A0A096NTR6_PAPAN Loading...

Transmembrane protein 87A

AlphaFold DB , UniProt , Accession A0A096NTR6, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM87A, Length 555 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	32.2	Very low	34.6	Very low	223 Å²	223	99.3 Å²	99.3	100%	1.099	58%	0.577	S	S	*	*				0	-27.9	0	-68.9	-159.3	-77.5	0	0	115
2	A	32.3	Very low	35.1	Very low	73 Å²	73	97.1 Å²	97.1	60%	0.603	57%	0.565	S	S	*	*	H	α-helix	trans	-71.8	-28	176.3	0	0	0	0	0	114.8	A4 A5 W6	A2-A4 VanDerWaalsContact C-N 3.32Å; A2-A4 PolarHBondContact O-N 2.88Å; A2-A5 PolarHBondContact O-N 3.38Å; A2-W6 VanDerWaalsContact O-CD1 3.25Å; A2-W6 PolarHBondContact O-N 3.47Å
3	A	30.1	Very low	35.4	Very low	75 Å²	75	93.1 Å²	93.1	62%	0.62	54%	0.543	S	S	*	.	H	α-helix	trans	-68.2	-29.2	177.5	0	0	0	0	0	113.3	W6 L7	A3-W6 PolarHBondContact O-N 3.38Å; A3-L7 PolarHBondContact O-N 3.09Å
4	A	29.7	Very low	35.5	Very low	63 Å²	63	93.5 Å²	93.5	52%	0.521	55%	0.547	S	S	.	.	H	α-helix	trans	-72.3	-30	175.6	0	0	0	0	0	112.3	A2 L7 Q8	A2-A4 VanDerWaalsContact C-N 3.32Å; A2-A4 PolarHBondContact O-N 2.88Å; A4-L7 PolarHBondContact O-N 3.32Å; A4-Q8 PolarHBondContact O-N 3.46Å
5	A	37.6	Very low	35.5	Very low	54 Å²	54	96.1 Å²	96.1	45%	0.446	56%	0.557	S	S	.	*	H	α-helix	trans	-70.3	-32.4	173.8	0	0	0	0	0	112.3	A2 Q8 V9	A2-A5 PolarHBondContact O-N 3.38Å; A5-Q8 PolarHBondContact O-N 3.47Å; A5-V9 WeakPolarHBondContact O-CG2 3.37Å; A5-V9 PolarHBondContact O-N 3.11Å
6	W	39.6	Very low	35.5	Very low	111 Å²	111	94.6 Å²	94.6	42%	0.42	55%	0.546	S	S	.	.	H	α-helix	trans	-72.7	-33.3	175.3	-78.6	95.8	0	0	0	112.9	A2 A3 Q8 V9 L10 T383	A2-W6 VanDerWaalsContact O-CD1 3.25Å; A2-W6 PolarHBondContact O-N 3.47Å; A3-W6 PolarHBondContact O-N 3.38Å; W6-Q8 VanDerWaalsContact C-N 3.25Å; W6-Q8 PolarHBondContact O-N 3.21Å; W6-V9 PolarHBondContact O-N 3.02Å; W6-L10 PolarHBondContact O-N 3.49Å; W6-L10 VanDerWaalsContact O-N 3.08Å; W6-T383 HydrophobicContact CZ2-CG2 4.16Å
7	L	34.9	Very low	35.7	Very low	122 Å²	122	94.9 Å²	94.9	64%	0.639	54%	0.544	S	S	*	.	H	α-helix	trans	-68.6	-21.5	171.1	-93.6	147.4	0	0	0	113.2	A3 A4 P11	A3-L7 PolarHBondContact O-N 3.09Å; A4-L7 PolarHBondContact O-N 3.32Å; L7-P11 WeakPolarHBondContact O-CD 3.32Å
8	Q	37.1	Very low	35.4	Very low	155 Å²	155	93 Å²	93	72%	0.724	55%	0.549	S	S	*	.	H	α-helix	trans	-86.6	-13.6	170.7	-70.5	-162.5	-19.1	0	0	114.1	A4 A5 W6 P11	A4-Q8 PolarHBondContact O-N 3.46Å; A5-Q8 PolarHBondContact O-N 3.47Å; W6-Q8 VanDerWaalsContact C-N 3.25Å; W6-Q8 PolarHBondContact O-N 3.21Å; Q8-P11 WeakPolarHBondContact O-CD 3.39Å
9	V	37	Very low	35.1	Very low	66 Å²	66	92.8 Å²	92.8	40%	0.4	56%	0.559	S	S	.	*	H	α-helix	trans	-92.1	-18.9	171.9	179.1	0	0	0	0	111.5	A5 W6 V12 V13	A5-V9 WeakPolarHBondContact O-CG2 3.37Å; A5-V9 PolarHBondContact O-N 3.11Å; W6-V9 PolarHBondContact O-N 3.02Å; V9-V12 CarbonylContact O-C 3.54Å; V9-V12 WeakPolarHBondContact O-CA 3.41Å; V9-V12 WeakPolarHBondContact O-CB 3.47Å; V9-V12 PolarHBondContact O-N 3.36Å; V9-V13 HydrophobicContact CG1-CG2 4.12Å; V9-V13 WeakPolarHBondContact O-CG2 3.41Å; V9-V13 PolarHBondContact O-N 3.42Å
10	L	34.7	Very low	34.7	Very low	82 Å²	82	95.8 Å²	95.8	43%	0.429	57%	0.566	S	S	.	*	H	α-helix	trans	-55.1	-45.8	172.6	-132.6	93.7	0	0	0	112.8	W6 V12 V13 V14 W376	W6-L10 PolarHBondContact O-N 3.49Å; W6-L10 VanDerWaalsContact O-N 3.08Å; L10-V12 VanDerWaalsContact C-N 3.25Å; L10-V12 PolarHBondContact O-N 3.17Å; L10-V13 PolarHBondContact O-N 3.34Å; L10-V14 WeakPolarHBondContact O-CB 3.45Å; L10-V14 VanDerWaalsContact O-CG2 3.24Å; L10-V14 WeakPolarHBondContact O-CG2 3.33Å; L10-V14 PolarHBondContact O-N 3.1Å; L10-W376 HydrophobicContact CD1-CH2 3.8Å; L10-W376 HydrophobicContact CD1-CZ3 4.49Å
11	P	35.5	Very low	34.5	Very low	68 Å²	68	96.5 Å²	96.5	44%	0.442	57%	0.574	S	S	.	*	H	α-helix	trans	-63.6	-29.7	172.9	-20.2	31.5	0	0	0	112.9	L7 Q8 V14 L15	L7-P11 WeakPolarHBondContact O-CD 3.32Å; Q8-P11 WeakPolarHBondContact O-CD 3.39Å; P11-V14 PolarHBondContact O-N 3.48Å; P11-L15 WeakPolarHBondContact O-CB 3.45Å; P11-L15 WeakPolarHBondContact O-CD1 3.4Å; P11-L15 WeakPolarHBondContact O-CG 3.23Å; P11-L15 PolarHBondContact O-N 3.44Å
12	V	40.1	Very low	34	Very low	73 Å²	73	90.1 Å²	90.1	44%	0.442	55%	0.551	S	S	.	*	H	α-helix	trans	-76.3	-33.7	178.6	-179.2	0	0	0	0	111.3	V9 L10 L16	V9-V12 CarbonylContact O-C 3.54Å; V9-V12 WeakPolarHBondContact O-CA 3.41Å; V9-V12 WeakPolarHBondContact O-CB 3.47Å; V9-V12 PolarHBondContact O-N 3.36Å; L10-V12 VanDerWaalsContact C-N 3.25Å; L10-V12 PolarHBondContact O-N 3.17Å; V12-L16 HydrophobicContact CG1-CD1 4.44Å; V12-L16 VanDerWaalsContact O-CB 3.25Å; V12-L16 WeakPolarHBondContact O-CB 3.28Å; V12-L16 WeakPolarHBondContact O-CD1 3.41Å; V12-L16 WeakPolarHBondContact O-CG 3.05Å; V12-L16 PolarHBondContact O-N 3.2Å
13	V	39.7	Very low	33.9	Very low	45 Å²	45	91.9 Å²	91.9	27%	0.273	56%	0.556	S	S	.	*	H	α-helix	trans	-73.1	-32.7	171.2	173.9	0	0	0	0	111.4	V9 L10 W376	V9-V13 HydrophobicContact CG1-CG2 4.12Å; V9-V13 WeakPolarHBondContact O-CG2 3.41Å; V9-V13 PolarHBondContact O-N 3.42Å; L10-V13 PolarHBondContact O-N 3.34Å; V13-W376 HydrophobicContact CG1-CE3 4.21Å; V13-W376 HydrophobicContact CG1-CZ3 4.29Å; V13-W376 HydrophobicContact CG2-CZ3 4.28Å
14	V	36.5	Very low	33.6	Very low	99 Å²	99	96.2 Å²	96.2	60%	0.6	57%	0.568	S	S	*	*	H	α-helix	trans	-73.4	-36.6	171.8	171.3	0	0	0	0	111.6	L10 P11 L16 L17	L10-V14 WeakPolarHBondContact O-CB 3.45Å; L10-V14 VanDerWaalsContact O-CG2 3.24Å; L10-V14 WeakPolarHBondContact O-CG2 3.33Å; L10-V14 PolarHBondContact O-N 3.1Å; P11-V14 PolarHBondContact O-N 3.48Å; V14-L16 VanDerWaalsContact C-N 3.32Å; V14-L17 PolarHBondContact O-N 3.25Å
15	L	35.1	Very low	33.3	Very low	133 Å²	133	99 Å²	99	70%	0.696	58%	0.584	S	S	*	*	H	α-helix	trans	-70	-27.6	172	-91.1	152.9	0	0	0	112.6	P11 L17	P11-L15 WeakPolarHBondContact O-CB 3.45Å; P11-L15 WeakPolarHBondContact O-CD1 3.4Å; P11-L15 WeakPolarHBondContact O-CG 3.23Å; P11-L15 PolarHBondContact O-N 3.44Å; L15-L17 PolarHBondContact O-N 2.88Å
16	L	36.1	Very low	32.8	Very low	72 Å²	72	104.1 Å²	104.1	38%	0.377	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-12.7	174.5	-90.4	167.7	0	0	0	114.1	V12 V14 V412 I416	V12-L16 HydrophobicContact CG1-CD1 4.44Å; V12-L16 VanDerWaalsContact O-CB 3.25Å; V12-L16 WeakPolarHBondContact O-CB 3.28Å; V12-L16 WeakPolarHBondContact O-CD1 3.41Å; V12-L16 WeakPolarHBondContact O-CG 3.05Å; V12-L16 PolarHBondContact O-N 3.2Å; V14-L16 VanDerWaalsContact C-N 3.32Å; L16-V412 HydrophobicContact CD1-CG1 4.46Å; L16-I416 HydrophobicContact CD1-CD1 4.2Å; L16-I416 HydrophobicContact CD2-CD1 3.25Å; L16-I416 HydrophobicContact CD2-CG1 3.27Å; L16-I416 HydrophobicContact CG-CD1 4.09Å
17	L	39.4	Very low	32.3	Very low	99 Å²	99	106.7 Å²	106.7	52%	0.518	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.9	22.1	-173.4	-82.6	158.6	0	0	0	115.3	V14 L15 T372	V14-L17 PolarHBondContact O-N 3.25Å; L15-L17 PolarHBondContact O-N 2.88Å; L17-T372 HydrophobicContact CD1-CG2 3.29Å; L17-T372 VanDerWaalsContact CD1-OG1 3.22Å; L17-T372 WeakPolarHBondContact CD1-OG1 3.4Å; L17-T372 WeakPolarHBondContact CD2-OG1 3.19Å
18	G	30.4	Very low	31.9	Very low	61 Å²	61	103.2 Å²	103.2	63%	0.629	60%	0.603	S	S	*	*			trans	102.1	109.4	162.5	0	0	0	0	0	113.8
19	A	29.4	Very low	31.4	Very low	89 Å²	89	102.1 Å²	102.1	74%	0.736	61%	0.607	S	S	*	*			trans	-69	124.6	157.9	0	0	0	0	0	109.4
20	Q	26.5	Very low	31	Very low	152 Å²	152	100.4 Å²	100.4	71%	0.71	60%	0.602	S	S	*	*			trans	-90.4	139.8	143.4	-104.7	-90.7	-44.8	0	0	106.6	S22	Q20-S22 PolarHBondContact NE2-O 3.5Å
21	P	29.9	Very low	30.6	Very low	111 Å²	111	99.3 Å²	99.3	72%	0.721	60%	0.6	S	S	*	*				-133.1	141.6	97.2	33.3	-20.7	0	0	0	114
22	S	22.9	Very low	30.4	Very low	90 Å²	90	97.8 Å²	97.8	63%	0.629	59%	0.593	S	S	*	*	S	Bend	trans	78.3	152.3	156.2	53.9	0	0	0	0	119	Q20	Q20-S22 PolarHBondContact NE2-O 3.5Å
23	P	30.1	Very low	29.9	Very low	109 Å²	109	97.5 Å²	97.5	71%	0.708	59%	0.593	S	S	*	*			trans	-92.1	164.6	-143.5	37.2	-34.7	0	0	0	112.5
24	L	24.1	Very low	29.8	Very low	167 Å²	167	96.2 Å²	96.2	87%	0.874	59%	0.585	S	S	*	*	S	Bend	trans	96.7	72.8	178.3	-54.2	168.5	0	0	0	114.9
25	S	23.1	Very low	29.9	Very low	121 Å²	121	94.4 Å²	94.4	85%	0.846	58%	0.58	S	S	*	*			trans	163.1	77	135.5	46.7	0	0	0	0	109.2	F27	S25-F27 PolarHBondContact O-N 3.23Å
26	L	27.8	Very low	30.3	Very low	161 Å²	161	89.5 Å²	89.5	84%	0.843	56%	0.559	S	S	*	*			trans	-54.4	118.1	158.2	-84.1	142.1	0	0	0	107.8
27	F	28.5	Very low	31.1	Very low	165 Å²	165	86.4 Å²	86.4	72%	0.724	54%	0.544	S	S	*	.			trans	-175.6	123.2	140	-86.3	-60.5	0	0	0	110.8	S25 R427	S25-F27 PolarHBondContact O-N 3.23Å; F27-R427 PolarHBondContact O-NH2 3.01Å
28	S	27	Very low	32.2	Very low	49 Å²	49	85.6 Å²	85.6	34%	0.343	54%	0.54	S	S	.	.			trans	52.4	93.6	157.4	-162	0	0	0	0	119.9	R427	S28-R427 PolarHBondContact O-NH1 3.19Å; S28-R427 PolarHBondContact O-NH2 3.45Å
29	V	25.9	Very low	34.1	Very low	133 Å²	133	88.8 Å²	88.8	81%	0.806	53%	0.533	S	S	*	.			trans	-101.9	72.7	154.9	-179.2	0	0	0	0	107.9	F364	V29-F364 WeakPolarHBondContact O-CZ 3.23Å
30	G	27.7	Very low	36.3	Very low	29 Å²	29	84.5 Å²	84.5	30%	0.299	50%	0.498	S	S	.	.	S	Bend	trans	-147	170.1	165.2	0	0	0	0	0	107.5	A32	G30-A32 PolarHBondContact O-N 3.47Å
31	P	28	Very low	38.8	Very low	60 Å²	60	79.3 Å²	79.3	39%	0.39	47%	0.473	S	S	.	.	S	Bend	trans	-45.5	133.8	164.2	21.1	-31.3	0	0	0	108	W445	P31-W445 HydrophobicContact CB-CG 3.98Å
32	A	29.7	Very low	41.3	Very low	36 Å²	36	76.4 Å²	76.4	30%	0.298	45%	0.448	S	S	.	.			trans	-43.8	136	176.3	0	0	0	0	0	108.8	G30 V34 D441	G30-A32 PolarHBondContact O-N 3.47Å; A32-V34 PolarHBondContact O-N 2.78Å; A32-D441 WeakPolarHBondContact CB-OD2 3.36Å; A32-D441 PolarHBondContact N-OD2 2.91Å
33	P	31.1	Very low	44.1	Very low	67 Å²	67	77 Å²	77	44%	0.435	44%	0.44	S	S	.	.			trans	-49.6	136.8	178.1	22.3	-32.3	0	0	0	107.4	A35 R351	P33-A35 PolarHBondContact O-N 2.97Å; P33-R351 HydrophobicContact CB-CG 4.09Å
34	V	37	Very low	46.4	Very low	17 Å²	17	73.4 Å²	73.4	10%	0.103	42%	0.415	C	S	.	.			trans	-60	90.8	154.6	-177.8	0	0	0	0	103.5	A32 A36 F276	A32-V34 PolarHBondContact O-N 2.78Å; V34-A36 PolarHBondContact O-N 3.23Å; V34-F276 HydrophobicContact CG1-CE1 4.28Å
35	A	38.7	Very low	49	Very low	61 Å²	61	69.1 Å²	69.1	50%	0.504	40%	0.397	S	S	.	.			trans	-53.1	118.2	154.5	0	0	0	0	0	102.6	P33 A37	P33-A35 PolarHBondContact O-N 2.97Å; A35-A37 PolarHBondContact O-N 3.3Å
36	A	43.3	Very low	51.3	Low	31 Å²	31	64.6 Å²	64.6	26%	0.256	36%	0.363	S	S	.	.			trans	-39.3	124.2	158.1	0	0	0	0	0	105.6	V34 D38 L294	V34-A36 PolarHBondContact O-N 3.23Å; A36-D38 WeakPolarHBondContact O-CA 3.48Å; A36-D38 PolarHBondContact O-N 3.41Å; A36-L294 HydrophobicContact CB-CD2 3.3Å
37	A	52.2	Low	53	Low	7 Å²	7	59.6 Å²	59.6	6%	0.058	34%	0.341	C	S	.	.			trans	-44.3	120.2	179.3	0	0	0	0	0	107.7	A35 R39 D223 F280 I283	A35-A37 PolarHBondContact O-N 3.3Å; A37-R39 PolarHBondContact O-N 2.9Å; A37-D223 WeakPolarHBondContact CA-OD1 3.22Å; A37-D223 HydrophobicContact CB-CB 4.49Å; A37-D223 VanDerWaalsContact CB-OD1 3.27Å; A37-D223 WeakPolarHBondContact CB-OD1 3.49Å; A37-F280 HydrophobicContact CB-CD1 4.14Å; A37-F280 HydrophobicContact CB-CE1 3.66Å; A37-F280 HydrophobicContact CB-CZ 4.43Å; A37-I283 HydrophobicContact CB-CD1 3.52Å
38	D	62.3	Low	54.1	Low	82 Å²	82	55.3 Å²	55.3	44%	0.439	33%	0.331	S	S	.	.			trans	-57.6	140.8	-161.7	-98.7	-27.6	0	0	0	108.1	A36 S40 K57	A36-D38 WeakPolarHBondContact O-CA 3.48Å; A36-D38 PolarHBondContact O-N 3.41Å; D38-S40 PolarHBondContact O-N 3.17Å; D38-K57 VanDerWaalsContact C-NZ 3.29Å; D38-K57 HydrophobicContact CB-CD 4.44Å; D38-K57 VanDerWaalsContact CB-CE 3.43Å; D38-K57 PolarHBondContact O-NZ 3.01Å
39	R	70	Confident	55.6	Low	127 Å²	127	56.3 Å²	56.3	48%	0.479	35%	0.349	S	S	.	.			trans	-60	138.2	-178.3	-63.5	-179.9	-179.1	168.4	3.2	109	A37 W42 K57	A37-R39 PolarHBondContact O-N 2.9Å; R39-W42 VanDerWaalsContact O-CH2 3.28Å; R39-W42 WeakPolarHBondContact O-CH2 3.48Å; R39-W42 WeakPolarHBondContact O-CZ2 3.43Å; R39-K57 PolarHBondContact O-NZ 3.15Å
40	S	75.8	Confident	57.6	Low	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.339	C	S	.	.	S	Bend	trans	-102.3	-0.1	174.3	-67.6	0	0	0	0	112.1	D38 K57 V212 Y218 G287	D38-S40 PolarHBondContact O-N 3.17Å; S40-K57 PolarHBondContact OG-NZ 3.41Å; S40-V212 PolarHBondContact O-N 3.16Å; S40-Y218 WeakPolarHBondContact CB-O 3.38Å; S40-Y218 PolarHBondContact OG-O 2.91Å; S40-G287 PolarHBondContact N-O 2.75Å
41	K	80.8	Confident	59.9	Low	42 Å²	42	58.6 Å²	58.6	18%	0.183	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	123.8	175	-172.2	164	175.5	-120.2	0	109	H43 T209 V210 E211 G287 E288	K41-H43 VanDerWaalsContact CE-NE2 3.31Å; K41-H43 WeakPolarHBondContact CE-NE2 3.24Å; K41-H43 PolarHBondContact NZ-NE2 3.11Å; K41-T209 HydrophobicContact CG-CG2 4.44Å; K41-V210 VanDerWaalsContact CA-O 3.31Å; K41-V210 WeakPolarHBondContact CA-O 3.14Å; K41-E211 HydrophobicContact CB-CG 4.5Å; K41-E211 HydrophobicContact CD-CG 3.86Å; K41-E211 WeakPolarHBondContact CE-OE1 3.48Å; K41-E211 HydrophobicContact CG-CG 3.81Å; K41-G287 PolarHBondContact N-O 3.39Å; K41-E288 HydrophobicContact CB-CG 4.07Å; K41-E288 HydrophobicContact CD-CG 4.25Å; K41-E288 WeakPolarHBondContact CD-OE1 3.42Å; K41-E288 HydrophobicContact CG-CG 4.39Å; K41-E288 IonicContact NZ-OE1 2.78Å; K41-E288 PolarHBondContact NZ-OE1 2.97Å
42	W	80.9	Confident	62.4	Low	51 Å²	51	58.7 Å²	58.7	19%	0.193	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132	179.3	-60.5	-95	0	0	0	109.6	R39 I44 F55 K57 T209 V210 V212	R39-W42 VanDerWaalsContact O-CH2 3.28Å; R39-W42 WeakPolarHBondContact O-CH2 3.48Å; R39-W42 WeakPolarHBondContact O-CZ2 3.43Å; W42-I44 HydrophobicContact CB-CD1 4.15Å; W42-I44 HydrophobicContact CB-CG1 4.45Å; W42-F55 HydrophobicContact CB-CD1 4.49Å; W42-F55 HydrophobicContact CB-CE1 3.86Å; W42-F55 AromaticContact CD2-CD1 3.65Å; W42-F55 HydrophobicContact CD2-CD1 3.65Å; W42-F55 AromaticContact CD2-CE1 3.93Å; W42-F55 HydrophobicContact CD2-CE1 3.93Å; W42-F55 AromaticContact CE2-CD1 3.75Å; W42-F55 HydrophobicContact CE3-CD1 4.09Å; W42-F55 HydrophobicContact CE3-CE1 4.44Å; W42-F55 AromaticContact CG-CD1 3.85Å; W42-F55 HydrophobicContact CG-CD1 3.85Å; W42-F55 AromaticContact CG-CE1 3.67Å; W42-F55 HydrophobicContact CG-CE1 3.67Å; W42-F55 HydrophobicContact CZ2-CD1 4.24Å; W42-F55 AromaticContact NE1-CD1 4Å; W42-K57 HydrophobicContact CH2-CD 4.15Å; W42-K57 HydrophobicContact CZ2-CD 4.45Å; W42-T209 VanDerWaalsContact O-CA 3.25Å; W42-T209 WeakPolarHBondContact O-CA 3.35Å; W42-V210 HydrophobicContact CE3-CB 3.89Å; W42-V210 HydrophobicContact CE3-CG1 3.88Å; W42-V210 HydrophobicContact CZ3-CG1 4.09Å; W42-V210 PolarHBondContact N-O 3.43Å; W42-V210 PolarHBondContact O-N 3.23Å; W42-V212 HydrophobicContact CH2-CG2 4.15Å; W42-V212 HydrophobicContact CZ3-CB 4.34Å; W42-V212 HydrophobicContact CZ3-CG2 3.65Å
43	H	81.5	Confident	65	Low	101 Å²	101	57.9 Å²	57.9	47%	0.468	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	108.3	170.8	-67.4	-70.8	0	0	0	108	K41 T209 E288	K41-H43 VanDerWaalsContact CE-NE2 3.31Å; K41-H43 WeakPolarHBondContact CE-NE2 3.24Å; K41-H43 PolarHBondContact NZ-NE2 3.11Å; H43-T209 VanDerWaalsContact CE1-CG2 3.46Å; H43-T209 WeakPolarHBondContact CE1-CG2 3.29Å; H43-T209 PolarHBondContact CE1-OG1 3.08Å; H43-T209 PolarHBondContact ND1-OG1 2.97Å; H43-E288 IonicContact CD2-OE1 3.91Å; H43-E288 IonicContact NE2-OE1 3.64Å; H43-E288 PolarHBondContact NE2-OE1 3.24Å; H43-E288 VanDerWaalsContact NE2-OE1 3.16Å
44	I	78.9	Confident	67.4	Low	35 Å²	35	56.4 Å²	56.4	18%	0.179	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	113.7	-175.2	-68.1	158	0	0	0	108.9	W42 I46 F53 F55 T207 M208	W42-I44 HydrophobicContact CB-CD1 4.15Å; W42-I44 HydrophobicContact CB-CG1 4.45Å; I44-I46 PolarHBondContact O-N 2.86Å; I44-F53 HydrophobicContact CD1-CD1 4.49Å; I44-F53 HydrophobicContact CG2-CD1 3.81Å; I44-F53 HydrophobicContact CG2-CE1 3.54Å; I44-F53 HydrophobicContact CG2-CZ 4.4Å; I44-F55 HydrophobicContact CD1-CE1 3.35Å; I44-F55 HydrophobicContact CD1-CZ 3.28Å; I44-T207 WeakPolarHBondContact O-CA 3.39Å; I44-M208 HydrophobicContact CB-CE 4.49Å; I44-M208 HydrophobicContact CD1-CE 4.03Å; I44-M208 PolarHBondContact N-O 2.9Å; I44-M208 PolarHBondContact O-N 2.89Å
45	P	78.3	Confident	69.6	Low	77 Å²	77	56.4 Å²	56.4	50%	0.5	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.6	163.8	29.5	-31.2	0	0	0	107.6	P47	P45-P47 WeakPolarHBondContact O-CD 3.25Å
46	I	72.4	Confident	71.7	Confident	25 Å²	25	55 Å²	55	13%	0.128	31%	0.308	C	S	.	.			trans	-84.3	106.7	-179.3	-62.1	165.1	0	0	0	107.9	I44 F53 F69 I188 F206 M208	I44-I46 PolarHBondContact O-N 2.86Å; I46-F53 HydrophobicContact CG1-CZ 4.36Å; I46-F53 HydrophobicContact CG2-CE2 4.48Å; I46-F53 HydrophobicContact CG2-CZ 4.2Å; I46-F69 HydrophobicContact CD1-CD1 4.49Å; I46-F69 HydrophobicContact CD1-CE1 4.41Å; I46-I188 HydrophobicContact CD1-CD1 3.73Å; I46-I188 HydrophobicContact CG1-CD1 4.27Å; I46-F206 HydrophobicContact CD1-CB 3.93Å; I46-F206 PolarHBondContact N-O 3.48Å; I46-F206 VanDerWaalsContact N-O 3.1Å; I46-M208 HydrophobicContact CD1-CB 4.21Å; I46-M208 HydrophobicContact CG1-CB 4.31Å
47	P	63.4	Low	73.6	Confident	57 Å²	57	54.2 Å²	54.2	37%	0.37	30%	0.299	S	S	.	.			trans	-83.6	151.2	-179.2	34	-29	0	0	0	110.9	P45 G49 K50	P45-P47 WeakPolarHBondContact O-CD 3.25Å; P47-G49 PolarHBondContact O-N 3.15Å; P47-K50 HydrophobicContact CG-CB 4.35Å
48	S	51	Low	75.2	Confident	75 Å²	75	54 Å²	54	52%	0.524	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	105.5	169.4	-54.5	0	0	0	0	109.7
49	G	58.9	Low	76.4	Confident	70 Å²	70	50.4 Å²	50.4	72%	0.722	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.5	-11.7	171.2	0	0	0	0	0	117.1	P47	P47-G49 PolarHBondContact O-N 3.15Å
50	K	67.4	Low	77.2	Confident	134 Å²	134	45.2 Å²	45.2	58%	0.583	26%	0.258	S	S	*	.			trans	-109.5	113.6	170.9	-73.5	-170.7	178.6	-176.1	0	110.6	P47	P47-K50 HydrophobicContact CG-CB 4.35Å
51	N	76.4	Confident	77.8	Confident	76 Å²	76	52.3 Å²	52.3	41%	0.406	29%	0.285	S	S	.	.			trans	-95.5	-14	-178.9	-61	-14	0	0	0	112.9	H187 I188	N51-H187 CarbonylContact O-C 3.55Å; N51-H187 WeakPolarHBondContact O-CA 3.35Å; N51-H187 PolarHBondContact O-CD2 3.44Å; N51-I188 PolarHBondContact O-N 3.38Å
52	Y	81.1	Confident	78	Confident	62 Å²	62	54.9 Å²	54.9	24%	0.243	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.9	-177.7	-65.7	-86.3	0	0	0	111.8	V101 E102 L105 I185 V186 H187	Y52-V101 HydrophobicContact CD1-CG1 3.73Å; Y52-V101 HydrophobicContact CG-CG1 3.91Å; Y52-E102 HydrophobicContact CD2-CG 3.96Å; Y52-E102 HydrophobicContact CE2-CG 3.49Å; Y52-E102 VanDerWaalsContact CE2-CG 3.49Å; Y52-E102 VanDerWaalsContact CE2-OE1 3.26Å; Y52-E102 WeakPolarHBondContact CE2-OE1 3.37Å; Y52-L105 HydrophobicContact CD1-CD1 3.77Å; Y52-L105 HydrophobicContact CE1-CD1 3.37Å; Y52-I185 HydrophobicContact CD1-CG2 4.31Å; Y52-V186 WeakPolarHBondContact CA-O 3.38Å; Y52-H187 HydrophobicContact CD1-CB 3.6Å; Y52-H187 AromaticContact CD1-CD2 3.8Å; Y52-H187 HydrophobicContact CE1-CB 3.52Å; Y52-H187 AromaticContact CE1-CD2 3.34Å; Y52-H187 WeakPolarHBondContact CE1-CD2 3.29Å; Y52-H187 AromaticContact CE1-CG 3.56Å; Y52-H187 AromaticContact CE2-CD2 3.65Å; Y52-H187 HydrophobicContact CG-CB 4.49Å; Y52-H187 AromaticContact CZ-CD2 3.27Å; Y52-H187 AromaticContact CZ-CG 3.92Å; Y52-H187 AromaticContact CZ-NE2 3.9Å
53	F	82.6	Confident	78.3	Confident	19 Å²	19	52.5 Å²	52.5	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.7	176	-58.4	-85.9	0	0	0	109	I44 I46 F55 I185 V186 I188 M208	I44-F53 HydrophobicContact CD1-CD1 4.49Å; I44-F53 HydrophobicContact CG2-CD1 3.81Å; I44-F53 HydrophobicContact CG2-CE1 3.54Å; I44-F53 HydrophobicContact CG2-CZ 4.4Å; I46-F53 HydrophobicContact CG1-CZ 4.36Å; I46-F53 HydrophobicContact CG2-CE2 4.48Å; I46-F53 HydrophobicContact CG2-CZ 4.2Å; F53-F55 HydrophobicContact CB-CE2 3.96Å; F53-F55 HydrophobicContact CB-CZ 4.15Å; F53-I185 CarbonylContact O-C 3.52Å; F53-I185 VanDerWaalsContact O-CA 3.3Å; F53-I185 WeakPolarHBondContact O-CA 3.21Å; F53-V186 PolarHBondContact N-O 3.04Å; F53-V186 PolarHBondContact O-N 3.39Å; F53-I188 HydrophobicContact CD2-CD1 4.1Å; F53-I188 HydrophobicContact CE2-CD1 3.82Å; F53-M208 HydrophobicContact CB-CE 3.84Å; F53-M208 HydrophobicContact CD1-CE 4.35Å; F53-M208 HydrophobicContact CD2-CE 4.11Å; F53-M208 HydrophobicContact CG-CE 3.83Å
54	S	82.8	Confident	78.4	Confident	36 Å²	36	48.8 Å²	48.8	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.3	-176.2	59.1	0	0	0	0	112.3	F96 F184	S54-F96 VanDerWaalsContact CB-CE1 3.4Å; S54-F184 CarbonylContact C-O 3.48Å; S54-F184 WeakPolarHBondContact CA-O 3.18Å
55	F	83.6	Confident	78.7	Confident	17 Å²	17	47.6 Å²	47.6	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	111.5	-179.4	-50	-88.7	0	0	0	108.7	W42 I44 F53 I183 F184 V186 M208 V210	W42-F55 HydrophobicContact CB-CD1 4.49Å; W42-F55 HydrophobicContact CB-CE1 3.86Å; W42-F55 AromaticContact CD2-CD1 3.65Å; W42-F55 HydrophobicContact CD2-CD1 3.65Å; W42-F55 AromaticContact CD2-CE1 3.93Å; W42-F55 HydrophobicContact CD2-CE1 3.93Å; W42-F55 AromaticContact CE2-CD1 3.75Å; W42-F55 HydrophobicContact CE3-CD1 4.09Å; W42-F55 HydrophobicContact CE3-CE1 4.44Å; W42-F55 AromaticContact CG-CD1 3.85Å; W42-F55 HydrophobicContact CG-CD1 3.85Å; W42-F55 AromaticContact CG-CE1 3.67Å; W42-F55 HydrophobicContact CG-CE1 3.67Å; W42-F55 HydrophobicContact CZ2-CD1 4.24Å; W42-F55 AromaticContact NE1-CD1 4Å; I44-F55 HydrophobicContact CD1-CE1 3.35Å; I44-F55 HydrophobicContact CD1-CZ 3.28Å; F53-F55 HydrophobicContact CB-CE2 3.96Å; F53-F55 HydrophobicContact CB-CZ 4.15Å; F55-I183 WeakPolarHBondContact O-CA 2.9Å; F55-F184 HydrophobicContact CB-CB 4.37Å; F55-F184 AromaticContact CD2-CD1 3.77Å; F55-F184 HydrophobicContact CD2-CD1 3.77Å; F55-F184 WeakPolarHBondContact CD2-O 3.28Å; F55-F184 HydrophobicContact CE2-CD1 4.39Å; F55-F184 PolarHBondContact N-O 2.94Å; F55-F184 PolarHBondContact O-N 2.9Å; F55-V186 HydrophobicContact CE2-CG2 4.45Å; F55-M208 HydrophobicContact CE2-CE 4.05Å; F55-M208 HydrophobicContact CZ-CE 3.74Å; F55-V210 HydrophobicContact CE1-CG2 4.33Å; F55-V210 HydrophobicContact CE2-CG2 3.88Å; F55-V210 HydrophobicContact CZ-CB 4.42Å; F55-V210 HydrophobicContact CZ-CG2 3.74Å
56	G	81.4	Confident	78.9	Confident	32 Å²	32	47.6 Å²	47.6	33%	0.33	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.6	175.7	0	0	0	0	0	110.6	Y182	G56-Y182 WeakPolarHBondContact CA-O 3.21Å
57	K	83.8	Confident	79.3	Confident	13 Å²	13	46.9 Å²	46.9	6%	0.057	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	152.2	176	-148.4	160.2	-168	-174.1	0	113.9	D38 R39 S40 W42 L59 Y182 T220	D38-K57 VanDerWaalsContact C-NZ 3.29Å; D38-K57 HydrophobicContact CB-CD 4.44Å; D38-K57 VanDerWaalsContact CB-CE 3.43Å; D38-K57 PolarHBondContact O-NZ 3.01Å; R39-K57 PolarHBondContact O-NZ 3.15Å; S40-K57 PolarHBondContact OG-NZ 3.41Å; W42-K57 HydrophobicContact CH2-CD 4.15Å; W42-K57 HydrophobicContact CZ2-CD 4.45Å; K57-L59 HydrophobicContact CB-CD2 3.98Å; K57-L59 HydrophobicContact CB-CG 4.38Å; K57-L59 HydrophobicContact CD-CD2 4.36Å; K57-L59 HydrophobicContact CG-CD2 4.17Å; K57-Y182 PolarHBondContact N-O 2.92Å; K57-Y182 PolarHBondContact O-N 3.39Å; K57-T220 HydrophobicContact CD-CG2 3.59Å; K57-T220 HydrophobicContact CG-CG2 4.09Å; K57-T220 VanDerWaalsContact NZ-CG2 3.26Å
58	I	86.5	Confident	80.1	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	116.5	171.3	-49.4	-176.1	0	0	0	109.7	Y90 P181 L221 E222 W435 L438	I58-Y90 HydrophobicContact CD1-CD2 3.82Å; I58-Y90 HydrophobicContact CD1-CE2 3.64Å; I58-Y90 HydrophobicContact CG1-CD2 4.14Å; I58-Y90 HydrophobicContact CG1-CE2 3.91Å; I58-P181 HydrophobicContact CG1-CB 4.5Å; I58-P181 HydrophobicContact CG1-CG 4.48Å; I58-L221 HydrophobicContact CG2-CB 4.07Å; I58-L221 HydrophobicContact CG2-CD2 4.14Å; I58-L221 HydrophobicContact CG2-CG 4.28Å; I58-L221 PolarHBondContact O-N 3.17Å; I58-E222 HydrophobicContact CB-CB 4.49Å; I58-E222 HydrophobicContact CD1-CB 4.27Å; I58-W435 HydrophobicContact CD1-CB 4.31Å; I58-W435 HydrophobicContact CD1-CE3 4.15Å; I58-W435 HydrophobicContact CG2-CD2 4.36Å; I58-W435 HydrophobicContact CG2-CE3 3.53Å; I58-W435 HydrophobicContact CG2-CH2 4.3Å; I58-W435 HydrophobicContact CG2-CZ3 3.5Å; I58-W435 VanDerWaalsContact CG2-CZ3 3.5Å; I58-L438 HydrophobicContact CD1-CD1 3.94Å
59	L	86.9	Confident	81.5	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	148.4	-172.5	-55.9	179.9	0	0	0	112	K57 T63 I65 T176 A180 Y182 V212 T220	K57-L59 HydrophobicContact CB-CD2 3.98Å; K57-L59 HydrophobicContact CB-CG 4.38Å; K57-L59 HydrophobicContact CD-CD2 4.36Å; K57-L59 HydrophobicContact CG-CD2 4.17Å; L59-T63 HydrophobicContact CB-CG2 4.47Å; L59-T63 HydrophobicContact CD1-CG2 4.35Å; L59-T63 HydrophobicContact CD2-CG2 4.38Å; L59-I65 HydrophobicContact CD1-CD1 4.44Å; L59-T176 HydrophobicContact CB-CG2 4.07Å; L59-T176 HydrophobicContact CD1-CG2 3.78Å; L59-A180 PolarHBondContact N-O 3.29Å; L59-A180 PolarHBondContact O-N 3.07Å; L59-Y182 HydrophobicContact CB-CD2 3.85Å; L59-Y182 HydrophobicContact CB-CE2 4.43Å; L59-Y182 HydrophobicContact CD1-CD2 4.26Å; L59-Y182 HydrophobicContact CD1-CG 4.23Å; L59-Y182 HydrophobicContact CG-CD2 4.27Å; L59-V212 HydrophobicContact CD1-CG1 4.14Å; L59-V212 HydrophobicContact CD2-CG1 3.59Å; L59-T220 HydrophobicContact CD2-CG2 4.39Å
60	F	87.3	Confident	82.4	Confident	19 Å²	19	46 Å²	46	8%	0.083	22%	0.224	C	C	.	.			trans	-69.8	157.2	167.7	-67.7	-85	0	0	0	110.4	T63 T176 D179 P215 Y216 L221 Y224	F60-T63 PolarHBondContact N-OG1 3.36Å; F60-T63 WeakPolarHBondContact O-CB 3.22Å; F60-T63 PolarHBondContact O-N 3.02Å; F60-T63 PolarHBondContact O-OG1 3.45Å; F60-T176 PolarHBondContact O-OG1 3.43Å; F60-D179 WeakPolarHBondContact CA-OD1 3.5Å; F60-P215 HydrophobicContact CB-CG 3.86Å; F60-P215 HydrophobicContact CD1-CG 4.37Å; F60-P215 HydrophobicContact CD2-CG 4.25Å; F60-P215 HydrophobicContact CG-CG 3.93Å; F60-Y216 HydrophobicContact CD2-CD2 4.44Å; F60-Y216 HydrophobicContact CE1-CD2 4.03Å; F60-Y216 AromaticContact CE1-CE2 3.91Å; F60-Y216 HydrophobicContact CE1-CE2 3.91Å; F60-Y216 AromaticContact CE2-CD2 3.86Å; F60-Y216 HydrophobicContact CE2-CD2 3.86Å; F60-Y216 AromaticContact CZ-CD2 3.63Å; F60-Y216 HydrophobicContact CZ-CD2 3.63Å; F60-Y216 AromaticContact CZ-CE2 3.92Å; F60-Y216 HydrophobicContact CZ-CE2 3.92Å; F60-L221 HydrophobicContact CD1-CB 4.24Å; F60-L221 HydrophobicContact CD1-CD1 3.67Å; F60-L221 HydrophobicContact CD1-CD2 4.42Å; F60-L221 HydrophobicContact CD1-CG 4.32Å; F60-L221 HydrophobicContact CD2-CB 3.99Å; F60-L221 HydrophobicContact CE1-CB 4.16Å; F60-L221 HydrophobicContact CE1-CD1 3.17Å; F60-L221 HydrophobicContact CE1-CG 4.15Å; F60-L221 VanDerWaalsContact CE2-CA 3.5Å; F60-L221 HydrophobicContact CE2-CB 3.87Å; F60-L221 HydrophobicContact CE2-CD1 4.36Å; F60-L221 HydrophobicContact CG-CB 4.17Å; F60-L221 HydrophobicContact CG-CD1 4.45Å; F60-L221 HydrophobicContact CZ-CB 3.95Å; F60-L221 HydrophobicContact CZ-CD1 3.56Å; F60-L221 HydrophobicContact CZ-CG 4.33Å; F60-Y224 HydrophobicContact CZ-CD1 4.46Å; F60-Y224 HydrophobicContact CZ-CD2 4.41Å; F60-Y224 HydrophobicContact CZ-CG 4.01Å
61	R	87.8	Confident	82.8	Confident	149 Å²	149	41.4 Å²	41.4	56%	0.562	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	144.8	163.5	-179.2	174.4	178.4	-169.1	1.5	110.8	T63 D179	R61-T63 PolarHBondContact O-N 3.5Å; R61-D179 WeakPolarHBondContact CB-OD1 3.39Å; R61-D179 PolarHBondContact N-OD1 2.98Å
62	N	86	Confident	82.6	Confident	95 Å²	95	43.9 Å²	43.9	51%	0.508	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	27.1	-177.6	-53.2	-16.2	0	0	0	113.6	T176	N62-T176 PolarHBondContact N-O 3.43Å; N62-T176 PolarHBondContact N-OG1 3.15Å
63	T	85.9	Confident	82	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	24%	0.243	C	C	.	.			trans	-77.1	126.5	169.9	-62.8	0	0	0	0	109	L59 F60 R61 Q175 T176 V212	L59-T63 HydrophobicContact CB-CG2 4.47Å; L59-T63 HydrophobicContact CD1-CG2 4.35Å; L59-T63 HydrophobicContact CD2-CG2 4.38Å; F60-T63 PolarHBondContact N-OG1 3.36Å; F60-T63 WeakPolarHBondContact O-CB 3.22Å; F60-T63 PolarHBondContact O-N 3.02Å; F60-T63 PolarHBondContact O-OG1 3.45Å; R61-T63 PolarHBondContact O-N 3.5Å; T63-Q175 VanDerWaalsContact O-CA 3.29Å; T63-Q175 WeakPolarHBondContact O-CA 3.01Å; T63-T176 WeakPolarHBondContact CB-OG1 3.11Å; T63-T176 PolarHBondContact N-OG1 3.14Å; T63-T176 PolarHBondContact O-N 3.19Å; T63-V212 HydrophobicContact CG2-CG1 3.44Å; T63-V212 VanDerWaalsContact CG2-CG1 3.44Å
64	T	84.8	Confident	81.4	Confident	22 Å²	22	45.7 Å²	45.7	14%	0.135	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.7	176.5	49.6	0	0	0	0	111.4	F66 P173 L174 Q175 K213	T64-F66 VanDerWaalsContact OG1-CE2 3.28Å; T64-F66 WeakPolarHBondContact OG1-CE2 3.5Å; T64-P173 HydrophobicContact CG2-CB 4.29Å; T64-P173 HydrophobicContact CG2-CG 3.97Å; T64-L174 WeakPolarHBondContact CA-O 3.2Å; T64-Q175 HydrophobicContact CG2-CG 3.68Å; T64-K213 PolarHBondContact N-O 3.08Å; T64-K213 PolarHBondContact O-N 3.17Å; T64-K213 PolarHBondContact OG1-O 3.17Å
65	I	84.3	Confident	80.7	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.051	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.6	173.9	-52.7	180	0	0	0	108	L59 L84 L174 F184 V210 V212	L59-I65 HydrophobicContact CD1-CD1 4.44Å; I65-L84 HydrophobicContact CD1-CD1 3.67Å; I65-L84 HydrophobicContact CD1-CD2 4.06Å; I65-L174 HydrophobicContact CB-CB 4.47Å; I65-L174 HydrophobicContact CB-CD2 3.99Å; I65-L174 HydrophobicContact CB-CG 4.2Å; I65-L174 HydrophobicContact CD1-CD2 4.29Å; I65-L174 HydrophobicContact CG2-CD2 4.33Å; I65-L174 PolarHBondContact N-O 3.17Å; I65-F184 HydrophobicContact CD1-CD2 4.37Å; I65-F184 HydrophobicContact CD1-CG 4.4Å; I65-F184 HydrophobicContact CG2-CD1 4.24Å; I65-F184 HydrophobicContact CG2-CE1 4.04Å; I65-F184 HydrophobicContact CG2-CZ 4.19Å; I65-V210 HydrophobicContact CG2-CG1 4.25Å; I65-V212 HydrophobicContact CG1-CG2 4.26Å; I65-V212 HydrophobicContact CG2-CG2 4.26Å
66	F	82.3	Confident	80.2	Confident	77 Å²	77	52.2 Å²	52.2	34%	0.338	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.6	174.5	-55.4	-81.8	0	0	0	109.7	T64 V210 E211 K213	T64-F66 VanDerWaalsContact OG1-CE2 3.28Å; T64-F66 WeakPolarHBondContact OG1-CE2 3.5Å; F66-V210 WeakPolarHBondContact O-CA 3.38Å; F66-E211 HydrophobicContact CB-CB 4.14Å; F66-E211 HydrophobicContact CD2-CB 4.42Å; F66-E211 PolarHBondContact N-O 3.41Å; F66-E211 PolarHBondContact O-N 3.4Å; F66-K213 HydrophobicContact CD2-CB 4.48Å; F66-K213 HydrophobicContact CE2-CB 3.97Å; F66-K213 HydrophobicContact CE2-CD 4.5Å
67	L	81.1	Confident	79.9	Confident	11 Å²	11	52.5 Å²	52.5	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.6	174.9	179.9	65.7	0	0	0	107.2	F69 I80 F137 V186 M208 V210	L67-F69 HydrophobicContact CD1-CE2 4.14Å; L67-F69 HydrophobicContact CD1-CZ 3.91Å; L67-F69 HydrophobicContact CD2-CE2 3.71Å; L67-F69 HydrophobicContact CD2-CZ 3.81Å; L67-F69 HydrophobicContact CG-CD2 4.47Å; L67-F69 HydrophobicContact CG-CE2 3.55Å; L67-F69 HydrophobicContact CG-CZ 3.8Å; L67-I80 HydrophobicContact CD2-CG2 4.48Å; L67-F137 HydrophobicContact CB-CD2 3.8Å; L67-F137 HydrophobicContact CB-CE2 3.64Å; L67-F137 HydrophobicContact CB-CZ 4.41Å; L67-F137 HydrophobicContact CD2-CD1 4.46Å; L67-F137 HydrophobicContact CD2-CD2 4.21Å; L67-F137 HydrophobicContact CD2-CE1 4.04Å; L67-F137 HydrophobicContact CD2-CE2 3.78Å; L67-F137 HydrophobicContact CD2-CZ 3.7Å; L67-F137 HydrophobicContact CG-CD2 4.4Å; L67-F137 HydrophobicContact CG-CE2 3.85Å; L67-F137 HydrophobicContact CG-CZ 4.15Å; L67-F137 WeakPolarHBondContact O-CE2 3.45Å; L67-V186 HydrophobicContact CD1-CG2 4.43Å; L67-V186 HydrophobicContact CD2-CG1 4.39Å; L67-V186 HydrophobicContact CD2-CG2 4.42Å; L67-M208 HydrophobicContact CD1-CG 3.58Å; L67-M208 HydrophobicContact CD1-SD 3.68Å; L67-V210 HydrophobicContact CD1-CG2 3.77Å
68	K	81.2	Confident	79.6	Confident	89 Å²	89	52.2 Å²	52.2	39%	0.387	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	144.3	179.8	-63.1	175.2	-170.8	162	0	109	T209 E211	K68-T209 PolarHBondContact N-O 3.39Å; K68-T209 PolarHBondContact O-N 2.84Å; K68-E211 IonicContact NZ-OE1 2.77Å; K68-E211 PolarHBondContact NZ-OE1 2.95Å; K68-E211 IonicContact NZ-OE2 2.91Å; K68-E211 PolarHBondContact NZ-OE2 3.18Å
