G158 WeakPolarHBondContact O-CA 3.5Å; W154-G158 PolarHBondContact O-N 2.94Å; W154-L401 HydrophobicContact CE3-CD2 4.2Å; W154-L401 HydrophobicContact CZ3-CD2 3.79Å; W154-M404 HydrophobicContact CE3-CE 4.33Å; W154-M404 VanDerWaalsContact O-CE 3.32Å; W154-M404 WeakPolarHBondContact O-CE 3.34Å
155	R	84.7	Confident	85.3	Confident	38 Å²	38	57.2 Å²	57.2	14%	0.143	30%	0.302	C	S	.	.	H	α-helix	trans	-64	-46.4	169.7	-179.1	-171.5	65.3	99.1	-10.1	111.3	Y92 L151 E152 V153 A159 M405 F411	Y92-R155 HydrophobicContact CE1-CB 4.27Å; L151-R155 WeakPolarHBondContact O-CB 3.37Å; L151-R155 PolarHBondContact O-N 2.89Å; E152-R155 WeakPolarHBondContact O-CB 3.42Å; E152-R155 PolarHBondContact O-N 2.79Å; V153-R155 PolarHBondContact O-N 2.97Å; R155-A159 VanDerWaalsContact O-CB 3.24Å; R155-A159 WeakPolarHBondContact O-CB 3.35Å; R155-A159 PolarHBondContact O-N 2.9Å; R155-M405 HydrophobicContact CG-CE 4.13Å; R155-F411 WeakPolarHBondContact CD-O 3.2Å
156	Y	87.5	Confident	85.5	Confident	130 Å²	130	53.2 Å²	53.2	51%	0.51	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-44.6	178.1	-72.4	-69.7	0	0	0	111.9	E152 V153 G158 A159 A160	E152-Y156 HydrophobicContact CG-CE2 4.23Å; E152-Y156 WeakPolarHBondContact O-CD2 3.4Å; E152-Y156 PolarHBondContact O-N 2.63Å; V153-Y156 PolarHBondContact O-N 3.4Å; V153-Y156 VanDerWaalsContact O-N 3.16Å; Y156-G158 VanDerWaalsContact C-N 3.34Å; Y156-A159 PolarHBondContact O-N 3.43Å; Y156-A160 WeakPolarHBondContact O-CB 3.31Å; Y156-A160 PolarHBondContact O-N 3.45Å
157	I	92.1	Very high	85.9	Confident	68 Å²	68	51.1 Å²	51.1	35%	0.349	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-44.8	176.4	-64.3	174.1	0	0	0	110.3	V153 W154 A160 G161 L401	V153-I157 HydrophobicContact CG1-CD1 3.7Å; V153-I157 HydrophobicContact CG1-CG1 4.38Å; V153-I157 WeakPolarHBondContact O-CG1 3.41Å; V153-I157 PolarHBondContact O-N 2.87Å; W154-I157 HydrophobicContact CD2-CD1 4.5Å; W154-I157 HydrophobicContact CE3-CB 4.22Å; W154-I157 HydrophobicContact CE3-CG2 3.99Å; W154-I157 HydrophobicContact CH2-CG2 4.36Å; W154-I157 HydrophobicContact CZ2-CD1 4.49Å; W154-I157 HydrophobicContact CZ3-CB 4.46Å; W154-I157 HydrophobicContact CZ3-CG2 3.75Å; I157-A160 PolarHBondContact O-N 3.19Å; I157-G161 PolarHBondContact O-N 3.14Å; I157-L401 HydrophobicContact CG2-CD1 4.39Å
158	G	90.3	Very high	86.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-47	176.8	0	0	0	0	0	112.3	W154 Y156 G161 G162 M404 M405	W154-G158 WeakPolarHBondContact O-CA 3.5Å; W154-G158 PolarHBondContact O-N 2.94Å; Y156-G158 VanDerWaalsContact C-N 3.34Å; G158-G161 PolarHBondContact O-N 3.03Å; G158-G162 WeakPolarHBondContact O-CA 3.39Å; G158-G162 PolarHBondContact O-N 3.05Å; G158-M404 VanDerWaalsContact CA-CE 3.4Å; G158-M405 WeakPolarHBondContact O-CG 3.36Å
159	A	86.9	Confident	86.3	Confident	30 Å²	30	47.3 Å²	47.3	25%	0.248	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-45.1	178.1	0	0	0	0	0	111.8	R155 Y156 A163 M405 W410	R155-A159 VanDerWaalsContact O-CB 3.24Å; R155-A159 WeakPolarHBondContact O-CB 3.35Å; R155-A159 PolarHBondContact O-N 2.9Å; Y156-A159 PolarHBondContact O-N 3.43Å; A159-A163 WeakPolarHBondContact O-CB 3.29Å; A159-A163 PolarHBondContact O-N 3.32Å; A159-M405 HydrophobicContact CB-CE 4.25Å; A159-W410 HydrophobicContact CB-CE3 4.49Å; A159-W410 HydrophobicContact CB-CZ3 4.08Å
160	A	90.5	Very high	86.2	Confident	55 Å²	55	42.9 Å²	42.9	46%	0.455	23%	0.229	S	C	.	.	H	α-helix	trans	-63.6	-48.9	176.9	0	0	0	0	0	111.6	Y156 I157 A163 I164	Y156-A160 WeakPolarHBondContact O-CB 3.31Å; Y156-A160 PolarHBondContact O-N 3.45Å; I157-A160 PolarHBondContact O-N 3.19Å; A160-A163 PolarHBondContact O-N 3.38Å; A160-I164 WeakPolarHBondContact O-CG1 3.12Å; A160-I164 PolarHBondContact O-N 3.46Å
161	G	90.1	Very high	85.9	Confident	5 Å²	5	45.1 Å²	45.1	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-41.1	178.1	0	0	0	0	0	113	I157 G158 I164 F165	I157-G161 PolarHBondContact O-N 3.14Å; G158-G161 PolarHBondContact O-N 3.03Å; G161-I164 PolarHBondContact O-N 2.9Å; G161-F165 WeakPolarHBondContact O-CB 3.29Å; G161-F165 PolarHBondContact O-N 3.41Å
162	G	85.7	Confident	85.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-39.4	174.9	0	0	0	0	0	112.8	G158 F165 L166	G158-G162 WeakPolarHBondContact O-CA 3.39Å; G158-G162 PolarHBondContact O-N 3.05Å; G162-F165 PolarHBondContact O-N 2.77Å; G162-L166 WeakPolarHBondContact O-CB 3.41Å; G162-L166 VanDerWaalsContact O-CG 3.31Å; G162-L166 WeakPolarHBondContact O-CG 3.37Å; G162-L166 PolarHBondContact O-N 3.5Å
163	A	86.4	Confident	85.3	Confident	52 Å²	52	40.8 Å²	40.8	43%	0.43	22%	0.221	S	C	.	.	H	α-helix	trans	-64.6	-41.9	174.1	0	0	0	0	0	112.2	A159 A160 L166 L167	A159-A163 WeakPolarHBondContact O-CB 3.29Å; A159-A163 PolarHBondContact O-N 3.32Å; A160-A163 PolarHBondContact O-N 3.38Å; A163-L166 PolarHBondContact O-N 3.34Å; A163-L167 PolarHBondContact O-N 2.91Å
164	I	88.1	Confident	85	Confident	85 Å²	85	37.5 Å²	37.5	44%	0.436	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-44.2	174.4	-63.4	165.6	0	0	0	110.3	A160 G161 L166 L167 I168 L398	A160-I164 WeakPolarHBondContact O-CG1 3.12Å; A160-I164 PolarHBondContact O-N 3.46Å; G161-I164 PolarHBondContact O-N 2.9Å; I164-L166 PolarHBondContact O-N 2.9Å; I164-L167 PolarHBondContact O-N 2.91Å; I164-I168 HydrophobicContact CG2-CD1 4Å; I164-I168 WeakPolarHBondContact O-CG1 3.21Å; I164-I168 PolarHBondContact O-N 2.86Å; I164-L398 HydrophobicContact CB-CD1 4.43Å; I164-L398 HydrophobicContact CB-CD2 4.39Å; I164-L398 HydrophobicContact CG2-CD1 3.68Å; I164-L398 HydrophobicContact CG2-CD2 4.36Å
165	F	86.1	Confident	84.4	Confident	3 Å²	3	37.7 Å²	37.7	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-47	176.9	-174.3	-101.4	0	0	0	111.9	G161 G162 L167 I168 Q169 V395 L398 G399 Y402	G161-F165 WeakPolarHBondContact O-CB 3.29Å; G161-F165 PolarHBondContact O-N 3.41Å; G162-F165 PolarHBondContact O-N 2.77Å; F165-L167 VanDerWaalsContact C-N 3.33Å; F165-L167 PolarHBondContact O-N 3.06Å; F165-I168 PolarHBondContact O-N 2.82Å; F165-Q169 WeakPolarHBondContact O-CB 3.23Å; F165-Q169 PolarHBondContact O-N 3.37Å; F165-V395 HydrophobicContact CD2-CG1 4.5Å; F165-V395 HydrophobicContact CE2-CG1 3.94Å; F165-L398 HydrophobicContact CB-CB 4Å; F165-L398 HydrophobicContact CD2-CB 3.89Å; F165-L398 HydrophobicContact CG-CB 4.41Å; F165-G399 VanDerWaalsContact CD2-CA 3.48Å; F165-G399 VanDerWaalsContact CD2-N 3.29Å; F165-G399 VanDerWaalsContact CE2-CA 3.44Å; F165-Y402 AromaticContact CD1-CD1 3.83Å; F165-Y402 HydrophobicContact CD1-CD1 3.83Å; F165-Y402 HydrophobicContact CD1-CD2 4.27Å; F165-Y402 AromaticContact CD1-CG 3.62Å; F165-Y402 HydrophobicContact CD1-CG 3.62Å; F165-Y402 AromaticContact CE1-CD1 3.88Å; F165-Y402 HydrophobicContact CE1-CD1 3.88Å; F165-Y402 HydrophobicContact CE1-CG 4.16Å; F165-Y402 HydrophobicContact CG-CG 4.45Å
166	L	82.2	Confident	84.1	Confident	14 Å²	14	37.7 Å²	37.7	7%	0.073	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-44.4	176.2	-77.1	169.6	0	0	0	111.4	G162 A163 I164 I168 Q169 L170 Y402 W410 L431	G162-L166 WeakPolarHBondContact O-CB 3.41Å; G162-L166 VanDerWaalsContact O-CG 3.31Å; G162-L166 WeakPolarHBondContact O-CG 3.37Å; G162-L166 PolarHBondContact O-N 3.5Å; A163-L166 PolarHBondContact O-N 3.34Å; I164-L166 PolarHBondContact O-N 2.9Å; L166-I168 PolarHBondContact O-N 2.84Å; L166-Q169 WeakPolarHBondContact O-CB 3.45Å; L166-Q169 PolarHBondContact O-N 2.78Å; L166-L170 VanDerWaalsContact O-CG 3.28Å; L166-L170 WeakPolarHBondContact O-CG 3.22Å; L166-L170 PolarHBondContact O-N 2.89Å; L166-Y402 HydrophobicContact CD1-CD2 4.24Å; L166-Y402 HydrophobicContact CD1-CE2 3.89Å; L166-Y402 HydrophobicContact CD2-CD2 4.15Å; L166-Y402 HydrophobicContact CD2-CE2 3.48Å; L166-Y402 VanDerWaalsContact CD2-CE2 3.48Å; L166-Y402 HydrophobicContact CG-CD2 3.88Å; L166-Y402 HydrophobicContact CG-CE2 3.64Å; L166-W410 HydrophobicContact CD1-CH2 4.4Å; L166-W410 HydrophobicContact CD1-CZ2 4.3Å; L166-L431 HydrophobicContact CD1-CD1 4.07Å; L166-L431 HydrophobicContact CD1-CD2 3.8Å; L166-L431 HydrophobicContact CD1-CG 4.13Å
167	L	85.1	Confident	83.8	Confident	93 Å²	93	31.5 Å²	31.5	49%	0.487	18%	0.18	S	C	.	.	H	α-helix	trans	-61.3	-45.3	177.5	-174.9	149.8	0	0	0	111.9	A163 I164 F165 Q169 L170 M171	A163-L167 PolarHBondContact O-N 2.91Å; I164-L167 PolarHBondContact O-N 2.91Å; F165-L167 VanDerWaalsContact C-N 3.33Å; F165-L167 PolarHBondContact O-N 3.06Å; L167-Q169 VanDerWaalsContact C-N 3.32Å; L167-Q169 PolarHBondContact O-N 3.45Å; L167-L170 PolarHBondContact O-N 3.14Å; L167-M171 PolarHBondContact O-N 3.36Å
168	I	80.1	Confident	83.3	Confident	17 Å²	17	29.1 Å²	29.1	9%	0.087	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-45.2	175.8	-67.9	170.2	0	0	0	110	I164 F165 L166 L170 M171 L172 L340 L398	I164-I168 HydrophobicContact CG2-CD1 4Å; I164-I168 WeakPolarHBondContact O-CG1 3.21Å; I164-I168 PolarHBondContact O-N 2.86Å; F165-I168 PolarHBondContact O-N 2.82Å; L166-I168 PolarHBondContact O-N 2.84Å; I168-L170 PolarHBondContact O-N 3.37Å; I168-M171 PolarHBondContact O-N 2.89Å; I168-L172 HydrophobicContact CG2-CD1 3.82Å; I168-L172 HydrophobicContact CG2-CG 4.42Å; I168-L172 VanDerWaalsContact O-CG 3.26Å; I168-L172 WeakPolarHBondContact O-CG 3.35Å; I168-L172 PolarHBondContact O-N 2.89Å; I168-L340 HydrophobicContact CG2-CD1 4.01Å; I168-L340 HydrophobicContact CG2-CD2 4.5Å; I168-L398 HydrophobicContact CD1-CD1 3.71Å
169	Q	80.1	Confident	82.7	Confident	31 Å²	31	33.2 Å²	33.2	15%	0.145	18%	0.183	C	C	.	.	H	α-helix	trans	-59.9	-43.9	177.8	176.5	175.5	14.7	0	0	112.1	F165 L166 L167 L172 L173 S327	F165-Q169 WeakPolarHBondContact O-CB 3.23Å; F165-Q169 PolarHBondContact O-N 3.37Å; L166-Q169 WeakPolarHBondContact O-CB 3.45Å; L166-Q169 PolarHBondContact O-N 2.78Å; L167-Q169 VanDerWaalsContact C-N 3.32Å; L167-Q169 PolarHBondContact O-N 3.45Å; Q169-L172 PolarHBondContact O-N 2.86Å; Q169-L173 WeakPolarHBondContact O-CB 3.31Å; Q169-L173 PolarHBondContact O-N 3.32Å; Q169-S327 VanDerWaalsContact CG-OG 3.32Å; Q169-S327 WeakPolarHBondContact CG-OG 3.47Å; Q169-S327 PolarHBondContact NE2-OG 3.32Å
170	L	81.8	Confident	82.3	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-63.8	-42.7	177.4	-69.1	179.1	0	0	0	111.8	L166 L167 I168 L172 L173 V174 Y270 S435 V438 C439 L442	L166-L170 VanDerWaalsContact O-CG 3.28Å; L166-L170 WeakPolarHBondContact O-CG 3.22Å; L166-L170 PolarHBondContact O-N 2.89Å; L167-L170 PolarHBondContact O-N 3.14Å; I168-L170 PolarHBondContact O-N 3.37Å; L170-L172 VanDerWaalsContact C-N 3.32Å; L170-L172 PolarHBondContact O-N 2.84Å; L170-L173 PolarHBondContact O-N 3.21Å; L170-V174 WeakPolarHBondContact O-CG2 3.46Å; L170-V174 PolarHBondContact O-N 3.1Å; L170-Y270 HydrophobicContact CD2-CE1 3.46Å; L170-Y270 VanDerWaalsContact CD2-CE1 3.46Å; L170-Y270 WeakPolarHBondContact CD2-OH 3.38Å; L170-S435 WeakPolarHBondContact CD1-O 3.32Å; L170-V438 HydrophobicContact CD1-CB 4.01Å; L170-V438 HydrophobicContact CD1-CG1 3.8Å; L170-C439 HydrophobicContact CD1-CB 4.35Å; L170-C439 HydrophobicContact CD2-CB 3.86Å; L170-L442 HydrophobicContact CB-CD1 3.95Å
171	M	80.9	Confident	82.1	Confident	66 Å²	66	31.9 Å²	31.9	33%	0.325	16%	0.16	S	C	.	.	H	α-helix	trans	-60.8	-43.2	176.1	-179.2	176.4	168.8	0	0	111.6	L167 I168 V174 E175 A339 L340 L442	L167-M171 PolarHBondContact O-N 3.36Å; I168-M171 PolarHBondContact O-N 2.89Å; M171-V174 PolarHBondContact O-N 3.39Å; M171-E175 PolarHBondContact O-N 3.21Å; M171-A339 WeakPolarHBondContact CE-O 3.43Å; M171-L340 HydrophobicContact CE-CD2 4Å; M171-L340 HydrophobicContact CE-CG 4.33Å; M171-L340 HydrophobicContact SD-CD2 3.53Å; M171-L340 VanDerWaalsContact SD-CD2 3.53Å; M171-L340 HydrophobicContact SD-CG 4.36Å; M171-L442 HydrophobicContact CB-CD1 4.45Å
172	L	75.3	Confident	81.7	Confident	16 Å²	16	33.9 Å²	33.9	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-37	178.3	-70.4	169.6	0	0	0	112.8	I168 Q169 L170 E175 F176 S331 A339 L340	I168-L172 HydrophobicContact CG2-CD1 3.82Å; I168-L172 HydrophobicContact CG2-CG 4.42Å; I168-L172 VanDerWaalsContact O-CG 3.26Å; I168-L172 WeakPolarHBondContact O-CG 3.35Å; I168-L172 PolarHBondContact O-N 2.89Å; Q169-L172 PolarHBondContact O-N 2.86Å; L170-L172 VanDerWaalsContact C-N 3.32Å; L170-L172 PolarHBondContact O-N 2.84Å; L172-E175 PolarHBondContact O-N 3.45Å; L172-F176 VanDerWaalsContact O-CB 3.25Å; L172-F176 WeakPolarHBondContact O-CB 3.43Å; L172-F176 PolarHBondContact O-N 3.4Å; L172-S331 WeakPolarHBondContact CD1-OG 3.46Å; L172-A339 HydrophobicContact CD2-CB 4.4Å; L172-L340 HydrophobicContact CD1-CD1 4.29Å; L172-L340 HydrophobicContact CD2-CD1 3.74Å; L172-L340 HydrophobicContact CD2-CG 4.45Å; L172-L340 HydrophobicContact CG-CD1 4.1Å
173	L	78.4	Confident	81.4	Confident	35 Å²	35	36 Å²	36	18%	0.183	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-46.9	174.4	-177.8	79	0	0	0	111.5	Q169 L170 E175 F176 A177 I267 Y270	Q169-L173 WeakPolarHBondContact O-CB 3.31Å; Q169-L173 PolarHBondContact O-N 3.32Å; L170-L173 PolarHBondContact O-N 3.21Å; L173-E175 VanDerWaalsContact C-N 3.33Å; L173-E175 PolarHBondContact O-N 2.94Å; L173-F176 WeakPolarHBondContact O-CB 3.4Å; L173-F176 PolarHBondContact O-N 2.88Å; L173-A177 PolarHBondContact O-N 3.48Å; L173-I267 HydrophobicContact CD2-CD1 4.42Å; L173-Y270 HydrophobicContact CD2-CD1 3.31Å; L173-Y270 HydrophobicContact CD2-CD2 3.73Å; L173-Y270 HydrophobicContact CD2-CE1 3.58Å; L173-Y270 HydrophobicContact CD2-CE2 3.99Å; L173-Y270 HydrophobicContact CD2-CG 3.37Å
174	V	82.8	Confident	81.2	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-47.1	177.7	166.4	0	0	0	0	110.5	L170 M171 A177 H178 I267 L442 Y443 T446	L170-V174 WeakPolarHBondContact O-CG2 3.46Å; L170-V174 PolarHBondContact O-N 3.1Å; M171-V174 PolarHBondContact O-N 3.39Å; V174-A177 WeakPolarHBondContact O-CB 3.31Å; V174-A177 PolarHBondContact O-N 2.85Å; V174-H178 PolarHBondContact O-CD2 3.3Å; V174-H178 PolarHBondContact O-N 3.5Å; V174-H178 VanDerWaalsContact O-N 3.07Å; V174-I267 HydrophobicContact CG2-CD1 3.89Å; V174-L442 HydrophobicContact CG2-CB 4.34Å; V174-Y443 HydrophobicContact CG1-CD2 4.13Å; V174-T446 HydrophobicContact CG1-CG2 4.48Å
175	E	77.4	Confident	80.9	Confident	48 Å²	48	32 Å²	32	22%	0.224	16%	0.155	C	C	.	.	H	α-helix	trans	-68.9	-37.3	-179.2	-157.7	-147	-156.7	0	0	112.4	M171 L172 L173 A177 H178 R179 A339	M171-E175 PolarHBondContact O-N 3.21Å; L172-E175 PolarHBondContact O-N 3.45Å; L173-E175 VanDerWaalsContact C-N 3.33Å; L173-E175 PolarHBondContact O-N 2.94Å; E175-A177 VanDerWaalsContact C-N 3.3Å; E175-A177 PolarHBondContact O-N 3.42Å; E175-H178 PolarHBondContact O-N 2.91Å; E175-R179 VanDerWaalsContact CD-NH2 3.26Å; E175-R179 WeakPolarHBondContact O-CB 3.4Å; E175-R179 VanDerWaalsContact O-CG 3.29Å; E175-R179 WeakPolarHBondContact O-CG 3.4Å; E175-R179 PolarHBondContact O-N 3.35Å; E175-R179 IonicContact OE1-CZ 3.66Å; E175-R179 IonicContact OE1-NE 3.72Å; E175-R179 PolarHBondContact OE1-NE 3.32Å; E175-R179 IonicContact OE1-NH2 3.82Å; E175-R179 PolarHBondContact OE1-NH2 3.35Å; E175-R179 IonicContact OE2-CZ 3.38Å; E175-R179 IonicContact OE2-NE 3.25Å; E175-R179 PolarHBondContact OE2-NE 3.43Å; E175-R179 IonicContact OE2-NH2 2.7Å; E175-R179 PolarHBondContact OE2-NH2 3.24Å; E175-R179 VanDerWaalsContact OE2-NH2 3.14Å; E175-A339 HydrophobicContact CG-CB 4.35Å; E175-A339 VanDerWaalsContact OE1-CA 3.23Å; E175-A339 WeakPolarHBondContact OE1-CA 3.33Å; E175-A339 WeakPolarHBondContact OE1-CB 3.17Å; E175-A339 WeakPolarHBondContact OE2-CB 3.33Å
176	F	78	Confident	80.7	Confident	38 Å²	38	32.9 Å²	32.9	17%	0.167	16%	0.162	C	C	.	.	H	α-helix	trans	-55.6	-46.4	170.7	167.1	-99.3	0	0	0	111.4	L172 L173 H178 R179 W180	L172-F176 VanDerWaalsContact O-CB 3.25Å; L172-F176 WeakPolarHBondContact O-CB 3.43Å; L172-F176 PolarHBondContact O-N 3.4Å; L173-F176 WeakPolarHBondContact O-CB 3.4Å; L173-F176 PolarHBondContact O-N 2.88Å; F176-H178 PolarHBondContact O-N 2.86Å; F176-R179 PolarHBondContact O-N 3.02Å; F176-W180 AromaticContact CE1-CE3 3.55Å; F176-W180 HydrophobicContact CE1-CE3 3.55Å; F176-W180 AromaticContact CE1-CZ3 3.99Å; F176-W180 HydrophobicContact CE1-CZ3 3.99Å; F176-W180 HydrophobicContact CZ-CD2 4.33Å; F176-W180 AromaticContact CZ-CE3 3.53Å; F176-W180 HydrophobicContact CZ-CE3 3.53Å; F176-W180 HydrophobicContact CZ-CZ3 4Å; F176-W180 WeakPolarHBondContact O-CB 3.44Å; F176-W180 PolarHBondContact O-N 3.48Å
177	A	82.6	Confident	80.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.8	-47.2	177.6	0	0	0	0	0	111.3	L173 V174 E175 W180 N181 Q263 V266 I267	L173-A177 PolarHBondContact O-N 3.48Å; V174-A177 WeakPolarHBondContact O-CB 3.31Å; V174-A177 PolarHBondContact O-N 2.85Å; E175-A177 VanDerWaalsContact C-N 3.3Å; E175-A177 PolarHBondContact O-N 3.42Å; A177-W180 PolarHBondContact O-N 3.4Å; A177-N181 PolarHBondContact O-N 3.08Å; A177-N181 VanDerWaalsContact O-N 3.13Å; A177-Q263 HydrophobicContact CB-CB 4.25Å; A177-Q263 WeakPolarHBondContact O-CG 3.28Å; A177-V266 HydrophobicContact CB-CB 4.14Å; A177-V266 HydrophobicContact CB-CG1 4.15Å; A177-I267 HydrophobicContact CB-CD1 4.37Å
178	H	81	Confident	80.3	Confident	19 Å²	19	29.9 Å²	29.9	9%	0.088	15%	0.148	C	C	.	.	H	α-helix	trans	-58.5	-48.1	174.8	-77.8	-74.3	0	0	0	112.9	V174 E175 F176 W180 N181 T182 Q263 Y443	V174-H178 PolarHBondContact O-CD2 3.3Å; V174-H178 PolarHBondContact O-N 3.5Å; V174-H178 VanDerWaalsContact O-N 3.07Å; E175-H178 PolarHBondContact O-N 2.91Å; F176-H178 PolarHBondContact O-N 2.86Å; H178-W180 PolarHBondContact O-N 3.28Å; H178-N181 PolarHBondContact O-N 2.89Å; H178-T182 PolarHBondContact O-N 3.26Å; H178-T182 PolarHBondContact O-OG1 2.99Å; H178-T182 VanDerWaalsContact O-OG1 3.09Å; H178-Q263 HydrophobicContact CB-CG 4.47Å; H178-Y443 AromaticContact CE1-CE2 3.79Å; H178-Y443 AromaticContact NE2-CD2 3.69Å; H178-Y443 AromaticContact NE2-CE2 3.45Å; H178-Y443 WeakPolarHBondContact NE2-CE2 3.31Å
179	R	76.4	Confident	80.2	Confident	86 Å²	86	36.1 Å²	36.1	33%	0.325	18%	0.177	S	C	.	.	H	α-helix	trans	-61.6	-44.3	179	-73.4	174.4	-175.6	-107.2	2.4	112.2	E175 F176 N181 T182 N183 R335	E175-R179 VanDerWaalsContact CD-NH2 3.26Å; E175-R179 WeakPolarHBondContact O-CB 3.4Å; E175-R179 VanDerWaalsContact O-CG 3.29Å; E175-R179 WeakPolarHBondContact O-CG 3.4Å; E175-R179 PolarHBondContact O-N 3.35Å; E175-R179 IonicContact OE1-CZ 3.66Å; E175-R179 IonicContact OE1-NE 3.72Å; E175-R179 PolarHBondContact OE1-NE 3.32Å; E175-R179 IonicContact OE1-NH2 3.82Å; E175-R179 PolarHBondContact OE1-NH2 3.35Å; E175-R179 IonicContact OE2-CZ 3.38Å; E175-R179 IonicContact OE2-NE 3.25Å; E175-R179 PolarHBondContact OE2-NE 3.43Å; E175-R179 IonicContact OE2-NH2 2.7Å; E175-R179 PolarHBondContact OE2-NH2 3.24Å; E175-R179 VanDerWaalsContact OE2-NH2 3.14Å; F176-R179 PolarHBondContact O-N 3.02Å; R179-N181 VanDerWaalsContact C-N 3.33Å; R179-N181 PolarHBondContact O-N 2.91Å; R179-T182 PolarHBondContact O-N 3.16Å; R179-N183 VanDerWaalsContact O-CB 3.27Å; R179-N183 WeakPolarHBondContact O-CB 3.32Å; R179-N183 PolarHBondContact O-N 3.04Å; R179-R335 VanDerWaalsContact NH1-CB 3.32Å; R179-R335 PolarHBondContact NH2-O 3.14Å
180	W	79.4	Confident	80.2	Confident	53 Å²	53	43.5 Å²	43.5	20%	0.201	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-49.7	178	-174.1	-5.2	0	0	0	110	F176 A177 H178 T182 N183 W184 V201 L262 V266	F176-W180 AromaticContact CE1-CE3 3.55Å; F176-W180 HydrophobicContact CE1-CE3 3.55Å; F176-W180 AromaticContact CE1-CZ3 3.99Å; F176-W180 HydrophobicContact CE1-CZ3 3.99Å; F176-W180 HydrophobicContact CZ-CD2 4.33Å; F176-W180 AromaticContact CZ-CE3 3.53Å; F176-W180 HydrophobicContact CZ-CE3 3.53Å; F176-W180 HydrophobicContact CZ-CZ3 4Å; F176-W180 WeakPolarHBondContact O-CB 3.44Å; F176-W180 PolarHBondContact O-N 3.48Å; A177-W180 PolarHBondContact O-N 3.4Å; H178-W180 PolarHBondContact O-N 3.28Å; W180-T182 PolarHBondContact O-N 3.29Å; W180-N183 PolarHBondContact O-N 2.86Å; W180-W184 AromaticContact CD1-CD1 3.5Å; W180-W184 VanDerWaalsContact CD1-CD1 3.5Å; W180-W184 AromaticContact CD1-CD2 3.91Å; W180-W184 AromaticContact CD1-CE2 3.78Å; W180-W184 AromaticContact CD1-CG 3.75Å; W180-W184 AromaticContact CD1-NE1 3.5Å; W180-W184 HydrophobicContact CZ2-CH2 4.48Å; W180-W184 HydrophobicContact CZ2-CZ2 4.29Å; W180-W184 AromaticContact NE1-CD1 3.67Å; W180-W184 AromaticContact NE1-CD2 3.43Å; W180-W184 AromaticContact NE1-CE2 3.08Å; W180-W184 AromaticContact NE1-CG 3.79Å; W180-W184 AromaticContact NE1-CZ2 3.47Å; W180-W184 AromaticContact NE1-NE1 3.24Å; W180-W184 PolarHBondContact O-N 3.38Å; W180-V201 HydrophobicContact CH2-CG1 4.47Å; W180-V201 HydrophobicContact CZ2-CG1 4.24Å; W180-L262 HydrophobicContact CB-CD2 4.3Å; W180-L262 HydrophobicContact CD2-CD2 4.02Å; W180-L262 HydrophobicContact CG-CD2 3.75Å; W180-V266 HydrophobicContact CE3-CG2 4.32Å; W180-V266 HydrophobicContact CZ3-CG2 4.32Å
181	N	85.6	Confident	80.4	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-45.4	178	-174.7	84.9	0	0	0	112.3	A177 H178 R179 N183 W184 S185 R258 L262 Q263	A177-N181 PolarHBondContact O-N 3.08Å; A177-N181 VanDerWaalsContact O-N 3.13Å; H178-N181 PolarHBondContact O-N 2.89Å; R179-N181 VanDerWaalsContact C-N 3.33Å; R179-N181 PolarHBondContact O-N 2.91Å; N181-N183 PolarHBondContact O-N 3.24Å; N181-W184 PolarHBondContact O-N 3.47Å; N181-S185 WeakPolarHBondContact O-CB 3.4Å; N181-S185 PolarHBondContact O-N 2.88Å; N181-S185 PolarHBondContact O-OG 3.43Å; N181-R258 PolarHBondContact ND2-O 3.38Å; N181-L262 HydrophobicContact CB-CB 4.21Å; N181-L262 HydrophobicContact CB-CD2 4.14Å; N181-L262 WeakPolarHBondContact OD1-CB 3.28Å; N181-Q263 HydrophobicContact CB-CG 3.56Å; N181-Q263 PolarHBondContact ND2-NE2 2.82Å; N181-Q263 PolarHBondContact ND2-OE1 3.43Å; N181-Q263 PolarHBondContact OD1-OE1 3.32Å
182	T	82.4	Confident	80.5	Confident	47 Å²	47	54.7 Å²	54.7	29%	0.288	25%	0.249	S	C	.	.	H	α-helix	trans	-56.7	-49.1	177.4	-62.9	0	0	0	0	111.4	H178 R179 W180 W184 S185 S186	H178-T182 PolarHBondContact O-N 3.26Å; H178-T182 PolarHBondContact O-OG1 2.99Å; H178-T182 VanDerWaalsContact O-OG1 3.09Å; R179-T182 PolarHBondContact O-N 3.16Å; W180-T182 PolarHBondContact O-N 3.29Å; T182-W184 PolarHBondContact O-N 2.97Å; T182-S185 WeakPolarHBondContact CA-OG 3.48Å; T182-S185 PolarHBondContact O-N 3.48Å; T182-S185 PolarHBondContact O-OG 3.34Å; T182-S186 PolarHBondContact O-N 3.1Å; T182-S186 PolarHBondContact O-OG 3.35Å; T182-S186 VanDerWaalsContact O-OG 3.12Å
183	N	79.7	Confident	81	Confident	45 Å²	45	59.8 Å²	59.8	24%	0.241	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-44.3	-179.9	177.8	42.5	0	0	0	112.7	R179 W180 N181 S186 G187 A353 R354	R179-N183 VanDerWaalsContact O-CB 3.27Å; R179-N183 WeakPolarHBondContact O-CB 3.32Å; R179-N183 PolarHBondContact O-N 3.04Å; W180-N183 PolarHBondContact O-N 2.86Å; N181-N183 PolarHBondContact O-N 3.24Å; N183-S186 PolarHBondContact O-OG 3.31Å; N183-G187 PolarHBondContact O-N 3.22Å; N183-A353 WeakPolarHBondContact O-CB 3.37Å; N183-A353 VanDerWaalsContact OD1-CA 3.31Å; N183-A353 WeakPolarHBondContact OD1-CA 3.48Å; N183-R354 PolarHBondContact ND2-O 2.8Å; N183-R354 PolarHBondContact OD1-N 2.7Å
184	W	81.4	Confident	81.3	Confident	25 Å²	25	61 Å²	61	10%	0.095	28%	0.278	C	S	.	.	H	α-helix	trans	-74.2	-37	178.6	-79.3	31.8	0	0	0	111.9	W180 N181 T182 S186 G187 V188 W194 A197 L198 V201	W180-W184 AromaticContact CD1-CD1 3.5Å; W180-W184 VanDerWaalsContact CD1-CD1 3.5Å; W180-W184 AromaticContact CD1-CD2 3.91Å; W180-W184 AromaticContact CD1-CE2 3.78Å; W180-W184 AromaticContact CD1-CG 3.75Å; W180-W184 AromaticContact CD1-NE1 3.5Å; W180-W184 HydrophobicContact CZ2-CH2 4.48Å; W180-W184 HydrophobicContact CZ2-CZ2 4.29Å; W180-W184 AromaticContact NE1-CD1 3.67Å; W180-W184 AromaticContact NE1-CD2 3.43Å; W180-W184 AromaticContact NE1-CE2 3.08Å; W180-W184 AromaticContact NE1-CG 3.79Å; W180-W184 AromaticContact NE1-CZ2 3.47Å; W180-W184 AromaticContact NE1-NE1 3.24Å; W180-W184 PolarHBondContact O-N 3.38Å; N181-W184 PolarHBondContact O-N 3.47Å; T182-W184 PolarHBondContact O-N 2.97Å; W184-S186 VanDerWaalsContact C-N 3.34Å; W184-S186 PolarHBondContact O-N 3.4Å; W184-G187 WeakPolarHBondContact O-CA 3.45Å; W184-G187 PolarHBondContact O-N 3.48Å; W184-V188 PolarHBondContact O-N 2.91Å; W184-W194 AromaticContact CD1-CZ3 3.97Å; W184-W194 HydrophobicContact CD2-CE3 4.05Å; W184-W194 AromaticContact CD2-CZ3 3.96Å; W184-W194 HydrophobicContact CD2-CZ3 3.96Å; W184-W194 AromaticContact CE2-CZ3 3.68Å; W184-W194 HydrophobicContact CE3-CE3 4.44Å; W184-W194 HydrophobicContact CG-CE3 4.17Å; W184-W194 HydrophobicContact CG-CZ3 4.16Å; W184-W194 HydrophobicContact CZ2-CZ3 4.14Å; W184-W194 AromaticContact NE1-CZ3 3.69Å; W184-A197 HydrophobicContact CE3-CB 4.37Å; W184-A197 HydrophobicContact CH2-CB 4.39Å; W184-A197 HydrophobicContact CZ3-CB 3.81Å; W184-L198 HydrophobicContact CB-CD1 4Å; W184-L198 HydrophobicContact CE3-CB 4.25Å; W184-L198 HydrophobicContact CE3-CD1 4.15Å; W184-V201 HydrophobicContact CH2-CG2 3.81Å; W184-V201 HydrophobicContact CZ3-CB 4.25Å; W184-V201 HydrophobicContact CZ3-CG2 3.71Å
185	S	81.8	Confident	81.4	Confident	27 Å²	27	68.1 Å²	68.1	19%	0.189	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-38.3	175.5	70	0	0	0	0	112.2	N181 T182 G187 V188	N181-S185 WeakPolarHBondContact O-CB 3.4Å; N181-S185 PolarHBondContact O-N 2.88Å; N181-S185 PolarHBondContact O-OG 3.43Å; T182-S185 WeakPolarHBondContact CA-OG 3.48Å; T182-S185 PolarHBondContact O-N 3.48Å; T182-S185 PolarHBondContact O-OG 3.34Å; S185-G187 VanDerWaalsContact C-N 3.27Å; S185-G187 PolarHBondContact O-N 3.04Å; S185-V188 WeakPolarHBondContact O-CB 3.49Å; S185-V188 PolarHBondContact O-N 3.34Å
186	S	81.8	Confident	81.9	Confident	22 Å²	22	68.4 Å²	68.4	15%	0.154	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-27.8	172.9	50.4	0	0	0	0	112.6	T182 N183 W184 V188 E189 Y190	T182-S186 PolarHBondContact O-N 3.1Å; T182-S186 PolarHBondContact O-OG 3.35Å; T182-S186 VanDerWaalsContact O-OG 3.12Å; N183-S186 PolarHBondContact O-OG 3.31Å; W184-S186 VanDerWaalsContact C-N 3.34Å; W184-S186 PolarHBondContact O-N 3.4Å; S186-V188 PolarHBondContact O-N 2.96Å; S186-E189 PolarHBondContact O-N 3.27Å; S186-Y190 VanDerWaalsContact O-CD2 3.27Å; S186-Y190 WeakPolarHBondContact O-CD2 3.21Å
187	G	77.9	Confident	82.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-28	173.4	0	0	0	0	0	113.5	N183 W184 S185 E189 Y190 N191 W194	N183-G187 PolarHBondContact O-N 3.22Å; W184-G187 WeakPolarHBondContact O-CA 3.45Å; W184-G187 PolarHBondContact O-N 3.48Å; S185-G187 VanDerWaalsContact C-N 3.27Å; S185-G187 PolarHBondContact O-N 3.04Å; G187-E189 VanDerWaalsContact C-N 3.27Å; G187-E189 PolarHBondContact O-N 3.11Å; G187-Y190 PolarHBondContact O-N 3.23Å; G187-Y190 VanDerWaalsContact O-N 3.16Å; G187-N191 PolarHBondContact O-N 2.83Å; G187-W194 VanDerWaalsContact O-CD1 3.23Å
188	V	81.9	Confident	82.6	Confident	45 Å²	45	69.4 Å²	69.4	27%	0.273	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-33.9	179.8	178.2	0	0	0	0	112	W184 S185 S186 Y190 W194 Y195	W184-V188 PolarHBondContact O-N 2.91Å; S185-V188 WeakPolarHBondContact O-CB 3.49Å; S185-V188 PolarHBondContact O-N 3.34Å; S186-V188 PolarHBondContact O-N 2.96Å; V188-Y190 PolarHBondContact O-N 2.93Å; V188-W194 HydrophobicContact CG2-CB 4.18Å; V188-Y195 HydrophobicContact CG1-CD2 4.18Å; V188-Y195 HydrophobicContact CG2-CD2 4.41Å
189	E	77.4	Confident	83	Confident	148 Å²	148	71 Å²	71	69%	0.692	34%	0.344	S	S	*	.	H	α-helix	trans	-62.2	-29.9	178	-65.5	179.2	-176.7	0	0	111.9	S186 G187	S186-E189 PolarHBondContact O-N 3.27Å; G187-E189 VanDerWaalsContact C-N 3.27Å; G187-E189 PolarHBondContact O-N 3.11Å
190	Y	81.2	Confident	83.8	Confident	186 Å²	186	73.1 Å²	73.1	73%	0.729	36%	0.356	S	S	*	.	H	α-helix	trans	-96.1	-38.2	-178.5	-58.9	-79	0	0	0	113.6	S186 G187 V188	S186-Y190 VanDerWaalsContact O-CD2 3.27Å; S186-Y190 WeakPolarHBondContact O-CD2 3.21Å; G187-Y190 PolarHBondContact O-N 3.23Å; G187-Y190 VanDerWaalsContact O-N 3.16Å; V188-Y190 PolarHBondContact O-N 2.93Å
191	N	84.1	Confident	84.3	Confident	79 Å²	79	72 Å²	72	42%	0.422	36%	0.355	S	S	.	.			trans	-145.3	124.3	-176.8	-176	-5.9	0	0	0	111.7	G187 L193 W194	G187-N191 PolarHBondContact O-N 2.83Å; N191-L193 PolarHBondContact O-N 3.37Å; N191-L193 VanDerWaalsContact O-N 3.12Å; N191-L193 WeakPolarHBondContact OD1-CB 3.46Å; N191-L193 PolarHBondContact OD1-N 2.92Å; N191-W194 WeakPolarHBondContact O-CB 3.29Å; N191-W194 PolarHBondContact O-N 3.44Å
192	R	84.9	Confident	84.7	Confident	224 Å²	224	72.4 Å²	72.4	85%	0.845	36%	0.357	S	S	*	.	H	α-helix	trans	-60.1	-21.7	177.4	-65.5	-175.8	179.8	-175.8	-0.1	113.5	W194 Y195 A196	R192-W194 PolarHBondContact O-N 3.48Å; R192-Y195 WeakPolarHBondContact O-CB 3.38Å; R192-Y195 PolarHBondContact O-N 3.27Å; R192-Y195 VanDerWaalsContact O-N 3.09Å; R192-A196 PolarHBondContact O-N 2.85Å
193	L	85.6	Confident	85.3	Confident	123 Å²	123	75.6 Å²	75.6	64%	0.644	37%	0.372	S	S	*	.	H	α-helix	trans	-60.7	-33.2	174.4	-168	70.7	0	0	0	112.2	N191 Y195 A196 A197	N191-L193 PolarHBondContact O-N 3.37Å; N191-L193 VanDerWaalsContact O-N 3.12Å; N191-L193 WeakPolarHBondContact OD1-CB 3.46Å; N191-L193 PolarHBondContact OD1-N 2.92Å; L193-Y195 VanDerWaalsContact C-N 3.25Å; L193-Y195 PolarHBondContact O-N 2.91Å; L193-A196 PolarHBondContact O-N 3.48Å; L193-A197 WeakPolarHBondContact O-CB 3.42Å; L193-A197 PolarHBondContact O-N 3.41Å
194	W	82.9	Confident	86	Confident	61 Å²	61	76.8 Å²	76.8	23%	0.231	38%	0.378	C	S	.	.	H	α-helix	trans	-64.9	-30.8	175.6	-74.2	110.8	0	0	0	112.4	W184 G187 V188 N191 R192 L198 A353	W184-W194 AromaticContact CD1-CZ3 3.97Å; W184-W194 HydrophobicContact CD2-CE3 4.05Å; W184-W194 AromaticContact CD2-CZ3 3.96Å; W184-W194 HydrophobicContact CD2-CZ3 3.96Å; W184-W194 AromaticContact CE2-CZ3 3.68Å; W184-W194 HydrophobicContact CE3-CE3 4.44Å; W184-W194 HydrophobicContact CG-CE3 4.17Å; W184-W194 HydrophobicContact CG-CZ3 4.16Å; W184-W194 HydrophobicContact CZ2-CZ3 4.14Å; W184-W194 AromaticContact NE1-CZ3 3.69Å; G187-W194 VanDerWaalsContact O-CD1 3.23Å; V188-W194 HydrophobicContact CG2-CB 4.18Å; N191-W194 WeakPolarHBondContact O-CB 3.29Å; N191-W194 PolarHBondContact O-N 3.44Å; R192-W194 PolarHBondContact O-N 3.48Å; W194-L198 VanDerWaalsContact O-CB 3.25Å; W194-L198 WeakPolarHBondContact O-CB 3.48Å; W194-L198 PolarHBondContact O-N 3.47Å; W194-A353 HydrophobicContact CZ2-CB 4.28Å
195	Y	85.7	Confident	86.5	Confident	151 Å²	151	76.8 Å²	76.8	59%	0.592	38%	0.38	S	S	*	.	H	α-helix	trans	-68.2	-44.7	174.7	-175.1	-95.9	0	0	0	111.1	V188 R192 L193 A197 L198 A199	V188-Y195 HydrophobicContact CG1-CD2 4.18Å; V188-Y195 HydrophobicContact CG2-CD2 4.41Å; R192-Y195 WeakPolarHBondContact O-CB 3.38Å; R192-Y195 PolarHBondContact O-N 3.27Å; R192-Y195 VanDerWaalsContact O-N 3.09Å; L193-Y195 VanDerWaalsContact C-N 3.25Å; L193-Y195 PolarHBondContact O-N 2.91Å; Y195-A197 PolarHBondContact O-N 3.16Å; Y195-L198 PolarHBondContact O-N 3.18Å; Y195-A199 WeakPolarHBondContact O-CB 3.41Å; Y195-A199 PolarHBondContact O-N 3.35Å
196	A	87.7	Confident	87.2	Confident	55 Å²	55	77.7 Å²	77.7	46%	0.455	38%	0.38	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.1	0	0	0	0	0	111.6	R192 L193 A199 F200	R192-A196 PolarHBondContact O-N 2.85Å; L193-A196 PolarHBondContact O-N 3.48Å; A196-A199 PolarHBondContact O-N 3.4Å; A196-F200 VanDerWaalsContact O-CB 3.27Å; A196-F200 WeakPolarHBondContact O-CB 3.41Å; A196-F200 PolarHBondContact O-N 3.47Å
197	A	88	Confident	87.8	Confident	31 Å²	31	80 Å²	80	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-45.8	175.6	0	0	0	0	0	111.9	W184 L193 Y195 A199 F200 V201	W184-A197 HydrophobicContact CE3-CB 4.37Å; W184-A197 HydrophobicContact CH2-CB 4.39Å; W184-A197 HydrophobicContact CZ3-CB 3.81Å; L193-A197 WeakPolarHBondContact O-CB 3.42Å; L193-A197 PolarHBondContact O-N 3.41Å; Y195-A197 PolarHBondContact O-N 3.16Å; A197-A199 PolarHBondContact O-N 3.23Å; A197-F200 PolarHBondContact O-N 2.85Å; A197-V201 WeakPolarHBondContact O-CG2 3.41Å; A197-V201 PolarHBondContact O-N 2.88Å
198	L	87.9	Confident	88.5	Confident	27 Å²	27	84.3 Å²	84.3	14%	0.141	42%	0.418	C	S	.	.	H	α-helix	trans	-59.9	-47	177.9	-175.3	71.6	0	0	0	111.6	W184 W194 Y195 T202 L262	W184-L198 HydrophobicContact CB-CD1 4Å; W184-L198 HydrophobicContact CE3-CB 4.25Å; W184-L198 HydrophobicContact CE3-CD1 4.15Å; W194-L198 VanDerWaalsContact O-CB 3.25Å; W194-L198 WeakPolarHBondContact O-CB 3.48Å; W194-L198 PolarHBondContact O-N 3.47Å; Y195-L198 PolarHBondContact O-N 3.18Å; L198-T202 VanDerWaalsContact O-CB 3.3Å; L198-T202 WeakPolarHBondContact O-CB 3.12Å; L198-T202 PolarHBondContact O-N 3.22Å; L198-T202 PolarHBondContact O-OG1 3.29Å; L198-L262 HydrophobicContact CD1-CB 3.88Å; L198-L262 HydrophobicContact CD1-CD1 4.36Å; L198-L262 HydrophobicContact CD1-CD2 3.78Å; L198-L262 HydrophobicContact CD1-CG 4.21Å
199	A	89.8	Confident	89.1	Confident	52 Å²	52	82.6 Å²	82.6	43%	0.43	41%	0.409	S	S	.	.	H	α-helix	trans	-63.3	-44.6	177.9	0	0	0	0	0	111.7	Y195 A196 A197 T202 L203	Y195-A199 WeakPolarHBondContact O-CB 3.41Å; Y195-A199 PolarHBondContact O-N 3.35Å; A196-A199 PolarHBondContact O-N 3.4Å; A197-A199 PolarHBondContact O-N 3.23Å; A199-T202 PolarHBondContact O-N 3.08Å; A199-L203 WeakPolarHBondContact O-CB 3.47Å; A199-L203 PolarHBondContact O-N 3.41Å
200	F	92.3	Very high	89.9	Confident	131 Å²	131	79.8 Å²	79.8	58%	0.575	40%	0.402	S	S	*	.	H	α-helix	trans	-62.9	-48.2	179.6	-179.6	-105.8	0	0	0	112.6	A196 A197 T202 L203 I204	A196-F200 VanDerWaalsContact O-CB 3.27Å; A196-F200 WeakPolarHBondContact O-CB 3.41Å; A196-F200 PolarHBondContact O-N 3.47Å; A197-F200 PolarHBondContact O-N 2.85Å; F200-T202 VanDerWaalsContact C-N 3.33Å; F200-T202 PolarHBondContact O-N 3.44Å; F200-L203 WeakPolarHBondContact O-CB 3.21Å; F200-L203 PolarHBondContact O-N 2.82Å; F200-I204 HydrophobicContact CD1-CD1 3.82Å; F200-I204 HydrophobicContact CE1-CD1 3.3Å; F200-I204 HydrophobicContact CE1-CG1 4.46Å; F200-I204 HydrophobicContact CE2-CD1 4.14Å; F200-I204 HydrophobicContact CG-CD1 4.44Å; F200-I204 HydrophobicContact CZ-CD1 3.49Å; F200-I204 VanDerWaalsContact CZ-CD1 3.49Å; F200-I204 HydrophobicContact CZ-CG1 4.42Å; F200-I204 WeakPolarHBondContact O-CG1 3.3Å; F200-I204 PolarHBondContact O-N 3.41Å
201	V	90.9	Very high	90.6	Very high	31 Å²	31	72.8 Å²	72.8	19%	0.188	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-41.4	178	174.1	0	0	0	0	110.9	W180 W184 A197 L203 I204 L205 L262	W180-V201 HydrophobicContact CH2-CG1 4.47Å; W180-V201 HydrophobicContact CZ2-CG1 4.24Å; W184-V201 HydrophobicContact CH2-CG2 3.81Å; W184-V201 HydrophobicContact CZ3-CB 4.25Å; W184-V201 HydrophobicContact CZ3-CG2 3.71Å; A197-V201 WeakPolarHBondContact O-CG2 3.41Å; A197-V201 PolarHBondContact O-N 2.88Å; V201-L203 VanDerWaalsContact C-N 3.35Å; V201-L203 PolarHBondContact O-N 2.73Å; V201-I204 PolarHBondContact O-N 3.35Å; V201-L205 HydrophobicContact CG1-CD1 3.99Å; V201-L205 HydrophobicContact CG1-CG 4.34Å; V201-L205 VanDerWaalsContact O-CG 3.31Å; V201-L205 WeakPolarHBondContact O-CG 3.25Å; V201-L205 PolarHBondContact O-N 3.29Å; V201-L262 HydrophobicContact CB-CD1 4.18Å; V201-L262 HydrophobicContact CG1-CD1 3.62Å
202	T	92.7	Very high	90.9	Very high	11 Å²	11	70.4 Å²	70.4	7%	0.067	38%	0.377	C	S	.	.	H	α-helix	trans	-60.2	-45.6	176.5	-58.3	0	0	0	0	111.2	L198 A199 F200 I204 L205 F206 L261	L198-T202 VanDerWaalsContact O-CB 3.3Å; L198-T202 WeakPolarHBondContact O-CB 3.12Å; L198-T202 PolarHBondContact O-N 3.22Å; L198-T202 PolarHBondContact O-OG1 3.29Å; A199-T202 PolarHBondContact O-N 3.08Å; F200-T202 VanDerWaalsContact C-N 3.33Å; F200-T202 PolarHBondContact O-N 3.44Å; T202-I204 VanDerWaalsContact C-N 3.34Å; T202-I204 PolarHBondContact O-N 2.85Å; T202-L205 PolarHBondContact O-N 3.37Å; T202-F206 HydrophobicContact CG2-CD2 3.82Å; T202-F206 HydrophobicContact CG2-CE2 3.84Å; T202-F206 WeakPolarHBondContact O-CD2 3.39Å; T202-F206 PolarHBondContact O-N 2.8Å; T202-F206 VanDerWaalsContact O-N 3.08Å; T202-L261 HydrophobicContact CG2-CB 3.82Å; T202-L261 HydrophobicContact CG2-CD2 3.87Å; T202-L261 HydrophobicContact CG2-CG 3.71Å
203	L	94.7	Very high	91.4	Very high	114 Å²	114	62 Å²	62	60%	0.597	35%	0.351	S	S	*	.	H	α-helix	trans	-57.8	-46.2	176.9	-174	81.1	0	0	0	111.5	A199 F200 V201 F206 S207	A199-L203 WeakPolarHBondContact O-CB 3.47Å; A199-L203 PolarHBondContact O-N 3.41Å; F200-L203 WeakPolarHBondContact O-CB 3.21Å; F200-L203 PolarHBondContact O-N 2.82Å; V201-L203 VanDerWaalsContact C-N 3.35Å; V201-L203 PolarHBondContact O-N 2.73Å; L203-F206 PolarHBondContact O-N 3.34Å; L203-S207 WeakPolarHBondContact O-CB 3.15Å; L203-S207 PolarHBondContact O-N 3.41Å; L203-S207 PolarHBondContact O-OG 3.49Å
204	I	94.4	Very high	91.9	Very high	70 Å²	70	60.1 Å²	60.1	36%	0.359	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-47.8	177.3	-71.7	172.4	0	0	0	111.1	F200 V201 T202 F206 S207 I208	F200-I204 HydrophobicContact CD1-CD1 3.82Å; F200-I204 HydrophobicContact CE1-CD1 3.3Å; F200-I204 HydrophobicContact CE1-CG1 4.46Å; F200-I204 HydrophobicContact CE2-CD1 4.14Å; F200-I204 HydrophobicContact CG-CD1 4.44Å; F200-I204 HydrophobicContact CZ-CD1 3.49Å; F200-I204 VanDerWaalsContact CZ-CD1 3.49Å; F200-I204 HydrophobicContact CZ-CG1 4.42Å; F200-I204 WeakPolarHBondContact O-CG1 3.3Å; F200-I204 PolarHBondContact O-N 3.41Å; V201-I204 PolarHBondContact O-N 3.35Å; T202-I204 VanDerWaalsContact C-N 3.34Å; T202-I204 PolarHBondContact O-N 2.85Å; I204-F206 PolarHBondContact O-N 2.85Å; I204-S207 WeakPolarHBondContact O-CB 3.43Å; I204-S207 PolarHBondContact O-N 3.36Å; I204-I208 HydrophobicContact CG2-CD1 3.67Å; I204-I208 HydrophobicContact CG2-CG1 4.33Å; I204-I208 WeakPolarHBondContact O-CG1 3.42Å; I204-I208 PolarHBondContact O-N 3.16Å
205	L	93.1	Very high	92.3	Very high	25 Å²	25	60.5 Å²	60.5	13%	0.131	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-46.1	-178.4	-69.7	170.2	0	0	0	111.8	V201 T202 S207 I208 A209 L262 V266 V269	V201-L205 HydrophobicContact CG1-CD1 3.99Å; V201-L205 HydrophobicContact CG1-CG 4.34Å; V201-L205 VanDerWaalsContact O-CG 3.31Å; V201-L205 WeakPolarHBondContact O-CG 3.25Å; V201-L205 PolarHBondContact O-N 3.29Å; T202-L205 PolarHBondContact O-N 3.37Å; L205-S207 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 2.83Å; L205-I208 PolarHBondContact O-N 2.88Å; L205-A209 PolarHBondContact O-N 2.84Å; L205-L262 HydrophobicContact CD1-CD1 3.85Å; L205-V266 HydrophobicContact CD1-CG2 3.65Å; L205-V269 HydrophobicContact CB-CG2 4.1Å; L205-V269 HydrophobicContact CD2-CG2 3.94Å; L205-V269 WeakPolarHBondContact O-CG2 3.36Å
206	F	95.4	Very high	92.6	Very high	45 Å²	45	53.3 Å²	53.3	20%	0.197	32%	0.319	C	S	.	.	H	α-helix	trans	-67.5	-35.2	176.3	-81.2	-74.4	0	0	0	112.7	T202 L203 I204 A209 V210 S244 L261 P264	T202-F206 HydrophobicContact CG2-CD2 3.82Å; T202-F206 HydrophobicContact CG2-CE2 3.84Å; T202-F206 WeakPolarHBondContact O-CD2 3.39Å; T202-F206 PolarHBondContact O-N 2.8Å; T202-F206 VanDerWaalsContact O-N 3.08Å; L203-F206 PolarHBondContact O-N 3.34Å; I204-F206 PolarHBondContact O-N 2.85Å; F206-A209 PolarHBondContact O-N 3.26Å; F206-V210 WeakPolarHBondContact O-CG2 3.35Å; F206-V210 PolarHBondContact O-N 2.99Å; F206-S244 WeakPolarHBondContact CE1-OG 3.29Å; F206-S244 WeakPolarHBondContact CZ-OG 2.85Å; F206-L261 HydrophobicContact CD2-CG 4.45Å; F206-L261 HydrophobicContact CE2-CD1 3.92Å; F206-L261 HydrophobicContact CE2-CD2 4.17Å; F206-L261 HydrophobicContact CE2-CG 3.61Å; F206-L261 WeakPolarHBondContact CE2-O 3.15Å; F206-L261 HydrophobicContact CZ-CD1 3.88Å; F206-L261 HydrophobicContact CZ-CG 4.11Å; F206-P264 HydrophobicContact CZ-CG 4.45Å
207	S	95.6	Very high	92.8	Very high	71 Å²	71	51.8 Å²	51.8	50%	0.497	31%	0.309	S	S	.	.	H	α-helix	trans	-63.8	-42.5	176.3	-58.1	0	0	0	0	111.2	L203 I204 L205 G211	L203-S207 WeakPolarHBondContact O-CB 3.15Å; L203-S207 PolarHBondContact O-N 3.41Å; L203-S207 PolarHBondContact O-OG 3.49Å; I204-S207 WeakPolarHBondContact O-CB 3.43Å; I204-S207 PolarHBondContact O-N 3.36Å; L205-S207 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 2.83Å; S207-G211 PolarHBondContact O-N 2.71Å
208	I	92.4	Very high	93	Very high	90 Å²	90	56.1 Å²	56.1	46%	0.462	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-45.4	173.8	-68.3	168.8	0	0	0	110.6	I204 L205 G211 A212 V269	I204-I208 HydrophobicContact CG2-CD1 3.67Å; I204-I208 HydrophobicContact CG2-CG1 4.33Å; I204-I208 WeakPolarHBondContact O-CG1 3.42Å; I204-I208 PolarHBondContact O-N 3.16Å; L205-I208 PolarHBondContact O-N 2.88Å; I208-G211 PolarHBondContact O-N 2.67Å; I208-A212 WeakPolarHBondContact O-CB 3.26Å; I208-A212 PolarHBondContact O-N 2.94Å; I208-V269 HydrophobicContact CB-CG2 4.27Å; I208-V269 HydrophobicContact CG2-CG1 4.14Å; I208-V269 HydrophobicContact CG2-CG2 4.17Å
209	A	93.6	Very high	93	Very high	9 Å²	9	59.2 Å²	59.2	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-46.3	179.9	0	0	0	0	0	112.1	L205 F206 A212 V213 V269 M272	L205-A209 PolarHBondContact O-N 2.84Å; F206-A209 PolarHBondContact O-N 3.26Å; A209-A212 PolarHBondContact O-N 3.24Å; A209-V213 WeakPolarHBondContact O-CG2 3.35Å; A209-V213 PolarHBondContact O-N 3.19Å; A209-V213 VanDerWaalsContact O-N 3.07Å; A209-V269 HydrophobicContact CB-CG2 4.18Å; A209-M272 HydrophobicContact CB-CG 4.25Å
210	V	95.9	Very high	92.8	Very high	90 Å²	90	57.5 Å²	57.5	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-44.2	176.4	173.4	0	0	0	0	110.9	F206 A212 V213 V214	F206-V210 WeakPolarHBondContact O-CG2 3.35Å; F206-V210 PolarHBondContact O-N 2.99Å; V210-A212 VanDerWaalsContact C-N 3.28Å; V210-A212 PolarHBondContact O-N 3.44Å; V210-V213 PolarHBondContact O-N 3.26Å; V210-V213 VanDerWaalsContact O-N 3.14Å; V210-V214 WeakPolarHBondContact O-CG2 3.23Å; V210-V214 PolarHBondContact O-N 3.49Å
211	G	95	Very high	92.7	Very high	39 Å²	39	53.1 Å²	53.1	40%	0.402	30%	0.304	S	S	.	.	H	α-helix	trans	-57.2	-41.2	175.3	0	0	0	0	0	112.3	S207 I208 V214 F215	S207-G211 PolarHBondContact O-N 2.71Å; I208-G211 PolarHBondContact O-N 2.67Å; G211-V214 PolarHBondContact O-N 3.41Å; G211-F215 VanDerWaalsContact O-CB 3.25Å; G211-F215 WeakPolarHBondContact O-CB 3.38Å; G211-F215 PolarHBondContact O-N 2.81Å
212	A	90.8	Very high	92.4	Very high	28 Å²	28	54.2 Å²	54.2	23%	0.231	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-39.9	175.8	0	0	0	0	0	112.7	I208 A209 V210 F215 M216 M272	I208-A212 WeakPolarHBondContact O-CB 3.26Å; I208-A212 PolarHBondContact O-N 2.94Å; A209-A212 PolarHBondContact O-N 3.24Å; V210-A212 VanDerWaalsContact C-N 3.28Å; V210-A212 PolarHBondContact O-N 3.44Å; A212-F215 PolarHBondContact O-N 3.46Å; A212-M216 HydrophobicContact CB-CE 4.24Å; A212-M216 WeakPolarHBondContact O-CB 3.31Å; A212-M216 VanDerWaalsContact O-CE 3.29Å; A212-M216 WeakPolarHBondContact O-CE 3.37Å; A212-M216 WeakPolarHBondContact O-CG 3.31Å; A212-M216 PolarHBondContact O-N 3.42Å; A212-M272 HydrophobicContact CB-CB 3.88Å; A212-M272 HydrophobicContact CB-CG 4.34Å
213	V	94.9	Very high	92	Very high	49 Å²	49	58.8 Å²	58.8	30%	0.297	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-48.8	173.9	174.1	0	0	0	0	110.9	A209 V210 M216 G217 L233 M272	A209-V213 WeakPolarHBondContact O-CG2 3.35Å; A209-V213 PolarHBondContact O-N 3.19Å; A209-V213 VanDerWaalsContact O-N 3.07Å; V210-V213 PolarHBondContact O-N 3.26Å; V210-V213 VanDerWaalsContact O-N 3.14Å; V213-M216 PolarHBondContact O-N 2.93Å; V213-G217 PolarHBondContact O-N 3.48Å; V213-L233 HydrophobicContact CG1-CD1 4.32Å; V213-M272 HydrophobicContact CG2-CE 4.43Å; V213-M272 HydrophobicContact CG2-CG 4.31Å; V213-M272 HydrophobicContact CG2-SD 3.29Å; V213-M272 WeakPolarHBondContact CG2-SD 3.4Å
214	V	95.4	Very high	91.4	Very high	82 Å²	82	59.3 Å²	59.3	50%	0.497	34%	0.344	S	S	.	.	H	α-helix	trans	-62.3	-46.7	179.5	175.9	0	0	0	0	110.4	V210 G211 M216 G217 L218	V210-V214 WeakPolarHBondContact O-CG2 3.23Å; V210-V214 PolarHBondContact O-N 3.49Å; G211-V214 PolarHBondContact O-N 3.41Å; V214-M216 PolarHBondContact O-N 3.3Å; V214-G217 PolarHBondContact O-N 3.46Å; V214-G217 VanDerWaalsContact O-N 3.16Å; V214-L218 HydrophobicContact CG1-CD1 3.99Å; V214-L218 HydrophobicContact CG1-CG 4.36Å; V214-L218 WeakPolarHBondContact O-CG 3.23Å; V214-L218 PolarHBondContact O-N 2.87Å
215	F	92.9	Very high	90.9	Very high	69 Å²	69	56.6 Å²	56.6	30%	0.303	33%	0.332	S	S	.	.	H	α-helix	trans	-57.8	-50.1	177.7	177.8	-94	0	0	0	112	G211 A212 G217 L218 Y219 Y220 F276 F299	G211-F215 VanDerWaalsContact O-CB 3.25Å; G211-F215 WeakPolarHBondContact O-CB 3.38Å; G211-F215 PolarHBondContact O-N 2.81Å; A212-F215 PolarHBondContact O-N 3.46Å; F215-G217 VanDerWaalsContact C-N 3.29Å; F215-G217 PolarHBondContact O-N 3.46Å; F215-L218 PolarHBondContact O-N 3.48Å; F215-Y219 HydrophobicContact CD1-CD2 4.49Å; F215-Y219 AromaticContact CD2-CD2 3.52Å; F215-Y219 HydrophobicContact CD2-CD2 3.52Å; F215-Y219 AromaticContact CD2-CE2 3.56Å; F215-Y219 HydrophobicContact CD2-CE2 3.56Å; F215-Y219 HydrophobicContact CE1-CD2 4.42Å; F215-Y219 AromaticContact CE2-CD2 3.45Å; F215-Y219 HydrophobicContact CE2-CD2 3.45Å; F215-Y219 VanDerWaalsContact CE2-CD2 3.45Å; F215-Y219 AromaticContact CE2-CE2 3.51Å; F215-Y219 HydrophobicContact CE2-CE2 3.51Å; F215-Y219 HydrophobicContact CE2-CG 4.49Å; F215-Y219 HydrophobicContact CG-CD2 4.07Å; F215-Y219 HydrophobicContact CG-CE2 4.48Å; F215-Y219 AromaticContact CZ-CD2 3.94Å; F215-Y219 HydrophobicContact CZ-CD2 3.94Å; F215-Y219 HydrophobicContact CZ-CE2 4.39Å; F215-Y219 VanDerWaalsContact O-CD2 3.29Å; F215-Y219 WeakPolarHBondContact O-CD2 3.27Å; F215-Y219 PolarHBondContact O-N 3.24Å; F215-Y220 HydrophobicContact CE1-CE2 4.21Å; F215-F276 HydrophobicContact CE1-CD2 4.27Å; F215-F276 AromaticContact CE1-CE2 3.89Å; F215-F276 HydrophobicContact CE1-CE2 3.89Å; F215-F299 HydrophobicContact CE1-CD2 4.37Å; F215-F299 AromaticContact CE2-CD2 3.78Å; F215-F299 HydrophobicContact CE2-CD2 3.78Å; F215-F299 AromaticContact CE2-CE2 3.49Å; F215-F299 HydrophobicContact CE2-CE2 3.49Å; F215-F299 VanDerWaalsContact CE2-CE2 3.49Å; F215-F299 HydrophobicContact CE2-CZ 4.35Å; F215-F299 AromaticContact CZ-CD2 3.38Å; F215-F299 HydrophobicContact CZ-CD2 3.38Å; F215-F299 AromaticContact CZ-CE2 3.53Å; F215-F299 HydrophobicContact CZ-CE2 3.53Å; F215-F299 HydrophobicContact CZ-CG 4.11Å; F215-F299 HydrophobicContact CZ-CZ 4.35Å
216	M	92.1	Very high	90.5	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-35.9	176.4	-73.2	-175.6	-78.7	0	0	112.1	A212 V213 V214 Y220 L233 M272 T275 F276 F279	A212-M216 HydrophobicContact CB-CE 4.24Å; A212-M216 WeakPolarHBondContact O-CB 3.31Å; A212-M216 VanDerWaalsContact O-CE 3.29Å; A212-M216 WeakPolarHBondContact O-CE 3.37Å; A212-M216 WeakPolarHBondContact O-CG 3.31Å; A212-M216 PolarHBondContact O-N 3.42Å; V213-M216 PolarHBondContact O-N 2.93Å; V214-M216 PolarHBondContact O-N 3.3Å; M216-Y220 WeakPolarHBondContact O-CA 3.33Å; M216-Y220 WeakPolarHBondContact O-CB 3.4Å; M216-Y220 PolarHBondContact O-N 3Å; M216-L233 HydrophobicContact CB-CD1 3.91Å; M216-L233 HydrophobicContact CB-CD2 4.04Å; M216-L233 HydrophobicContact CE-CD1 3.83Å; M216-L233 HydrophobicContact SD-CD1 4.23Å; M216-M272 HydrophobicContact CE-CB 4.29Å; M216-M272 HydrophobicContact CE-SD 3.8Å; M216-T275 HydrophobicContact CE-CG2 4.28Å; M216-T275 HydrophobicContact SD-CG2 3.87Å; M216-F276 HydrophobicContact CG-CB 4.35Å; M216-F276 HydrophobicContact CG-CD2 4.34Å; M216-F276 WeakPolarHBondContact SD-CA 3.24Å; M216-F276 HydrophobicContact SD-CB 3.69Å; M216-F276 PolarHBondContact SD-N 3.23Å; M216-F276 VanDerWaalsContact SD-N 3.37Å; M216-F279 HydrophobicContact CB-CD2 4.42Å; M216-F279 HydrophobicContact CB-CE2 4.34Å; M216-F279 HydrophobicContact CG-CD2 4.36Å; M216-F279 HydrophobicContact SD-CD2 4Å; M216-F279 HydrophobicContact SD-CE2 4.07Å
217	G	91.9	Very high	90.1	Very high	22 Å²	22	57 Å²	57	23%	0.227	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-44.4	174.5	0	0	0	0	0	112.3	V213 V214 F215 T221	V213-G217 PolarHBondContact O-N 3.48Å; V214-G217 PolarHBondContact O-N 3.46Å; V214-G217 VanDerWaalsContact O-N 3.16Å; F215-G217 VanDerWaalsContact C-N 3.29Å; F215-G217 PolarHBondContact O-N 3.46Å; G217-T221 PolarHBondContact O-OG1 3.33Å
218	L	91.2	Very high	89.8	Confident	122 Å²	122	55.5 Å²	55.5	64%	0.639	33%	0.329	S	S	*	.	H	α-helix	trans	-73.7	-39.4	-178	-67.4	175.3	0	0	0	113.5	V214 F215	V214-L218 HydrophobicContact CG1-CD1 3.99Å; V214-L218 HydrophobicContact CG1-CG 4.36Å; V214-L218 WeakPolarHBondContact O-CG 3.23Å; V214-L218 PolarHBondContact O-N 2.87Å; F215-L218 PolarHBondContact O-N 3.48Å
219	Y	87.1	Confident	89.7	Confident	93 Å²	93	51.4 Å²	51.4	37%	0.365	31%	0.308	S	S	.	.	H	α-helix	trans	-105.8	-29.4	-169.9	-65.3	-70.9	0	0	0	114.9	F215 C297 F299 P300	F215-Y219 HydrophobicContact CD1-CD2 4.49Å; F215-Y219 AromaticContact CD2-CD2 3.52Å; F215-Y219 HydrophobicContact CD2-CD2 3.52Å; F215-Y219 AromaticContact CD2-CE2 3.56Å; F215-Y219 HydrophobicContact CD2-CE2 3.56Å; F215-Y219 HydrophobicContact CE1-CD2 4.42Å; F215-Y219 AromaticContact CE2-CD2 3.45Å; F215-Y219 HydrophobicContact CE2-CD2 3.45Å; F215-Y219 VanDerWaalsContact CE2-CD2 3.45Å; F215-Y219 AromaticContact CE2-CE2 3.51Å; F215-Y219 HydrophobicContact CE2-CE2 3.51Å; F215-Y219 HydrophobicContact CE2-CG 4.49Å; F215-Y219 HydrophobicContact CG-CD2 4.07Å; F215-Y219 HydrophobicContact CG-CE2 4.48Å; F215-Y219 AromaticContact CZ-CD2 3.94Å; F215-Y219 HydrophobicContact CZ-CD2 3.94Å; F215-Y219 HydrophobicContact CZ-CE2 4.39Å; F215-Y219 VanDerWaalsContact O-CD2 3.29Å; F215-Y219 WeakPolarHBondContact O-CD2 3.27Å; F215-Y219 PolarHBondContact O-N 3.24Å; Y219-C297 CarbonylContact O-C 3.59Å; Y219-C297 WeakPolarHBondContact O-CA 3.35Å; Y219-F299 AromaticContact CD1-CD2 3.71Å; Y219-F299 HydrophobicContact CD1-CD2 3.71Å; Y219-F299 HydrophobicContact CD1-CE2 4.04Å; Y219-F299 AromaticContact CD2-CD2 3.78Å; Y219-F299 HydrophobicContact CD2-CD2 3.78Å; Y219-F299 AromaticContact CD2-CE2 3.95Å; Y219-F299 HydrophobicContact CD2-CE2 3.95Å; Y219-F299 HydrophobicContact CE1-CD2 4.07Å; Y219-F299 AromaticContact CE1-CE2 3.91Å; Y219-F299 HydrophobicContact CE1-CE2 3.91Å; Y219-F299 HydrophobicContact CE2-CD2 4.16Å; Y219-F299 AromaticContact CE2-CE2 3.83Å; Y219-F299 HydrophobicContact CE2-CE2 3.83Å; Y219-F299 AromaticContact CG-CD2 3.56Å; Y219-F299 HydrophobicContact CG-CD2 3.56Å; Y219-F299 HydrophobicContact CG-CE2 4.06Å; Y219-F299 AromaticContact CZ-CE2 3.8Å; Y219-P300 HydrophobicContact CD1-CG 4.41Å; Y219-P300 HydrophobicContact CE1-CG 4.5Å