69	F	79.5	Confident	79.5	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.035	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	131	174.4	-65.7	-84.8	0	0	0	107.9	I46 L67 I80 L131 F132 F137 I188 M208	I46-F69 HydrophobicContact CD1-CD1 4.49Å; I46-F69 HydrophobicContact CD1-CE1 4.41Å; L67-F69 HydrophobicContact CD1-CE2 4.14Å; L67-F69 HydrophobicContact CD1-CZ 3.91Å; L67-F69 HydrophobicContact CD2-CE2 3.71Å; L67-F69 HydrophobicContact CD2-CZ 3.81Å; L67-F69 HydrophobicContact CG-CD2 4.47Å; L67-F69 HydrophobicContact CG-CE2 3.55Å; L67-F69 HydrophobicContact CG-CZ 3.8Å; F69-I80 HydrophobicContact CD2-CD1 4.25Å; F69-I80 HydrophobicContact CE1-CD1 4.02Å; F69-I80 HydrophobicContact CE2-CD1 3.54Å; F69-I80 HydrophobicContact CZ-CD1 3.43Å; F69-I80 VanDerWaalsContact CZ-CD1 3.43Å; F69-I80 HydrophobicContact CZ-CG2 4.48Å; F69-L131 HydrophobicContact CB-CD2 3.51Å; F69-L131 HydrophobicContact CB-CG 3.81Å; F69-L131 HydrophobicContact CD1-CD2 3.78Å; F69-L131 HydrophobicContact CD1-CG 4.45Å; F69-L131 HydrophobicContact CD2-CD1 4.43Å; F69-L131 HydrophobicContact CD2-CD2 4.15Å; F69-L131 HydrophobicContact CD2-CG 3.92Å; F69-L131 HydrophobicContact CG-CD2 3.53Å; F69-L131 HydrophobicContact CG-CG 3.79Å; F69-F132 HydrophobicContact CB-CD1 4.19Å; F69-F132 HydrophobicContact CB-CE1 4.43Å; F69-F132 WeakPolarHBondContact O-CD1 3.44Å; F69-F137 HydrophobicContact CE2-CE2 4.45Å; F69-F137 AromaticContact CE2-CZ 3.88Å; F69-F137 HydrophobicContact CE2-CZ 3.88Å; F69-I188 HydrophobicContact CE1-CD1 4.2Å; F69-M208 HydrophobicContact CD1-CB 4.13Å; F69-M208 HydrophobicContact CD1-CG 4.16Å; F69-M208 HydrophobicContact CE1-CB 3.88Å; F69-M208 HydrophobicContact CE1-CG 3.58Å; F69-M208 HydrophobicContact CE1-SD 3.93Å; F69-M208 HydrophobicContact CZ-CG 4.01Å; F69-M208 HydrophobicContact CZ-SD 4.11Å
70	D	77.8	Confident	79.2	Confident	85 Å²	85	54.3 Å²	54.3	46%	0.455	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.4	176.8	-59.1	-59.9	0	0	0	108.3	T207	D70-T207 PolarHBondContact N-O 2.73Å; D70-T207 PolarHBondContact O-N 3.44Å; D70-T207 PolarHBondContact O-OG1 3.22Å; D70-T207 VanDerWaalsContact O-OG1 3.08Å
71	G	75.8	Confident	79	Confident	39 Å²	39	54 Å²	54	40%	0.402	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	174.6	-176.5	-175.9	0	0	0	0	0	113.7	F132 L205	G71-F132 VanDerWaalsContact C-CZ 3.41Å; G71-F132 VanDerWaalsContact N-CE1 3.32Å; G71-F132 WeakPolarHBondContact O-CE2 3.5Å; G71-L205 WeakPolarHBondContact CA-O 3.47Å
72	E	73	Confident	78.9	Confident	127 Å²	127	47 Å²	47	59%	0.593	26%	0.259	S	S	*	.			trans	-83.7	146.2	175.9	-68.7	-177.1	171.1	0	0	111.6	C74 F132 L205	E72-C74 PolarHBondContact O-N 3.05Å; E72-F132 VanDerWaalsContact O-CE2 3.27Å; E72-F132 WeakPolarHBondContact O-CE2 3.38Å; E72-F132 WeakPolarHBondContact O-CZ 3.48Å; E72-L205 HydrophobicContact CB-CD2 3.72Å; E72-L205 HydrophobicContact CB-CG 4.04Å; E72-L205 PolarHBondContact N-O 3.34Å
73	P	67	Low	78.8	Confident	100 Å²	100	44 Å²	44	65%	0.649	24%	0.241	S	C	*	.			trans	-62	136.2	177.2	26.4	-33.6	0	0	0	111
74	C	70.4	Confident	78.8	Confident	19 Å²	19	43.9 Å²	43.9	13%	0.128	24%	0.24	C	C	.	.			trans	-147.4	160.2	176.7	43.5	0	0	0	0	112.2	E72 L76 C128 L205 F206	E72-C74 PolarHBondContact O-N 3.05Å; C74-L76 VanDerWaalsContact C-N 3.28Å; C74-L76 PolarHBondContact O-N 3.45Å; C74-C128 HydrophobicContact CB-CB 4.07Å; C74-C128 WeakPolarHBondContact CB-SG 3.41Å; C74-C128 WeakPolarHBondContact O-CB 3.47Å; C74-C128 PolarHBondContact O-N 3.24Å; C74-C128 PolarHBondContact O-SG 2.72Å; C74-C128 WeakPolarHBondContact SG-CB 3.38Å; C74-C128 CovalentContact SG-SG 2.04Å; C74-C128 PolarHBondContact SG-SG 2.99Å; C74-L205 HydrophobicContact CB-CD2 4.43Å; C74-F206 VanDerWaalsContact SG-CE1 3.53Å; C74-F206 WeakPolarHBondContact SG-CZ 3.39Å
75	D	68.1	Low	78.9	Confident	154 Å²	154	43.1 Å²	43.1	82%	0.824	24%	0.235	S	C	*	.			trans	-94.7	27.7	-176.9	-61.6	-28.7	0	0	0	112.4
76	L	72.8	Confident	78.9	Confident	37 Å²	37	42.6 Å²	42.6	19%	0.194	23%	0.232	C	C	.	.			trans	-91.5	136.9	179.2	-66	164.8	0	0	0	110.4	C74 L202	C74-L76 VanDerWaalsContact C-N 3.28Å; C74-L76 PolarHBondContact O-N 3.45Å; L76-L202 HydrophobicContact CD1-CD1 3.88Å
77	S	75.8	Confident	78.9	Confident	37 Å²	37	39 Å²	39	26%	0.259	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	127.5	169.6	61.9	0	0	0	0	110.1	F125 S191	S77-F125 CarbonylContact C-O 3.54Å; S77-F125 VanDerWaalsContact CA-O 3.26Å; S77-F125 WeakPolarHBondContact CA-O 3.36Å; S77-S191 PolarHBondContact O-N 3.06Å; S77-S191 VanDerWaalsContact O-N 3.08Å; S77-S191 PolarHBondContact O-OG 2.89Å; S77-S191 WeakPolarHBondContact OG-CB 3.19Å; S77-S191 PolarHBondContact OG-O 3.3Å; S77-S191 PolarHBondContact OG-OG 2.96Å
78	L	78.6	Confident	78.7	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.2	-174.2	-64.6	171.6	0	0	0	109.7	F125 L131 I188 I190 F206	L78-F125 PolarHBondContact N-O 3.46Å; L78-F125 PolarHBondContact O-N 3.11Å; L78-L131 HydrophobicContact CD1-CD1 4.2Å; L78-L131 HydrophobicContact CD1-CD2 3.82Å; L78-I188 HydrophobicContact CD2-CG2 4.4Å; L78-I190 HydrophobicContact CD2-CB 4.25Å; L78-I190 HydrophobicContact CD2-CG1 3.69Å; L78-I190 HydrophobicContact CD2-CG2 4.23Å; L78-F206 HydrophobicContact CD1-CE1 4.47Å; L78-F206 HydrophobicContact CD1-CZ 4.32Å
79	N	83.1	Confident	78.6	Confident	52 Å²	52	37.7 Å²	37.7	28%	0.278	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.2	169.8	-171.5	11.6	0	0	0	109.5	S122 K123 L124 G189	N79-S122 PolarHBondContact OD1-OG 3.42Å; N79-S122 VanDerWaalsContact OD1-OG 3.08Å; N79-K123 PolarHBondContact OD1-O 2.98Å; N79-L124 HydrophobicContact CB-CD1 3.83Å; N79-G189 PolarHBondContact N-O 3.36Å; N79-G189 PolarHBondContact O-N 3.06Å
80	I	81.4	Confident	78.4	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.3	177.5	-58.4	-176	0	0	0	108.6	L67 F69 S122 K123 F125 L131 F137 V186 H187 I188	L67-I80 HydrophobicContact CD2-CG2 4.48Å; F69-I80 HydrophobicContact CD2-CD1 4.25Å; F69-I80 HydrophobicContact CE1-CD1 4.02Å; F69-I80 HydrophobicContact CE2-CD1 3.54Å; F69-I80 HydrophobicContact CZ-CD1 3.43Å; F69-I80 VanDerWaalsContact CZ-CD1 3.43Å; F69-I80 HydrophobicContact CZ-CG2 4.48Å; I80-S122 WeakPolarHBondContact O-CA 3.38Å; I80-K123 PolarHBondContact N-O 3.01Å; I80-K123 PolarHBondContact O-N 3.33Å; I80-F125 HydrophobicContact CB-CE2 4.17Å; I80-F125 HydrophobicContact CD1-CD2 4.21Å; I80-F125 HydrophobicContact CD1-CE2 3.98Å; I80-F125 HydrophobicContact CG1-CD2 4.22Å; I80-F125 HydrophobicContact CG1-CE2 4.14Å; I80-L131 HydrophobicContact CD1-CD1 3.35Å; I80-L131 HydrophobicContact CD1-CG 4.32Å; I80-L131 HydrophobicContact CG1-CD1 4.35Å; I80-F137 HydrophobicContact CG2-CE1 4.44Å; I80-V186 HydrophobicContact CG2-CG1 4.1Å; I80-H187 WeakPolarHBondContact CA-O 3.46Å; I80-I188 HydrophobicContact CG1-CG1 4.42Å
81	T	83.1	Confident	78.2	Confident	13 Å²	13	36.4 Å²	36.4	8%	0.08	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.6	172.5	46.2	0	0	0	0	108.9	S121 S122 H187	T81-S121 WeakPolarHBondContact CA-O 3.42Å; T81-S122 WeakPolarHBondContact CG2-OG 3.33Å; T81-H187 PolarHBondContact N-O 3.09Å; T81-H187 PolarHBondContact O-N 3.41Å; T81-H187 WeakPolarHBondContact OG1-CB 3.43Å; T81-H187 PolarHBondContact OG1-ND1 3.21Å; T81-H187 PolarHBondContact OG1-O 3.5Å
82	W	84.8	Confident	78.1	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.8	172.8	62.4	-98.4	0	0	0	111.4	L84 Q119 T120 S121 F137 G139 L174 F184 I185	W82-L84 HydrophobicContact CE3-CB 4.32Å; W82-L84 HydrophobicContact CZ3-CB 4.02Å; W82-Q119 HydrophobicContact CH2-CB 4.26Å; W82-Q119 HydrophobicContact CH2-CG 3.77Å; W82-Q119 HydrophobicContact CZ3-CB 4.06Å; W82-Q119 HydrophobicContact CZ3-CG 4.09Å; W82-Q119 WeakPolarHBondContact CZ3-O 3.5Å; W82-T120 VanDerWaalsContact O-CA 3.27Å; W82-T120 WeakPolarHBondContact O-CA 3.49Å; W82-T120 WeakPolarHBondContact O-CB 3.15Å; W82-T120 PolarHBondContact O-OG1 2.94Å; W82-S121 VanDerWaalsContact CE2-CB 3.5Å; W82-S121 VanDerWaalsContact CZ2-CB 3.44Å; W82-S121 PolarHBondContact N-O 3.38Å; W82-S121 PolarHBondContact O-N 3.31Å; W82-F137 AromaticContact CD1-CD1 3.85Å; W82-F137 AromaticContact NE1-CD1 3.81Å; W82-G139 VanDerWaalsContact CZ2-CA 3.42Å; W82-L174 HydrophobicContact CD2-CD2 4.31Å; W82-L174 HydrophobicContact CE3-CD1 4.26Å; W82-L174 HydrophobicContact CE3-CD2 4.02Å; W82-L174 HydrophobicContact CH2-CD1 3.32Å; W82-L174 HydrophobicContact CH2-CD2 4.33Å; W82-L174 HydrophobicContact CH2-CG 4.4Å; W82-L174 HydrophobicContact CZ2-CD1 4.04Å; W82-L174 HydrophobicContact CZ3-CD1 3.45Å; W82-L174 VanDerWaalsContact CZ3-CD1 3.45Å; W82-L174 HydrophobicContact CZ3-CD2 4.05Å; W82-L174 HydrophobicContact CZ3-CG 4.42Å; W82-F184 HydrophobicContact CB-CE2 3.89Å; W82-F184 HydrophobicContact CB-CZ 4.16Å; W82-F184 HydrophobicContact CD2-CE2 4.39Å; W82-F184 HydrophobicContact CE3-CE2 4.18Å; W82-F184 HydrophobicContact CG-CE2 4.31Å; W82-I185 CarbonylContact C-O 3.49Å; W82-I185 VanDerWaalsContact CA-O 3.26Å; W82-I185 WeakPolarHBondContact CA-O 3.29Å
83	Y	84.8	Confident	78.2	Confident	32 Å²	32	31 Å²	31	13%	0.125	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	128.3	178.3	-57.8	-95.5	0	0	0	108.2	L105 Q119 T120 F184 I185	Y83-L105 HydrophobicContact CD1-CD2 3.97Å; Y83-L105 HydrophobicContact CD2-CD1 4.41Å; Y83-L105 HydrophobicContact CD2-CD2 3.81Å; Y83-L105 HydrophobicContact CE1-CD2 4.22Å; Y83-L105 HydrophobicContact CE2-CD1 4.18Å; Y83-L105 HydrophobicContact CE2-CD2 4.09Å; Y83-L105 HydrophobicContact CG-CD2 3.76Å; Y83-Q119 WeakPolarHBondContact CA-O 3.3Å; Y83-T120 WeakPolarHBondContact CD1-OG1 3.45Å; Y83-T120 VanDerWaalsContact CE1-OG1 3.3Å; Y83-T120 WeakPolarHBondContact CE1-OG1 3.22Å; Y83-F184 CarbonylContact O-C 3.57Å; Y83-F184 WeakPolarHBondContact O-CA 3.18Å; Y83-F184 WeakPolarHBondContact O-CD2 3.39Å; Y83-I185 PolarHBondContact N-O 3.48Å; Y83-I185 PolarHBondContact O-N 3.33Å
84	L	85.9	Confident	78.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	119	171.7	-179.1	62.8	0	0	0	107.7	I65 W82 Y118 Q119 L174 W177 Y182 I183 F184	I65-L84 HydrophobicContact CD1-CD1 3.67Å; I65-L84 HydrophobicContact CD1-CD2 4.06Å; W82-L84 HydrophobicContact CE3-CB 4.32Å; W82-L84 HydrophobicContact CZ3-CB 4.02Å; L84-Y118 CarbonylContact O-C 3.45Å; L84-Y118 WeakPolarHBondContact O-CA 3.39Å; L84-Y118 WeakPolarHBondContact O-CB 3.36Å; L84-Q119 PolarHBondContact N-O 3.26Å; L84-Q119 PolarHBondContact O-N 3.33Å; L84-L174 HydrophobicContact CB-CD1 4.44Å; L84-L174 HydrophobicContact CD2-CD1 3.69Å; L84-L174 HydrophobicContact CD2-CD2 4.39Å; L84-L174 HydrophobicContact CD2-CG 4.02Å; L84-W177 HydrophobicContact CD2-CH2 4.36Å; L84-W177 HydrophobicContact CD2-CZ3 3.91Å; L84-W177 HydrophobicContact CG-CH2 4.15Å; L84-W177 HydrophobicContact CG-CZ3 4.2Å; L84-Y182 HydrophobicContact CD1-CD1 3.74Å; L84-Y182 HydrophobicContact CD1-CG 4.4Å; L84-Y182 HydrophobicContact CD2-CD1 4.47Å; L84-Y182 HydrophobicContact CG-CD1 3.98Å; L84-Y182 HydrophobicContact CG-CE1 4.41Å; L84-I183 WeakPolarHBondContact CA-O 3.17Å; L84-F184 HydrophobicContact CB-CD2 4.29Å; L84-F184 HydrophobicContact CD1-CB 4.1Å; L84-F184 HydrophobicContact CD1-CD2 4.17Å
85	K	85.4	Confident	77.8	Confident	5 Å²	5	37.8 Å²	37.8	2%	0.022	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.1	178.7	-174	-160.9	-176.8	-90.7	0	110.3	E92 Y104 L108 S115 R117 Y182 I183	K85-E92 VanDerWaalsContact CE-OE1 3.26Å; K85-E92 WeakPolarHBondContact CE-OE1 3.34Å; K85-E92 IonicContact NZ-OE1 2.71Å; K85-E92 PolarHBondContact NZ-OE1 3.44Å; K85-E92 IonicContact NZ-OE2 2.98Å; K85-E92 PolarHBondContact NZ-OE2 3.23Å; K85-Y104 HydrophobicContact CD-CE1 4.44Å; K85-Y104 WeakPolarHBondContact CD-OH 3.34Å; K85-Y104 WeakPolarHBondContact CE-OH 3.37Å; K85-L108 HydrophobicContact CB-CD1 4.4Å; K85-L108 HydrophobicContact CD-CD1 3.64Å; K85-L108 HydrophobicContact CG-CD1 4.16Å; K85-S115 WeakPolarHBondContact CE-O 3.35Å; K85-S115 PolarHBondContact NZ-O 3.28Å; K85-R117 CarbonylContact C-O 3.58Å; K85-R117 WeakPolarHBondContact CA-O 3.39Å; K85-R117 WeakPolarHBondContact CG-O 3.34Å; K85-Y182 CarbonylContact O-C 3.54Å; K85-Y182 VanDerWaalsContact O-CA 3.26Å; K85-Y182 WeakPolarHBondContact O-CA 3.25Å; K85-I183 PolarHBondContact N-O 3.45Å; K85-I183 PolarHBondContact O-N 2.97Å
86	S	85.9	Confident	77.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.3	163.7	66.2	0	0	0	0	109.5	G116 R117 W177 P181	S86-G116 WeakPolarHBondContact O-CA 3.46Å; S86-R117 PolarHBondContact N-O 2.88Å; S86-R117 PolarHBondContact OG-N 3.07Å; S86-R117 PolarHBondContact OG-O 3.45Å; S86-W177 WeakPolarHBondContact OG-CZ2 3.28Å; S86-W177 PolarHBondContact OG-NE1 2.87Å; S86-P181 WeakPolarHBondContact CA-O 3.17Å
87	A	80.9	Confident	77.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.176	C	C	.	.			trans	-101.1	138.1	171.7	0	0	0	0	0	110	E92 I93 P181	A87-E92 HydrophobicContact CB-CB 4.32Å; A87-E92 WeakPolarHBondContact CB-OE2 3.24Å; A87-I93 HydrophobicContact CB-CD1 4.13Å; A87-I93 HydrophobicContact CB-CG1 4.02Å; A87-P181 PolarHBondContact N-O 3.45Å; A87-P181 WeakPolarHBondContact O-CD 3.36Å
88	D	76.8	Confident	76.6	Confident	56 Å²	56	38.1 Å²	38.1	30%	0.299	19%	0.19	S	C	.	.	S	Bend	trans	-78.7	-12.8	170.2	-51.8	-49.6	0	0	0	111.1	S115 G116	D88-S115 WeakPolarHBondContact OD2-CB 3.48Å; D88-S115 PolarHBondContact OD2-OG 3.29Å; D88-G116 PolarHBondContact OD2-N 3.38Å
89	C	78.9	Confident	75.7	Confident	17 Å²	17	46.6 Å²	46.6	12%	0.115	23%	0.23	C	C	.	.			trans	-117.7	117.3	-172.6	-155.1	0	0	0	0	111.3	N91 E92 C431	C89-N91 VanDerWaalsContact C-N 3.31Å; C89-N91 PolarHBondContact O-N 3.04Å; C89-E92 HydrophobicContact CB-CB 4.31Å; C89-E92 WeakPolarHBondContact O-CB 3.44Å; C89-E92 PolarHBondContact O-N 3.02Å; C89-C431 WeakPolarHBondContact CA-SG 3.12Å; C89-C431 HydrophobicContact CB-CB 4.36Å; C89-C431 WeakPolarHBondContact CB-SG 3.48Å; C89-C431 WeakPolarHBondContact SG-CA 3.39Å; C89-C431 WeakPolarHBondContact SG-CB 3.45Å; C89-C431 CovalentContact SG-SG 2.03Å; C89-C431 PolarHBondContact SG-SG 2.81Å
90	Y	76	Confident	75.1	Confident	32 Å²	32	48.6 Å²	48.6	13%	0.125	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-35.6	180	-179.4	-107.3	0	0	0	113.2	I58 E92 I93 Y94 P181 Q432 W435 L438	I58-Y90 HydrophobicContact CD1-CD2 3.82Å; I58-Y90 HydrophobicContact CD1-CE2 3.64Å; I58-Y90 HydrophobicContact CG1-CD2 4.14Å; I58-Y90 HydrophobicContact CG1-CE2 3.91Å; Y90-E92 PolarHBondContact O-N 3.24Å; Y90-E92 VanDerWaalsContact O-N 3.14Å; Y90-I93 PolarHBondContact O-N 2.91Å; Y90-Y94 HydrophobicContact CE1-CD2 4.13Å; Y90-Y94 HydrophobicContact CE1-CG 4.29Å; Y90-Y94 PolarHBondContact O-N 2.83Å; Y90-P181 HydrophobicContact CD2-CB 4.44Å; Y90-P181 HydrophobicContact CD2-CG 4.26Å; Y90-Q432 WeakPolarHBondContact CB-O 3.28Å; Y90-Q432 PolarHBondContact N-O 3.48Å; Y90-Q432 VanDerWaalsContact N-O 3.16Å; Y90-W435 HydrophobicContact CD2-CB 4.44Å; Y90-W435 HydrophobicContact CG-CB 4.37Å; Y90-L438 HydrophobicContact CD1-CD1 3.93Å; Y90-L438 HydrophobicContact CD2-CD1 4.05Å; Y90-L438 HydrophobicContact CE1-CD1 3.84Å; Y90-L438 HydrophobicContact CE1-CD2 4.11Å; Y90-L438 HydrophobicContact CE2-CD1 3.99Å; Y90-L438 HydrophobicContact CG-CD1 4.02Å
91	N	74.8	Confident	74.8	Confident	34 Å²	34	48.7 Å²	48.7	18%	0.182	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-26.8	179.3	-68.3	-8.1	0	0	0	113.2	C89 I93 N95 T430	C89-N91 VanDerWaalsContact C-N 3.31Å; C89-N91 PolarHBondContact O-N 3.04Å; N91-I93 VanDerWaalsContact C-N 3.26Å; N91-I93 PolarHBondContact O-N 3.31Å; N91-N95 WeakPolarHBondContact O-CB 3.48Å; N91-N95 PolarHBondContact O-N 3.02Å; N91-N95 VanDerWaalsContact O-N 3.12Å; N91-N95 PolarHBondContact O-ND2 2.74Å; N91-T430 PolarHBondContact ND2-O 3.06Å
92	E	73.4	Confident	74.5	Confident	38 Å²	38	53.7 Å²	53.7	18%	0.178	26%	0.26	C	S	.	.	H	α-helix	trans	-65.6	-32.7	176.5	-164.1	-170.4	150.9	0	0	111.7	K85 A87 C89 Y90 Y104 L114	K85-E92 VanDerWaalsContact CE-OE1 3.26Å; K85-E92 WeakPolarHBondContact CE-OE1 3.34Å; K85-E92 IonicContact NZ-OE1 2.71Å; K85-E92 PolarHBondContact NZ-OE1 3.44Å; K85-E92 IonicContact NZ-OE2 2.98Å; K85-E92 PolarHBondContact NZ-OE2 3.23Å; A87-E92 HydrophobicContact CB-CB 4.32Å; A87-E92 WeakPolarHBondContact CB-OE2 3.24Å; C89-E92 HydrophobicContact CB-CB 4.31Å; C89-E92 WeakPolarHBondContact O-CB 3.44Å; C89-E92 PolarHBondContact O-N 3.02Å; Y90-E92 PolarHBondContact O-N 3.24Å; Y90-E92 VanDerWaalsContact O-N 3.14Å; E92-Y104 HydrophobicContact CG-CE2 4.28Å; E92-Y104 WeakPolarHBondContact OE1-CE2 3.4Å; E92-Y104 PolarHBondContact OE1-OH 3.17Å; E92-L114 WeakPolarHBondContact OE1-CD2 3.47Å
93	I	73.4	Confident	73.9	Confident	16 Å²	16	58.9 Å²	58.9	8%	0.082	29%	0.286	C	S	.	.	H	α-helix	trans	-85.8	-45	179.3	-50.9	-149.5	0	0	0	110.5	A87 Y90 N91 N95 F96 P181 Y182 I183	A87-I93 HydrophobicContact CB-CD1 4.13Å; A87-I93 HydrophobicContact CB-CG1 4.02Å; Y90-I93 PolarHBondContact O-N 2.91Å; N91-I93 VanDerWaalsContact C-N 3.26Å; N91-I93 PolarHBondContact O-N 3.31Å; I93-N95 PolarHBondContact O-N 3.08Å; I93-F96 VanDerWaalsContact O-CB 3.23Å; I93-F96 WeakPolarHBondContact O-CB 3.19Å; I93-F96 PolarHBondContact O-N 3.08Å; I93-P181 HydrophobicContact CD1-CB 3.2Å; I93-P181 HydrophobicContact CG1-CB 3.88Å; I93-Y182 VanDerWaalsContact CD1-C 3.42Å; I93-Y182 VanDerWaalsContact CD1-N 3.27Å; I93-Y182 WeakPolarHBondContact CD1-O 3.33Å; I93-I183 HydrophobicContact CB-CD1 4.4Å; I93-I183 HydrophobicContact CB-CG1 4.23Å; I93-I183 HydrophobicContact CD1-CD1 4.38Å; I93-I183 HydrophobicContact CD1-CG1 3.56Å; I93-I183 HydrophobicContact CG1-CD1 3.94Å; I93-I183 HydrophobicContact CG1-CG1 3.66Å; I93-I183 HydrophobicContact CG2-CG1 4.12Å
94	Y	66.4	Low	73.5	Confident	156 Å²	156	58.5 Å²	58.5	61%	0.612	28%	0.284	S	S	*	.	H	α-helix	trans	-65	-38	-176.1	-174.9	-95.6	0	0	0	113	Y90 F96	Y90-Y94 HydrophobicContact CE1-CD2 4.13Å; Y90-Y94 HydrophobicContact CE1-CG 4.29Å; Y90-Y94 PolarHBondContact O-N 2.83Å; Y94-F96 VanDerWaalsContact C-N 3.28Å; Y94-F96 PolarHBondContact O-N 3.48Å
95	N	63	Low	73.2	Confident	105 Å²	105	58.8 Å²	58.8	56%	0.561	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.1	179	-68.1	-30.8	0	0	0	113.5	N91 I93 K97	N91-N95 WeakPolarHBondContact O-CB 3.48Å; N91-N95 PolarHBondContact O-N 3.02Å; N91-N95 VanDerWaalsContact O-N 3.12Å; N91-N95 PolarHBondContact O-ND2 2.74Å; I93-N95 PolarHBondContact O-N 3.08Å; N95-K97 PolarHBondContact O-N 2.93Å
96	F	65.9	Low	72.7	Confident	39 Å²	39	64.3 Å²	64.3	17%	0.171	31%	0.312	C	S	.	.			trans	-71	104.7	-173.7	-169	-95.5	0	0	0	111	S54 I93 Y94 V101 Y104 I183 I185	S54-F96 VanDerWaalsContact CB-CE1 3.4Å; I93-F96 VanDerWaalsContact O-CB 3.23Å; I93-F96 WeakPolarHBondContact O-CB 3.19Å; I93-F96 PolarHBondContact O-N 3.08Å; Y94-F96 VanDerWaalsContact C-N 3.28Å; Y94-F96 PolarHBondContact O-N 3.48Å; F96-V101 HydrophobicContact CE1-CG2 3.52Å; F96-V101 HydrophobicContact CZ-CB 4.08Å; F96-V101 HydrophobicContact CZ-CG1 4.3Å; F96-V101 HydrophobicContact CZ-CG2 3.52Å; F96-Y104 HydrophobicContact CD2-CD2 4.24Å; F96-Y104 HydrophobicContact CD2-CE2 4.45Å; F96-Y104 HydrophobicContact CD2-CG 4.31Å; F96-Y104 AromaticContact CE2-CD1 3.62Å; F96-Y104 HydrophobicContact CE2-CD1 3.62Å; F96-Y104 AromaticContact CE2-CD2 3.86Å; F96-Y104 HydrophobicContact CE2-CD2 3.86Å; F96-Y104 HydrophobicContact CE2-CE1 4.1Å; F96-Y104 HydrophobicContact CE2-CE2 4.31Å; F96-Y104 AromaticContact CE2-CG 3.48Å; F96-Y104 HydrophobicContact CE2-CG 3.48Å; F96-Y104 VanDerWaalsContact CE2-CG 3.48Å; F96-Y104 HydrophobicContact CZ-CD1 4.22Å; F96-Y104 HydrophobicContact CZ-CG 4.37Å; F96-I183 HydrophobicContact CD2-CD1 4.23Å; F96-I183 HydrophobicContact CG-CD1 4.38Å; F96-I185 HydrophobicContact CZ-CD1 4.02Å
97	K	63.8	Low	72.2	Confident	129 Å²	129	69.6 Å²	69.6	56%	0.561	34%	0.335	S	S	*	.			trans	-88.4	140.5	174.3	-68.5	-178.8	-179.1	176.9	0	110.5	N95 E99 E100	N95-K97 PolarHBondContact O-N 2.93Å; K97-E99 PolarHBondContact O-N 3.27Å; K97-E99 VanDerWaalsContact O-N 3.07Å; K97-E100 PolarHBondContact O-N 3Å
98	A	61.5	Low	71.9	Confident	67 Å²	67	69.8 Å²	69.8	55%	0.554	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.4	177.7	0	0	0	0	0	113.6	V101	A98-V101 WeakPolarHBondContact O-CG2 3.43Å
99	E	61.3	Low	71.7	Confident	185 Å²	185	73.4 Å²	73.4	86%	0.864	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-77.5	-17.4	178.7	-67.6	171.4	-178	0	0	113.4	K97	K97-E99 PolarHBondContact O-N 3.27Å; K97-E99 VanDerWaalsContact O-N 3.07Å
100	E	69.7	Low	71.2	Confident	93 Å²	93	77.4 Å²	77.4	44%	0.435	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-102.5	6.2	-176.6	-63.9	178.7	-160	0	0	113.1	K97 E102 M103 Y104	K97-E100 PolarHBondContact O-N 3Å; E100-E102 VanDerWaalsContact C-N 3.33Å; E100-E102 PolarHBondContact O-N 2.94Å; E100-M103 HydrophobicContact CB-CE 4.39Å; E100-M103 HydrophobicContact CG-CE 4.14Å; E100-M103 PolarHBondContact O-N 3.16Å; E100-Y104 WeakPolarHBondContact O-CB 3.41Å; E100-Y104 PolarHBondContact O-N 3.41Å
101	V	75.4	Confident	70.8	Confident	3 Å²	3	81.6 Å²	81.6	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-59	-42.2	-174.2	177.6	0	0	0	0	112.1	Y52 F96 A98 Y104 L105 I185	Y52-V101 HydrophobicContact CD1-CG1 3.73Å; Y52-V101 HydrophobicContact CG-CG1 3.91Å; F96-V101 HydrophobicContact CE1-CG2 3.52Å; F96-V101 HydrophobicContact CZ-CB 4.08Å; F96-V101 HydrophobicContact CZ-CG1 4.3Å; F96-V101 HydrophobicContact CZ-CG2 3.52Å; A98-V101 WeakPolarHBondContact O-CG2 3.43Å; V101-Y104 WeakPolarHBondContact O-CB 3.46Å; V101-Y104 PolarHBondContact O-N 2.86Å; V101-L105 HydrophobicContact CG1-CD1 3.92Å; V101-L105 HydrophobicContact CG1-CG 4.25Å; V101-L105 WeakPolarHBondContact O-CB 3.2Å; V101-L105 WeakPolarHBondContact O-CG 3.35Å; V101-L105 PolarHBondContact O-N 2.94Å; V101-I185 HydrophobicContact CG1-CD1 4.31Å; V101-I185 HydrophobicContact CG1-CG2 3.78Å
102	E	75.6	Confident	70	Confident	119 Å²	119	87.6 Å²	87.6	56%	0.556	41%	0.405	S	S	*	.	H	α-helix	trans	-64.4	-51.8	-178.4	-69.8	-178.2	175.7	0	0	111.5	Y52 E100 Y104 L105 E106	Y52-E102 HydrophobicContact CD2-CG 3.96Å; Y52-E102 HydrophobicContact CE2-CG 3.49Å; Y52-E102 VanDerWaalsContact CE2-CG 3.49Å; Y52-E102 VanDerWaalsContact CE2-OE1 3.26Å; Y52-E102 WeakPolarHBondContact CE2-OE1 3.37Å; E100-E102 VanDerWaalsContact C-N 3.33Å; E100-E102 PolarHBondContact O-N 2.94Å; E102-Y104 PolarHBondContact O-N 3.28Å; E102-L105 PolarHBondContact O-N 2.91Å; E102-E106 PolarHBondContact O-N 3.34Å
103	M	72.8	Confident	69.4	Low	111 Å²	111	89 Å²	89	55%	0.547	43%	0.43	S	S	.	.	H	α-helix	trans	-58.6	-36.5	175.4	-70.7	-161.7	-63.3	0	0	112	E100 K107	E100-M103 HydrophobicContact CB-CE 4.39Å; E100-M103 HydrophobicContact CG-CE 4.14Å; E100-M103 PolarHBondContact O-N 3.16Å; M103-K107 WeakPolarHBondContact O-CG 3.4Å; M103-K107 PolarHBondContact O-N 3.1Å
104	Y	76.9	Confident	69.1	Low	23 Å²	23	89.1 Å²	89.1	9%	0.09	43%	0.43	C	S	.	.	H	α-helix	trans	-67.7	-44.5	177.3	-179.6	-95.2	0	0	0	112.3	K85 E92 F96 E100 V101 E102 E106 K107 L108 L114 I185	K85-Y104 HydrophobicContact CD-CE1 4.44Å; K85-Y104 WeakPolarHBondContact CD-OH 3.34Å; K85-Y104 WeakPolarHBondContact CE-OH 3.37Å; E92-Y104 HydrophobicContact CG-CE2 4.28Å; E92-Y104 WeakPolarHBondContact OE1-CE2 3.4Å; E92-Y104 PolarHBondContact OE1-OH 3.17Å; F96-Y104 HydrophobicContact CD2-CD2 4.24Å; F96-Y104 HydrophobicContact CD2-CE2 4.45Å; F96-Y104 HydrophobicContact CD2-CG 4.31Å; F96-Y104 AromaticContact CE2-CD1 3.62Å; F96-Y104 HydrophobicContact CE2-CD1 3.62Å; F96-Y104 AromaticContact CE2-CD2 3.86Å; F96-Y104 HydrophobicContact CE2-CD2 3.86Å; F96-Y104 HydrophobicContact CE2-CE1 4.1Å; F96-Y104 HydrophobicContact CE2-CE2 4.31Å; F96-Y104 AromaticContact CE2-CG 3.48Å; F96-Y104 HydrophobicContact CE2-CG 3.48Å; F96-Y104 VanDerWaalsContact CE2-CG 3.48Å; F96-Y104 HydrophobicContact CZ-CD1 4.22Å; F96-Y104 HydrophobicContact CZ-CG 4.37Å; E100-Y104 WeakPolarHBondContact O-CB 3.41Å; E100-Y104 PolarHBondContact O-N 3.41Å; V101-Y104 WeakPolarHBondContact O-CB 3.46Å; V101-Y104 PolarHBondContact O-N 2.86Å; E102-Y104 PolarHBondContact O-N 3.28Å; Y104-E106 VanDerWaalsContact C-N 3.31Å; Y104-E106 PolarHBondContact O-N 3.39Å; Y104-K107 PolarHBondContact O-N 3.47Å; Y104-L108 HydrophobicContact CE1-CD1 4.11Å; Y104-L108 WeakPolarHBondContact O-CB 3.44Å; Y104-L108 PolarHBondContact O-N 3.35Å; Y104-L114 HydrophobicContact CD2-CD2 4.36Å; Y104-L114 HydrophobicContact CE2-CD2 3.57Å; Y104-I185 HydrophobicContact CD1-CD1 4.1Å; Y104-I185 HydrophobicContact CE1-CD1 4.18Å
105	L	78.4	Confident	69.1	Low	6 Å²	6	82.6 Å²	82.6	3%	0.031	41%	0.407	C	S	.	.	H	α-helix	trans	-65	-34.9	175.7	-72.3	175.1	0	0	0	111.8	Y52 Y83 V101 E102 L108 K109 I185	Y52-L105 HydrophobicContact CD1-CD1 3.77Å; Y52-L105 HydrophobicContact CE1-CD1 3.37Å; Y83-L105 HydrophobicContact CD1-CD2 3.97Å; Y83-L105 HydrophobicContact CD2-CD1 4.41Å; Y83-L105 HydrophobicContact CD2-CD2 3.81Å; Y83-L105 HydrophobicContact CE1-CD2 4.22Å; Y83-L105 HydrophobicContact CE2-CD1 4.18Å; Y83-L105 HydrophobicContact CE2-CD2 4.09Å; Y83-L105 HydrophobicContact CG-CD2 3.76Å; V101-L105 HydrophobicContact CG1-CD1 3.92Å; V101-L105 HydrophobicContact CG1-CG 4.25Å; V101-L105 WeakPolarHBondContact O-CB 3.2Å; V101-L105 WeakPolarHBondContact O-CG 3.35Å; V101-L105 PolarHBondContact O-N 2.94Å; E102-L105 PolarHBondContact O-N 2.91Å; L105-L108 PolarHBondContact O-N 3.31Å; L105-K109 WeakPolarHBondContact O-CG 3.37Å; L105-K109 PolarHBondContact O-N 2.86Å; L105-I185 HydrophobicContact CD1-CG2 4.33Å; L105-I185 HydrophobicContact CD2-CD1 3.89Å; L105-I185 HydrophobicContact CG-CD1 4.35Å
106	E	75.4	Confident	69.6	Low	122 Å²	122	77.9 Å²	77.9	57%	0.57	38%	0.384	S	S	*	.	H	α-helix	trans	-62	-50	171.1	-74	-170.3	159.2	0	0	111.6	E102 Y104 L108 K109 E110	E102-E106 PolarHBondContact O-N 3.34Å; Y104-E106 VanDerWaalsContact C-N 3.31Å; Y104-E106 PolarHBondContact O-N 3.39Å; E106-L108 PolarHBondContact O-N 3.27Å; E106-K109 PolarHBondContact O-N 3.48Å; E106-K109 VanDerWaalsContact O-N 3.12Å; E106-E110 WeakPolarHBondContact O-CB 3.47Å; E106-E110 WeakPolarHBondContact O-CG 3.45Å; E106-E110 PolarHBondContact O-N 3.44Å
107	K	75.6	Confident	70.1	Confident	111 Å²	111	80.9 Å²	80.9	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-57.1	-37	175	-73	174.9	-177.1	174.9	0	112.4	M103 Y104 E110 K111 R112 L114	M103-K107 WeakPolarHBondContact O-CG 3.4Å; M103-K107 PolarHBondContact O-N 3.1Å; Y104-K107 PolarHBondContact O-N 3.47Å; K107-E110 PolarHBondContact O-N 2.88Å; K107-K111 PolarHBondContact O-N 3.32Å; K107-R112 PolarHBondContact O-N 2.9Å; K107-L114 HydrophobicContact CB-CD1 3.66Å
108	L	75	Confident	70.8	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.016	37%	0.372	C	S	.	.	H	α-helix	trans	-68	-41.2	178.1	-166.6	132.2	0	0	0	112	K85 Y104 L105 E106 K111 L114 Y118	K85-L108 HydrophobicContact CB-CD1 4.4Å; K85-L108 HydrophobicContact CD-CD1 3.64Å; K85-L108 HydrophobicContact CG-CD1 4.16Å; Y104-L108 HydrophobicContact CE1-CD1 4.11Å; Y104-L108 WeakPolarHBondContact O-CB 3.44Å; Y104-L108 PolarHBondContact O-N 3.35Å; L105-L108 PolarHBondContact O-N 3.31Å; E106-L108 PolarHBondContact O-N 3.27Å; L108-K111 PolarHBondContact O-N 3.3Å; L108-L114 HydrophobicContact CB-CD1 4.24Å; L108-Y118 HydrophobicContact CD2-CD1 4.1Å; L108-Y118 HydrophobicContact CD2-CD2 3.69Å; L108-Y118 HydrophobicContact CD2-CE1 4.11Å; L108-Y118 HydrophobicContact CD2-CE2 3.73Å; L108-Y118 HydrophobicContact CD2-CG 3.86Å; L108-Y118 HydrophobicContact CG-CD1 4.46Å
109	K	72.3	Confident	71.8	Confident	133 Å²	133	73.9 Å²	73.9	58%	0.578	35%	0.351	S	S	*	.	H	α-helix	trans	-65.7	-41	172.4	-72.5	174.2	-175.9	176	0	111.9	L105 E106 K111	L105-K109 WeakPolarHBondContact O-CG 3.37Å; L105-K109 PolarHBondContact O-N 2.86Å; E106-K109 PolarHBondContact O-N 3.48Å; E106-K109 VanDerWaalsContact O-N 3.12Å; K109-K111 PolarHBondContact O-N 3.06Å
110	E	68.9	Low	72.6	Confident	100 Å²	100	66.6 Å²	66.6	47%	0.467	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-6.9	178.3	-67.9	-169	145.4	0	0	113.8	E106 K107 R112	E106-E110 WeakPolarHBondContact O-CB 3.47Å; E106-E110 WeakPolarHBondContact O-CG 3.45Å; E106-E110 PolarHBondContact O-N 3.44Å; K107-E110 PolarHBondContact O-N 2.88Å; E110-R112 HydrophobicContact CB-CG 4.21Å; E110-R112 PolarHBondContact O-N 3.3Å; E110-R112 IonicContact OE1-CZ 3.67Å; E110-R112 IonicContact OE1-NH2 2.94Å; E110-R112 PolarHBondContact OE1-NH2 3.43Å; E110-R112 IonicContact OE2-CZ 2.98Å; E110-R112 IonicContact OE2-NE 3.35Å; E110-R112 PolarHBondContact OE2-NE 2.85Å; E110-R112 IonicContact OE2-NH1 3.29Å; E110-R112 PolarHBondContact OE2-NH1 2.73Å; E110-R112 IonicContact OE2-NH2 3.08Å; E110-R112 PolarHBondContact OE2-NH2 3.39Å; E110-R112 VanDerWaalsContact OE2-NH2 3.08Å
111	K	66.5	Low	73.1	Confident	121 Å²	121	63.3 Å²	63.3	53%	0.526	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	29.7	-175.8	-56.4	178.7	-177.8	175.4	0	113.7	K107 L108 K109	K107-K111 PolarHBondContact O-N 3.32Å; L108-K111 PolarHBondContact O-N 3.3Å; K109-K111 PolarHBondContact O-N 3.06Å
112	R	58.9	Low	73.2	Confident	160 Å²	160	66.6 Å²	66.6	60%	0.604	33%	0.33	S	S	*	.			trans	-95.2	124	-178.1	-72.7	-171.6	-151.7	151.9	21.5	111.8	K107 E110 L114	K107-R112 PolarHBondContact O-N 2.9Å; E110-R112 HydrophobicContact CB-CG 4.21Å; E110-R112 PolarHBondContact O-N 3.3Å; E110-R112 IonicContact OE1-CZ 3.67Å; E110-R112 IonicContact OE1-NH2 2.94Å; E110-R112 PolarHBondContact OE1-NH2 3.43Å; E110-R112 IonicContact OE2-CZ 2.98Å; E110-R112 IonicContact OE2-NE 3.35Å; E110-R112 PolarHBondContact OE2-NE 2.85Å; E110-R112 IonicContact OE2-NH1 3.29Å; E110-R112 PolarHBondContact OE2-NH1 2.73Å; E110-R112 IonicContact OE2-NH2 3.08Å; E110-R112 PolarHBondContact OE2-NH2 3.39Å; E110-R112 VanDerWaalsContact OE2-NH2 3.08Å; R112-L114 PolarHBondContact O-N 3.47Å; R112-L114 VanDerWaalsContact O-N 3.1Å
113	G	60	Low	73.3	Confident	68 Å²	68	65.3 Å²	65.3	70%	0.701	32%	0.322	S	S	*	.	S	Bend	trans	67.3	9.9	163.8	0	0	0	0	0	116.8
114	L	68.4	Low	73.5	Confident	17 Å²	17	65.2 Å²	65.2	9%	0.089	32%	0.323	C	S	.	.			trans	-113.9	135.1	179.8	-71.7	152	0	0	0	109.4	E92 Y104 K107 L108 R112 L145	E92-L114 WeakPolarHBondContact OE1-CD2 3.47Å; Y104-L114 HydrophobicContact CD2-CD2 4.36Å; Y104-L114 HydrophobicContact CE2-CD2 3.57Å; K107-L114 HydrophobicContact CB-CD1 3.66Å; L108-L114 HydrophobicContact CB-CD1 4.24Å; R112-L114 PolarHBondContact O-N 3.47Å; R112-L114 VanDerWaalsContact O-N 3.1Å; L114-L145 HydrophobicContact CB-CD2 3.6Å; L114-L145 VanDerWaalsContact O-CD2 3.23Å; L114-L145 WeakPolarHBondContact O-CD2 3.41Å
115	S	66.9	Low	73.5	Confident	19 Å²	19	64.3 Å²	64.3	13%	0.133	32%	0.32	C	S	.	.			trans	-103.6	163.6	172.5	78.2	0	0	0	0	111.4	K85 D88	K85-S115 WeakPolarHBondContact CE-O 3.35Å; K85-S115 PolarHBondContact NZ-O 3.28Å; D88-S115 WeakPolarHBondContact OD2-CB 3.48Å; D88-S115 PolarHBondContact OD2-OG 3.29Å
116	G	71.9	Confident	73.3	Confident	6 Å²	6	70.6 Å²	70.6	6%	0.062	35%	0.349	C	S	.	.	S	Bend	trans	110.3	-157.7	174.8	0	0	0	0	0	114.2	S86 D88 L145	S86-G116 WeakPolarHBondContact O-CA 3.46Å; D88-G116 PolarHBondContact OD2-N 3.38Å; G116-L145 WeakPolarHBondContact O-CB 3.33Å; G116-L145 PolarHBondContact O-N 2.89Å
117	R	76	Confident	73.1	Confident	103 Å²	103	68.3 Å²	68.3	39%	0.389	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.5	-178.9	-60.4	179.7	-171.1	176.2	4.1	109	K85 S86 M142 H143 W177	K85-R117 CarbonylContact C-O 3.58Å; K85-R117 WeakPolarHBondContact CA-O 3.39Å; K85-R117 WeakPolarHBondContact CG-O 3.34Å; S86-R117 PolarHBondContact N-O 2.88Å; S86-R117 PolarHBondContact OG-N 3.07Å; S86-R117 PolarHBondContact OG-O 3.45Å; R117-M142 HydrophobicContact CB-CE 3.93Å; R117-H143 WeakPolarHBondContact CA-O 3.37Å; R117-W177 HydrophobicContact CB-CZ2 3.75Å; R117-W177 WeakPolarHBondContact O-CZ2 3.36Å
118	Y	80.1	Confident	72.8	Confident	23 Å²	23	63 Å²	63	9%	0.09	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157	170.4	72.3	-78.9	0	0	0	112.2	L84 L108 T120 H143 L145	L84-Y118 CarbonylContact O-C 3.45Å; L84-Y118 WeakPolarHBondContact O-CA 3.39Å; L84-Y118 WeakPolarHBondContact O-CB 3.36Å; L108-Y118 HydrophobicContact CD2-CD1 4.1Å; L108-Y118 HydrophobicContact CD2-CD2 3.69Å; L108-Y118 HydrophobicContact CD2-CE1 4.11Å; L108-Y118 HydrophobicContact CD2-CE2 3.73Å; L108-Y118 HydrophobicContact CD2-CG 3.86Å; L108-Y118 HydrophobicContact CG-CD1 4.46Å; Y118-T120 HydrophobicContact CD2-CG2 4.47Å; Y118-T120 HydrophobicContact CE2-CG2 4.22Å; Y118-H143 HydrophobicContact CD1-CB 3.76Å; Y118-H143 HydrophobicContact CD2-CB 4.32Å; Y118-H143 HydrophobicContact CE1-CB 3.3Å; Y118-H143 HydrophobicContact CE2-CB 3.89Å; Y118-H143 AromaticContact CE2-CD2 3.44Å; Y118-H143 VanDerWaalsContact CE2-CD2 3.44Å; Y118-H143 WeakPolarHBondContact CE2-CD2 3.31Å; Y118-H143 AromaticContact CE2-CG 3.97Å; Y118-H143 HydrophobicContact CG-CB 4.28Å; Y118-H143 AromaticContact CZ-CD2 3.62Å; Y118-H143 AromaticContact CZ-CG 3.7Å; Y118-H143 PolarHBondContact N-O 3.39Å; Y118-H143 PolarHBondContact O-N 3.38Å; Y118-L145 HydrophobicContact CD1-CD1 3.16Å; Y118-L145 HydrophobicContact CE1-CD1 3.35Å; Y118-L145 HydrophobicContact CE1-CG 4.4Å; Y118-L145 HydrophobicContact CG-CD1 4.41Å