220	Y	86.6	Confident	89.6	Confident	16 Å²	16	54.5 Å²	54.5	6%	0.063	32%	0.32	C	S	.	.	S	Bend	trans	-105.5	5.8	-175.8	-74.9	-90	0	0	0	113.4	F215 M216 N229 F276 F279 S280 C297 F299	F215-Y220 HydrophobicContact CE1-CE2 4.21Å; M216-Y220 WeakPolarHBondContact O-CA 3.33Å; M216-Y220 WeakPolarHBondContact O-CB 3.4Å; M216-Y220 PolarHBondContact O-N 3Å; Y220-N229 WeakPolarHBondContact O-CB 3.42Å; Y220-N229 PolarHBondContact O-ND2 3.01Å; Y220-F276 AromaticContact CE2-CD2 3.97Å; Y220-F276 HydrophobicContact CE2-CD2 3.97Å; Y220-F276 AromaticContact CE2-CE2 3.68Å; Y220-F276 HydrophobicContact CE2-CE2 3.68Å; Y220-F276 AromaticContact CZ-CE2 3.91Å; Y220-F279 HydrophobicContact CD1-CB 3.58Å; Y220-F279 HydrophobicContact CD1-CD2 4.45Å; Y220-F279 HydrophobicContact CD1-CG 4.48Å; Y220-F279 HydrophobicContact CE1-CB 3.99Å; Y220-F279 HydrophobicContact CG-CB 4.09Å; Y220-F279 HydrophobicContact CG-CD2 4.15Å; Y220-S280 PolarHBondContact OH-OG 3.48Å; Y220-C297 WeakPolarHBondContact CD1-O 3.47Å; Y220-F299 HydrophobicContact CE2-CB 4.09Å
221	T	89.2	Confident	89.4	Confident	39 Å²	39	54.9 Å²	54.9	24%	0.239	32%	0.318	C	S	.	.			trans	-124.2	147.6	172.5	84.9	0	0	0	0	111.5	G217 K230 L233	G217-T221 PolarHBondContact O-OG1 3.33Å; T221-K230 HydrophobicContact CG2-CG 3.95Å; T221-L233 HydrophobicContact CG2-CD2 4.1Å
222	H	86.4	Confident	89.4	Confident	53 Å²	53	53.9 Å²	53.9	25%	0.245	30%	0.303	C	S	.	.			trans	-136.6	138.2	179.9	-176.4	-94.1	0	0	0	109.9	V224 A225 K230 V296 C297	H222-V224 VanDerWaalsContact C-N 3.29Å; H222-V224 PolarHBondContact ND1-N 3.47Å; H222-V224 PolarHBondContact O-N 3.3Å; H222-V224 VanDerWaalsContact O-N 3.11Å; H222-A225 HydrophobicContact CB-CB 4.31Å; H222-A225 PolarHBondContact O-N 3.02Å; H222-K230 WeakPolarHBondContact O-CE 3.41Å; H222-K230 PolarHBondContact O-NZ 3.42Å; H222-V296 HydrophobicContact CB-CB 4.46Å; H222-C297 VanDerWaalsContact CB-SG 3.57Å
223	P	82.9	Confident	89.6	Confident	108 Å²	108	53.2 Å²	53.2	70%	0.701	30%	0.295	S	S	*	.	S	Bend	trans	-51.9	-40.2	-173.9	17.5	-32.7	0	0	0	114.8	K230	P223-K230 VanDerWaalsContact C-NZ 3.31Å; P223-K230 PolarHBondContact O-NZ 2.98Å
224	V	82.9	Confident	89.6	Confident	124 Å²	124	52.7 Å²	52.7	75%	0.752	30%	0.3	S	S	*	.	S	Bend	trans	-98.5	-22.1	-176.1	-175.3	0	0	0	0	113.6	H222	H222-V224 VanDerWaalsContact C-N 3.29Å; H222-V224 PolarHBondContact ND1-N 3.47Å; H222-V224 PolarHBondContact O-N 3.3Å; H222-V224 VanDerWaalsContact O-N 3.11Å
225	A	83.1	Confident	89.6	Confident	13 Å²	13	52 Å²	52	11%	0.107	29%	0.292	C	S	.	.	S	Bend	trans	-121.5	178.8	-173.2	0	0	0	0	0	112.4	H222 S227 K230 V287 V296	H222-A225 HydrophobicContact CB-CB 4.31Å; H222-A225 PolarHBondContact O-N 3.02Å; A225-S227 VanDerWaalsContact C-N 3.27Å; A225-S227 PolarHBondContact O-N 3.44Å; A225-K230 WeakPolarHBondContact O-CE 3.46Å; A225-K230 PolarHBondContact O-NZ 3.11Å; A225-V287 HydrophobicContact CB-CG2 3.49Å; A225-V287 VanDerWaalsContact CB-CG2 3.49Å; A225-V296 HydrophobicContact CB-CG2 3.95Å
226	C	84.4	Confident	89.7	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.014	28%	0.278	C	S	.	.			trans	53.9	41.4	173.7	-47.5	0	0	0	0	114.2	L228 N229 K230 E285 C297	C226-L228 PolarHBondContact O-N 3.27Å; C226-N229 HydrophobicContact CB-CB 4.27Å; C226-N229 PolarHBondContact O-N 3.02Å; C226-N229 VanDerWaalsContact O-N 3.1Å; C226-K230 PolarHBondContact O-N 3.29Å; C226-E285 WeakPolarHBondContact CA-OE2 3.4Å; C226-E285 PolarHBondContact N-OE2 2.99Å; C226-E285 PolarHBondContact SG-OE2 3.35Å; C226-E285 VanDerWaalsContact SG-OE2 3.38Å; C226-C297 HydrophobicContact CB-CB 3.77Å; C226-C297 WeakPolarHBondContact CB-SG 3.26Å; C226-C297 WeakPolarHBondContact SG-CB 3.47Å; C226-C297 CovalentContact SG-SG 1.98Å; C226-C297 PolarHBondContact SG-SG 2.95Å
227	S	87.8	Confident	89.8	Confident	78 Å²	78	49.4 Å²	49.4	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-51.5	-41.1	175.2	53.8	0	0	0	0	111.6	A225 N229 K230 I231	A225-S227 VanDerWaalsContact C-N 3.27Å; A225-S227 PolarHBondContact O-N 3.44Å; S227-N229 PolarHBondContact O-N 2.88Å; S227-K230 WeakPolarHBondContact O-CB 3.28Å; S227-K230 PolarHBondContact O-N 3.03Å; S227-I231 VanDerWaalsContact O-CG1 3.31Å; S227-I231 WeakPolarHBondContact O-CG1 3.29Å; S227-I231 PolarHBondContact O-N 3.19Å
228	L	88.4	Confident	89.9	Confident	39 Å²	39	51.4 Å²	51.4	20%	0.204	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-41.9	179.9	-170.9	139.9	0	0	0	112.4	C226 K230 I231 F232 W426 Y429 W430	C226-L228 PolarHBondContact O-N 3.27Å; L228-K230 PolarHBondContact O-N 3.49Å; L228-I231 PolarHBondContact O-N 3.49Å; L228-F232 HydrophobicContact CD1-CE2 3.94Å; L228-F232 HydrophobicContact CD2-CD2 3.56Å; L228-F232 HydrophobicContact CD2-CE2 3.53Å; L228-F232 HydrophobicContact CG-CD2 3.68Å; L228-F232 HydrophobicContact CG-CE2 3.41Å; L228-F232 VanDerWaalsContact CG-CE2 3.41Å; L228-F232 WeakPolarHBondContact O-CD2 3.45Å; L228-F232 PolarHBondContact O-N 3.34Å; L228-W426 HydrophobicContact CD1-CH2 4.35Å; L228-W426 HydrophobicContact CD1-CZ3 4.19Å; L228-W426 HydrophobicContact CD2-CZ3 4.31Å; L228-Y429 HydrophobicContact CD2-CE1 3.67Å; L228-Y429 HydrophobicContact CD2-CE2 4.13Å; L228-Y429 WeakPolarHBondContact CD2-OH 3.41Å; L228-W430 HydrophobicContact CD1-CZ2 4.48Å
229	N	90.8	Very high	90.1	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-40.5	176.5	-66.3	8.6	0	0	0	111.1	Y220 C226 S227 L233 F279 K282	Y220-N229 WeakPolarHBondContact O-CB 3.42Å; Y220-N229 PolarHBondContact O-ND2 3.01Å; C226-N229 HydrophobicContact CB-CB 4.27Å; C226-N229 PolarHBondContact O-N 3.02Å; C226-N229 VanDerWaalsContact O-N 3.1Å; S227-N229 PolarHBondContact O-N 2.88Å; N229-L233 WeakPolarHBondContact O-CB 3.42Å; N229-L233 PolarHBondContact O-N 3.33Å; N229-F279 HydrophobicContact CB-CD1 4.47Å; N229-F279 HydrophobicContact CB-CD2 4.46Å; N229-F279 HydrophobicContact CB-CE1 4.19Å; N229-F279 HydrophobicContact CB-CE2 4.17Å; N229-F279 HydrophobicContact CB-CZ 4.02Å; N229-F279 VanDerWaalsContact O-CZ 3.23Å; N229-F279 WeakPolarHBondContact O-CZ 3.19Å; N229-K282 PolarHBondContact OD1-NZ 2.74Å
230	K	91	Very high	90.5	Very high	74 Å²	74	44.1 Å²	44.1	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-48.9	176.4	-63.3	173.8	-169.5	168.1	0	111.9	T221 H222 P223 A225 C226 S227 L228 L233 G234	T221-K230 HydrophobicContact CG2-CG 3.95Å; H222-K230 WeakPolarHBondContact O-CE 3.41Å; H222-K230 PolarHBondContact O-NZ 3.42Å; P223-K230 VanDerWaalsContact C-NZ 3.31Å; P223-K230 PolarHBondContact O-NZ 2.98Å; A225-K230 WeakPolarHBondContact O-CE 3.46Å; A225-K230 PolarHBondContact O-NZ 3.11Å; C226-K230 PolarHBondContact O-N 3.29Å; S227-K230 WeakPolarHBondContact O-CB 3.28Å; S227-K230 PolarHBondContact O-N 3.03Å; L228-K230 PolarHBondContact O-N 3.49Å; K230-L233 PolarHBondContact O-N 2.88Å; K230-G234 PolarHBondContact O-N 2.91Å
231	I	93.2	Very high	90.8	Very high	98 Å²	98	48.8 Å²	48.8	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-49.2	-178.1	-68.7	165.8	0	0	0	109.6	S227 L228 G234 I235	S227-I231 VanDerWaalsContact O-CG1 3.31Å; S227-I231 WeakPolarHBondContact O-CG1 3.29Å; S227-I231 PolarHBondContact O-N 3.19Å; L228-I231 PolarHBondContact O-N 3.49Å; I231-G234 PolarHBondContact O-N 3.26Å; I231-I235 HydrophobicContact CG2-CD1 3.63Å; I231-I235 HydrophobicContact CG2-CG1 4.37Å; I231-I235 VanDerWaalsContact O-CG1 3.31Å; I231-I235 WeakPolarHBondContact O-CG1 3.46Å; I231-I235 PolarHBondContact O-N 2.96Å
232	F	93.6	Very high	91	Very high	18 Å²	18	51 Å²	51	8%	0.079	30%	0.299	C	S	.	.	H	α-helix	trans	-71	-34.9	-178	-71.3	-51.6	0	0	0	113.9	L228 G234 I235 N236 F279 Y429 W430 V433 W437	L228-F232 HydrophobicContact CD1-CE2 3.94Å; L228-F232 HydrophobicContact CD2-CD2 3.56Å; L228-F232 HydrophobicContact CD2-CE2 3.53Å; L228-F232 HydrophobicContact CG-CD2 3.68Å; L228-F232 HydrophobicContact CG-CE2 3.41Å; L228-F232 VanDerWaalsContact CG-CE2 3.41Å; L228-F232 WeakPolarHBondContact O-CD2 3.45Å; L228-F232 PolarHBondContact O-N 3.34Å; F232-G234 VanDerWaalsContact C-N 3.31Å; F232-I235 HydrophobicContact CD1-CD1 4.38Å; F232-I235 PolarHBondContact O-N 3.1Å; F232-N236 WeakPolarHBondContact O-CB 3.36Å; F232-N236 PolarHBondContact O-N 3.33Å; F232-F279 HydrophobicContact CB-CE1 4.21Å; F232-F279 HydrophobicContact CB-CZ 4.39Å; F232-Y429 HydrophobicContact CD2-CE1 4.4Å; F232-Y429 WeakPolarHBondContact CD2-OH 3.27Å; F232-Y429 HydrophobicContact CE2-CE1 4.12Å; F232-Y429 WeakPolarHBondContact CE2-OH 3.37Å; F232-W430 HydrophobicContact CE1-CZ3 4.49Å; F232-W430 AromaticContact CE2-CH2 3.99Å; F232-W430 HydrophobicContact CE2-CH2 3.99Å; F232-W430 HydrophobicContact CE2-CZ3 4.21Å; F232-W430 AromaticContact CZ-CH2 3.56Å; F232-W430 HydrophobicContact CZ-CH2 3.56Å; F232-W430 AromaticContact CZ-CZ3 3.64Å; F232-W430 HydrophobicContact CZ-CZ3 3.64Å; F232-V433 HydrophobicContact CD1-CG1 4.31Å; F232-V433 HydrophobicContact CE1-CG1 4.23Å; F232-V433 HydrophobicContact CZ-CG1 4.49Å; F232-W437 HydrophobicContact CD1-CH2 4.47Å; F232-W437 AromaticContact CD1-CZ2 3.82Å; F232-W437 HydrophobicContact CD1-CZ2 3.82Å; F232-W437 AromaticContact CE1-CH2 3.71Å; F232-W437 HydrophobicContact CE1-CH2 3.71Å; F232-W437 AromaticContact CE1-CZ2 3.5Å; F232-W437 HydrophobicContact CE1-CZ2 3.5Å; F232-W437 VanDerWaalsContact CE1-CZ2 3.5Å; F232-W437 HydrophobicContact CZ-CH2 4.46Å
233	L	95.1	Very high	91.3	Very high	14 Å²	14	48.6 Å²	48.6	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-43.6	172.2	-176	60.7	0	0	0	110.7	V213 M216 T221 N229 K230 G237 T275 F279	V213-L233 HydrophobicContact CG1-CD1 4.32Å; M216-L233 HydrophobicContact CB-CD1 3.91Å; M216-L233 HydrophobicContact CB-CD2 4.04Å; M216-L233 HydrophobicContact CE-CD1 3.83Å; M216-L233 HydrophobicContact SD-CD1 4.23Å; T221-L233 HydrophobicContact CG2-CD2 4.1Å; N229-L233 WeakPolarHBondContact O-CB 3.42Å; N229-L233 PolarHBondContact O-N 3.33Å; K230-L233 PolarHBondContact O-N 2.88Å; L233-G237 PolarHBondContact O-N 2.95Å; L233-T275 HydrophobicContact CD1-CG2 4.49Å; L233-F279 HydrophobicContact CB-CE2 4.11Å; L233-F279 HydrophobicContact CB-CZ 4.01Å; L233-F279 HydrophobicContact CD1-CE2 4.43Å
234	G	94.5	Very high	91.8	Very high	38 Å²	38	43.9 Å²	43.9	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-53.5	174.6	0	0	0	0	0	112.3	K230 I231 F232 N236 G237 S238	K230-G234 PolarHBondContact O-N 2.91Å; I231-G234 PolarHBondContact O-N 3.26Å; F232-G234 VanDerWaalsContact C-N 3.31Å; G234-N236 PolarHBondContact O-N 3.4Å; G234-G237 PolarHBondContact O-N 3.46Å; G234-S238 WeakPolarHBondContact O-CB 3.45Å; G234-S238 PolarHBondContact O-N 3.43Å; G234-S238 PolarHBondContact O-OG 2.69Å
235	I	95.5	Very high	92.3	Very high	68 Å²	68	44 Å²	44	35%	0.349	25%	0.254	S	S	.	.	H	α-helix	trans	-58.5	-51.9	-179.5	-69.1	169.2	0	0	0	111.2	I231 F232 G237 S238 L239	I231-I235 HydrophobicContact CG2-CD1 3.63Å; I231-I235 HydrophobicContact CG2-CG1 4.37Å; I231-I235 VanDerWaalsContact O-CG1 3.31Å; I231-I235 WeakPolarHBondContact O-CG1 3.46Å; I231-I235 PolarHBondContact O-N 2.96Å; F232-I235 HydrophobicContact CD1-CD1 4.38Å; F232-I235 PolarHBondContact O-N 3.1Å; I235-G237 PolarHBondContact O-N 3.33Å; I235-S238 PolarHBondContact O-N 3.44Å; I235-L239 HydrophobicContact CG2-CD1 3.78Å; I235-L239 HydrophobicContact CG2-CG 4.35Å; I235-L239 WeakPolarHBondContact O-CB 3.05Å; I235-L239 VanDerWaalsContact O-CG 3.31Å; I235-L239 WeakPolarHBondContact O-CG 3.32Å; I235-L239 PolarHBondContact O-N 2.77Å
236	N	95	Very high	92.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-66.7	-40.3	-176.7	-69.7	-11.4	0	0	0	111.4	F232 G234 L239 C240 V271 M272 T275 W437	F232-N236 WeakPolarHBondContact O-CB 3.36Å; F232-N236 PolarHBondContact O-N 3.33Å; G234-N236 PolarHBondContact O-N 3.4Å; N236-L239 PolarHBondContact O-N 3.08Å; N236-C240 PolarHBondContact O-N 2.88Å; N236-C240 PolarHBondContact O-SG 3.44Å; N236-V271 HydrophobicContact CB-CG1 4.1Å; N236-M272 HydrophobicContact CB-CE 4.05Å; N236-T275 PolarHBondContact ND2-OG1 3.1Å; N236-W437 PolarHBondContact OD1-NE1 2.71Å; N236-W437 VanDerWaalsContact OD1-NE1 3.08Å
237	G	94.7	Very high	92.8	Very high	15 Å²	15	46.2 Å²	46.2	16%	0.155	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-47.3	173.8	0	0	0	0	0	112.3	L233 G234 I235 C240 L241	L233-G237 PolarHBondContact O-N 2.95Å; G234-G237 PolarHBondContact O-N 3.46Å; I235-G237 PolarHBondContact O-N 3.33Å; G237-C240 PolarHBondContact O-N 3.01Å; G237-L241 WeakPolarHBondContact O-CG 3.35Å; G237-L241 PolarHBondContact O-N 2.8Å; G237-L241 VanDerWaalsContact O-N 3.14Å
238	S	94.5	Very high	92.9	Very high	64 Å²	64	46.2 Å²	46.2	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-42.4	177	-63.4	0	0	0	0	112.6	G234 I235 C240 L241 I242	G234-S238 WeakPolarHBondContact O-CB 3.45Å; G234-S238 PolarHBondContact O-N 3.43Å; G234-S238 PolarHBondContact O-OG 2.69Å; I235-S238 PolarHBondContact O-N 3.44Å; S238-C240 PolarHBondContact O-N 3.5Å; S238-L241 WeakPolarHBondContact O-CB 3.48Å; S238-L241 PolarHBondContact O-N 3.23Å; S238-I242 WeakPolarHBondContact O-CG1 3.29Å; S238-I242 PolarHBondContact O-N 2.79Å
239	L	94.8	Very high	93	Very high	52 Å²	52	46.1 Å²	46.1	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-41.1	177.2	-72.5	171.9	0	0	0	112	I235 N236 L241 I242 V243 L440	I235-L239 HydrophobicContact CG2-CD1 3.78Å; I235-L239 HydrophobicContact CG2-CG 4.35Å; I235-L239 WeakPolarHBondContact O-CB 3.05Å; I235-L239 VanDerWaalsContact O-CG 3.31Å; I235-L239 WeakPolarHBondContact O-CG 3.32Å; I235-L239 PolarHBondContact O-N 2.77Å; N236-L239 PolarHBondContact O-N 3.08Å; L239-L241 VanDerWaalsContact C-N 3.31Å; L239-L241 PolarHBondContact O-N 3.36Å; L239-I242 PolarHBondContact O-N 3.42Å; L239-V243 WeakPolarHBondContact O-CB 3.5Å; L239-V243 VanDerWaalsContact O-CG2 3.28Å; L239-V243 WeakPolarHBondContact O-CG2 3.29Å; L239-V243 PolarHBondContact O-N 2.63Å; L239-L440 HydrophobicContact CB-CD1 3.74Å; L239-L440 HydrophobicContact CD1-CD1 3.87Å; L239-L440 HydrophobicContact CG-CD1 4.45Å
240	C	95.3	Very high	92.7	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.061	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-40.1	174.2	-70.9	0	0	0	0	112.3	N236 G237 S238 S244	N236-C240 PolarHBondContact O-N 2.88Å; N236-C240 PolarHBondContact O-SG 3.44Å; G237-C240 PolarHBondContact O-N 3.01Å; S238-C240 PolarHBondContact O-N 3.5Å; C240-S244 WeakPolarHBondContact O-CB 3.5Å; C240-S244 PolarHBondContact O-N 2.81Å; C240-S244 PolarHBondContact O-OG 2.72Å
241	L	93.8	Very high	92.5	Very high	114 Å²	114	54 Å²	54	60%	0.597	30%	0.299	S	S	*	.	H	α-helix	trans	-64.6	-47.7	174.3	-68.6	178.1	0	0	0	111.8	G237 S238 L239 V243 S244 L245	G237-L241 WeakPolarHBondContact O-CG 3.35Å; G237-L241 PolarHBondContact O-N 2.8Å; G237-L241 VanDerWaalsContact O-N 3.14Å; S238-L241 WeakPolarHBondContact O-CB 3.48Å; S238-L241 PolarHBondContact O-N 3.23Å; L239-L241 VanDerWaalsContact C-N 3.31Å; L239-L241 PolarHBondContact O-N 3.36Å; L241-V243 VanDerWaalsContact C-N 3.33Å; L241-V243 PolarHBondContact O-N 3.07Å; L241-S244 PolarHBondContact O-N 3.33Å; L241-L245 WeakPolarHBondContact O-CG 3.46Å; L241-L245 PolarHBondContact O-N 3Å
242	I	93.9	Very high	92.1	Very high	86 Å²	86	49.5 Å²	49.5	44%	0.441	28%	0.277	S	S	.	.	H	α-helix	trans	-57.3	-48.1	178.2	-70.4	165.3	0	0	0	110.5	S238 L239 S244 L245 L246	S238-I242 WeakPolarHBondContact O-CG1 3.29Å; S238-I242 PolarHBondContact O-N 2.79Å; L239-I242 PolarHBondContact O-N 3.42Å; I242-S244 VanDerWaalsContact C-N 3.3Å; I242-S244 PolarHBondContact O-N 3.08Å; I242-L245 PolarHBondContact O-N 2.9Å; I242-L246 HydrophobicContact CG2-CD1 3.97Å; I242-L246 HydrophobicContact CG2-CG 4.31Å; I242-L246 WeakPolarHBondContact O-CG 3.21Å; I242-L246 PolarHBondContact O-N 3.4Å
243	V	92.6	Very high	91.6	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-39.6	179.7	168.5	0	0	0	0	111.8	L239 L241 L246 A247 P264 L440 Y443 I444	L239-V243 WeakPolarHBondContact O-CB 3.5Å; L239-V243 VanDerWaalsContact O-CG2 3.28Å; L239-V243 WeakPolarHBondContact O-CG2 3.29Å; L239-V243 PolarHBondContact O-N 2.63Å; L241-V243 VanDerWaalsContact C-N 3.33Å; L241-V243 PolarHBondContact O-N 3.07Å; V243-L246 PolarHBondContact O-N 3.35Å; V243-A247 PolarHBondContact O-N 3.14Å; V243-P264 HydrophobicContact CG1-CB 4.19Å; V243-L440 HydrophobicContact CG2-CD2 3.96Å; V243-Y443 HydrophobicContact CG1-CD1 3.18Å; V243-Y443 HydrophobicContact CG1-CE1 3.15Å; V243-Y443 HydrophobicContact CG1-CG 4.29Å; V243-I444 HydrophobicContact CG2-CD1 3.83Å; V243-I444 HydrophobicContact CG2-CG1 3.78Å
244	S	93.2	Very high	91	Very high	10 Å²	10	60.1 Å²	60.1	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-66.3	-40	176.2	-57	0	0	0	0	112.3	F206 C240 L241 I242 A247 I248	F206-S244 WeakPolarHBondContact CE1-OG 3.29Å; F206-S244 WeakPolarHBondContact CZ-OG 2.85Å; C240-S244 WeakPolarHBondContact O-CB 3.5Å; C240-S244 PolarHBondContact O-N 2.81Å; C240-S244 PolarHBondContact O-OG 2.72Å; L241-S244 PolarHBondContact O-N 3.33Å; I242-S244 VanDerWaalsContact C-N 3.3Å; I242-S244 PolarHBondContact O-N 3.08Å; S244-A247 PolarHBondContact O-N 2.87Å; S244-I248 PolarHBondContact O-N 3.35Å
245	L	92.2	Very high	90.2	Very high	126 Å²	126	61.9 Å²	61.9	66%	0.66	32%	0.324	S	S	*	.	H	α-helix	trans	-66.7	-41.1	174.8	-68.8	174.2	0	0	0	112	L241 I242 A247 I248 S249	L241-L245 WeakPolarHBondContact O-CG 3.46Å; L241-L245 PolarHBondContact O-N 3Å; I242-L245 PolarHBondContact O-N 2.9Å; L245-A247 VanDerWaalsContact C-N 3.29Å; L245-A247 PolarHBondContact O-N 3.27Å; L245-I248 PolarHBondContact O-N 3.29Å; L245-S249 PolarHBondContact O-N 3.47Å
246	L	90.4	Very high	89.2	Confident	61 Å²	61	60.8 Å²	60.8	32%	0.319	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-39.2	175.4	-72.9	174.7	0	0	0	111.6	I242 V243 I248 S249 I252 L447	I242-L246 HydrophobicContact CG2-CD1 3.97Å; I242-L246 HydrophobicContact CG2-CG 4.31Å; I242-L246 WeakPolarHBondContact O-CG 3.21Å; I242-L246 PolarHBondContact O-N 3.4Å; V243-L246 PolarHBondContact O-N 3.35Å; L246-I248 VanDerWaalsContact C-N 3.31Å; L246-I248 PolarHBondContact O-N 3.5Å; L246-S249 VanDerWaalsContact O-CB 3.31Å; L246-S249 WeakPolarHBondContact O-CB 3.27Å; L246-S249 PolarHBondContact O-N 2.81Å; L246-I252 WeakPolarHBondContact O-CG1 3.2Å; L246-L447 HydrophobicContact CB-CD2 4.22Å
247	A	88.9	Confident	88.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-65.5	-30.3	179.6	0	0	0	0	0	114.2	V243 S244 L245 S259 P264 L447	V243-A247 PolarHBondContact O-N 3.14Å; S244-A247 PolarHBondContact O-N 2.87Å; L245-A247 VanDerWaalsContact C-N 3.29Å; L245-A247 PolarHBondContact O-N 3.27Å; A247-S259 PolarHBondContact O-OG 2.78Å; A247-P264 HydrophobicContact CB-CB 4.35Å; A247-P264 HydrophobicContact CB-CG 3.8Å; A247-L447 HydrophobicContact CB-CD1 4.13Å
248	I	89.8	Confident	87	Confident	79 Å²	79	71.4 Å²	71.4	41%	0.405	37%	0.367	S	S	.	.	H	α-helix	trans	-91	-13.3	176.8	-59.1	160.4	0	0	0	112	S244 L245 L246 Q253 L261	S244-I248 PolarHBondContact O-N 3.35Å; L245-I248 PolarHBondContact O-N 3.29Å; L246-I248 VanDerWaalsContact C-N 3.31Å; L246-I248 PolarHBondContact O-N 3.5Å; I248-Q253 PolarHBondContact O-NE2 3.32Å; I248-L261 HydrophobicContact CD1-CD1 3.42Å; I248-L261 VanDerWaalsContact CD1-CD1 3.42Å; I248-L261 HydrophobicContact CD1-CD2 4.12Å; I248-L261 HydrophobicContact CD1-CG 4.26Å; I248-L261 HydrophobicContact CG1-CD1 3.85Å
249	S	89.9	Confident	86.1	Confident	37 Å²	37	68.8 Å²	68.8	26%	0.259	35%	0.349	S	S	.	.			trans	-52.7	129.7	-177	179	0	0	0	0	111.3	L245 L246 Y251 I252 Q253	L245-S249 PolarHBondContact O-N 3.47Å; L246-S249 VanDerWaalsContact O-CB 3.31Å; L246-S249 WeakPolarHBondContact O-CB 3.27Å; L246-S249 PolarHBondContact O-N 2.81Å; S249-Y251 PolarHBondContact O-N 2.99Å; S249-I252 PolarHBondContact O-N 3.5Å; S249-Q253 PolarHBondContact O-N 3.19Å
250	P	85.8	Confident	85.6	Confident	95 Å²	95	67.1 Å²	67.1	62%	0.617	34%	0.344	S	S	*	.	H	α-helix	trans	-60.9	-23.6	-176.8	24.7	-34.7	0	0	0	112.2	K254	P250-K254 VanDerWaalsContact O-CG 3.28Å; P250-K254 WeakPolarHBondContact O-CG 3.11Å; P250-K254 PolarHBondContact O-N 3.19Å
251	Y	85.3	Confident	85.3	Confident	146 Å²	146	69.6 Å²	69.6	57%	0.573	36%	0.357	S	S	*	.	H	α-helix	trans	-68.1	-44.9	174.9	-175.8	-115.7	0	0	0	112.1	S249 K254 L255 M451	S249-Y251 PolarHBondContact O-N 2.99Å; Y251-K254 PolarHBondContact O-N 3.49Å; Y251-L255 HydrophobicContact CD1-CD1 4.38Å; Y251-L255 HydrophobicContact CE1-CD1 4.14Å; Y251-L255 WeakPolarHBondContact O-CD1 3.37Å; Y251-M451 HydrophobicContact CD1-SD 4.09Å; Y251-M451 HydrophobicContact CE1-CE 4.22Å; Y251-M451 HydrophobicContact CE1-SD 3.2Å; Y251-M451 WeakPolarHBondContact CE1-SD 3.47Å
252	I	84.9	Confident	85	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.026	33%	0.328	C	S	.	.	H	α-helix	trans	-71.2	-39.8	178.2	-64.1	-63.4	0	0	0	110.9	L246 S249 K254 L255 Q256 L447 L448 M451	L246-I252 WeakPolarHBondContact O-CG1 3.2Å; S249-I252 PolarHBondContact O-N 3.5Å; I252-K254 VanDerWaalsContact C-N 3.26Å; I252-K254 PolarHBondContact O-N 3.14Å; I252-L255 PolarHBondContact O-N 3.01Å; I252-Q256 PolarHBondContact O-N 2.81Å; I252-L447 HydrophobicContact CB-CD2 4.38Å; I252-L447 HydrophobicContact CD1-CD2 3.72Å; I252-L447 HydrophobicContact CG1-CD2 3.76Å; I252-L447 HydrophobicContact CG2-CD1 4.09Å; I252-L447 HydrophobicContact CG2-CD2 3.78Å; I252-L447 HydrophobicContact CG2-CG 3.77Å; I252-L448 HydrophobicContact CD1-CD2 3.9Å; I252-M451 HydrophobicContact CD1-CE 3.55Å; I252-M451 HydrophobicContact CD1-SD 4.49Å
253	Q	83.7	Confident	84.9	Confident	79 Å²	79	60.1 Å²	60.1	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-30.6	177.7	-69.8	-174.5	-7.9	0	0	113	I248 S249 L255 Q256 P257	I248-Q253 PolarHBondContact O-NE2 3.32Å; S249-Q253 PolarHBondContact O-N 3.19Å; Q253-L255 VanDerWaalsContact C-N 3.31Å; Q253-L255 PolarHBondContact O-N 2.87Å; Q253-Q256 CarbonylContact O-C 3.29Å; Q253-Q256 VanDerWaalsContact O-C 3.29Å; Q253-P257 VanDerWaalsContact O-CA 3.28Å; Q253-P257 WeakPolarHBondContact O-CA 3.35Å
254	K	82.8	Confident	84.9	Confident	175 Å²	175	60 Å²	60	76%	0.761	31%	0.307	S	S	*	.	H	α-helix	trans	-64.2	-35.8	171.6	-78.7	174.9	-178.4	-174.3	0	112.8	P250 Y251 I252	P250-K254 VanDerWaalsContact O-CG 3.28Å; P250-K254 WeakPolarHBondContact O-CG 3.11Å; P250-K254 PolarHBondContact O-N 3.19Å; Y251-K254 PolarHBondContact O-N 3.49Å; I252-K254 VanDerWaalsContact C-N 3.26Å; I252-K254 PolarHBondContact O-N 3.14Å
255	L	76.8	Confident	84.9	Confident	76 Å²	76	59.5 Å²	59.5	40%	0.398	30%	0.303	S	S	.	.	H	α-helix	trans	-84.2	-32.4	-178.7	-66.7	159.2	0	0	0	112.1	Y251 I252 Q253 M451	Y251-L255 HydrophobicContact CD1-CD1 4.38Å; Y251-L255 HydrophobicContact CE1-CD1 4.14Å; Y251-L255 WeakPolarHBondContact O-CD1 3.37Å; I252-L255 PolarHBondContact O-N 3.01Å; Q253-L255 VanDerWaalsContact C-N 3.31Å; Q253-L255 PolarHBondContact O-N 2.87Å; L255-M451 HydrophobicContact CD1-CE 4.36Å; L255-M451 HydrophobicContact CD1-CG 3.26Å; L255-M451 HydrophobicContact CD1-SD 3.41Å; L255-M451 WeakPolarHBondContact CD1-SD 3.27Å; L255-M451 HydrophobicContact CD2-CG 4.35Å; L255-M451 HydrophobicContact CG-CG 4.38Å
256	Q	75	Confident	84.7	Confident	45 Å²	45	54.4 Å²	54.4	21%	0.21	28%	0.277	C	S	.	.			trans	-135.3	88.3	179	-167.9	173.5	-83.4	0	0	109.5	I252 Q253 R258 S259	I252-Q256 PolarHBondContact O-N 2.81Å; Q253-Q256 CarbonylContact O-C 3.29Å; Q253-Q256 VanDerWaalsContact O-C 3.29Å; Q256-R258 PolarHBondContact O-N 2.87Å; Q256-R258 VanDerWaalsContact O-N 3.12Å; Q256-S259 WeakPolarHBondContact O-CB 3.46Å; Q256-S259 PolarHBondContact O-N 2.79Å
257	P	71.6	Confident	84.7	Confident	115 Å²	115	51.5 Å²	51.5	75%	0.747	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.2	-174.6	22.3	-31.7	0	0	0	113.7	Q253 S259	Q253-P257 VanDerWaalsContact O-CA 3.28Å; Q253-P257 WeakPolarHBondContact O-CA 3.35Å; P257-S259 VanDerWaalsContact C-N 3.34Å
258	R	71.9	Confident	84.9	Confident	123 Å²	123	51.7 Å²	51.7	46%	0.464	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	9.9	171.7	-60.5	-169.9	179.6	166.1	-3.9	113.5	N181 Q256	N181-R258 PolarHBondContact ND2-O 3.38Å; Q256-R258 PolarHBondContact O-N 2.87Å; Q256-R258 VanDerWaalsContact O-N 3.12Å
259	S	76.6	Confident	84.9	Confident	10 Å²	10	49.7 Å²	49.7	7%	0.07	26%	0.255	C	S	.	.			trans	-67.5	131.9	170.3	-168.5	0	0	0	0	109.4	A247 Q256 P257	A247-S259 PolarHBondContact O-OG 2.78Å; Q256-S259 WeakPolarHBondContact O-CB 3.46Å; Q256-S259 PolarHBondContact O-N 2.79Å; P257-S259 VanDerWaalsContact C-N 3.34Å
260	G	82.6	Confident	84.7	Confident	16 Å²	16	50 Å²	50	17%	0.165	25%	0.25	C	S	.	.			trans	-138.4	-177.1	-175.7	0	0	0	0	0	111.9	Q263 P264	G260-Q263 VanDerWaalsContact CA-OE1 3.32Å; G260-Q263 VanDerWaalsContact N-OE1 3.11Å; G260-Q263 PolarHBondContact O-OE1 3.43Å; G260-P264 VanDerWaalsContact O-CD 3.29Å; G260-P264 WeakPolarHBondContact O-CD 3.46Å