119	Q	81	Confident	72.4	Confident	25 Å²	25	65.6 Å²	65.6	12%	0.117	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.1	170.7	-163.2	178.8	13.6	0	0	108	W82 Y83 L84 G139 F141 M142 W177	W82-Q119 HydrophobicContact CH2-CB 4.26Å; W82-Q119 HydrophobicContact CH2-CG 3.77Å; W82-Q119 HydrophobicContact CZ3-CB 4.06Å; W82-Q119 HydrophobicContact CZ3-CG 4.09Å; W82-Q119 WeakPolarHBondContact CZ3-O 3.5Å; Y83-Q119 WeakPolarHBondContact CA-O 3.3Å; L84-Q119 PolarHBondContact N-O 3.26Å; L84-Q119 PolarHBondContact O-N 3.33Å; Q119-G139 PolarHBondContact NE2-O 2.93Å; Q119-F141 WeakPolarHBondContact CA-O 3.2Å; Q119-F141 WeakPolarHBondContact CG-O 3.3Å; Q119-M142 HydrophobicContact CB-SD 3.88Å; Q119-M142 HydrophobicContact CG-SD 4.16Å; Q119-W177 HydrophobicContact CB-CH2 4.45Å; Q119-W177 HydrophobicContact CB-CZ3 4.13Å
120	T	79.4	Confident	72.1	Confident	32 Å²	32	63.5 Å²	63.5	20%	0.196	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.7	175.6	-174.3	0	0	0	0	110.5	W82 Y83 Y118	W82-T120 VanDerWaalsContact O-CA 3.27Å; W82-T120 WeakPolarHBondContact O-CA 3.49Å; W82-T120 WeakPolarHBondContact O-CB 3.15Å; W82-T120 PolarHBondContact O-OG1 2.94Å; Y83-T120 WeakPolarHBondContact CD1-OG1 3.45Å; Y83-T120 VanDerWaalsContact CE1-OG1 3.3Å; Y83-T120 WeakPolarHBondContact CE1-OG1 3.22Å; Y118-T120 HydrophobicContact CD2-CG2 4.47Å; Y118-T120 HydrophobicContact CE2-CG2 4.22Å
121	S	79.3	Confident	72	Confident	25 Å²	25	58.9 Å²	58.9	18%	0.175	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	149.8	170.8	-176.9	0	0	0	0	109.7	T81 W82 S138	T81-S121 WeakPolarHBondContact CA-O 3.42Å; W82-S121 VanDerWaalsContact CE2-CB 3.5Å; W82-S121 VanDerWaalsContact CZ2-CB 3.44Å; W82-S121 PolarHBondContact N-O 3.38Å; W82-S121 PolarHBondContact O-N 3.31Å; S121-S138 PolarHBondContact OG-O 3.25Å
122	S	77.8	Confident	71.9	Confident	72 Å²	72	55.8 Å²	55.8	50%	0.503	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.8	179.4	-169.6	0	0	0	0	108.2	N79 I80 T81	N79-S122 PolarHBondContact OD1-OG 3.42Å; N79-S122 VanDerWaalsContact OD1-OG 3.08Å; I80-S122 WeakPolarHBondContact O-CA 3.38Å; T81-S122 WeakPolarHBondContact CG2-OG 3.33Å
123	K	78.5	Confident	72	Confident	92 Å²	92	55.2 Å²	55.2	40%	0.4	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	125.9	175	-168	169.2	172.9	-164.5	0	110.2	N79 I80 F125	N79-K123 PolarHBondContact OD1-O 2.98Å; I80-K123 PolarHBondContact N-O 3.01Å; I80-K123 PolarHBondContact O-N 3.33Å; K123-F125 HydrophobicContact CB-CE2 4.02Å; K123-F125 HydrophobicContact CB-CZ 4.09Å; K123-F125 HydrophobicContact CD-CE1 3.92Å; K123-F125 HydrophobicContact CD-CE2 4.31Å; K123-F125 HydrophobicContact CD-CZ 3.54Å; K123-F125 HydrophobicContact CG-CE1 4.12Å; K123-F125 HydrophobicContact CG-CE2 4Å; K123-F125 HydrophobicContact CG-CZ 3.68Å
124	L	77.1	Confident	71.5	Confident	108 Å²	108	59.3 Å²	59.3	57%	0.565	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	130.2	175.2	-174.2	70.5	0	0	0	109.3	N79	N79-L124 HydrophobicContact CB-CD1 3.83Å
125	F	76.6	Confident	70.9	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.1	174.7	-62.2	-79.6	0	0	0	109	S77 L78 I80 K123 E130 L131 Q135	S77-F125 CarbonylContact C-O 3.54Å; S77-F125 VanDerWaalsContact CA-O 3.26Å; S77-F125 WeakPolarHBondContact CA-O 3.36Å; L78-F125 PolarHBondContact N-O 3.46Å; L78-F125 PolarHBondContact O-N 3.11Å; I80-F125 HydrophobicContact CB-CE2 4.17Å; I80-F125 HydrophobicContact CD1-CD2 4.21Å; I80-F125 HydrophobicContact CD1-CE2 3.98Å; I80-F125 HydrophobicContact CG1-CD2 4.22Å; I80-F125 HydrophobicContact CG1-CE2 4.14Å; K123-F125 HydrophobicContact CB-CE2 4.02Å; K123-F125 HydrophobicContact CB-CZ 4.09Å; K123-F125 HydrophobicContact CD-CE1 3.92Å; K123-F125 HydrophobicContact CD-CE2 4.31Å; K123-F125 HydrophobicContact CD-CZ 3.54Å; K123-F125 HydrophobicContact CG-CE1 4.12Å; K123-F125 HydrophobicContact CG-CE2 4Å; K123-F125 HydrophobicContact CG-CZ 3.68Å; F125-E130 HydrophobicContact CD1-CB 4.29Å; F125-L131 HydrophobicContact CB-CD1 4.28Å; F125-L131 HydrophobicContact CD1-CD1 4.32Å; F125-L131 HydrophobicContact CD2-CD1 3.5Å; F125-L131 VanDerWaalsContact CD2-CD1 3.5Å; F125-L131 HydrophobicContact CE2-CD1 3.84Å; F125-L131 HydrophobicContact CG-CD1 3.75Å; F125-L131 HydrophobicContact CZ-CD1 4.38Å; F125-Q135 VanDerWaalsContact CE1-CD 3.42Å; F125-Q135 VanDerWaalsContact CZ-NE2 3.35Å
126	Q	74.1	Confident	70.1	Confident	138 Å²	138	61.7 Å²	61.7	65%	0.645	32%	0.321	S	S	*	.	S	Bend	trans	-78.4	-34.9	-179.1	-68.7	-179	-9.6	0	0	111.4
127	N	71.5	Confident	69.2	Low	74 Å²	74	62.4 Å²	62.4	40%	0.396	32%	0.323	S	S	.	.	S	Bend	trans	-130.8	148.9	179.2	-64.3	-22.8	0	0	0	111.4	S129 E130	N127-S129 PolarHBondContact O-N 3.48Å; N127-E130 PolarHBondContact O-N 2.94Å; N127-E130 VanDerWaalsContact O-N 3.16Å
128	C	68.1	Low	67.7	Low	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.6	-31	176.5	-54.3	0	0	0	0	112.7	C74 E130 L131 F132 F206	C74-C128 HydrophobicContact CB-CB 4.07Å; C74-C128 WeakPolarHBondContact CB-SG 3.41Å; C74-C128 WeakPolarHBondContact O-CB 3.47Å; C74-C128 PolarHBondContact O-N 3.24Å; C74-C128 PolarHBondContact O-SG 2.72Å; C74-C128 WeakPolarHBondContact SG-CB 3.38Å; C74-C128 CovalentContact SG-SG 2.04Å; C74-C128 PolarHBondContact SG-SG 2.99Å; C128-E130 PolarHBondContact O-N 3.39Å; C128-L131 WeakPolarHBondContact O-CA 3.34Å; C128-L131 WeakPolarHBondContact O-CB 3.42Å; C128-L131 PolarHBondContact O-N 2.97Å; C128-F132 HydrophobicContact CB-CE2 4.04Å; C128-F132 HydrophobicContact CB-CZ 4.27Å; C128-F132 VanDerWaalsContact O-CD2 3.23Å; C128-F132 WeakPolarHBondContact O-CD2 3.35Å; C128-F132 WeakPolarHBondContact O-CE2 3.29Å; C128-F132 PolarHBondContact O-N 3.11Å; C128-F206 HydrophobicContact CB-CE1 3.99Å; C128-F206 HydrophobicContact CB-CZ 4.3Å; C128-F206 VanDerWaalsContact SG-CZ 3.57Å
129	S	66.3	Low	66.1	Low	58 Å²	58	60 Å²	60	41%	0.406	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-21.8	178.3	-53.4	0	0	0	0	113.6	N127	N127-S129 PolarHBondContact O-N 3.48Å
130	E	66.9	Low	64.4	Low	88 Å²	88	64.3 Å²	64.3	41%	0.411	35%	0.351	S	S	.	.	H	α-helix	trans	-79.8	-27.7	171.8	-63.5	-171	152.4	0	0	112.1	F125 N127 C128 F132 Q135	F125-E130 HydrophobicContact CD1-CB 4.29Å; N127-E130 PolarHBondContact O-N 2.94Å; N127-E130 VanDerWaalsContact O-N 3.16Å; C128-E130 PolarHBondContact O-N 3.39Å; E130-F132 VanDerWaalsContact C-N 3.33Å; E130-Q135 PolarHBondContact O-NE2 3.36Å
131	L	66.8	Low	62.8	Low	4 Å²	4	68.9 Å²	68.9	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-42.7	175.4	-152.6	80	0	0	0	111.7	F69 L78 I80 F125 C128 K133 Q135	F69-L131 HydrophobicContact CB-CD2 3.51Å; F69-L131 HydrophobicContact CB-CG 3.81Å; F69-L131 HydrophobicContact CD1-CD2 3.78Å; F69-L131 HydrophobicContact CD1-CG 4.45Å; F69-L131 HydrophobicContact CD2-CD1 4.43Å; F69-L131 HydrophobicContact CD2-CD2 4.15Å; F69-L131 HydrophobicContact CD2-CG 3.92Å; F69-L131 HydrophobicContact CG-CD2 3.53Å; F69-L131 HydrophobicContact CG-CG 3.79Å; L78-L131 HydrophobicContact CD1-CD1 4.2Å; L78-L131 HydrophobicContact CD1-CD2 3.82Å; I80-L131 HydrophobicContact CD1-CD1 3.35Å; I80-L131 HydrophobicContact CD1-CG 4.32Å; I80-L131 HydrophobicContact CG1-CD1 4.35Å; F125-L131 HydrophobicContact CB-CD1 4.28Å; F125-L131 HydrophobicContact CD1-CD1 4.32Å; F125-L131 HydrophobicContact CD2-CD1 3.5Å; F125-L131 VanDerWaalsContact CD2-CD1 3.5Å; F125-L131 HydrophobicContact CE2-CD1 3.84Å; F125-L131 HydrophobicContact CG-CD1 3.75Å; F125-L131 HydrophobicContact CZ-CD1 4.38Å; C128-L131 WeakPolarHBondContact O-CA 3.34Å; C128-L131 WeakPolarHBondContact O-CB 3.42Å; C128-L131 PolarHBondContact O-N 2.97Å; L131-K133 VanDerWaalsContact C-N 3.32Å; L131-K133 PolarHBondContact O-N 3.14Å; L131-Q135 PolarHBondContact O-NE2 3.08Å
132	F	64.8	Low	61.5	Low	55 Å²	55	72 Å²	72	24%	0.241	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-6.1	-172.4	-53.9	-43.4	0	0	0	114.8	F69 G71 E72 C128 E130 F206	F69-F132 HydrophobicContact CB-CD1 4.19Å; F69-F132 HydrophobicContact CB-CE1 4.43Å; F69-F132 WeakPolarHBondContact O-CD1 3.44Å; G71-F132 VanDerWaalsContact C-CZ 3.41Å; G71-F132 VanDerWaalsContact N-CE1 3.32Å; G71-F132 WeakPolarHBondContact O-CE2 3.5Å; E72-F132 VanDerWaalsContact O-CE2 3.27Å; E72-F132 WeakPolarHBondContact O-CE2 3.38Å; E72-F132 WeakPolarHBondContact O-CZ 3.48Å; C128-F132 HydrophobicContact CB-CE2 4.04Å; C128-F132 HydrophobicContact CB-CZ 4.27Å; C128-F132 VanDerWaalsContact O-CD2 3.23Å; C128-F132 WeakPolarHBondContact O-CD2 3.35Å; C128-F132 WeakPolarHBondContact O-CE2 3.29Å; C128-F132 PolarHBondContact O-N 3.11Å; E130-F132 VanDerWaalsContact C-N 3.33Å; F132-F206 AromaticContact CE1-CD1 3.74Å; F132-F206 HydrophobicContact CE1-CD1 3.74Å; F132-F206 HydrophobicContact CE1-CE1 4.05Å; F132-F206 AromaticContact CZ-CD1 3.57Å; F132-F206 HydrophobicContact CZ-CD1 3.57Å; F132-F206 AromaticContact CZ-CE1 3.53Å; F132-F206 HydrophobicContact CZ-CE1 3.53Å
133	K	60	Low	60.4	Low	148 Å²	148	71.8 Å²	71.8	64%	0.643	37%	0.373	S	S	*	.	S	Bend	trans	-72.6	153.2	171.4	-67.9	-179.6	-177.6	174.8	0	109.4	L131 Q135	L131-K133 VanDerWaalsContact C-N 3.32Å; L131-K133 PolarHBondContact O-N 3.14Å; K133-Q135 VanDerWaalsContact O-CG 3.3Å; K133-Q135 WeakPolarHBondContact O-CG 3.22Å; K133-Q135 PolarHBondContact O-N 3.47Å
134	T	50	Low	58.9	Low	155 Å²	155	77 Å²	77	95%	0.951	39%	0.39	S	S	*	.			trans	-60.9	112.3	175.5	-46.2	0	0	0	0	109.4
135	Q	56.2	Low	58	Low	35 Å²	35	72.2 Å²	72.2	16%	0.164	37%	0.365	C	S	.	.			trans	-110.4	131	-177.1	-67.4	-164.1	56.5	0	0	112.1	F125 E130 L131 K133 F137	F125-Q135 VanDerWaalsContact CE1-CD 3.42Å; F125-Q135 VanDerWaalsContact CZ-NE2 3.35Å; E130-Q135 PolarHBondContact O-NE2 3.36Å; L131-Q135 PolarHBondContact O-NE2 3.08Å; K133-Q135 VanDerWaalsContact O-CG 3.3Å; K133-Q135 WeakPolarHBondContact O-CG 3.22Å; K133-Q135 PolarHBondContact O-N 3.47Å; Q135-F137 HydrophobicContact CB-CE2 4.05Å; Q135-F137 HydrophobicContact CB-CZ 4.41Å
136	S	49.3	Very low	56.3	Low	51 Å²	51	75.4 Å²	75.4	36%	0.357	39%	0.386	S	S	.	.			trans	-87.5	110.8	161	59.5	0	0	0	0	108.4	S138 H171	S136-S138 PolarHBondContact O-N 3.14Å; S136-S138 VanDerWaalsContact O-N 3.14Å; S136-H171 PolarHBondContact OG-ND1 3.34Å
137	F	52.7	Low	55	Low	20 Å²	20	73.4 Å²	73.4	9%	0.088	38%	0.379	C	S	.	.			trans	-76	97.1	169.7	-69.8	-88.4	0	0	0	108.3	L67 F69 I80 W82 Q135	L67-F137 HydrophobicContact CB-CD2 3.8Å; L67-F137 HydrophobicContact CB-CE2 3.64Å; L67-F137 HydrophobicContact CB-CZ 4.41Å; L67-F137 HydrophobicContact CD2-CD1 4.46Å; L67-F137 HydrophobicContact CD2-CD2 4.21Å; L67-F137 HydrophobicContact CD2-CE1 4.04Å; L67-F137 HydrophobicContact CD2-CE2 3.78Å; L67-F137 HydrophobicContact CD2-CZ 3.7Å; L67-F137 HydrophobicContact CG-CD2 4.4Å; L67-F137 HydrophobicContact CG-CE2 3.85Å; L67-F137 HydrophobicContact CG-CZ 4.15Å; L67-F137 WeakPolarHBondContact O-CE2 3.45Å; F69-F137 HydrophobicContact CE2-CE2 4.45Å; F69-F137 AromaticContact CE2-CZ 3.88Å; F69-F137 HydrophobicContact CE2-CZ 3.88Å; I80-F137 HydrophobicContact CG2-CE1 4.44Å; W82-F137 AromaticContact CD1-CD1 3.85Å; W82-F137 AromaticContact NE1-CD1 3.81Å; Q135-F137 HydrophobicContact CB-CE2 4.05Å; Q135-F137 HydrophobicContact CB-CZ 4.41Å
138	S	45.6	Very low	53.6	Low	58 Å²	58	76.9 Å²	76.9	41%	0.406	40%	0.397	S	S	.	.			trans	-78.5	130.4	170.8	-169.5	0	0	0	0	108.9	S121 S136	S121-S138 PolarHBondContact OG-O 3.25Å; S136-S138 PolarHBondContact O-N 3.14Å; S136-S138 VanDerWaalsContact O-N 3.14Å
139	G	46.9	Very low	52.4	Low	17 Å²	17	80.7 Å²	80.7	18%	0.175	44%	0.436	C	S	.	.			trans	-98.6	117.3	176.7	0	0	0	0	0	111.3	W82 Q119	W82-G139 VanDerWaalsContact CZ2-CA 3.42Å; Q119-G139 PolarHBondContact NE2-O 2.93Å
140	D	43.9	Very low	50.8	Low	116 Å²	116	84.7 Å²	84.7	62%	0.62	45%	0.449	S	S	*	.			trans	-83.7	-14.5	-170.1	-86.4	-19	0	0	0	115.1
141	F	47.8	Very low	49	Very low	129 Å²	129	90.3 Å²	90.3	57%	0.566	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.3	120.7	-174	-61.2	-78.3	0	0	0	114.8	Q119 H143	Q119-F141 WeakPolarHBondContact CA-O 3.2Å; Q119-F141 WeakPolarHBondContact CG-O 3.3Å; F141-H143 WeakPolarHBondContact CB-NE2 3.36Å
142	M	50.6	Low	47.4	Very low	90 Å²	90	99 Å²	99	44%	0.443	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	115	167.3	-80.6	-63.5	-58.4	0	0	110.3	R117 Q119 W177	R117-M142 HydrophobicContact CB-CE 3.93Å; Q119-M142 HydrophobicContact CB-SD 3.88Å; Q119-M142 HydrophobicContact CG-SD 4.16Å; M142-W177 HydrophobicContact CE-CD2 3.58Å; M142-W177 HydrophobicContact CE-CE3 3.72Å; M142-W177 HydrophobicContact CE-CG 4.1Å; M142-W177 HydrophobicContact CE-CH2 4.16Å; M142-W177 HydrophobicContact CE-CZ2 4.06Å; M142-W177 HydrophobicContact CE-CZ3 4Å; M142-W177 HydrophobicContact SD-CD2 4.15Å; M142-W177 HydrophobicContact SD-CE3 3.64Å; M142-W177 HydrophobicContact SD-CH2 4.25Å; M142-W177 HydrophobicContact SD-CZ3 3.69Å
143	H	55.2	Low	45.6	Very low	67 Å²	67	105.5 Å²	105.5	31%	0.31	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.4	178.1	-64	-63.3	0	0	0	111.1	R117 Y118 F141	R117-H143 WeakPolarHBondContact CA-O 3.37Å; Y118-H143 HydrophobicContact CD1-CB 3.76Å; Y118-H143 HydrophobicContact CD2-CB 4.32Å; Y118-H143 HydrophobicContact CE1-CB 3.3Å; Y118-H143 HydrophobicContact CE2-CB 3.89Å; Y118-H143 AromaticContact CE2-CD2 3.44Å; Y118-H143 VanDerWaalsContact CE2-CD2 3.44Å; Y118-H143 WeakPolarHBondContact CE2-CD2 3.31Å; Y118-H143 AromaticContact CE2-CG 3.97Å; Y118-H143 HydrophobicContact CG-CB 4.28Å; Y118-H143 AromaticContact CZ-CD2 3.62Å; Y118-H143 AromaticContact CZ-CG 3.7Å; Y118-H143 PolarHBondContact N-O 3.39Å; Y118-H143 PolarHBondContact O-N 3.38Å; F141-H143 WeakPolarHBondContact CB-NE2 3.36Å
144	R	47	Very low	44.1	Very low	203 Å²	203	103 Å²	103	77%	0.766	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.3	126.2	175.1	-170.2	-169	-65.5	-164.7	1.7	109.6
145	L	57.3	Low	43	Very low	6 Å²	6	105.1 Å²	105.1	3%	0.031	55%	0.546	C	S	.	.	P	Polyproline II helix	trans	-90.6	149.4	165.6	-80.8	90.6	0	0	0	110.6	L114 G116 Y118	L114-L145 HydrophobicContact CB-CD2 3.6Å; L114-L145 VanDerWaalsContact O-CD2 3.23Å; L114-L145 WeakPolarHBondContact O-CD2 3.41Å; G116-L145 WeakPolarHBondContact O-CB 3.33Å; G116-L145 PolarHBondContact O-N 2.89Å; Y118-L145 HydrophobicContact CD1-CD1 3.16Å; Y118-L145 HydrophobicContact CE1-CD1 3.35Å; Y118-L145 HydrophobicContact CE1-CG 4.4Å; Y118-L145 HydrophobicContact CG-CD1 4.41Å
146	P	42.1	Very low	41.7	Very low	72 Å²	72	112.1 Å²	112.1	47%	0.468	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-61.3	142.4	173.9	24.5	-31.2	0	0	0	111.3
147	L	47	Very low	40.6	Very low	96 Å²	96	116.9 Å²	116.9	50%	0.503	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-70.1	139.3	173.4	-72.4	168.6	0	0	0	109.7	G149 E150	L147-G149 PolarHBondContact O-N 3.4Å; L147-E150 PolarHBondContact O-N 3.35Å
148	L	42	Very low	39.9	Very low	146 Å²	146	119.4 Å²	119.4	76%	0.764	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	97.7	178	-160.2	75.8	0	0	0	108.9
149	G	42.3	Very low	39	Very low	80 Å²	80	122.6 Å²	122.6	83%	0.825	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.2	-1	178.7	0	0	0	0	0	116.6	L147	L147-G149 PolarHBondContact O-N 3.4Å
150	E	31.7	Very low	38.3	Very low	143 Å²	143	129.5 Å²	129.5	67%	0.668	68%	0.682	S	S	*	*			trans	-85.7	120	175.9	-122.3	-177.1	140.7	0	0	111.5	L147 Q152	L147-E150 PolarHBondContact O-N 3.35Å; E150-Q152 PolarHBondContact O-N 2.85Å
151	K	30.7	Very low	37.4	Very low	205 Å²	205	130.5 Å²	130.5	89%	0.891	69%	0.687	S	S	*	*			trans	-70.6	122.6	163.3	-81.7	-177.7	176.3	178.9	0	108	E153	K151-E153 PolarHBondContact O-N 3.33Å; K151-E153 VanDerWaalsContact O-N 3.13Å
152	Q	32.8	Very low	36.3	Very low	187 Å²	187	130.1 Å²	130.1	87%	0.874	70%	0.695	S	S	*	*			trans	-62.7	109.8	171.5	-82.4	176.3	-23.9	0	0	110.2	E150	E150-Q152 PolarHBondContact O-N 2.85Å
153	E	25.9	Very low	35.1	Very low	192 Å²	192	134.2 Å²	134.2	90%	0.897	71%	0.711	S	S	*	*			trans	-99.1	103.5	147.4	-81.5	-169.3	168.2	0	0	108	K151 K155	K151-E153 PolarHBondContact O-N 3.33Å; K151-E153 VanDerWaalsContact O-N 3.13Å; E153-K155 PolarHBondContact O-N 3.04Å
154	A	29.5	Very low	34	Very low	95 Å²	95	139 Å²	139	79%	0.785	74%	0.737	S	S	*	*			trans	-69.8	117.7	170.1	0	0	0	0	0	109.3
155	K	25.8	Very low	33	Very low	199 Å²	199	132.2 Å²	132.2	87%	0.865	73%	0.731	S	S	*	*			trans	-127	90.6	150.1	-113.5	-179	-179.2	175.6	0	108.7	E153 N157	E153-K155 PolarHBondContact O-N 3.04Å; K155-N157 PolarHBondContact O-N 3.46Å
156	E	29.4	Very low	31.4	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	77%	0.769	S	S	*	*			trans	-61.5	121.9	162.2	-152.2	174.6	-164	0	0	107.7
157	N	25.7	Very low	30.9	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	79%	0.79	S	S	*	*			trans	-141	111.5	157.2	-95.8	-13.1	0	0	0	107.3	K155	K155-N157 PolarHBondContact O-N 3.46Å
158	G	39.4	Very low	29.9	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	80%	0.802	S	S	*	*			trans	-63.6	136.1	179.5	0	0	0	0	0	111.6
159	T	25.8	Very low	29.3	Very low	125 Å²	125	145 Å²	145	77%	0.767	81%	0.805	S	S	*	*			trans	-149.8	113.8	150	-24.2	0	0	0	0	107.4	L161	T159-L161 PolarHBondContact O-N 3.39Å
160	N	32.1	Very low	28.4	Very low	162 Å²	162	149.6 Å²	149.6	87%	0.866	81%	0.807	S	S	*	*			trans	-62.7	103.5	172.4	-65.9	-27.2	0	0	0	108.4
161	L	25.8	Very low	28.4	Very low	136 Å²	136	149.8 Å²	149.8	71%	0.712	81%	0.807	S	S	*	*			trans	-97.4	84.8	168.6	-108.7	153.8	0	0	0	108.1	T159 F163	T159-L161 PolarHBondContact O-N 3.39Å; L161-F163 HydrophobicContact CD2-CD2 4.08Å; L161-F163 HydrophobicContact CD2-CE2 3.7Å; L161-F163 HydrophobicContact CD2-CZ 4.33Å; L161-F163 PolarHBondContact O-N 3.37Å; L161-F163 VanDerWaalsContact O-N 3.14Å
162	T	25.3	Very low	29	Very low	121 Å²	121	146.6 Å²	146.6	74%	0.742	80%	0.796	S	S	*	*			trans	-66	100.5	160.3	39.5	0	0	0	0	108.5	I164	T162-I164 PolarHBondContact O-N 2.77Å
163	F	24.5	Very low	30.5	Very low	176 Å²	176	139.8 Å²	139.8	77%	0.772	77%	0.768	S	S	*	*			trans	-79.8	103.5	159.4	-90.3	-85.4	0	0	0	108.3	L161 G165	L161-F163 HydrophobicContact CD2-CD2 4.08Å; L161-F163 HydrophobicContact CD2-CE2 3.7Å; L161-F163 HydrophobicContact CD2-CZ 4.33Å; L161-F163 PolarHBondContact O-N 3.37Å; L161-F163 VanDerWaalsContact O-N 3.14Å; F163-G165 PolarHBondContact O-N 3.38Å
164	I	31.8	Very low	32.7	Very low	167 Å²	167	131 Å²	131	86%	0.856	73%	0.727	S	S	*	*			trans	-76.6	102.9	158.5	-65.8	171.9	0	0	0	105.3	T162	T162-I164 PolarHBondContact O-N 2.77Å
165	G	26.4	Very low	35.2	Very low	62 Å²	62	129.4 Å²	129.4	64%	0.639	70%	0.703	S	S	*	*			trans	-123.7	130	172.1	0	0	0	0	0	109	F163	F163-G165 PolarHBondContact O-N 3.38Å
166	D	24.1	Very low	38	Very low	155 Å²	155	120 Å²	120	83%	0.829	66%	0.663	S	S	*	*			trans	-45.7	133.7	-170.7	-94.8	-43.3	0	0	0	115.2	T168	D166-T168 VanDerWaalsContact C-N 3.29Å; D166-T168 PolarHBondContact O-N 3.42Å
167	K	31.8	Very low	40.5	Very low	210 Å²	210	113.3 Å²	113.3	91%	0.913	63%	0.629	S	S	*	*			trans	-67.1	89.5	164.3	-74	177.8	176.5	174.1	0	109
168	T	24.7	Very low	43.4	Very low	124 Å²	124	108.7 Å²	108.7	76%	0.761	60%	0.603	S	S	*	*			trans	-111.2	101.8	153.9	-21.5	0	0	0	0	106.4	D166 M170	D166-T168 VanDerWaalsContact C-N 3.29Å; D166-T168 PolarHBondContact O-N 3.42Å; T168-M170 PolarHBondContact O-N 3.4Å
169	A	30.3	Very low	45.7	Very low	100 Å²	100	109.2 Å²	109.2	83%	0.826	59%	0.588	S	S	*	*			trans	-62.7	102.8	178	0	0	0	0	0	109.6
170	M	23.4	Very low	48.5	Very low	175 Å²	175	103.4 Å²	103.4	86%	0.862	55%	0.553	S	S	*	*			trans	-130.3	106.3	158.9	-165.4	165.1	155	0	0	106	T168 E172	T168-M170 PolarHBondContact O-N 3.4Å; M170-E172 PolarHBondContact O-N 3.24Å; M170-E172 VanDerWaalsContact O-N 3.15Å
171	H	31.1	Very low	51.1	Low	147 Å²	147	95.7 Å²	95.7	68%	0.681	51%	0.512	S	S	*	.			trans	-48.3	114.7	-179.5	-67	-97.8	0	0	0	110.6	S136 P173	S136-H171 PolarHBondContact OG-ND1 3.34Å; H171-P173 WeakPolarHBondContact O-CD 3.45Å
172	E	43.5	Very low	54	Low	139 Å²	139	89.3 Å²	89.3	65%	0.65	48%	0.478	S	S	*	.			trans	-83	118.8	-177.8	-156.1	165.8	-167.5	0	0	109.6	M170	M170-E172 PolarHBondContact O-N 3.24Å; M170-E172 VanDerWaalsContact O-N 3.15Å
173	P	63.8	Low	56.9	Low	43 Å²	43	83.7 Å²	83.7	28%	0.279	44%	0.444	S	S	.	.			trans	-71.2	154.8	178.5	28.8	-32.6	0	0	0	110.8	T64 H171 Q175	T64-P173 HydrophobicContact CG2-CB 4.29Å; T64-P173 HydrophobicContact CG2-CG 3.97Å; H171-P173 WeakPolarHBondContact O-CD 3.45Å; P173-Q175 HydrophobicContact CG-CG 4.33Å; P173-Q175 WeakPolarHBondContact O-CG 3.27Å; P173-Q175 PolarHBondContact O-N 2.98Å
174	L	72.4	Confident	59.8	Low	7 Å²	7	75.7 Å²	75.7	4%	0.037	41%	0.409	C	S	.	.			trans	-56.8	110.6	174.9	180	58.2	0	0	0	110.2	T64 I65 W82 L84 F184	T64-L174 WeakPolarHBondContact CA-O 3.2Å; I65-L174 HydrophobicContact CB-CB 4.47Å; I65-L174 HydrophobicContact CB-CD2 3.99Å; I65-L174 HydrophobicContact CB-CG 4.2Å; I65-L174 HydrophobicContact CD1-CD2 4.29Å; I65-L174 HydrophobicContact CG2-CD2 4.33Å; I65-L174 PolarHBondContact N-O 3.17Å; W82-L174 HydrophobicContact CD2-CD2 4.31Å; W82-L174 HydrophobicContact CE3-CD1 4.26Å; W82-L174 HydrophobicContact CE3-CD2 4.02Å; W82-L174 HydrophobicContact CH2-CD1 3.32Å; W82-L174 HydrophobicContact CH2-CD2 4.33Å; W82-L174 HydrophobicContact CH2-CG 4.4Å; W82-L174 HydrophobicContact CZ2-CD1 4.04Å; W82-L174 HydrophobicContact CZ3-CD1 3.45Å; W82-L174 VanDerWaalsContact CZ3-CD1 3.45Å; W82-L174 HydrophobicContact CZ3-CD2 4.05Å; W82-L174 HydrophobicContact CZ3-CG 4.42Å; L84-L174 HydrophobicContact CB-CD1 4.44Å; L84-L174 HydrophobicContact CD2-CD1 3.69Å; L84-L174 HydrophobicContact CD2-CD2 4.39Å; L84-L174 HydrophobicContact CD2-CG 4.02Å; L174-F184 HydrophobicContact CD2-CD2 4.18Å; L174-F184 HydrophobicContact CD2-CE2 3.54Å; L174-F184 HydrophobicContact CD2-CZ 4.21Å
175	Q	82.1	Confident	62.4	Low	63 Å²	63	68 Å²	68	29%	0.294	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-122.7	144.5	-175	-77.9	-178.2	20.3	0	0	112.6	T63 T64 P173	T63-Q175 VanDerWaalsContact O-CA 3.29Å; T63-Q175 WeakPolarHBondContact O-CA 3.01Å; T64-Q175 HydrophobicContact CG2-CG 3.68Å; P173-Q175 HydrophobicContact CG-CG 4.33Å; P173-Q175 WeakPolarHBondContact O-CG 3.27Å; P173-Q175 PolarHBondContact O-N 2.98Å
176	T	84.1	Confident	65.2	Low	2 Å²	2	65 Å²	65	1%	0.012	34%	0.338	C	S	.	.			trans	-76.1	139.9	170.4	57.6	0	0	0	0	111.4	L59 F60 N62 T63 Y182	L59-T176 HydrophobicContact CB-CG2 4.07Å; L59-T176 HydrophobicContact CD1-CG2 3.78Å; F60-T176 PolarHBondContact O-OG1 3.43Å; N62-T176 PolarHBondContact N-O 3.43Å; N62-T176 PolarHBondContact N-OG1 3.15Å; T63-T176 WeakPolarHBondContact CB-OG1 3.11Å; T63-T176 PolarHBondContact N-OG1 3.14Å; T63-T176 PolarHBondContact O-N 3.19Å; T176-Y182 HydrophobicContact CG2-CD1 4.17Å; T176-Y182 HydrophobicContact CG2-CD2 3.99Å; T176-Y182 HydrophobicContact CG2-CE1 3.97Å; T176-Y182 HydrophobicContact CG2-CE2 3.82Å; T176-Y182 HydrophobicContact CG2-CG 4.18Å
177	W	83.2	Confident	68.2	Low	41 Å²	41	59.3 Å²	59.3	16%	0.155	31%	0.307	C	S	.	.			trans	-95	-17.2	-175.2	49.3	84.1	0	0	0	115.1	L84 S86 R117 Q119 M142 Y182	L84-W177 HydrophobicContact CD2-CH2 4.36Å; L84-W177 HydrophobicContact CD2-CZ3 3.91Å; L84-W177 HydrophobicContact CG-CH2 4.15Å; L84-W177 HydrophobicContact CG-CZ3 4.2Å; S86-W177 WeakPolarHBondContact OG-CZ2 3.28Å; S86-W177 PolarHBondContact OG-NE1 2.87Å; R117-W177 HydrophobicContact CB-CZ2 3.75Å; R117-W177 WeakPolarHBondContact O-CZ2 3.36Å; Q119-W177 HydrophobicContact CB-CH2 4.45Å; Q119-W177 HydrophobicContact CB-CZ3 4.13Å; M142-W177 HydrophobicContact CE-CD2 3.58Å; M142-W177 HydrophobicContact CE-CE3 3.72Å; M142-W177 HydrophobicContact CE-CG 4.1Å; M142-W177 HydrophobicContact CE-CH2 4.16Å; M142-W177 HydrophobicContact CE-CZ2 4.06Å; M142-W177 HydrophobicContact CE-CZ3 4Å; M142-W177 HydrophobicContact SD-CD2 4.15Å; M142-W177 HydrophobicContact SD-CE3 3.64Å; M142-W177 HydrophobicContact SD-CH2 4.25Å; M142-W177 HydrophobicContact SD-CZ3 3.69Å; W177-Y182 HydrophobicContact CD2-CE1 4.23Å; W177-Y182 AromaticContact CE2-CE1 3.82Å; W177-Y182 HydrophobicContact CE3-CE1 4.35Å; W177-Y182 AromaticContact CH2-CE1 3.8Å; W177-Y182 HydrophobicContact CH2-CE1 3.8Å; W177-Y182 AromaticContact CZ2-CE1 3.61Å; W177-Y182 HydrophobicContact CZ2-CE1 3.61Å; W177-Y182 HydrophobicContact CZ3-CE1 4.16Å; W177-Y182 PolarHBondContact N-OH 3.28Å; W177-Y182 PolarHBondContact NE1-OH 2.8Å
178	Q	85.3	Confident	70.6	Confident	55 Å²	55	49.7 Å²	49.7	26%	0.257	27%	0.265	S	S	.	.	S	Bend	trans	-152	165.4	179.2	70.1	-171.7	25.4	0	0	111.3	A180 Y182	Q178-A180 HydrophobicContact CG-CB 4Å; Q178-A180 PolarHBondContact O-N 2.93Å; Q178-Y182 PolarHBondContact N-OH 3.32Å; Q178-Y182 VanDerWaalsContact N-OH 3.13Å; Q178-Y182 VanDerWaalsContact O-CE2 3.27Å; Q178-Y182 WeakPolarHBondContact O-CE2 3.14Å; Q178-Y182 PolarHBondContact O-OH 3.46Å; Q178-Y182 VanDerWaalsContact O-OH 3.12Å
179	D	87.6	Confident	73.2	Confident	83 Å²	83	44.7 Å²	44.7	44%	0.444	24%	0.239	S	C	.	.	S	Bend	trans	-73.8	112	169.7	-64.8	-15.2	0	0	0	108.3	F60 R61 L221 W435	F60-D179 WeakPolarHBondContact CA-OD1 3.5Å; R61-D179 WeakPolarHBondContact CB-OD1 3.39Å; R61-D179 PolarHBondContact N-OD1 2.98Å; D179-L221 HydrophobicContact CB-CD2 3.88Å; D179-W435 HydrophobicContact CB-CH2 4.11Å; D179-W435 WeakPolarHBondContact O-CZ2 3.49Å
180	A	85.8	Confident	75.4	Confident	3 Å²	3	43.6 Å²	43.6	3%	0.025	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	164.9	-178.8	0	0	0	0	0	112	L59 Q178 Y182	L59-A180 PolarHBondContact N-O 3.29Å; L59-A180 PolarHBondContact O-N 3.07Å; Q178-A180 HydrophobicContact CG-CB 4Å; Q178-A180 PolarHBondContact O-N 2.93Å; A180-Y182 HydrophobicContact CB-CD2 4.36Å; A180-Y182 HydrophobicContact CB-CE2 3.92Å; A180-Y182 WeakPolarHBondContact O-CD2 3.26Å; A180-Y182 PolarHBondContact O-N 2.89Å
181	P	86.4	Confident	77.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	126.8	156.7	-19.3	31.6	0	0	0	110.4	I58 S86 A87 Y90 I93 W435	I58-P181 HydrophobicContact CG1-CB 4.5Å; I58-P181 HydrophobicContact CG1-CG 4.48Å; S86-P181 WeakPolarHBondContact CA-O 3.17Å; A87-P181 PolarHBondContact N-O 3.45Å; A87-P181 WeakPolarHBondContact O-CD 3.36Å; Y90-P181 HydrophobicContact CD2-CB 4.44Å; Y90-P181 HydrophobicContact CD2-CG 4.26Å; I93-P181 HydrophobicContact CD1-CB 3.2Å; I93-P181 HydrophobicContact CG1-CB 3.88Å; P181-W435 HydrophobicContact CG-CB 4.47Å; P181-W435 HydrophobicContact CG-CD2 4.21Å; P181-W435 HydrophobicContact CG-CG 3.91Å
182	Y	86.3	Confident	78.5	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	142.1	176.5	-79.2	-93	0	0	0	112.3	G56 K57 L59 L84 K85 I93 T176 W177 Q178 A180	G56-Y182 WeakPolarHBondContact CA-O 3.21Å; K57-Y182 PolarHBondContact N-O 2.92Å; K57-Y182 PolarHBondContact O-N 3.39Å; L59-Y182 HydrophobicContact CB-CD2 3.85Å; L59-Y182 HydrophobicContact CB-CE2 4.43Å; L59-Y182 HydrophobicContact CD1-CD2 4.26Å; L59-Y182 HydrophobicContact CD1-CG 4.23Å; L59-Y182 HydrophobicContact CG-CD2 4.27Å; L84-Y182 HydrophobicContact CD1-CD1 3.74Å; L84-Y182 HydrophobicContact CD1-CG 4.4Å; L84-Y182 HydrophobicContact CD2-CD1 4.47Å; L84-Y182 HydrophobicContact CG-CD1 3.98Å; L84-Y182 HydrophobicContact CG-CE1 4.41Å; K85-Y182 CarbonylContact O-C 3.54Å; K85-Y182 VanDerWaalsContact O-CA 3.26Å; K85-Y182 WeakPolarHBondContact O-CA 3.25Å; I93-Y182 VanDerWaalsContact CD1-C 3.42Å; I93-Y182 VanDerWaalsContact CD1-N 3.27Å; I93-Y182 WeakPolarHBondContact CD1-O 3.33Å; T176-Y182 HydrophobicContact CG2-CD1 4.17Å; T176-Y182 HydrophobicContact CG2-CD2 3.99Å; T176-Y182 HydrophobicContact CG2-CE1 3.97Å; T176-Y182 HydrophobicContact CG2-CE2 3.82Å; T176-Y182 HydrophobicContact CG2-CG 4.18Å; W177-Y182 HydrophobicContact CD2-CE1 4.23Å; W177-Y182 AromaticContact CE2-CE1 3.82Å; W177-Y182 HydrophobicContact CE3-CE1 4.35Å; W177-Y182 AromaticContact CH2-CE1 3.8Å; W177-Y182 HydrophobicContact CH2-CE1 3.8Å; W177-Y182 AromaticContact CZ2-CE1 3.61Å; W177-Y182 HydrophobicContact CZ2-CE1 3.61Å; W177-Y182 HydrophobicContact CZ3-CE1 4.16Å; W177-Y182 PolarHBondContact N-OH 3.28Å; W177-Y182 PolarHBondContact NE1-OH 2.8Å; Q178-Y182 PolarHBondContact N-OH 3.32Å; Q178-Y182 VanDerWaalsContact N-OH 3.13Å; Q178-Y182 VanDerWaalsContact O-CE2 3.27Å; Q178-Y182 WeakPolarHBondContact O-CE2 3.14Å; Q178-Y182 PolarHBondContact O-OH 3.46Å; Q178-Y182 VanDerWaalsContact O-OH 3.12Å; A180-Y182 HydrophobicContact CB-CD2 4.36Å; A180-Y182 HydrophobicContact CB-CE2 3.92Å; A180-Y182 WeakPolarHBondContact O-CD2 3.26Å; A180-Y182 PolarHBondContact O-N 2.89Å
183	I	86.8	Confident	78.4	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.015	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124	166.7	-50.6	-177	0	0	0	108	F55 L84 K85 I93 F96 I185	F55-I183 WeakPolarHBondContact O-CA 2.9Å; L84-I183 WeakPolarHBondContact CA-O 3.17Å; K85-I183 PolarHBondContact N-O 3.45Å; K85-I183 PolarHBondContact O-N 2.97Å; I93-I183 HydrophobicContact CB-CD1 4.4Å; I93-I183 HydrophobicContact CB-CG1 4.23Å; I93-I183 HydrophobicContact CD1-CD1 4.38Å; I93-I183 HydrophobicContact CD1-CG1 3.56Å; I93-I183 HydrophobicContact CG1-CD1 3.94Å; I93-I183 HydrophobicContact CG1-CG1 3.66Å; I93-I183 HydrophobicContact CG2-CG1 4.12Å; F96-I183 HydrophobicContact CD2-CD1 4.23Å; F96-I183 HydrophobicContact CG-CD1 4.38Å; I183-I185 HydrophobicContact CG2-CD1 4.1Å; I183-I185 HydrophobicContact CG2-CG1 3.8Å
184	F	86.3	Confident	77.1	Confident	9 Å²	9	39.3 Å²	39.3	4%	0.039	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.2	172.2	-178.1	-119.9	0	0	0	109.3	S54 F55 I65 W82 Y83 L84 L174 V186 V210	S54-F184 CarbonylContact C-O 3.48Å; S54-F184 WeakPolarHBondContact CA-O 3.18Å; F55-F184 HydrophobicContact CB-CB 4.37Å; F55-F184 AromaticContact CD2-CD1 3.77Å; F55-F184 HydrophobicContact CD2-CD1 3.77Å; F55-F184 WeakPolarHBondContact CD2-O 3.28Å; F55-F184 HydrophobicContact CE2-CD1 4.39Å; F55-F184 PolarHBondContact N-O 2.94Å; F55-F184 PolarHBondContact O-N 2.9Å; I65-F184 HydrophobicContact CD1-CD2 4.37Å; I65-F184 HydrophobicContact CD1-CG 4.4Å; I65-F184 HydrophobicContact CG2-CD1 4.24Å; I65-F184 HydrophobicContact CG2-CE1 4.04Å; I65-F184 HydrophobicContact CG2-CZ 4.19Å; W82-F184 HydrophobicContact CB-CE2 3.89Å; W82-F184 HydrophobicContact CB-CZ 4.16Å; W82-F184 HydrophobicContact CD2-CE2 4.39Å; W82-F184 HydrophobicContact CE3-CE2 4.18Å; W82-F184 HydrophobicContact CG-CE2 4.31Å; Y83-F184 CarbonylContact O-C 3.57Å; Y83-F184 WeakPolarHBondContact O-CA 3.18Å; Y83-F184 WeakPolarHBondContact O-CD2 3.39Å; L84-F184 HydrophobicContact CB-CD2 4.29Å; L84-F184 HydrophobicContact CD1-CB 4.1Å; L84-F184 HydrophobicContact CD1-CD2 4.17Å; L174-F184 HydrophobicContact CD2-CD2 4.18Å; L174-F184 HydrophobicContact CD2-CE2 3.54Å; L174-F184 HydrophobicContact CD2-CZ 4.21Å; F184-V186 HydrophobicContact CD1-CG2 4.05Å; F184-V186 HydrophobicContact CE1-CG2 3.31Å; F184-V186 HydrophobicContact CE2-CG2 4.38Å; F184-V186 HydrophobicContact CZ-CG2 3.51Å; F184-V210 HydrophobicContact CD1-CG1 4.22Å; F184-V210 HydrophobicContact CE1-CG1 4.12Å; F184-V210 HydrophobicContact CE1-CG2 4.49Å
185	I	86.1	Confident	75.7	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.6	-178.7	-54.4	169.7	0	0	0	108.1	Y52 F53 W82 Y83 F96 V101 Y104 L105 I183	Y52-I185 HydrophobicContact CD1-CG2 4.31Å; F53-I185 CarbonylContact O-C 3.52Å; F53-I185 VanDerWaalsContact O-CA 3.3Å; F53-I185 WeakPolarHBondContact O-CA 3.21Å; W82-I185 CarbonylContact C-O 3.49Å; W82-I185 VanDerWaalsContact CA-O 3.26Å; W82-I185 WeakPolarHBondContact CA-O 3.29Å; Y83-I185 PolarHBondContact N-O 3.48Å; Y83-I185 PolarHBondContact O-N 3.33Å; F96-I185 HydrophobicContact CZ-CD1 4.02Å; V101-I185 HydrophobicContact CG1-CD1 4.31Å; V101-I185 HydrophobicContact CG1-CG2 3.78Å; Y104-I185 HydrophobicContact CD1-CD1 4.1Å; Y104-I185 HydrophobicContact CE1-CD1 4.18Å; L105-I185 HydrophobicContact CD1-CG2 4.33Å; L105-I185 HydrophobicContact CD2-CD1 3.89Å; L105-I185 HydrophobicContact CG-CD1 4.35Å; I183-I185 HydrophobicContact CG2-CD1 4.1Å; I183-I185 HydrophobicContact CG2-CG1 3.8Å
186	V	84.8	Confident	73.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.3	173.1	-174.4	0	0	0	0	108.1	Y52 F53 F55 L67 I80 F184 I188 M208	Y52-V186 WeakPolarHBondContact CA-O 3.38Å; F53-V186 PolarHBondContact N-O 3.04Å; F53-V186 PolarHBondContact O-N 3.39Å; F55-V186 HydrophobicContact CE2-CG2 4.45Å; L67-V186 HydrophobicContact CD1-CG2 4.43Å; L67-V186 HydrophobicContact CD2-CG1 4.39Å; L67-V186 HydrophobicContact CD2-CG2 4.42Å; I80-V186 HydrophobicContact CG2-CG1 4.1Å; F184-V186 HydrophobicContact CD1-CG2 4.05Å; F184-V186 HydrophobicContact CE1-CG2 3.31Å; F184-V186 HydrophobicContact CE2-CG2 4.38Å; F184-V186 HydrophobicContact CZ-CG2 3.51Å; V186-I188 HydrophobicContact CG1-CD1 4.47Å; V186-I188 HydrophobicContact CG1-CG1 4.16Å; V186-M208 HydrophobicContact CB-SD 4.25Å; V186-M208 HydrophobicContact CG1-SD 3.95Å; V186-M208 HydrophobicContact CG2-SD 4.42Å