261	L	88.9	Confident	84.9	Confident	62 Å²	62	45.5 Å²	45.5	33%	0.325	22%	0.221	S	C	.	.	S	Bend	trans	-93.4	-11.5	-179.5	-163.7	60.2	0	0	0	112.2	T202 F206 I248 P264 G265	T202-L261 HydrophobicContact CG2-CB 3.82Å; T202-L261 HydrophobicContact CG2-CD2 3.87Å; T202-L261 HydrophobicContact CG2-CG 3.71Å; F206-L261 HydrophobicContact CD2-CG 4.45Å; F206-L261 HydrophobicContact CE2-CD1 3.92Å; F206-L261 HydrophobicContact CE2-CD2 4.17Å; F206-L261 HydrophobicContact CE2-CG 3.61Å; F206-L261 WeakPolarHBondContact CE2-O 3.15Å; F206-L261 HydrophobicContact CZ-CD1 3.88Å; F206-L261 HydrophobicContact CZ-CG 4.11Å; I248-L261 HydrophobicContact CD1-CD1 3.42Å; I248-L261 VanDerWaalsContact CD1-CD1 3.42Å; I248-L261 HydrophobicContact CD1-CD2 4.12Å; I248-L261 HydrophobicContact CD1-CG 4.26Å; I248-L261 HydrophobicContact CG1-CD1 3.85Å; L261-P264 HydrophobicContact CD1-CG 3.93Å; L261-P264 VanDerWaalsContact O-CD 3.3Å; L261-P264 WeakPolarHBondContact O-CD 3.45Å; L261-P264 WeakPolarHBondContact O-CG 3.36Å; L261-G265 PolarHBondContact O-N 3.31Å
262	L	89.3	Confident	85.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-46	176.6	-174	76.8	0	0	0	111.6	W180 N181 L198 V201 L205 G265 V266	W180-L262 HydrophobicContact CB-CD2 4.3Å; W180-L262 HydrophobicContact CD2-CD2 4.02Å; W180-L262 HydrophobicContact CG-CD2 3.75Å; N181-L262 HydrophobicContact CB-CB 4.21Å; N181-L262 HydrophobicContact CB-CD2 4.14Å; N181-L262 WeakPolarHBondContact OD1-CB 3.28Å; L198-L262 HydrophobicContact CD1-CB 3.88Å; L198-L262 HydrophobicContact CD1-CD1 4.36Å; L198-L262 HydrophobicContact CD1-CD2 3.78Å; L198-L262 HydrophobicContact CD1-CG 4.21Å; V201-L262 HydrophobicContact CB-CD1 4.18Å; V201-L262 HydrophobicContact CG1-CD1 3.62Å; L205-L262 HydrophobicContact CD1-CD1 3.85Å; L262-G265 PolarHBondContact O-N 3.43Å; L262-V266 PolarHBondContact O-N 3.27Å
263	Q	90.1	Very high	85.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-54.8	-179.7	-51	92	-33.1	0	0	112.9	A177 H178 N181 G260 G265 V266 I267 Y443	A177-Q263 HydrophobicContact CB-CB 4.25Å; A177-Q263 WeakPolarHBondContact O-CG 3.28Å; H178-Q263 HydrophobicContact CB-CG 4.47Å; N181-Q263 HydrophobicContact CB-CG 3.56Å; N181-Q263 PolarHBondContact ND2-NE2 2.82Å; N181-Q263 PolarHBondContact ND2-OE1 3.43Å; N181-Q263 PolarHBondContact OD1-OE1 3.32Å; G260-Q263 VanDerWaalsContact CA-OE1 3.32Å; G260-Q263 VanDerWaalsContact N-OE1 3.11Å; G260-Q263 PolarHBondContact O-OE1 3.43Å; Q263-G265 PolarHBondContact O-N 2.81Å; Q263-V266 PolarHBondContact O-N 2.04Å; Q263-I267 WeakPolarHBondContact O-CG1 3.44Å; Q263-I267 PolarHBondContact O-N 3.4Å; Q263-I267 VanDerWaalsContact O-N 3.16Å; Q263-Y443 HydrophobicContact CB-CE2 3.79Å
264	P	93.6	Very high	85.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-24.8	-179.9	30.3	-37.8	0	0	0	112.2	F206 V243 A247 G260 L261 S268 Y443	F206-P264 HydrophobicContact CZ-CG 4.45Å; V243-P264 HydrophobicContact CG1-CB 4.19Å; A247-P264 HydrophobicContact CB-CB 4.35Å; A247-P264 HydrophobicContact CB-CG 3.8Å; G260-P264 VanDerWaalsContact O-CD 3.29Å; G260-P264 WeakPolarHBondContact O-CD 3.46Å; L261-P264 HydrophobicContact CD1-CG 3.93Å; L261-P264 VanDerWaalsContact O-CD 3.3Å; L261-P264 WeakPolarHBondContact O-CD 3.45Å; L261-P264 WeakPolarHBondContact O-CG 3.36Å; P264-S268 VanDerWaalsContact O-CB 3.25Å; P264-S268 WeakPolarHBondContact O-CB 3.03Å; P264-S268 PolarHBondContact O-N 2.97Å; P264-S268 PolarHBondContact O-OG 3.37Å; P264-Y443 HydrophobicContact CB-CE1 4.46Å; P264-Y443 WeakPolarHBondContact CD-OH 3.38Å
265	G	93.1	Very high	85.4	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.6	-47.1	171.6	0	0	0	0	0	112.8	L261 L262 Q263 S268 V269	L261-G265 PolarHBondContact O-N 3.31Å; L262-G265 PolarHBondContact O-N 3.43Å; Q263-G265 PolarHBondContact O-N 2.81Å; G265-S268 PolarHBondContact O-N 3.24Å; G265-V269 WeakPolarHBondContact O-CG2 3.44Å; G265-V269 PolarHBondContact O-N 2.97Å
266	V	88.4	Confident	85.8	Confident	18 Å²	18	30.9 Å²	30.9	11%	0.109	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-46.3	175.7	174.3	0	0	0	0	110.9	A177 W180 L205 L262 Q263 S268 V269 Y270	A177-V266 HydrophobicContact CB-CB 4.14Å; A177-V266 HydrophobicContact CB-CG1 4.15Å; W180-V266 HydrophobicContact CE3-CG2 4.32Å; W180-V266 HydrophobicContact CZ3-CG2 4.32Å; L205-V266 HydrophobicContact CD1-CG2 3.65Å; L262-V266 PolarHBondContact O-N 3.27Å; Q263-V266 PolarHBondContact O-N 2.04Å; V266-S268 VanDerWaalsContact C-N 3.33Å; V266-S268 PolarHBondContact O-N 2.94Å; V266-V269 PolarHBondContact O-N 3.37Å; V266-Y270 PolarHBondContact O-N 3.38Å; V266-Y270 VanDerWaalsContact O-N 3.08Å
267	I	90.3	Very high	85.9	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-62.7	-41.4	177.9	-60.3	-56.2	0	0	0	111.1	L173 V174 A177 Q263 V269 Y270 V271 L440 Y443	L173-I267 HydrophobicContact CD2-CD1 4.42Å; V174-I267 HydrophobicContact CG2-CD1 3.89Å; A177-I267 HydrophobicContact CB-CD1 4.37Å; Q263-I267 WeakPolarHBondContact O-CG1 3.44Å; Q263-I267 PolarHBondContact O-N 3.4Å; Q263-I267 VanDerWaalsContact O-N 3.16Å; I267-V269 PolarHBondContact O-N 3.04Å; I267-Y270 PolarHBondContact O-N 2.73Å; I267-V271 HydrophobicContact CG2-CG2 4.17Å; I267-V271 VanDerWaalsContact O-CG2 3.29Å; I267-V271 WeakPolarHBondContact O-CG2 3.42Å; I267-V271 PolarHBondContact O-N 3.34Å; I267-L440 HydrophobicContact CG2-CD2 4.18Å; I267-Y443 HydrophobicContact CD1-CD2 4.39Å; I267-Y443 HydrophobicContact CG1-CD2 3.67Å; I267-Y443 HydrophobicContact CG1-CE2 4.14Å; I267-Y443 HydrophobicContact CG1-CG 4.17Å
268	S	93.6	Very high	86.4	Confident	4 Å²	4	24.3 Å²	24.3	3%	0.028	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-45.5	178.8	-63.6	0	0	0	0	112.1	P264 G265 V266 Y270 V271 M272	P264-S268 VanDerWaalsContact O-CB 3.25Å; P264-S268 WeakPolarHBondContact O-CB 3.03Å; P264-S268 PolarHBondContact O-N 2.97Å; P264-S268 PolarHBondContact O-OG 3.37Å; G265-S268 PolarHBondContact O-N 3.24Å; V266-S268 VanDerWaalsContact C-N 3.33Å; V266-S268 PolarHBondContact O-N 2.94Å; S268-Y270 VanDerWaalsContact C-N 3.32Å; S268-Y270 PolarHBondContact O-N 3.38Å; S268-V271 PolarHBondContact O-N 3.36Å; S268-M272 WeakPolarHBondContact O-CB 3.45Å; S268-M272 VanDerWaalsContact O-CG 3.29Å; S268-M272 WeakPolarHBondContact O-CG 3.46Å; S268-M272 PolarHBondContact O-N 3.34Å
269	V	88.4	Confident	87	Confident	37 Å²	37	18.7 Å²	18.7	22%	0.224	10%	0.096	C	C	.	.	H	α-helix	trans	-60.5	-43.4	175.6	172	0	0	0	0	111	L205 I208 A209 G265 V266 I267 M272 Y273	L205-V269 HydrophobicContact CB-CG2 4.1Å; L205-V269 HydrophobicContact CD2-CG2 3.94Å; L205-V269 WeakPolarHBondContact O-CG2 3.36Å; I208-V269 HydrophobicContact CB-CG2 4.27Å; I208-V269 HydrophobicContact CG2-CG1 4.14Å; I208-V269 HydrophobicContact CG2-CG2 4.17Å; A209-V269 HydrophobicContact CB-CG2 4.18Å; G265-V269 WeakPolarHBondContact O-CG2 3.44Å; G265-V269 PolarHBondContact O-N 2.97Å; V266-V269 PolarHBondContact O-N 3.37Å; I267-V269 PolarHBondContact O-N 3.04Å; V269-M272 PolarHBondContact O-N 3.45Å; V269-Y273 PolarHBondContact O-N 3.05Å
270	Y	85.7	Confident	87.1	Confident	43 Å²	43	21 Å²	21	17%	0.169	11%	0.112	C	C	.	.	H	α-helix	trans	-65.5	-42.9	179.4	-179	-103.5	0	0	0	112.9	L170 L173 V266 I267 S268 M272 Y273 L274 C439	L170-Y270 HydrophobicContact CD2-CE1 3.46Å; L170-Y270 VanDerWaalsContact CD2-CE1 3.46Å; L170-Y270 WeakPolarHBondContact CD2-OH 3.38Å; L173-Y270 HydrophobicContact CD2-CD1 3.31Å; L173-Y270 HydrophobicContact CD2-CD2 3.73Å; L173-Y270 HydrophobicContact CD2-CE1 3.58Å; L173-Y270 HydrophobicContact CD2-CE2 3.99Å; L173-Y270 HydrophobicContact CD2-CG 3.37Å; V266-Y270 PolarHBondContact O-N 3.38Å; V266-Y270 VanDerWaalsContact O-N 3.08Å; I267-Y270 PolarHBondContact O-N 2.73Å; S268-Y270 VanDerWaalsContact C-N 3.32Å; S268-Y270 PolarHBondContact O-N 3.38Å; Y270-M272 VanDerWaalsContact C-N 3.31Å; Y270-M272 PolarHBondContact O-N 2.86Å; Y270-Y273 HydrophobicContact CD2-CD1 4.49Å; Y270-Y273 HydrophobicContact CE2-CD1 4.5Å; Y270-Y273 WeakPolarHBondContact O-CB 3.38Å; Y270-Y273 PolarHBondContact O-N 3.48Å; Y270-L274 HydrophobicContact CD1-CD1 4.03Å; Y270-L274 HydrophobicContact CD1-CG 4.39Å; Y270-L274 HydrophobicContact CE1-CD1 3.32Å; Y270-L274 HydrophobicContact CE1-CG 3.9Å; Y270-L274 HydrophobicContact CE2-CG 4.32Å; Y270-L274 PolarHBondContact O-N 2.97Å; Y270-C439 HydrophobicContact CE1-CB 4.48Å
271	V	90.6	Very high	86.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.6	-39	175.5	173.6	0	0	0	0	110.8	N236 I267 S268 L274 T275 C436 L440	N236-V271 HydrophobicContact CB-CG1 4.1Å; I267-V271 HydrophobicContact CG2-CG2 4.17Å; I267-V271 VanDerWaalsContact O-CG2 3.29Å; I267-V271 WeakPolarHBondContact O-CG2 3.42Å; I267-V271 PolarHBondContact O-N 3.34Å; S268-V271 PolarHBondContact O-N 3.36Å; V271-L274 PolarHBondContact O-N 3.15Å; V271-T275 WeakPolarHBondContact O-CB 3.3Å; V271-T275 PolarHBondContact O-N 3.06Å; V271-T275 PolarHBondContact O-OG1 3.42Å; V271-C436 HydrophobicContact CG1-CB 4.18Å; V271-L440 HydrophobicContact CG1-CD1 4.17Å; V271-L440 HydrophobicContact CG2-CD1 4.22Å; V271-L440 HydrophobicContact CG2-CD2 4.01Å; V271-L440 HydrophobicContact CG2-CG 3.84Å
272	M	90.1	Very high	86.1	Confident	3 Å²	3	19.1 Å²	19.1	2%	0.015	10%	0.099	C	C	.	.	H	α-helix	trans	-65.9	-40.3	174.8	-70.1	-54.6	106.4	0	0	112.2	A209 A212 V213 M216 N236 S268 V269 Y270 T275 F276	A209-M272 HydrophobicContact CB-CG 4.25Å; A212-M272 HydrophobicContact CB-CB 3.88Å; A212-M272 HydrophobicContact CB-CG 4.34Å; V213-M272 HydrophobicContact CG2-CE 4.43Å; V213-M272 HydrophobicContact CG2-CG 4.31Å; V213-M272 HydrophobicContact CG2-SD 3.29Å; V213-M272 WeakPolarHBondContact CG2-SD 3.4Å; M216-M272 HydrophobicContact CE-CB 4.29Å; M216-M272 HydrophobicContact CE-SD 3.8Å; N236-M272 HydrophobicContact CB-CE 4.05Å; S268-M272 WeakPolarHBondContact O-CB 3.45Å; S268-M272 VanDerWaalsContact O-CG 3.29Å; S268-M272 WeakPolarHBondContact O-CG 3.46Å; S268-M272 PolarHBondContact O-N 3.34Å; V269-M272 PolarHBondContact O-N 3.45Å; Y270-M272 VanDerWaalsContact C-N 3.31Å; Y270-M272 PolarHBondContact O-N 2.86Å; M272-T275 PolarHBondContact O-N 3.33Å; M272-F276 WeakPolarHBondContact O-CB 3.45Å; M272-F276 PolarHBondContact O-N 3.14Å
273	Y	84.7	Confident	85.5	Confident	83 Å²	83	20.7 Å²	20.7	33%	0.325	11%	0.11	S	C	.	.	H	α-helix	trans	-60.1	-48.5	173	165.2	-99.1	0	0	0	112.2	V269 Y270 T275 F276 S277	V269-Y273 PolarHBondContact O-N 3.05Å; Y270-Y273 HydrophobicContact CD2-CD1 4.49Å; Y270-Y273 HydrophobicContact CE2-CD1 4.5Å; Y270-Y273 WeakPolarHBondContact O-CB 3.38Å; Y270-Y273 PolarHBondContact O-N 3.48Å; Y273-T275 VanDerWaalsContact C-N 3.3Å; Y273-T275 PolarHBondContact O-N 3.28Å; Y273-F276 PolarHBondContact O-N 3.06Å; Y273-S277 VanDerWaalsContact O-CB 3.29Å; Y273-S277 WeakPolarHBondContact O-CB 3.23Å; Y273-S277 PolarHBondContact O-N 3.49Å
274	L	83	Confident	84.9	Confident	14 Å²	14	25.9 Å²	25.9	7%	0.073	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-35.9	177.9	-76.2	-175.1	0	0	0	112	Y270 V271 S277 A278 C436	Y270-L274 HydrophobicContact CD1-CD1 4.03Å; Y270-L274 HydrophobicContact CD1-CG 4.39Å; Y270-L274 HydrophobicContact CE1-CD1 3.32Å; Y270-L274 HydrophobicContact CE1-CG 3.9Å; Y270-L274 HydrophobicContact CE2-CG 4.32Å; Y270-L274 PolarHBondContact O-N 2.97Å; V271-L274 PolarHBondContact O-N 3.15Å; L274-S277 PolarHBondContact O-N 3.41Å; L274-A278 WeakPolarHBondContact O-CB 3.05Å; L274-A278 PolarHBondContact O-N 3.37Å; L274-C436 WeakPolarHBondContact CB-SG 3.26Å
275	T	89.4	Confident	84.1	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-64	-47.2	175.4	-56.3	0	0	0	0	111.1	M216 L233 N236 V271 M272 Y273 S277 A278 F279	M216-T275 HydrophobicContact CE-CG2 4.28Å; M216-T275 HydrophobicContact SD-CG2 3.87Å; L233-T275 HydrophobicContact CD1-CG2 4.49Å; N236-T275 PolarHBondContact ND2-OG1 3.1Å; V271-T275 WeakPolarHBondContact O-CB 3.3Å; V271-T275 PolarHBondContact O-N 3.06Å; V271-T275 PolarHBondContact O-OG1 3.42Å; M272-T275 PolarHBondContact O-N 3.33Å; Y273-T275 VanDerWaalsContact C-N 3.3Å; Y273-T275 PolarHBondContact O-N 3.28Å; T275-S277 PolarHBondContact O-N 2.91Å; T275-A278 WeakPolarHBondContact O-CB 3.35Å; T275-A278 PolarHBondContact O-N 2.9Å; T275-F279 HydrophobicContact CG2-CD1 4.49Å; T275-F279 HydrophobicContact CG2-CD2 4.46Å; T275-F279 HydrophobicContact CG2-CE1 3.9Å; T275-F279 HydrophobicContact CG2-CE2 3.87Å; T275-F279 HydrophobicContact CG2-CZ 3.56Å; T275-F279 WeakPolarHBondContact O-CD1 3.29Å; T275-F279 WeakPolarHBondContact O-CG 3.13Å; T275-F279 PolarHBondContact O-N 3.43Å
276	F	84.8	Confident	83.3	Confident	74 Å²	74	34.8 Å²	34.8	33%	0.325	18%	0.175	S	C	.	.	H	α-helix	trans	-58.3	-48.8	174.1	168.4	-103.1	0	0	0	111	F215 M216 Y220 M272 Y273 A278 F279 S280	F215-F276 HydrophobicContact CE1-CD2 4.27Å; F215-F276 AromaticContact CE1-CE2 3.89Å; F215-F276 HydrophobicContact CE1-CE2 3.89Å; M216-F276 HydrophobicContact CG-CB 4.35Å; M216-F276 HydrophobicContact CG-CD2 4.34Å; M216-F276 WeakPolarHBondContact SD-CA 3.24Å; M216-F276 HydrophobicContact SD-CB 3.69Å; M216-F276 PolarHBondContact SD-N 3.23Å; M216-F276 VanDerWaalsContact SD-N 3.37Å; Y220-F276 AromaticContact CE2-CD2 3.97Å; Y220-F276 HydrophobicContact CE2-CD2 3.97Å; Y220-F276 AromaticContact CE2-CE2 3.68Å; Y220-F276 HydrophobicContact CE2-CE2 3.68Å; Y220-F276 AromaticContact CZ-CE2 3.91Å; M272-F276 WeakPolarHBondContact O-CB 3.45Å; M272-F276 PolarHBondContact O-N 3.14Å; Y273-F276 PolarHBondContact O-N 3.06Å; F276-A278 VanDerWaalsContact C-N 3.28Å; F276-A278 PolarHBondContact O-N 3.18Å; F276-F279 PolarHBondContact O-N 2.91Å; F276-F279 VanDerWaalsContact O-N 3.13Å; F276-S280 PolarHBondContact O-N 2.91Å; F276-S280 PolarHBondContact O-OG 2.77Å
277	S	77.6	Confident	83	Confident	21 Å²	21	35.5 Å²	35.5	15%	0.147	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-33.5	179.5	-167	0	0	0	0	112.6	Y273 L274 T275 S281 K432	Y273-S277 VanDerWaalsContact O-CB 3.29Å; Y273-S277 WeakPolarHBondContact O-CB 3.23Å; Y273-S277 PolarHBondContact O-N 3.49Å; L274-S277 PolarHBondContact O-N 3.41Å; T275-S277 PolarHBondContact O-N 2.91Å; S277-S281 PolarHBondContact O-N 3.02Å; S277-S281 PolarHBondContact O-OG 3.32Å; S277-K432 PolarHBondContact O-NZ 3.48Å; S277-K432 VanDerWaalsContact OG-CE 3.31Å; S277-K432 WeakPolarHBondContact OG-CE 2.89Å; S277-K432 PolarHBondContact OG-NZ 3.44Å
278	A	82.6	Confident	82.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-50	172.5	0	0	0	0	0	110.3	L274 T275 F276 S280 S281 K282 Y429 K432 V433	L274-A278 WeakPolarHBondContact O-CB 3.05Å; L274-A278 PolarHBondContact O-N 3.37Å; T275-A278 WeakPolarHBondContact O-CB 3.35Å; T275-A278 PolarHBondContact O-N 2.9Å; F276-A278 VanDerWaalsContact C-N 3.28Å; F276-A278 PolarHBondContact O-N 3.18Å; A278-S280 VanDerWaalsContact C-N 3.31Å; A278-S280 PolarHBondContact O-N 3.03Å; A278-S281 WeakPolarHBondContact O-CA 3.21Å; A278-S281 PolarHBondContact O-N 3.34Å; A278-K282 PolarHBondContact O-N 3.15Å; A278-Y429 HydrophobicContact CB-CD2 4.13Å; A278-Y429 HydrophobicContact CB-CE2 4.1Å; A278-Y429 WeakPolarHBondContact O-CD2 3.44Å; A278-K432 HydrophobicContact CB-CB 3.79Å; A278-K432 HydrophobicContact CB-CD 4.34Å; A278-V433 HydrophobicContact CB-CG2 4.04Å
279	F	84.1	Confident	81.6	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-40.5	-179	-66.5	-3.5	0	0	0	112.3	M216 Y220 N229 F232 L233 T275 F276 S281 K282 Y429	M216-F279 HydrophobicContact CB-CD2 4.42Å; M216-F279 HydrophobicContact CB-CE2 4.34Å; M216-F279 HydrophobicContact CG-CD2 4.36Å; M216-F279 HydrophobicContact SD-CD2 4Å; M216-F279 HydrophobicContact SD-CE2 4.07Å; Y220-F279 HydrophobicContact CD1-CB 3.58Å; Y220-F279 HydrophobicContact CD1-CD2 4.45Å; Y220-F279 HydrophobicContact CD1-CG 4.48Å; Y220-F279 HydrophobicContact CE1-CB 3.99Å; Y220-F279 HydrophobicContact CG-CB 4.09Å; Y220-F279 HydrophobicContact CG-CD2 4.15Å; N229-F279 HydrophobicContact CB-CD1 4.47Å; N229-F279 HydrophobicContact CB-CD2 4.46Å; N229-F279 HydrophobicContact CB-CE1 4.19Å; N229-F279 HydrophobicContact CB-CE2 4.17Å; N229-F279 HydrophobicContact CB-CZ 4.02Å; N229-F279 VanDerWaalsContact O-CZ 3.23Å; N229-F279 WeakPolarHBondContact O-CZ 3.19Å; F232-F279 HydrophobicContact CB-CE1 4.21Å; F232-F279 HydrophobicContact CB-CZ 4.39Å; L233-F279 HydrophobicContact CB-CE2 4.11Å; L233-F279 HydrophobicContact CB-CZ 4.01Å; L233-F279 HydrophobicContact CD1-CE2 4.43Å; T275-F279 HydrophobicContact CG2-CD1 4.49Å; T275-F279 HydrophobicContact CG2-CD2 4.46Å; T275-F279 HydrophobicContact CG2-CE1 3.9Å; T275-F279 HydrophobicContact CG2-CE2 3.87Å; T275-F279 HydrophobicContact CG2-CZ 3.56Å; T275-F279 WeakPolarHBondContact O-CD1 3.29Å; T275-F279 WeakPolarHBondContact O-CG 3.13Å; T275-F279 PolarHBondContact O-N 3.43Å; F276-F279 PolarHBondContact O-N 2.91Å; F276-F279 VanDerWaalsContact O-N 3.13Å; F279-S281 PolarHBondContact O-N 2.93Å; F279-K282 PolarHBondContact O-N 2.84Å; F279-Y429 HydrophobicContact CD1-CE2 4.02Å
280	S	78.1	Confident	80.7	Confident	59 Å²	59	49.9 Å²	49.9	41%	0.413	25%	0.252	S	S	.	.	H	α-helix	trans	-68.5	-19	174.9	-52.6	0	0	0	0	114.1	Y220 F276 A278	Y220-S280 PolarHBondContact OH-OG 3.48Å; F276-S280 PolarHBondContact O-N 2.91Å; F276-S280 PolarHBondContact O-OG 2.77Å; A278-S280 VanDerWaalsContact C-N 3.31Å; A278-S280 PolarHBondContact O-N 3.03Å
281	S	73.9	Confident	80.2	Confident	23 Å²	23	50.6 Å²	50.6	16%	0.161	27%	0.273	C	S	.	.	H	α-helix	trans	-92.8	-5.5	177.3	-62.9	0	0	0	0	113.7	S277 A278 F279 G424 S425 K432	S277-S281 PolarHBondContact O-N 3.02Å; S277-S281 PolarHBondContact O-OG 3.32Å; A278-S281 WeakPolarHBondContact O-CA 3.21Å; A278-S281 PolarHBondContact O-N 3.34Å; F279-S281 PolarHBondContact O-N 2.93Å; S281-G424 CarbonylContact O-C 3.29Å; S281-G424 VanDerWaalsContact O-C 3.29Å; S281-G424 WeakPolarHBondContact O-CA 3.38Å; S281-S425 PolarHBondContact O-N 3.05Å; S281-K432 PolarHBondContact OG-NZ 3.07Å
282	K	76.8	Confident	79.6	Confident	14 Å²	14	54.7 Å²	54.7	6%	0.061	30%	0.298	C	S	.	.	S	Bend	trans	-74.8	142.9	177.6	-170.4	-178.3	167	-173.3	0	110.5	N229 A278 F279 E285 W426 Y429	N229-K282 PolarHBondContact OD1-NZ 2.74Å; A278-K282 PolarHBondContact O-N 3.15Å; F279-K282 PolarHBondContact O-N 2.84Å; K282-E285 WeakPolarHBondContact CE-OE1 3.48Å; K282-E285 IonicContact NZ-OE1 3.36Å; K282-E285 PolarHBondContact NZ-OE1 2.85Å; K282-W426 HydrophobicContact CD-CH2 4.2Å; K282-W426 VanDerWaalsContact CE-CH2 3.48Å; K282-W426 HydrophobicContact CG-CH2 4.17Å; K282-W426 HydrophobicContact CG-CZ2 4.31Å; K282-W426 HydrophobicContact CG-CZ3 4.35Å; K282-Y429 HydrophobicContact CB-CD2 3.79Å; K282-Y429 HydrophobicContact CB-CE2 4.26Å; K282-Y429 HydrophobicContact CD-CE2 4.34Å; K282-Y429 HydrophobicContact CG-CD2 4.25Å
283	P	77.2	Confident	79	Confident	34 Å²	34	59.8 Å²	59.8	22%	0.221	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-56	140.8	169.2	-26	36	0	0	0	112	E285 D423 W426	P283-E285 PolarHBondContact O-N 2.96Å; P283-D423 WeakPolarHBondContact CA-O 3.38Å; P283-D423 VanDerWaalsContact CB-O 3.25Å; P283-D423 WeakPolarHBondContact CB-O 3.34Å; P283-D423 WeakPolarHBondContact CG-O 3.49Å; P283-W426 HydrophobicContact CG-CG 4.34Å
284	K	76.3	Confident	78.6	Confident	109 Å²	109	60.6 Å²	60.6	47%	0.474	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-64.1	130.7	-176.7	-59.9	178.4	-171.7	126.7	0	110.1	V298 D423	K284-V298 HydrophobicContact CG-CG2 4.11Å; K284-D423 IonicContact NZ-OD1 3.14Å; K284-D423 PolarHBondContact NZ-OD1 3.49Å
285	E	77.4	Confident	78.4	Confident	63 Å²	63	63.8 Å²	63.8	29%	0.294	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	139.3	170.5	-73.7	-178	-155.1	0	0	109.5	C226 K282 P283 V296	C226-E285 WeakPolarHBondContact CA-OE2 3.4Å; C226-E285 PolarHBondContact N-OE2 2.99Å; C226-E285 PolarHBondContact SG-OE2 3.35Å; C226-E285 VanDerWaalsContact SG-OE2 3.38Å; K282-E285 WeakPolarHBondContact CE-OE1 3.48Å; K282-E285 IonicContact NZ-OE1 3.36Å; K282-E285 PolarHBondContact NZ-OE1 2.85Å; P283-E285 PolarHBondContact O-N 2.96Å; E285-V296 HydrophobicContact CB-CG2 4.18Å; E285-V296 WeakPolarHBondContact O-CG2 3.32Å; E285-V296 PolarHBondContact O-N 3.41Å
286	M	77.4	Confident	78	Confident	123 Å²	123	64.3 Å²	64.3	61%	0.606	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.6	175.5	-63.6	-174.8	-179.1	0	0	109.3	Q294 T295	M286-Q294 WeakPolarHBondContact CA-O 3.29Å; M286-T295 HydrophobicContact CE-CG2 3.96Å; M286-T295 HydrophobicContact CG-CG2 4.1Å
287	V	81.5	Confident	77.7	Confident	33 Å²	33	61.6 Å²	61.6	20%	0.2	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.1	172.6	178.7	0	0	0	0	107.7	A225 V289 Q294 V296	A225-V287 HydrophobicContact CB-CG2 3.49Å; A225-V287 VanDerWaalsContact CB-CG2 3.49Å; V287-V289 HydrophobicContact CG1-CG2 4.03Å; V287-V289 PolarHBondContact O-N 2.85Å; V287-Q294 PolarHBondContact N-O 3.16Å; V287-Q294 PolarHBondContact O-N 2.69Å; V287-V296 HydrophobicContact CB-CG1 4.09Å; V287-V296 HydrophobicContact CB-CG2 4.4Å; V287-V296 HydrophobicContact CG2-CB 4.49Å; V287-V296 HydrophobicContact CG2-CG1 4.09Å; V287-V296 HydrophobicContact CG2-CG2 3.6Å
288	E	79	Confident	77.6	Confident	136 Å²	136	63.3 Å²	63.3	64%	0.636	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	113	172.8	-167	176.3	174.3	0	0	108.7
289	V	75.1	Confident	77.2	Confident	50 Å²	50	66.4 Å²	66.4	30%	0.303	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121	173.8	-176.1	0	0	0	0	106.7	V287 G291 V292	V287-V289 HydrophobicContact CG1-CG2 4.03Å; V287-V289 PolarHBondContact O-N 2.85Å; V289-G291 VanDerWaalsContact C-N 3.29Å; V289-G291 PolarHBondContact O-N 3.46Å; V289-V292 PolarHBondContact N-O 3.3Å; V289-V292 VanDerWaalsContact N-O 3.09Å; V289-V292 PolarHBondContact O-N 3.49Å; V289-V292 VanDerWaalsContact O-N 3.14Å
290	D	70.6	Confident	76.3	Confident	158 Å²	158	69.9 Å²	69.9	85%	0.845	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	36.8	-178.5	-56	-39.9	0	0	0	114.6	V292	D290-V292 PolarHBondContact O-N 3.24Å
291	G	73.3	Confident	75.3	Confident	59 Å²	59	73 Å²	73	61%	0.608	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	7.5	179.3	0	0	0	0	0	114.7	V289	V289-G291 VanDerWaalsContact C-N 3.29Å; V289-G291 PolarHBondContact O-N 3.46Å
292	V	77.9	Confident	74	Confident	86 Å²	86	79.6 Å²	79.6	52%	0.521	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.3	175.9	-176.6	0	0	0	0	109.4	V289 D290 Q294	V289-V292 PolarHBondContact N-O 3.3Å; V289-V292 VanDerWaalsContact N-O 3.09Å; V289-V292 PolarHBondContact O-N 3.49Å; V289-V292 VanDerWaalsContact O-N 3.14Å; D290-V292 PolarHBondContact O-N 3.24Å; V292-Q294 HydrophobicContact CG1-CG 4.41Å; V292-Q294 PolarHBondContact O-N 2.91Å; V292-Q294 VanDerWaalsContact O-N 3.14Å
293	N	78.7	Confident	72.2	Confident	110 Å²	110	81.4 Å²	81.4	59%	0.588	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	105.7	173.8	-72.6	-26.6	0	0	0	109.8
294	Q	76.9	Confident	70.8	Confident	99 Å²	99	84.6 Å²	84.6	46%	0.463	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	134.9	175.8	-63.1	-173.9	10.3	0	0	109.9	M286 V287 V292 V296	M286-Q294 WeakPolarHBondContact CA-O 3.29Å; V287-Q294 PolarHBondContact N-O 3.16Å; V287-Q294 PolarHBondContact O-N 2.69Å; V292-Q294 HydrophobicContact CG1-CG 4.41Å; V292-Q294 PolarHBondContact O-N 2.91Å; V292-Q294 VanDerWaalsContact O-N 3.14Å; Q294-V296 PolarHBondContact O-N 2.86Å
295	T	78.8	Confident	69.3	Low	81 Å²	81	81.4 Å²	81.4	50%	0.497	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	124.7	170.9	51.8	0	0	0	0	109.7	M286	M286-T295 HydrophobicContact CE-CG2 3.96Å; M286-T295 HydrophobicContact CG-CG2 4.1Å
296	V	79.8	Confident	68.1	Low	13 Å²	13	84.4 Å²	84.4	8%	0.079	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	161.7	-178.1	-66.4	0	0	0	0	111	H222 A225 E285 V287 Q294 V298	H222-V296 HydrophobicContact CB-CB 4.46Å; A225-V296 HydrophobicContact CB-CG2 3.95Å; E285-V296 HydrophobicContact CB-CG2 4.18Å; E285-V296 WeakPolarHBondContact O-CG2 3.32Å; E285-V296 PolarHBondContact O-N 3.41Å; V287-V296 HydrophobicContact CB-CG1 4.09Å; V287-V296 HydrophobicContact CB-CG2 4.4Å; V287-V296 HydrophobicContact CG2-CB 4.49Å; V287-V296 HydrophobicContact CG2-CG1 4.09Å; V287-V296 HydrophobicContact CG2-CG2 3.6Å; Q294-V296 PolarHBondContact O-N 2.86Å; V296-V298 VanDerWaalsContact C-N 3.25Å; V296-V298 PolarHBondContact O-N 3.42Å
297	C	78.1	Confident	66.9	Low	17 Å²	17	81.5 Å²	81.5	12%	0.115	48%	0.482	C	S	.	.	S	Bend	trans	62.5	32.1	173.6	-44	0	0	0	0	114.4	Y219 Y220 H222 C226	Y219-C297 CarbonylContact O-C 3.59Å; Y219-C297 WeakPolarHBondContact O-CA 3.35Å; Y220-C297 WeakPolarHBondContact CD1-O 3.47Å; H222-C297 VanDerWaalsContact CB-SG 3.57Å; C226-C297 HydrophobicContact CB-CB 3.77Å; C226-C297 WeakPolarHBondContact CB-SG 3.26Å; C226-C297 WeakPolarHBondContact SG-CB 3.47Å; C226-C297 CovalentContact SG-SG 1.98Å; C226-C297 PolarHBondContact SG-SG 2.95Å
298	V	76.6	Confident	65.4	Low	57 Å²	57	82.3 Å²	82.3	35%	0.345	49%	0.485	S	S	.	.	S	Bend	trans	-124	141.4	172.6	-178.1	0	0	0	0	106.2	K284 V296 P300	K284-V298 HydrophobicContact CG-CG2 4.11Å; V296-V298 VanDerWaalsContact C-N 3.25Å; V296-V298 PolarHBondContact O-N 3.42Å; V298-P300 VanDerWaalsContact O-CD 3.29Å; V298-P300 WeakPolarHBondContact O-CD 3.45Å