187	H	85.9	Confident	71.1	Confident	36 Å²	36	56.1 Å²	56.1	17%	0.167	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129	172	165	-97.7	0	0	0	110.2	N51 Y52 I80 T81	N51-H187 CarbonylContact O-C 3.55Å; N51-H187 WeakPolarHBondContact O-CA 3.35Å; N51-H187 PolarHBondContact O-CD2 3.44Å; Y52-H187 HydrophobicContact CD1-CB 3.6Å; Y52-H187 AromaticContact CD1-CD2 3.8Å; Y52-H187 HydrophobicContact CE1-CB 3.52Å; Y52-H187 AromaticContact CE1-CD2 3.34Å; Y52-H187 WeakPolarHBondContact CE1-CD2 3.29Å; Y52-H187 AromaticContact CE1-CG 3.56Å; Y52-H187 AromaticContact CE2-CD2 3.65Å; Y52-H187 HydrophobicContact CG-CB 4.49Å; Y52-H187 AromaticContact CZ-CD2 3.27Å; Y52-H187 AromaticContact CZ-CG 3.92Å; Y52-H187 AromaticContact CZ-NE2 3.9Å; I80-H187 WeakPolarHBondContact CA-O 3.46Å; T81-H187 PolarHBondContact N-O 3.09Å; T81-H187 PolarHBondContact O-N 3.41Å; T81-H187 WeakPolarHBondContact OG1-CB 3.43Å; T81-H187 PolarHBondContact OG1-ND1 3.21Å; T81-H187 PolarHBondContact OG1-O 3.5Å
188	I	83.3	Confident	69	Low	8 Å²	8	61.5 Å²	61.5	4%	0.041	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	107.9	-178.4	-61.5	161	0	0	0	107.3	I46 N51 F53 F69 L78 I80 V186 M208	I46-I188 HydrophobicContact CD1-CD1 3.73Å; I46-I188 HydrophobicContact CG1-CD1 4.27Å; N51-I188 PolarHBondContact O-N 3.38Å; F53-I188 HydrophobicContact CD2-CD1 4.1Å; F53-I188 HydrophobicContact CE2-CD1 3.82Å; F69-I188 HydrophobicContact CE1-CD1 4.2Å; L78-I188 HydrophobicContact CD2-CG2 4.4Å; I80-I188 HydrophobicContact CG1-CG1 4.42Å; V186-I188 HydrophobicContact CG1-CD1 4.47Å; V186-I188 HydrophobicContact CG1-CG1 4.16Å; I188-M208 HydrophobicContact CD1-SD 4.18Å
189	G	79.9	Confident	66.8	Low	19 Å²	19	67 Å²	67	20%	0.196	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.2	172	0	0	0	0	0	110.4	N79	N79-G189 PolarHBondContact N-O 3.36Å; N79-G189 PolarHBondContact O-N 3.06Å
190	I	75.8	Confident	64.4	Low	76 Å²	76	70.5 Å²	70.5	39%	0.39	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	116.7	174.3	-52.2	178.3	0	0	0	108.3	L78 L202	L78-I190 HydrophobicContact CD2-CB 4.25Å; L78-I190 HydrophobicContact CD2-CG1 3.69Å; L78-I190 HydrophobicContact CD2-CG2 4.23Å; I190-L202 HydrophobicContact CD1-CD2 4.38Å
191	S	64.6	Low	62.4	Low	56 Å²	56	73.8 Å²	73.8	39%	0.392	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	91.2	170	34.5	0	0	0	0	109.3	S77 S193	S77-S191 PolarHBondContact O-N 3.06Å; S77-S191 VanDerWaalsContact O-N 3.08Å; S77-S191 PolarHBondContact O-OG 2.89Å; S77-S191 WeakPolarHBondContact OG-CB 3.19Å; S77-S191 PolarHBondContact OG-O 3.3Å; S77-S191 PolarHBondContact OG-OG 2.96Å; S191-S193 PolarHBondContact O-N 2.94Å
192	S	54.8	Low	60.7	Low	81 Å²	81	76.4 Å²	76.4	57%	0.566	43%	0.425	S	S	*	.			trans	-77.3	115.3	168.4	179.8	0	0	0	0	109.4	K194	S192-K194 PolarHBondContact OG-O 3.25Å
193	S	42.1	Very low	58.9	Low	105 Å²	105	78.6 Å²	78.6	73%	0.734	44%	0.441	S	S	*	.			trans	-93.9	118	158.5	103.4	0	0	0	0	106.9	S191	S191-S193 PolarHBondContact O-N 2.94Å
194	K	36.8	Very low	57.2	Low	172 Å²	172	85 Å²	85	75%	0.748	48%	0.475	S	S	*	.	S	Bend	trans	100.2	108.7	179.1	-59.5	176	178.8	176.7	0	114.5	S192 S196	S192-K194 PolarHBondContact OG-O 3.25Å; K194-S196 PolarHBondContact O-N 2.87Å; K194-S196 VanDerWaalsContact O-N 3.08Å
195	E	41.6	Very low	56	Low	202 Å²	202	86.7 Å²	86.7	94%	0.944	48%	0.484	S	S	*	.			trans	-41.9	111.4	154.4	-71.8	171.9	143.3	0	0	109.8
196	S	33.7	Very low	55.3	Low	97 Å²	97	87.1 Å²	87.1	68%	0.678	49%	0.486	S	S	*	.			trans	-147.2	129.8	152.8	64	0	0	0	0	109.3	K194 K198	K194-S196 PolarHBondContact O-N 2.87Å; K194-S196 VanDerWaalsContact O-N 3.08Å; S196-K198 VanDerWaalsContact C-N 3.25Å; S196-K198 PolarHBondContact O-N 3.4Å
197	S	35.9	Very low	55.1	Low	126 Å²	126	89.8 Å²	89.8	88%	0.881	50%	0.502	S	S	*	.	S	Bend	trans	-62.7	70.1	-178	40.4	0	0	0	0	113
198	K	39.3	Very low	54.9	Low	154 Å²	154	88.1 Å²	88.1	67%	0.67	49%	0.494	S	S	*	.			trans	-136.4	48.1	168	-74.2	-170.3	179	179.2	0	111.8	S196 N200 S201	S196-K198 VanDerWaalsContact C-N 3.25Å; S196-K198 PolarHBondContact O-N 3.4Å; K198-N200 PolarHBondContact O-N 3.42Å; K198-S201 PolarHBondContact O-OG 3.22Å
199	E	39.5	Very low	54.8	Low	170 Å²	170	87.9 Å²	87.9	79%	0.794	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-63	-23.2	173.6	-90.2	176.7	145.3	0	0	113.4
200	N	37.8	Very low	55	Low	157 Å²	157	87 Å²	87	84%	0.84	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-87.9	-6.3	-175.1	-73.9	-13.8	0	0	0	115.4	K198	K198-N200 PolarHBondContact O-N 3.42Å
201	S	43.1	Very low	55.3	Low	73 Å²	73	84.3 Å²	84.3	51%	0.51	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-106.7	-0.3	-178.5	60.6	0	0	0	0	114.9	K198	K198-S201 PolarHBondContact O-OG 3.22Å
202	L	50.8	Low	56.3	Low	54 Å²	54	82.1 Å²	82.1	28%	0.283	45%	0.454	S	S	.	.	S	Bend	trans	-95.1	-13.4	-173.5	-149.8	133.7	0	0	0	113.5	L76 I190 N204 L205	L76-L202 HydrophobicContact CD1-CD1 3.88Å; I190-L202 HydrophobicContact CD1-CD2 4.38Å; L202-N204 PolarHBondContact O-N 3.46Å; L202-N204 VanDerWaalsContact O-N 3.07Å; L202-L205 PolarHBondContact O-N 2.85Å
203	S	48.3	Very low	57.7	Low	49 Å²	49	82.4 Å²	82.4	34%	0.343	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-7.5	-169.7	51.1	0	0	0	0	115.7
204	N	50.9	Low	59.7	Low	138 Å²	138	78 Å²	78	74%	0.738	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	4.8	-177.4	-69.6	-26.7	0	0	0	114.4	L202 F206	L202-N204 PolarHBondContact O-N 3.46Å; L202-N204 VanDerWaalsContact O-N 3.07Å; N204-F206 PolarHBondContact O-N 3.49Å
205	L	60.7	Low	61.9	Low	44 Å²	44	73.8 Å²	73.8	23%	0.23	41%	0.407	C	S	.	.	S	Bend	trans	-78.9	-18	-168.1	-127.8	108.6	0	0	0	114.1	G71 E72 C74 L202	G71-L205 WeakPolarHBondContact CA-O 3.47Å; E72-L205 HydrophobicContact CB-CD2 3.72Å; E72-L205 HydrophobicContact CB-CG 4.04Å; E72-L205 PolarHBondContact N-O 3.34Å; C74-L205 HydrophobicContact CB-CD2 4.43Å; L202-L205 PolarHBondContact O-N 2.85Å
206	F	72.7	Confident	63.9	Low	13 Å²	13	68.1 Å²	68.1	6%	0.057	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138.2	-174.1	-54.6	-87.4	0	0	0	113.3	I46 C74 L78 C128 F132 N204	I46-F206 HydrophobicContact CD1-CB 3.93Å; I46-F206 PolarHBondContact N-O 3.48Å; I46-F206 VanDerWaalsContact N-O 3.1Å; C74-F206 VanDerWaalsContact SG-CE1 3.53Å; C74-F206 WeakPolarHBondContact SG-CZ 3.39Å; L78-F206 HydrophobicContact CD1-CE1 4.47Å; L78-F206 HydrophobicContact CD1-CZ 4.32Å; C128-F206 HydrophobicContact CB-CE1 3.99Å; C128-F206 HydrophobicContact CB-CZ 4.3Å; C128-F206 VanDerWaalsContact SG-CZ 3.57Å; F132-F206 AromaticContact CE1-CD1 3.74Å; F132-F206 HydrophobicContact CE1-CD1 3.74Å; F132-F206 HydrophobicContact CE1-CE1 4.05Å; F132-F206 AromaticContact CZ-CD1 3.57Å; F132-F206 HydrophobicContact CZ-CD1 3.57Å; F132-F206 AromaticContact CZ-CE1 3.53Å; F132-F206 HydrophobicContact CZ-CE1 3.53Å; N204-F206 PolarHBondContact O-N 3.49Å
207	T	79.6	Confident	66.3	Low	56 Å²	56	66.5 Å²	66.5	34%	0.344	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.1	171.4	56.5	0	0	0	0	109.4	I44 D70	I44-T207 WeakPolarHBondContact O-CA 3.39Å; D70-T207 PolarHBondContact N-O 2.73Å; D70-T207 PolarHBondContact O-N 3.44Å; D70-T207 PolarHBondContact O-OG1 3.22Å; D70-T207 VanDerWaalsContact O-OG1 3.08Å
208	M	81.7	Confident	68.6	Low	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122	171.7	-177.1	-179.9	69.8	0	0	108.4	I44 I46 F53 F55 L67 F69 V186 I188 V210	I44-M208 HydrophobicContact CB-CE 4.49Å; I44-M208 HydrophobicContact CD1-CE 4.03Å; I44-M208 PolarHBondContact N-O 2.9Å; I44-M208 PolarHBondContact O-N 2.89Å; I46-M208 HydrophobicContact CD1-CB 4.21Å; I46-M208 HydrophobicContact CG1-CB 4.31Å; F53-M208 HydrophobicContact CB-CE 3.84Å; F53-M208 HydrophobicContact CD1-CE 4.35Å; F53-M208 HydrophobicContact CD2-CE 4.11Å; F53-M208 HydrophobicContact CG-CE 3.83Å; F55-M208 HydrophobicContact CE2-CE 4.05Å; F55-M208 HydrophobicContact CZ-CE 3.74Å; L67-M208 HydrophobicContact CD1-CG 3.58Å; L67-M208 HydrophobicContact CD1-SD 3.68Å; F69-M208 HydrophobicContact CD1-CB 4.13Å; F69-M208 HydrophobicContact CD1-CG 4.16Å; F69-M208 HydrophobicContact CE1-CB 3.88Å; F69-M208 HydrophobicContact CE1-CG 3.58Å; F69-M208 HydrophobicContact CE1-SD 3.93Å; F69-M208 HydrophobicContact CZ-CG 4.01Å; F69-M208 HydrophobicContact CZ-SD 4.11Å; V186-M208 HydrophobicContact CB-SD 4.25Å; V186-M208 HydrophobicContact CG1-SD 3.95Å; V186-M208 HydrophobicContact CG2-SD 4.42Å; I188-M208 HydrophobicContact CD1-SD 4.18Å; M208-V210 HydrophobicContact CE-CG2 4.07Å; M208-V210 HydrophobicContact CG-CG2 4.29Å; M208-V210 HydrophobicContact SD-CG2 4.41Å
209	T	82.1	Confident	70.6	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.025	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.3	174.8	-59	0	0	0	0	109.5	K41 W42 H43 K68 E211	K41-T209 HydrophobicContact CG-CG2 4.44Å; W42-T209 VanDerWaalsContact O-CA 3.25Å; W42-T209 WeakPolarHBondContact O-CA 3.35Å; H43-T209 VanDerWaalsContact CE1-CG2 3.46Å; H43-T209 WeakPolarHBondContact CE1-CG2 3.29Å; H43-T209 PolarHBondContact CE1-OG1 3.08Å; H43-T209 PolarHBondContact ND1-OG1 2.97Å; K68-T209 PolarHBondContact N-O 3.39Å; K68-T209 PolarHBondContact O-N 2.84Å; T209-E211 HydrophobicContact CG2-CG 4.15Å
210	V	82.8	Confident	72.6	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.9	173.6	-177.9	0	0	0	0	108.1	K41 W42 F55 I65 F66 L67 F184 M208	K41-V210 VanDerWaalsContact CA-O 3.31Å; K41-V210 WeakPolarHBondContact CA-O 3.14Å; W42-V210 HydrophobicContact CE3-CB 3.89Å; W42-V210 HydrophobicContact CE3-CG1 3.88Å; W42-V210 HydrophobicContact CZ3-CG1 4.09Å; W42-V210 PolarHBondContact N-O 3.43Å; W42-V210 PolarHBondContact O-N 3.23Å; F55-V210 HydrophobicContact CE1-CG2 4.33Å; F55-V210 HydrophobicContact CE2-CG2 3.88Å; F55-V210 HydrophobicContact CZ-CB 4.42Å; F55-V210 HydrophobicContact CZ-CG2 3.74Å; I65-V210 HydrophobicContact CG2-CG1 4.25Å; F66-V210 WeakPolarHBondContact O-CA 3.38Å; L67-V210 HydrophobicContact CD1-CG2 3.77Å; F184-V210 HydrophobicContact CD1-CG1 4.22Å; F184-V210 HydrophobicContact CE1-CG1 4.12Å; F184-V210 HydrophobicContact CE1-CG2 4.49Å; M208-V210 HydrophobicContact CE-CG2 4.07Å; M208-V210 HydrophobicContact CG-CG2 4.29Å; M208-V210 HydrophobicContact SD-CG2 4.41Å
211	E	83.4	Confident	74.6	Confident	19 Å²	19	41.1 Å²	41.1	9%	0.089	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124	178.3	-75.7	171	-153.1	0	0	109.5	K41 F66 K68 T209 Y218	K41-E211 HydrophobicContact CB-CG 4.5Å; K41-E211 HydrophobicContact CD-CG 3.86Å; K41-E211 WeakPolarHBondContact CE-OE1 3.48Å; K41-E211 HydrophobicContact CG-CG 3.81Å; F66-E211 HydrophobicContact CB-CB 4.14Å; F66-E211 HydrophobicContact CD2-CB 4.42Å; F66-E211 PolarHBondContact N-O 3.41Å; F66-E211 PolarHBondContact O-N 3.4Å; K68-E211 IonicContact NZ-OE1 2.77Å; K68-E211 PolarHBondContact NZ-OE1 2.95Å; K68-E211 IonicContact NZ-OE2 2.91Å; K68-E211 PolarHBondContact NZ-OE2 3.18Å; T209-E211 HydrophobicContact CG2-CG 4.15Å; E211-Y218 HydrophobicContact CB-CE1 4.34Å; E211-Y218 HydrophobicContact CG-CE1 4.46Å
212	V	85.1	Confident	76.3	Confident	10 Å²	10	40.2 Å²	40.2	6%	0.061	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.9	177.7	176.4	0	0	0	0	108.6	S40 W42 L59 T63 I65 Y218	S40-V212 PolarHBondContact O-N 3.16Å; W42-V212 HydrophobicContact CH2-CG2 4.15Å; W42-V212 HydrophobicContact CZ3-CB 4.34Å; W42-V212 HydrophobicContact CZ3-CG2 3.65Å; L59-V212 HydrophobicContact CD1-CG1 4.14Å; L59-V212 HydrophobicContact CD2-CG1 3.59Å; T63-V212 HydrophobicContact CG2-CG1 3.44Å; T63-V212 VanDerWaalsContact CG2-CG1 3.44Å; I65-V212 HydrophobicContact CG1-CG2 4.26Å; I65-V212 HydrophobicContact CG2-CG2 4.26Å; V212-Y218 WeakPolarHBondContact O-CD1 3.45Å
213	K	84.4	Confident	77.8	Confident	86 Å²	86	38 Å²	38	37%	0.374	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111.5	-177.4	-165.5	177	-176.8	174.2	0	110.6	T64 F66 E217	T64-K213 PolarHBondContact N-O 3.08Å; T64-K213 PolarHBondContact O-N 3.17Å; T64-K213 PolarHBondContact OG1-O 3.17Å; F66-K213 HydrophobicContact CD2-CB 4.48Å; F66-K213 HydrophobicContact CE2-CB 3.97Å; F66-K213 HydrophobicContact CE2-CD 4.5Å; K213-E217 CarbonylContact C-O 3.55Å; K213-E217 WeakPolarHBondContact CA-O 3.45Å
214	G	84.4	Confident	79.7	Confident	14 Å²	14	38.8 Å²	38.8	14%	0.144	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-91.6	-171.8	176.1	0	0	0	0	0	113.6	Y216 E217	G214-Y216 PolarHBondContact O-N 3.4Å; G214-E217 PolarHBondContact N-O 3.19Å; G214-E217 PolarHBondContact O-N 2.96Å
215	P	82.4	Confident	81.5	Confident	83 Å²	83	33.6 Å²	33.6	54%	0.539	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.7	174.9	25.5	-33.3	0	0	0	112.7	F60	F60-P215 HydrophobicContact CB-CG 3.86Å; F60-P215 HydrophobicContact CD1-CG 4.37Å; F60-P215 HydrophobicContact CD2-CG 4.25Å; F60-P215 HydrophobicContact CG-CG 3.93Å
216	Y	82.9	Confident	82.7	Confident	83 Å²	83	32.5 Å²	32.5	33%	0.325	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	40.8	175.3	-59.8	-75.9	0	0	0	111.7	F60 G214 Y218 L219 Y224	F60-Y216 HydrophobicContact CD2-CD2 4.44Å; F60-Y216 HydrophobicContact CE1-CD2 4.03Å; F60-Y216 AromaticContact CE1-CE2 3.91Å; F60-Y216 HydrophobicContact CE1-CE2 3.91Å; F60-Y216 AromaticContact CE2-CD2 3.86Å; F60-Y216 HydrophobicContact CE2-CD2 3.86Å; F60-Y216 AromaticContact CZ-CD2 3.63Å; F60-Y216 HydrophobicContact CZ-CD2 3.63Å; F60-Y216 AromaticContact CZ-CE2 3.92Å; F60-Y216 HydrophobicContact CZ-CE2 3.92Å; G214-Y216 PolarHBondContact O-N 3.4Å; Y216-Y218 PolarHBondContact O-N 2.87Å; Y216-L219 WeakPolarHBondContact O-CB 3.4Å; Y216-L219 PolarHBondContact O-N 3.02Å; Y216-Y224 HydrophobicContact CD1-CD2 4.38Å; Y216-Y224 AromaticContact CD1-CE2 3.74Å; Y216-Y224 HydrophobicContact CD1-CE2 3.74Å; Y216-Y224 HydrophobicContact CD2-CD2 4.03Å; Y216-Y224 AromaticContact CD2-CE2 3.97Å; Y216-Y224 HydrophobicContact CD2-CE2 3.97Å; Y216-Y224 AromaticContact CE1-CE2 3.7Å; Y216-Y224 HydrophobicContact CE1-CE2 3.7Å; Y216-Y224 HydrophobicContact CE2-CD2 4.31Å; Y216-Y224 AromaticContact CE2-CE2 3.94Å; Y216-Y224 HydrophobicContact CE2-CE2 3.94Å; Y216-Y224 HydrophobicContact CG-CD2 4.06Å; Y216-Y224 AromaticContact CG-CE2 3.87Å; Y216-Y224 HydrophobicContact CG-CE2 3.87Å; Y216-Y224 AromaticContact CZ-CE2 3.81Å; Y216-Y224 AromaticContact CZ-CZ 3.84Å
217	E	85.6	Confident	83.4	Confident	62 Å²	62	32.4 Å²	32.4	29%	0.29	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	61.5	-126.8	-178.1	-57.3	172.3	177.8	0	0	111.9	K213 G214 L219 R284 Y285	K213-E217 CarbonylContact C-O 3.55Å; K213-E217 WeakPolarHBondContact CA-O 3.45Å; G214-E217 PolarHBondContact N-O 3.19Å; G214-E217 PolarHBondContact O-N 2.96Å; E217-L219 VanDerWaalsContact C-N 3.26Å; E217-L219 PolarHBondContact O-N 3.31Å; E217-R284 HydrophobicContact CB-CG 4.45Å; E217-R284 VanDerWaalsContact CB-O 3.25Å; E217-R284 WeakPolarHBondContact CB-O 3.42Å; E217-R284 VanDerWaalsContact OE2-O 3.14Å; E217-Y285 WeakPolarHBondContact OE2-CA 3.38Å; E217-Y285 WeakPolarHBondContact OE2-CD1 3.41Å
218	Y	82.9	Confident	84	Confident	38 Å²	38	32.8 Å²	32.8	15%	0.149	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.7	-178.2	-64.7	-78	0	0	0	113.2	S40 E211 V212 Y216 I283 R284 G287	S40-Y218 WeakPolarHBondContact CB-O 3.38Å; S40-Y218 PolarHBondContact OG-O 2.91Å; E211-Y218 HydrophobicContact CB-CE1 4.34Å; E211-Y218 HydrophobicContact CG-CE1 4.46Å; V212-Y218 WeakPolarHBondContact O-CD1 3.45Å; Y216-Y218 PolarHBondContact O-N 2.87Å; Y218-I283 WeakPolarHBondContact CB-O 3.43Å; Y218-R284 PolarHBondContact N-O 3.34Å; Y218-G287 VanDerWaalsContact CB-CA 3.42Å; Y218-G287 VanDerWaalsContact CG-CA 3.44Å
219	L	82.2	Confident	84.5	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.016	17%	0.168	C	C	.	.			trans	-81.1	137.8	-177.4	-165.3	63.6	0	0	0	111.5	Y216 E217 D223 Y224 M227 F280 R284	Y216-L219 WeakPolarHBondContact O-CB 3.4Å; Y216-L219 PolarHBondContact O-N 3.02Å; E217-L219 VanDerWaalsContact C-N 3.26Å; E217-L219 PolarHBondContact O-N 3.31Å; L219-D223 HydrophobicContact CD1-CB 3.51Å; L219-D223 HydrophobicContact CG-CB 4.23Å; L219-Y224 HydrophobicContact CD2-CD2 3.94Å; L219-M227 HydrophobicContact CD2-CE 3.78Å; L219-M227 HydrophobicContact CD2-SD 3.71Å; L219-F280 HydrophobicContact CD1-CD1 4.47Å; L219-R284 HydrophobicContact CB-CB 4.37Å; L219-R284 HydrophobicContact CB-CG 4.35Å
220	T	80.1	Confident	84.9	Confident	6 Å²	6	33.8 Å²	33.8	4%	0.037	17%	0.167	C	C	.	.			trans	-98.6	167.4	-177	74.2	0	0	0	0	113	K57 L59 E222 D223 Y224	K57-T220 HydrophobicContact CD-CG2 3.59Å; K57-T220 HydrophobicContact CG-CG2 4.09Å; K57-T220 VanDerWaalsContact NZ-CG2 3.26Å; L59-T220 HydrophobicContact CD2-CG2 4.39Å; T220-E222 PolarHBondContact O-N 2.95Å; T220-D223 PolarHBondContact O-N 3.36Å; T220-D223 PolarHBondContact OG1-OD2 3.41Å; T220-Y224 WeakPolarHBondContact O-CB 3.38Å; T220-Y224 PolarHBondContact O-N 2.89Å
221	L	81.5	Confident	85.4	Confident	28 Å²	28	37.2 Å²	37.2	15%	0.147	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-25.1	-172.4	178.4	58.3	0	0	0	112.3	I58 F60 D179 P225 W435	I58-L221 HydrophobicContact CG2-CB 4.07Å; I58-L221 HydrophobicContact CG2-CD2 4.14Å; I58-L221 HydrophobicContact CG2-CG 4.28Å; I58-L221 PolarHBondContact O-N 3.17Å; F60-L221 HydrophobicContact CD1-CB 4.24Å; F60-L221 HydrophobicContact CD1-CD1 3.67Å; F60-L221 HydrophobicContact CD1-CD2 4.42Å; F60-L221 HydrophobicContact CD1-CG 4.32Å; F60-L221 HydrophobicContact CD2-CB 3.99Å; F60-L221 HydrophobicContact CE1-CB 4.16Å; F60-L221 HydrophobicContact CE1-CD1 3.17Å; F60-L221 HydrophobicContact CE1-CG 4.15Å; F60-L221 VanDerWaalsContact CE2-CA 3.5Å; F60-L221 HydrophobicContact CE2-CB 3.87Å; F60-L221 HydrophobicContact CE2-CD1 4.36Å; F60-L221 HydrophobicContact CG-CB 4.17Å; F60-L221 HydrophobicContact CG-CD1 4.45Å; F60-L221 HydrophobicContact CZ-CB 3.95Å; F60-L221 HydrophobicContact CZ-CD1 3.56Å; F60-L221 HydrophobicContact CZ-CG 4.33Å; D179-L221 HydrophobicContact CB-CD2 3.88Å; L221-P225 WeakPolarHBondContact O-CD 3.46Å; L221-W435 HydrophobicContact CD2-CH2 3.49Å; L221-W435 VanDerWaalsContact CD2-CH2 3.49Å; L221-W435 HydrophobicContact CD2-CZ3 3.38Å; L221-W435 HydrophobicContact CG-CZ3 3.96Å
222	E	77.9	Confident	86	Confident	53 Å²	53	39.7 Å²	39.7	25%	0.248	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-44.5	172.7	-174	171.1	-179.7	0	0	112.2	I58 T220 P225	I58-E222 HydrophobicContact CB-CB 4.49Å; I58-E222 HydrophobicContact CD1-CB 4.27Å; T220-E222 PolarHBondContact O-N 2.95Å; E222-P225 WeakPolarHBondContact O-CD 3.46Å; E222-P225 WeakPolarHBondContact O-CG 3.29Å
223	D	82.6	Confident	86.3	Confident	9 Å²	9	40 Å²	40	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-74.9	-27.1	-176.9	-59.8	-47	0	0	0	113.1	A37 L219 T220 L226 M227 F280	A37-D223 WeakPolarHBondContact CA-OD1 3.22Å; A37-D223 HydrophobicContact CB-CB 4.49Å; A37-D223 VanDerWaalsContact CB-OD1 3.27Å; A37-D223 WeakPolarHBondContact CB-OD1 3.49Å; L219-D223 HydrophobicContact CD1-CB 3.51Å; L219-D223 HydrophobicContact CG-CB 4.23Å; T220-D223 PolarHBondContact O-N 3.36Å; T220-D223 PolarHBondContact OG1-OD2 3.41Å; D223-L226 WeakPolarHBondContact O-CB 3.33Å; D223-L226 PolarHBondContact O-N 2.85Å; D223-M227 PolarHBondContact O-N 3.32Å; D223-F280 HydrophobicContact CB-CD1 4.28Å; D223-F280 HydrophobicContact CB-CE1 3.99Å
224	Y	86.9	Confident	86.8	Confident	64 Å²	64	37.1 Å²	37.1	25%	0.251	19%	0.192	S	C	.	.	H	α-helix	trans	-56.7	-55.5	-176.4	-177.6	-97.8	0	0	0	114.5	F60 Y216 L219 T220 L226 M227 I228	F60-Y224 HydrophobicContact CZ-CD1 4.46Å; F60-Y224 HydrophobicContact CZ-CD2 4.41Å; F60-Y224 HydrophobicContact CZ-CG 4.01Å; Y216-Y224 HydrophobicContact CD1-CD2 4.38Å; Y216-Y224 AromaticContact CD1-CE2 3.74Å; Y216-Y224 HydrophobicContact CD1-CE2 3.74Å; Y216-Y224 HydrophobicContact CD2-CD2 4.03Å; Y216-Y224 AromaticContact CD2-CE2 3.97Å; Y216-Y224 HydrophobicContact CD2-CE2 3.97Å; Y216-Y224 AromaticContact CE1-CE2 3.7Å; Y216-Y224 HydrophobicContact CE1-CE2 3.7Å; Y216-Y224 HydrophobicContact CE2-CD2 4.31Å; Y216-Y224 AromaticContact CE2-CE2 3.94Å; Y216-Y224 HydrophobicContact CE2-CE2 3.94Å; Y216-Y224 HydrophobicContact CG-CD2 4.06Å; Y216-Y224 AromaticContact CG-CE2 3.87Å; Y216-Y224 HydrophobicContact CG-CE2 3.87Å; Y216-Y224 AromaticContact CZ-CE2 3.81Å; Y216-Y224 AromaticContact CZ-CZ 3.84Å; L219-Y224 HydrophobicContact CD2-CD2 3.94Å; T220-Y224 WeakPolarHBondContact O-CB 3.38Å; T220-Y224 PolarHBondContact O-N 2.89Å; Y224-L226 PolarHBondContact O-N 2.91Å; Y224-M227 HydrophobicContact CD2-CE 4.36Å; Y224-M227 HydrophobicContact CE2-CE 4.39Å; Y224-M227 PolarHBondContact O-N 3.2Å; Y224-I228 HydrophobicContact CD1-CD1 4.05Å; Y224-I228 HydrophobicContact CE1-CD1 3.49Å; Y224-I228 VanDerWaalsContact CE1-CD1 3.49Å; Y224-I228 HydrophobicContact CE2-CD1 4.43Å; Y224-I228 PolarHBondContact O-N 2.93Å
225	P	89.3	Confident	87.4	Confident	30 Å²	30	40.9 Å²	40.9	20%	0.195	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-32.9	176.8	25.8	-35	0	0	0	112.1	L221 E222 I228 F229 W439	L221-P225 WeakPolarHBondContact O-CD 3.46Å; E222-P225 WeakPolarHBondContact O-CD 3.46Å; E222-P225 WeakPolarHBondContact O-CG 3.29Å; P225-I228 PolarHBondContact O-N 3.5Å; P225-F229 WeakPolarHBondContact O-CB 3.34Å; P225-F229 PolarHBondContact O-N 2.94Å; P225-W439 HydrophobicContact CB-CD2 3.82Å; P225-W439 HydrophobicContact CB-CE3 4.41Å; P225-W439 HydrophobicContact CB-CG 3.92Å; P225-W439 HydrophobicContact CB-CZ2 4.38Å; P225-W439 HydrophobicContact CG-CB 4.1Å; P225-W439 VanDerWaalsContact CG-CD1 3.48Å; P225-W439 HydrophobicContact CG-CD2 4.08Å; P225-W439 HydrophobicContact CG-CG 3.61Å
226	L	85.4	Confident	88	Confident	20 Å²	20	39 Å²	39	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-43.1	179.6	-168.2	59.7	0	0	0	111.4	D223 Y224 I228 F229 F230 F280	D223-L226 WeakPolarHBondContact O-CB 3.33Å; D223-L226 PolarHBondContact O-N 2.85Å; Y224-L226 PolarHBondContact O-N 2.91Å; L226-I228 VanDerWaalsContact C-N 3.32Å; L226-I228 PolarHBondContact O-N 3.42Å; L226-F229 HydrophobicContact CD1-CD1 4.3Å; L226-F229 WeakPolarHBondContact O-CB 3.46Å; L226-F229 PolarHBondContact O-N 3.39Å; L226-F229 VanDerWaalsContact O-N 3.16Å; L226-F230 HydrophobicContact CD1-CD2 4.02Å; L226-F230 HydrophobicContact CD1-CE2 3.62Å; L226-F230 HydrophobicContact CD2-CE2 4.15Å; L226-F230 HydrophobicContact CG-CD2 3.84Å; L226-F230 HydrophobicContact CG-CE2 3.61Å; L226-F230 WeakPolarHBondContact O-CD2 3.32Å; L226-F230 PolarHBondContact O-N 3.02Å; L226-F280 HydrophobicContact CB-CZ 4.34Å; L226-F280 HydrophobicContact CD2-CE1 4.28Å; L226-F280 HydrophobicContact CD2-CE2 4.42Å; L226-F280 HydrophobicContact CD2-CZ 3.59Å; L226-F280 HydrophobicContact CG-CE2 4.32Å; L226-F280 HydrophobicContact CG-CZ 3.83Å
227	M	88.6	Confident	88.6	Confident	11 Å²	11	35.2 Å²	35.2	5%	0.054	18%	0.18	C	C	.	.	H	α-helix	trans	-55.7	-45.7	172.8	179.6	-169.7	68	0	0	111.7	L219 D223 Y224 F230 M231 Y277 F280	L219-M227 HydrophobicContact CD2-CE 3.78Å; L219-M227 HydrophobicContact CD2-SD 3.71Å; D223-M227 PolarHBondContact O-N 3.32Å; Y224-M227 HydrophobicContact CD2-CE 4.36Å; Y224-M227 HydrophobicContact CE2-CE 4.39Å; Y224-M227 PolarHBondContact O-N 3.2Å; M227-F230 PolarHBondContact O-N 3.34Å; M227-M231 PolarHBondContact O-N 3.47Å; M227-Y277 HydrophobicContact CG-CD2 4.41Å; M227-Y277 HydrophobicContact CG-CE2 4.3Å; M227-F280 HydrophobicContact CB-CB 3.98Å; M227-F280 HydrophobicContact CB-CD1 4.26Å; M227-F280 HydrophobicContact CB-CG 4.05Å; M227-F280 HydrophobicContact CG-CB 3.77Å; M227-F280 HydrophobicContact CG-CG 4.37Å; M227-F280 HydrophobicContact SD-CB 4.46Å
228	I	91.7	Very high	89.1	Confident	64 Å²	64	35.2 Å²	35.2	33%	0.328	18%	0.184	S	C	.	.	H	α-helix	trans	-64	-43.6	177.8	-63.4	169.7	0	0	0	110.4	Y224 P225 L226 F230 M231 V232	Y224-I228 HydrophobicContact CD1-CD1 4.05Å; Y224-I228 HydrophobicContact CE1-CD1 3.49Å; Y224-I228 VanDerWaalsContact CE1-CD1 3.49Å; Y224-I228 HydrophobicContact CE2-CD1 4.43Å; Y224-I228 PolarHBondContact O-N 2.93Å; P225-I228 PolarHBondContact O-N 3.5Å; L226-I228 VanDerWaalsContact C-N 3.32Å; L226-I228 PolarHBondContact O-N 3.42Å; I228-F230 PolarHBondContact O-N 3.31Å; I228-M231 WeakPolarHBondContact O-CB 3.28Å; I228-M231 PolarHBondContact O-N 3.03Å; I228-V232 HydrophobicContact CG2-CG2 4.39Å; I228-V232 WeakPolarHBondContact O-CG2 3.34Å; I228-V232 PolarHBondContact O-N 3.05Å
229	F	92	Very high	89.8	Confident	24 Å²	24	38 Å²	38	11%	0.105	20%	0.201	C	C	.	.	H	α-helix	trans	-58.3	-46.6	176.1	172.1	-95.8	0	0	0	112.1	P225 L226 M231 V232 M233 W439 A443 R446	P225-F229 WeakPolarHBondContact O-CB 3.34Å; P225-F229 PolarHBondContact O-N 2.94Å; L226-F229 HydrophobicContact CD1-CD1 4.3Å; L226-F229 WeakPolarHBondContact O-CB 3.46Å; L226-F229 PolarHBondContact O-N 3.39Å; L226-F229 VanDerWaalsContact O-N 3.16Å; F229-M231 VanDerWaalsContact C-N 3.33Å; F229-M231 PolarHBondContact O-N 3.29Å; F229-V232 PolarHBondContact O-N 3.08Å; F229-M233 HydrophobicContact CD1-CG 4.32Å; F229-M233 HydrophobicContact CD2-CE 4.22Å; F229-M233 HydrophobicContact CD2-CG 4.21Å; F229-M233 HydrophobicContact CE1-CG 3.92Å; F229-M233 HydrophobicContact CE2-CE 3.3Å; F229-M233 HydrophobicContact CE2-CG 3.83Å; F229-M233 HydrophobicContact CE2-SD 4.41Å; F229-M233 HydrophobicContact CG-CG 4.45Å; F229-M233 HydrophobicContact CZ-CE 3.61Å; F229-M233 HydrophobicContact CZ-CG 3.67Å; F229-M233 HydrophobicContact CZ-SD 4.36Å; F229-M233 WeakPolarHBondContact O-CB 3.43Å; F229-M233 VanDerWaalsContact O-CG 3.3Å; F229-M233 WeakPolarHBondContact O-CG 3.31Å; F229-M233 PolarHBondContact O-N 2.88Å; F229-W439 HydrophobicContact CB-CZ3 4.43Å; F229-W439 HydrophobicContact CD2-CZ3 4.44Å; F229-A443 HydrophobicContact CD1-CB 4.13Å; F229-A443 HydrophobicContact CD2-CB 3.93Å; F229-A443 HydrophobicContact CE1-CB 3.96Å; F229-A443 HydrophobicContact CE2-CB 3.73Å; F229-A443 HydrophobicContact CG-CB 4.11Å; F229-A443 HydrophobicContact CZ-CB 3.75Å; F229-A443 VanDerWaalsContact CZ-O 3.29Å; F229-A443 WeakPolarHBondContact CZ-O 3.37Å; F229-R446 HydrophobicContact CE1-CB 4.05Å; F229-R446 HydrophobicContact CZ-CB 4.01Å
230	F	91.3	Very high	90.4	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-38.1	176.8	-84.2	-77	0	0	0	112.5	L226 M227 I228 C234 K273 F276 F280	L226-F230 HydrophobicContact CD1-CD2 4.02Å; L226-F230 HydrophobicContact CD1-CE2 3.62Å; L226-F230 HydrophobicContact CD2-CE2 4.15Å; L226-F230 HydrophobicContact CG-CD2 3.84Å; L226-F230 HydrophobicContact CG-CE2 3.61Å; L226-F230 WeakPolarHBondContact O-CD2 3.32Å; L226-F230 PolarHBondContact O-N 3.02Å; M227-F230 PolarHBondContact O-N 3.34Å; I228-F230 PolarHBondContact O-N 3.31Å; F230-C234 VanDerWaalsContact O-CB 3.26Å; F230-C234 WeakPolarHBondContact O-CB 3.32Å; F230-C234 PolarHBondContact O-N 3.45Å; F230-K273 HydrophobicContact CD1-CD 3.57Å; F230-K273 HydrophobicContact CE1-CD 3.81Å; F230-F276 HydrophobicContact CD1-CB 3.57Å; F230-F276 HydrophobicContact CD1-CD2 4.27Å; F230-F276 HydrophobicContact CD1-CG 4.17Å; F230-F276 HydrophobicContact CE1-CB 3.56Å; F230-F276 HydrophobicContact CE1-CD1 4.47Å; F230-F276 AromaticContact CE1-CD2 3.51Å; F230-F276 HydrophobicContact CE1-CD2 3.51Å; F230-F276 HydrophobicContact CE1-CE2 4.32Å; F230-F276 AromaticContact CE1-CG 3.61Å; F230-F276 HydrophobicContact CE1-CG 3.61Å; F230-F276 HydrophobicContact CG-CB 4.1Å; F230-F276 HydrophobicContact CZ-CB 4.07Å; F230-F276 HydrophobicContact CZ-CD1 4.36Å; F230-F276 HydrophobicContact CZ-CD2 4.07Å; F230-F276 AromaticContact CZ-CG 3.92Å; F230-F276 HydrophobicContact CZ-CG 3.92Å; F230-F280 HydrophobicContact CD2-CD2 4.08Å; F230-F280 AromaticContact CD2-CE2 3.48Å; F230-F280 HydrophobicContact CD2-CE2 3.48Å; F230-F280 VanDerWaalsContact CD2-CE2 3.48Å; F230-F280 HydrophobicContact CD2-CZ 4.32Å; F230-F280 AromaticContact CE2-CE2 3.64Å; F230-F280 HydrophobicContact CE2-CE2 3.64Å; F230-F280 HydrophobicContact CE2-CZ 4.25Å; F230-F280 HydrophobicContact CG-CE2 4.34Å
231	M	92.8	Very high	91.1	Very high	73 Å²	73	38.9 Å²	38.9	36%	0.36	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-51.1	174.3	-172.8	-163.2	75.2	0	0	111.8	M227 I228 F229 M233 C234 I235 Y277	M227-M231 PolarHBondContact O-N 3.47Å; I228-M231 WeakPolarHBondContact O-CB 3.28Å; I228-M231 PolarHBondContact O-N 3.03Å; F229-M231 VanDerWaalsContact C-N 3.33Å; F229-M231 PolarHBondContact O-N 3.29Å; M231-M233 PolarHBondContact O-N 3.08Å; M231-C234 WeakPolarHBondContact O-CB 3.34Å; M231-C234 PolarHBondContact O-N 2.73Å; M231-I235 WeakPolarHBondContact O-CG1 3.48Å; M231-I235 PolarHBondContact O-N 2.98Å; M231-I235 VanDerWaalsContact O-N 3.12Å; M231-Y277 HydrophobicContact CB-CD2 3.87Å; M231-Y277 HydrophobicContact CB-CE2 3.68Å; M231-Y277 HydrophobicContact CG-CD2 4.41Å; M231-Y277 HydrophobicContact CG-CE2 3.86Å
232	V	95.4	Very high	91.8	Very high	71 Å²	71	41.8 Å²	41.8	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-61.9	-45.2	179.4	173.1	0	0	0	0	110.6	I228 F229 C234 I235 V236	I228-V232 HydrophobicContact CG2-CG2 4.39Å; I228-V232 WeakPolarHBondContact O-CG2 3.34Å; I228-V232 PolarHBondContact O-N 3.05Å; F229-V232 PolarHBondContact O-N 3.08Å; V232-C234 VanDerWaalsContact C-N 3.32Å; V232-C234 PolarHBondContact O-N 3.45Å; V232-I235 PolarHBondContact O-N 3.29Å; V232-V236 WeakPolarHBondContact O-CG2 3.39Å; V232-V236 PolarHBondContact O-N 3.3Å
233	M	92.4	Very high	92.5	Very high	18 Å²	18	43.1 Å²	43.1	9%	0.089	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-37.9	176.8	-73.7	-65.2	175.8	0	0	112	F229 M231 I235 V236 Y237 K273 L447	F229-M233 HydrophobicContact CD1-CG 4.32Å; F229-M233 HydrophobicContact CD2-CE 4.22Å; F229-M233 HydrophobicContact CD2-CG 4.21Å; F229-M233 HydrophobicContact CE1-CG 3.92Å; F229-M233 HydrophobicContact CE2-CE 3.3Å; F229-M233 HydrophobicContact CE2-CG 3.83Å; F229-M233 HydrophobicContact CE2-SD 4.41Å; F229-M233 HydrophobicContact CG-CG 4.45Å; F229-M233 HydrophobicContact CZ-CE 3.61Å; F229-M233 HydrophobicContact CZ-CG 3.67Å; F229-M233 HydrophobicContact CZ-SD 4.36Å; F229-M233 WeakPolarHBondContact O-CB 3.43Å; F229-M233 VanDerWaalsContact O-CG 3.3Å; F229-M233 WeakPolarHBondContact O-CG 3.31Å; F229-M233 PolarHBondContact O-N 2.88Å; M231-M233 PolarHBondContact O-N 3.08Å; M233-I235 VanDerWaalsContact C-N 3.33Å; M233-I235 PolarHBondContact O-N 2.9Å; M233-V236 PolarHBondContact O-N 3.37Å; M233-Y237 VanDerWaalsContact O-CD2 3.29Å; M233-Y237 WeakPolarHBondContact O-CD2 3.33Å; M233-Y237 PolarHBondContact O-N 3.46Å; M233-K273 HydrophobicContact CB-CD 4.32Å; M233-K273 HydrophobicContact CB-CG 4.38Å; M233-L447 HydrophobicContact CE-CB 3.92Å; M233-L447 HydrophobicContact CE-CD1 3.84Å; M233-L447 HydrophobicContact CE-CG 3.88Å
234	C	95.1	Very high	93.1	Very high	25 Å²	25	43 Å²	43	17%	0.169	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-47	173.9	-170.7	0	0	0	0	111.2	F230 M231 V232 V236 Y237 V238 K273	F230-C234 VanDerWaalsContact O-CB 3.26Å; F230-C234 WeakPolarHBondContact O-CB 3.32Å; F230-C234 PolarHBondContact O-N 3.45Å; M231-C234 WeakPolarHBondContact O-CB 3.34Å; M231-C234 PolarHBondContact O-N 2.73Å; V232-C234 VanDerWaalsContact C-N 3.32Å; V232-C234 PolarHBondContact O-N 3.45Å; C234-V236 VanDerWaalsContact C-N 3.35Å; C234-V236 PolarHBondContact O-N 2.95Å; C234-Y237 PolarHBondContact O-N 2.92Å; C234-V238 WeakPolarHBondContact O-CG2 3.21Å; C234-V238 PolarHBondContact O-N 2.9Å; C234-K273 HydrophobicContact CB-CB 3.92Å
235	I	95.9	Very high	93.4	Very high	93 Å²	93	45.6 Å²	45.6	48%	0.477	25%	0.25	S	C	.	.	H	α-helix	trans	-59.9	-44.9	175.9	-63	166.6	0	0	0	110.9	M231 V232 M233 Y237 V238 L239	M231-I235 WeakPolarHBondContact O-CG1 3.48Å; M231-I235 PolarHBondContact O-N 2.98Å; M231-I235 VanDerWaalsContact O-N 3.12Å; V232-I235 PolarHBondContact O-N 3.29Å; M233-I235 VanDerWaalsContact C-N 3.33Å; M233-I235 PolarHBondContact O-N 2.9Å; I235-Y237 VanDerWaalsContact C-N 3.32Å; I235-Y237 PolarHBondContact O-N 3.41Å; I235-V238 WeakPolarHBondContact O-CB 3.23Å; I235-V238 PolarHBondContact O-N 3.19Å; I235-L239 HydrophobicContact CG2-CD1 4.47Å; I235-L239 WeakPolarHBondContact O-CG 3.48Å; I235-L239 PolarHBondContact O-N 2.98Å
236	V	96.2	Very high	93.5	Very high	43 Å²	43	46.6 Å²	46.6	26%	0.261	26%	0.26	S	S	.	.	H	α-helix	trans	-59.1	-42.5	176.6	172.1	0	0	0	0	111.5	V232 M233 C234 L239 F240	V232-V236 WeakPolarHBondContact O-CG2 3.39Å; V232-V236 PolarHBondContact O-N 3.3Å; M233-V236 PolarHBondContact O-N 3.37Å; C234-V236 VanDerWaalsContact C-N 3.35Å; C234-V236 PolarHBondContact O-N 2.95Å; V236-L239 WeakPolarHBondContact O-CB 3.26Å; V236-L239 PolarHBondContact O-N 3.35Å; V236-F240 HydrophobicContact CG1-CD1 4.35Å; V236-F240 HydrophobicContact CG1-CD2 4.39Å; V236-F240 HydrophobicContact CG1-CE1 3.8Å; V236-F240 HydrophobicContact CG1-CE2 3.88Å; V236-F240 HydrophobicContact CG1-CZ 3.54Å; V236-F240 WeakPolarHBondContact O-CD1 3.42Å; V236-F240 WeakPolarHBondContact O-CG 3.45Å; V236-F240 PolarHBondContact O-N 3.34Å