299	F	74.4	Confident	63.9	Low	64 Å²	64	82 Å²	82	28%	0.281	48%	0.482	S	S	.	.			trans	-63.3	117.3	171.4	-177.5	-102.4	0	0	0	109.4	F215 Y219 Y220 F301	F215-F299 HydrophobicContact CE1-CD2 4.37Å; F215-F299 AromaticContact CE2-CD2 3.78Å; F215-F299 HydrophobicContact CE2-CD2 3.78Å; F215-F299 AromaticContact CE2-CE2 3.49Å; F215-F299 HydrophobicContact CE2-CE2 3.49Å; F215-F299 VanDerWaalsContact CE2-CE2 3.49Å; F215-F299 HydrophobicContact CE2-CZ 4.35Å; F215-F299 AromaticContact CZ-CD2 3.38Å; F215-F299 HydrophobicContact CZ-CD2 3.38Å; F215-F299 AromaticContact CZ-CE2 3.53Å; F215-F299 HydrophobicContact CZ-CE2 3.53Å; F215-F299 HydrophobicContact CZ-CG 4.11Å; F215-F299 HydrophobicContact CZ-CZ 4.35Å; Y219-F299 AromaticContact CD1-CD2 3.71Å; Y219-F299 HydrophobicContact CD1-CD2 3.71Å; Y219-F299 HydrophobicContact CD1-CE2 4.04Å; Y219-F299 AromaticContact CD2-CD2 3.78Å; Y219-F299 HydrophobicContact CD2-CD2 3.78Å; Y219-F299 AromaticContact CD2-CE2 3.95Å; Y219-F299 HydrophobicContact CD2-CE2 3.95Å; Y219-F299 HydrophobicContact CE1-CD2 4.07Å; Y219-F299 AromaticContact CE1-CE2 3.91Å; Y219-F299 HydrophobicContact CE1-CE2 3.91Å; Y219-F299 HydrophobicContact CE2-CD2 4.16Å; Y219-F299 AromaticContact CE2-CE2 3.83Å; Y219-F299 HydrophobicContact CE2-CE2 3.83Å; Y219-F299 AromaticContact CG-CD2 3.56Å; Y219-F299 HydrophobicContact CG-CD2 3.56Å; Y219-F299 HydrophobicContact CG-CE2 4.06Å; Y219-F299 AromaticContact CZ-CE2 3.8Å; Y220-F299 HydrophobicContact CE2-CB 4.09Å; F299-F301 AromaticContact CD1-CD2 3.7Å; F299-F301 HydrophobicContact CD1-CD2 3.7Å; F299-F301 HydrophobicContact CD1-CE2 4.03Å; F299-F301 AromaticContact CE1-CD2 3.77Å; F299-F301 HydrophobicContact CE1-CD2 3.77Å; F299-F301 AromaticContact CE1-CE2 3.81Å; F299-F301 HydrophobicContact CE1-CE2 3.81Å; F299-F301 PolarHBondContact O-N 3.43Å
300	P	65	Low	62.8	Low	79 Å²	79	86.3 Å²	86.3	51%	0.513	50%	0.499	S	S	.	.			trans	-74.5	97.5	-176.5	29.6	-32	0	0	0	109.1	Y219 V298 N302	Y219-P300 HydrophobicContact CD1-CG 4.41Å; Y219-P300 HydrophobicContact CE1-CG 4.5Å; V298-P300 VanDerWaalsContact O-CD 3.29Å; V298-P300 WeakPolarHBondContact O-CD 3.45Å; P300-N302 PolarHBondContact O-N 3.37Å; P300-N302 VanDerWaalsContact O-N 3.11Å
301	F	56.9	Low	61.8	Low	125 Å²	125	83.9 Å²	83.9	55%	0.548	49%	0.485	S	S	.	.			trans	-73.1	97.6	162	-112.3	-85.2	0	0	0	107.7	F299 S303 V312	F299-F301 AromaticContact CD1-CD2 3.7Å; F299-F301 HydrophobicContact CD1-CD2 3.7Å; F299-F301 HydrophobicContact CD1-CE2 4.03Å; F299-F301 AromaticContact CE1-CD2 3.77Å; F299-F301 HydrophobicContact CE1-CD2 3.77Å; F299-F301 AromaticContact CE1-CE2 3.81Å; F299-F301 HydrophobicContact CE1-CE2 3.81Å; F299-F301 PolarHBondContact O-N 3.43Å; F301-S303 VanDerWaalsContact C-N 3.3Å; F301-S303 PolarHBondContact O-N 3.47Å; F301-V312 HydrophobicContact CE1-CG2 4.42Å; F301-V312 HydrophobicContact CE2-CG2 3.84Å; F301-V312 HydrophobicContact CZ-CG2 3.79Å
302	N	45.8	Very low	60.7	Low	161 Å²	161	84.4 Å²	84.4	86%	0.861	48%	0.476	S	S	*	.			trans	-73.5	82.8	168.7	-90.4	-9.9	0	0	0	109.3	P300	P300-N302 PolarHBondContact O-N 3.37Å; P300-N302 VanDerWaalsContact O-N 3.11Å
303	S	40.1	Very low	59.3	Low	52 Å²	52	85.1 Å²	85.1	36%	0.364	48%	0.48	S	S	.	.			trans	-161.5	117.9	160.7	52.2	0	0	0	0	111.9	F301 S305 D308	F301-S303 VanDerWaalsContact C-N 3.3Å; F301-S303 PolarHBondContact O-N 3.47Å; S303-S305 PolarHBondContact O-N 3.4Å; S303-D308 WeakPolarHBondContact CB-OD2 3.39Å; S303-D308 PolarHBondContact OG-OD2 3.04Å
304	G	46.8	Very low	58	Low	101 Å²	101	81.4 Å²	81.4	100%	1.041	47%	0.468	S	S	*	.			trans	-72.8	45	176.3	0	0	0	0	0	114.3
305	S	45.5	Very low	56.5	Low	42 Å²	42	81.7 Å²	81.7	29%	0.294	47%	0.472	S	S	.	.			trans	-127.1	128.9	174.4	91.6	0	0	0	0	111.8	S303 S307 D308	S303-S305 PolarHBondContact O-N 3.4Å; S305-S307 WeakPolarHBondContact CB-OG 3.28Å; S305-S307 PolarHBondContact O-N 3.1Å; S305-S307 VanDerWaalsContact O-N 3.15Å; S305-S307 PolarHBondContact OG-OG 3.41Å; S305-D308 PolarHBondContact O-N 3.1Å; S305-D308 PolarHBondContact OG-OD2 2.82Å; S305-D308 VanDerWaalsContact OG-OD2 3.11Å
306	E	52.3	Low	55.1	Low	127 Å²	127	79.7 Å²	79.7	59%	0.593	47%	0.468	S	S	*	.	H	α-helix	trans	-59.1	-20.9	174.6	-76.6	-69.9	120.5	0	0	112.7	K309 Q310	E306-K309 IonicContact OE1-NZ 2.77Å; E306-K309 PolarHBondContact OE1-NZ 3.06Å; E306-Q310 PolarHBondContact O-N 2.71Å
307	S	52.1	Low	53.8	Low	62 Å²	62	81.2 Å²	81.2	43%	0.434	48%	0.482	S	S	.	.	H	α-helix	trans	-66.7	-33.3	177.5	37	0	0	0	0	114.1	S305 Q310 I311	S305-S307 WeakPolarHBondContact CB-OG 3.28Å; S305-S307 PolarHBondContact O-N 3.1Å; S305-S307 VanDerWaalsContact O-N 3.15Å; S305-S307 PolarHBondContact OG-OG 3.41Å; S307-Q310 PolarHBondContact O-N 3.49Å; S307-I311 WeakPolarHBondContact O-CD1 3.49Å; S307-I311 VanDerWaalsContact O-CG1 3.27Å; S307-I311 WeakPolarHBondContact O-CG1 3.43Å; S307-I311 PolarHBondContact O-N 2.96Å
308	D	48.8	Very low	52.6	Low	49 Å²	49	84.9 Å²	84.9	26%	0.262	50%	0.504	S	S	.	.	H	α-helix	trans	-75.9	-33.1	-177	-66.4	-36.2	0	0	0	112.3	S303 S305 Q310 I311 V312	S303-D308 WeakPolarHBondContact CB-OD2 3.39Å; S303-D308 PolarHBondContact OG-OD2 3.04Å; S305-D308 PolarHBondContact O-N 3.1Å; S305-D308 PolarHBondContact OG-OD2 2.82Å; S305-D308 VanDerWaalsContact OG-OD2 3.11Å; D308-Q310 VanDerWaalsContact C-N 3.31Å; D308-Q310 PolarHBondContact O-N 3.39Å; D308-I311 PolarHBondContact O-N 2.89Å; D308-V312 WeakPolarHBondContact O-CG2 3.49Å; D308-V312 PolarHBondContact O-N 3.29Å
309	K	48.5	Very low	51.5	Low	131 Å²	131	85.7 Å²	85.7	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-39	171.9	-66.5	178.6	-169.9	160.6	0	111.3	E306 T313	E306-K309 IonicContact OE1-NZ 2.77Å; E306-K309 PolarHBondContact OE1-NZ 3.06Å; K309-T313 VanDerWaalsContact O-CB 3.29Å; K309-T313 WeakPolarHBondContact O-CB 3.48Å; K309-T313 PolarHBondContact O-N 3.31Å; K309-T313 PolarHBondContact O-OG1 3.44Å
310	Q	51.8	Low	50.5	Low	139 Å²	139	85.8 Å²	85.8	65%	0.65	51%	0.508	S	S	*	.	H	α-helix	trans	-67.7	-38.2	175.5	-70.6	-173.5	-17.5	0	0	112	E306 S307 D308 G314	E306-Q310 PolarHBondContact O-N 2.71Å; S307-Q310 PolarHBondContact O-N 3.49Å; D308-Q310 VanDerWaalsContact C-N 3.31Å; D308-Q310 PolarHBondContact O-N 3.39Å; Q310-G314 WeakPolarHBondContact O-CA 3.5Å; Q310-G314 PolarHBondContact O-N 3.01Å
311	I	50.4	Low	50.1	Low	108 Å²	108	84.4 Å²	84.4	55%	0.554	49%	0.494	S	S	*	.	H	α-helix	trans	-68.1	-42.8	177.2	-67.7	163.6	0	0	0	111.5	S307 D308 G314 L315	S307-I311 WeakPolarHBondContact O-CD1 3.49Å; S307-I311 VanDerWaalsContact O-CG1 3.27Å; S307-I311 WeakPolarHBondContact O-CG1 3.43Å; S307-I311 PolarHBondContact O-N 2.96Å; D308-I311 PolarHBondContact O-N 2.89Å; I311-G314 PolarHBondContact O-N 2.88Å; I311-L315 WeakPolarHBondContact O-CB 3.44Å; I311-L315 PolarHBondContact O-N 2.89Å
312	V	48.8	Very low	49.9	Very low	69 Å²	69	81 Å²	81	42%	0.418	49%	0.489	S	S	.	.	H	α-helix	trans	-69.2	-41.8	178.9	173.8	0	0	0	0	111.5	F301 D308 G314 L315 G316	F301-V312 HydrophobicContact CE1-CG2 4.42Å; F301-V312 HydrophobicContact CE2-CG2 3.84Å; F301-V312 HydrophobicContact CZ-CG2 3.79Å; D308-V312 WeakPolarHBondContact O-CG2 3.49Å; D308-V312 PolarHBondContact O-N 3.29Å; V312-G314 VanDerWaalsContact C-N 3.34Å; V312-L315 PolarHBondContact O-N 3.32Å; V312-G316 PolarHBondContact O-N 3.41Å
313	T	50	Low	50.2	Low	101 Å²	101	75.8 Å²	75.8	62%	0.62	47%	0.465	S	S	*	.	H	α-helix	trans	-65.7	-40.8	175	-51.4	0	0	0	0	110.7	K309 G316 A317	K309-T313 VanDerWaalsContact O-CB 3.29Å; K309-T313 WeakPolarHBondContact O-CB 3.48Å; K309-T313 PolarHBondContact O-N 3.31Å; K309-T313 PolarHBondContact O-OG1 3.44Å; T313-G316 PolarHBondContact O-N 3.06Å; T313-A317 WeakPolarHBondContact O-CB 3.5Å; T313-A317 PolarHBondContact O-N 3.37Å
314	G	49.8	Very low	50.9	Low	32 Å²	32	73.8 Å²	73.8	33%	0.33	45%	0.45	S	S	.	.	H	α-helix	trans	-64.1	-44.3	174.8	0	0	0	0	0	112.9	Q310 I311 V312 A317 V318	Q310-G314 WeakPolarHBondContact O-CA 3.5Å; Q310-G314 PolarHBondContact O-N 3.01Å; I311-G314 PolarHBondContact O-N 2.88Å; V312-G314 VanDerWaalsContact C-N 3.34Å; G314-A317 PolarHBondContact O-N 2.89Å; G314-V318 WeakPolarHBondContact O-CB 3.4Å; G314-V318 WeakPolarHBondContact O-CG2 3.42Å; G314-V318 PolarHBondContact O-N 2.99Å
315	L	46.2	Very low	51.5	Low	105 Å²	105	71.6 Å²	71.6	55%	0.55	41%	0.414	S	S	.	.	H	α-helix	trans	-65.8	-41.6	176.5	-175.8	65.6	0	0	0	111.4	I311 V312 V318 I319	I311-L315 WeakPolarHBondContact O-CB 3.44Å; I311-L315 PolarHBondContact O-N 2.89Å; V312-L315 PolarHBondContact O-N 3.32Å; L315-V318 PolarHBondContact O-N 3.44Å; L315-I319 HydrophobicContact CD1-CD1 4.24Å; L315-I319 HydrophobicContact CG-CD1 3.96Å; L315-I319 WeakPolarHBondContact O-CB 3.36Å; L315-I319 VanDerWaalsContact O-CG1 3.23Å; L315-I319 WeakPolarHBondContact O-CG1 3.49Å; L315-I319 PolarHBondContact O-N 2.87Å
316	G	49.8	Very low	52.1	Low	39 Å²	39	74.8 Å²	74.8	40%	0.402	42%	0.42	S	S	.	.	H	α-helix	trans	-62.2	-41.5	173.8	0	0	0	0	0	112.7	V312 T313 L320	V312-G316 PolarHBondContact O-N 3.41Å; T313-G316 PolarHBondContact O-N 3.06Å; G316-L320 VanDerWaalsContact O-CB 3.29Å; G316-L320 WeakPolarHBondContact O-CB 3.47Å; G316-L320 PolarHBondContact O-N 2.88Å
317	A	53.1	Low	52.2	Low	45 Å²	45	69.3 Å²	69.3	37%	0.372	40%	0.396	S	S	.	.	H	α-helix	trans	-66	-43.4	174.3	0	0	0	0	0	111.9	T313 G314 I319 L320 F321	T313-A317 WeakPolarHBondContact O-CB 3.5Å; T313-A317 PolarHBondContact O-N 3.37Å; G314-A317 PolarHBondContact O-N 2.89Å; A317-I319 PolarHBondContact O-N 3Å; A317-L320 PolarHBondContact O-N 3.31Å; A317-F321 WeakPolarHBondContact O-CB 3.43Å; A317-F321 PolarHBondContact O-N 3.49Å
318	V	51.8	Low	52.3	Low	95 Å²	95	66.5 Å²	66.5	58%	0.576	38%	0.376	S	S	*	.	H	α-helix	trans	-63.4	-41.3	176.8	168.3	0	0	0	0	111.4	G314 L315 F321 A322	G314-V318 WeakPolarHBondContact O-CB 3.4Å; G314-V318 WeakPolarHBondContact O-CG2 3.42Å; G314-V318 PolarHBondContact O-N 2.99Å; L315-V318 PolarHBondContact O-N 3.44Å; V318-F321 PolarHBondContact O-N 3.03Å; V318-A322 VanDerWaalsContact O-CB 3.29Å; V318-A322 WeakPolarHBondContact O-CB 3.44Å; V318-A322 PolarHBondContact O-N 3.48Å
319	I	52.7	Low	52.5	Low	73 Å²	73	67.2 Å²	67.2	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-67.6	-45.9	176.1	-69.2	167	0	0	0	110.6	L315 A317 F321 A322 C323	L315-I319 HydrophobicContact CD1-CD1 4.24Å; L315-I319 HydrophobicContact CG-CD1 3.96Å; L315-I319 WeakPolarHBondContact O-CB 3.36Å; L315-I319 VanDerWaalsContact O-CG1 3.23Å; L315-I319 WeakPolarHBondContact O-CG1 3.49Å; L315-I319 PolarHBondContact O-N 2.87Å; A317-I319 PolarHBondContact O-N 3Å; I319-F321 PolarHBondContact O-N 3.33Å; I319-A322 PolarHBondContact O-N 3.36Å; I319-C323 WeakPolarHBondContact O-CB 3.47Å; I319-C323 PolarHBondContact O-N 3.37Å; I319-C323 PolarHBondContact O-SG 3.44Å
320	L	53.6	Low	52.7	Low	66 Å²	66	62.8 Å²	62.8	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-56.6	-43.5	174.7	179.4	68.6	0	0	0	110.6	G316 A317 C323 I324	G316-L320 VanDerWaalsContact O-CB 3.29Å; G316-L320 WeakPolarHBondContact O-CB 3.47Å; G316-L320 PolarHBondContact O-N 2.88Å; A317-L320 PolarHBondContact O-N 3.31Å; L320-C323 PolarHBondContact O-N 2.03Å; L320-I324 HydrophobicContact CD1-CD1 4.18Å; L320-I324 HydrophobicContact CG-CD1 3.87Å; L320-I324 WeakPolarHBondContact O-CB 3.07Å; L320-I324 WeakPolarHBondContact O-CG1 3.08Å; L320-I324 PolarHBondContact O-N 3.24Å
321	F	56.7	Low	52.6	Low	50 Å²	50	56.5 Å²	56.5	22%	0.219	34%	0.335	C	S	.	.	H	α-helix	trans	-67	-45.2	179.1	-163.7	-114	0	0	0	111.9	L44 T47 V48 A317 V318 I319 C323 I324 I325	L44-F321 HydrophobicContact CD1-CD1 4.19Å; L44-F321 HydrophobicContact CD1-CE1 3.23Å; L44-F321 HydrophobicContact CD1-CE2 3.9Å; L44-F321 HydrophobicContact CD1-CZ 3.04Å; L44-F321 HydrophobicContact CG-CE1 3.93Å; L44-F321 HydrophobicContact CG-CZ 3.51Å; T47-F321 HydrophobicContact CG2-CD2 4.08Å; T47-F321 HydrophobicContact CG2-CE2 3.64Å; V48-F321 HydrophobicContact CG2-CE1 4.16Å; V48-F321 HydrophobicContact CG2-CE2 4.09Å; V48-F321 HydrophobicContact CG2-CZ 3.42Å; V48-F321 VanDerWaalsContact CG2-CZ 3.42Å; A317-F321 WeakPolarHBondContact O-CB 3.43Å; A317-F321 PolarHBondContact O-N 3.49Å; V318-F321 PolarHBondContact O-N 3.03Å; I319-F321 PolarHBondContact O-N 3.33Å; F321-C323 VanDerWaalsContact C-N 3.31Å; F321-C323 PolarHBondContact O-N 2.89Å; F321-I324 PolarHBondContact O-N 3.31Å; F321-I325 HydrophobicContact CD1-CD1 3.56Å; F321-I325 HydrophobicContact CD1-CG1 4.45Å; F321-I325 HydrophobicContact CE1-CD1 3.69Å; F321-I325 HydrophobicContact CG-CD1 4.23Å; F321-I325 HydrophobicContact CZ-CD1 4.43Å; F321-I325 WeakPolarHBondContact O-CB 3.48Å; F321-I325 WeakPolarHBondContact O-CD1 2.87Å; F321-I325 WeakPolarHBondContact O-CG1 3.01Å; F321-I325 PolarHBondContact O-N 2.82Å
322	A	53	Low	52.5	Low	53 Å²	53	51.8 Å²	51.8	44%	0.438	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-39.4	173.4	0	0	0	0	0	111.9	V318 I319 Y326	V318-A322 VanDerWaalsContact O-CB 3.29Å; V318-A322 WeakPolarHBondContact O-CB 3.44Å; V318-A322 PolarHBondContact O-N 3.48Å; I319-A322 PolarHBondContact O-N 3.36Å; A322-Y326 WeakPolarHBondContact O-CB 3.45Å; A322-Y326 PolarHBondContact O-N 3.48Å
323	C	53.4	Low	52.7	Low	52 Å²	52	50.6 Å²	50.6	35%	0.351	30%	0.304	S	S	.	.	H	α-helix	trans	-68.1	-40.4	174.7	-72.4	0	0	0	0	112.4	I319 L320 F321 S327	I319-C323 WeakPolarHBondContact O-CB 3.47Å; I319-C323 PolarHBondContact O-N 3.37Å; I319-C323 PolarHBondContact O-SG 3.44Å; L320-C323 PolarHBondContact O-N 2.03Å; F321-C323 VanDerWaalsContact C-N 3.31Å; F321-C323 PolarHBondContact O-N 2.89Å; C323-S327 WeakPolarHBondContact O-CB 3.25Å; C323-S327 PolarHBondContact O-N 3.11Å
324	I	54.6	Low	52.6	Low	11 Å²	11	50.1 Å²	50.1	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-65.2	-45.3	175.5	-71.4	166.8	0	0	0	110	F43 L320 F321 S327 C328 Y402 V403	F43-I324 HydrophobicContact CE1-CG2 3.92Å; L320-I324 HydrophobicContact CD1-CD1 4.18Å; L320-I324 HydrophobicContact CG-CD1 3.87Å; L320-I324 WeakPolarHBondContact O-CB 3.07Å; L320-I324 WeakPolarHBondContact O-CG1 3.08Å; L320-I324 PolarHBondContact O-N 3.24Å; F321-I324 PolarHBondContact O-N 3.31Å; I324-S327 PolarHBondContact O-N 3.09Å; I324-C328 WeakPolarHBondContact O-CB 3.43Å; I324-C328 PolarHBondContact O-N 3.18Å; I324-C328 PolarHBondContact O-SG 3.42Å; I324-Y402 HydrophobicContact CD1-CE1 4.14Å; I324-Y402 HydrophobicContact CG1-CE1 4.13Å; I324-V403 HydrophobicContact CD1-CG2 4.42Å; I324-V403 HydrophobicContact CG2-CG2 4.43Å
325	I	58.1	Low	52.7	Low	54 Å²	54	54.7 Å²	54.7	28%	0.277	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-51.2	175.5	-68.9	164.9	0	0	0	110.4	L44 F321 S327 C328 L329	L44-I325 HydrophobicContact CD1-CD1 3.26Å; L44-I325 HydrophobicContact CD1-CG1 3.41Å; L44-I325 VanDerWaalsContact CD1-CG1 3.41Å; F321-I325 HydrophobicContact CD1-CD1 3.56Å; F321-I325 HydrophobicContact CD1-CG1 4.45Å; F321-I325 HydrophobicContact CE1-CD1 3.69Å; F321-I325 HydrophobicContact CG-CD1 4.23Å; F321-I325 HydrophobicContact CZ-CD1 4.43Å; F321-I325 WeakPolarHBondContact O-CB 3.48Å; F321-I325 WeakPolarHBondContact O-CD1 2.87Å; F321-I325 WeakPolarHBondContact O-CG1 3.01Å; F321-I325 PolarHBondContact O-N 2.82Å; I325-S327 VanDerWaalsContact C-N 3.31Å; I325-S327 PolarHBondContact O-N 2.95Å; I325-C328 PolarHBondContact O-N 3.45Å; I325-L329 HydrophobicContact CG2-CD1 3.5Å; I325-L329 VanDerWaalsContact CG2-CD1 3.5Å; I325-L329 HydrophobicContact CG2-CG 4.18Å; I325-L329 VanDerWaalsContact O-CB 3.3Å; I325-L329 WeakPolarHBondContact O-CB 3.41Å; I325-L329 VanDerWaalsContact O-CG 3.26Å; I325-L329 WeakPolarHBondContact O-CG 3.25Å; I325-L329 PolarHBondContact O-N 3.21Å
326	Y	59.3	Low	52.8	Low	109 Å²	109	50.1 Å²	50.1	43%	0.427	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-43.4	179	179.8	-98.6	0	0	0	111	A322 L329 T330	A322-Y326 WeakPolarHBondContact O-CB 3.45Å; A322-Y326 PolarHBondContact O-N 3.48Å; Y326-L329 PolarHBondContact O-N 3.39Å; Y326-T330 WeakPolarHBondContact CE2-OG1 3.35Å; Y326-T330 WeakPolarHBondContact O-CB 3.42Å; Y326-T330 PolarHBondContact O-N 3.19Å; Y326-T330 PolarHBondContact O-OG1 3.47Å
327	S	52.9	Low	52.4	Low	12 Å²	12	48.5 Å²	48.5	8%	0.084	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-45.8	175.5	-171.8	0	0	0	0	111.3	Q169 C323 I324 I325 S331	Q169-S327 VanDerWaalsContact CG-OG 3.32Å; Q169-S327 WeakPolarHBondContact CG-OG 3.47Å; Q169-S327 PolarHBondContact NE2-OG 3.32Å; C323-S327 WeakPolarHBondContact O-CB 3.25Å; C323-S327 PolarHBondContact O-N 3.11Å; I324-S327 PolarHBondContact O-N 3.09Å; I325-S327 VanDerWaalsContact C-N 3.31Å; I325-S327 PolarHBondContact O-N 2.95Å; S327-S331 WeakPolarHBondContact O-CA 3.2Å; S327-S331 WeakPolarHBondContact O-CB 3.25Å; S327-S331 PolarHBondContact O-N 3.49Å
328	C	54.8	Low	52	Low	4 Å²	4	48.7 Å²	48.7	3%	0.027	26%	0.262	C	S	.	.	H	α-helix	trans	-68	-40.4	179.6	-66.6	0	0	0	0	112.1	I324 I325 T332 F396	I324-C328 WeakPolarHBondContact O-CB 3.43Å; I324-C328 PolarHBondContact O-N 3.18Å; I324-C328 PolarHBondContact O-SG 3.42Å; I325-C328 PolarHBondContact O-N 3.45Å; C328-T332 WeakPolarHBondContact O-CB 3.48Å; C328-T332 WeakPolarHBondContact O-CG2 3.33Å; C328-T332 PolarHBondContact O-OG1 2.87Å; C328-F396 HydrophobicContact CB-CE1 4.02Å; C328-F396 HydrophobicContact CB-CZ 4.14Å
329	L	53.8	Low	51.6	Low	63 Å²	63	44.8 Å²	44.8	33%	0.33	24%	0.239	S	C	.	.	H	α-helix	trans	-74.3	-34.5	179.2	-69.7	175.5	0	0	0	112.5	A40 I325 Y326 T332	A40-L329 HydrophobicContact CB-CD2 3.45Å; A40-L329 VanDerWaalsContact CB-CD2 3.45Å; A40-L329 HydrophobicContact CB-CG 4.3Å; I325-L329 HydrophobicContact CG2-CD1 3.5Å; I325-L329 VanDerWaalsContact CG2-CD1 3.5Å; I325-L329 HydrophobicContact CG2-CG 4.18Å; I325-L329 VanDerWaalsContact O-CB 3.3Å; I325-L329 WeakPolarHBondContact O-CB 3.41Å; I325-L329 VanDerWaalsContact O-CG 3.26Å; I325-L329 WeakPolarHBondContact O-CG 3.25Å; I325-L329 PolarHBondContact O-N 3.21Å; Y326-L329 PolarHBondContact O-N 3.39Å; L329-T332 PolarHBondContact O-OG1 3.33Å; L329-T332 VanDerWaalsContact O-OG1 3.1Å
330	T	51.9	Low	51.2	Low	39 Å²	39	43 Å²	43	24%	0.239	23%	0.23	C	C	.	.	H	α-helix	trans	-82.8	-38.2	-179.2	-53.4	0	0	0	0	111.4	Y326 T332 T333 S336	Y326-T330 WeakPolarHBondContact CE2-OG1 3.35Å; Y326-T330 WeakPolarHBondContact O-CB 3.42Å; Y326-T330 PolarHBondContact O-N 3.19Å; Y326-T330 PolarHBondContact O-OG1 3.47Å; T330-T332 PolarHBondContact O-N 3.34Å; T330-T332 VanDerWaalsContact O-N 3.15Å; T330-T333 PolarHBondContact O-N 3.05Å; T330-T333 PolarHBondContact O-OG1 3.45Å; T330-S336 PolarHBondContact O-OG 2.82Å
331	S	49.1	Very low	51.1	Low	7 Å²	7	47.6 Å²	47.6	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-22.1	174.3	179.7	0	0	0	0	113.6	L172 S327 S336 V395	L172-S331 WeakPolarHBondContact CD1-OG 3.46Å; S327-S331 WeakPolarHBondContact O-CA 3.2Å; S327-S331 WeakPolarHBondContact O-CB 3.25Å; S327-S331 PolarHBondContact O-N 3.49Å; S331-S336 WeakPolarHBondContact O-CB 3.06Å; S331-V395 WeakPolarHBondContact OG-CG1 3.29Å
332	T	49.4	Very low	50.6	Low	8 Å²	8	48.4 Å²	48.4	5%	0.049	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	11.9	-173.7	55	0	0	0	0	113.8	R36 C328 L329 T330 F392 F396	R36-T332 WeakPolarHBondContact CD-O 3.09Å; R36-T332 PolarHBondContact NH1-O 3.18Å; R36-T332 VanDerWaalsContact NH1-O 3.07Å; C328-T332 WeakPolarHBondContact O-CB 3.48Å; C328-T332 WeakPolarHBondContact O-CG2 3.33Å; C328-T332 PolarHBondContact O-OG1 2.87Å; L329-T332 PolarHBondContact O-OG1 3.33Å; L329-T332 VanDerWaalsContact O-OG1 3.1Å; T330-T332 PolarHBondContact O-N 3.34Å; T330-T332 VanDerWaalsContact O-N 3.15Å; T332-F392 VanDerWaalsContact CB-CE2 3.44Å; T332-F392 HydrophobicContact CG2-CD2 3.26Å; T332-F392 HydrophobicContact CG2-CE2 3.39Å; T332-F392 HydrophobicContact CG2-CG 4.34Å; T332-F396 HydrophobicContact CG2-CD2 4.4Å; T332-F396 HydrophobicContact CG2-CE2 3.82Å
333	T	53.5	Low	49.9	Very low	44 Å²	44	48.2 Å²	48.2	27%	0.27	24%	0.24	S	C	.	.	S	Bend	trans	-76.7	150.6	171.6	60.9	0	0	0	0	111.9	T330 R335 S336 S337	T330-T333 PolarHBondContact O-N 3.05Å; T330-T333 PolarHBondContact O-OG1 3.45Å; T333-R335 PolarHBondContact O-N 2.81Å; T333-S336 WeakPolarHBondContact O-CB 3.33Å; T333-S336 PolarHBondContact O-N 2.75Å; T333-S336 PolarHBondContact OG1-OG 3.25Å; T333-S337 PolarHBondContact O-N 2.7Å
334	K	48.1	Very low	49.4	Very low	92 Å²	92	56.4 Å²	56.4	40%	0.4	26%	0.264	S	S	.	.	H	α-helix	trans	-42.4	-38.5	174.9	-28.2	-165	170.5	-163.9	0	111.8	S337 A338 I386	K334-S337 PolarHBondContact O-N 3.21Å; K334-S337 PolarHBondContact O-OG 3.47Å; K334-A338 PolarHBondContact O-N 3.47Å; K334-I386 HydrophobicContact CB-CG2 4.12Å; K334-I386 WeakPolarHBondContact CB-O 3.34Å; K334-I386 HydrophobicContact CD-CB 4.16Å; K334-I386 HydrophobicContact CD-CG1 4.27Å; K334-I386 HydrophobicContact CD-CG2 3.26Å; K334-I386 VanDerWaalsContact CE-CD1 3.46Å; K334-I386 HydrophobicContact CG-CB 4.5Å; K334-I386 HydrophobicContact CG-CG2 3.23Å
335	R	50.9	Low	48.5	Very low	128 Å²	128	61.1 Å²	61.1	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-68.4	-39.5	-173.9	-72.4	-178	-173.9	-174.4	3.7	111.8	R179 T333 A338 A339 E351	R179-R335 VanDerWaalsContact NH1-CB 3.32Å; R179-R335 PolarHBondContact NH2-O 3.14Å; T333-R335 PolarHBondContact O-N 2.81Å; R335-A338 PolarHBondContact O-N 3.07Å; R335-A339 PolarHBondContact O-N 3.05Å; R335-E351 IonicContact CZ-OE2 3.15Å; R335-E351 IonicContact NH1-OE2 3.52Å; R335-E351 IonicContact NH2-OE1 2.7Å; R335-E351 PolarHBondContact NH2-OE1 2.92Å; R335-E351 IonicContact NH2-OE2 3.59Å; R335-E351 PolarHBondContact NH2-OE2 3.23Å
336	S	47.5	Very low	47.3	Very low	8 Å²	8	63.5 Å²	63.5	6%	0.056	31%	0.311	C	S	.	.	H	α-helix	trans	-72.1	-34.7	175.2	-61.8	0	0	0	0	113.5	T330 S331 T333 A338 A339 L340	T330-S336 PolarHBondContact O-OG 2.82Å; S331-S336 WeakPolarHBondContact O-CB 3.06Å; T333-S336 WeakPolarHBondContact O-CB 3.33Å; T333-S336 PolarHBondContact O-N 2.75Å; T333-S336 PolarHBondContact OG1-OG 3.25Å; S336-A338 VanDerWaalsContact C-N 3.35Å; S336-A339 WeakPolarHBondContact O-CB 3.22Å; S336-A339 PolarHBondContact O-N 2.95Å; S336-L340 PolarHBondContact O-N 3.2Å
337	S	42.2	Very low	46.1	Very low	5 Å²	5	67 Å²	67	4%	0.035	33%	0.331	C	S	.	.	H	α-helix	trans	-69.5	-30.9	172.6	45.2	0	0	0	0	113.5	T333 K334 R341 V342 Y343	T333-S337 PolarHBondContact O-N 2.7Å; K334-S337 PolarHBondContact O-N 3.21Å; K334-S337 PolarHBondContact O-OG 3.47Å; S337-R341 PolarHBondContact O-N 3.47Å; S337-V342 PolarHBondContact O-N 3.49Å; S337-Y343 PolarHBondContact O-N 2.6Å
338	A	44.5	Very low	45.4	Very low	50 Å²	50	72.1 Å²	72.1	41%	0.413	36%	0.364	S	S	.	.	H	α-helix	trans	-71.4	-37.3	171.4	0	0	0	0	0	111.7	K334 R335 S336 L340 R341	K334-A338 PolarHBondContact O-N 3.47Å; R335-A338 PolarHBondContact O-N 3.07Å; S336-A338 VanDerWaalsContact C-N 3.35Å; A338-L340 PolarHBondContact O-N 3.24Å; A338-R341 PolarHBondContact O-N 3.28Å; A338-R341 VanDerWaalsContact O-N 3.09Å
339	A	43.1	Very low	44.4	Very low	12 Å²	12	79.6 Å²	79.6	10%	0.099	40%	0.398	C	S	.	.	H	α-helix	trans	-55.8	-47.5	174.7	0	0	0	0	0	113.6	M171 L172 E175 R335 S336 R341	M171-A339 WeakPolarHBondContact CE-O 3.43Å; L172-A339 HydrophobicContact CD2-CB 4.4Å; E175-A339 HydrophobicContact CG-CB 4.35Å; E175-A339 VanDerWaalsContact OE1-CA 3.23Å; E175-A339 WeakPolarHBondContact OE1-CA 3.33Å; E175-A339 WeakPolarHBondContact OE1-CB 3.17Å; E175-A339 WeakPolarHBondContact OE2-CB 3.33Å; R335-A339 PolarHBondContact O-N 3.05Å; S336-A339 WeakPolarHBondContact O-CB 3.22Å; S336-A339 PolarHBondContact O-N 2.95Å; A339-R341 PolarHBondContact O-N 2.92Å
340	L	45.3	Very low	43.4	Very low	36 Å²	36	83.5 Å²	83.5	19%	0.188	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	4.3	-179.5	-75.8	149.6	0	0	0	112.2	I168 M171 L172 S336 A338 V342 F391	I168-L340 HydrophobicContact CG2-CD1 4.01Å; I168-L340 HydrophobicContact CG2-CD2 4.5Å; M171-L340 HydrophobicContact CE-CD2 4Å; M171-L340 HydrophobicContact CE-CG 4.33Å; M171-L340 HydrophobicContact SD-CD2 3.53Å; M171-L340 VanDerWaalsContact SD-CD2 3.53Å; M171-L340 HydrophobicContact SD-CG 4.36Å; L172-L340 HydrophobicContact CD1-CD1 4.29Å; L172-L340 HydrophobicContact CD2-CD1 3.74Å; L172-L340 HydrophobicContact CD2-CG 4.45Å; L172-L340 HydrophobicContact CG-CD1 4.1Å; S336-L340 PolarHBondContact O-N 3.2Å; A338-L340 PolarHBondContact O-N 3.24Å; L340-V342 HydrophobicContact CB-CG2 4.17Å; L340-V342 PolarHBondContact O-N 3.41Å; L340-F391 HydrophobicContact CB-CZ 4.37Å; L340-F391 HydrophobicContact CD1-CE1 3.82Å; L340-F391 HydrophobicContact CD1-CZ 3.72Å; L340-F391 HydrophobicContact CG-CZ 4.5Å
341	R	50.7	Low	42.6	Very low	163 Å²	163	85.3 Å²	85.3	62%	0.615	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	19.2	178.4	-55.3	-180	-175.3	157.7	6	114.7	S337 A338 A339 Y343 R456	S337-R341 PolarHBondContact O-N 3.47Å; A338-R341 PolarHBondContact O-N 3.28Å; A338-R341 VanDerWaalsContact O-N 3.09Å; A339-R341 PolarHBondContact O-N 2.92Å; R341-Y343 VanDerWaalsContact C-N 3.26Å; R341-R456 VanDerWaalsContact NH2-NH2 3.15Å
342	V	45.8	Very low	42.1	Very low	67 Å²	67	95.1 Å²	95.1	41%	0.406	47%	0.467	S	S	.	.	S	Bend	trans	-77.1	-22.3	176.4	-178.6	0	0	0	0	110.5	S337 L340 C388 F391	S337-V342 PolarHBondContact O-N 3.49Å; L340-V342 HydrophobicContact CB-CG2 4.17Å; L340-V342 PolarHBondContact O-N 3.41Å; V342-C388 HydrophobicContact CG1-CB 4.26Å; V342-F391 HydrophobicContact CB-CD2 4.4Å; V342-F391 HydrophobicContact CB-CG 4.28Å; V342-F391 HydrophobicContact CG1-CB 3.85Å; V342-F391 HydrophobicContact CG1-CD2 4.08Å; V342-F391 HydrophobicContact CG1-CG 3.91Å; V342-F391 HydrophobicContact CG2-CD2 3.86Å; V342-F391 HydrophobicContact CG2-CE2 3.95Å; V342-F391 HydrophobicContact CG2-CG 4.19Å; V342-F391 HydrophobicContact CG2-CZ 4.36Å
343	Y	39.4	Very low	41.5	Very low	48 Å²	48	95.5 Å²	95.5	19%	0.188	47%	0.471	C	S	.	.	S	Bend	trans	-121.8	111.7	173.1	-163.9	-104.9	0	0	0	110.2	S337 R341 R384 T385	S337-Y343 PolarHBondContact O-N 2.6Å; R341-Y343 VanDerWaalsContact C-N 3.26Å; Y343-R384 WeakPolarHBondContact OH-CD 3.45Å; Y343-R384 VanDerWaalsContact OH-CG 3.3Å; Y343-R384 WeakPolarHBondContact OH-CG 3.23Å; Y343-T385 PolarHBondContact OH-O 3.05Å; Y343-T385 VanDerWaalsContact OH-O 3.04Å
344	R	42.4	Very low	41.1	Very low	225 Å²	225	97.3 Å²	97.3	85%	0.849	47%	0.473	S	S	*	.			trans	-113.9	100.1	176.1	-175.9	177.1	173.3	149.8	0.1	106.3
345	N	35.9	Very low	40.5	Very low	109 Å²	109	95.3 Å²	95.3	58%	0.583	47%	0.47	S	S	*	.			trans	161.6	94.2	152	-80.2	-12.5	0	0	0	111.2
346	S	32.8	Very low	39.8	Very low	105 Å²	105	92.6 Å²	92.6	73%	0.734	47%	0.47	S	S	*	.			trans	170.1	129.4	142	49.9	0	0	0	0	108.3
347	E	34.9	Very low	38.8	Very low	181 Å²	181	100.7 Å²	100.7	85%	0.846	50%	0.504	S	S	*	.			trans	-49.6	141.8	171.9	-69.3	176.3	138.1	0	0	110.6	E349	E347-E349 PolarHBondContact O-N 3.26Å
348	P	37.2	Very low	38.1	Very low	121 Å²	121	104.5 Å²	104.5	79%	0.786	53%	0.53	S	S	*	.			trans	-69.4	102.3	163.7	28.8	-27.4	0	0	0	106.8	T350	P348-T350 PolarHBondContact O-N 2.96Å
349	E	33.4	Very low	37.4	Very low	160 Å²	160	112.1 Å²	112.1	75%	0.748	55%	0.554	S	S	*	*			trans	-49.4	129.9	159.3	-90.6	-175	150.1	0	0	107.6	E347 E351	E347-E349 PolarHBondContact O-N 3.26Å; E349-E351 PolarHBondContact O-N 2.9Å
350	T	32.5	Very low	36.6	Very low	145 Å²	145	113.8 Å²	113.8	89%	0.89	57%	0.572	S	S	*	*			trans	-64	82.9	-180	41.8	0	0	0	0	109.7	P348 R352	P348-T350 PolarHBondContact O-N 2.96Å; T350-R352 PolarHBondContact O-N 3.47Å
351	E	36.3	Very low	36	Very low	77 Å²	77	117.4 Å²	117.4	36%	0.36	59%	0.592	S	S	.	*			trans	-67	130.8	168.4	-84.2	-178.8	-162.8	0	0	109.7	R335 E349 R354	R335-E351 IonicContact CZ-OE2 3.15Å; R335-E351 IonicContact NH1-OE2 3.52Å; R335-E351 IonicContact NH2-OE1 2.7Å; R335-E351 PolarHBondContact NH2-OE1 2.92Å; R335-E351 IonicContact NH2-OE2 3.59Å; R335-E351 PolarHBondContact NH2-OE2 3.23Å; E349-E351 PolarHBondContact O-N 2.9Å; E351-R354 VanDerWaalsContact CD-NH2 3.34Å; E351-R354 IonicContact OE1-NH2 3.04Å; E351-R354 IonicContact OE2-CZ 3.72Å; E351-R354 IonicContact OE2-NE 2.82Å; E351-R354 IonicContact OE2-NH2 3.51Å
352	R	37.9	Very low	35.4	Very low	213 Å²	213	111.6 Å²	111.6	80%	0.804	57%	0.573	S	S	*	*			trans	-44.9	144.8	167.6	-167.2	174.8	-173.7	165.9	1.5	111	T350 R354	T350-R352 PolarHBondContact O-N 3.47Å; R352-R354 WeakPolarHBondContact O-CG 3.43Å; R352-R354 PolarHBondContact O-N 3.25Å
353	A	36.2	Very low	34.9	Very low	16 Å²	16	114.4 Å²	114.4	13%	0.132	59%	0.59	C	S	.	*			trans	-54.5	111.5	178.8	0	0	0	0	0	111.8	N183 W194	N183-A353 WeakPolarHBondContact O-CB 3.37Å; N183-A353 VanDerWaalsContact OD1-CA 3.31Å; N183-A353 WeakPolarHBondContact OD1-CA 3.48Å; W194-A353 HydrophobicContact CZ2-CB 4.28Å
354	R	45.8	Very low	34.9	Very low	82 Å²	82	116.6 Å²	116.6	31%	0.309	60%	0.602	S	S	.	*			trans	-106.2	144.7	178.5	-65.1	-179.2	-154	-163.6	5.3	110.9	N183 E351 R352 C356 D362	N183-R354 PolarHBondContact ND2-O 2.8Å; N183-R354 PolarHBondContact OD1-N 2.7Å; E351-R354 VanDerWaalsContact CD-NH2 3.34Å; E351-R354 IonicContact OE1-NH2 3.04Å; E351-R354 IonicContact OE2-CZ 3.72Å; E351-R354 IonicContact OE2-NE 2.82Å; E351-R354 IonicContact OE2-NH2 3.51Å; R352-R354 WeakPolarHBondContact O-CG 3.43Å; R352-R354 PolarHBondContact O-N 3.25Å; R354-C356 PolarHBondContact O-N 2.87Å; R354-D362 IonicContact CZ-OD1 3.19Å; R354-D362 IonicContact NH1-OD1 2.71Å; R354-D362 PolarHBondContact NH1-OD1 3.06Å; R354-D362 IonicContact NH1-OD2 3.81Å; R354-D362 IonicContact NH2-OD1 2.74Å; R354-D362 PolarHBondContact NH2-OD1 3.24Å
355	C	35.2	Very low	34.7	Very low	51 Å²	51	114.3 Å²	114.3	35%	0.345	61%	0.607	S	S	.	*			trans	-64.2	132.6	167.5	-177.9	0	0	0	0	109	F357 C358	C355-F357 PolarHBondContact O-N 3.31Å; C355-C358 HydrophobicContact CB-CB 4.01Å; C355-C358 PolarHBondContact O-N 3.42Å; C355-C358 VanDerWaalsContact O-N 3.08Å
356	C	37.4	Very low	35.2	Very low	71 Å²	71	112.8 Å²	112.8	48%	0.48	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.8	-10.2	-177.8	-156.1	0	0	0	0	113.7	R354	R354-C356 PolarHBondContact O-N 2.87Å
357	F	26.4	Very low	35.6	Very low	177 Å²	177	115.8 Å²	115.8	78%	0.776	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-3	-179.5	-82.6	-86.3	0	0	0	114.6	C355	C355-F357 PolarHBondContact O-N 3.31Å
358	C	26.8	Very low	36.2	Very low	86 Å²	86	113 Å²	113	58%	0.581	58%	0.583	S	S	*	*			trans	-100.7	106.6	-179.6	-65.8	0	0	0	0	110.4	C355 G360	C355-C358 HydrophobicContact CB-CB 4.01Å; C355-C358 PolarHBondContact O-N 3.42Å; C355-C358 VanDerWaalsContact O-N 3.08Å; C358-G360 VanDerWaalsContact C-N 3.29Å; C358-G360 PolarHBondContact O-N 2.84Å
359	F	29.2	Very low	36.5	Very low	210 Å²	210	113.6 Å²	113.6	92%	0.921	58%	0.575	S	S	*	*			trans	-71.1	84.5	165.7	-65.8	-86.9	0	0	0	108.9
360	G	27.2	Very low	37	Very low	46 Å²	46	114.2 Å²	114.2	47%	0.474	58%	0.575	S	S	.	*			trans	-89.6	130.9	171.8	0	0	0	0	0	110.7	C358 D362	C358-G360 VanDerWaalsContact C-N 3.29Å; C358-G360 PolarHBondContact O-N 2.84Å; G360-D362 PolarHBondContact O-N 3.24Å
361	D	33	Very low	37.6	Very low	112 Å²	112	110.9 Å²	110.9	60%	0.599	56%	0.555	S	S	*	*			trans	-52.3	122.1	176.3	-105.7	-25.2	0	0	0	111.4
362	D	37	Very low	38	Very low	41 Å²	41	114.6 Å²	114.6	22%	0.219	58%	0.583	C	S	.	*			trans	-86.6	100.5	154.8	-53.4	-49.6	0	0	0	105.8	K30 R354 G360 E364	K30-D362 IonicContact NZ-OD2 2.77Å; K30-D362 PolarHBondContact NZ-OD2 3.23Å; R354-D362 IonicContact CZ-OD1 3.19Å; R354-D362 IonicContact NH1-OD1 2.71Å; R354-D362 PolarHBondContact NH1-OD1 3.06Å; R354-D362 IonicContact NH1-OD2 3.81Å; R354-D362 IonicContact NH2-OD1 2.74Å; R354-D362 PolarHBondContact NH2-OD1 3.24Å; G360-D362 PolarHBondContact O-N 3.24Å; D362-E364 PolarHBondContact O-N 3.31Å
363	T	35.4	Very low	38.4	Very low	126 Å²	126	106.8 Å²	106.8	77%	0.773	56%	0.561	S	S	*	*			trans	-74.7	80.4	159.6	47.5	0	0	0	0	107.6
364	E	39.5	Very low	39.3	Very low	95 Å²	95	106.7 Å²	106.7	44%	0.444	56%	0.562	S	S	.	*			trans	-96.2	139.5	155.8	-77.3	170.5	-167	0	0	107.2	D362 Y366	D362-E364 PolarHBondContact O-N 3.31Å; E364-Y366 VanDerWaalsContact C-N 3.28Å; E364-Y366 HydrophobicContact CB-CD2 4.05Å; E364-Y366 HydrophobicContact CB-CE2 3.53Å; E364-Y366 VanDerWaalsContact O-CD2 3.26Å; E364-Y366 WeakPolarHBondContact O-CD2 3.45Å; E364-Y366 PolarHBondContact O-N 3.21Å; E364-Y366 PolarHBondContact OE2-OH 3.34Å
365	D	39.4	Very low	40.2	Very low	177 Å²	177	103.6 Å²	103.6	95%	0.947	55%	0.551	S	S	*	*			trans	-66.9	75.8	-176.6	-69.5	-42.8	0	0	0	111.8
366	Y	44.5	Very low	41.6	Very low	76 Å²	76	103.1 Å²	103.1	30%	0.298	55%	0.548	S	S	.	.			trans	-87.4	143.1	167.2	-64.7	-81.1	0	0	0	109.9	E364 E368 V378 D380	E364-Y366 VanDerWaalsContact C-N 3.28Å; E364-Y366 HydrophobicContact CB-CD2 4.05Å; E364-Y366 HydrophobicContact CB-CE2 3.53Å; E364-Y366 VanDerWaalsContact O-CD2 3.26Å; E364-Y366 WeakPolarHBondContact O-CD2 3.45Å; E364-Y366 PolarHBondContact O-N 3.21Å; E364-Y366 PolarHBondContact OE2-OH 3.34Å; Y366-E368 PolarHBondContact O-N 2.63Å; Y366-V378 HydrophobicContact CD1-CG1 4.49Å; Y366-V378 HydrophobicContact CD2-CG1 3.48Å; Y366-V378 VanDerWaalsContact CD2-CG1 3.48Å; Y366-V378 HydrophobicContact CE2-CG1 4.28Å; Y366-V378 HydrophobicContact CG-CG1 3.63Å; Y366-D380 HydrophobicContact CE1-CB 4.45Å
367	E	42.1	Very low	43	Very low	168 Å²	168	100.7 Å²	100.7	79%	0.785	53%	0.531	S	S	*	.			trans	-55.2	112.1	179.4	-66.8	-165.4	168.3	0	0	111.1	E369	E367-E369 PolarHBondContact O-N 2.78Å
368	E	46.7	Very low	45.3	Very low	122 Å²	122	93.7 Å²	93.7	57%	0.57	50%	0.503	S	S	*	.			trans	-80.9	100.2	-176.1	-68.2	-165.6	148.8	0	0	111.2	K28 Y366 K370	K28-E368 IonicContact NZ-OE1 2.87Å; K28-E368 PolarHBondContact NZ-OE1 3.4Å; Y366-E368 PolarHBondContact O-N 2.63Å; E368-K370 PolarHBondContact O-N 2.99Å; E368-K370 VanDerWaalsContact O-N 3.13Å
369	E	44.3	Very low	47.6	Very low	135 Å²	135	92.7 Å²	92.7	63%	0.631	49%	0.487	S	S	*	.			trans	-75.2	97.9	158.4	-102.5	-166	162.3	0	0	109.6	E367 T371	E367-E369 PolarHBondContact O-N 2.78Å; E369-T371 PolarHBondContact O-N 3.28Å
370	K	43	Very low	49.8	Very low	172 Å²	172	83.2 Å²	83.2	75%	0.748	45%	0.446	S	S	*	.			trans	-68.6	90.5	171.2	-77	177.2	-179.5	167.1	0	110.2	E368 T372	E368-K370 PolarHBondContact O-N 2.99Å; E368-K370 VanDerWaalsContact O-N 3.13Å; K370-T372 PolarHBondContact O-N 3.26Å
371	T	45.4	Very low	52.1	Low	76 Å²	76	81 Å²	81	47%	0.466	42%	0.423	S	S	.	.			trans	-62.4	123.9	164.4	54.2	0	0	0	0	109.1	E369 S373	E369-T371 PolarHBondContact O-N 3.28Å; T371-S373 PolarHBondContact O-N 3.12Å
372	T	45	Very low	54.1	Low	155 Å²	155	80.3 Å²	80.3	95%	0.951	42%	0.417	S	S	*	.	S	Bend	trans	-66.8	-0.1	-168.7	-27.3	0	0	0	0	114.5	K370	K370-T372 PolarHBondContact O-N 3.26Å
373	S	47.3	Very low	55.8	Low	48 Å²	48	87.3 Å²	87.3	34%	0.336	45%	0.448	S	S	.	.	S	Bend	trans	-166.7	117.5	171.9	-178.7	0	0	0	0	109.9	T371	T371-S373 PolarHBondContact O-N 3.12Å
374	G	55.6	Low	57.7	Low	14 Å²	14	88 Å²	88	14%	0.144	44%	0.437	C	S	.	.	S	Bend	trans	133.7	174	177.9	0	0	0	0	0	114.8	N24 S376	N24-G374 PolarHBondContact OD1-N 3.42Å; N24-G374 VanDerWaalsContact OD1-N 3.14Å; G374-S376 PolarHBondContact O-N 3.44Å
375	Q	62.8	Low	59.4	Low	17 Å²	17	83.7 Å²	83.7	8%	0.079	42%	0.417	C	S	.	.			trans	-61.4	128.9	172.5	-177.7	-175.3	13.7	0	0	110.5	S20 C21 C26 P27 I29	S20-Q375 VanDerWaalsContact CB-O 3.28Å; S20-Q375 WeakPolarHBondContact CB-O 3.09Å; C21-Q375 VanDerWaalsContact CB-OE1 3.31Å; C21-Q375 VanDerWaalsContact O-CB 3.31Å; C21-Q375 WeakPolarHBondContact O-CB 3.26Å; C21-Q375 PolarHBondContact O-N 3.08Å; C26-Q375 HydrophobicContact CB-CB 4.36Å; C26-Q375 HydrophobicContact CB-CG 4.08Å; P27-Q375 WeakPolarHBondContact O-CG 2.91Å; P27-Q375 PolarHBondContact O-NE2 3.49Å; I29-Q375 HydrophobicContact CG2-CG 4.32Å
376	S	64.5	Low	61	Low	42 Å²	42	76 Å²	76	29%	0.294	38%	0.376	S	S	.	.			trans	-72.6	134.3	176.7	57.8	0	0	0	0	111.5	K28 I29 G374	K28-S376 VanDerWaalsContact CG-OG 3.29Å; K28-S376 WeakPolarHBondContact CG-OG 3.32Å; I29-S376 PolarHBondContact N-O 3.28Å; G374-S376 PolarHBondContact O-N 3.44Å
377	V	67.9	Low	62.4	Low	19 Å²	19	72.6 Å²	72.6	12%	0.115	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131	178.6	-176.7	0	0	0	0	109.4	A18 I29 Q31	A18-V377 HydrophobicContact CB-CG1 3.76Å; A18-V377 HydrophobicContact CB-CG2 4.42Å; I29-V377 HydrophobicContact CG2-CG2 4.12Å; I29-V377 WeakPolarHBondContact O-CA 3.27Å; Q31-V377 HydrophobicContact CB-CG1 4.18Å
378	V	74.7	Confident	64.3	Low	30 Å²	30	66.1 Å²	66.1	18%	0.182	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120	175.6	179.1	0	0	0	0	109	K28 I29 K30 Q31 Y366 D380	K28-V378 HydrophobicContact CB-CG2 4.43Å; K28-V378 HydrophobicContact CD-CG2 4.44Å; I29-V378 PolarHBondContact O-N 3.24Å; K30-V378 WeakPolarHBondContact CA-O 3.32Å; K30-V378 HydrophobicContact CG-CB 4.41Å; Q31-V378 PolarHBondContact N-O 3.18Å; Y366-V378 HydrophobicContact CD1-CG1 4.49Å; Y366-V378 HydrophobicContact CD2-CG1 3.48Å; Y366-V378 VanDerWaalsContact CD2-CG1 3.48Å; Y366-V378 HydrophobicContact CE2-CG1 4.28Å; Y366-V378 HydrophobicContact CG-CG1 3.63Å; V378-D380 PolarHBondContact O-N 2.85Å; V378-D380 VanDerWaalsContact O-N 3.1Å
379	Y	75	Confident	66.1	Low	66 Å²	66	60.4 Å²	60.4	26%	0.259	31%	0.308	S	S	.	.			trans	-83.5	76.5	179.4	-69.1	-83.9	0	0	0	111	A18 Q31 E381	A18-Y379 HydrophobicContact CB-CE1 4.48Å; Q31-Y379 HydrophobicContact CB-CD1 4.41Å; Q31-Y379 HydrophobicContact CG-CD1 4.45Å; Y379-E381 VanDerWaalsContact C-N 3.25Å; Y379-E381 PolarHBondContact O-N 2.97Å
380	D	74.5	Confident	68.1	Low	10 Å²	10	54.7 Å²	54.7	5%	0.053	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	1.8	-172.7	63.4	-34.7	0	0	0	114.9	K30 Q31 S32 Y366 V378 I386	K30-D380 HydrophobicContact CB-CB 4.49Å; K30-D380 WeakPolarHBondContact CB-OD2 3.41Å; K30-D380 HydrophobicContact CD-CB 4.4Å; Q31-D380 PolarHBondContact N-OD1 3.01Å; S32-D380 WeakPolarHBondContact CB-OD1 3.17Å; S32-D380 WeakPolarHBondContact CB-OD2 3.2Å; S32-D380 PolarHBondContact N-OD1 2.72Å; S32-D380 PolarHBondContact OG-OD1 3.04Å; S32-D380 PolarHBondContact OG-OD2 3.05Å; Y366-D380 HydrophobicContact CE1-CB 4.45Å; V378-D380 PolarHBondContact O-N 2.85Å; V378-D380 VanDerWaalsContact O-N 3.1Å; D380-I386 HydrophobicContact CB-CD1 3.62Å; D380-I386 WeakPolarHBondContact O-CD1 3.44Å; D380-I386 WeakPolarHBondContact OD2-CD1 3.45Å
381	E	76.4	Confident	70.1	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	10.7	-174.8	-63.6	-167.7	118.3	0	0	114.8	S115 Y379 R384 I386 Y387 Y389	S115-E381 VanDerWaalsContact CB-O 3.25Å; S115-E381 WeakPolarHBondContact CB-O 3.27Å; S115-E381 PolarHBondContact N-O 2.94Å; S115-E381 VanDerWaalsContact OG-C 3.22Å; S115-E381 PolarHBondContact OG-O 2.98Å; S115-E381 VanDerWaalsContact OG-O 3.06Å; Y379-E381 VanDerWaalsContact C-N 3.25Å; Y379-E381 PolarHBondContact O-N 2.97Å; E381-R384 WeakPolarHBondContact CA-O 2.99Å; E381-I386 HydrophobicContact CG-CB 3.85Å; E381-I386 HydrophobicContact CG-CD1 3.74Å; E381-I386 HydrophobicContact CG-CG1 3.82Å; E381-I386 VanDerWaalsContact OE1-CB 3.28Å; E381-I386 WeakPolarHBondContact OE1-CB 3.49Å; E381-I386 PolarHBondContact OE1-N 3.18Å; E381-Y387 WeakPolarHBondContact OE1-CD1 3.33Å; E381-Y387 WeakPolarHBondContact OE1-CE1 3.18Å; E381-Y389 WeakPolarHBondContact OE1-CE1 3.43Å; E381-Y389 PolarHBondContact OE1-OH 3.19Å; E381-Y389 PolarHBondContact OE2-OH 2.91Å
382	E	75.9	Confident	71.9	Confident	97 Å²	97	44.5 Å²	44.5	45%	0.453	23%	0.232	S	C	.	.	S	Bend	trans	-61.1	-53	-174.7	-170.5	169.4	-170.9	0	0	112.5	S114 S115 T116	S114-E382 WeakPolarHBondContact CB-O 3.29Å; S114-E382 PolarHBondContact OG-O 3.29Å; S115-E382 VanDerWaalsContact OG-CA 3.29Å; S115-E382 WeakPolarHBondContact OG-CA 2.88Å; S115-E382 PolarHBondContact OG-N 2.78Å; T116-E382 HydrophobicContact CG2-CG 3.8Å
383	E	72.6	Confident	74.1	Confident	188 Å²	188	37.1 Å²	37.1	88%	0.879	19%	0.187	S	C	*	.	S	Bend	trans	-77.3	-39.7	177.8	-61.8	-171.5	164.7	0	0	112.6
384	R	74.6	Confident	76.1	Confident	142 Å²	142	38.3 Å²	38.3	54%	0.536	19%	0.186	S	C	.	.	S	Bend	trans	-150.9	134.7	-174.7	-170.8	177.1	-73.8	-157.7	2.9	112.5	H113 Y343 E381	H113-R384 CarbonylContact O-C 3.29Å; H113-R384 VanDerWaalsContact O-CA 3.25Å; H113-R384 WeakPolarHBondContact O-CA 3.33Å; Y343-R384 WeakPolarHBondContact OH-CD 3.45Å; Y343-R384 VanDerWaalsContact OH-CG 3.3Å; Y343-R384 WeakPolarHBondContact OH-CG 3.23Å; E381-R384 WeakPolarHBondContact CA-O 2.99Å
385	T	74.8	Confident	77.5	Confident	4 Å²	4	37.8 Å²	37.8	3%	0.025	18%	0.18	C	C	.	.			trans	-62.5	138.1	173.1	52.2	0	0	0	0	111.1	I112 H113 Y343 Y389	I112-T385 HydrophobicContact CG2-CG2 4.06Å; H113-T385 PolarHBondContact O-N 3.31Å; Y343-T385 PolarHBondContact OH-O 3.05Å; Y343-T385 VanDerWaalsContact OH-O 3.04Å; T385-Y389 HydrophobicContact CG2-CD2 4.38Å; T385-Y389 HydrophobicContact CG2-CE1 3.98Å; T385-Y389 HydrophobicContact CG2-CE2 3.81Å
386	I	72.8	Confident	78.7	Confident	16 Å²	16	37 Å²	37	8%	0.082	18%	0.177	C	C	.	.	S	Bend	trans	-85	-25.2	-173.1	-88	178.1	0	0	0	112.3	K334 D380 E381	K334-I386 HydrophobicContact CB-CG2 4.12Å; K334-I386 WeakPolarHBondContact CB-O 3.34Å; K334-I386 HydrophobicContact CD-CB 4.16Å; K334-I386 HydrophobicContact CD-CG1 4.27Å; K334-I386 HydrophobicContact CD-CG2 3.26Å; K334-I386 VanDerWaalsContact CE-CD1 3.46Å; K334-I386 HydrophobicContact CG-CB 4.5Å; K334-I386 HydrophobicContact CG-CG2 3.23Å; D380-I386 HydrophobicContact CB-CD1 3.62Å; D380-I386 WeakPolarHBondContact O-CD1 3.44Å; D380-I386 WeakPolarHBondContact OD2-CD1 3.45Å; E381-I386 HydrophobicContact CG-CB 3.85Å; E381-I386 HydrophobicContact CG-CD1 3.74Å; E381-I386 HydrophobicContact CG-CG1 3.82Å; E381-I386 VanDerWaalsContact OE1-CB 3.28Å; E381-I386 WeakPolarHBondContact OE1-CB 3.49Å; E381-I386 PolarHBondContact OE1-N 3.18Å
387	Y	74.3	Confident	80.1	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.016	17%	0.169	C	C	.	.	S	Bend	trans	-143.2	157.2	177.7	64.6	-77	0	0	0	108.8	T35 R36 H123 E381 Y389 F392	T35-Y387 PolarHBondContact OG1-OH 3.46Å; R36-Y387 HydrophobicContact CG-CE1 4.15Å; R36-Y387 HydrophobicContact CG-CE2 4.24Å; H123-Y387 AromaticContact NE2-CZ 3.87Å; H123-Y387 PolarHBondContact NE2-OH 3.46Å; E381-Y387 WeakPolarHBondContact OE1-CD1 3.33Å; E381-Y387 WeakPolarHBondContact OE1-CE1 3.18Å; Y387-Y389 HydrophobicContact CD1-CD1 4.32Å; Y387-Y389 HydrophobicContact CD1-CE1 4.11Å; Y387-Y389 AromaticContact CD2-CD1 3.93Å; Y387-Y389 HydrophobicContact CD2-CD1 3.93Å; Y387-Y389 AromaticContact CE1-CD1 3.96Å; Y387-Y389 HydrophobicContact CE1-CD1 3.96Å; Y387-Y389 AromaticContact CE1-CE1 3.59Å; Y387-Y389 HydrophobicContact CE1-CE1 3.59Å; Y387-Y389 AromaticContact CE2-CD1 3.5Å; Y387-Y389 HydrophobicContact CE2-CD1 3.5Å; Y387-Y389 HydrophobicContact CE2-CE1 4.02Å; Y387-Y389 HydrophobicContact CG-CD1 4.34Å; Y387-Y389 AromaticContact CZ-CD1 3.53Å; Y387-Y389 AromaticContact CZ-CE1 3.55Å; Y387-Y389 WeakPolarHBondContact O-CD1 3.28Å; Y387-Y389 PolarHBondContact O-N 2.7Å; Y387-Y389 VanDerWaalsContact O-N 3.15Å; Y387-F392 HydrophobicContact CD2-CB 3.71Å; Y387-F392 HydrophobicContact CD2-CD2 4.12Å; Y387-F392 HydrophobicContact CD2-CG 4.08Å; Y387-F392 HydrophobicContact CE2-CB 3.62Å; Y387-F392 HydrophobicContact CE2-CD1 4.13Å; Y387-F392 AromaticContact CE2-CD2 3.7Å; Y387-F392 HydrophobicContact CE2-CD2 3.7Å; Y387-F392 HydrophobicContact CE2-CE2 4.4Å; Y387-F392 AromaticContact CE2-CG 3.55Å; Y387-F392 HydrophobicContact CE2-CG 3.55Å
388	C	81.4	Confident	81.2	Confident	32 Å²	32	35.8 Å²	35.8	22%	0.216	17%	0.165	C	C	.	.			trans	-73.9	108.3	175	-179.6	0	0	0	0	109.9	V342 S390 F391 F392	V342-C388 HydrophobicContact CG1-CB 4.26Å; C388-S390 VanDerWaalsContact C-N 3.31Å; C388-S390 PolarHBondContact O-N 2.68Å; C388-F391 HydrophobicContact CB-CB 3.89Å; C388-F391 PolarHBondContact O-N 3.34Å; C388-F392 WeakPolarHBondContact O-CB 3.38Å; C388-F392 PolarHBondContact O-N 3.21Å
389	Y	84.7	Confident	81.8	Confident	1 Å²	1	34.4 Å²	34.4	0%	0.004	16%	0.156	C	C	.	.	H	α-helix	trans	-57.9	-41.4	-179.4	-65.1	-10.1	0	0	0	112.8	I112 A120 H123 N124 E381 T385 Y387 F391 F392 H393	I112-Y389 HydrophobicContact CB-CD2 4.01Å; I112-Y389 HydrophobicContact CB-CE2 4.49Å; I112-Y389 HydrophobicContact CD1-CD2 4.17Å; I112-Y389 HydrophobicContact CG2-CD2 3.78Å; I112-Y389 HydrophobicContact CG2-CE2 3.76Å; A120-Y389 HydrophobicContact CB-CE2 4.25Å; H123-Y389 HydrophobicContact CB-CD2 4.4Å; H123-Y389 HydrophobicContact CB-CE2 4.5Å; H123-Y389 AromaticContact CD2-CD1 3.88Å; H123-Y389 AromaticContact CD2-CD2 3.47Å; H123-Y389 VanDerWaalsContact CD2-CD2 3.47Å; H123-Y389 WeakPolarHBondContact CD2-CD2 3.39Å; H123-Y389 AromaticContact CD2-CE1 3.82Å; H123-Y389 AromaticContact CD2-CE2 3.42Å; H123-Y389 VanDerWaalsContact CD2-CE2 3.42Å; H123-Y389 WeakPolarHBondContact CD2-CE2 3.39Å; H123-Y389 AromaticContact CD2-CG 3.7Å; H123-Y389 AromaticContact CD2-CZ 3.58Å; H123-Y389 AromaticContact CG-CD2 3.96Å; H123-Y389 AromaticContact NE2-CD1 3.6Å; H123-Y389 AromaticContact NE2-CD2 3.97Å; H123-Y389 AromaticContact NE2-CE1 3.78Å; H123-Y389 AromaticContact NE2-CG 3.69Å; N124-Y389 PolarHBondContact ND2-OH 2.94Å; E381-Y389 WeakPolarHBondContact OE1-CE1 3.43Å; E381-Y389 PolarHBondContact OE1-OH 3.19Å; E381-Y389 PolarHBondContact OE2-OH 2.91Å; T385-Y389 HydrophobicContact CG2-CD2 4.38Å; T385-Y389 HydrophobicContact CG2-CE1 3.98Å; T385-Y389 HydrophobicContact CG2-CE2 3.81Å; Y387-Y389 HydrophobicContact CD1-CD1 4.32Å; Y387-Y389 HydrophobicContact CD1-CE1 4.11Å; Y387-Y389 AromaticContact CD2-CD1 3.93Å; Y387-Y389 HydrophobicContact CD2-CD1 3.93Å; Y387-Y389 AromaticContact CE1-CD1 3.96Å; Y387-Y389 HydrophobicContact CE1-CD1 3.96Å; Y387-Y389 AromaticContact CE1-CE1 3.59Å; Y387-Y389 HydrophobicContact CE1-CE1 3.59Å; Y387-Y389 AromaticContact CE2-CD1 3.5Å; Y387-Y389 HydrophobicContact CE2-CD1 3.5Å; Y387-Y389 HydrophobicContact CE2-CE1 4.02Å; Y387-Y389 HydrophobicContact CG-CD1 4.34Å; Y387-Y389 AromaticContact CZ-CD1 3.53Å; Y387-Y389 AromaticContact CZ-CE1 3.55Å; Y387-Y389 WeakPolarHBondContact O-CD1 3.28Å; Y387-Y389 PolarHBondContact O-N 2.7Å; Y387-Y389 VanDerWaalsContact O-N 3.15Å; Y389-F391 PolarHBondContact O-N 3.09Å; Y389-F392 WeakPolarHBondContact O-CB 3.25Å; Y389-F392 PolarHBondContact O-N 3.31Å; Y389-H393 PolarHBondContact O-CD2 3.23Å; Y389-H393 PolarHBondContact O-N 3.25Å; Y389-H393 VanDerWaalsContact O-N 3.1Å
390	S	86.7	Confident	82.6	Confident	15 Å²	15	31.2 Å²	31.2	11%	0.105	14%	0.144	C	C	.	.	H	α-helix	trans	-64.1	-43.6	179.3	178.4	0	0	0	0	112.2	S106 T109 L110 C388 H393 F394	S106-S390 VanDerWaalsContact O-CB 3.27Å; S106-S390 WeakPolarHBondContact O-CB 3.41Å; S106-S390 PolarHBondContact O-OG 2.67Å; S106-S390 PolarHBondContact OG-O 3.14Å; S106-S390 PolarHBondContact OG-OG 3.16Å; T109-S390 VanDerWaalsContact OG1-CA 3.31Å; T109-S390 WeakPolarHBondContact OG1-CA 3.49Å; T109-S390 PolarHBondContact OG1-N 2.87Å; L110-S390 WeakPolarHBondContact CD2-OG 3.29Å; C388-S390 VanDerWaalsContact C-N 3.31Å; C388-S390 PolarHBondContact O-N 2.68Å; S390-H393 PolarHBondContact O-N 3.23Å; S390-F394 WeakPolarHBondContact O-CB 3.49Å; S390-F394 PolarHBondContact O-N 3.04Å
391	F	84.7	Confident	83.4	Confident	31 Å²	31	30.9 Å²	30.9	14%	0.136	14%	0.142	C	C	.	.	H	α-helix	trans	-65.9	-40.3	177.2	-176.1	-106.1	0	0	0	111.9	L340 V342 C388 Y389 H393 F394 V395	L340-F391 HydrophobicContact CB-CZ 4.37Å; L340-F391 HydrophobicContact CD1-CE1 3.82Å; L340-F391 HydrophobicContact CD1-CZ 3.72Å; L340-F391 HydrophobicContact CG-CZ 4.5Å; V342-F391 HydrophobicContact CB-CD2 4.4Å; V342-F391 HydrophobicContact CB-CG 4.28Å; V342-F391 HydrophobicContact CG1-CB 3.85Å; V342-F391 HydrophobicContact CG1-CD2 4.08Å; V342-F391 HydrophobicContact CG1-CG 3.91Å; V342-F391 HydrophobicContact CG2-CD2 3.86Å; V342-F391 HydrophobicContact CG2-CE2 3.95Å; V342-F391 HydrophobicContact CG2-CG 4.19Å; V342-F391 HydrophobicContact CG2-CZ 4.36Å; C388-F391 HydrophobicContact CB-CB 3.89Å; C388-F391 PolarHBondContact O-N 3.34Å; Y389-F391 PolarHBondContact O-N 3.09Å; F391-H393 PolarHBondContact O-N 3.1Å; F391-F394 WeakPolarHBondContact O-CB 3.42Å; F391-F394 PolarHBondContact O-N 3.15Å; F391-V395 HydrophobicContact CD1-CG2 4.2Å; F391-V395 HydrophobicContact CE1-CG2 3.64Å; F391-V395 HydrophobicContact CE2-CG2 4.15Å; F391-V395 HydrophobicContact CZ-CG2 3.58Å; F391-V395 WeakPolarHBondContact O-CG2 3.43Å; F391-V395 PolarHBondContact O-N 3.3Å
392	F	84.6	Confident	83.9	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-53.7	-52.4	174.3	166.6	-91.6	0	0	0	111.8	R36 Y39 T332 Y387 C388 Y389 F394 V395 F396	R36-F392 HydrophobicContact CB-CE2 3.97Å; R36-F392 HydrophobicContact CB-CZ 4.24Å; R36-F392 HydrophobicContact CG-CD2 4.15Å; R36-F392 HydrophobicContact CG-CE2 3.49Å; R36-F392 VanDerWaalsContact CG-CE2 3.49Å; R36-F392 HydrophobicContact CG-CZ 3.96Å; Y39-F392 AromaticContact CD2-CE1 3.68Å; Y39-F392 HydrophobicContact CD2-CE1 3.68Å; Y39-F392 HydrophobicContact CD2-CZ 4.05Å; Y39-F392 HydrophobicContact CE2-CE1 4.4Å; Y39-F392 AromaticContact CG-CE1 3.96Å; Y39-F392 HydrophobicContact CG-CE1 3.96Å; Y39-F392 HydrophobicContact CG-CZ 4.27Å; T332-F392 VanDerWaalsContact CB-CE2 3.44Å; T332-F392 HydrophobicContact CG2-CD2 3.26Å; T332-F392 HydrophobicContact CG2-CE2 3.39Å; T332-F392 HydrophobicContact CG2-CG 4.34Å; Y387-F392 HydrophobicContact CD2-CB 3.71Å; Y387-F392 HydrophobicContact CD2-CD2 4.12Å; Y387-F392 HydrophobicContact CD2-CG 4.08Å; Y387-F392 HydrophobicContact CE2-CB 3.62Å; Y387-F392 HydrophobicContact CE2-CD1 4.13Å; Y387-F392 AromaticContact CE2-CD2 3.7Å; Y387-F392 HydrophobicContact CE2-CD2 3.7Å; Y387-F392 HydrophobicContact CE2-CE2 4.4Å; Y387-F392 AromaticContact CE2-CG 3.55Å; Y387-F392 HydrophobicContact CE2-CG 3.55Å; C388-F392 WeakPolarHBondContact O-CB 3.38Å; C388-F392 PolarHBondContact O-N 3.21Å; Y389-F392 WeakPolarHBondContact O-CB 3.25Å; Y389-F392 PolarHBondContact O-N 3.31Å; F392-F394 VanDerWaalsContact C-N 3.33Å; F392-F394 PolarHBondContact O-N 3.41Å; F392-V395 PolarHBondContact O-N 3.42Å; F392-F396 HydrophobicContact CD1-CD2 4.33Å; F392-F396 HydrophobicContact CD2-CD2 4.44Å; F392-F396 HydrophobicContact CD2-CE2 4.17Å; F392-F396 AromaticContact CE1-CD2 3.93Å; F392-F396 HydrophobicContact CE1-CD2 3.93Å; F392-F396 AromaticContact CE1-CE2 3.91Å; F392-F396 HydrophobicContact CE1-CE2 3.91Å; F392-F396 HydrophobicContact CE2-CD2 4.05Å; F392-F396 AromaticContact CE2-CE2 3.43Å; F392-F396 HydrophobicContact CE2-CE2 3.43Å; F392-F396 VanDerWaalsContact CE2-CE2 3.43Å; F392-F396 HydrophobicContact CE2-CZ 4.47Å; F392-F396 AromaticContact CZ-CD2 3.78Å; F392-F396 HydrophobicContact CZ-CD2 3.78Å; F392-F396 AromaticContact CZ-CE2 3.27Å; F392-F396 HydrophobicContact CZ-CE2 3.27Å; F392-F396 HydrophobicContact CZ-CZ 4.27Å; F392-F396 WeakPolarHBondContact O-CD2 3.3Å; F392-F396 PolarHBondContact O-N 3.06Å