237	Y	95.5	Very high	93.7	Very high	3 Å²	3	49.8 Å²	49.8	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-69.5	-33.6	177.2	-89.5	-100.1	0	0	0	113	M233 C234 I235 L239 F240 G241 K273 F449 L453	M233-Y237 VanDerWaalsContact O-CD2 3.29Å; M233-Y237 WeakPolarHBondContact O-CD2 3.33Å; M233-Y237 PolarHBondContact O-N 3.46Å; C234-Y237 PolarHBondContact O-N 2.92Å; I235-Y237 VanDerWaalsContact C-N 3.32Å; I235-Y237 PolarHBondContact O-N 3.41Å; Y237-L239 VanDerWaalsContact C-N 3.34Å; Y237-F240 PolarHBondContact O-N 2.98Å; Y237-G241 PolarHBondContact O-N 3.26Å; Y237-K273 HydrophobicContact CD2-CG 4.4Å; Y237-F449 WeakPolarHBondContact OH-CD1 2.65Å; Y237-L453 HydrophobicContact CE1-CD2 4.09Å
238	V	96.1	Very high	93.7	Very high	62 Å²	62	49.9 Å²	49.9	38%	0.376	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-44.6	170.3	170.7	0	0	0	0	110	C234 I235 F240 G241 V242 M270	C234-V238 WeakPolarHBondContact O-CG2 3.21Å; C234-V238 PolarHBondContact O-N 2.9Å; I235-V238 WeakPolarHBondContact O-CB 3.23Å; I235-V238 PolarHBondContact O-N 3.19Å; V238-F240 PolarHBondContact O-N 3.22Å; V238-G241 PolarHBondContact O-N 2.68Å; V238-V242 HydrophobicContact CG1-CG2 4.4Å; V238-V242 WeakPolarHBondContact O-CG2 3.32Å; V238-V242 PolarHBondContact O-N 3.45Å; V238-M270 HydrophobicContact CG2-CG 4.32Å; V238-M270 HydrophobicContact CG2-SD 3.88Å
239	L	96.1	Very high	93.6	Very high	98 Å²	98	50.1 Å²	50.1	51%	0.513	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-43.7	175.2	-66.9	174.8	0	0	0	111.7	I235 V236 Y237 G241 V242 L243	I235-L239 HydrophobicContact CG2-CD1 4.47Å; I235-L239 WeakPolarHBondContact O-CG 3.48Å; I235-L239 PolarHBondContact O-N 2.98Å; V236-L239 WeakPolarHBondContact O-CB 3.26Å; V236-L239 PolarHBondContact O-N 3.35Å; Y237-L239 VanDerWaalsContact C-N 3.34Å; L239-G241 VanDerWaalsContact C-N 3.33Å; L239-G241 PolarHBondContact O-N 2.93Å; L239-V242 PolarHBondContact O-N 2.93Å; L239-L243 VanDerWaalsContact O-CB 3.3Å; L239-L243 WeakPolarHBondContact O-CB 3.22Å; L239-L243 WeakPolarHBondContact O-CG 3.43Å; L239-L243 PolarHBondContact O-N 3.27Å
240	F	95.7	Very high	93.5	Very high	19 Å²	19	53.8 Å²	53.8	8%	0.083	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-43.8	173.9	-68.8	-6.4	0	0	0	111.8	V236 Y237 V238 W244 I266 L453 F454 M457	V236-F240 HydrophobicContact CG1-CD1 4.35Å; V236-F240 HydrophobicContact CG1-CD2 4.39Å; V236-F240 HydrophobicContact CG1-CE1 3.8Å; V236-F240 HydrophobicContact CG1-CE2 3.88Å; V236-F240 HydrophobicContact CG1-CZ 3.54Å; V236-F240 WeakPolarHBondContact O-CD1 3.42Å; V236-F240 WeakPolarHBondContact O-CG 3.45Å; V236-F240 PolarHBondContact O-N 3.34Å; Y237-F240 PolarHBondContact O-N 2.98Å; V238-F240 PolarHBondContact O-N 3.22Å; F240-W244 WeakPolarHBondContact O-CB 3.38Å; F240-W244 PolarHBondContact O-N 3.45Å; F240-I266 HydrophobicContact CB-CG2 4.07Å; F240-L453 HydrophobicContact CD2-CD2 3.59Å; F240-L453 HydrophobicContact CE2-CD2 3.94Å; F240-F454 HydrophobicContact CD1-CD2 4.26Å; F240-F454 HydrophobicContact CE1-CB 4.4Å; F240-F454 AromaticContact CE1-CD2 3.45Å; F240-F454 HydrophobicContact CE1-CD2 3.45Å; F240-F454 VanDerWaalsContact CE1-CD2 3.45Å; F240-F454 HydrophobicContact CE1-CE2 4.14Å; F240-F454 HydrophobicContact CE1-CG 4.29Å; F240-F454 HydrophobicContact CE2-CB 4.21Å; F240-F454 HydrophobicContact CZ-CB 3.75Å; F240-F454 AromaticContact CZ-CD2 3.69Å; F240-F454 HydrophobicContact CZ-CD2 3.69Å; F240-F454 HydrophobicContact CZ-CG 4.07Å; F240-M457 HydrophobicContact CB-SD 4.47Å
241	G	95.1	Very high	93.1	Very high	7 Å²	7	58 Å²	58	7%	0.072	33%	0.329	C	S	.	.	H	α-helix	trans	-60	-50.7	176.7	0	0	0	0	0	112.1	Y237 V238 L239 W244 L245	Y237-G241 PolarHBondContact O-N 3.26Å; V238-G241 PolarHBondContact O-N 2.68Å; L239-G241 VanDerWaalsContact C-N 3.33Å; L239-G241 PolarHBondContact O-N 2.93Å; G241-W244 PolarHBondContact O-N 3.15Å; G241-L245 VanDerWaalsContact O-CB 3.25Å; G241-L245 WeakPolarHBondContact O-CB 2.98Å; G241-L245 WeakPolarHBondContact O-CG 3.37Å; G241-L245 PolarHBondContact O-N 2.95Å
242	V	95.6	Very high	92.7	Very high	90 Å²	90	63.6 Å²	63.6	55%	0.545	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-47	179.6	173.1	0	0	0	0	111.4	V238 L239 W244 L245 A246	V238-V242 HydrophobicContact CG1-CG2 4.4Å; V238-V242 WeakPolarHBondContact O-CG2 3.32Å; V238-V242 PolarHBondContact O-N 3.45Å; L239-V242 PolarHBondContact O-N 2.93Å; V242-W244 PolarHBondContact O-N 2.81Å; V242-L245 PolarHBondContact O-N 3.48Å; V242-A246 VanDerWaalsContact O-CB 3.3Å; V242-A246 WeakPolarHBondContact O-CB 3.19Å; V242-A246 PolarHBondContact O-N 3.35Å
243	L	93.6	Very high	92	Very high	80 Å²	80	71.6 Å²	71.6	42%	0.419	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-44.4	178	-71.4	170.8	0	0	0	111.6	L239 A246 W247	L239-L243 VanDerWaalsContact O-CB 3.3Å; L239-L243 WeakPolarHBondContact O-CB 3.22Å; L239-L243 WeakPolarHBondContact O-CG 3.43Å; L239-L243 PolarHBondContact O-N 3.27Å; L243-A246 PolarHBondContact O-N 2.87Å; L243-W247 PolarHBondContact O-N 3.41Å
244	W	94.5	Very high	91.3	Very high	6 Å²	6	73.7 Å²	73.7	2%	0.023	38%	0.38	C	S	.	.	H	α-helix	trans	-67.9	-42	179.4	-172.2	-103.5	0	0	0	112.6	F240 G241 V242 W247 S248 Q259 I262 I266 M457	F240-W244 WeakPolarHBondContact O-CB 3.38Å; F240-W244 PolarHBondContact O-N 3.45Å; G241-W244 PolarHBondContact O-N 3.15Å; V242-W244 PolarHBondContact O-N 2.81Å; W244-W247 HydrophobicContact CE3-CE3 4.19Å; W244-W247 PolarHBondContact O-N 3.28Å; W244-S248 VanDerWaalsContact O-CB 3.24Å; W244-S248 WeakPolarHBondContact O-CB 3.49Å; W244-S248 PolarHBondContact O-N 2.92Å; W244-S248 PolarHBondContact O-OG 3.47Å; W244-Q259 HydrophobicContact CH2-CG 4.33Å; W244-Q259 HydrophobicContact CZ2-CB 3.9Å; W244-Q259 HydrophobicContact CZ2-CG 4.12Å; W244-Q259 PolarHBondContact NE1-O 2.87Å; W244-I262 HydrophobicContact CD2-CG2 4.34Å; W244-I262 HydrophobicContact CH2-CB 4.2Å; W244-I262 HydrophobicContact CH2-CD1 3.93Å; W244-I262 HydrophobicContact CH2-CG2 3.83Å; W244-I262 HydrophobicContact CZ2-CB 3.69Å; W244-I262 HydrophobicContact CZ2-CD1 4.12Å; W244-I262 HydrophobicContact CZ2-CG1 4.5Å; W244-I262 HydrophobicContact CZ2-CG2 3.6Å; W244-I262 HydrophobicContact CZ3-CG2 4.31Å; W244-I266 HydrophobicContact CB-CD1 3.78Å; W244-I266 HydrophobicContact CD2-CD1 4Å; W244-I266 HydrophobicContact CG-CD1 3.62Å; W244-M457 HydrophobicContact CD2-CG 4.36Å; W244-M457 HydrophobicContact CE3-CB 4.48Å; W244-M457 HydrophobicContact CE3-CG 3.34Å; W244-M457 HydrophobicContact CE3-SD 4.33Å; W244-M457 HydrophobicContact CZ3-CB 4.46Å; W244-M457 HydrophobicContact CZ3-CG 3.69Å
245	L	92.8	Very high	90.5	Very high	119 Å²	119	73.5 Å²	73.5	62%	0.623	38%	0.377	S	S	*	.	H	α-helix	trans	-64	-41.6	175.5	-74	173	0	0	0	111.2	G241 V242 S248 A249	G241-L245 VanDerWaalsContact O-CB 3.25Å; G241-L245 WeakPolarHBondContact O-CB 2.98Å; G241-L245 WeakPolarHBondContact O-CG 3.37Å; G241-L245 PolarHBondContact O-N 2.95Å; V242-L245 PolarHBondContact O-N 3.48Å; L245-S248 PolarHBondContact O-N 3.44Å; L245-A249 VanDerWaalsContact O-CB 3.25Å; L245-A249 WeakPolarHBondContact O-CB 3.32Å; L245-A249 PolarHBondContact O-N 3.2Å
246	A	91.9	Very high	89.8	Confident	51 Å²	51	69.9 Å²	69.9	42%	0.421	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-49.8	176.2	0	0	0	0	0	111.5	V242 L243 S248 A249 C250	V242-A246 VanDerWaalsContact O-CB 3.3Å; V242-A246 WeakPolarHBondContact O-CB 3.19Å; V242-A246 PolarHBondContact O-N 3.35Å; L243-A246 PolarHBondContact O-N 2.87Å; A246-S248 PolarHBondContact O-N 2.97Å; A246-A249 PolarHBondContact O-N 2.91Å; A246-C250 PolarHBondContact O-N 3.07Å; A246-C250 PolarHBondContact O-SG 2.93Å
247	W	90.4	Very high	89.2	Confident	88 Å²	88	76.4 Å²	76.4	33%	0.333	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-41.1	175.2	-69.9	-32.4	0	0	0	112.7	L243 W244 A249 C250 Y251 M457 R461 P462	L243-W247 PolarHBondContact O-N 3.41Å; W244-W247 HydrophobicContact CE3-CE3 4.19Å; W244-W247 PolarHBondContact O-N 3.28Å; W247-A249 VanDerWaalsContact C-N 3.34Å; W247-A249 PolarHBondContact O-N 3.42Å; W247-C250 PolarHBondContact O-N 3.15Å; W247-Y251 WeakPolarHBondContact O-CD2 3.43Å; W247-Y251 PolarHBondContact O-N 2.89Å; W247-M457 HydrophobicContact CH2-CE 3.85Å; W247-M457 HydrophobicContact CZ3-CE 3.56Å; W247-M457 HydrophobicContact CZ3-CG 4.03Å; W247-M457 HydrophobicContact CZ3-SD 4.03Å; W247-R461 HydrophobicContact CE3-CB 4.44Å; W247-P462 HydrophobicContact CB-CG 4.19Å
248	S	88.3	Confident	88.7	Confident	13 Å²	13	76.5 Å²	76.5	9%	0.091	38%	0.379	C	S	.	.	H	α-helix	trans	-66.7	-35.4	179.6	-59	0	0	0	0	112.2	W244 L245 A246 Y251 W252	W244-S248 VanDerWaalsContact O-CB 3.24Å; W244-S248 WeakPolarHBondContact O-CB 3.49Å; W244-S248 PolarHBondContact O-N 2.92Å; W244-S248 PolarHBondContact O-OG 3.47Å; L245-S248 PolarHBondContact O-N 3.44Å; A246-S248 PolarHBondContact O-N 2.97Å; S248-Y251 CarbonylContact O-C 3.45Å; S248-W252 WeakPolarHBondContact O-CA 3.33Å; S248-W252 WeakPolarHBondContact O-CB 3.26Å; S248-W252 PolarHBondContact O-N 3.37Å
249	A	89.3	Confident	88.4	Confident	69 Å²	69	73.7 Å²	73.7	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-70.5	-42.6	176.8	0	0	0	0	0	111.9	L245 A246 W247 Y251 W252	L245-A249 VanDerWaalsContact O-CB 3.25Å; L245-A249 WeakPolarHBondContact O-CB 3.32Å; L245-A249 PolarHBondContact O-N 3.2Å; A246-A249 PolarHBondContact O-N 2.91Å; W247-A249 VanDerWaalsContact C-N 3.34Å; W247-A249 PolarHBondContact O-N 3.42Å; A249-Y251 PolarHBondContact O-N 3.26Å; A249-W252 PolarHBondContact O-N 2.94Å
250	C	88.9	Confident	88	Confident	101 Å²	101	74.5 Å²	74.5	68%	0.682	36%	0.361	S	S	*	.	H	α-helix	trans	-60.2	-32.9	176.4	-70	0	0	0	0	112.8	A246 W247	A246-C250 PolarHBondContact O-N 3.07Å; A246-C250 PolarHBondContact O-SG 2.93Å; W247-C250 PolarHBondContact O-N 3.15Å
251	Y	84.3	Confident	87.8	Confident	90 Å²	90	79.1 Å²	79.1	35%	0.353	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	29.6	-177.7	-60.1	-74.3	0	0	0	113.1	W247 S248 A249 R253 D254 P462 A464	W247-Y251 WeakPolarHBondContact O-CD2 3.43Å; W247-Y251 PolarHBondContact O-N 2.89Å; S248-Y251 CarbonylContact O-C 3.45Å; A249-Y251 PolarHBondContact O-N 3.26Å; Y251-R253 PolarHBondContact O-N 3.21Å; Y251-R253 VanDerWaalsContact O-N 3.07Å; Y251-D254 PolarHBondContact O-N 3.43Å; Y251-P462 HydrophobicContact CD2-CB 3.86Å; Y251-P462 HydrophobicContact CG-CB 4.18Å; Y251-A464 HydrophobicContact CD1-CB 4.15Å; Y251-A464 HydrophobicContact CE1-CB 3.89Å
252	W	83.8	Confident	87.6	Confident	190 Å²	190	78.9 Å²	78.9	72%	0.72	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-60	-27.5	-169.6	-166.6	51.4	0	0	0	114.1	S248 A249 D254	S248-W252 WeakPolarHBondContact O-CA 3.33Å; S248-W252 WeakPolarHBondContact O-CB 3.26Å; S248-W252 PolarHBondContact O-N 3.37Å; A249-W252 PolarHBondContact O-N 2.94Å; W252-D254 VanDerWaalsContact C-N 3.34Å; W252-D254 PolarHBondContact O-N 2.9Å
253	R	79.9	Confident	87.5	Confident	239 Å²	239	75.6 Å²	75.6	90%	0.902	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-71.5	-25.1	178.4	-67.7	-169.6	172.2	104.1	-0.3	114	Y251	Y251-R253 PolarHBondContact O-N 3.21Å; Y251-R253 VanDerWaalsContact O-N 3.07Å
254	D	77.8	Confident	87.5	Confident	61 Å²	61	73.4 Å²	73.4	33%	0.326	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-111	13.1	-171.8	-63.8	-43.7	0	0	0	113	Y251 W252 L256 Q467	Y251-D254 PolarHBondContact O-N 3.43Å; W252-D254 VanDerWaalsContact C-N 3.34Å; W252-D254 PolarHBondContact O-N 2.9Å; D254-L256 PolarHBondContact O-N 3.19Å; D254-Q467 HydrophobicContact CB-CG 3.76Å; D254-Q467 PolarHBondContact O-NE2 2.9Å; D254-Q467 VanDerWaalsContact O-NE2 3.15Å
255	L	79.8	Confident	87.5	Confident	22 Å²	22	73.3 Å²	73.3	12%	0.115	35%	0.353	C	S	.	.			trans	-69.9	126.9	-170.8	-138.4	75.3	0	0	0	112.5	Q259 F260 P462	L255-Q259 HydrophobicContact CD1-CB 4.41Å; L255-Q259 VanDerWaalsContact CD1-OE1 3.25Å; L255-Q259 HydrophobicContact CD2-CB 4.28Å; L255-Q259 HydrophobicContact CG-CB 3.93Å; L255-Q259 VanDerWaalsContact CG-OE1 3.24Å; L255-F260 HydrophobicContact CB-CE2 4.1Å; L255-F260 HydrophobicContact CB-CZ 4.22Å; L255-F260 HydrophobicContact CD2-CD1 4.06Å; L255-F260 HydrophobicContact CD2-CD2 4.2Å; L255-F260 HydrophobicContact CD2-CE1 3.67Å; L255-F260 HydrophobicContact CD2-CE2 3.82Å; L255-F260 HydrophobicContact CD2-CG 4.32Å; L255-F260 HydrophobicContact CD2-CZ 3.54Å; L255-F260 HydrophobicContact CG-CE2 4.39Å; L255-F260 HydrophobicContact CG-CZ 4.44Å; L255-P462 HydrophobicContact CD1-CB 4.01Å; L255-P462 HydrophobicContact CD1-CG 3.81Å
256	L	81.3	Confident	87.6	Confident	16 Å²	16	67.8 Å²	67.8	8%	0.084	32%	0.324	C	S	.	.			trans	-77.4	149.2	175.7	-69.5	165.6	0	0	0	110.4	D254 I258 Q259 N466	D254-L256 PolarHBondContact O-N 3.19Å; L256-I258 PolarHBondContact O-N 3.36Å; L256-I258 VanDerWaalsContact O-N 3.08Å; L256-Q259 HydrophobicContact CB-CG 4.39Å; L256-Q259 WeakPolarHBondContact O-CB 3.34Å; L256-Q259 PolarHBondContact O-N 3.26Å; L256-N466 HydrophobicContact CD1-CB 4.4Å
257	R	83.4	Confident	87.8	Confident	181 Å²	181	70.8 Å²	70.8	68%	0.683	33%	0.328	S	S	*	.	H	α-helix	trans	-50.9	-39.8	176.9	-67.5	-175.6	-174.2	-143.3	-0.2	112.4	Q259 F260 W261	R257-Q259 VanDerWaalsContact C-N 3.26Å; R257-Q259 PolarHBondContact O-N 2.94Å; R257-F260 WeakPolarHBondContact O-CB 3.34Å; R257-F260 PolarHBondContact O-N 3.4Å; R257-W261 PolarHBondContact O-N 2.93Å
258	I	84.9	Confident	87.9	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-33.7	179.7	-65.1	170.3	0	0	0	112.2	L256 F260 W261 I262 I314 V315 Y319 W460	L256-I258 PolarHBondContact O-N 3.36Å; L256-I258 VanDerWaalsContact O-N 3.08Å; I258-F260 VanDerWaalsContact C-N 3.32Å; I258-F260 PolarHBondContact O-N 3.29Å; I258-W261 WeakPolarHBondContact O-CB 3.46Å; I258-W261 PolarHBondContact O-N 2.91Å; I258-W261 VanDerWaalsContact O-N 3.11Å; I258-I262 HydrophobicContact CG2-CD1 4.2Å; I258-I262 HydrophobicContact CG2-CG1 4.44Å; I258-I262 WeakPolarHBondContact O-CG1 3.43Å; I258-I262 PolarHBondContact O-N 2.98Å; I258-I314 HydrophobicContact CD1-CG2 4.4Å; I258-I314 HydrophobicContact CG1-CG2 4.42Å; I258-V315 HydrophobicContact CG2-CG2 4.05Å; I258-Y319 HydrophobicContact CD1-CD1 4.1Å; I258-Y319 WeakPolarHBondContact CD1-O 3.48Å; I258-Y319 HydrophobicContact CG1-CD1 4.12Å; I258-W460 HydrophobicContact CB-CZ3 4.2Å; I258-W460 HydrophobicContact CD1-CH2 3.99Å; I258-W460 HydrophobicContact CD1-CZ3 3.8Å; I258-W460 HydrophobicContact CG2-CE3 3.92Å; I258-W460 HydrophobicContact CG2-CH2 4.46Å; I258-W460 HydrophobicContact CG2-CZ3 3.82Å
259	Q	89.3	Confident	88.2	Confident	3 Å²	3	67.1 Å²	67.1	1%	0.014	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-31.8	-179.2	-70	170.4	-28.3	0	0	112.2	W244 L255 L256 R257 I262 G263 W460	W244-Q259 HydrophobicContact CH2-CG 4.33Å; W244-Q259 HydrophobicContact CZ2-CB 3.9Å; W244-Q259 HydrophobicContact CZ2-CG 4.12Å; W244-Q259 PolarHBondContact NE1-O 2.87Å; L255-Q259 HydrophobicContact CD1-CB 4.41Å; L255-Q259 VanDerWaalsContact CD1-OE1 3.25Å; L255-Q259 HydrophobicContact CD2-CB 4.28Å; L255-Q259 HydrophobicContact CG-CB 3.93Å; L255-Q259 VanDerWaalsContact CG-OE1 3.24Å; L256-Q259 HydrophobicContact CB-CG 4.39Å; L256-Q259 WeakPolarHBondContact O-CB 3.34Å; L256-Q259 PolarHBondContact O-N 3.26Å; R257-Q259 VanDerWaalsContact C-N 3.26Å; R257-Q259 PolarHBondContact O-N 2.94Å; Q259-I262 PolarHBondContact O-N 3.42Å; Q259-G263 PolarHBondContact O-N 3.27Å; Q259-W460 PolarHBondContact NE2-O 3.08Å; Q259-W460 VanDerWaalsContact NE2-O 3.11Å
260	F	88.6	Confident	88.4	Confident	115 Å²	115	66.2 Å²	66.2	50%	0.504	30%	0.298	S	S	.	.	H	α-helix	trans	-64.9	-39.8	169.9	-69	-73.1	0	0	0	111.8	L255 R257 I258 G263 A264	L255-F260 HydrophobicContact CB-CE2 4.1Å; L255-F260 HydrophobicContact CB-CZ 4.22Å; L255-F260 HydrophobicContact CD2-CD1 4.06Å; L255-F260 HydrophobicContact CD2-CD2 4.2Å; L255-F260 HydrophobicContact CD2-CE1 3.67Å; L255-F260 HydrophobicContact CD2-CE2 3.82Å; L255-F260 HydrophobicContact CD2-CG 4.32Å; L255-F260 HydrophobicContact CD2-CZ 3.54Å; L255-F260 HydrophobicContact CG-CE2 4.39Å; L255-F260 HydrophobicContact CG-CZ 4.44Å; R257-F260 WeakPolarHBondContact O-CB 3.34Å; R257-F260 PolarHBondContact O-N 3.4Å; I258-F260 VanDerWaalsContact C-N 3.32Å; I258-F260 PolarHBondContact O-N 3.29Å; F260-G263 PolarHBondContact O-N 3.4Å; F260-A264 WeakPolarHBondContact O-CB 3.48Å; F260-A264 PolarHBondContact O-N 2.88Å
261	W	89.9	Confident	88.7	Confident	116 Å²	116	64.4 Å²	64.4	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-40.3	175	-69.6	93.2	0	0	0	111.9	R257 I258 A264 V265 L307 L311	R257-W261 PolarHBondContact O-N 2.93Å; I258-W261 WeakPolarHBondContact O-CB 3.46Å; I258-W261 PolarHBondContact O-N 2.91Å; I258-W261 VanDerWaalsContact O-N 3.11Å; W261-A264 PolarHBondContact O-N 3.45Å; W261-V265 WeakPolarHBondContact O-CG2 3.45Å; W261-V265 PolarHBondContact O-N 3.45Å; W261-L307 HydrophobicContact CE3-CD2 4.02Å; W261-L307 HydrophobicContact CZ3-CD2 3.55Å; W261-L311 HydrophobicContact CB-CD1 4.04Å
262	I	92	Very high	89	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-47.6	174.1	-63.9	168.7	0	0	0	110	W244 I258 Q259 A264 V265 I266 L311 I456 W460	W244-I262 HydrophobicContact CD2-CG2 4.34Å; W244-I262 HydrophobicContact CH2-CB 4.2Å; W244-I262 HydrophobicContact CH2-CD1 3.93Å; W244-I262 HydrophobicContact CH2-CG2 3.83Å; W244-I262 HydrophobicContact CZ2-CB 3.69Å; W244-I262 HydrophobicContact CZ2-CD1 4.12Å; W244-I262 HydrophobicContact CZ2-CG1 4.5Å; W244-I262 HydrophobicContact CZ2-CG2 3.6Å; W244-I262 HydrophobicContact CZ3-CG2 4.31Å; I258-I262 HydrophobicContact CG2-CD1 4.2Å; I258-I262 HydrophobicContact CG2-CG1 4.44Å; I258-I262 WeakPolarHBondContact O-CG1 3.43Å; I258-I262 PolarHBondContact O-N 2.98Å; Q259-I262 PolarHBondContact O-N 3.42Å; I262-A264 VanDerWaalsContact C-N 3.31Å; I262-A264 PolarHBondContact O-N 2.94Å; I262-V265 PolarHBondContact O-N 3.46Å; I262-I266 HydrophobicContact CG2-CD1 3.97Å; I262-I266 WeakPolarHBondContact O-CG1 3.05Å; I262-I266 PolarHBondContact O-N 3.4Å; I262-L311 HydrophobicContact CB-CD1 4.39Å; I262-L311 HydrophobicContact CG1-CD1 3.74Å; I262-L311 HydrophobicContact CG1-CD2 4.39Å; I262-I456 HydrophobicContact CD1-CG2 4.09Å; I262-I456 HydrophobicContact CG1-CG2 4.36Å; I262-W460 HydrophobicContact CD1-CB 3.56Å; I262-W460 HydrophobicContact CD1-CG 4.04Å
263	G	93.4	Very high	89.4	Confident	20 Å²	20	51.6 Å²	51.6	21%	0.206	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-40.7	176	0	0	0	0	0	113	Q259 F260 I266 F267	Q259-G263 PolarHBondContact O-N 3.27Å; F260-G263 PolarHBondContact O-N 3.4Å; G263-I266 PolarHBondContact O-N 2.9Å; G263-F267 WeakPolarHBondContact O-CB 3.23Å; G263-F267 PolarHBondContact O-N 3.35Å
264	A	93.2	Very high	90.1	Very high	35 Å²	35	42.2 Å²	42.2	29%	0.289	21%	0.206	S	C	.	.	H	α-helix	trans	-62.7	-43.3	175.5	0	0	0	0	0	112.1	F260 W261 I262 I266 F267 L268	F260-A264 WeakPolarHBondContact O-CB 3.48Å; F260-A264 PolarHBondContact O-N 2.88Å; W261-A264 PolarHBondContact O-N 3.45Å; I262-A264 VanDerWaalsContact C-N 3.31Å; I262-A264 PolarHBondContact O-N 2.94Å; A264-I266 VanDerWaalsContact C-N 3.34Å; A264-I266 PolarHBondContact O-N 3.44Å; A264-F267 PolarHBondContact O-N 3.07Å; A264-L268 WeakPolarHBondContact O-CD1 3.49Å; A264-L268 PolarHBondContact O-N 3.03Å
265	V	94.4	Very high	90.7	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-38.8	177	177.2	0	0	0	0	111.5	W261 I262 G269 K304 L307 A308 L311 F449 L453	W261-V265 WeakPolarHBondContact O-CG2 3.45Å; W261-V265 PolarHBondContact O-N 3.45Å; I262-V265 PolarHBondContact O-N 3.46Å; V265-G269 PolarHBondContact O-N 2.95Å; V265-K304 HydrophobicContact CG1-CG 4.31Å; V265-L307 HydrophobicContact CG2-CB 3.95Å; V265-A308 HydrophobicContact CG1-CB 4.24Å; V265-L311 HydrophobicContact CG2-CD1 4.03Å; V265-F449 HydrophobicContact CG1-CZ 4.06Å; V265-L453 HydrophobicContact CB-CD1 4.37Å; V265-L453 HydrophobicContact CG1-CD1 3.55Å
266	I	95.4	Very high	91.2	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-47.7	174.6	-65.4	163.3	0	0	0	110.5	F240 W244 I262 G263 A264 G269 M270 L453	F240-I266 HydrophobicContact CB-CG2 4.07Å; W244-I266 HydrophobicContact CB-CD1 3.78Å; W244-I266 HydrophobicContact CD2-CD1 4Å; W244-I266 HydrophobicContact CG-CD1 3.62Å; I262-I266 HydrophobicContact CG2-CD1 3.97Å; I262-I266 WeakPolarHBondContact O-CG1 3.05Å; I262-I266 PolarHBondContact O-N 3.4Å; G263-I266 PolarHBondContact O-N 2.9Å; A264-I266 VanDerWaalsContact C-N 3.34Å; A264-I266 PolarHBondContact O-N 3.44Å; I266-G269 PolarHBondContact O-N 3.33Å; I266-M270 PolarHBondContact O-N 2.93Å; I266-L453 HydrophobicContact CG1-CD1 4.36Å; I266-L453 HydrophobicContact CG1-CD2 4.03Å; I266-L453 HydrophobicContact CG1-CG 4.48Å
267	F	95.4	Very high	91.6	Very high	113 Å²	113	42.2 Å²	42.2	50%	0.496	20%	0.203	S	C	.	.	H	α-helix	trans	-61.6	-45.3	179.1	178.1	-105	0	0	0	112.2	G263 A264 G269 M270 L271	G263-F267 WeakPolarHBondContact O-CB 3.23Å; G263-F267 PolarHBondContact O-N 3.35Å; A264-F267 PolarHBondContact O-N 3.07Å; F267-G269 VanDerWaalsContact C-N 3.29Å; F267-G269 PolarHBondContact O-N 3.32Å; F267-M270 HydrophobicContact CD2-CE 3.84Å; F267-M270 HydrophobicContact CE2-CE 4.5Å; F267-M270 WeakPolarHBondContact O-CB 3.41Å; F267-M270 PolarHBondContact O-N 3.49Å; F267-L271 HydrophobicContact CD1-CD1 3.96Å; F267-L271 HydrophobicContact CD1-CG 4.49Å; F267-L271 HydrophobicContact CE1-CD1 3.33Å; F267-L271 HydrophobicContact CE1-CG 4.05Å; F267-L271 HydrophobicContact CE2-CD1 4.48Å; F267-L271 HydrophobicContact CE2-CG 4.38Å; F267-L271 HydrophobicContact CZ-CD1 3.63Å; F267-L271 HydrophobicContact CZ-CD2 4.26Å; F267-L271 HydrophobicContact CZ-CG 3.98Å; F267-L271 PolarHBondContact O-N 3.18Å
268	L	93.8	Very high	92	Very high	25 Å²	25	36.3 Å²	36.3	13%	0.131	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-37.3	174.4	-92	83.3	0	0	0	112.2	A264 L271 E272 V303 K304 L307	A264-L268 WeakPolarHBondContact O-CD1 3.49Å; A264-L268 PolarHBondContact O-N 3.03Å; L268-L271 PolarHBondContact O-N 3.49Å; L268-E272 WeakPolarHBondContact O-CB 3.41Å; L268-E272 PolarHBondContact O-N 3.42Å; L268-V303 HydrophobicContact CD2-CB 3.86Å; L268-V303 HydrophobicContact CD2-CG1 3.43Å; L268-V303 VanDerWaalsContact CD2-CG1 3.43Å; L268-K304 HydrophobicContact CB-CB 4.15Å; L268-K304 HydrophobicContact CB-CG 4.27Å; L268-K304 HydrophobicContact CD2-CB 4.28Å; L268-L307 HydrophobicContact CD1-CD1 4.27Å; L268-L307 HydrophobicContact CD2-CD1 3.89Å
269	G	92.6	Very high	92.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-41.5	174.5	0	0	0	0	0	113	V265 I266 F267 E272 K273	V265-G269 PolarHBondContact O-N 2.95Å; I266-G269 PolarHBondContact O-N 3.33Å; F267-G269 VanDerWaalsContact C-N 3.29Å; F267-G269 PolarHBondContact O-N 3.32Å; G269-E272 PolarHBondContact O-N 3.05Å; G269-K273 WeakPolarHBondContact O-CG 3.39Å; G269-K273 PolarHBondContact O-N 3.43Å
270	M	94.4	Very high	92	Very high	49 Å²	49	36.9 Å²	36.9	24%	0.241	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-46.9	173.6	172.7	173.2	30.2	0	0	111.7	V238 I266 F267 K273 A274	V238-M270 HydrophobicContact CG2-CG 4.32Å; V238-M270 HydrophobicContact CG2-SD 3.88Å; I266-M270 PolarHBondContact O-N 2.93Å; F267-M270 HydrophobicContact CD2-CE 3.84Å; F267-M270 HydrophobicContact CE2-CE 4.5Å; F267-M270 WeakPolarHBondContact O-CB 3.41Å; F267-M270 PolarHBondContact O-N 3.49Å; M270-K273 PolarHBondContact O-N 2.88Å; M270-A274 WeakPolarHBondContact O-CB 3.42Å; M270-A274 PolarHBondContact O-N 3.37Å
271	L	94.5	Very high	92	Very high	64 Å²	64	33.4 Å²	33.4	34%	0.335	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-46.2	176.5	-74.1	179.8	0	0	0	111.9	F267 L268 K273 A274 V275	F267-L271 HydrophobicContact CD1-CD1 3.96Å; F267-L271 HydrophobicContact CD1-CG 4.49Å; F267-L271 HydrophobicContact CE1-CD1 3.33Å; F267-L271 HydrophobicContact CE1-CG 4.05Å; F267-L271 HydrophobicContact CE2-CD1 4.48Å; F267-L271 HydrophobicContact CE2-CG 4.38Å; F267-L271 HydrophobicContact CZ-CD1 3.63Å; F267-L271 HydrophobicContact CZ-CD2 4.26Å; F267-L271 HydrophobicContact CZ-CG 3.98Å; F267-L271 PolarHBondContact O-N 3.18Å; L268-L271 PolarHBondContact O-N 3.49Å; L271-K273 PolarHBondContact O-N 3.01Å; L271-A274 PolarHBondContact O-N 3.34Å; L271-V275 WeakPolarHBondContact O-CG2 3.28Å; L271-V275 PolarHBondContact O-N 2.96Å
272	E	92.4	Very high	91.9	Very high	6 Å²	6	29.4 Å²	29.4	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-55.5	-51.4	177	179.8	-164.9	128.7	0	0	111.3	L268 G269 A274 V275 F276 S301 K304	L268-E272 WeakPolarHBondContact O-CB 3.41Å; L268-E272 PolarHBondContact O-N 3.42Å; G269-E272 PolarHBondContact O-N 3.05Å; E272-A274 VanDerWaalsContact C-N 3.32Å; E272-A274 PolarHBondContact O-N 2.93Å; E272-V275 PolarHBondContact O-N 2.85Å; E272-F276 HydrophobicContact CG-CD2 3.71Å; E272-F276 HydrophobicContact CG-CE2 3.54Å; E272-F276 VanDerWaalsContact O-CD2 3.28Å; E272-F276 WeakPolarHBondContact O-CD2 3.37Å; E272-F276 PolarHBondContact O-N 3.06Å; E272-S301 VanDerWaalsContact CD-OG 3.24Å; E272-S301 WeakPolarHBondContact CG-OG 3.31Å; E272-K304 VanDerWaalsContact OE2-CD 3.23Å; E272-K304 WeakPolarHBondContact OE2-CD 3.4Å; E272-K304 WeakPolarHBondContact OE2-CE 3.3Å; E272-K304 IonicContact OE2-NZ 3.98Å
273	K	91.7	Very high	91.6	Very high	5 Å²	5	29.3 Å²	29.3	2%	0.022	17%	0.167	C	C	.	.	H	α-helix	trans	-65.5	-35.6	-179.1	-61.5	-52.2	171	-149.5	0	112.4	F230 M233 C234 Y237 G269 M270 L271 Y277	F230-K273 HydrophobicContact CD1-CD 3.57Å; F230-K273 HydrophobicContact CE1-CD 3.81Å; M233-K273 HydrophobicContact CB-CD 4.32Å; M233-K273 HydrophobicContact CB-CG 4.38Å; C234-K273 HydrophobicContact CB-CB 3.92Å; Y237-K273 HydrophobicContact CD2-CG 4.4Å; G269-K273 WeakPolarHBondContact O-CG 3.39Å; G269-K273 PolarHBondContact O-N 3.43Å; M270-K273 PolarHBondContact O-N 2.88Å; L271-K273 PolarHBondContact O-N 3.01Å; K273-Y277 VanDerWaalsContact O-CB 3.28Å; K273-Y277 WeakPolarHBondContact O-CB 3.37Å; K273-Y277 PolarHBondContact O-N 3.25Å
274	A	93.3	Very high	91.3	Very high	41 Å²	41	31.2 Å²	31.2	34%	0.339	17%	0.168	S	C	.	.	H	α-helix	trans	-64.9	-43.1	175	0	0	0	0	0	112.1	M270 L271 E272 Y277 A278	M270-A274 WeakPolarHBondContact O-CB 3.42Å; M270-A274 PolarHBondContact O-N 3.37Å; L271-A274 PolarHBondContact O-N 3.34Å; E272-A274 VanDerWaalsContact C-N 3.32Å; E272-A274 PolarHBondContact O-N 2.93Å; A274-Y277 PolarHBondContact O-N 3.43Å; A274-A278 WeakPolarHBondContact O-CB 3.33Å; A274-A278 PolarHBondContact O-N 3.39Å
275	V	92.1	Very high	90.9	Very high	29 Å²	29	36 Å²	36	18%	0.176	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-45.7	179	178.5	0	0	0	0	111.1	L271 E272 Y277 A278 E279 A297 L300	L271-V275 WeakPolarHBondContact O-CG2 3.28Å; L271-V275 PolarHBondContact O-N 2.96Å; E272-V275 PolarHBondContact O-N 2.85Å; V275-Y277 PolarHBondContact O-N 3.18Å; V275-A278 PolarHBondContact O-N 3.01Å; V275-E279 PolarHBondContact O-N 3.5Å; V275-A297 HydrophobicContact CB-CB 4.33Å; V275-A297 HydrophobicContact CG1-CB 3.59Å; V275-L300 HydrophobicContact CG2-CD1 3.89Å
276	F	89.3	Confident	90.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-44.1	175.3	-80.5	-62.1	0	0	0	112	V34 F230 E272 A278 E279 F280 L294 A297 S301	V34-F276 HydrophobicContact CG1-CE1 4.28Å; F230-F276 HydrophobicContact CD1-CB 3.57Å; F230-F276 HydrophobicContact CD1-CD2 4.27Å; F230-F276 HydrophobicContact CD1-CG 4.17Å; F230-F276 HydrophobicContact CE1-CB 3.56Å; F230-F276 HydrophobicContact CE1-CD1 4.47Å; F230-F276 AromaticContact CE1-CD2 3.51Å; F230-F276 HydrophobicContact CE1-CD2 3.51Å; F230-F276 HydrophobicContact CE1-CE2 4.32Å; F230-F276 AromaticContact CE1-CG 3.61Å; F230-F276 HydrophobicContact CE1-CG 3.61Å; F230-F276 HydrophobicContact CG-CB 4.1Å; F230-F276 HydrophobicContact CZ-CB 4.07Å; F230-F276 HydrophobicContact CZ-CD1 4.36Å; F230-F276 HydrophobicContact CZ-CD2 4.07Å; F230-F276 AromaticContact CZ-CG 3.92Å; F230-F276 HydrophobicContact CZ-CG 3.92Å; E272-F276 HydrophobicContact CG-CD2 3.71Å; E272-F276 HydrophobicContact CG-CE2 3.54Å; E272-F276 VanDerWaalsContact O-CD2 3.28Å; E272-F276 WeakPolarHBondContact O-CD2 3.37Å; E272-F276 PolarHBondContact O-N 3.06Å; F276-A278 VanDerWaalsContact C-N 3.33Å; F276-A278 PolarHBondContact O-N 2.93Å; F276-E279 WeakPolarHBondContact O-CB 3.13Å; F276-E279 PolarHBondContact O-N 3.34Å; F276-F280 WeakPolarHBondContact O-CD2 3.45Å; F276-F280 PolarHBondContact O-N 2.97Å; F276-L294 HydrophobicContact CE1-CD1 4.43Å; F276-A297 HydrophobicContact CD1-CB 4.14Å; F276-A297 HydrophobicContact CE1-CB 3.85Å; F276-A297 HydrophobicContact CE2-CB 4.29Å; F276-A297 HydrophobicContact CG-CB 4.48Å; F276-A297 HydrophobicContact CZ-CB 3.93Å; F276-S301 WeakPolarHBondContact CE2-OG 3.26Å
277	Y	90.6	Very high	89.5	Confident	69 Å²	69	42 Å²	42	27%	0.271	21%	0.205	S	C	.	.	H	α-helix	trans	-61.9	-40.9	176.7	178	-105.1	0	0	0	112.3	M227 M231 K273 A274 V275 E279 F280 Q281	M227-Y277 HydrophobicContact CG-CD2 4.41Å; M227-Y277 HydrophobicContact CG-CE2 4.3Å; M231-Y277 HydrophobicContact CB-CD2 3.87Å; M231-Y277 HydrophobicContact CB-CE2 3.68Å; M231-Y277 HydrophobicContact CG-CD2 4.41Å; M231-Y277 HydrophobicContact CG-CE2 3.86Å; K273-Y277 VanDerWaalsContact O-CB 3.28Å; K273-Y277 WeakPolarHBondContact O-CB 3.37Å; K273-Y277 PolarHBondContact O-N 3.25Å; A274-Y277 PolarHBondContact O-N 3.43Å; V275-Y277 PolarHBondContact O-N 3.18Å; Y277-E279 VanDerWaalsContact C-N 3.29Å; Y277-E279 PolarHBondContact O-N 2.96Å; Y277-F280 PolarHBondContact O-N 2.88Å; Y277-Q281 HydrophobicContact CD1-CG 4.3Å; Y277-Q281 HydrophobicContact CE1-CG 3.86Å; Y277-Q281 HydrophobicContact CE2-CG 4.23Å; Y277-Q281 WeakPolarHBondContact O-CG 3.37Å; Y277-Q281 PolarHBondContact O-N 3.34Å; Y277-Q281 PolarHBondContact OH-NE2 2.94Å
278	A	90.4	Very high	88.8	Confident	56 Å²	56	40.2 Å²	40.2	46%	0.463	20%	0.198	S	C	.	.	H	α-helix	trans	-63.1	-36.5	175.9	0	0	0	0	0	112	A274 V275 F276 Q281 N282	A274-A278 WeakPolarHBondContact O-CB 3.33Å; A274-A278 PolarHBondContact O-N 3.39Å; V275-A278 PolarHBondContact O-N 3.01Å; F276-A278 VanDerWaalsContact C-N 3.33Å; F276-A278 PolarHBondContact O-N 2.93Å; A278-Q281 PolarHBondContact O-N 3.3Å; A278-N282 WeakPolarHBondContact O-CB 3.43Å; A278-N282 PolarHBondContact O-N 2.85Å
279	E	88.1	Confident	88	Confident	12 Å²	12	39.9 Å²	39.9	6%	0.056	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-49	174.1	-174.7	177.9	-177.3	0	0	111.8	V275 F276 Y277 Q281 N282 I283 L294	V275-E279 PolarHBondContact O-N 3.5Å; F276-E279 WeakPolarHBondContact O-CB 3.13Å; F276-E279 PolarHBondContact O-N 3.34Å; Y277-E279 VanDerWaalsContact C-N 3.29Å; Y277-E279 PolarHBondContact O-N 2.96Å; E279-Q281 VanDerWaalsContact C-N 3.27Å; E279-Q281 PolarHBondContact O-N 3.45Å; E279-N282 PolarHBondContact O-N 2.8Å; E279-I283 HydrophobicContact CG-CD1 3.99Å; E279-I283 WeakPolarHBondContact O-CG1 3.25Å; E279-I283 PolarHBondContact O-N 2.89Å; E279-L294 WeakPolarHBondContact OE1-CB 3.46Å; E279-L294 WeakPolarHBondContact OE1-CD1 3.49Å; E279-L294 VanDerWaalsContact OE2-CD1 3.25Å; E279-L294 WeakPolarHBondContact OE2-CD1 3.47Å
280	F	86.4	Confident	87.5	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.035	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-37.9	176.2	-77.5	-71.2	0	0	0	112.4	A37 L219 D223 L226 M227 F230 F276 Y277 I283 R284	A37-F280 HydrophobicContact CB-CD1 4.14Å; A37-F280 HydrophobicContact CB-CE1 3.66Å; A37-F280 HydrophobicContact CB-CZ 4.43Å; L219-F280 HydrophobicContact CD1-CD1 4.47Å; D223-F280 HydrophobicContact CB-CD1 4.28Å; D223-F280 HydrophobicContact CB-CE1 3.99Å; L226-F280 HydrophobicContact CB-CZ 4.34Å; L226-F280 HydrophobicContact CD2-CE1 4.28Å; L226-F280 HydrophobicContact CD2-CE2 4.42Å; L226-F280 HydrophobicContact CD2-CZ 3.59Å; L226-F280 HydrophobicContact CG-CE2 4.32Å; L226-F280 HydrophobicContact CG-CZ 3.83Å; M227-F280 HydrophobicContact CB-CB 3.98Å; M227-F280 HydrophobicContact CB-CD1 4.26Å; M227-F280 HydrophobicContact CB-CG 4.05Å; M227-F280 HydrophobicContact CG-CB 3.77Å; M227-F280 HydrophobicContact CG-CG 4.37Å; M227-F280 HydrophobicContact SD-CB 4.46Å; F230-F280 HydrophobicContact CD2-CD2 4.08Å; F230-F280 AromaticContact CD2-CE2 3.48Å; F230-F280 HydrophobicContact CD2-CE2 3.48Å; F230-F280 VanDerWaalsContact CD2-CE2 3.48Å; F230-F280 HydrophobicContact CD2-CZ 4.32Å; F230-F280 AromaticContact CE2-CE2 3.64Å; F230-F280 HydrophobicContact CE2-CE2 3.64Å; F230-F280 HydrophobicContact CE2-CZ 4.25Å; F230-F280 HydrophobicContact CG-CE2 4.34Å; F276-F280 WeakPolarHBondContact O-CD2 3.45Å; F276-F280 PolarHBondContact O-N 2.97Å; Y277-F280 PolarHBondContact O-N 2.88Å; F280-I283 PolarHBondContact O-N 3.48Å; F280-R284 WeakPolarHBondContact O-CB 3.41Å; F280-R284 PolarHBondContact O-N 2.98Å