393	H	90.1	Very high	84.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-33.4	178.1	-75	-59.1	0	0	0	112.8	Y39 F102 F105 H123 Y389 S390 F391 V395 F396 F397	Y39-H393 AromaticContact CD1-CE1 3.87Å; Y39-H393 AromaticContact CE1-CE1 3.55Å; Y39-H393 AromaticContact CE2-CE1 3.73Å; Y39-H393 AromaticContact CZ-CE1 3.47Å; Y39-H393 VanDerWaalsContact CZ-CE1 3.47Å; Y39-H393 AromaticContact CZ-NE2 3.95Å; F102-H393 AromaticContact CD1-ND1 3.67Å; F105-H393 HydrophobicContact CB-CB 4.32Å; H123-H393 AromaticContact CE1-CE1 3.87Å; H123-H393 AromaticContact CE1-NE2 3.11Å; H123-H393 PolarHBondContact CE1-NE2 2.83Å; H123-H393 AromaticContact ND1-CD2 3.97Å; H123-H393 AromaticContact ND1-CE1 3.86Å; H123-H393 AromaticContact ND1-NE2 2.98Å; H123-H393 PolarHBondContact ND1-NE2 3.03Å; Y389-H393 PolarHBondContact O-CD2 3.23Å; Y389-H393 PolarHBondContact O-N 3.25Å; Y389-H393 VanDerWaalsContact O-N 3.1Å; S390-H393 PolarHBondContact O-N 3.23Å; F391-H393 PolarHBondContact O-N 3.1Å; H393-V395 VanDerWaalsContact C-N 3.33Å; H393-V395 PolarHBondContact O-N 2.88Å; H393-F396 PolarHBondContact O-N 2.89Å; H393-F397 PolarHBondContact O-N 3.4Å
394	F	89.8	Confident	84.9	Confident	73 Å²	73	18.7 Å²	18.7	32%	0.32	8%	0.084	S	C	.	.	H	α-helix	trans	-63.4	-39.3	175.1	-173.2	-108.8	0	0	0	112.2	S390 F391 F392 F397 L398	S390-F394 WeakPolarHBondContact O-CB 3.49Å; S390-F394 PolarHBondContact O-N 3.04Å; F391-F394 WeakPolarHBondContact O-CB 3.42Å; F391-F394 PolarHBondContact O-N 3.15Å; F392-F394 VanDerWaalsContact C-N 3.33Å; F392-F394 PolarHBondContact O-N 3.41Å; F394-F397 AromaticContact CD2-CD1 3.99Å; F394-F397 HydrophobicContact CD2-CD1 3.99Å; F394-F397 AromaticContact CE2-CD1 3.92Å; F394-F397 HydrophobicContact CE2-CD1 3.92Å; F394-F397 HydrophobicContact CE2-CE1 4.14Å; F394-F397 WeakPolarHBondContact O-CB 3.29Å; F394-F397 PolarHBondContact O-N 3.39Å; F394-L398 HydrophobicContact CD1-CD1 3.93Å; F394-L398 HydrophobicContact CD1-CG 4.39Å; F394-L398 HydrophobicContact CE1-CD1 3.5Å; F394-L398 VanDerWaalsContact CE1-CD1 3.5Å; F394-L398 HydrophobicContact CE1-CG 4.05Å; F394-L398 HydrophobicContact CZ-CD1 4.05Å; F394-L398 HydrophobicContact CZ-CD2 4.28Å; F394-L398 HydrophobicContact CZ-CG 4.18Å; F394-L398 WeakPolarHBondContact O-CG 3.45Å; F394-L398 PolarHBondContact O-N 3.49Å
395	V	84.9	Confident	85.4	Confident	2 Å²	2	12 Å²	12	1%	0.012	6%	0.059	C	C	.	.	H	α-helix	trans	-64.3	-41.4	174	171.2	0	0	0	0	111.1	F165 S331 F391 F392 H393 L398 G399	F165-V395 HydrophobicContact CD2-CG1 4.5Å; F165-V395 HydrophobicContact CE2-CG1 3.94Å; S331-V395 WeakPolarHBondContact OG-CG1 3.29Å; F391-V395 HydrophobicContact CD1-CG2 4.2Å; F391-V395 HydrophobicContact CE1-CG2 3.64Å; F391-V395 HydrophobicContact CE2-CG2 4.15Å; F391-V395 HydrophobicContact CZ-CG2 3.58Å; F391-V395 WeakPolarHBondContact O-CG2 3.43Å; F391-V395 PolarHBondContact O-N 3.3Å; F392-V395 PolarHBondContact O-N 3.42Å; H393-V395 VanDerWaalsContact C-N 3.33Å; H393-V395 PolarHBondContact O-N 2.88Å; V395-L398 PolarHBondContact O-N 3.43Å; V395-G399 PolarHBondContact O-N 2.59Å
396	F	88.7	Confident	85.5	Confident	1 Å²	1	12.8 Å²	12.8	0%	0.004	7%	0.065	C	C	.	.	H	α-helix	trans	-65.7	-37	174.5	-87.6	-75.9	0	0	0	112.9	A40 F43 F102 C328 T332 F392 H393 G399 S400	A40-F396 HydrophobicContact CB-CZ 4.17Å; F43-F396 HydrophobicContact CB-CD1 3.87Å; F43-F396 HydrophobicContact CB-CE1 3.73Å; F43-F396 HydrophobicContact CD1-CE1 4.49Å; F43-F396 AromaticContact CD2-CD1 3.54Å; F43-F396 HydrophobicContact CD2-CD1 3.54Å; F43-F396 HydrophobicContact CD2-CE1 4.14Å; F43-F396 HydrophobicContact CE2-CD1 4.2Å; F43-F396 AromaticContact CG-CD1 3.77Å; F43-F396 HydrophobicContact CG-CD1 3.77Å; F43-F396 AromaticContact CG-CE1 3.87Å; F43-F396 HydrophobicContact CG-CE1 3.87Å; F102-F396 HydrophobicContact CB-CB 4.15Å; F102-F396 HydrophobicContact CD1-CB 3.43Å; F102-F396 VanDerWaalsContact CD1-CB 3.43Å; F102-F396 HydrophobicContact CD1-CG 4.06Å; F102-F396 HydrophobicContact CD2-CB 4.01Å; F102-F396 HydrophobicContact CE1-CB 3.7Å; F102-F396 HydrophobicContact CE1-CD1 4.13Å; F102-F396 HydrophobicContact CE1-CD2 4.35Å; F102-F396 AromaticContact CE1-CG 3.81Å; F102-F396 HydrophobicContact CE1-CG 3.81Å; F102-F396 HydrophobicContact CE2-CB 4.27Å; F102-F396 HydrophobicContact CE2-CD1 4.4Å; F102-F396 HydrophobicContact CG-CB 3.6Å; F102-F396 HydrophobicContact CZ-CB 4.12Å; F102-F396 AromaticContact CZ-CD1 3.98Å; F102-F396 HydrophobicContact CZ-CD1 3.98Å; F102-F396 HydrophobicContact CZ-CG 4.13Å; C328-F396 HydrophobicContact CB-CE1 4.02Å; C328-F396 HydrophobicContact CB-CZ 4.14Å; T332-F396 HydrophobicContact CG2-CD2 4.4Å; T332-F396 HydrophobicContact CG2-CE2 3.82Å; F392-F396 HydrophobicContact CD1-CD2 4.33Å; F392-F396 HydrophobicContact CD2-CD2 4.44Å; F392-F396 HydrophobicContact CD2-CE2 4.17Å; F392-F396 AromaticContact CE1-CD2 3.93Å; F392-F396 HydrophobicContact CE1-CD2 3.93Å; F392-F396 AromaticContact CE1-CE2 3.91Å; F392-F396 HydrophobicContact CE1-CE2 3.91Å; F392-F396 HydrophobicContact CE2-CD2 4.05Å; F392-F396 AromaticContact CE2-CE2 3.43Å; F392-F396 HydrophobicContact CE2-CE2 3.43Å; F392-F396 VanDerWaalsContact CE2-CE2 3.43Å; F392-F396 HydrophobicContact CE2-CZ 4.47Å; F392-F396 AromaticContact CZ-CD2 3.78Å; F392-F396 HydrophobicContact CZ-CD2 3.78Å; F392-F396 AromaticContact CZ-CE2 3.27Å; F392-F396 HydrophobicContact CZ-CE2 3.27Å; F392-F396 HydrophobicContact CZ-CZ 4.27Å; F392-F396 WeakPolarHBondContact O-CD2 3.3Å; F392-F396 PolarHBondContact O-N 3.06Å; H393-F396 PolarHBondContact O-N 2.89Å; F396-G399 PolarHBondContact O-N 3.46Å; F396-S400 PolarHBondContact O-N 2.89Å
397	F	93.9	Very high	85.6	Confident	31 Å²	31	13.3 Å²	13.3	14%	0.136	7%	0.068	C	C	.	.	H	α-helix	trans	-58.5	-52.3	170.6	161.1	-106.8	0	0	0	111	A99 F102 F103 H393 F394 G399 S400 L401	A99-F397 HydrophobicContact CB-CD2 3.88Å; A99-F397 HydrophobicContact CB-CE2 4Å; A99-F397 WeakPolarHBondContact O-CD2 3.33Å; F102-F397 HydrophobicContact CB-CB 4.1Å; F103-F397 HydrophobicContact CB-CD2 3.75Å; F103-F397 HydrophobicContact CB-CE2 4.16Å; F103-F397 HydrophobicContact CB-CG 4.16Å; F103-F397 HydrophobicContact CD2-CD1 4.17Å; F103-F397 HydrophobicContact CD2-CD2 4.28Å; F103-F397 HydrophobicContact CD2-CE1 4.22Å; F103-F397 HydrophobicContact CD2-CE2 4.31Å; F103-F397 HydrophobicContact CD2-CG 4.19Å; F103-F397 HydrophobicContact CD2-CZ 4.28Å; F103-F397 HydrophobicContact CG-CD2 4.35Å; F103-F397 HydrophobicContact CG-CE2 4.4Å; H393-F397 PolarHBondContact O-N 3.4Å; F394-F397 AromaticContact CD2-CD1 3.99Å; F394-F397 HydrophobicContact CD2-CD1 3.99Å; F394-F397 AromaticContact CE2-CD1 3.92Å; F394-F397 HydrophobicContact CE2-CD1 3.92Å; F394-F397 HydrophobicContact CE2-CE1 4.14Å; F394-F397 WeakPolarHBondContact O-CB 3.29Å; F394-F397 PolarHBondContact O-N 3.39Å; F397-G399 VanDerWaalsContact C-N 3.28Å; F397-G399 PolarHBondContact O-N 3.32Å; F397-S400 WeakPolarHBondContact O-CB 3.45Å; F397-S400 PolarHBondContact O-N 3.29Å; F397-S400 VanDerWaalsContact O-N 3.1Å; F397-S400 PolarHBondContact O-OG 2.92Å; F397-L401 HydrophobicContact CE1-CD1 4.08Å; F397-L401 HydrophobicContact CE2-CD1 4.08Å; F397-L401 HydrophobicContact CE2-CG 4.41Å; F397-L401 HydrophobicContact CZ-CD1 3.72Å; F397-L401 PolarHBondContact O-N 3.13Å
398	L	90.7	Very high	85.7	Confident	4 Å²	4	13.1 Å²	13.1	2%	0.021	7%	0.067	C	C	.	.	H	α-helix	trans	-61.3	-37.7	176	-69.3	177.4	0	0	0	112.3	I164 F165 I168 F394 V395 S400 L401 Y402	I164-L398 HydrophobicContact CB-CD1 4.43Å; I164-L398 HydrophobicContact CB-CD2 4.39Å; I164-L398 HydrophobicContact CG2-CD1 3.68Å; I164-L398 HydrophobicContact CG2-CD2 4.36Å; F165-L398 HydrophobicContact CB-CB 4Å; F165-L398 HydrophobicContact CD2-CB 3.89Å; F165-L398 HydrophobicContact CG-CB 4.41Å; I168-L398 HydrophobicContact CD1-CD1 3.71Å; F394-L398 HydrophobicContact CD1-CD1 3.93Å; F394-L398 HydrophobicContact CD1-CG 4.39Å; F394-L398 HydrophobicContact CE1-CD1 3.5Å; F394-L398 VanDerWaalsContact CE1-CD1 3.5Å; F394-L398 HydrophobicContact CE1-CG 4.05Å; F394-L398 HydrophobicContact CZ-CD1 4.05Å; F394-L398 HydrophobicContact CZ-CD2 4.28Å; F394-L398 HydrophobicContact CZ-CG 4.18Å; F394-L398 WeakPolarHBondContact O-CG 3.45Å; F394-L398 PolarHBondContact O-N 3.49Å; V395-L398 PolarHBondContact O-N 3.43Å; L398-S400 VanDerWaalsContact C-N 3.29Å; L398-S400 PolarHBondContact O-N 3.09Å; L398-L401 WeakPolarHBondContact O-CB 3.43Å; L398-L401 PolarHBondContact O-N 3.3Å; L398-Y402 PolarHBondContact O-N 3.48Å
399	G	86.8	Confident	85.1	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-61.6	-36.4	174.8	0	0	0	0	0	112.5	F165 V395 F396 F397 L401 Y402 V403	F165-G399 VanDerWaalsContact CD2-CA 3.48Å; F165-G399 VanDerWaalsContact CD2-N 3.29Å; F165-G399 VanDerWaalsContact CE2-CA 3.44Å; V395-G399 PolarHBondContact O-N 2.59Å; F396-G399 PolarHBondContact O-N 3.46Å; F397-G399 VanDerWaalsContact C-N 3.28Å; F397-G399 PolarHBondContact O-N 3.32Å; G399-L401 VanDerWaalsContact C-N 3.34Å; G399-Y402 WeakPolarHBondContact O-CB 3.31Å; G399-Y402 PolarHBondContact O-N 2.84Å; G399-V403 WeakPolarHBondContact O-CG2 3.33Å; G399-V403 PolarHBondContact O-N 2.92Å
400	S	91.7	Very high	84.3	Confident	0 Å²	0	17 Å²	17	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.3	-37.2	177.8	71.4	0	0	0	0	112.1	A99 F396 F397 L398 V403 M404	A99-S400 WeakPolarHBondContact CA-OG 3.36Å; A99-S400 WeakPolarHBondContact CB-OG 3.4Å; F396-S400 PolarHBondContact O-N 2.89Å; F397-S400 WeakPolarHBondContact O-CB 3.45Å; F397-S400 PolarHBondContact O-N 3.29Å; F397-S400 VanDerWaalsContact O-N 3.1Å; F397-S400 PolarHBondContact O-OG 2.92Å; L398-S400 VanDerWaalsContact C-N 3.29Å; L398-S400 PolarHBondContact O-N 3.09Å; S400-V403 PolarHBondContact O-N 3.26Å; S400-M404 WeakPolarHBondContact O-CB 3.46Å; S400-M404 PolarHBondContact O-N 3.1Å
401	L	92	Very high	83	Confident	2 Å²	2	18.6 Å²	18.6	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-67.1	-40.5	172.8	-60	-179.6	0	0	0	111.3	A99 W154 I157 F397 L398 G399 M404 M405	A99-L401 HydrophobicContact CB-CD2 4.23Å; W154-L401 HydrophobicContact CE3-CD2 4.2Å; W154-L401 HydrophobicContact CZ3-CD2 3.79Å; I157-L401 HydrophobicContact CG2-CD1 4.39Å; F397-L401 HydrophobicContact CE1-CD1 4.08Å; F397-L401 HydrophobicContact CE2-CD1 4.08Å; F397-L401 HydrophobicContact CE2-CG 4.41Å; F397-L401 HydrophobicContact CZ-CD1 3.72Å; F397-L401 PolarHBondContact O-N 3.13Å; L398-L401 WeakPolarHBondContact O-CB 3.43Å; L398-L401 PolarHBondContact O-N 3.3Å; G399-L401 VanDerWaalsContact C-N 3.34Å; L401-M404 HydrophobicContact CD2-CE 4.07Å; L401-M404 WeakPolarHBondContact O-CB 3.49Å; L401-M404 PolarHBondContact O-N 2.99Å; L401-M405 WeakPolarHBondContact O-CG 3.28Å; L401-M405 PolarHBondContact O-N 3.03Å; L401-M405 VanDerWaalsContact O-N 3.12Å
402	Y	85.7	Confident	81.5	Confident	27 Å²	27	22 Å²	22	11%	0.106	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-44.4	174	175.9	-105.7	0	0	0	112.5	F165 L166 I324 L398 G399 M405 S406 W410	F165-Y402 AromaticContact CD1-CD1 3.83Å; F165-Y402 HydrophobicContact CD1-CD1 3.83Å; F165-Y402 HydrophobicContact CD1-CD2 4.27Å; F165-Y402 AromaticContact CD1-CG 3.62Å; F165-Y402 HydrophobicContact CD1-CG 3.62Å; F165-Y402 AromaticContact CE1-CD1 3.88Å; F165-Y402 HydrophobicContact CE1-CD1 3.88Å; F165-Y402 HydrophobicContact CE1-CG 4.16Å; F165-Y402 HydrophobicContact CG-CG 4.45Å; L166-Y402 HydrophobicContact CD1-CD2 4.24Å; L166-Y402 HydrophobicContact CD1-CE2 3.89Å; L166-Y402 HydrophobicContact CD2-CD2 4.15Å; L166-Y402 HydrophobicContact CD2-CE2 3.48Å; L166-Y402 VanDerWaalsContact CD2-CE2 3.48Å; L166-Y402 HydrophobicContact CG-CD2 3.88Å; L166-Y402 HydrophobicContact CG-CE2 3.64Å; I324-Y402 HydrophobicContact CD1-CE1 4.14Å; I324-Y402 HydrophobicContact CG1-CE1 4.13Å; L398-Y402 PolarHBondContact O-N 3.48Å; G399-Y402 WeakPolarHBondContact O-CB 3.31Å; G399-Y402 PolarHBondContact O-N 2.84Å; Y402-M405 PolarHBondContact O-N 2.96Å; Y402-S406 WeakPolarHBondContact CE2-OG 3.31Å; Y402-S406 VanDerWaalsContact CZ-OG 3.22Å; Y402-S406 VanDerWaalsContact O-CB 3.28Å; Y402-S406 WeakPolarHBondContact O-CB 3.34Å; Y402-S406 PolarHBondContact O-N 3.29Å; Y402-S406 PolarHBondContact O-OG 3.46Å; Y402-W410 HydrophobicContact CD2-CZ2 4.04Å; Y402-W410 HydrophobicContact CE2-CZ2 4.08Å
403	V	83.8	Confident	79.8	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.012	12%	0.123	C	C	.	.	H	α-helix	trans	-61	-44.7	176.3	165.2	0	0	0	0	111	F43 T47 I324 G399 S400 M405 S406 I407	F43-V403 HydrophobicContact CE1-CG2 3.84Å; F43-V403 HydrophobicContact CZ-CB 4.44Å; F43-V403 HydrophobicContact CZ-CG2 3.55Å; T47-V403 HydrophobicContact CG2-CG1 3.75Å; T47-V403 HydrophobicContact CG2-CG2 4.32Å; I324-V403 HydrophobicContact CD1-CG2 4.42Å; I324-V403 HydrophobicContact CG2-CG2 4.43Å; G399-V403 WeakPolarHBondContact O-CG2 3.33Å; G399-V403 PolarHBondContact O-N 2.92Å; S400-V403 PolarHBondContact O-N 3.26Å; V403-M405 PolarHBondContact O-N 2.94Å; V403-S406 PolarHBondContact O-N 2.93Å; V403-I407 HydrophobicContact CG1-CD1 3.6Å; V403-I407 HydrophobicContact CG1-CG1 4.25Å; V403-I407 WeakPolarHBondContact O-CG1 3.27Å; V403-I407 PolarHBondContact O-N 3.33Å
404	M	87.3	Confident	77.6	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-52.8	-52.5	175.3	-170.9	174.1	67.1	0	0	111.5	Y92 C95 W154 G158 S400 L401 T408	Y92-M404 HydrophobicContact CD1-CE 4.1Å; Y92-M404 HydrophobicContact CD1-CG 3.91Å; Y92-M404 HydrophobicContact CD1-SD 3.46Å; Y92-M404 WeakPolarHBondContact CD1-SD 3.32Å; Y92-M404 HydrophobicContact CD2-CG 4.25Å; Y92-M404 HydrophobicContact CE1-CE 3.95Å; Y92-M404 HydrophobicContact CE1-CG 4.09Å; Y92-M404 HydrophobicContact CE1-SD 3.88Å; Y92-M404 HydrophobicContact CE2-CG 4.44Å; Y92-M404 HydrophobicContact CG-CG 3.99Å; Y92-M404 HydrophobicContact CG-SD 3.97Å; C95-M404 HydrophobicContact CB-CB 3.59Å; C95-M404 HydrophobicContact CB-CG 3.81Å; C95-M404 HydrophobicContact CB-SD 4.08Å; W154-M404 HydrophobicContact CE3-CE 4.33Å; W154-M404 VanDerWaalsContact O-CE 3.32Å; W154-M404 WeakPolarHBondContact O-CE 3.34Å; G158-M404 VanDerWaalsContact CA-CE 3.4Å; S400-M404 WeakPolarHBondContact O-CB 3.46Å; S400-M404 PolarHBondContact O-N 3.1Å; L401-M404 HydrophobicContact CD2-CE 4.07Å; L401-M404 WeakPolarHBondContact O-CB 3.49Å; L401-M404 PolarHBondContact O-N 2.99Å; M404-T408 WeakPolarHBondContact O-CB 3.46Å; M404-T408 WeakPolarHBondContact O-CG2 3.33Å; M404-T408 PolarHBondContact O-N 2.71Å; M404-T408 PolarHBondContact O-OG1 2.94Å
405	M	83.4	Confident	75.3	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-68.7	-36.9	-179.4	-61.6	-49.3	-59	0	0	112.8	Y92 R155 G158 A159 L401 Y402 V403 T408 N409 W410	Y92-M405 PolarHBondContact OH-SD 3.08Å; R155-M405 HydrophobicContact CG-CE 4.13Å; G158-M405 WeakPolarHBondContact O-CG 3.36Å; A159-M405 HydrophobicContact CB-CE 4.25Å; L401-M405 WeakPolarHBondContact O-CG 3.28Å; L401-M405 PolarHBondContact O-N 3.03Å; L401-M405 VanDerWaalsContact O-N 3.12Å; Y402-M405 PolarHBondContact O-N 2.96Å; V403-M405 PolarHBondContact O-N 2.94Å; M405-T408 CarbonylContact O-C 3.5Å; M405-T408 PolarHBondContact O-OG1 3.35Å; M405-N409 PolarHBondContact O-N 3.49Å; M405-W410 HydrophobicContact CB-CD2 3.78Å; M405-W410 HydrophobicContact CB-CE3 4.05Å; M405-W410 HydrophobicContact CB-CG 4.33Å; M405-W410 HydrophobicContact CB-CH2 4.05Å; M405-W410 HydrophobicContact CB-CZ2 3.77Å; M405-W410 HydrophobicContact CB-CZ3 4.19Å; M405-W410 HydrophobicContact CE-CD2 4.49Å; M405-W410 HydrophobicContact CE-CE3 4.15Å; M405-W410 HydrophobicContact CG-CE3 4.43Å; M405-W410 HydrophobicContact CG-CH2 4.39Å; M405-W410 HydrophobicContact CG-CZ3 4.32Å; M405-W410 VanDerWaalsContact O-CD1 3.3Å; M405-W410 PolarHBondContact O-N 3.22Å
406	S	77.4	Confident	72.9	Confident	20 Å²	20	43.7 Å²	43.7	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-69.2	-43.8	-177.9	-60.8	0	0	0	0	112.6	Y402 V403 T408 N409	Y402-S406 WeakPolarHBondContact CE2-OG 3.31Å; Y402-S406 VanDerWaalsContact CZ-OG 3.22Å; Y402-S406 VanDerWaalsContact O-CB 3.28Å; Y402-S406 WeakPolarHBondContact O-CB 3.34Å; Y402-S406 PolarHBondContact O-N 3.29Å; Y402-S406 PolarHBondContact O-OG 3.46Å; V403-S406 PolarHBondContact O-N 2.93Å; S406-T408 VanDerWaalsContact C-N 3.31Å; S406-N409 PolarHBondContact O-N 2.93Å
407	I	75.9	Confident	70.5	Confident	27 Å²	27	51.5 Å²	51.5	14%	0.138	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-35.7	178.4	-67.8	177.6	0	0	0	110.7	T47 C50 V51 M54 V91 V403 N409	T47-I407 HydrophobicContact CG2-CD1 4.35Å; C50-I407 HydrophobicContact CB-CD1 3.62Å; V51-I407 HydrophobicContact CG2-CD1 3.88Å; V51-I407 HydrophobicContact CG2-CG1 4.39Å; M54-I407 HydrophobicContact CE-CG2 4.25Å; M54-I407 WeakPolarHBondContact CE-O 3.48Å; M54-I407 HydrophobicContact CG-CG2 3.58Å; M54-I407 HydrophobicContact SD-CG2 4.27Å; V91-I407 HydrophobicContact CG1-CB 4.13Å; V91-I407 HydrophobicContact CG1-CG2 3.89Å; V91-I407 HydrophobicContact CG2-CG2 3.99Å; V403-I407 HydrophobicContact CG1-CD1 3.6Å; V403-I407 HydrophobicContact CG1-CG1 4.25Å; V403-I407 WeakPolarHBondContact O-CG1 3.27Å; V403-I407 PolarHBondContact O-N 3.33Å; I407-N409 PolarHBondContact O-N 2.93Å
408	T	75	Confident	68.1	Low	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	16.4	177.4	63.9	0	0	0	0	113.9	Y88 V91 Y92 M404 M405 S406 W410 F411	Y88-T408 HydrophobicContact CD1-CG2 4.35Å; Y88-T408 HydrophobicContact CG-CG2 4.35Å; V91-T408 HydrophobicContact CB-CG2 4.19Å; V91-T408 HydrophobicContact CG1-CG2 3.92Å; Y92-T408 HydrophobicContact CD2-CG2 3.74Å; Y92-T408 HydrophobicContact CE2-CG2 3.47Å; Y92-T408 VanDerWaalsContact CE2-CG2 3.47Å; M404-T408 WeakPolarHBondContact O-CB 3.46Å; M404-T408 WeakPolarHBondContact O-CG2 3.33Å; M404-T408 PolarHBondContact O-N 2.71Å; M404-T408 PolarHBondContact O-OG1 2.94Å; M405-T408 CarbonylContact O-C 3.5Å; M405-T408 PolarHBondContact O-OG1 3.35Å; S406-T408 VanDerWaalsContact C-N 3.31Å; T408-W410 PolarHBondContact O-N 3.41Å; T408-F411 WeakPolarHBondContact O-CB 3.36Å; T408-F411 PolarHBondContact O-N 3.5Å
409	N	69.3	Low	65.5	Low	82 Å²	82	59.8 Å²	59.8	44%	0.439	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	29.5	176.4	-67.6	-51.6	0	0	0	115.3	M405 S406 I407 F411 V428	M405-N409 PolarHBondContact O-N 3.49Å; S406-N409 PolarHBondContact O-N 2.93Å; I407-N409 PolarHBondContact O-N 2.93Å; N409-F411 PolarHBondContact O-N 3Å; N409-V428 VanDerWaalsContact O-CG2 3.28Å; N409-V428 WeakPolarHBondContact O-CG2 3.45Å
410	W	68.3	Low	63.1	Low	32 Å²	32	68.1 Å²	68.1	12%	0.121	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	43.8	-179.7	-62.3	74.2	0	0	0	112.8	A159 L166 Y402 M405 T408 V428 L431	A159-W410 HydrophobicContact CB-CE3 4.49Å; A159-W410 HydrophobicContact CB-CZ3 4.08Å; L166-W410 HydrophobicContact CD1-CH2 4.4Å; L166-W410 HydrophobicContact CD1-CZ2 4.3Å; Y402-W410 HydrophobicContact CD2-CZ2 4.04Å; Y402-W410 HydrophobicContact CE2-CZ2 4.08Å; M405-W410 HydrophobicContact CB-CD2 3.78Å; M405-W410 HydrophobicContact CB-CE3 4.05Å; M405-W410 HydrophobicContact CB-CG 4.33Å; M405-W410 HydrophobicContact CB-CH2 4.05Å; M405-W410 HydrophobicContact CB-CZ2 3.77Å; M405-W410 HydrophobicContact CB-CZ3 4.19Å; M405-W410 HydrophobicContact CE-CD2 4.49Å; M405-W410 HydrophobicContact CE-CE3 4.15Å; M405-W410 HydrophobicContact CG-CE3 4.43Å; M405-W410 HydrophobicContact CG-CH2 4.39Å; M405-W410 HydrophobicContact CG-CZ3 4.32Å; M405-W410 VanDerWaalsContact O-CD1 3.3Å; M405-W410 PolarHBondContact O-N 3.22Å; T408-W410 PolarHBondContact O-N 3.41Å; W410-V428 HydrophobicContact CB-CG2 3.97Å; W410-V428 HydrophobicContact CG-CG2 4.22Å; W410-L431 HydrophobicContact CD2-CD1 3.67Å; W410-L431 HydrophobicContact CE3-CD1 3.57Å; W410-L431 HydrophobicContact CH2-CD1 3.34Å; W410-L431 HydrophobicContact CZ2-CD1 3.44Å; W410-L431 VanDerWaalsContact CZ2-CD1 3.44Å; W410-L431 HydrophobicContact CZ2-CD2 4.44Å; W410-L431 HydrophobicContact CZ3-CD1 3.39Å
411	F	58.5	Low	60.4	Low	48 Å²	48	70.2 Å²	70.2	21%	0.211	33%	0.331	C	S	.	.			trans	-57.2	146.3	-171.5	-177.1	-103.6	0	0	0	115.1	Y88 R155 T408 N409 Y413 L421	Y88-F411 HydrophobicContact CD2-CG 4.38Å; Y88-F411 HydrophobicContact CE2-CB 4.42Å; Y88-F411 AromaticContact CE2-CD2 3.92Å; Y88-F411 HydrophobicContact CE2-CD2 3.92Å; Y88-F411 HydrophobicContact CE2-CE2 4.35Å; Y88-F411 HydrophobicContact CE2-CG 4.09Å; R155-F411 WeakPolarHBondContact CD-O 3.2Å; T408-F411 WeakPolarHBondContact O-CB 3.36Å; T408-F411 PolarHBondContact O-N 3.5Å; N409-F411 PolarHBondContact O-N 3Å; F411-Y413 HydrophobicContact CE1-CD2 4.04Å; F411-L421 HydrophobicContact CD2-CD2 4.29Å; F411-L421 HydrophobicContact CE2-CD1 4.08Å; F411-L421 HydrophobicContact CE2-CD2 4.12Å; F411-L421 HydrophobicContact CE2-CG 4.17Å
412	H	53.3	Low	57.9	Low	104 Å²	104	77.9 Å²	77.9	48%	0.481	37%	0.372	S	S	.	.			trans	-125.6	125.8	173.3	-153.1	-38	0	0	0	109.3	D414	H412-D414 IonicContact CE1-OD2 2.58Å; H412-D414 PolarHBondContact CE1-OD2 3.47Å; H412-D414 IonicContact ND1-OD2 2.81Å
413	Y	49.4	Very low	56.2	Low	106 Å²	106	80 Å²	80	42%	0.416	39%	0.385	S	S	.	.			trans	-85.9	-10.6	-169.5	-176.2	-98.7	0	0	0	114.9	M76 F411 D415	M76-Y413 PolarHBondContact O-OH 3.29Å; F411-Y413 HydrophobicContact CE1-CD2 4.04Å; Y413-D415 PolarHBondContact O-N 2.91Å
414	D	44.1	Very low	54.9	Low	104 Å²	104	81.7 Å²	81.7	56%	0.556	40%	0.403	S	S	*	.			trans	-83.3	-14	-159.7	-73.4	-36.9	0	0	0	116.1	H412 H416	H412-D414 IonicContact CE1-OD2 2.58Å; H412-D414 PolarHBondContact CE1-OD2 3.47Å; H412-D414 IonicContact ND1-OD2 2.81Å; D414-H416 PolarHBondContact O-ND1 2.92Å
415	D	40.5	Very low	54	Low	143 Å²	143	83 Å²	83	77%	0.765	41%	0.412	S	S	*	.	S	Bend	trans	-93.4	115.1	178.9	-80.6	-32	0	0	0	111.7	Y413 K417	Y413-D415 PolarHBondContact O-N 2.91Å; D415-K417 PolarHBondContact O-N 3.17Å
416	H	35.1	Very low	53.7	Low	181 Å²	181	88.3 Å²	88.3	84%	0.838	43%	0.432	S	S	*	.	S	Bend	trans	-65.7	28.9	-176.5	-74.6	32.2	0	0	0	115.8	D414	D414-H416 PolarHBondContact O-ND1 2.92Å
417	K	38	Very low	53.5	Low	164 Å²	164	89.9 Å²	89.9	71%	0.713	44%	0.443	S	S	*	.			trans	-139.3	89.9	166	-70.5	-168.2	178.5	-173.4	0	109.6	D415 E419	D415-K417 PolarHBondContact O-N 3.17Å; K417-E419 PolarHBondContact O-N 3.06Å
418	I	44.7	Very low	53.4	Low	56 Å²	56	89.2 Å²	89.2	29%	0.287	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-65	-0.1	177.1	-57.2	-178.8	0	0	0	111.5	N81 K420 L421	N81-I418 HydrophobicContact CB-CB 4.37Å; N81-I418 HydrophobicContact CB-CG2 3.44Å; N81-I418 VanDerWaalsContact CB-CG2 3.44Å; N81-I418 WeakPolarHBondContact ND2-CB 3.41Å; N81-I418 VanDerWaalsContact ND2-CG2 3.25Å; N81-I418 WeakPolarHBondContact ND2-CG2 3.46Å; I418-K420 VanDerWaalsContact C-N 3.33Å; I418-K420 PolarHBondContact O-N 3.47Å; I418-L421 HydrophobicContact CB-CD1 4.21Å; I418-L421 HydrophobicContact CG2-CD1 3.1Å; I418-L421 WeakPolarHBondContact O-CB 3.46Å; I418-L421 VanDerWaalsContact O-CD1 3.32Å; I418-L421 WeakPolarHBondContact O-CD1 3.31Å
419	E	34.4	Very low	53.7	Low	154 Å²	154	89.2 Å²	89.2	72%	0.72	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-74.9	-10.6	-179.5	-70	177.7	157.2	0	0	115.1	K417 L421	K417-E419 PolarHBondContact O-N 3.06Å; E419-L421 VanDerWaalsContact C-N 3.34Å
420	K	37.2	Very low	54.5	Low	175 Å²	175	90.5 Å²	90.5	76%	0.761	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-92.7	15.4	175.7	-70.3	-169.8	178.6	-178.8	0	114.3	I418 L422	I418-K420 VanDerWaalsContact C-N 3.33Å; I418-K420 PolarHBondContact O-N 3.47Å; K420-L422 VanDerWaalsContact C-N 3.26Å; K420-L422 PolarHBondContact O-N 2.82Å
421	L	36	Very low	55.2	Low	44 Å²	44	90.9 Å²	90.9	23%	0.23	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.5	-169.9	-117.9	143.4	0	0	0	115.8	T84 Y88 F411 I418 E419	T84-L421 HydrophobicContact CG2-CD2 4.32Å; Y88-L421 HydrophobicContact CE2-CD2 3.93Å; Y88-L421 WeakPolarHBondContact OH-CD2 3.41Å; F411-L421 HydrophobicContact CD2-CD2 4.29Å; F411-L421 HydrophobicContact CE2-CD1 4.08Å; F411-L421 HydrophobicContact CE2-CD2 4.12Å; F411-L421 HydrophobicContact CE2-CG 4.17Å; I418-L421 HydrophobicContact CB-CD1 4.21Å; I418-L421 HydrophobicContact CG2-CD1 3.1Å; I418-L421 WeakPolarHBondContact O-CB 3.46Å; I418-L421 VanDerWaalsContact O-CD1 3.32Å; I418-L421 WeakPolarHBondContact O-CD1 3.31Å; E419-L421 VanDerWaalsContact C-N 3.34Å
422	L	39.2	Very low	56.4	Low	164 Å²	164	90.2 Å²	90.2	86%	0.859	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	3.4	-175.3	-67.7	171.2	0	0	0	114.2	K420	K420-L422 VanDerWaalsContact C-N 3.26Å; K420-L422 PolarHBondContact O-N 2.82Å
423	D	49.6	Very low	58	Low	72 Å²	72	85.4 Å²	85.4	39%	0.385	42%	0.418	S	S	.	.	S	Bend	trans	-112	70.2	177.9	-83.4	-36.2	0	0	0	111.2	P283 K284	P283-D423 WeakPolarHBondContact CA-O 3.38Å; P283-D423 VanDerWaalsContact CB-O 3.25Å; P283-D423 WeakPolarHBondContact CB-O 3.34Å; P283-D423 WeakPolarHBondContact CG-O 3.49Å; K284-D423 IonicContact NZ-OD1 3.14Å; K284-D423 PolarHBondContact NZ-OD1 3.49Å
424	G	57	Low	60	Low	37 Å²	37	83.7 Å²	83.7	38%	0.381	42%	0.418	S	S	.	.			trans	63.9	157.1	174	0	0	0	0	0	115	S281	S281-G424 CarbonylContact O-C 3.29Å; S281-G424 VanDerWaalsContact O-C 3.29Å; S281-G424 WeakPolarHBondContact O-CA 3.38Å
425	S	68.1	Low	62.1	Low	28 Å²	28	79.4 Å²	79.4	20%	0.196	40%	0.396	C	S	.	.			trans	-125	122	176.7	169.9	0	0	0	0	109.8	S281 S427 V428 Y429	S281-S425 PolarHBondContact O-N 3.05Å; S425-S427 PolarHBondContact O-N 2.99Å; S425-S427 PolarHBondContact OG-N 3.05Å; S425-V428 PolarHBondContact O-N 2.86Å; S425-V428 PolarHBondContact OG-N 3.03Å; S425-Y429 WeakPolarHBondContact O-CB 3.18Å; S425-Y429 PolarHBondContact O-N 2.77Å
426	W	75.6	Confident	64.4	Low	113 Å²	113	72.6 Å²	72.6	43%	0.428	36%	0.36	S	S	.	.	H	α-helix	trans	-60.5	-32	172.6	-79.9	109.1	0	0	0	112.1	L228 K282 P283 Y429 W430	L228-W426 HydrophobicContact CD1-CH2 4.35Å; L228-W426 HydrophobicContact CD1-CZ3 4.19Å; L228-W426 HydrophobicContact CD2-CZ3 4.31Å; K282-W426 HydrophobicContact CD-CH2 4.2Å; K282-W426 VanDerWaalsContact CE-CH2 3.48Å; K282-W426 HydrophobicContact CG-CH2 4.17Å; K282-W426 HydrophobicContact CG-CZ2 4.31Å; K282-W426 HydrophobicContact CG-CZ3 4.35Å; P283-W426 HydrophobicContact CG-CG 4.34Å; W426-Y429 HydrophobicContact CE3-CD1 4.07Å; W426-Y429 HydrophobicContact CE3-CG 4.31Å; W426-Y429 HydrophobicContact CZ3-CD1 4.19Å; W426-Y429 HydrophobicContact CZ3-CE1 4.46Å; W426-Y429 WeakPolarHBondContact O-CB 3.3Å; W426-Y429 PolarHBondContact O-N 3.33Å; W426-W430 AromaticContact CE3-NE1 3.83Å; W426-W430 PolarHBondContact O-N 3.12Å
427	S	74.4	Confident	67.2	Low	53 Å²	53	68.3 Å²	68.3	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-63.9	-47.4	175.5	-52.9	0	0	0	0	111.1	S425 Y429 W430 L431	S425-S427 PolarHBondContact O-N 2.99Å; S425-S427 PolarHBondContact OG-N 3.05Å; S427-Y429 VanDerWaalsContact C-N 3.32Å; S427-Y429 PolarHBondContact O-N 3.19Å; S427-W430 PolarHBondContact O-N 3.38Å; S427-L431 VanDerWaalsContact O-CB 3.3Å; S427-L431 WeakPolarHBondContact O-CB 3.25Å; S427-L431 PolarHBondContact O-N 3.03Å
428	V	73.5	Confident	69.8	Low	14 Å²	14	62.5 Å²	62.5	9%	0.085	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-39.1	177.6	178.5	0	0	0	0	110.9	N409 W410 S425 K432	N409-V428 VanDerWaalsContact O-CG2 3.28Å; N409-V428 WeakPolarHBondContact O-CG2 3.45Å; W410-V428 HydrophobicContact CB-CG2 3.97Å; W410-V428 HydrophobicContact CG-CG2 4.22Å; S425-V428 PolarHBondContact O-N 2.86Å; S425-V428 PolarHBondContact OG-N 3.03Å; V428-K432 HydrophobicContact CG1-CD 4.17Å; V428-K432 WeakPolarHBondContact O-CG 3.05Å; V428-K432 PolarHBondContact O-N 3.33Å; V428-K432 VanDerWaalsContact O-N 3.17Å
429	Y	81.6	Confident	71.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-54.7	-58	173.8	177.7	-87.2	0	0	0	111.5	L228 F232 A278 F279 K282 S425 W426 S427 L431 K432 V433	L228-Y429 HydrophobicContact CD2-CE1 3.67Å; L228-Y429 HydrophobicContact CD2-CE2 4.13Å; L228-Y429 WeakPolarHBondContact CD2-OH 3.41Å; F232-Y429 HydrophobicContact CD2-CE1 4.4Å; F232-Y429 WeakPolarHBondContact CD2-OH 3.27Å; F232-Y429 HydrophobicContact CE2-CE1 4.12Å; F232-Y429 WeakPolarHBondContact CE2-OH 3.37Å; A278-Y429 HydrophobicContact CB-CD2 4.13Å; A278-Y429 HydrophobicContact CB-CE2 4.1Å; A278-Y429 WeakPolarHBondContact O-CD2 3.44Å; F279-Y429 HydrophobicContact CD1-CE2 4.02Å; K282-Y429 HydrophobicContact CB-CD2 3.79Å; K282-Y429 HydrophobicContact CB-CE2 4.26Å; K282-Y429 HydrophobicContact CD-CE2 4.34Å; K282-Y429 HydrophobicContact CG-CD2 4.25Å; S425-Y429 WeakPolarHBondContact O-CB 3.18Å; S425-Y429 PolarHBondContact O-N 2.77Å; W426-Y429 HydrophobicContact CE3-CD1 4.07Å; W426-Y429 HydrophobicContact CE3-CG 4.31Å; W426-Y429 HydrophobicContact CZ3-CD1 4.19Å; W426-Y429 HydrophobicContact CZ3-CE1 4.46Å; W426-Y429 WeakPolarHBondContact O-CB 3.3Å; W426-Y429 PolarHBondContact O-N 3.33Å; S427-Y429 VanDerWaalsContact C-N 3.32Å; S427-Y429 PolarHBondContact O-N 3.19Å; Y429-L431 PolarHBondContact O-N 2.75Å; Y429-K432 PolarHBondContact O-N 2.96Å; Y429-V433 HydrophobicContact CD1-CG2 4.22Å; Y429-V433 HydrophobicContact CE1-CG2 3.63Å; Y429-V433 HydrophobicContact CE2-CG2 4.46Å; Y429-V433 WeakPolarHBondContact O-CG2 3.29Å; Y429-V433 PolarHBondContact O-N 2.8Å
430	W	85.8	Confident	74.7	Confident	108 Å²	108	52.7 Å²	52.7	41%	0.409	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-36.9	-175.9	-78.8	114	0	0	0	112.7	L228 F232 W426 S427 K432 V433 V434	L228-W430 HydrophobicContact CD1-CZ2 4.48Å; F232-W430 HydrophobicContact CE1-CZ3 4.49Å; F232-W430 AromaticContact CE2-CH2 3.99Å; F232-W430 HydrophobicContact CE2-CH2 3.99Å; F232-W430 HydrophobicContact CE2-CZ3 4.21Å; F232-W430 AromaticContact CZ-CH2 3.56Å; F232-W430 HydrophobicContact CZ-CH2 3.56Å; F232-W430 AromaticContact CZ-CZ3 3.64Å; F232-W430 HydrophobicContact CZ-CZ3 3.64Å; W426-W430 AromaticContact CE3-NE1 3.83Å; W426-W430 PolarHBondContact O-N 3.12Å; S427-W430 PolarHBondContact O-N 3.38Å; W430-K432 VanDerWaalsContact C-N 3.29Å; W430-K432 PolarHBondContact O-N 3.12Å; W430-V433 HydrophobicContact CE3-CB 4.42Å; W430-V433 HydrophobicContact CE3-CG1 4.39Å; W430-V433 HydrophobicContact CZ3-CG1 4.42Å; W430-V433 PolarHBondContact O-N 3.37Å; W430-V434 WeakPolarHBondContact O-CB 3.3Å; W430-V434 WeakPolarHBondContact O-CG2 3.49Å; W430-V434 PolarHBondContact O-N 2.72Å
431	L	83.3	Confident	77.4	Confident	40 Å²	40	50.7 Å²	50.7	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-57.8	-43	174.7	178.9	139.3	0	0	0	111.8	L166 W410 S427 Y429 S435	L166-L431 HydrophobicContact CD1-CD1 4.07Å; L166-L431 HydrophobicContact CD1-CD2 3.8Å; L166-L431 HydrophobicContact CD1-CG 4.13Å; W410-L431 HydrophobicContact CD2-CD1 3.67Å; W410-L431 HydrophobicContact CE3-CD1 3.57Å; W410-L431 HydrophobicContact CH2-CD1 3.34Å; W410-L431 HydrophobicContact CZ2-CD1 3.44Å; W410-L431 VanDerWaalsContact CZ2-CD1 3.44Å; W410-L431 HydrophobicContact CZ2-CD2 4.44Å; W410-L431 HydrophobicContact CZ3-CD1 3.39Å; S427-L431 VanDerWaalsContact O-CB 3.3Å; S427-L431 WeakPolarHBondContact O-CB 3.25Å; S427-L431 PolarHBondContact O-N 3.03Å; Y429-L431 PolarHBondContact O-N 2.75Å; L431-S435 WeakPolarHBondContact O-CB 3.39Å; L431-S435 PolarHBondContact O-N 3.03Å; L431-S435 PolarHBondContact O-OG 3.43Å
432	K	82.9	Confident	80	Confident	35 Å²	35	50.3 Å²	50.3	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-41.6	177.3	-69.9	172.9	-178.6	178.8	0	112.1	S277 A278 S281 V428 Y429 W430 S435 C436	S277-K432 PolarHBondContact O-NZ 3.48Å; S277-K432 VanDerWaalsContact OG-CE 3.31Å; S277-K432 WeakPolarHBondContact OG-CE 2.89Å; S277-K432 PolarHBondContact OG-NZ 3.44Å; A278-K432 HydrophobicContact CB-CB 3.79Å; A278-K432 HydrophobicContact CB-CD 4.34Å; S281-K432 PolarHBondContact OG-NZ 3.07Å; V428-K432 HydrophobicContact CG1-CD 4.17Å; V428-K432 WeakPolarHBondContact O-CG 3.05Å; V428-K432 PolarHBondContact O-N 3.33Å; V428-K432 VanDerWaalsContact O-N 3.17Å; Y429-K432 PolarHBondContact O-N 2.96Å; W430-K432 VanDerWaalsContact C-N 3.29Å; W430-K432 PolarHBondContact O-N 3.12Å; K432-S435 WeakPolarHBondContact O-CB 3.38Å; K432-S435 PolarHBondContact O-N 2.84Å; K432-C436 PolarHBondContact O-N 2.81Å; K432-C436 PolarHBondContact O-SG 3.35Å; K432-C436 VanDerWaalsContact O-SG 3.38Å
433	V	88.4	Confident	82.4	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-47.5	176.8	172.3	0	0	0	0	111.5	F232 A278 Y429 W430 S435 C436 W437	F232-V433 HydrophobicContact CD1-CG1 4.31Å; F232-V433 HydrophobicContact CE1-CG1 4.23Å; F232-V433 HydrophobicContact CZ-CG1 4.49Å; A278-V433 HydrophobicContact CB-CG2 4.04Å; Y429-V433 HydrophobicContact CD1-CG2 4.22Å; Y429-V433 HydrophobicContact CE1-CG2 3.63Å; Y429-V433 HydrophobicContact CE2-CG2 4.46Å; Y429-V433 WeakPolarHBondContact O-CG2 3.29Å; Y429-V433 PolarHBondContact O-N 2.8Å; W430-V433 HydrophobicContact CE3-CB 4.42Å; W430-V433 HydrophobicContact CE3-CG1 4.39Å; W430-V433 HydrophobicContact CZ3-CG1 4.42Å; W430-V433 PolarHBondContact O-N 3.37Å; V433-S435 VanDerWaalsContact C-N 3.28Å; V433-S435 PolarHBondContact O-N 3.3Å; V433-C436 VanDerWaalsContact O-CB 3.28Å; V433-C436 WeakPolarHBondContact O-CB 3.41Å; V433-C436 PolarHBondContact O-N 3.04Å; V433-C436 VanDerWaalsContact O-N 3.16Å; V433-W437 HydrophobicContact CG1-CD2 4.34Å; V433-W437 HydrophobicContact CG1-CH2 3.95Å; V433-W437 HydrophobicContact CG1-CZ2 3.7Å; V433-W437 HydrophobicContact CG1-CZ3 4.35Å; V433-W437 PolarHBondContact O-N 3.28Å
434	V	90.6	Very high	84.3	Confident	70 Å²	70	41.3 Å²	41.3	42%	0.424	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-39.8	176.7	172.5	0	0	0	0	110.5	W430 C436 W437 V438	W430-V434 WeakPolarHBondContact O-CB 3.3Å; W430-V434 WeakPolarHBondContact O-CG2 3.49Å; W430-V434 PolarHBondContact O-N 2.72Å; V434-C436 VanDerWaalsContact C-N 3.3Å; V434-C436 PolarHBondContact O-N 3.04Å; V434-W437 PolarHBondContact O-N 2.7Å; V434-W437 VanDerWaalsContact O-N 3.14Å; V434-V438 HydrophobicContact CG1-CG2 4.1Å; V434-V438 WeakPolarHBondContact O-CG2 3.44Å; V434-V438 PolarHBondContact O-N 3.4Å
435	S	87.3	Confident	85.9	Confident	14 Å²	14	42 Å²	42	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-37.2	175.8	-61	0	0	0	0	112.6	L170 L431 K432 V433 C439	L170-S435 WeakPolarHBondContact CD1-O 3.32Å; L431-S435 WeakPolarHBondContact O-CB 3.39Å; L431-S435 PolarHBondContact O-N 3.03Å; L431-S435 PolarHBondContact O-OG 3.43Å; K432-S435 WeakPolarHBondContact O-CB 3.38Å; K432-S435 PolarHBondContact O-N 2.84Å; V433-S435 VanDerWaalsContact C-N 3.28Å; V433-S435 PolarHBondContact O-N 3.3Å; S435-C439 VanDerWaalsContact O-CB 3.29Å; S435-C439 WeakPolarHBondContact O-CB 3.33Å; S435-C439 PolarHBondContact O-N 3.34Å
436	C	89.6	Confident	86.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.8	-50	172.2	-66.5	0	0	0	0	111.7	V271 L274 K432 V433 V434 C439 L440	V271-C436 HydrophobicContact CG1-CB 4.18Å; L274-C436 WeakPolarHBondContact CB-SG 3.26Å; K432-C436 PolarHBondContact O-N 2.81Å; K432-C436 PolarHBondContact O-SG 3.35Å; K432-C436 VanDerWaalsContact O-SG 3.38Å; V433-C436 VanDerWaalsContact O-CB 3.28Å; V433-C436 WeakPolarHBondContact O-CB 3.41Å; V433-C436 PolarHBondContact O-N 3.04Å; V433-C436 VanDerWaalsContact O-N 3.16Å; V434-C436 VanDerWaalsContact C-N 3.3Å; V434-C436 PolarHBondContact O-N 3.04Å; C436-C439 WeakPolarHBondContact O-CB 3.43Å; C436-C439 PolarHBondContact O-N 3.5Å; C436-L440 WeakPolarHBondContact O-CG 3.48Å; C436-L440 PolarHBondContact O-N 3.45Å
437	W	93.9	Very high	87	Confident	91 Å²	91	38.1 Å²	38.1	35%	0.345	19%	0.194	S	C	.	.	H	α-helix	trans	-69.5	-39.2	-176.2	-61.9	-18.8	0	0	0	112.4	F232 N236 V433 V434 C439 L440 F441	F232-W437 HydrophobicContact CD1-CH2 4.47Å; F232-W437 AromaticContact CD1-CZ2 3.82Å; F232-W437 HydrophobicContact CD1-CZ2 3.82Å; F232-W437 AromaticContact CE1-CH2 3.71Å; F232-W437 HydrophobicContact CE1-CH2 3.71Å; F232-W437 AromaticContact CE1-CZ2 3.5Å; F232-W437 HydrophobicContact CE1-CZ2 3.5Å; F232-W437 VanDerWaalsContact CE1-CZ2 3.5Å; F232-W437 HydrophobicContact CZ-CH2 4.46Å; N236-W437 PolarHBondContact OD1-NE1 2.71Å; N236-W437 VanDerWaalsContact OD1-NE1 3.08Å; V433-W437 HydrophobicContact CG1-CD2 4.34Å; V433-W437 HydrophobicContact CG1-CH2 3.95Å; V433-W437 HydrophobicContact CG1-CZ2 3.7Å; V433-W437 HydrophobicContact CG1-CZ3 4.35Å; V433-W437 PolarHBondContact O-N 3.28Å; V434-W437 PolarHBondContact O-N 2.7Å; V434-W437 VanDerWaalsContact O-N 3.14Å; W437-C439 VanDerWaalsContact C-N 3.32Å; W437-C439 PolarHBondContact O-N 3.04Å; W437-L440 PolarHBondContact O-N 2.82Å; W437-F441 VanDerWaalsContact O-CB 3.23Å; W437-F441 WeakPolarHBondContact O-CB 3.17Å; W437-F441 PolarHBondContact O-N 2.74Å
438	V	92.5	Very high	87.4	Confident	43 Å²	43	38 Å²	38	26%	0.261	19%	0.189	S	C	.	.	H	α-helix	trans	-61.3	-43.1	172.7	173.1	0	0	0	0	110.3	L170 V434 F441 L442	L170-V438 HydrophobicContact CD1-CB 4.01Å; L170-V438 HydrophobicContact CD1-CG1 3.8Å; V434-V438 HydrophobicContact CG1-CG2 4.1Å; V434-V438 WeakPolarHBondContact O-CG2 3.44Å; V434-V438 PolarHBondContact O-N 3.4Å; V438-F441 PolarHBondContact O-N 3.4Å; V438-L442 HydrophobicContact CG1-CD1 3.86Å; V438-L442 HydrophobicContact CG1-CG 4.18Å; V438-L442 WeakPolarHBondContact O-CB 3.47Å; V438-L442 VanDerWaalsContact O-CG 3.23Å; V438-L442 WeakPolarHBondContact O-CG 3.27Å; V438-L442 PolarHBondContact O-N 2.88Å
439	C	90.1	Very high	87.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.7	-49.2	177.1	-170.6	0	0	0	0	112.1	L170 Y270 S435 C436 W437 F441 L442 Y443	L170-C439 HydrophobicContact CD1-CB 4.35Å; L170-C439 HydrophobicContact CD2-CB 3.86Å; Y270-C439 HydrophobicContact CE1-CB 4.48Å; S435-C439 VanDerWaalsContact O-CB 3.29Å; S435-C439 WeakPolarHBondContact O-CB 3.33Å; S435-C439 PolarHBondContact O-N 3.34Å; C436-C439 WeakPolarHBondContact O-CB 3.43Å; C436-C439 PolarHBondContact O-N 3.5Å; W437-C439 VanDerWaalsContact C-N 3.32Å; W437-C439 PolarHBondContact O-N 3.04Å; C439-F441 PolarHBondContact O-N 2.96Å; C439-L442 PolarHBondContact O-N 2.91Å; C439-Y443 WeakPolarHBondContact O-CB 3.17Å; C439-Y443 PolarHBondContact O-N 3.24Å
440	L	92.9	Very high	87.2	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-42.6	177.2	-72.8	163.7	0	0	0	111.8	L239 V243 I267 V271 C436 W437 Y443 I444	L239-L440 HydrophobicContact CB-CD1 3.74Å; L239-L440 HydrophobicContact CD1-CD1 3.87Å; L239-L440 HydrophobicContact CG-CD1 4.45Å; V243-L440 HydrophobicContact CG2-CD2 3.96Å; I267-L440 HydrophobicContact CG2-CD2 4.18Å; V271-L440 HydrophobicContact CG1-CD1 4.17Å; V271-L440 HydrophobicContact CG2-CD1 4.22Å; V271-L440 HydrophobicContact CG2-CD2 4.01Å; V271-L440 HydrophobicContact CG2-CG 3.84Å; C436-L440 WeakPolarHBondContact O-CG 3.48Å; C436-L440 PolarHBondContact O-N 3.45Å; W437-L440 PolarHBondContact O-N 2.82Å; L440-Y443 PolarHBondContact O-N 3.22Å; L440-I444 VanDerWaalsContact O-CG1 3.29Å; L440-I444 WeakPolarHBondContact O-CG1 3.49Å; L440-I444 PolarHBondContact O-N 3.46Å
441	F	93.6	Very high	86.4	Confident	132 Å²	132	37 Å²	37	58%	0.579	20%	0.195	S	C	*	.	H	α-helix	trans	-62.3	-48.1	176.7	176.5	-101	0	0	0	111.8	W437 V438 C439 Y443 I444 V445	W437-F441 VanDerWaalsContact O-CB 3.23Å; W437-F441 WeakPolarHBondContact O-CB 3.17Å; W437-F441 PolarHBondContact O-N 2.74Å; V438-F441 PolarHBondContact O-N 3.4Å; C439-F441 PolarHBondContact O-N 2.96Å; F441-Y443 VanDerWaalsContact C-N 3.29Å; F441-Y443 PolarHBondContact O-N 2.73Å; F441-I444 PolarHBondContact O-N 3.49Å; F441-V445 HydrophobicContact CD1-CG2 4.21Å; F441-V445 HydrophobicContact CD2-CG2 4.28Å; F441-V445 HydrophobicContact CE1-CG2 3.78Å; F441-V445 HydrophobicContact CE2-CG2 3.85Å; F441-V445 HydrophobicContact CG-CG2 4.45Å; F441-V445 HydrophobicContact CZ-CG2 3.59Å; F441-V445 WeakPolarHBondContact O-CB 3.25Å; F441-V445 WeakPolarHBondContact O-CG2 3.44Å; F441-V445 PolarHBondContact O-N 3.5Å
442	L	89.9	Confident	85.7	Confident	37 Å²	37	41.6 Å²	41.6	19%	0.194	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-40	176.9	-72.6	174.4	0	0	0	111.7	L170 M171 V174 V438 C439 T446	L170-L442 HydrophobicContact CB-CD1 3.95Å; M171-L442 HydrophobicContact CB-CD1 4.45Å; V174-L442 HydrophobicContact CG2-CB 4.34Å; V438-L442 HydrophobicContact CG1-CD1 3.86Å; V438-L442 HydrophobicContact CG1-CG 4.18Å; V438-L442 WeakPolarHBondContact O-CB 3.47Å; V438-L442 VanDerWaalsContact O-CG 3.23Å; V438-L442 WeakPolarHBondContact O-CG 3.27Å; V438-L442 PolarHBondContact O-N 2.88Å; C439-L442 PolarHBondContact O-N 2.91Å; L442-T446 WeakPolarHBondContact O-CB 3.37Å; L442-T446 PolarHBondContact O-N 3.13Å; L442-T446 PolarHBondContact O-OG1 2.87Å
443	Y	90.4	Very high	84.8	Confident	1 Å²	1	43 Å²	43	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-49.6	174.8	-179.1	-92.6	0	0	0	112	V174 H178 V243 Q263 P264 I267 C439 L440 F441 V445 T446 L447	V174-Y443 HydrophobicContact CG1-CD2 4.13Å; H178-Y443 AromaticContact CE1-CE2 3.79Å; H178-Y443 AromaticContact NE2-CD2 3.69Å; H178-Y443 AromaticContact NE2-CE2 3.45Å; H178-Y443 WeakPolarHBondContact NE2-CE2 3.31Å; V243-Y443 HydrophobicContact CG1-CD1 3.18Å; V243-Y443 HydrophobicContact CG1-CE1 3.15Å; V243-Y443 HydrophobicContact CG1-CG 4.29Å; Q263-Y443 HydrophobicContact CB-CE2 3.79Å; P264-Y443 HydrophobicContact CB-CE1 4.46Å; P264-Y443 WeakPolarHBondContact CD-OH 3.38Å; I267-Y443 HydrophobicContact CD1-CD2 4.39Å; I267-Y443 HydrophobicContact CG1-CD2 3.67Å; I267-Y443 HydrophobicContact CG1-CE2 4.14Å; I267-Y443 HydrophobicContact CG1-CG 4.17Å; C439-Y443 WeakPolarHBondContact O-CB 3.17Å; C439-Y443 PolarHBondContact O-N 3.24Å; L440-Y443 PolarHBondContact O-N 3.22Å; F441-Y443 VanDerWaalsContact C-N 3.29Å; F441-Y443 PolarHBondContact O-N 2.73Å; Y443-V445 PolarHBondContact O-N 2.99Å; Y443-T446 PolarHBondContact O-N 3.38Å; Y443-L447 HydrophobicContact CE1-CD1 4Å; Y443-L447 WeakPolarHBondContact O-CB 3.29Å; Y443-L447 PolarHBondContact O-N 3.42Å
444	I	89.9	Confident	83.5	Confident	45 Å²	45	46.1 Å²	46.1	23%	0.231	25%	0.25	C	S	.	.	H	α-helix	trans	-59	-48.2	177.8	-69.1	166	0	0	0	110.2	V243 L440 F441 T446 L447 L448	V243-I444 HydrophobicContact CG2-CD1 3.83Å; V243-I444 HydrophobicContact CG2-CG1 3.78Å; L440-I444 VanDerWaalsContact O-CG1 3.29Å; L440-I444 WeakPolarHBondContact O-CG1 3.49Å; L440-I444 PolarHBondContact O-N 3.46Å; F441-I444 PolarHBondContact O-N 3.49Å; I444-T446 VanDerWaalsContact C-N 3.27Å; I444-T446 PolarHBondContact O-N 3.06Å; I444-L447 WeakPolarHBondContact O-CB 3.28Å; I444-L447 PolarHBondContact O-N 3.44Å; I444-L447 VanDerWaalsContact O-N 3.11Å; I444-L448 HydrophobicContact CG2-CD1 3.6Å; I444-L448 HydrophobicContact CG2-CG 4.07Å; I444-L448 VanDerWaalsContact O-CG 3.27Å; I444-L448 WeakPolarHBondContact O-CG 3.28Å; I444-L448 PolarHBondContact O-N 3.39Å
445	V	88.6	Confident	81.7	Confident	53 Å²	53	52 Å²	52	32%	0.321	27%	0.27	S	S	.	.	H	α-helix	trans	-58.6	-40.8	178	170	0	0	0	0	111.2	F441 Y443 L447 L448 A449	F441-V445 HydrophobicContact CD1-CG2 4.21Å; F441-V445 HydrophobicContact CD2-CG2 4.28Å; F441-V445 HydrophobicContact CE1-CG2 3.78Å; F441-V445 HydrophobicContact CE2-CG2 3.85Å; F441-V445 HydrophobicContact CG-CG2 4.45Å; F441-V445 HydrophobicContact CZ-CG2 3.59Å; F441-V445 WeakPolarHBondContact O-CB 3.25Å; F441-V445 WeakPolarHBondContact O-CG2 3.44Å; F441-V445 PolarHBondContact O-N 3.5Å; Y443-V445 PolarHBondContact O-N 2.99Å; V445-L447 VanDerWaalsContact C-N 3.33Å; V445-L447 PolarHBondContact O-N 3.16Å; V445-L448 CarbonylContact O-C 3.57Å; V445-L448 PolarHBondContact O-N 3.34Å; V445-A449 WeakPolarHBondContact O-CA 3.26Å; V445-A449 WeakPolarHBondContact O-CB 3.5Å; V445-A449 PolarHBondContact O-N 3Å
446	T	83.9	Confident	79.9	Confident	55 Å²	55	57.7 Å²	57.7	34%	0.337	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-38.8	177.7	-56.2	0	0	0	0	111.6	V174 L442 Y443 I444	V174-T446 HydrophobicContact CG1-CG2 4.48Å; L442-T446 WeakPolarHBondContact O-CB 3.37Å; L442-T446 PolarHBondContact O-N 3.13Å; L442-T446 PolarHBondContact O-OG1 2.87Å; Y443-T446 PolarHBondContact O-N 3.38Å; I444-T446 VanDerWaalsContact C-N 3.27Å; I444-T446 PolarHBondContact O-N 3.06Å
447	L	83.3	Confident	78	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-68.1	-36.5	176.3	-168.9	120.8	0	0	0	112.7	L246 A247 I252 Y443 I444 V445	L246-L447 HydrophobicContact CB-CD2 4.22Å; A247-L447 HydrophobicContact CB-CD1 4.13Å; I252-L447 HydrophobicContact CB-CD2 4.38Å; I252-L447 HydrophobicContact CD1-CD2 3.72Å; I252-L447 HydrophobicContact CG1-CD2 3.76Å; I252-L447 HydrophobicContact CG2-CD1 4.09Å; I252-L447 HydrophobicContact CG2-CD2 3.78Å; I252-L447 HydrophobicContact CG2-CG 3.77Å; Y443-L447 HydrophobicContact CE1-CD1 4Å; Y443-L447 WeakPolarHBondContact O-CB 3.29Å; Y443-L447 PolarHBondContact O-N 3.42Å; I444-L447 WeakPolarHBondContact O-CB 3.28Å; I444-L447 PolarHBondContact O-N 3.44Å; I444-L447 VanDerWaalsContact O-N 3.11Å; V445-L447 VanDerWaalsContact C-N 3.33Å; V445-L447 PolarHBondContact O-N 3.16Å
448	L	82.9	Confident	75.5	Confident	51 Å²	51	66.2 Å²	66.2	27%	0.267	33%	0.332	S	S	.	.	H	α-helix	trans	-88.7	-11.1	179.5	-55.4	178	0	0	0	113.4	I252 I444 V445 P450 M451 M452	I252-L448 HydrophobicContact CD1-CD2 3.9Å; I444-L448 HydrophobicContact CG2-CD1 3.6Å; I444-L448 HydrophobicContact CG2-CG 4.07Å; I444-L448 VanDerWaalsContact O-CG 3.27Å; I444-L448 WeakPolarHBondContact O-CG 3.28Å; I444-L448 PolarHBondContact O-N 3.39Å; V445-L448 CarbonylContact O-C 3.57Å; V445-L448 PolarHBondContact O-N 3.34Å; L448-P450 VanDerWaalsContact C-CD 3.41Å; L448-P450 VanDerWaalsContact C-N 3.33Å; L448-M451 HydrophobicContact CB-CE 3.86Å; L448-M451 HydrophobicContact CD2-CE 3.09Å; L448-M451 HydrophobicContact CG-CE 4.01Å; L448-M451 WeakPolarHBondContact O-CB 3.39Å; L448-M451 PolarHBondContact O-N 2.83Å; L448-M452 PolarHBondContact O-N 3.38Å
449	A	80.2	Confident	72.7	Confident	28 Å²	28	72.2 Å²	72.2	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-53.7	-38.6	-175.2	0	0	0	0	0	114.4	V445 M451 M452 C453	V445-A449 WeakPolarHBondContact O-CA 3.26Å; V445-A449 WeakPolarHBondContact O-CB 3.5Å; V445-A449 PolarHBondContact O-N 3Å; A449-M451 PolarHBondContact O-N 3.21Å; A449-M452 PolarHBondContact O-N 3.09Å; A449-C453 PolarHBondContact O-N 3.06Å; A449-C453 VanDerWaalsContact O-N 3.1Å
450	P	70.7	Confident	71.9	Confident	16 Å²	16	75.8 Å²	75.8	10%	0.104	41%	0.405	C	S	.	.	H	α-helix	trans	-59.2	-28.8	174.1	-25.7	36.4	0	0	0	113.9	L448 P454 F457	L448-P450 VanDerWaalsContact C-CD 3.41Å; L448-P450 VanDerWaalsContact C-N 3.33Å; P450-P454 WeakPolarHBondContact O-CA 3.46Å; P450-F457 HydrophobicContact CB-CD2 4.26Å
451	M	70.2	Confident	70.8	Confident	57 Å²	57	79.6 Å²	79.6	28%	0.281	43%	0.425	S	S	.	.	H	α-helix	trans	-83.1	-36.5	178	-61.6	-171.9	-81.1	0	0	113.4	Y251 I252 L255 L448 A449 C453 P454	Y251-M451 HydrophobicContact CD1-SD 4.09Å; Y251-M451 HydrophobicContact CE1-CE 4.22Å; Y251-M451 HydrophobicContact CE1-SD 3.2Å; Y251-M451 WeakPolarHBondContact CE1-SD 3.47Å; I252-M451 HydrophobicContact CD1-CE 3.55Å; I252-M451 HydrophobicContact CD1-SD 4.49Å; L255-M451 HydrophobicContact CD1-CE 4.36Å; L255-M451 HydrophobicContact CD1-CG 3.26Å; L255-M451 HydrophobicContact CD1-SD 3.41Å; L255-M451 WeakPolarHBondContact CD1-SD 3.27Å; L255-M451 HydrophobicContact CD2-CG 4.35Å; L255-M451 HydrophobicContact CG-CG 4.38Å; L448-M451 HydrophobicContact CB-CE 3.86Å; L448-M451 HydrophobicContact CD2-CE 3.09Å; L448-M451 HydrophobicContact CG-CE 4.01Å; L448-M451 WeakPolarHBondContact O-CB 3.39Å; L448-M451 PolarHBondContact O-N 2.83Å; A449-M451 PolarHBondContact O-N 3.21Å; M451-C453 VanDerWaalsContact C-N 3.29Å; M451-P454 WeakPolarHBondContact O-CD 3.34Å
452	M	68.2	Low	69.5	Low	136 Å²	136	76.7 Å²	76.7	67%	0.67	42%	0.417	S	S	*	.	H	α-helix	trans	-75.6	-22.2	-178.9	-63.5	-176.7	69.1	0	0	111.9	L448 A449	L448-M452 PolarHBondContact O-N 3.38Å; A449-M452 PolarHBondContact O-N 3.09Å
453	C	64.4	Low	68.3	Low	63 Å²	63	79 Å²	79	43%	0.426	43%	0.43	S	S	.	.			trans	-138	63.6	-179.1	-70.2	0	0	0	0	111.8	A449 M451 K455 R456 F457	A449-C453 PolarHBondContact O-N 3.06Å; A449-C453 VanDerWaalsContact O-N 3.1Å; M451-C453 VanDerWaalsContact C-N 3.29Å; C453-K455 PolarHBondContact O-N 3.34Å; C453-R456 HydrophobicContact CB-CB 4.13Å; C453-R456 VanDerWaalsContact O-CB 3.27Å; C453-R456 WeakPolarHBondContact O-CB 3.34Å; C453-R456 PolarHBondContact O-N 3.25Å; C453-R456 VanDerWaalsContact O-N 3.09Å; C453-F457 WeakPolarHBondContact O-CD2 3.33Å
454	P	59.6	Low	66.9	Low	68 Å²	68	83.9 Å²	83.9	44%	0.442	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-60.7	-41.2	-173.5	21.2	-30.6	0	0	0	112.8	P450 M451 R456 F457 E458	P450-P454 WeakPolarHBondContact O-CA 3.46Å; M451-P454 WeakPolarHBondContact O-CD 3.34Å; P454-R456 PolarHBondContact O-N 3.35Å; P454-F457 PolarHBondContact O-N 3.12Å; P454-E458 PolarHBondContact O-N 2.92Å
455	K	53.4	Low	65.4	Low	193 Å²	193	86.5 Å²	86.5	84%	0.839	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-59.4	-10.2	177	-64.5	-171.3	177.7	-175.3	0	115.2	C453	C453-K455 PolarHBondContact O-N 3.34Å
456	R	49	Very low	63.7	Low	134 Å²	134	88.9 Å²	88.9	51%	0.506	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-94.5	-24.2	-179.4	-173.9	-177.2	178.6	138.8	15.2	112.8	R341 C453 P454	R341-R456 VanDerWaalsContact NH2-NH2 3.15Å; C453-R456 HydrophobicContact CB-CB 4.13Å; C453-R456 VanDerWaalsContact O-CB 3.27Å; C453-R456 WeakPolarHBondContact O-CB 3.34Å; C453-R456 PolarHBondContact O-N 3.25Å; C453-R456 VanDerWaalsContact O-N 3.09Å; P454-R456 PolarHBondContact O-N 3.35Å
457	F	50.6	Low	62.2	Low	115 Å²	115	91.5 Å²	91.5	50%	0.504	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-5.7	-175.6	-63.7	-82.3	0	0	0	112.6	P450 C453 P454 A459	P450-F457 HydrophobicContact CB-CD2 4.26Å; C453-F457 WeakPolarHBondContact O-CD2 3.33Å; P454-F457 PolarHBondContact O-N 3.12Å; F457-A459 PolarHBondContact O-N 3.28Å
458	E	40.3	Very low	60.4	Low	155 Å²	155	98.8 Å²	98.8	72%	0.724	53%	0.533	S	S	*	.			trans	-73	97.2	156.3	-70.8	173.4	172.6	0	0	107.9	P454	P454-E458 PolarHBondContact O-N 2.92Å
459	A	35.2	Very low	58.3	Low	169 Å²	169	103.1 Å²	103.1	100%	1.397	56%	0.557	S	S	*	*			trans	-111	0	163.7	0	0	0	0	0	108.4	F457	F457-A459 PolarHBondContact O-N 3.28Å

Retrieved 459 of 459 residues in 174.8 ms (Link to these results)

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