281	Q	88.5	Confident	86.9	Confident	41 Å²	41	45.5 Å²	45.5	19%	0.192	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-43	173.1	-76.9	-75	8.8	0	0	112	Y277 A278 E279 I283 R284 Y285	Y277-Q281 HydrophobicContact CD1-CG 4.3Å; Y277-Q281 HydrophobicContact CE1-CG 3.86Å; Y277-Q281 HydrophobicContact CE2-CG 4.23Å; Y277-Q281 WeakPolarHBondContact O-CG 3.37Å; Y277-Q281 PolarHBondContact O-N 3.34Å; Y277-Q281 PolarHBondContact OH-NE2 2.94Å; A278-Q281 PolarHBondContact O-N 3.3Å; E279-Q281 VanDerWaalsContact C-N 3.27Å; E279-Q281 PolarHBondContact O-N 3.45Å; Q281-I283 VanDerWaalsContact C-N 3.32Å; Q281-I283 PolarHBondContact O-N 3.5Å; Q281-R284 PolarHBondContact O-N 3.27Å; Q281-Y285 WeakPolarHBondContact O-CD2 3.31Å; Q281-Y285 PolarHBondContact O-N 3.36Å; Q281-Y285 VanDerWaalsContact O-N 3.16Å
282	N	88.2	Confident	86.4	Confident	33 Å²	33	44.8 Å²	44.8	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-40	177.1	-175.2	79.1	0	0	0	111.4	A278 E279 K286 E288	A278-N282 WeakPolarHBondContact O-CB 3.43Å; A278-N282 PolarHBondContact O-N 2.85Å; E279-N282 PolarHBondContact O-N 2.8Å; N282-K286 WeakPolarHBondContact O-CB 3.44Å; N282-K286 PolarHBondContact O-N 2.9Å; N282-K286 VanDerWaalsContact OD1-CD 3.31Å; N282-K286 WeakPolarHBondContact OD1-CD 3.28Å; N282-K286 WeakPolarHBondContact OD1-CE 3.26Å; N282-K286 PolarHBondContact OD1-NZ 3.47Å; N282-K286 VanDerWaalsContact OD1-NZ 3.1Å; N282-E288 PolarHBondContact ND2-O 2.99Å
283	I	85.1	Confident	86.1	Confident	1 Å²	1	46 Å²	46	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-66	-42.3	176.2	-68.4	171.1	0	0	0	110.8	A37 Y218 E279 F280 Q281 Y285 G287	A37-I283 HydrophobicContact CB-CD1 3.52Å; Y218-I283 WeakPolarHBondContact CB-O 3.43Å; E279-I283 HydrophobicContact CG-CD1 3.99Å; E279-I283 WeakPolarHBondContact O-CG1 3.25Å; E279-I283 PolarHBondContact O-N 2.89Å; F280-I283 PolarHBondContact O-N 3.48Å; Q281-I283 VanDerWaalsContact C-N 3.32Å; Q281-I283 PolarHBondContact O-N 3.5Å; I283-Y285 PolarHBondContact O-N 3.12Å; I283-G287 WeakPolarHBondContact O-CA 3.41Å; I283-G287 PolarHBondContact O-N 2.88Å
284	R	86.8	Confident	85.7	Confident	60 Å²	60	46.1 Å²	46.1	23%	0.226	25%	0.249	C	C	.	.	H	α-helix	trans	-55.2	-50.5	176.5	-179.9	178.1	174	168.2	-0.2	112.2	E217 Y218 L219 F280 Q281	E217-R284 HydrophobicContact CB-CG 4.45Å; E217-R284 VanDerWaalsContact CB-O 3.25Å; E217-R284 WeakPolarHBondContact CB-O 3.42Å; E217-R284 VanDerWaalsContact OE2-O 3.14Å; Y218-R284 PolarHBondContact N-O 3.34Å; L219-R284 HydrophobicContact CB-CB 4.37Å; L219-R284 HydrophobicContact CB-CG 4.35Å; F280-R284 WeakPolarHBondContact O-CB 3.41Å; F280-R284 PolarHBondContact O-N 2.98Å; Q281-R284 PolarHBondContact O-N 3.27Å
285	Y	86.3	Confident	85.5	Confident	136 Å²	136	46.6 Å²	46.6	53%	0.533	25%	0.246	S	C	.	.	H	α-helix	trans	-83.8	-38.8	-174.8	-68	-63.3	0	0	0	114.7	E217 Q281 I283	E217-Y285 WeakPolarHBondContact OE2-CA 3.38Å; E217-Y285 WeakPolarHBondContact OE2-CD1 3.41Å; Q281-Y285 WeakPolarHBondContact O-CD2 3.31Å; Q281-Y285 PolarHBondContact O-N 3.36Å; Q281-Y285 VanDerWaalsContact O-N 3.16Å; I283-Y285 PolarHBondContact O-N 3.12Å
286	K	83.4	Confident	85.4	Confident	132 Å²	132	49.6 Å²	49.6	57%	0.574	26%	0.26	S	S	*	.	H	α-helix	trans	-100.9	-19.6	-174.9	-61.1	-172	-171.2	157.3	0	114	N282 E288	N282-K286 WeakPolarHBondContact O-CB 3.44Å; N282-K286 PolarHBondContact O-N 2.9Å; N282-K286 VanDerWaalsContact OD1-CD 3.31Å; N282-K286 WeakPolarHBondContact OD1-CD 3.28Å; N282-K286 WeakPolarHBondContact OD1-CE 3.26Å; N282-K286 PolarHBondContact OD1-NZ 3.47Å; N282-K286 VanDerWaalsContact OD1-NZ 3.1Å; K286-E288 PolarHBondContact O-N 2.94Å
287	G	77.1	Confident	85.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	73.6	0.3	-177.3	0	0	0	0	0	115.7	S40 K41 Y218 I283	S40-G287 PolarHBondContact N-O 2.75Å; K41-G287 PolarHBondContact N-O 3.39Å; Y218-G287 VanDerWaalsContact CB-CA 3.42Å; Y218-G287 VanDerWaalsContact CG-CA 3.44Å; I283-G287 WeakPolarHBondContact O-CA 3.41Å; I283-G287 PolarHBondContact O-N 2.88Å
288	E	78.9	Confident	85.3	Confident	75 Å²	75	46.2 Å²	46.2	35%	0.35	25%	0.247	S	C	.	.	S	Bend	trans	-124.3	137.3	-177.3	-68.8	175.4	-165.7	0	0	111	K41 H43 N282 K286	K41-E288 HydrophobicContact CB-CG 4.07Å; K41-E288 HydrophobicContact CD-CG 4.25Å; K41-E288 WeakPolarHBondContact CD-OE1 3.42Å; K41-E288 HydrophobicContact CG-CG 4.39Å; K41-E288 IonicContact NZ-OE1 2.78Å; K41-E288 PolarHBondContact NZ-OE1 2.97Å; H43-E288 IonicContact CD2-OE1 3.91Å; H43-E288 IonicContact NE2-OE1 3.64Å; H43-E288 PolarHBondContact NE2-OE1 3.24Å; H43-E288 VanDerWaalsContact NE2-OE1 3.16Å; N282-E288 PolarHBondContact ND2-O 2.99Å; K286-E288 PolarHBondContact O-N 2.94Å
289	S	77.1	Confident	85.3	Confident	19 Å²	19	47.6 Å²	47.6	13%	0.133	25%	0.246	C	C	.	.			trans	-84.7	133.7	174.6	58.9	0	0	0	0	111	Q291	S289-Q291 PolarHBondContact O-N 2.68Å
290	V	83.8	Confident	85.5	Confident	76 Å²	76	48.7 Å²	48.7	46%	0.461	25%	0.252	S	S	.	.			trans	-85.5	102.6	172.9	179	0	0	0	0	107.6	G292 A293 L294	V290-G292 PolarHBondContact O-N 3.1Å; V290-G292 VanDerWaalsContact O-N 3.11Å; V290-A293 HydrophobicContact CB-CB 4.17Å; V290-A293 HydrophobicContact CG1-CB 4.25Å; V290-A293 WeakPolarHBondContact O-CB 3.22Å; V290-A293 PolarHBondContact O-N 3.2Å; V290-L294 PolarHBondContact O-N 3.37Å
291	Q	81.3	Confident	85.7	Confident	90 Å²	90	48.3 Å²	48.3	42%	0.421	25%	0.25	S	S	.	.	H	α-helix	trans	-53.2	-37.7	-175	-173.4	174.8	-17.3	0	0	113.1	S289 A293 L294 I295 V352	S289-Q291 PolarHBondContact O-N 2.68Å; Q291-A293 PolarHBondContact O-N 3.48Å; Q291-L294 PolarHBondContact O-N 2.92Å; Q291-I295 HydrophobicContact CG-CD1 4.02Å; Q291-I295 VanDerWaalsContact O-CG1 3.32Å; Q291-I295 WeakPolarHBondContact O-CG1 3.42Å; Q291-I295 PolarHBondContact O-N 3.27Å; Q291-V352 HydrophobicContact CG-CG1 4.45Å
292	G	84.2	Confident	85.8	Confident	49 Å²	49	46.4 Å²	46.4	51%	0.505	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-36	177.1	0	0	0	0	0	114.2	V290 L296	V290-G292 PolarHBondContact O-N 3.1Å; V290-G292 VanDerWaalsContact O-N 3.11Å; G292-L296 WeakPolarHBondContact O-CB 3.02Å; G292-L296 PolarHBondContact O-N 3.4Å
293	A	85.1	Confident	86.1	Confident	33 Å²	33	46.9 Å²	46.9	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-69.6	-39.3	178	0	0	0	0	0	111.2	V290 Q291 L296 A297	V290-A293 HydrophobicContact CB-CB 4.17Å; V290-A293 HydrophobicContact CG1-CB 4.25Å; V290-A293 WeakPolarHBondContact O-CB 3.22Å; V290-A293 PolarHBondContact O-N 3.2Å; Q291-A293 PolarHBondContact O-N 3.48Å; A293-L296 PolarHBondContact O-N 3.36Å; A293-A297 WeakPolarHBondContact O-CB 3.5Å; A293-A297 PolarHBondContact O-N 3.49Å
294	L	84.1	Confident	86.4	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-42.7	176.9	-178.8	60.8	0	0	0	112.2	A36 F276 E279 V290 Q291 L296 A297 E298 V352	A36-L294 HydrophobicContact CB-CD2 3.3Å; F276-L294 HydrophobicContact CE1-CD1 4.43Å; E279-L294 WeakPolarHBondContact OE1-CB 3.46Å; E279-L294 WeakPolarHBondContact OE1-CD1 3.49Å; E279-L294 VanDerWaalsContact OE2-CD1 3.25Å; E279-L294 WeakPolarHBondContact OE2-CD1 3.47Å; V290-L294 PolarHBondContact O-N 3.37Å; Q291-L294 PolarHBondContact O-N 2.92Å; L294-L296 VanDerWaalsContact C-N 3.3Å; L294-L296 PolarHBondContact O-N 3.22Å; L294-A297 WeakPolarHBondContact O-CB 3.47Å; L294-A297 PolarHBondContact O-N 3.32Å; L294-E298 PolarHBondContact O-N 2.92Å; L294-V352 HydrophobicContact CB-CG1 4.29Å; L294-V352 HydrophobicContact CD1-CG2 4.4Å; L294-V352 HydrophobicContact CD2-CB 4.32Å; L294-V352 HydrophobicContact CD2-CG1 3.57Å; L294-V352 HydrophobicContact CD2-CG2 3.99Å; L294-V352 HydrophobicContact CG-CB 4.42Å; L294-V352 HydrophobicContact CG-CG1 3.78Å; L294-V352 HydrophobicContact CG-CG2 3.74Å
295	I	88.4	Confident	86.5	Confident	51 Å²	51	47 Å²	47	26%	0.262	25%	0.246	S	C	.	.	H	α-helix	trans	-59.6	-43.4	173.5	-68.6	169.3	0	0	0	110.4	Q291 E298 L299 V349 V352	Q291-I295 HydrophobicContact CG-CD1 4.02Å; Q291-I295 VanDerWaalsContact O-CG1 3.32Å; Q291-I295 WeakPolarHBondContact O-CG1 3.42Å; Q291-I295 PolarHBondContact O-N 3.27Å; I295-E298 PolarHBondContact O-N 2.96Å; I295-L299 WeakPolarHBondContact O-CB 3.36Å; I295-L299 PolarHBondContact O-N 2.83Å; I295-V349 HydrophobicContact CG2-CG2 4.34Å; I295-V352 HydrophobicContact CG1-CB 4.35Å; I295-V352 HydrophobicContact CG1-CG1 3.69Å
296	L	90.4	Very high	86.8	Confident	91 Å²	91	40.8 Å²	40.8	48%	0.476	22%	0.223	S	C	.	.	H	α-helix	trans	-63.4	-43.4	176.5	-179.6	66.2	0	0	0	111.9	G292 A293 L294 E298 L299 L300	G292-L296 WeakPolarHBondContact O-CB 3.02Å; G292-L296 PolarHBondContact O-N 3.4Å; A293-L296 PolarHBondContact O-N 3.36Å; L294-L296 VanDerWaalsContact C-N 3.3Å; L294-L296 PolarHBondContact O-N 3.22Å; L296-E298 VanDerWaalsContact C-N 3.29Å; L296-E298 PolarHBondContact O-N 3.42Å; L296-L299 PolarHBondContact O-N 3.3Å; L296-L300 HydrophobicContact CG-CD1 4.2Å; L296-L300 WeakPolarHBondContact O-CB 3.42Å; L296-L300 WeakPolarHBondContact O-CG 3.36Å; L296-L300 PolarHBondContact O-N 3.45Å
297	A	88.6	Confident	87.2	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-43	176.9	0	0	0	0	0	111.5	V275 F276 A293 L294 S301	V275-A297 HydrophobicContact CB-CB 4.33Å; V275-A297 HydrophobicContact CG1-CB 3.59Å; F276-A297 HydrophobicContact CD1-CB 4.14Å; F276-A297 HydrophobicContact CE1-CB 3.85Å; F276-A297 HydrophobicContact CE2-CB 4.29Å; F276-A297 HydrophobicContact CG-CB 4.48Å; F276-A297 HydrophobicContact CZ-CB 3.93Å; A293-A297 WeakPolarHBondContact O-CB 3.5Å; A293-A297 PolarHBondContact O-N 3.49Å; L294-A297 WeakPolarHBondContact O-CB 3.47Å; L294-A297 PolarHBondContact O-N 3.32Å; A297-S301 WeakPolarHBondContact O-CB 3.2Å; A297-S301 PolarHBondContact O-N 2.93Å; A297-S301 PolarHBondContact O-OG 3.27Å
298	E	88.1	Confident	87.9	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-71.8	-39	179.8	-163.6	59.4	-153.5	0	0	112.1	L294 I295 L296 S301 A302 R305 R351 V352	L294-E298 PolarHBondContact O-N 2.92Å; I295-E298 PolarHBondContact O-N 2.96Å; L296-E298 VanDerWaalsContact C-N 3.29Å; L296-E298 PolarHBondContact O-N 3.42Å; E298-S301 WeakPolarHBondContact O-CB 3.19Å; E298-S301 PolarHBondContact O-N 3.36Å; E298-A302 PolarHBondContact O-N 3.1Å; E298-R305 IonicContact OE1-CZ 3.84Å; E298-R305 IonicContact OE1-NH1 3.54Å; E298-R305 IonicContact OE1-NH2 2.68Å; E298-R305 PolarHBondContact OE1-NH2 3.22Å; E298-R351 IonicContact OE1-CZ 2.75Å; E298-R351 IonicContact OE1-NH2 2.68Å; E298-R351 PolarHBondContact OE1-NH2 2.86Å; E298-R351 IonicContact OE2-CZ 2.95Å; E298-R351 IonicContact OE2-NH2 3.58Å; E298-R351 PolarHBondContact OE2-NH2 3.39Å; E298-V352 HydrophobicContact CB-CG2 4.34Å
299	L	91.4	Very high	88.4	Confident	84 Å²	84	36.2 Å²	36.2	44%	0.44	20%	0.204	S	C	.	.	H	α-helix	trans	-63.8	-42.7	174.9	-174	63.4	0	0	0	111.4	I295 L296 S301 A302 V303	I295-L299 WeakPolarHBondContact O-CB 3.36Å; I295-L299 PolarHBondContact O-N 2.83Å; L296-L299 PolarHBondContact O-N 3.3Å; L299-S301 VanDerWaalsContact C-N 3.28Å; L299-S301 PolarHBondContact O-N 3.25Å; L299-A302 PolarHBondContact O-N 2.94Å; L299-V303 WeakPolarHBondContact O-CG2 3.39Å; L299-V303 PolarHBondContact O-N 3.47Å
300	L	91.9	Very high	89	Confident	35 Å²	35	36 Å²	36	18%	0.183	20%	0.202	C	C	.	.	H	α-helix	trans	-58.9	-41.9	172.8	-76.4	169.7	0	0	0	111.3	V275 L296 V303 K304	V275-L300 HydrophobicContact CG2-CD1 3.89Å; L296-L300 HydrophobicContact CG-CD1 4.2Å; L296-L300 WeakPolarHBondContact O-CB 3.42Å; L296-L300 WeakPolarHBondContact O-CG 3.36Å; L296-L300 PolarHBondContact O-N 3.45Å; L300-V303 PolarHBondContact O-N 3.48Å; L300-K304 WeakPolarHBondContact O-CB 3.41Å; L300-K304 PolarHBondContact O-N 2.97Å
301	S	90.3	Very high	89.3	Confident	1 Å²	1	33 Å²	33	1%	0.007	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-43.5	175.4	-60.7	0	0	0	0	111.7	E272 F276 A297 E298 L299 K304 R305	E272-S301 VanDerWaalsContact CD-OG 3.24Å; E272-S301 WeakPolarHBondContact CG-OG 3.31Å; F276-S301 WeakPolarHBondContact CE2-OG 3.26Å; A297-S301 WeakPolarHBondContact O-CB 3.2Å; A297-S301 PolarHBondContact O-N 2.93Å; A297-S301 PolarHBondContact O-OG 3.27Å; E298-S301 WeakPolarHBondContact O-CB 3.19Å; E298-S301 PolarHBondContact O-N 3.36Å; L299-S301 VanDerWaalsContact C-N 3.28Å; L299-S301 PolarHBondContact O-N 3.25Å; S301-K304 PolarHBondContact O-N 3.12Å; S301-R305 VanDerWaalsContact O-CB 3.26Å; S301-R305 WeakPolarHBondContact O-CB 3.4Å; S301-R305 WeakPolarHBondContact O-CG 3.38Å; S301-R305 PolarHBondContact O-N 3.44Å
302	A	91.4	Very high	89.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-44.6	177.4	0	0	0	0	0	111.9	E298 L299 R305 S306 L341	E298-A302 PolarHBondContact O-N 3.1Å; L299-A302 PolarHBondContact O-N 2.94Å; A302-R305 PolarHBondContact O-N 2.78Å; A302-S306 PolarHBondContact O-N 3.48Å; A302-L341 HydrophobicContact CB-CD1 4.13Å
303	V	94.1	Very high	90	Very high	43 Å²	43	27.6 Å²	27.6	26%	0.261	15%	0.146	S	C	.	.	H	α-helix	trans	-63.3	-45.7	175	-179	0	0	0	0	110.9	L268 L299 L300 R305 S306 L307 L341	L268-V303 HydrophobicContact CD2-CB 3.86Å; L268-V303 HydrophobicContact CD2-CG1 3.43Å; L268-V303 VanDerWaalsContact CD2-CG1 3.43Å; L299-V303 WeakPolarHBondContact O-CG2 3.39Å; L299-V303 PolarHBondContact O-N 3.47Å; L300-V303 PolarHBondContact O-N 3.48Å; V303-R305 VanDerWaalsContact C-N 3.33Å; V303-R305 PolarHBondContact O-N 3.21Å; V303-S306 PolarHBondContact O-N 3.21Å; V303-S306 PolarHBondContact O-OG 3.1Å; V303-L307 HydrophobicContact CG1-CD1 3.96Å; V303-L307 HydrophobicContact CG1-CG 4.16Å; V303-L307 WeakPolarHBondContact O-CB 3.46Å; V303-L307 VanDerWaalsContact O-CG 3.28Å; V303-L307 WeakPolarHBondContact O-CG 3.4Å; V303-L307 PolarHBondContact O-N 2.93Å; V303-L341 HydrophobicContact CB-CD1 4.33Å; V303-L341 HydrophobicContact CG2-CD1 3.78Å; V303-L341 HydrophobicContact CG2-CD2 4.45Å
304	K	92.6	Very high	90.2	Very high	12 Å²	12	26.7 Å²	26.7	5%	0.052	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-46.5	176.4	-174.4	-167.1	67	68	0	111.3	V265 L268 E272 L300 S301 L307 A308 F449	V265-K304 HydrophobicContact CG1-CG 4.31Å; L268-K304 HydrophobicContact CB-CB 4.15Å; L268-K304 HydrophobicContact CB-CG 4.27Å; L268-K304 HydrophobicContact CD2-CB 4.28Å; E272-K304 VanDerWaalsContact OE2-CD 3.23Å; E272-K304 WeakPolarHBondContact OE2-CD 3.4Å; E272-K304 WeakPolarHBondContact OE2-CE 3.3Å; E272-K304 IonicContact OE2-NZ 3.98Å; L300-K304 WeakPolarHBondContact O-CB 3.41Å; L300-K304 PolarHBondContact O-N 2.97Å; S301-K304 PolarHBondContact O-N 3.12Å; K304-L307 PolarHBondContact O-N 3.44Å; K304-A308 VanDerWaalsContact O-CB 3.29Å; K304-A308 WeakPolarHBondContact O-CB 3.21Å; K304-A308 PolarHBondContact O-N 3.43Å; K304-F449 HydrophobicContact CD-CE1 4.05Å; K304-F449 HydrophobicContact CD-CZ 4.25Å; K304-F449 HydrophobicContact CG-CZ 4.31Å
305	R	89.1	Confident	90.3	Very high	51 Å²	51	26.4 Å²	26.4	19%	0.192	14%	0.135	C	C	.	.	H	α-helix	trans	-61.3	-41.4	178.8	-80.1	179.2	-157.9	158.8	14.3	111.8	E298 S301 A302 V303 R309 Y340	E298-R305 IonicContact OE1-CZ 3.84Å; E298-R305 IonicContact OE1-NH1 3.54Å; E298-R305 IonicContact OE1-NH2 2.68Å; E298-R305 PolarHBondContact OE1-NH2 3.22Å; S301-R305 VanDerWaalsContact O-CB 3.26Å; S301-R305 WeakPolarHBondContact O-CB 3.4Å; S301-R305 WeakPolarHBondContact O-CG 3.38Å; S301-R305 PolarHBondContact O-N 3.44Å; A302-R305 PolarHBondContact O-N 2.78Å; V303-R305 VanDerWaalsContact C-N 3.33Å; V303-R305 PolarHBondContact O-N 3.21Å; R305-R309 WeakPolarHBondContact O-CG 3.46Å; R305-R309 PolarHBondContact O-N 3.44Å; R305-R309 PolarHBondContact O-NH1 2.99Å; R305-Y340 HydrophobicContact CB-CE1 4.14Å
306	S	92.1	Very high	90.2	Very high	6 Å²	6	24 Å²	24	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-68.6	-48.7	177.7	77.2	0	0	0	0	111.3	A302 V303 A308 R309 T310	A302-S306 PolarHBondContact O-N 3.48Å; V303-S306 PolarHBondContact O-N 3.21Å; V303-S306 PolarHBondContact O-OG 3.1Å; S306-A308 VanDerWaalsContact C-N 3.32Å; S306-A308 PolarHBondContact O-N 2.91Å; S306-R309 PolarHBondContact O-N 3.19Å; S306-T310 WeakPolarHBondContact O-CB 3.48Å; S306-T310 PolarHBondContact O-N 3.43Å; S306-T310 PolarHBondContact O-OG1 3.35Å; S306-T310 VanDerWaalsContact O-OG1 3.14Å
307	L	91.7	Very high	90.1	Very high	32 Å²	32	20.9 Å²	20.9	17%	0.168	11%	0.106	C	C	.	.	H	α-helix	trans	-58.6	-43.3	178.6	-72.7	-176.1	0	0	0	112	W261 V265 L268 V303 K304 T310 L311	W261-L307 HydrophobicContact CE3-CD2 4.02Å; W261-L307 HydrophobicContact CZ3-CD2 3.55Å; V265-L307 HydrophobicContact CG2-CB 3.95Å; L268-L307 HydrophobicContact CD1-CD1 4.27Å; L268-L307 HydrophobicContact CD2-CD1 3.89Å; V303-L307 HydrophobicContact CG1-CD1 3.96Å; V303-L307 HydrophobicContact CG1-CG 4.16Å; V303-L307 WeakPolarHBondContact O-CB 3.46Å; V303-L307 VanDerWaalsContact O-CG 3.28Å; V303-L307 WeakPolarHBondContact O-CG 3.4Å; V303-L307 PolarHBondContact O-N 2.93Å; K304-L307 PolarHBondContact O-N 3.44Å; L307-T310 PolarHBondContact O-N 3.25Å; L307-L311 WeakPolarHBondContact O-CB 3.35Å; L307-L311 PolarHBondContact O-N 3.45Å
308	A	90.8	Very high	89.8	Confident	14 Å²	14	20.9 Å²	20.9	12%	0.116	11%	0.106	C	C	.	.	H	α-helix	trans	-63.2	-44	177.8	0	0	0	0	0	112.3	V265 K304 S306 L311 V312 F449	V265-A308 HydrophobicContact CG1-CB 4.24Å; K304-A308 VanDerWaalsContact O-CB 3.29Å; K304-A308 WeakPolarHBondContact O-CB 3.21Å; K304-A308 PolarHBondContact O-N 3.43Å; S306-A308 VanDerWaalsContact C-N 3.32Å; S306-A308 PolarHBondContact O-N 2.91Å; A308-L311 WeakPolarHBondContact O-CB 3.29Å; A308-L311 PolarHBondContact O-N 2.98Å; A308-V312 WeakPolarHBondContact O-CG2 3.27Å; A308-V312 PolarHBondContact O-N 3.06Å; A308-F449 HydrophobicContact CB-CE2 3.56Å; A308-F449 HydrophobicContact CB-CZ 3.77Å
309	R	89.5	Confident	89.3	Confident	65 Å²	65	22.4 Å²	22.4	25%	0.245	11%	0.112	C	C	.	.	H	α-helix	trans	-65	-45.5	176.9	-74.3	179.9	175.8	89	-11.5	111.7	R305 S306 L311 V312 I313 Y340 D371	R305-R309 WeakPolarHBondContact O-CG 3.46Å; R305-R309 PolarHBondContact O-N 3.44Å; R305-R309 PolarHBondContact O-NH1 2.99Å; S306-R309 PolarHBondContact O-N 3.19Å; R309-L311 VanDerWaalsContact C-N 3.3Å; R309-L311 PolarHBondContact O-N 3.02Å; R309-V312 PolarHBondContact O-N 3.11Å; R309-I313 WeakPolarHBondContact O-CD1 3.29Å; R309-I313 VanDerWaalsContact O-CG1 3.27Å; R309-I313 WeakPolarHBondContact O-CG1 3.48Å; R309-I313 PolarHBondContact O-N 3.3Å; R309-Y340 VanDerWaalsContact NH1-CE1 3.27Å; R309-Y340 PolarHBondContact NH1-OH 2.97Å; R309-Y340 PolarHBondContact NH2-OH 3.22Å; R309-D371 IonicContact CZ-OD1 3Å; R309-D371 IonicContact NE-OD1 3.15Å; R309-D371 PolarHBondContact NE-OD1 2.96Å; R309-D371 VanDerWaalsContact NH2-CG 3.3Å; R309-D371 IonicContact NH2-OD1 3.12Å; R309-D371 PolarHBondContact NH2-OD1 3.47Å; R309-D371 IonicContact NH2-OD2 3.04Å; R309-D371 PolarHBondContact NH2-OD2 3.47Å; R309-D371 VanDerWaalsContact NH2-OD2 3.1Å
310	T	90.7	Very high	88.3	Confident	16 Å²	16	19.3 Å²	19.3	10%	0.098	10%	0.101	C	C	.	.	H	α-helix	trans	-57.6	-44	174.6	-64.2	0	0	0	0	111.2	S306 L307 I313 I314 V333 G337	S306-T310 WeakPolarHBondContact O-CB 3.48Å; S306-T310 PolarHBondContact O-N 3.43Å; S306-T310 PolarHBondContact O-OG1 3.35Å; S306-T310 VanDerWaalsContact O-OG1 3.14Å; L307-T310 PolarHBondContact O-N 3.25Å; T310-I313 PolarHBondContact O-N 2.97Å; T310-I314 HydrophobicContact CG2-CD1 3.72Å; T310-I314 HydrophobicContact CG2-CG1 4.39Å; T310-I314 WeakPolarHBondContact O-CB 3.34Å; T310-I314 WeakPolarHBondContact O-CG1 3.34Å; T310-I314 PolarHBondContact O-N 3.33Å; T310-V333 HydrophobicContact CG2-CG1 3.95Å; T310-G337 WeakPolarHBondContact OG1-CA 3.36Å
311	L	89.9	Confident	87.1	Confident	12 Å²	12	18.7 Å²	18.7	6%	0.063	10%	0.097	C	C	.	.	H	α-helix	trans	-60.1	-49.1	176.5	-172.5	162.9	0	0	0	111.6	W261 I262 V265 L307 A308 R309 I313 I314 V315	W261-L311 HydrophobicContact CB-CD1 4.04Å; I262-L311 HydrophobicContact CB-CD1 4.39Å; I262-L311 HydrophobicContact CG1-CD1 3.74Å; I262-L311 HydrophobicContact CG1-CD2 4.39Å; V265-L311 HydrophobicContact CG2-CD1 4.03Å; L307-L311 WeakPolarHBondContact O-CB 3.35Å; L307-L311 PolarHBondContact O-N 3.45Å; A308-L311 WeakPolarHBondContact O-CB 3.29Å; A308-L311 PolarHBondContact O-N 2.98Å; R309-L311 VanDerWaalsContact C-N 3.3Å; R309-L311 PolarHBondContact O-N 3.02Å; L311-I313 VanDerWaalsContact C-N 3.3Å; L311-I313 PolarHBondContact O-N 2.86Å; L311-I314 PolarHBondContact O-N 3.13Å; L311-V315 HydrophobicContact CD2-CG2 3.91Å; L311-V315 WeakPolarHBondContact O-CB 3.46Å; L311-V315 WeakPolarHBondContact O-CG2 3.45Å; L311-V315 PolarHBondContact O-N 2.88Å
312	V	89.3	Confident	85.8	Confident	22 Å²	22	19.7 Å²	19.7	13%	0.133	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-38.2	179.1	170.7	0	0	0	0	111.7	A308 R309 S316 I378 F404 I456	A308-V312 WeakPolarHBondContact O-CG2 3.27Å; A308-V312 PolarHBondContact O-N 3.06Å; R309-V312 PolarHBondContact O-N 3.11Å; V312-S316 VanDerWaalsContact O-CB 3.28Å; V312-S316 WeakPolarHBondContact O-CB 3.48Å; V312-S316 PolarHBondContact O-N 3.5Å; V312-S316 PolarHBondContact O-OG 3.35Å; V312-I378 HydrophobicContact CB-CD1 4.5Å; V312-I378 HydrophobicContact CG1-CD1 3.73Å; V312-I378 HydrophobicContact CG1-CG1 4.11Å; V312-I378 HydrophobicContact CG1-CG2 3.98Å; V312-F404 HydrophobicContact CG1-CZ 4.26Å; V312-I456 HydrophobicContact CG2-CD1 4.43Å
313	I	90.4	Very high	84.6	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-48.6	175.7	-66.9	161.2	0	0	0	110.7	R309 T310 L311 V315 S316 L317 V333 L374 I378	R309-I313 WeakPolarHBondContact O-CD1 3.29Å; R309-I313 VanDerWaalsContact O-CG1 3.27Å; R309-I313 WeakPolarHBondContact O-CG1 3.48Å; R309-I313 PolarHBondContact O-N 3.3Å; T310-I313 PolarHBondContact O-N 2.97Å; L311-I313 VanDerWaalsContact C-N 3.3Å; L311-I313 PolarHBondContact O-N 2.86Å; I313-V315 VanDerWaalsContact C-N 3.29Å; I313-V315 PolarHBondContact O-N 3.43Å; I313-S316 PolarHBondContact O-N 2.97Å; I313-S316 VanDerWaalsContact O-N 3.15Å; I313-L317 HydrophobicContact CG2-CD1 3.88Å; I313-L317 HydrophobicContact CG2-CG 4.44Å; I313-L317 WeakPolarHBondContact O-CG 3.2Å; I313-L317 PolarHBondContact O-N 3.24Å; I313-V333 HydrophobicContact CB-CG1 4.46Å; I313-V333 HydrophobicContact CG2-CG1 4.02Å; I313-V333 HydrophobicContact CG2-CG2 3.74Å; I313-L374 HydrophobicContact CD1-CB 4.48Å; I313-L374 HydrophobicContact CD1-CD2 3.47Å; I313-L374 VanDerWaalsContact CD1-CD2 3.47Å; I313-L374 HydrophobicContact CD1-CG 4.38Å; I313-I378 HydrophobicContact CG1-CD1 3.99Å; I313-I378 HydrophobicContact CG1-CG1 3.6Å
314	I	89.1	Confident	83.2	Confident	13 Å²	13	27.2 Å²	27.2	7%	0.067	14%	0.142	C	C	.	.	H	α-helix	trans	-58	-44.4	178.8	-72.4	172.2	0	0	0	110.8	I258 T310 L311 L317 G318 Y319 V333	I258-I314 HydrophobicContact CD1-CG2 4.4Å; I258-I314 HydrophobicContact CG1-CG2 4.42Å; T310-I314 HydrophobicContact CG2-CD1 3.72Å; T310-I314 HydrophobicContact CG2-CG1 4.39Å; T310-I314 WeakPolarHBondContact O-CB 3.34Å; T310-I314 WeakPolarHBondContact O-CG1 3.34Å; T310-I314 PolarHBondContact O-N 3.33Å; L311-I314 PolarHBondContact O-N 3.13Å; I314-L317 PolarHBondContact O-N 2.97Å; I314-G318 PolarHBondContact O-N 3.46Å; I314-Y319 HydrophobicContact CG2-CD1 3.39Å; I314-Y319 HydrophobicContact CG2-CE1 4.42Å; I314-Y319 HydrophobicContact CG2-CG 3.87Å; I314-Y319 WeakPolarHBondContact O-CB 3.43Å; I314-Y319 PolarHBondContact O-N 2.91Å; I314-V333 HydrophobicContact CD1-CG1 4.37Å; I314-V333 HydrophobicContact CG1-CG1 3.88Å
315	V	87	Confident	82.1	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-45.7	175.8	163	0	0	0	0	111.1	I258 L311 I313 L317 G318 Y401 F404 W460	I258-V315 HydrophobicContact CG2-CG2 4.05Å; L311-V315 HydrophobicContact CD2-CG2 3.91Å; L311-V315 WeakPolarHBondContact O-CB 3.46Å; L311-V315 WeakPolarHBondContact O-CG2 3.45Å; L311-V315 PolarHBondContact O-N 2.88Å; I313-V315 VanDerWaalsContact C-N 3.29Å; I313-V315 PolarHBondContact O-N 3.43Å; V315-L317 VanDerWaalsContact C-N 3.29Å; V315-L317 PolarHBondContact O-N 3.46Å; V315-G318 PolarHBondContact O-N 2.68Å; V315-Y401 WeakPolarHBondContact O-CE1 3.25Å; V315-Y401 PolarHBondContact O-OH 2.83Å; V315-F404 HydrophobicContact CG1-CD1 4.38Å; V315-F404 HydrophobicContact CG1-CE1 3.91Å; V315-F404 HydrophobicContact CG1-CE2 4.3Å; V315-F404 HydrophobicContact CG1-CZ 3.85Å; V315-W460 HydrophobicContact CB-CZ2 4.19Å; V315-W460 HydrophobicContact CG1-CH2 4.34Å; V315-W460 HydrophobicContact CG1-CZ2 3.5Å; V315-W460 VanDerWaalsContact CG1-CZ2 3.5Å; V315-W460 HydrophobicContact CG2-CH2 4.04Å; V315-W460 HydrophobicContact CG2-CZ2 3.79Å
316	S	87	Confident	80.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-32.2	179.7	-60.1	0	0	0	0	113.3	V312 I313 G318 S381 T385	V312-S316 VanDerWaalsContact O-CB 3.28Å; V312-S316 WeakPolarHBondContact O-CB 3.48Å; V312-S316 PolarHBondContact O-N 3.5Å; V312-S316 PolarHBondContact O-OG 3.35Å; I313-S316 PolarHBondContact O-N 2.97Å; I313-S316 VanDerWaalsContact O-N 3.15Å; S316-G318 PolarHBondContact O-N 3.04Å; S316-S381 CarbonylContact O-C 3.42Å; S316-T385 PolarHBondContact O-OG1 3.32Å
317	L	87.2	Confident	80.4	Confident	25 Å²	25	37.8 Å²	37.8	13%	0.131	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-10.3	174.3	-72.5	167.9	0	0	0	113.8	I313 I314 V315 L326 T329 V333 S381	I313-L317 HydrophobicContact CG2-CD1 3.88Å; I313-L317 HydrophobicContact CG2-CG 4.44Å; I313-L317 WeakPolarHBondContact O-CG 3.2Å; I313-L317 PolarHBondContact O-N 3.24Å; I314-L317 PolarHBondContact O-N 2.97Å; V315-L317 VanDerWaalsContact C-N 3.29Å; V315-L317 PolarHBondContact O-N 3.46Å; L317-L326 HydrophobicContact CB-CD2 4.16Å; L317-L326 HydrophobicContact CD1-CD2 3.78Å; L317-T329 HydrophobicContact CD1-CG2 3.97Å; L317-T329 HydrophobicContact CD2-CG2 4.27Å; L317-V333 HydrophobicContact CD1-CG2 3.59Å; L317-S381 WeakPolarHBondContact CD2-OG 3.41Å
318	G	82.7	Confident	80	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	15.7	-179.2	0	0	0	0	0	114.7	I314 V315 S316 I321 V322 K323 Y401	I314-G318 PolarHBondContact O-N 3.46Å; V315-G318 PolarHBondContact O-N 2.68Å; S316-G318 PolarHBondContact O-N 3.04Å; G318-I321 PolarHBondContact O-N 3.46Å; G318-V322 WeakPolarHBondContact O-CA 3.38Å; G318-V322 WeakPolarHBondContact O-CB 3.44Å; G318-V322 PolarHBondContact O-N 3.34Å; G318-K323 PolarHBondContact O-N 3.37Å; G318-Y401 WeakPolarHBondContact CA-OH 3.49Å
319	Y	77.7	Confident	79.8	Confident	33 Å²	33	43.3 Å²	43.3	13%	0.129	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-59	141.9	175.8	-176.2	-119.3	0	0	0	110.4	I258 I314 I321 L326	I258-Y319 HydrophobicContact CD1-CD1 4.1Å; I258-Y319 WeakPolarHBondContact CD1-O 3.48Å; I258-Y319 HydrophobicContact CG1-CD1 4.12Å; I314-Y319 HydrophobicContact CG2-CD1 3.39Å; I314-Y319 HydrophobicContact CG2-CE1 4.42Å; I314-Y319 HydrophobicContact CG2-CG 3.87Å; I314-Y319 WeakPolarHBondContact O-CB 3.43Å; I314-Y319 PolarHBondContact O-N 2.91Å; Y319-I321 PolarHBondContact O-N 3.33Å; Y319-L326 HydrophobicContact CD2-CB 4.03Å; Y319-L326 HydrophobicContact CD2-CD1 3.85Å; Y319-L326 HydrophobicContact CD2-CD2 4.46Å; Y319-L326 HydrophobicContact CD2-CG 4.33Å; Y319-L326 HydrophobicContact CE2-CB 4.5Å; Y319-L326 HydrophobicContact CG-CD1 4.23Å; Y319-L326 HydrophobicContact CG-CD2 4.43Å
320	G	69.6	Low	79.7	Confident	19 Å²	19	43.1 Å²	43.1	20%	0.196	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	-20.6	176.3	0	0	0	0	0	116	K323	G320-K323 PolarHBondContact N-O 2.98Å
321	I	66.8	Low	79.6	Confident	22 Å²	22	48.8 Å²	48.8	11%	0.113	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-42.9	177.8	-63.8	-172.9	0	0	0	112.6	G318 Y319 K397 Y401 W460	G318-I321 PolarHBondContact O-N 3.46Å; Y319-I321 PolarHBondContact O-N 3.33Å; I321-K397 HydrophobicContact CG2-CB 4.45Å; I321-K397 HydrophobicContact CG2-CD 3.57Å; I321-K397 HydrophobicContact CG2-CG 3.83Å; I321-K397 PolarHBondContact O-NZ 3.45Å; I321-Y401 HydrophobicContact CD1-CE2 4.43Å; I321-Y401 HydrophobicContact CG2-CE2 4.27Å; I321-W460 HydrophobicContact CD1-CE3 4.3Å; I321-W460 HydrophobicContact CD1-CH2 3.11Å; I321-W460 HydrophobicContact CD1-CZ2 3.69Å; I321-W460 HydrophobicContact CD1-CZ3 3.46Å; I321-W460 VanDerWaalsContact CD1-CZ3 3.46Å; I321-W460 HydrophobicContact CG1-CH2 3.71Å; I321-W460 HydrophobicContact CG1-CZ3 3.91Å
322	V	63.4	Low	79.7	Confident	22 Å²	22	53.8 Å²	53.8	13%	0.133	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-34.4	-172.2	-170.8	0	0	0	0	111.5	G318 T385 L388 L389 Y401	G318-V322 WeakPolarHBondContact O-CA 3.38Å; G318-V322 WeakPolarHBondContact O-CB 3.44Å; G318-V322 PolarHBondContact O-N 3.34Å; V322-T385 HydrophobicContact CG2-CG2 3.96Å; V322-L388 HydrophobicContact CG1-CD2 3.83Å; V322-L389 HydrophobicContact CG1-CD2 4.34Å; V322-L389 HydrophobicContact CG2-CD1 4.07Å; V322-L389 HydrophobicContact CG2-CD2 3.87Å; V322-L389 HydrophobicContact CG2-CG 4.15Å; V322-Y401 HydrophobicContact CG2-CE2 4.3Å
323	K	66.4	Low	79.9	Confident	108 Å²	108	52.9 Å²	52.9	47%	0.47	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-127.6	122.1	177.2	-65.7	-175.1	178.4	-177.2	0	110.2	G318 G320 R325 L326	G318-K323 PolarHBondContact O-N 3.37Å; G320-K323 PolarHBondContact N-O 2.98Å; K323-R325 VanDerWaalsContact C-N 3.3Å; K323-R325 PolarHBondContact O-N 3.49Å; K323-L326 HydrophobicContact CB-CD1 4.27Å
324	P	63.5	Low	79.9	Confident	93 Å²	93	56.7 Å²	56.7	60%	0.604	30%	0.299	S	S	*	.	S	Bend	trans	-71.4	-24.8	-178.2	27.4	-33.8	0	0	0	112.7	F471	P324-F471 HydrophobicContact CB-CE1 4.06Å
325	R	69.4	Low	80.2	Confident	223 Å²	223	60.8 Å²	60.8	84%	0.842	33%	0.325	S	S	*	.			trans	-138.2	133.3	178	-62.2	-175.6	179.5	173.9	0.6	110.2	K323	K323-R325 VanDerWaalsContact C-N 3.3Å; K323-R325 PolarHBondContact O-N 3.49Å
326	L	65.3	Low	80.5	Confident	16 Å²	16	61.7 Å²	61.7	8%	0.084	33%	0.333	C	S	.	.			trans	-94.7	2.3	-177.9	-125.3	66.5	0	0	0	113.9	L317 Y319 K323 V328 T329 L330	L317-L326 HydrophobicContact CB-CD2 4.16Å; L317-L326 HydrophobicContact CD1-CD2 3.78Å; Y319-L326 HydrophobicContact CD2-CB 4.03Å; Y319-L326 HydrophobicContact CD2-CD1 3.85Å; Y319-L326 HydrophobicContact CD2-CD2 4.46Å; Y319-L326 HydrophobicContact CD2-CG 4.33Å; Y319-L326 HydrophobicContact CE2-CB 4.5Å; Y319-L326 HydrophobicContact CG-CD1 4.23Å; Y319-L326 HydrophobicContact CG-CD2 4.43Å; K323-L326 HydrophobicContact CB-CD1 4.27Å; L326-V328 PolarHBondContact O-N 3.28Å; L326-T329 VanDerWaalsContact O-CB 3.29Å; L326-T329 WeakPolarHBondContact O-CB 3.24Å; L326-T329 PolarHBondContact O-N 3.14Å; L326-L330 HydrophobicContact CB-CB 4.04Å; L326-L330 PolarHBondContact O-N 3.43Å
327	G	80.3	Confident	80.7	Confident	53 Å²	53	62.2 Å²	62.2	55%	0.546	34%	0.338	S	S	.	.	H	α-helix	trans	46.6	-135.4	175	0	0	0	0	0	113.5	T329 L330	G327-T329 PolarHBondContact O-N 2.78Å; G327-L330 WeakPolarHBondContact O-CB 3.49Å; G327-L330 PolarHBondContact O-N 3.39Å; G327-L330 VanDerWaalsContact O-N 3.17Å
328	V	85.1	Confident	81.1	Confident	109 Å²	109	63.8 Å²	63.8	66%	0.661	35%	0.354	S	S	*	.	H	α-helix	trans	-61.1	-27.3	178.7	-175.6	0	0	0	0	112.7	L326 L330 H331 K332	L326-V328 PolarHBondContact O-N 3.28Å; V328-L330 VanDerWaalsContact C-N 3.26Å; V328-L330 PolarHBondContact O-N 2.93Å; V328-H331 PolarHBondContact O-N 3.24Å; V328-K332 PolarHBondContact O-N 3.38Å
329	T	86.1	Confident	81.7	Confident	53 Å²	53	67.3 Å²	67.3	33%	0.325	37%	0.373	S	S	.	.	H	α-helix	trans	-66	-29.2	178.9	-49.8	0	0	0	0	112	L317 L326 G327 K332 V333	L317-T329 HydrophobicContact CD1-CG2 3.97Å; L317-T329 HydrophobicContact CD2-CG2 4.27Å; L326-T329 VanDerWaalsContact O-CB 3.29Å; L326-T329 WeakPolarHBondContact O-CB 3.24Å; L326-T329 PolarHBondContact O-N 3.14Å; G327-T329 PolarHBondContact O-N 2.78Å; T329-K332 PolarHBondContact O-N 3.4Å; T329-V333 WeakPolarHBondContact O-CG2 3.21Å; T329-V333 PolarHBondContact O-N 3.39Å; T329-V333 VanDerWaalsContact O-N 3.1Å
330	L	86.5	Confident	82.4	Confident	61 Å²	61	66 Å²	66	32%	0.319	37%	0.367	S	S	.	.	H	α-helix	trans	-60.9	-46.5	174.9	-173	67	0	0	0	111.2	L326 G327 V328 K332 V333 V334	L326-L330 HydrophobicContact CB-CB 4.04Å; L326-L330 PolarHBondContact O-N 3.43Å; G327-L330 WeakPolarHBondContact O-CB 3.49Å; G327-L330 PolarHBondContact O-N 3.39Å; G327-L330 VanDerWaalsContact O-N 3.17Å; V328-L330 VanDerWaalsContact C-N 3.26Å; V328-L330 PolarHBondContact O-N 2.93Å; L330-K332 VanDerWaalsContact C-N 3.31Å; L330-K332 PolarHBondContact O-N 3.02Å; L330-V333 PolarHBondContact O-N 3.35Å; L330-V333 VanDerWaalsContact O-N 3.16Å; L330-V334 WeakPolarHBondContact O-CG2 3.25Å; L330-V334 PolarHBondContact O-N 2.8Å
331	H	89.8	Confident	83.6	Confident	134 Å²	134	67.7 Å²	67.7	62%	0.62	37%	0.372	S	S	*	.	H	α-helix	trans	-61.4	-40.5	178.3	-70.8	-76.9	0	0	0	111.6	V328 V333 V334 V335	V328-H331 PolarHBondContact O-N 3.24Å; H331-V333 VanDerWaalsContact C-N 3.31Å; H331-V333 PolarHBondContact O-N 2.94Å; H331-V334 PolarHBondContact O-N 3.47Å; H331-V335 WeakPolarHBondContact O-CB 3.4Å; H331-V335 VanDerWaalsContact O-CG2 3.29Å; H331-V335 WeakPolarHBondContact O-CG2 3.31Å; H331-V335 PolarHBondContact O-N 2.96Å
332	K	92.2	Very high	84.9	Confident	118 Å²	118	71.8 Å²	71.8	51%	0.513	39%	0.394	S	S	.	.	H	α-helix	trans	-58.4	-43.3	175.1	-63.2	-178	179.6	-177.4	0	111.9	V328 T329 L330 A336 W377	V328-K332 PolarHBondContact O-N 3.38Å; T329-K332 PolarHBondContact O-N 3.4Å; L330-K332 VanDerWaalsContact C-N 3.31Å; L330-K332 PolarHBondContact O-N 3.02Å; K332-A336 WeakPolarHBondContact O-CB 3.36Å; K332-A336 PolarHBondContact O-N 3.25Å; K332-W377 HydrophobicContact CB-CH2 4.13Å
333	V	92	Very high	86.3	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.012	40%	0.396	C	S	.	.	H	α-helix	trans	-68.5	-40.5	178.9	174.6	0	0	0	0	111.9	T310 I313 I314 L317 T329 L330 H331 A336 G337	T310-V333 HydrophobicContact CG2-CG1 3.95Å; I313-V333 HydrophobicContact CB-CG1 4.46Å; I313-V333 HydrophobicContact CG2-CG1 4.02Å; I313-V333 HydrophobicContact CG2-CG2 3.74Å; I314-V333 HydrophobicContact CD1-CG1 4.37Å; I314-V333 HydrophobicContact CG1-CG1 3.88Å; L317-V333 HydrophobicContact CD1-CG2 3.59Å; T329-V333 WeakPolarHBondContact O-CG2 3.21Å; T329-V333 PolarHBondContact O-N 3.39Å; T329-V333 VanDerWaalsContact O-N 3.1Å; L330-V333 PolarHBondContact O-N 3.35Å; L330-V333 VanDerWaalsContact O-N 3.16Å; H331-V333 VanDerWaalsContact C-N 3.31Å; H331-V333 PolarHBondContact O-N 2.94Å; V333-A336 PolarHBondContact O-N 3.13Å; V333-G337 PolarHBondContact O-N 3.24Å
334	V	91.8	Very high	87.3	Confident	84 Å²	84	67.6 Å²	67.6	51%	0.509	37%	0.374	S	S	.	.	H	α-helix	trans	-63.8	-44.6	176.6	172.5	0	0	0	0	110.8	L330 H331 G337 A338	L330-V334 WeakPolarHBondContact O-CG2 3.25Å; L330-V334 PolarHBondContact O-N 2.8Å; H331-V334 PolarHBondContact O-N 3.47Å; V334-G337 PolarHBondContact O-N 3.44Å; V334-A338 WeakPolarHBondContact O-CB 3.49Å; V334-A338 PolarHBondContact O-N 3.41Å
335	V	93.9	Very high	88.6	Confident	100 Å²	100	63.6 Å²	63.6	61%	0.606	35%	0.35	S	S	*	.	H	α-helix	trans	-62.3	-44.4	176	172.2	0	0	0	0	111	H331 G337 A338 L339	H331-V335 WeakPolarHBondContact O-CB 3.4Å; H331-V335 VanDerWaalsContact O-CG2 3.29Å; H331-V335 WeakPolarHBondContact O-CG2 3.31Å; H331-V335 PolarHBondContact O-N 2.96Å; V335-G337 VanDerWaalsContact C-N 3.34Å; V335-G337 PolarHBondContact O-N 3.34Å; V335-A338 PolarHBondContact O-N 3.16Å; V335-L339 WeakPolarHBondContact O-CB 3.49Å; V335-L339 PolarHBondContact O-N 3.11Å
336	A	93.1	Very high	89.5	Confident	21 Å²	21	56.1 Å²	56.1	17%	0.174	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-41.5	176	0	0	0	0	0	112.3	K332 V333 Y340 L374	K332-A336 WeakPolarHBondContact O-CB 3.36Å; K332-A336 PolarHBondContact O-N 3.25Å; V333-A336 PolarHBondContact O-N 3.13Å; A336-Y340 WeakPolarHBondContact O-CB 3.48Å; A336-Y340 PolarHBondContact O-N 3.01Å; A336-L374 HydrophobicContact CB-CD2 4.18Å
337	G	93	Very high	90.6	Very high	10 Å²	10	56.9 Å²	56.9	10%	0.103	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-41.2	175.7	0	0	0	0	0	113.3	T310 V333 V334 V335 Y340 L341	T310-G337 WeakPolarHBondContact OG1-CA 3.36Å; V333-G337 PolarHBondContact O-N 3.24Å; V334-G337 PolarHBondContact O-N 3.44Å; V335-G337 VanDerWaalsContact C-N 3.34Å; V335-G337 PolarHBondContact O-N 3.34Å; G337-Y340 PolarHBondContact O-N 3.49Å; G337-L341 WeakPolarHBondContact O-CB 3.16Å; G337-L341 PolarHBondContact O-N 3.08Å
338	A	94.8	Very high	90.7	Very high	58 Å²	58	54.3 Å²	54.3	48%	0.479	30%	0.302	S	S	.	.	H	α-helix	trans	-66.3	-42.4	176.3	0	0	0	0	0	111.8	V334 V335 L341 L342	V334-A338 WeakPolarHBondContact O-CB 3.49Å; V334-A338 PolarHBondContact O-N 3.41Å; V335-A338 PolarHBondContact O-N 3.16Å; A338-L341 PolarHBondContact O-N 3.28Å; A338-L342 PolarHBondContact O-N 3.29Å
339	L	94.7	Very high	90.8	Very high	75 Å²	75	51.7 Å²	51.7	39%	0.393	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-44.4	175.7	-169.5	66	0	0	0	111.1	V335 L341 L342 F343 L370	V335-L339 WeakPolarHBondContact O-CB 3.49Å; V335-L339 PolarHBondContact O-N 3.11Å; L339-L341 VanDerWaalsContact C-N 3.34Å; L339-L341 PolarHBondContact O-N 3.38Å; L339-L342 PolarHBondContact O-N 3.07Å; L339-F343 HydrophobicContact CD1-CD2 4.08Å; L339-F343 HydrophobicContact CD1-CE2 3.54Å; L339-F343 HydrophobicContact CD2-CE2 4.49Å; L339-F343 HydrophobicContact CG-CD2 4.02Å; L339-F343 HydrophobicContact CG-CE2 3.81Å; L339-F343 VanDerWaalsContact O-CD2 3.29Å; L339-F343 WeakPolarHBondContact O-CD2 3.4Å; L339-F343 PolarHBondContact O-N 3.18Å; L339-F343 VanDerWaalsContact O-N 3.15Å; L339-L370 HydrophobicContact CD2-CD1 4.26Å; L339-L370 HydrophobicContact CD2-CD2 3.86Å; L339-L370 HydrophobicContact CG-CD1 4.06Å
340	Y	92.6	Very high	90.7	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-44.2	174.6	-176.1	-85.6	0	0	0	111.8	R305 R309 A336 G337 L342 S344 L367 L370 D371 L374	R305-Y340 HydrophobicContact CB-CE1 4.14Å; R309-Y340 VanDerWaalsContact NH1-CE1 3.27Å; R309-Y340 PolarHBondContact NH1-OH 2.97Å; R309-Y340 PolarHBondContact NH2-OH 3.22Å; A336-Y340 WeakPolarHBondContact O-CB 3.48Å; A336-Y340 PolarHBondContact O-N 3.01Å; G337-Y340 PolarHBondContact O-N 3.49Å; Y340-L342 VanDerWaalsContact C-N 3.32Å; Y340-L342 PolarHBondContact O-N 3.47Å; Y340-S344 WeakPolarHBondContact O-CB 3.25Å; Y340-S344 PolarHBondContact O-N 3.37Å; Y340-L367 HydrophobicContact CD2-CD1 3.96Å; Y340-L367 HydrophobicContact CE2-CD1 3.42Å; Y340-L367 VanDerWaalsContact CE2-CD1 3.42Å; Y340-L367 HydrophobicContact CE2-CG 4.49Å; Y340-L370 HydrophobicContact CD2-CB 4.42Å; Y340-D371 WeakPolarHBondContact CE2-OD1 3.31Å; Y340-L374 HydrophobicContact CD2-CD1 3.82Å; Y340-L374 HydrophobicContact CG-CD1 4.28Å
341	L	94.9	Very high	90.3	Very high	55 Å²	55	49.7 Å²	49.7	29%	0.288	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-41.4	177.3	178.3	57.5	0	0	0	111.9	A302 V303 G337 A338 L339 G345	A302-L341 HydrophobicContact CB-CD1 4.13Å; V303-L341 HydrophobicContact CB-CD1 4.33Å; V303-L341 HydrophobicContact CG2-CD1 3.78Å; V303-L341 HydrophobicContact CG2-CD2 4.45Å; G337-L341 WeakPolarHBondContact O-CB 3.16Å; G337-L341 PolarHBondContact O-N 3.08Å; A338-L341 PolarHBondContact O-N 3.28Å; L339-L341 VanDerWaalsContact C-N 3.34Å; L339-L341 PolarHBondContact O-N 3.38Å; L341-G345 PolarHBondContact O-N 2.97Å
342	L	94.4	Very high	89.6	Confident	109 Å²	109	44.6 Å²	44.6	57%	0.571	25%	0.248	S	C	*	.	H	α-helix	trans	-62.2	-52.3	179.5	-176.4	124.5	0	0	0	111.4	A338 L339 Y340 G345 M346	A338-L342 PolarHBondContact O-N 3.29Å; L339-L342 PolarHBondContact O-N 3.07Å; Y340-L342 VanDerWaalsContact C-N 3.32Å; Y340-L342 PolarHBondContact O-N 3.47Å; L342-G345 PolarHBondContact O-N 2.86Å; L342-M346 VanDerWaalsContact O-CB 3.26Å; L342-M346 WeakPolarHBondContact O-CB 2.93Å; L342-M346 PolarHBondContact O-N 3.08Å
343	F	91.7	Very high	88.9	Confident	41 Å²	41	42.6 Å²	42.6	18%	0.18	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-38.8	179.2	-73.2	-70.2	0	0	0	112.6	L339 M346 E347 P366 L367 L370	L339-F343 HydrophobicContact CD1-CD2 4.08Å; L339-F343 HydrophobicContact CD1-CE2 3.54Å; L339-F343 HydrophobicContact CD2-CE2 4.49Å; L339-F343 HydrophobicContact CG-CD2 4.02Å; L339-F343 HydrophobicContact CG-CE2 3.81Å; L339-F343 VanDerWaalsContact O-CD2 3.29Å; L339-F343 WeakPolarHBondContact O-CD2 3.4Å; L339-F343 PolarHBondContact O-N 3.18Å; L339-F343 VanDerWaalsContact O-N 3.15Å; F343-M346 HydrophobicContact CD1-CE 3.76Å; F343-M346 HydrophobicContact CE1-CE 4.07Å; F343-M346 PolarHBondContact O-N 3.42Å; F343-E347 WeakPolarHBondContact O-CB 3.28Å; F343-E347 PolarHBondContact O-N 3.29Å; F343-P366 HydrophobicContact CD1-CB 3.87Å; F343-P366 HydrophobicContact CD1-CG 4.33Å; F343-P366 HydrophobicContact CE1-CB 3.67Å; F343-P366 HydrophobicContact CE1-CG 3.95Å; F343-P366 HydrophobicContact CE2-CB 4.35Å; F343-P366 HydrophobicContact CG-CB 4.32Å; F343-P366 HydrophobicContact CZ-CB 3.93Å; F343-P366 HydrophobicContact CZ-CG 4.49Å; F343-L367 HydrophobicContact CB-CB 4.3Å; F343-L367 HydrophobicContact CB-CD1 4.04Å; F343-L370 HydrophobicContact CB-CD1 4.44Å; F343-L370 HydrophobicContact CD2-CD1 3.43Å; F343-L370 VanDerWaalsContact CD2-CD1 3.43Å; F343-L370 HydrophobicContact CE2-CD1 4.01Å; F343-L370 HydrophobicContact CG-CD1 4.24Å
344	S	88.4	Confident	87.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68	-36.6	176.9	-177.3	0	0	0	0	112.5	Y340 G348	Y340-S344 WeakPolarHBondContact O-CB 3.25Å; Y340-S344 PolarHBondContact O-N 3.37Å; S344-G348 PolarHBondContact O-N 3.44Å; S344-G348 VanDerWaalsContact O-N 3.12Å
345	G	90.6	Very high	86.1	Confident	10 Å²	10	43.3 Å²	43.3	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-71.1	-41.5	175.8	0	0	0	0	0	111.5	L341 L342 G348 V349	L341-G345 PolarHBondContact O-N 2.97Å; L342-G345 PolarHBondContact O-N 2.86Å; G345-G348 PolarHBondContact O-N 3.41Å; G345-V349 WeakPolarHBondContact O-CG2 3.5Å; G345-V349 PolarHBondContact O-N 3.33Å
346	M	89.1	Confident	84.5	Confident	65 Å²	65	46.1 Å²	46.1	32%	0.32	27%	0.274	S	S	.	.	H	α-helix	trans	-61.3	-51.1	175.3	-174.5	169.1	75.2	0	0	111.2	L342 F343 G348 V349 L350 A363	L342-M346 VanDerWaalsContact O-CB 3.26Å; L342-M346 WeakPolarHBondContact O-CB 2.93Å; L342-M346 PolarHBondContact O-N 3.08Å; F343-M346 HydrophobicContact CD1-CE 3.76Å; F343-M346 HydrophobicContact CE1-CE 4.07Å; F343-M346 PolarHBondContact O-N 3.42Å; M346-G348 VanDerWaalsContact C-N 3.3Å; M346-G348 PolarHBondContact O-N 3.31Å; M346-V349 PolarHBondContact O-N 3.46Å; M346-L350 HydrophobicContact CB-CD1 4.45Å; M346-L350 HydrophobicContact CG-CD1 3.43Å; M346-L350 VanDerWaalsContact CG-CD1 3.43Å; M346-L350 WeakPolarHBondContact O-CB 3.1Å; M346-L350 WeakPolarHBondContact O-CD1 3.44Å; M346-L350 PolarHBondContact O-N 3.49Å; M346-A363 HydrophobicContact CB-CB 4.42Å; M346-A363 HydrophobicContact CE-CB 3.48Å; M346-A363 VanDerWaalsContact CE-CB 3.48Å; M346-A363 HydrophobicContact CG-CB 4Å
347	E	86.8	Confident	83.1	Confident	32 Å²	32	49.5 Å²	49.5	15%	0.15	29%	0.292	C	S	.	.	H	α-helix	trans	-54.4	-46.8	175.1	179.9	-86.8	155.2	0	0	111.5	F343 V349 L350 R351 A363 L367	F343-E347 WeakPolarHBondContact O-CB 3.28Å; F343-E347 PolarHBondContact O-N 3.29Å; E347-V349 PolarHBondContact O-N 3.43Å; E347-L350 PolarHBondContact O-N 3.32Å; E347-R351 VanDerWaalsContact O-CB 3.28Å; E347-R351 WeakPolarHBondContact O-CB 3.02Å; E347-R351 PolarHBondContact O-N 3.46Å; E347-R351 IonicContact OE1-NH1 3.1Å; E347-A363 HydrophobicContact CB-CB 4.04Å; E347-L367 HydrophobicContact CB-CD2 4.01Å; E347-L367 HydrophobicContact CG-CD2 4.14Å
348	G	83.7	Confident	82	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.8	-47.2	178	0	0	0	0	0	114.2	S344 G345 M346 R351 V352	S344-G348 PolarHBondContact O-N 3.44Å; S344-G348 VanDerWaalsContact O-N 3.12Å; G345-G348 PolarHBondContact O-N 3.41Å; M346-G348 VanDerWaalsContact C-N 3.3Å; M346-G348 PolarHBondContact O-N 3.31Å; G348-R351 PolarHBondContact O-N 3.25Å; G348-V352 WeakPolarHBondContact O-CG2 3.16Å; G348-V352 PolarHBondContact O-N 3.37Å; G348-V352 VanDerWaalsContact O-N 3.14Å
349	V	86	Confident	81.1	Confident	54 Å²	54	56.9 Å²	56.9	33%	0.327	32%	0.321	S	S	.	.	H	α-helix	trans	-68.5	-42.2	-179.9	173.3	0	0	0	0	111.7	I295 G345 M346 E347 R351 V352 T353	I295-V349 HydrophobicContact CG2-CG2 4.34Å; G345-V349 WeakPolarHBondContact O-CG2 3.5Å; G345-V349 PolarHBondContact O-N 3.33Å; M346-V349 PolarHBondContact O-N 3.46Å; E347-V349 PolarHBondContact O-N 3.43Å; V349-R351 VanDerWaalsContact C-N 3.28Å; V349-R351 PolarHBondContact O-N 3.16Å; V349-V352 PolarHBondContact O-N 2.95Å; V349-T353 WeakPolarHBondContact O-CB 3.16Å; V349-T353 PolarHBondContact O-N 2.71Å; V349-T353 PolarHBondContact O-OG1 2.88Å
350	L	84.6	Confident	80	Confident	24 Å²	24	55 Å²	55	13%	0.126	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-39.1	177.2	-88.2	89.5	0	0	0	111.2	M346 E347 T353 G354 A355 L359	M346-L350 HydrophobicContact CB-CD1 4.45Å; M346-L350 HydrophobicContact CG-CD1 3.43Å; M346-L350 VanDerWaalsContact CG-CD1 3.43Å; M346-L350 WeakPolarHBondContact O-CB 3.1Å; M346-L350 WeakPolarHBondContact O-CD1 3.44Å; M346-L350 PolarHBondContact O-N 3.49Å; E347-L350 PolarHBondContact O-N 3.32Å; L350-T353 PolarHBondContact O-N 3.25Å; L350-G354 PolarHBondContact O-N 2.92Å; L350-G354 VanDerWaalsContact O-N 3.13Å; L350-A355 HydrophobicContact CD2-CB 4.34Å; L350-A355 HydrophobicContact CG-CB 4.3Å; L350-A355 PolarHBondContact O-N 3.45Å; L350-L359 HydrophobicContact CD2-CB 3.74Å; L350-L359 HydrophobicContact CD2-CD2 4.03Å; L350-L359 HydrophobicContact CD2-CG 3.92Å; L350-L359 VanDerWaalsContact CD2-O 3.26Å; L350-L359 WeakPolarHBondContact CD2-O 3.39Å
351	R	77.4	Confident	79.2	Confident	48 Å²	48	57.3 Å²	57.3	18%	0.181	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-44.6	175.5	-174.8	176.8	74.2	-173.7	6.6	112.2	P33 E298 E347 G348 V349	P33-R351 HydrophobicContact CB-CG 4.09Å; E298-R351 IonicContact OE1-CZ 2.75Å; E298-R351 IonicContact OE1-NH2 2.68Å; E298-R351 PolarHBondContact OE1-NH2 2.86Å; E298-R351 IonicContact OE2-CZ 2.95Å; E298-R351 IonicContact OE2-NH2 3.58Å; E298-R351 PolarHBondContact OE2-NH2 3.39Å; E347-R351 VanDerWaalsContact O-CB 3.28Å; E347-R351 WeakPolarHBondContact O-CB 3.02Å; E347-R351 PolarHBondContact O-N 3.46Å; E347-R351 IonicContact OE1-NH1 3.1Å; G348-R351 PolarHBondContact O-N 3.25Å; V349-R351 VanDerWaalsContact C-N 3.28Å; V349-R351 PolarHBondContact O-N 3.16Å
352	V	76.8	Confident	78.6	Confident	26 Å²	26	60.2 Å²	60.2	16%	0.158	35%	0.348	C	S	.	.	H	α-helix	trans	-69.2	-35.7	179	172.3	0	0	0	0	112.3	Q291 L294 I295 E298 G348 V349 G354	Q291-V352 HydrophobicContact CG-CG1 4.45Å; L294-V352 HydrophobicContact CB-CG1 4.29Å; L294-V352 HydrophobicContact CD1-CG2 4.4Å; L294-V352 HydrophobicContact CD2-CB 4.32Å; L294-V352 HydrophobicContact CD2-CG1 3.57Å; L294-V352 HydrophobicContact CD2-CG2 3.99Å; L294-V352 HydrophobicContact CG-CB 4.42Å; L294-V352 HydrophobicContact CG-CG1 3.78Å; L294-V352 HydrophobicContact CG-CG2 3.74Å; I295-V352 HydrophobicContact CG1-CB 4.35Å; I295-V352 HydrophobicContact CG1-CG1 3.69Å; E298-V352 HydrophobicContact CB-CG2 4.34Å; G348-V352 WeakPolarHBondContact O-CG2 3.16Å; G348-V352 PolarHBondContact O-N 3.37Å; G348-V352 VanDerWaalsContact O-N 3.14Å; V349-V352 PolarHBondContact O-N 2.95Å; V352-G354 VanDerWaalsContact C-N 3.3Å; V352-G354 PolarHBondContact O-N 3.05Å
353	T	76.2	Confident	78.1	Confident	76 Å²	76	55 Å²	55	47%	0.466	32%	0.321	S	S	.	.	H	α-helix	trans	-81	-12.5	-176	-47.9	0	0	0	0	112.5	V349 L350 A355	V349-T353 WeakPolarHBondContact O-CB 3.16Å; V349-T353 PolarHBondContact O-N 2.71Å; V349-T353 PolarHBondContact O-OG1 2.88Å; L350-T353 PolarHBondContact O-N 3.25Å; T353-A355 PolarHBondContact O-N 2.87Å
354	G	65.1	Low	77.7	Confident	66 Å²	66	56.4 Å²	56.4	68%	0.68	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	29	-176.6	0	0	0	0	0	112.8	L350 V352	L350-G354 PolarHBondContact O-N 2.92Å; L350-G354 VanDerWaalsContact O-N 3.13Å; V352-G354 VanDerWaalsContact C-N 3.3Å; V352-G354 PolarHBondContact O-N 3.05Å
355	A	60.7	Low	77.5	Confident	36 Å²	36	61.7 Å²	61.7	30%	0.298	35%	0.354	S	S	.	.			trans	-62	150.4	-180	0	0	0	0	0	111	L350 T353	L350-A355 HydrophobicContact CD2-CB 4.34Å; L350-A355 HydrophobicContact CG-CB 4.3Å; L350-A355 PolarHBondContact O-N 3.45Å; T353-A355 PolarHBondContact O-N 2.87Å
356	Q	59.3	Low	77.4	Confident	159 Å²	159	63 Å²	63	74%	0.743	36%	0.361	S	S	*	.			trans	-45.7	141.5	-174.1	-148.7	132.7	13.1	0	0	112.7	D358 L359 A360	Q356-D358 PolarHBondContact O-N 2.86Å; Q356-L359 PolarHBondContact O-N 3.32Å; Q356-A360 PolarHBondContact O-N 3.45Å
357	T	63.8	Low	77.2	Confident	91 Å²	91	60.6 Å²	60.6	56%	0.558	35%	0.349	S	S	*	.	H	α-helix	trans	-49.4	-33	-174	46.8	0	0	0	0	113.8	S361	T357-S361 PolarHBondContact O-N 2.89Å; T357-S361 VanDerWaalsContact O-N 3.08Å; T357-S361 PolarHBondContact O-OG 2.92Å
358	D	71.3	Confident	77.2	Confident	121 Å²	121	60.9 Å²	60.9	65%	0.647	36%	0.357	S	S	*	.	H	α-helix	trans	-70	-35.8	-178.5	-60.5	-8.5	0	0	0	112	Q356 S361 L362	Q356-D358 PolarHBondContact O-N 2.86Å; D358-S361 PolarHBondContact O-OG 3.24Å; D358-L362 PolarHBondContact O-N 3.37Å
359	L	74.3	Confident	77.4	Confident	103 Å²	103	68 Å²	68	54%	0.539	39%	0.388	S	S	.	.	H	α-helix	trans	-77.6	-37.1	178.4	-140.1	74.2	0	0	0	111.2	L350 Q356 S361 L362	L350-L359 HydrophobicContact CD2-CB 3.74Å; L350-L359 HydrophobicContact CD2-CD2 4.03Å; L350-L359 HydrophobicContact CD2-CG 3.92Å; L350-L359 VanDerWaalsContact CD2-O 3.26Å; L350-L359 WeakPolarHBondContact CD2-O 3.39Å; Q356-L359 PolarHBondContact O-N 3.32Å; L359-S361 VanDerWaalsContact C-N 3.34Å; L359-S361 PolarHBondContact O-N 3.16Å; L359-L362 WeakPolarHBondContact O-CB 3.4Å; L359-L362 PolarHBondContact O-N 3.02Å
360	A	72.5	Confident	77.4	Confident	36 Å²	36	66.7 Å²	66.7	30%	0.298	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-39.9	176	0	0	0	0	0	111.9	Q356 L362 A363 F364	Q356-A360 PolarHBondContact O-N 3.45Å; A360-L362 VanDerWaalsContact C-N 3.3Å; A360-L362 PolarHBondContact O-N 3.47Å; A360-A363 PolarHBondContact O-N 3.16Å; A360-F364 PolarHBondContact O-N 3.39Å; A360-F364 VanDerWaalsContact O-N 3.16Å
361	S	76.2	Confident	77.5	Confident	52 Å²	52	67.5 Å²	67.5	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-65.2	-32.1	177.2	62.1	0	0	0	0	113.2	T357 D358 L359 A363 F364 I365	T357-S361 PolarHBondContact O-N 2.89Å; T357-S361 VanDerWaalsContact O-N 3.08Å; T357-S361 PolarHBondContact O-OG 2.92Å; D358-S361 PolarHBondContact O-OG 3.24Å; L359-S361 VanDerWaalsContact C-N 3.34Å; L359-S361 PolarHBondContact O-N 3.16Å; S361-A363 VanDerWaalsContact C-N 3.27Å; S361-A363 PolarHBondContact O-N 3.47Å; S361-F364 PolarHBondContact O-N 3.37Å; S361-I365 WeakPolarHBondContact O-CG1 3.45Å; S361-I365 PolarHBondContact O-N 3.26Å; S361-I365 VanDerWaalsContact O-N 3.11Å
362	L	82.3	Confident	77.9	Confident	115 Å²	115	67.3 Å²	67.3	60%	0.602	39%	0.388	S	S	*	.	H	α-helix	trans	-63.3	-28.9	175.5	-171.3	66.6	0	0	0	113.2	D358 L359 A360 P366	D358-L362 PolarHBondContact O-N 3.37Å; L359-L362 WeakPolarHBondContact O-CB 3.4Å; L359-L362 PolarHBondContact O-N 3.02Å; A360-L362 VanDerWaalsContact C-N 3.3Å; A360-L362 PolarHBondContact O-N 3.47Å; L362-P366 WeakPolarHBondContact O-CD 3.39Å; L362-P366 VanDerWaalsContact O-CG 3.23Å; L362-P366 WeakPolarHBondContact O-CG 3.34Å
363	A	83.2	Confident	78.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-85.4	-39.5	175.8	0	0	0	0	0	112.5	M346 E347 A360 S361 L367	M346-A363 HydrophobicContact CB-CB 4.42Å; M346-A363 HydrophobicContact CE-CB 3.48Å; M346-A363 VanDerWaalsContact CE-CB 3.48Å; M346-A363 HydrophobicContact CG-CB 4Å; E347-A363 HydrophobicContact CB-CB 4.04Å; A360-A363 PolarHBondContact O-N 3.16Å; S361-A363 VanDerWaalsContact C-N 3.27Å; S361-A363 PolarHBondContact O-N 3.47Å; A363-L367 WeakPolarHBondContact O-CB 3.49Å; A363-L367 PolarHBondContact O-N 3.22Å
364	F	82.9	Confident	78.9	Confident	70 Å²	70	65 Å²	65	31%	0.307	38%	0.378	S	S	.	.	H	α-helix	trans	-70.1	-45.1	-174.2	176.3	-96.9	0	0	0	113.3	V29 A360 S361 L367 A368	V29-F364 WeakPolarHBondContact O-CZ 3.23Å; A360-F364 PolarHBondContact O-N 3.39Å; A360-F364 VanDerWaalsContact O-N 3.16Å; S361-F364 PolarHBondContact O-N 3.37Å; F364-L367 WeakPolarHBondContact O-CB 3.4Å; F364-L367 PolarHBondContact O-N 2.93Å; F364-A368 PolarHBondContact O-N 2.96Å
365	I	85.3	Confident	79.9	Confident	111 Å²	111	65 Å²	65	57%	0.569	37%	0.367	S	S	*	.	H	α-helix	trans	-61.8	-49.6	-175.7	-63.9	164.8	0	0	0	111.5	S361 L367 A368 F369	S361-I365 WeakPolarHBondContact O-CG1 3.45Å; S361-I365 PolarHBondContact O-N 3.26Å; S361-I365 VanDerWaalsContact O-N 3.11Å; I365-L367 VanDerWaalsContact C-N 3.3Å; I365-L367 PolarHBondContact O-N 3.07Å; I365-A368 PolarHBondContact O-N 2.62Å; I365-F369 PolarHBondContact O-N 2.78Å
366	P	88.8	Confident	81.2	Confident	39 Å²	39	68.3 Å²	68.3	25%	0.253	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-35.6	175.7	-23.3	35.7	0	0	0	113	F343 L362 F369 L370	F343-P366 HydrophobicContact CD1-CB 3.87Å; F343-P366 HydrophobicContact CD1-CG 4.33Å; F343-P366 HydrophobicContact CE1-CB 3.67Å; F343-P366 HydrophobicContact CE1-CG 3.95Å; F343-P366 HydrophobicContact CE2-CB 4.35Å; F343-P366 HydrophobicContact CG-CB 4.32Å; F343-P366 HydrophobicContact CZ-CB 3.93Å; F343-P366 HydrophobicContact CZ-CG 4.49Å; L362-P366 WeakPolarHBondContact O-CD 3.39Å; L362-P366 VanDerWaalsContact O-CG 3.23Å; L362-P366 WeakPolarHBondContact O-CG 3.34Å; P366-F369 PolarHBondContact O-N 3.36Å; P366-L370 WeakPolarHBondContact O-CG 3.4Å; P366-L370 PolarHBondContact O-N 3.05Å
367	L	84.7	Confident	82.7	Confident	13 Å²	13	64.8 Å²	64.8	7%	0.068	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-43.6	178.7	-174.3	61.8	0	0	0	111.8	Y340 F343 E347 A363 F364 I365 F369 L370 D371	Y340-L367 HydrophobicContact CD2-CD1 3.96Å; Y340-L367 HydrophobicContact CE2-CD1 3.42Å; Y340-L367 VanDerWaalsContact CE2-CD1 3.42Å; Y340-L367 HydrophobicContact CE2-CG 4.49Å; F343-L367 HydrophobicContact CB-CB 4.3Å; F343-L367 HydrophobicContact CB-CD1 4.04Å; E347-L367 HydrophobicContact CB-CD2 4.01Å; E347-L367 HydrophobicContact CG-CD2 4.14Å; A363-L367 WeakPolarHBondContact O-CB 3.49Å; A363-L367 PolarHBondContact O-N 3.22Å; F364-L367 WeakPolarHBondContact O-CB 3.4Å; F364-L367 PolarHBondContact O-N 2.93Å; I365-L367 VanDerWaalsContact C-N 3.3Å; I365-L367 PolarHBondContact O-N 3.07Å; L367-F369 PolarHBondContact O-N 3.15Å; L367-L370 PolarHBondContact O-N 2.95Å; L367-D371 PolarHBondContact O-N 3.04Å
368	A	85.3	Confident	83.9	Confident	39 Å²	39	61 Å²	61	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-39.6	176.3	0	0	0	0	0	112.4	F364 I365 D371 T372	F364-A368 PolarHBondContact O-N 2.96Å; I365-A368 PolarHBondContact O-N 2.62Å; A368-D371 PolarHBondContact O-N 3.23Å; A368-T372 PolarHBondContact O-N 3.1Å; A368-T372 PolarHBondContact O-OG1 3.44Å
369	F	87.9	Confident	84.7	Confident	148 Å²	148	58 Å²	58	65%	0.649	31%	0.309	S	S	*	.	H	α-helix	trans	-63.9	-43.3	174.3	-179	-97.9	0	0	0	111.8	I365 P366 L367 T372 A373	I365-F369 PolarHBondContact O-N 2.78Å; P366-F369 PolarHBondContact O-N 3.36Å; L367-F369 PolarHBondContact O-N 3.15Å; F369-T372 WeakPolarHBondContact O-CB 3.19Å; F369-T372 PolarHBondContact O-N 3.42Å; F369-A373 WeakPolarHBondContact O-CB 3.28Å; F369-A373 PolarHBondContact O-N 3.35Å
370	L	87.9	Confident	85.4	Confident	27 Å²	27	56 Å²	56	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-43.6	175.7	-72	173.8	0	0	0	111.8	L339 Y340 F343 P366 L367 T372 A373 L374	L339-L370 HydrophobicContact CD2-CD1 4.26Å; L339-L370 HydrophobicContact CD2-CD2 3.86Å; L339-L370 HydrophobicContact CG-CD1 4.06Å; Y340-L370 HydrophobicContact CD2-CB 4.42Å; F343-L370 HydrophobicContact CB-CD1 4.44Å; F343-L370 HydrophobicContact CD2-CD1 3.43Å; F343-L370 VanDerWaalsContact CD2-CD1 3.43Å; F343-L370 HydrophobicContact CE2-CD1 4.01Å; F343-L370 HydrophobicContact CG-CD1 4.24Å; P366-L370 WeakPolarHBondContact O-CG 3.4Å; P366-L370 PolarHBondContact O-N 3.05Å; L367-L370 PolarHBondContact O-N 2.95Å; L370-T372 VanDerWaalsContact C-N 3.29Å; L370-T372 PolarHBondContact O-N 2.83Å; L370-A373 PolarHBondContact O-N 2.88Å; L370-L374 VanDerWaalsContact O-CB 3.32Å; L370-L374 WeakPolarHBondContact O-CB 3.35Å; L370-L374 WeakPolarHBondContact O-CG 3.43Å; L370-L374 PolarHBondContact O-N 2.68Å
371	D	85.6	Confident	86.2	Confident	42 Å²	42	54.5 Å²	54.5	23%	0.225	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-42.3	176.4	-89.5	-33.9	0	0	0	112.1	R309 Y340 L367 A368 C375	R309-D371 IonicContact CZ-OD1 3Å; R309-D371 IonicContact NE-OD1 3.15Å; R309-D371 PolarHBondContact NE-OD1 2.96Å; R309-D371 VanDerWaalsContact NH2-CG 3.3Å; R309-D371 IonicContact NH2-OD1 3.12Å; R309-D371 PolarHBondContact NH2-OD1 3.47Å; R309-D371 IonicContact NH2-OD2 3.04Å; R309-D371 PolarHBondContact NH2-OD2 3.47Å; R309-D371 VanDerWaalsContact NH2-OD2 3.1Å; Y340-D371 WeakPolarHBondContact CE2-OD1 3.31Å; L367-D371 PolarHBondContact O-N 3.04Å; A368-D371 PolarHBondContact O-N 3.23Å; D371-C375 WeakPolarHBondContact O-CB 3.39Å; D371-C375 PolarHBondContact O-N 2.64Å; D371-C375 PolarHBondContact O-SG 3.07Å
372	T	85.3	Confident	86.7	Confident	44 Å²	44	52.1 Å²	52.1	27%	0.27	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-50.6	174.8	-59	0	0	0	0	111.9	L17 A368 F369 L370 L374 C375 W376	L17-T372 HydrophobicContact CD1-CG2 3.29Å; L17-T372 VanDerWaalsContact CD1-OG1 3.22Å; L17-T372 WeakPolarHBondContact CD1-OG1 3.4Å; L17-T372 WeakPolarHBondContact CD2-OG1 3.19Å; A368-T372 PolarHBondContact O-N 3.1Å; A368-T372 PolarHBondContact O-OG1 3.44Å; F369-T372 WeakPolarHBondContact O-CB 3.19Å; F369-T372 PolarHBondContact O-N 3.42Å; L370-T372 VanDerWaalsContact C-N 3.29Å; L370-T372 PolarHBondContact O-N 2.83Å; T372-L374 VanDerWaalsContact C-N 3.34Å; T372-L374 PolarHBondContact O-N 3.43Å; T372-C375 PolarHBondContact O-N 2.89Å; T372-W376 WeakPolarHBondContact O-CB 3.46Å; T372-W376 PolarHBondContact O-N 3.29Å
373	A	88.4	Confident	87	Confident	42 Å²	42	48.5 Å²	48.5	35%	0.347	25%	0.252	S	S	.	.	H	α-helix	trans	-62.9	-40.4	-178.8	0	0	0	0	0	111.9	F369 L370 W376 W377	F369-A373 WeakPolarHBondContact O-CB 3.28Å; F369-A373 PolarHBondContact O-N 3.35Å; L370-A373 PolarHBondContact O-N 2.88Å; A373-W376 PolarHBondContact O-N 3.44Å; A373-W377 WeakPolarHBondContact O-CB 3.27Å; A373-W377 PolarHBondContact O-N 2.92Å
374	L	86.9	Confident	87.3	Confident	12 Å²	12	54.4 Å²	54.4	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-44.6	177.2	-70.2	176.1	0	0	0	111.5	I313 A336 Y340 L370 T372 W376 W377 I378	I313-L374 HydrophobicContact CD1-CB 4.48Å; I313-L374 HydrophobicContact CD1-CD2 3.47Å; I313-L374 VanDerWaalsContact CD1-CD2 3.47Å; I313-L374 HydrophobicContact CD1-CG 4.38Å; A336-L374 HydrophobicContact CB-CD2 4.18Å; Y340-L374 HydrophobicContact CD2-CD1 3.82Å; Y340-L374 HydrophobicContact CG-CD1 4.28Å; L370-L374 VanDerWaalsContact O-CB 3.32Å; L370-L374 WeakPolarHBondContact O-CB 3.35Å; L370-L374 WeakPolarHBondContact O-CG 3.43Å; L370-L374 PolarHBondContact O-N 2.68Å; T372-L374 VanDerWaalsContact C-N 3.34Å; T372-L374 PolarHBondContact O-N 3.43Å; L374-W376 VanDerWaalsContact C-N 3.33Å; L374-W376 PolarHBondContact O-N 2.97Å; L374-W377 WeakPolarHBondContact O-CB 3.23Å; L374-W377 PolarHBondContact O-N 3.37Å; L374-I378 WeakPolarHBondContact O-CD1 3.48Å; L374-I378 WeakPolarHBondContact O-CG1 3.33Å; L374-I378 PolarHBondContact O-N 2.86Å
375	C	85.8	Confident	87.4	Confident	66 Å²	66	51.6 Å²	51.6	45%	0.446	27%	0.268	S	S	.	.	H	α-helix	trans	-57.3	-47.2	174.5	-77.6	0	0	0	0	111.5	D371 T372 W377 I378 F379	D371-C375 WeakPolarHBondContact O-CB 3.39Å; D371-C375 PolarHBondContact O-N 2.64Å; D371-C375 PolarHBondContact O-SG 3.07Å; T372-C375 PolarHBondContact O-N 2.89Å; C375-W377 PolarHBondContact O-N 3.35Å; C375-I378 WeakPolarHBondContact O-CB 2.98Å; C375-I378 PolarHBondContact O-N 3.29Å; C375-F379 VanDerWaalsContact O-CD2 3.26Å; C375-F379 WeakPolarHBondContact O-CD2 3.36Å; C375-F379 PolarHBondContact O-N 3.28Å
376	W	87.4	Confident	87.4	Confident	104 Å²	104	47.7 Å²	47.7	39%	0.394	25%	0.248	S	C	.	.	H	α-helix	trans	-59.5	-46	176	-176.5	-100.2	0	0	0	112.3	L10 V13 T372 A373 L374 I378 F379 I380	L10-W376 HydrophobicContact CD1-CH2 3.8Å; L10-W376 HydrophobicContact CD1-CZ3 4.49Å; V13-W376 HydrophobicContact CG1-CE3 4.21Å; V13-W376 HydrophobicContact CG1-CZ3 4.29Å; V13-W376 HydrophobicContact CG2-CZ3 4.28Å; T372-W376 WeakPolarHBondContact O-CB 3.46Å; T372-W376 PolarHBondContact O-N 3.29Å; A373-W376 PolarHBondContact O-N 3.44Å; L374-W376 VanDerWaalsContact C-N 3.33Å; L374-W376 PolarHBondContact O-N 2.97Å; W376-I378 VanDerWaalsContact C-N 3.34Å; W376-I378 PolarHBondContact O-N 2.93Å; W376-F379 PolarHBondContact O-N 3.18Å; W376-I380 HydrophobicContact CD2-CD1 4.42Å; W376-I380 HydrophobicContact CG-CD1 4.41Å; W376-I380 HydrophobicContact CZ2-CD1 4.09Å; W376-I380 PolarHBondContact O-N 3.48Å; W376-I380 VanDerWaalsContact O-N 3.1Å
377	W	90.3	Very high	87.3	Confident	85 Å²	85	52.1 Å²	52.1	32%	0.322	26%	0.263	S	S	.	.	H	α-helix	trans	-57	-46.6	176.3	-168.7	-45.2	0	0	0	111.4	K332 A373 L374 C375 F379 I380 S381	K332-W377 HydrophobicContact CB-CH2 4.13Å; A373-W377 WeakPolarHBondContact O-CB 3.27Å; A373-W377 PolarHBondContact O-N 2.92Å; L374-W377 WeakPolarHBondContact O-CB 3.23Å; L374-W377 PolarHBondContact O-N 3.37Å; C375-W377 PolarHBondContact O-N 3.35Å; W377-F379 PolarHBondContact O-N 3.3Å; W377-I380 PolarHBondContact O-N 2.92Å; W377-S381 PolarHBondContact NE1-OG 3.32Å; W377-S381 WeakPolarHBondContact O-CB 3.23Å; W377-S381 PolarHBondContact O-N 2.91Å; W377-S381 PolarHBondContact O-OG 2.58Å
378	I	89.3	Confident	87.3	Confident	13 Å²	13	54 Å²	54	7%	0.067	27%	0.273	C	S	.	.	H	α-helix	trans	-55.8	-52.4	-180	-72.4	161.8	0	0	0	110.4	V312 I313 L374 C375 W376 I380 S381 L382 L408	V312-I378 HydrophobicContact CB-CD1 4.5Å; V312-I378 HydrophobicContact CG1-CD1 3.73Å; V312-I378 HydrophobicContact CG1-CG1 4.11Å; V312-I378 HydrophobicContact CG1-CG2 3.98Å; I313-I378 HydrophobicContact CG1-CD1 3.99Å; I313-I378 HydrophobicContact CG1-CG1 3.6Å; L374-I378 WeakPolarHBondContact O-CD1 3.48Å; L374-I378 WeakPolarHBondContact O-CG1 3.33Å; L374-I378 PolarHBondContact O-N 2.86Å; C375-I378 WeakPolarHBondContact O-CB 2.98Å; C375-I378 PolarHBondContact O-N 3.29Å; W376-I378 VanDerWaalsContact C-N 3.34Å; W376-I378 PolarHBondContact O-N 2.93Å; I378-I380 PolarHBondContact O-N 3.49Å; I378-S381 PolarHBondContact O-N 3.36Å; I378-L382 WeakPolarHBondContact O-CB 3.41Å; I378-L382 PolarHBondContact O-N 2.98Å; I378-L408 HydrophobicContact CG2-CD2 3.85Å
379	F	88.9	Confident	87	Confident	57 Å²	57	52.3 Å²	52.3	25%	0.25	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-39.4	-178.1	-78.6	-72.8	0	0	0	113.1	C375 W376 W377 T383 L408 I409 V412	C375-F379 VanDerWaalsContact O-CD2 3.26Å; C375-F379 WeakPolarHBondContact O-CD2 3.36Å; C375-F379 PolarHBondContact O-N 3.28Å; W376-F379 PolarHBondContact O-N 3.18Å; W377-F379 PolarHBondContact O-N 3.3Å; F379-T383 WeakPolarHBondContact O-CB 3.2Å; F379-T383 PolarHBondContact O-N 2.87Å; F379-T383 PolarHBondContact O-OG1 3.31Å; F379-L408 HydrophobicContact CD1-CD2 4.13Å; F379-L408 HydrophobicContact CE1-CD2 3.53Å; F379-L408 HydrophobicContact CE1-CG 4.34Å; F379-L408 HydrophobicContact CE2-CD2 4.1Å; F379-L408 HydrophobicContact CZ-CD2 3.5Å; F379-L408 VanDerWaalsContact CZ-CD2 3.5Å; F379-L408 HydrophobicContact CZ-CG 4.05Å; F379-I409 HydrophobicContact CE1-CG1 4.29Å; F379-V412 HydrophobicContact CZ-CG2 4.21Å
380	I	89.4	Confident	86.8	Confident	62 Å²	62	51.9 Å²	51.9	32%	0.318	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-50.3	174.8	-73	-176.4	0	0	0	110.5	W376 W377 I378 L382 T383 Q384	W376-I380 HydrophobicContact CD2-CD1 4.42Å; W376-I380 HydrophobicContact CG-CD1 4.41Å; W376-I380 HydrophobicContact CZ2-CD1 4.09Å; W376-I380 PolarHBondContact O-N 3.48Å; W376-I380 VanDerWaalsContact O-N 3.1Å; W377-I380 PolarHBondContact O-N 2.92Å; I378-I380 PolarHBondContact O-N 3.49Å; I380-L382 VanDerWaalsContact C-N 3.31Å; I380-L382 PolarHBondContact O-N 3.43Å; I380-T383 PolarHBondContact O-N 3.23Å; I380-Q384 HydrophobicContact CG2-CG 4.47Å; I380-Q384 WeakPolarHBondContact O-CG 3.32Å; I380-Q384 PolarHBondContact O-N 3.39Å
381	S	88.1	Confident	86.6	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.028	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-43.8	-178	-63.1	0	0	0	0	111	S316 L317 W377 I378 T383 Q384 T385	S316-S381 CarbonylContact O-C 3.42Å; L317-S381 WeakPolarHBondContact CD2-OG 3.41Å; W377-S381 PolarHBondContact NE1-OG 3.32Å; W377-S381 WeakPolarHBondContact O-CB 3.23Å; W377-S381 PolarHBondContact O-N 2.91Å; W377-S381 PolarHBondContact O-OG 2.58Å; I378-S381 PolarHBondContact O-N 3.36Å; S381-T383 VanDerWaalsContact C-N 3.34Å; S381-T383 PolarHBondContact O-N 3.35Å; S381-Q384 PolarHBondContact O-N 2.77Å; S381-T385 WeakPolarHBondContact O-CB 3.39Å; S381-T385 PolarHBondContact O-N 2.99Å; S381-T385 PolarHBondContact O-OG1 3.31Å
382	L	87.6	Confident	86.3	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-42.7	177.1	-173.4	58.7	0	0	0	111.7	I378 I380 T385 M386 Y401 F404 T405 L408	I378-L382 WeakPolarHBondContact O-CB 3.41Å; I378-L382 PolarHBondContact O-N 2.98Å; I380-L382 VanDerWaalsContact C-N 3.31Å; I380-L382 PolarHBondContact O-N 3.43Å; L382-T385 PolarHBondContact O-N 2.93Å; L382-M386 VanDerWaalsContact O-CB 3.28Å; L382-M386 WeakPolarHBondContact O-CB 3.21Å; L382-M386 WeakPolarHBondContact O-CG 3.03Å; L382-M386 PolarHBondContact O-N 3Å; L382-Y401 HydrophobicContact CD1-CD1 3.63Å; L382-Y401 HydrophobicContact CD1-CE1 4.17Å; L382-F404 HydrophobicContact CD1-CD1 3.86Å; L382-F404 HydrophobicContact CD1-CE1 4.17Å; L382-F404 HydrophobicContact CD2-CD1 4.3Å; L382-F404 HydrophobicContact CD2-CE1 4.37Å; L382-T405 HydrophobicContact CD2-CG2 3.84Å; L382-T405 VanDerWaalsContact CD2-OG1 3.22Å; L382-T405 WeakPolarHBondContact CD2-OG1 3.44Å; L382-T405 WeakPolarHBondContact CG-OG1 3.36Å; L382-L408 HydrophobicContact CD2-CD2 4.31Å
383	T	88.3	Confident	85.9	Confident	39 Å²	39	72 Å²	72	24%	0.239	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-40.7	176.8	-59.9	0	0	0	0	112	W6 F379 I380 S381 K387	W6-T383 HydrophobicContact CZ2-CG2 4.16Å; F379-T383 WeakPolarHBondContact O-CB 3.2Å; F379-T383 PolarHBondContact O-N 2.87Å; F379-T383 PolarHBondContact O-OG1 3.31Å; I380-T383 PolarHBondContact O-N 3.23Å; S381-T383 VanDerWaalsContact C-N 3.34Å; S381-T383 PolarHBondContact O-N 3.35Å; T383-K387 WeakPolarHBondContact O-CG 2.97Å; T383-K387 PolarHBondContact O-N 2.77Å; T383-K387 VanDerWaalsContact O-N 3.07Å
384	Q	88.4	Confident	85.3	Confident	124 Å²	124	71.6 Å²	71.6	58%	0.579	32%	0.324	S	S	*	.	H	α-helix	trans	-65.5	-48	176.3	-71.3	176.2	-5	0	0	111.5	I380 S381 M386 K387 L388	I380-Q384 HydrophobicContact CG2-CG 4.47Å; I380-Q384 WeakPolarHBondContact O-CG 3.32Å; I380-Q384 PolarHBondContact O-N 3.39Å; S381-Q384 PolarHBondContact O-N 2.77Å; Q384-M386 VanDerWaalsContact C-N 3.29Å; Q384-M386 PolarHBondContact O-N 3.36Å; Q384-K387 PolarHBondContact O-N 2.94Å; Q384-L388 PolarHBondContact O-N 2.84Å
385	T	86.8	Confident	84.9	Confident	11 Å²	11	77.4 Å²	77.4	7%	0.067	35%	0.354	C	S	.	.	H	α-helix	trans	-60.4	-40.2	177.7	-57.6	0	0	0	0	111.3	S316 V322 S381 L382 L388 L389 Y401	S316-T385 PolarHBondContact O-OG1 3.32Å; V322-T385 HydrophobicContact CG2-CG2 3.96Å; S381-T385 WeakPolarHBondContact O-CB 3.39Å; S381-T385 PolarHBondContact O-N 2.99Å; S381-T385 PolarHBondContact O-OG1 3.31Å; L382-T385 PolarHBondContact O-N 2.93Å; T385-L388 PolarHBondContact O-N 2.63Å; T385-L389 HydrophobicContact CG2-CD1 4.12Å; T385-L389 WeakPolarHBondContact O-CB 3.22Å; T385-L389 WeakPolarHBondContact O-CG 3.24Å; T385-L389 PolarHBondContact O-N 2.69Å; T385-Y401 HydrophobicContact CG2-CD1 4.39Å; T385-Y401 HydrophobicContact CG2-CE1 3.99Å
386	M	84.8	Confident	84.6	Confident	28 Å²	28	79 Å²	79	14%	0.138	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-45.7	174.3	-82.4	-71.1	-155.4	0	0	113.6	L382 Q384 L388 L389 K390 L398 Y401 R402 T405	L382-M386 VanDerWaalsContact O-CB 3.28Å; L382-M386 WeakPolarHBondContact O-CB 3.21Å; L382-M386 WeakPolarHBondContact O-CG 3.03Å; L382-M386 PolarHBondContact O-N 3Å; Q384-M386 VanDerWaalsContact C-N 3.29Å; Q384-M386 PolarHBondContact O-N 3.36Å; M386-L388 VanDerWaalsContact C-N 3.32Å; M386-L388 PolarHBondContact O-N 3.37Å; M386-L389 PolarHBondContact O-N 3.04Å; M386-K390 WeakPolarHBondContact O-CG 3.34Å; M386-K390 PolarHBondContact O-N 3.46Å; M386-L398 HydrophobicContact SD-CD1 3.69Å; M386-Y401 WeakPolarHBondContact CE-O 3.35Å; M386-R402 HydrophobicContact CE-CB 4.08Å; M386-T405 WeakPolarHBondContact CE-OG1 3.47Å
387	K	86.5	Confident	84.2	Confident	133 Å²	133	75.6 Å²	75.6	58%	0.578	35%	0.349	S	S	*	.	H	α-helix	trans	-61.4	-44.2	177.3	-74.8	176.3	-179.5	-179.9	0	110.8	T383 Q384 L389 K390 L391	T383-K387 WeakPolarHBondContact O-CG 2.97Å; T383-K387 PolarHBondContact O-N 2.77Å; T383-K387 VanDerWaalsContact O-N 3.07Å; Q384-K387 PolarHBondContact O-N 2.94Å; K387-L389 PolarHBondContact O-N 3.35Å; K387-K390 PolarHBondContact O-N 3.19Å; K387-L391 WeakPolarHBondContact O-CG 3.41Å; K387-L391 PolarHBondContact O-N 3.44Å
388	L	83.6	Confident	83.7	Confident	52 Å²	52	73.5 Å²	73.5	27%	0.272	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-44	176.8	-176.8	63.2	0	0	0	111.9	V322 Q384 T385 M386 L391 R392	V322-L388 HydrophobicContact CG1-CD2 3.83Å; Q384-L388 PolarHBondContact O-N 2.84Å; T385-L388 PolarHBondContact O-N 2.63Å; M386-L388 VanDerWaalsContact C-N 3.32Å; M386-L388 PolarHBondContact O-N 3.37Å; L388-L391 PolarHBondContact O-N 3.08Å; L388-R392 WeakPolarHBondContact O-CG 3.45Å; L388-R392 PolarHBondContact O-N 2.78Å
389	L	80.4	Confident	83.5	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-67.7	-33.2	178.1	-74.9	172.9	0	0	0	113.2	V322 T385 M386 K387 R393 K397 L398 Y401	V322-L389 HydrophobicContact CG1-CD2 4.34Å; V322-L389 HydrophobicContact CG2-CD1 4.07Å; V322-L389 HydrophobicContact CG2-CD2 3.87Å; V322-L389 HydrophobicContact CG2-CG 4.15Å; T385-L389 HydrophobicContact CG2-CD1 4.12Å; T385-L389 WeakPolarHBondContact O-CB 3.22Å; T385-L389 WeakPolarHBondContact O-CG 3.24Å; T385-L389 PolarHBondContact O-N 2.69Å; M386-L389 PolarHBondContact O-N 3.04Å; K387-L389 PolarHBondContact O-N 3.35Å; L389-R393 PolarHBondContact O-N 3.44Å; L389-K397 HydrophobicContact CD1-CB 4.36Å; L389-K397 HydrophobicContact CD2-CB 3.91Å; L389-K397 HydrophobicContact CD2-CD 4.27Å; L389-L398 HydrophobicContact CB-CD1 4.23Å; L389-Y401 HydrophobicContact CD1-CD2 3.5Å; L389-Y401 HydrophobicContact CD1-CE2 4.01Å; L389-Y401 HydrophobicContact CD1-CG 3.96Å
390	K	82.8	Confident	83.4	Confident	139 Å²	139	74.9 Å²	74.9	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-65.9	-43.1	173.1	-77.1	-177.3	179.8	-176.6	0	111.9	M386 K387 R393 L398	M386-K390 WeakPolarHBondContact O-CG 3.34Å; M386-K390 PolarHBondContact O-N 3.46Å; K387-K390 PolarHBondContact O-N 3.19Å; K390-R393 PolarHBondContact O-N 3.1Å; K390-L398 HydrophobicContact CG-CD1 3.61Å; K390-L398 HydrophobicContact CG-CD2 3.95Å; K390-L398 HydrophobicContact CG-CG 4.46Å
391	L	83.7	Confident	83.2	Confident	145 Å²	145	72 Å²	72	76%	0.759	34%	0.343	S	S	*	.	H	α-helix	trans	-64.6	-40.7	177.8	-70	172.2	0	0	0	111.4	K387 L388 R393	K387-L391 WeakPolarHBondContact O-CG 3.41Å; K387-L391 PolarHBondContact O-N 3.44Å; L388-L391 PolarHBondContact O-N 3.08Å; L391-R393 PolarHBondContact O-N 3.49Å
392	R	79.9	Confident	83.2	Confident	168 Å²	168	79.8 Å²	79.8	63%	0.634	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	6.4	178.8	-65.9	-174.5	-178.2	-146	-1.8	115.1	L388 N394	L388-R392 WeakPolarHBondContact O-CG 3.45Å; L388-R392 PolarHBondContact O-N 2.78Å; R392-N394 PolarHBondContact O-N 2.85Å
393	R	76.5	Confident	83.2	Confident	223 Å²	223	84.5 Å²	84.5	84%	0.842	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	25.5	179.6	-76.9	-177.8	166.5	149.2	-4	116.3	L389 K390 L391 I395	L389-R393 PolarHBondContact O-N 3.44Å; K390-R393 PolarHBondContact O-N 3.1Å; L391-R393 PolarHBondContact O-N 3.49Å; R393-I395 PolarHBondContact O-N 2.91Å; R393-I395 VanDerWaalsContact O-N 3.08Å
394	N	76.6	Confident	83.2	Confident	32 Å²	32	83 Å²	83	17%	0.171	38%	0.384	C	S	.	.			trans	-84.7	88.9	178.5	-166.5	-47.5	0	0	0	111.2	R392 V396 K397 L398	R392-N394 PolarHBondContact O-N 2.85Å; N394-V396 VanDerWaalsContact C-N 3.34Å; N394-V396 PolarHBondContact O-N 2.96Å; N394-K397 HydrophobicContact CB-CB 4.41Å; N394-K397 WeakPolarHBondContact ND2-CD 3.32Å; N394-K397 PolarHBondContact O-N 3.33Å; N394-K397 WeakPolarHBondContact OD1-CB 3.36Å; N394-K397 WeakPolarHBondContact OD1-CG 3.38Å; N394-K397 PolarHBondContact OD1-N 3.44Å; N394-K397 VanDerWaalsContact OD1-N 3.14Å; N394-L398 WeakPolarHBondContact O-CB 3.3Å; N394-L398 PolarHBondContact O-N 3.46Å
395	I	77.6	Confident	83.2	Confident	135 Å²	135	78.3 Å²	78.3	69%	0.692	36%	0.364	S	S	*	.	H	α-helix	trans	-61.9	-38.6	-171.1	-55.4	174.7	0	0	0	112.2	R393 S399	R393-I395 PolarHBondContact O-N 2.91Å; R393-I395 VanDerWaalsContact O-N 3.08Å; I395-S399 VanDerWaalsContact O-CB 3.31Å; I395-S399 WeakPolarHBondContact O-CB 3.37Å; I395-S399 PolarHBondContact O-N 3.07Å
396	V	78.9	Confident	83.3	Confident	99 Å²	99	81.4 Å²	81.4	60%	0.6	38%	0.38	S	S	*	.	H	α-helix	trans	-68.2	-49.9	-177.7	-179.6	0	0	0	0	111	N394 L398 S399 L400	N394-V396 VanDerWaalsContact C-N 3.34Å; N394-V396 PolarHBondContact O-N 2.96Å; V396-L398 VanDerWaalsContact C-N 3.34Å; V396-L398 PolarHBondContact O-N 3.15Å; V396-S399 PolarHBondContact O-N 3.24Å; V396-L400 PolarHBondContact O-N 3.36Å; V396-L400 VanDerWaalsContact O-N 3.08Å
397	K	79.9	Confident	83.5	Confident	33 Å²	33	81.8 Å²	81.8	14%	0.143	38%	0.384	C	S	.	.	H	α-helix	trans	-64.3	-40.7	176.8	-67.8	178.6	-178.1	-176.6	0	111.1	I321 L389 N394 S399 L400 Y401 F469	I321-K397 HydrophobicContact CG2-CB 4.45Å; I321-K397 HydrophobicContact CG2-CD 3.57Å; I321-K397 HydrophobicContact CG2-CG 3.83Å; I321-K397 PolarHBondContact O-NZ 3.45Å; L389-K397 HydrophobicContact CD1-CB 4.36Å; L389-K397 HydrophobicContact CD2-CB 3.91Å; L389-K397 HydrophobicContact CD2-CD 4.27Å; N394-K397 HydrophobicContact CB-CB 4.41Å; N394-K397 WeakPolarHBondContact ND2-CD 3.32Å; N394-K397 PolarHBondContact O-N 3.33Å; N394-K397 WeakPolarHBondContact OD1-CB 3.36Å; N394-K397 WeakPolarHBondContact OD1-CG 3.38Å; N394-K397 PolarHBondContact OD1-N 3.44Å; N394-K397 VanDerWaalsContact OD1-N 3.14Å; K397-S399 VanDerWaalsContact C-N 3.33Å; K397-S399 PolarHBondContact O-N 3.27Å; K397-L400 PolarHBondContact O-N 3.24Å; K397-Y401 WeakPolarHBondContact O-CD2 3.29Å; K397-Y401 PolarHBondContact O-N 3.49Å; K397-F469 WeakPolarHBondContact CE-O 3.27Å; K397-F469 PolarHBondContact NZ-O 2.95Å
398	L	80	Confident	83.5	Confident	41 Å²	41	76.8 Å²	76.8	22%	0.215	36%	0.363	C	S	.	.	H	α-helix	trans	-60.8	-42.6	176.6	-178.8	66.9	0	0	0	111.8	M386 L389 K390 N394 V396 Y401 R402	M386-L398 HydrophobicContact SD-CD1 3.69Å; L389-L398 HydrophobicContact CB-CD1 4.23Å; K390-L398 HydrophobicContact CG-CD1 3.61Å; K390-L398 HydrophobicContact CG-CD2 3.95Å; K390-L398 HydrophobicContact CG-CG 4.46Å; N394-L398 WeakPolarHBondContact O-CB 3.3Å; N394-L398 PolarHBondContact O-N 3.46Å; V396-L398 VanDerWaalsContact C-N 3.34Å; V396-L398 PolarHBondContact O-N 3.15Å; L398-Y401 PolarHBondContact O-N 3.28Å; L398-R402 WeakPolarHBondContact O-CB 3.44Å; L398-R402 PolarHBondContact O-N 3.45Å
399	S	85.3	Confident	83.7	Confident	52 Å²	52	78.4 Å²	78.4	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-61.3	-46.6	176	-175	0	0	0	0	111.2	I395 V396 K397 Y401 R402 H403	I395-S399 VanDerWaalsContact O-CB 3.31Å; I395-S399 WeakPolarHBondContact O-CB 3.37Å; I395-S399 PolarHBondContact O-N 3.07Å; V396-S399 PolarHBondContact O-N 3.24Å; K397-S399 VanDerWaalsContact C-N 3.33Å; K397-S399 PolarHBondContact O-N 3.27Å; S399-Y401 PolarHBondContact O-N 2.75Å; S399-R402 WeakPolarHBondContact O-CB 3.16Å; S399-R402 PolarHBondContact O-N 3.21Å; S399-R402 VanDerWaalsContact O-N 3.08Å; S399-H403 PolarHBondContact O-N 2.9Å; S399-H403 PolarHBondContact O-ND1 3.39Å; S399-H403 PolarHBondContact OG-CE1 2.99Å; S399-H403 VanDerWaalsContact OG-CE1 3.32Å
400	L	85.4	Confident	84.1	Confident	46 Å²	46	84 Å²	84	24%	0.241	40%	0.401	C	S	.	.	H	α-helix	trans	-57	-50.8	177.2	-176.9	155.6	0	0	0	111.8	V396 K397 R402 H403 F404 W460	V396-L400 PolarHBondContact O-N 3.36Å; V396-L400 VanDerWaalsContact O-N 3.08Å; K397-L400 PolarHBondContact O-N 3.24Å; L400-R402 PolarHBondContact O-N 3.14Å; L400-H403 PolarHBondContact O-N 3.34Å; L400-F404 PolarHBondContact O-N 3.29Å; L400-W460 HydrophobicContact CD2-CZ2 4.33Å
401	Y	86.5	Confident	84.2	Confident	1 Å²	1	78.1 Å²	78.1	0%	0.004	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-31.4	178.2	-87.4	-87.9	0	0	0	111.7	V315 G318 I321 V322 L382 T385 M386 L389 K397 L398 S399 F404 T405	V315-Y401 WeakPolarHBondContact O-CE1 3.25Å; V315-Y401 PolarHBondContact O-OH 2.83Å; G318-Y401 WeakPolarHBondContact CA-OH 3.49Å; I321-Y401 HydrophobicContact CD1-CE2 4.43Å; I321-Y401 HydrophobicContact CG2-CE2 4.27Å; V322-Y401 HydrophobicContact CG2-CE2 4.3Å; L382-Y401 HydrophobicContact CD1-CD1 3.63Å; L382-Y401 HydrophobicContact CD1-CE1 4.17Å; T385-Y401 HydrophobicContact CG2-CD1 4.39Å; T385-Y401 HydrophobicContact CG2-CE1 3.99Å; M386-Y401 WeakPolarHBondContact CE-O 3.35Å; L389-Y401 HydrophobicContact CD1-CD2 3.5Å; L389-Y401 HydrophobicContact CD1-CE2 4.01Å; L389-Y401 HydrophobicContact CD1-CG 3.96Å; K397-Y401 WeakPolarHBondContact O-CD2 3.29Å; K397-Y401 PolarHBondContact O-N 3.49Å; L398-Y401 PolarHBondContact O-N 3.28Å; S399-Y401 PolarHBondContact O-N 2.75Å; Y401-F404 WeakPolarHBondContact O-CB 3.42Å; Y401-F404 PolarHBondContact O-N 3.42Å; Y401-T405 PolarHBondContact O-N 2.72Å; Y401-T405 PolarHBondContact O-OG1 2.84Å
402	R	87	Confident	84.3	Confident	168 Å²	168	73.5 Å²	73.5	63%	0.634	36%	0.356	S	S	*	.	H	α-helix	trans	-68.8	-44	179.3	-174	179.4	-179.1	178.6	-1.9	111.6	M386 L398 S399 L400 F404 T405 N406	M386-R402 HydrophobicContact CE-CB 4.08Å; L398-R402 WeakPolarHBondContact O-CB 3.44Å; L398-R402 PolarHBondContact O-N 3.45Å; S399-R402 WeakPolarHBondContact O-CB 3.16Å; S399-R402 PolarHBondContact O-N 3.21Å; S399-R402 VanDerWaalsContact O-N 3.08Å; L400-R402 PolarHBondContact O-N 3.14Å; R402-F404 VanDerWaalsContact C-N 3.31Å; R402-T405 PolarHBondContact O-N 3.34Å; R402-N406 WeakPolarHBondContact O-CB 3.48Å; R402-N406 PolarHBondContact O-N 2.93Å; R402-N406 PolarHBondContact O-OD1 2.83Å
403	H	88.8	Confident	84.7	Confident	101 Å²	101	67.8 Å²	67.8	47%	0.468	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-42.9	173.3	-66.8	89.8	0	0	0	110.5	S399 L400 T405 N406 T407 L459	S399-H403 PolarHBondContact O-N 2.9Å; S399-H403 PolarHBondContact O-ND1 3.39Å; S399-H403 PolarHBondContact OG-CE1 2.99Å; S399-H403 VanDerWaalsContact OG-CE1 3.32Å; L400-H403 PolarHBondContact O-N 3.34Å; H403-T405 PolarHBondContact O-N 3.24Å; H403-N406 PolarHBondContact O-N 2.76Å; H403-T407 PolarHBondContact O-N 3.2Å; H403-T407 PolarHBondContact O-OG1 3.31Å; H403-L459 HydrophobicContact CB-CD2 4.19Å
404	F	88.1	Confident	85.1	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-58.9	-49.2	176.4	-178.9	-112.4	0	0	0	112.9	V312 V315 L382 L400 Y401 R402 N406 T407 L408 I456 L459	V312-F404 HydrophobicContact CG1-CZ 4.26Å; V315-F404 HydrophobicContact CG1-CD1 4.38Å; V315-F404 HydrophobicContact CG1-CE1 3.91Å; V315-F404 HydrophobicContact CG1-CE2 4.3Å; V315-F404 HydrophobicContact CG1-CZ 3.85Å; L382-F404 HydrophobicContact CD1-CD1 3.86Å; L382-F404 HydrophobicContact CD1-CE1 4.17Å; L382-F404 HydrophobicContact CD2-CD1 4.3Å; L382-F404 HydrophobicContact CD2-CE1 4.37Å; L400-F404 PolarHBondContact O-N 3.29Å; Y401-F404 WeakPolarHBondContact O-CB 3.42Å; Y401-F404 PolarHBondContact O-N 3.42Å; R402-F404 VanDerWaalsContact C-N 3.31Å; F404-N406 PolarHBondContact O-N 2.9Å; F404-T407 PolarHBondContact O-N 3.37Å; F404-L408 PolarHBondContact O-N 2.77Å; F404-I456 HydrophobicContact CE2-CD1 4.49Å; F404-I456 HydrophobicContact CE2-CG1 4.28Å; F404-L459 HydrophobicContact CB-CD2 3.84Å; F404-L459 HydrophobicContact CD2-CD2 4.39Å
405	T	88.2	Confident	85.6	Confident	24 Å²	24	58.4 Å²	58.4	15%	0.147	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-43.5	176.6	-52.8	0	0	0	0	111.8	L382 M386 Y401 R402 H403 T407 L408 I409	L382-T405 HydrophobicContact CD2-CG2 3.84Å; L382-T405 VanDerWaalsContact CD2-OG1 3.22Å; L382-T405 WeakPolarHBondContact CD2-OG1 3.44Å; L382-T405 WeakPolarHBondContact CG-OG1 3.36Å; M386-T405 WeakPolarHBondContact CE-OG1 3.47Å; Y401-T405 PolarHBondContact O-N 2.72Å; Y401-T405 PolarHBondContact O-OG1 2.84Å; R402-T405 PolarHBondContact O-N 3.34Å; H403-T405 PolarHBondContact O-N 3.24Å; T405-T407 VanDerWaalsContact C-N 3.33Å; T405-T407 PolarHBondContact O-N 3.32Å; T405-L408 PolarHBondContact O-N 3.39Å; T405-I409 HydrophobicContact CG2-CD1 3.83Å; T405-I409 HydrophobicContact CG2-CG1 4.39Å; T405-I409 VanDerWaalsContact O-CG1 3.31Å; T405-I409 WeakPolarHBondContact O-CG1 3.48Å; T405-I409 PolarHBondContact O-N 2.83Å
406	N	89.3	Confident	85.9	Confident	77 Å²	77	54.5 Å²	54.5	41%	0.412	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-43.5	178.5	-72.3	-3.9	0	0	0	111.2	R402 H403 F404 I409 L410	R402-N406 WeakPolarHBondContact O-CB 3.48Å; R402-N406 PolarHBondContact O-N 2.93Å; R402-N406 PolarHBondContact O-OD1 2.83Å; H403-N406 PolarHBondContact O-N 2.76Å; F404-N406 PolarHBondContact O-N 2.9Å; N406-I409 PolarHBondContact O-N 2.86Å; N406-L410 WeakPolarHBondContact O-CB 3.22Å; N406-L410 VanDerWaalsContact O-CG 3.29Å; N406-L410 WeakPolarHBondContact O-CG 3.3Å; N406-L410 PolarHBondContact O-N 3.36Å
407	T	88.9	Confident	86.4	Confident	35 Å²	35	54.4 Å²	54.4	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-44.7	174.9	-58.8	0	0	0	0	111.8	H403 F404 T405 I409 L410 A411 V455	H403-T407 PolarHBondContact O-N 3.2Å; H403-T407 PolarHBondContact O-OG1 3.31Å; F404-T407 PolarHBondContact O-N 3.37Å; T405-T407 VanDerWaalsContact C-N 3.33Å; T405-T407 PolarHBondContact O-N 3.32Å; T407-I409 VanDerWaalsContact C-N 3.34Å; T407-I409 PolarHBondContact O-N 3.28Å; T407-L410 PolarHBondContact O-N 3.2Å; T407-A411 WeakPolarHBondContact O-CB 3.43Å; T407-A411 PolarHBondContact O-N 2.94Å; T407-V455 HydrophobicContact CG2-CB 3.87Å; T407-V455 HydrophobicContact CG2-CG1 3.56Å; T407-V455 HydrophobicContact CG2-CG2 4.08Å; T407-V455 WeakPolarHBondContact OG1-CG1 3.35Å
408	L	85.5	Confident	86.6	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.147	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-43.5	178.5	-165.9	81.3	0	0	0	111.2	I378 F379 L382 F404 T405 A411 V412	I378-L408 HydrophobicContact CG2-CD2 3.85Å; F379-L408 HydrophobicContact CD1-CD2 4.13Å; F379-L408 HydrophobicContact CE1-CD2 3.53Å; F379-L408 HydrophobicContact CE1-CG 4.34Å; F379-L408 HydrophobicContact CE2-CD2 4.1Å; F379-L408 HydrophobicContact CZ-CD2 3.5Å; F379-L408 VanDerWaalsContact CZ-CD2 3.5Å; F379-L408 HydrophobicContact CZ-CG 4.05Å; L382-L408 HydrophobicContact CD2-CD2 4.31Å; F404-L408 PolarHBondContact O-N 2.77Å; T405-L408 PolarHBondContact O-N 3.39Å; L408-A411 PolarHBondContact O-N 2.79Å; L408-V412 WeakPolarHBondContact O-CG2 3.5Å; L408-V412 PolarHBondContact O-N 3.01Å
409	I	88.4	Confident	86.7	Confident	86 Å²	86	57.9 Å²	57.9	44%	0.441	31%	0.313	S	S	.	.	H	α-helix	trans	-63.8	-45	177.1	-68.2	167.9	0	0	0	111.1	F379 T405 N406 T407 A411 V412 A413	F379-I409 HydrophobicContact CE1-CG1 4.29Å; T405-I409 HydrophobicContact CG2-CD1 3.83Å; T405-I409 HydrophobicContact CG2-CG1 4.39Å; T405-I409 VanDerWaalsContact O-CG1 3.31Å; T405-I409 WeakPolarHBondContact O-CG1 3.48Å; T405-I409 PolarHBondContact O-N 2.83Å; N406-I409 PolarHBondContact O-N 2.86Å; T407-I409 VanDerWaalsContact C-N 3.34Å; T407-I409 PolarHBondContact O-N 3.28Å; I409-A411 VanDerWaalsContact C-N 3.31Å; I409-A411 PolarHBondContact O-N 3.18Å; I409-V412 PolarHBondContact O-N 3.07Å; I409-A413 WeakPolarHBondContact O-CB 3.47Å; I409-A413 PolarHBondContact O-N 2.04Å
410	L	88.8	Confident	86.6	Confident	123 Å²	123	60 Å²	60	64%	0.644	32%	0.319	S	S	*	.	H	α-helix	trans	-62.2	-38.6	177.1	-73.6	172.5	0	0	0	112	N406 T407 A413 A414	N406-L410 WeakPolarHBondContact O-CB 3.22Å; N406-L410 VanDerWaalsContact O-CG 3.29Å; N406-L410 WeakPolarHBondContact O-CG 3.3Å; N406-L410 PolarHBondContact O-N 3.36Å; T407-L410 PolarHBondContact O-N 3.2Å; L410-A413 PolarHBondContact O-N 3.25Å; L410-A414 WeakPolarHBondContact O-CB 3.49Å; L410-A414 PolarHBondContact O-N 3.1Å
411	A	84.7	Confident	86.6	Confident	15 Å²	15	64.9 Å²	64.9	12%	0.124	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-42.1	176.3	0	0	0	0	0	112.2	T407 L408 I409 A414 S415 I452	T407-A411 WeakPolarHBondContact O-CB 3.43Å; T407-A411 PolarHBondContact O-N 2.94Å; L408-A411 PolarHBondContact O-N 2.79Å; I409-A411 VanDerWaalsContact C-N 3.31Å; I409-A411 PolarHBondContact O-N 3.18Å; A411-A414 PolarHBondContact O-N 3.41Å; A411-S415 PolarHBondContact O-N 3.01Å; A411-I452 HydrophobicContact CB-CD1 3.77Å; A411-I452 HydrophobicContact CB-CG1 3.95Å
412	V	86.2	Confident	86.2	Confident	48 Å²	48	65.9 Å²	65.9	29%	0.291	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-48.4	173.9	173.3	0	0	0	0	110.1	L16 F379 L408 I409 A414 S415 I416	L16-V412 HydrophobicContact CD1-CG1 4.46Å; F379-V412 HydrophobicContact CZ-CG2 4.21Å; L408-V412 WeakPolarHBondContact O-CG2 3.5Å; L408-V412 PolarHBondContact O-N 3.01Å; I409-V412 PolarHBondContact O-N 3.07Å; V412-A414 VanDerWaalsContact C-N 3.33Å; V412-A414 PolarHBondContact O-N 3.28Å; V412-S415 PolarHBondContact O-N 2.82Å; V412-S415 VanDerWaalsContact O-N 3.1Å; V412-S415 PolarHBondContact O-OG 3.12Å; V412-I416 HydrophobicContact CG1-CD1 4.23Å; V412-I416 WeakPolarHBondContact O-CG1 3.23Å; V412-I416 PolarHBondContact O-N 3.09Å; V412-I416 VanDerWaalsContact O-N 3.07Å
413	A	87.3	Confident	85.8	Confident	47 Å²	47	60.3 Å²	60.3	39%	0.388	33%	0.325	S	S	.	.	H	α-helix	trans	-57.7	-44.2	177.3	0	0	0	0	0	112.5	I409 L410 S415 I416 V417	I409-A413 WeakPolarHBondContact O-CB 3.47Å; I409-A413 PolarHBondContact O-N 2.04Å; L410-A413 PolarHBondContact O-N 3.25Å; A413-S415 PolarHBondContact O-N 3.44Å; A413-I416 PolarHBondContact O-N 3.13Å; A413-V417 WeakPolarHBondContact O-CG2 3.35Å; A413-V417 PolarHBondContact O-N 3.19Å; A413-V417 VanDerWaalsContact O-N 3.14Å
414	A	86.2	Confident	85.4	Confident	36 Å²	36	60.9 Å²	60.9	30%	0.298	33%	0.33	S	S	.	.	H	α-helix	trans	-59.6	-45.2	175	0	0	0	0	0	111.5	L410 A411 V412 I416 V417 F418	L410-A414 WeakPolarHBondContact O-CB 3.49Å; L410-A414 PolarHBondContact O-N 3.1Å; A411-A414 PolarHBondContact O-N 3.41Å; V412-A414 VanDerWaalsContact C-N 3.33Å; V412-A414 PolarHBondContact O-N 3.28Å; A414-I416 VanDerWaalsContact C-N 3.3Å; A414-I416 PolarHBondContact O-N 2.83Å; A414-V417 PolarHBondContact O-N 2.96Å; A414-F418 HydrophobicContact CB-CD2 4.49Å; A414-F418 HydrophobicContact CB-CE2 4.33Å; A414-F418 WeakPolarHBondContact O-CD2 3.38Å; A414-F418 PolarHBondContact O-N 2.99Å
415	S	86.3	Confident	84.9	Confident	23 Å²	23	64.1 Å²	64.1	16%	0.161	34%	0.344	C	S	.	.	H	α-helix	trans	-60.2	-37.9	178.6	72.2	0	0	0	0	112.9	A411 V412 A413 F418 I419	A411-S415 PolarHBondContact O-N 3.01Å; V412-S415 PolarHBondContact O-N 2.82Å; V412-S415 VanDerWaalsContact O-N 3.1Å; V412-S415 PolarHBondContact O-OG 3.12Å; A413-S415 PolarHBondContact O-N 3.44Å; S415-F418 PolarHBondContact O-N 3.46Å; S415-I419 WeakPolarHBondContact O-CD1 3.17Å; S415-I419 VanDerWaalsContact O-CG1 3.23Å; S415-I419 WeakPolarHBondContact O-CG1 3.41Å; S415-I419 PolarHBondContact O-N 2.9Å
416	I	84.8	Confident	84.2	Confident	53 Å²	53	64.5 Å²	64.5	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-63.9	-48.7	176.2	-60.8	171.1	0	0	0	110.9	L16 V412 A413 A414 F418 I419 I420	L16-I416 HydrophobicContact CD1-CD1 4.2Å; L16-I416 HydrophobicContact CD2-CD1 3.25Å; L16-I416 HydrophobicContact CD2-CG1 3.27Å; L16-I416 HydrophobicContact CG-CD1 4.09Å; V412-I416 HydrophobicContact CG1-CD1 4.23Å; V412-I416 WeakPolarHBondContact O-CG1 3.23Å; V412-I416 PolarHBondContact O-N 3.09Å; V412-I416 VanDerWaalsContact O-N 3.07Å; A413-I416 PolarHBondContact O-N 3.13Å; A414-I416 VanDerWaalsContact C-N 3.3Å; A414-I416 PolarHBondContact O-N 2.83Å; I416-F418 VanDerWaalsContact C-N 3.25Å; I416-F418 PolarHBondContact O-N 2.73Å; I416-I419 PolarHBondContact O-N 2.96Å; I416-I420 HydrophobicContact CG2-CD1 3.82Å; I416-I420 HydrophobicContact CG2-CG1 4.43Å; I416-I420 WeakPolarHBondContact O-CG1 3.35Å; I416-I420 PolarHBondContact O-N 3.38Å
417	V	87.8	Confident	83.2	Confident	96 Å²	96	67.5 Å²	67.5	58%	0.582	35%	0.349	S	S	*	.	H	α-helix	trans	-58.5	-42.5	179	173.2	0	0	0	0	110.3	A413 A414 I420 W421	A413-V417 WeakPolarHBondContact O-CG2 3.35Å; A413-V417 PolarHBondContact O-N 3.19Å; A413-V417 VanDerWaalsContact O-N 3.14Å; A414-V417 PolarHBondContact O-N 2.96Å; V417-I420 PolarHBondContact O-N 3.44Å; V417-W421 WeakPolarHBondContact O-CB 3.38Å; V417-W421 PolarHBondContact O-N 2.89Å
418	F	84.8	Confident	82.4	Confident	80 Å²	80	70.9 Å²	70.9	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-65.4	-44.7	175.9	-74.7	-61.4	0	0	0	112.7	A414 S415 I416 I420 W421 T422 I444	A414-F418 HydrophobicContact CB-CD2 4.49Å; A414-F418 HydrophobicContact CB-CE2 4.33Å; A414-F418 WeakPolarHBondContact O-CD2 3.38Å; A414-F418 PolarHBondContact O-N 2.99Å; S415-F418 PolarHBondContact O-N 3.46Å; I416-F418 VanDerWaalsContact C-N 3.25Å; I416-F418 PolarHBondContact O-N 2.73Å; F418-I420 VanDerWaalsContact C-N 3.3Å; F418-I420 PolarHBondContact O-N 2.69Å; F418-W421 WeakPolarHBondContact O-CB 3.48Å; F418-W421 PolarHBondContact O-N 3.42Å; F418-T422 WeakPolarHBondContact O-CG2 3.49Å; F418-T422 PolarHBondContact O-N 2.92Å; F418-T422 PolarHBondContact O-OG1 2.87Å; F418-T422 VanDerWaalsContact O-OG1 3.12Å; F418-I444 HydrophobicContact CD1-CD1 4.3Å; F418-I444 HydrophobicContact CD1-CG1 3.91Å; F418-I444 HydrophobicContact CD2-CG1 4.04Å; F418-I444 HydrophobicContact CE1-CD1 3.76Å; F418-I444 HydrophobicContact CE1-CG1 3.9Å; F418-I444 HydrophobicContact CE2-CD1 4.04Å; F418-I444 HydrophobicContact CE2-CG1 4.04Å; F418-I444 HydrophobicContact CG-CG1 4.01Å; F418-I444 HydrophobicContact CZ-CD1 3.63Å; F418-I444 HydrophobicContact CZ-CG1 3.98Å
419	I	82.1	Confident	81.7	Confident	68 Å²	68	72.6 Å²	72.6	35%	0.349	38%	0.376	S	S	.	.	H	α-helix	trans	-59	-42.9	176.4	-69.3	162.4	0	0	0	110.9	S415 I416 T422 T423 W445	S415-I419 WeakPolarHBondContact O-CD1 3.17Å; S415-I419 VanDerWaalsContact O-CG1 3.23Å; S415-I419 WeakPolarHBondContact O-CG1 3.41Å; S415-I419 PolarHBondContact O-N 2.9Å; I416-I419 PolarHBondContact O-N 2.96Å; I419-T422 PolarHBondContact O-OG1 3.46Å; I419-T422 VanDerWaalsContact O-OG1 3.13Å; I419-T423 WeakPolarHBondContact O-CB 3.44Å; I419-T423 PolarHBondContact O-N 2.68Å; I419-T423 PolarHBondContact O-OG1 2.58Å; I419-W445 HydrophobicContact CD1-CH2 3.98Å; I419-W445 HydrophobicContact CG1-CH2 3.8Å; I419-W445 HydrophobicContact CG1-CZ2 4.04Å
420	I	83.6	Confident	80.8	Confident	96 Å²	96	75 Å²	75	49%	0.492	40%	0.395	S	S	.	.	H	α-helix	trans	-63	-46.7	177.4	-67.7	168	0	0	0	110	I416 V417 F418 T423 M424	I416-I420 HydrophobicContact CG2-CD1 3.82Å; I416-I420 HydrophobicContact CG2-CG1 4.43Å; I416-I420 WeakPolarHBondContact O-CG1 3.35Å; I416-I420 PolarHBondContact O-N 3.38Å; V417-I420 PolarHBondContact O-N 3.44Å; F418-I420 VanDerWaalsContact C-N 3.3Å; F418-I420 PolarHBondContact O-N 2.69Å; I420-T423 PolarHBondContact O-N 3.49Å; I420-M424 HydrophobicContact CG2-CG 4.44Å; I420-M424 WeakPolarHBondContact O-CB 3.42Å; I420-M424 VanDerWaalsContact O-CG 3.24Å; I420-M424 WeakPolarHBondContact O-CG 3.27Å; I420-M424 PolarHBondContact O-N 3.25Å
421	W	84.3	Confident	80	Confident	148 Å²	148	71.3 Å²	71.3	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-58.5	-51.8	177.7	177.9	-84.5	0	0	0	112.1	V417 F418 T423 M424 K425	V417-W421 WeakPolarHBondContact O-CB 3.38Å; V417-W421 PolarHBondContact O-N 2.89Å; F418-W421 WeakPolarHBondContact O-CB 3.48Å; F418-W421 PolarHBondContact O-N 3.42Å; W421-T423 VanDerWaalsContact C-N 3.33Å; W421-T423 PolarHBondContact O-N 3.37Å; W421-M424 PolarHBondContact O-N 3.01Å; W421-K425 HydrophobicContact CZ2-CG 4.47Å; W421-K425 WeakPolarHBondContact O-CB 3.26Å; W421-K425 PolarHBondContact O-N 3.16Å
422	T	79.5	Confident	79.5	Confident	22 Å²	22	71.3 Å²	71.3	14%	0.135	38%	0.376	C	S	.	.	H	α-helix	trans	-65.5	-37	-179	58.4	0	0	0	0	111.5	F418 I419 K425 F426 D441	F418-T422 WeakPolarHBondContact O-CG2 3.49Å; F418-T422 PolarHBondContact O-N 2.92Å; F418-T422 PolarHBondContact O-OG1 2.87Å; F418-T422 VanDerWaalsContact O-OG1 3.12Å; I419-T422 PolarHBondContact O-OG1 3.46Å; I419-T422 VanDerWaalsContact O-OG1 3.13Å; T422-K425 PolarHBondContact O-N 2.79Å; T422-F426 HydrophobicContact CG2-CD2 4.35Å; T422-F426 HydrophobicContact CG2-CE2 4.36Å; T422-F426 WeakPolarHBondContact O-CB 3.49Å; T422-F426 PolarHBondContact O-N 3Å; T422-D441 WeakPolarHBondContact CG2-OD1 2.91Å
423	T	79.1	Confident	78.9	Confident	52 Å²	52	72.5 Å²	72.5	32%	0.319	39%	0.387	S	S	.	.	I	π-helix	trans	-62.9	-46	174.6	-59.3	0	0	0	0	111.4	I419 I420 W421 K425 R427 I428	I419-T423 WeakPolarHBondContact O-CB 3.44Å; I419-T423 PolarHBondContact O-N 2.68Å; I419-T423 PolarHBondContact O-OG1 2.58Å; I420-T423 PolarHBondContact O-N 3.49Å; W421-T423 VanDerWaalsContact C-N 3.33Å; W421-T423 PolarHBondContact O-N 3.37Å; T423-K425 PolarHBondContact O-N 3.18Å; T423-R427 HydrophobicContact CG2-CB 4.21Å; T423-R427 WeakPolarHBondContact O-CA 3.47Å; T423-R427 WeakPolarHBondContact O-CB 3.26Å; T423-R427 PolarHBondContact O-N 3.04Å; T423-I428 HydrophobicContact CG2-CD1 4.35Å; T423-I428 PolarHBondContact O-N 3.49Å
424	M	80.4	Confident	78.5	Confident	113 Å²	113	73.4 Å²	73.4	56%	0.557	39%	0.385	S	S	*	.	I	π-helix	trans	-65.2	-39.3	179	-71.5	-70.8	151.5	0	0	112.2	I420 W421 I428	I420-M424 HydrophobicContact CG2-CG 4.44Å; I420-M424 WeakPolarHBondContact O-CB 3.42Å; I420-M424 VanDerWaalsContact O-CG 3.24Å; I420-M424 WeakPolarHBondContact O-CG 3.27Å; I420-M424 PolarHBondContact O-N 3.25Å; W421-M424 PolarHBondContact O-N 3.01Å; M424-I428 HydrophobicContact CE-CD1 3.66Å; M424-I428 HydrophobicContact SD-CD1 3.69Å
425	K	77.4	Confident	78.1	Confident	76 Å²	76	73.2 Å²	73.2	33%	0.33	38%	0.377	S	S	.	.	I	π-helix	trans	-81.9	-41.6	-176.4	-82.4	-67.7	-160.2	163.4	0	114.4	W421 T422 T423 V429 D434	W421-K425 HydrophobicContact CZ2-CG 4.47Å; W421-K425 WeakPolarHBondContact O-CB 3.26Å; W421-K425 PolarHBondContact O-N 3.16Å; T422-K425 PolarHBondContact O-N 2.79Å; T423-K425 PolarHBondContact O-N 3.18Å; K425-V429 WeakPolarHBondContact O-CG2 3.38Å; K425-D434 IonicContact NZ-OD2 2.83Å; K425-D434 PolarHBondContact NZ-OD2 2.78Å
426	F	71.9	Confident	77.9	Confident	32 Å²	32	81 Å²	81	14%	0.14	40%	0.402	C	S	.	.	I	π-helix	trans	-106	-26.5	-171.3	-61.3	-61.3	0	0	0	114.1	T422 Q432 E437	T422-F426 HydrophobicContact CG2-CD2 4.35Å; T422-F426 HydrophobicContact CG2-CE2 4.36Å; T422-F426 WeakPolarHBondContact O-CB 3.49Å; T422-F426 PolarHBondContact O-N 3Å; F426-Q432 HydrophobicContact CD1-CG 4.13Å; F426-E437 HydrophobicContact CZ-CB 4.4Å
427	R	69.7	Low	77.7	Confident	141 Å²	141	82.8 Å²	82.8	53%	0.532	41%	0.41	S	S	.	.	I	π-helix	trans	-102.3	-33.4	-170.3	-58.7	-67.6	-100.8	-97.9	-8.1	114.7	F27 S28 T423	F27-R427 PolarHBondContact O-NH2 3.01Å; S28-R427 PolarHBondContact O-NH1 3.19Å; S28-R427 PolarHBondContact O-NH2 3.45Å; T423-R427 HydrophobicContact CG2-CB 4.21Å; T423-R427 WeakPolarHBondContact O-CA 3.47Å; T423-R427 WeakPolarHBondContact O-CB 3.26Å; T423-R427 PolarHBondContact O-N 3.04Å
428	I	71.1	Confident	77.3	Confident	106 Å²	106	79.8 Å²	79.8	54%	0.544	39%	0.39	S	S	.	.	S	Bend	trans	-88.7	-24.5	-175.7	-66.5	173.8	0	0	0	111.9	T423 M424 T430	T423-I428 HydrophobicContact CG2-CD1 4.35Å; T423-I428 PolarHBondContact O-N 3.49Å; M424-I428 HydrophobicContact CE-CD1 3.66Å; M424-I428 HydrophobicContact SD-CD1 3.69Å; I428-T430 PolarHBondContact O-N 3.28Å
429	V	71.9	Confident	77.2	Confident	63 Å²	63	80 Å²	80	38%	0.382	39%	0.389	S	S	.	.			trans	-79.1	123.9	-176.6	-166.2	0	0	0	0	110	K425 C431	K425-V429 WeakPolarHBondContact O-CG2 3.38Å; V429-C431 WeakPolarHBondContact CG1-O 3.49Å; V429-C431 PolarHBondContact O-N 3.21Å
430	T	68.7	Low	77.3	Confident	136 Å²	136	79.5 Å²	79.5	83%	0.834	39%	0.389	S	S	*	.	S	Bend	trans	-62.2	-29.5	177.5	49.7	0	0	0	0	112.4	N91 I428	N91-T430 PolarHBondContact ND2-O 3.06Å; I428-T430 PolarHBondContact O-N 3.28Å
431	C	72.3	Confident	77.1	Confident	47 Å²	47	76.1 Å²	76.1	32%	0.318	37%	0.372	S	S	.	.	S	Bend	trans	-127.6	112.1	174.8	-172.8	0	0	0	0	113.4	C89 V429 S433	C89-C431 WeakPolarHBondContact CA-SG 3.12Å; C89-C431 HydrophobicContact CB-CB 4.36Å; C89-C431 WeakPolarHBondContact CB-SG 3.48Å; C89-C431 WeakPolarHBondContact SG-CA 3.39Å; C89-C431 WeakPolarHBondContact SG-CB 3.45Å; C89-C431 CovalentContact SG-SG 2.03Å; C89-C431 PolarHBondContact SG-SG 2.81Å; V429-C431 WeakPolarHBondContact CG1-O 3.49Å; V429-C431 PolarHBondContact O-N 3.21Å; C431-S433 PolarHBondContact O-N 3.05Å; C431-S433 VanDerWaalsContact O-N 3.12Å
432	Q	74.5	Confident	76.8	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.07	35%	0.349	C	S	.	.			trans	-81.3	90	177.7	-173.4	176.2	-54.5	0	0	111.1	Y90 F426	Y90-Q432 WeakPolarHBondContact CB-O 3.28Å; Y90-Q432 PolarHBondContact N-O 3.48Å; Y90-Q432 VanDerWaalsContact N-O 3.16Å; F426-Q432 HydrophobicContact CD1-CG 4.13Å
433	S	73.1	Confident	77.1	Confident	73 Å²	73	69 Å²	69	51%	0.51	34%	0.344	S	S	.	.			trans	-79.4	-26.9	175.4	60.6	0	0	0	0	113.4	C431 W435	C431-S433 PolarHBondContact O-N 3.05Å; C431-S433 VanDerWaalsContact O-N 3.12Å; S433-W435 PolarHBondContact O-N 2.81Å
434	D	78.9	Confident	77.3	Confident	65 Å²	65	67.8 Å²	67.8	35%	0.348	34%	0.336	S	S	.	.			trans	-84	39.9	-177.9	-65	-17.5	0	0	0	112.1	K425 R436 E437	K425-D434 IonicContact NZ-OD2 2.83Å; K425-D434 PolarHBondContact NZ-OD2 2.78Å; D434-R436 PolarHBondContact O-N 2.87Å; D434-E437 PolarHBondContact O-N 3.05Å
435	W	78.3	Confident	77.5	Confident	32 Å²	32	65.8 Å²	65.8	12%	0.121	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-60.2	-20.4	-177.7	55.7	-98.8	0	0	0	113.4	I58 Y90 D179 P181 L221 S433 E437 L438	I58-W435 HydrophobicContact CD1-CB 4.31Å; I58-W435 HydrophobicContact CD1-CE3 4.15Å; I58-W435 HydrophobicContact CG2-CD2 4.36Å; I58-W435 HydrophobicContact CG2-CE3 3.53Å; I58-W435 HydrophobicContact CG2-CH2 4.3Å; I58-W435 HydrophobicContact CG2-CZ3 3.5Å; I58-W435 VanDerWaalsContact CG2-CZ3 3.5Å; Y90-W435 HydrophobicContact CD2-CB 4.44Å; Y90-W435 HydrophobicContact CG-CB 4.37Å; D179-W435 HydrophobicContact CB-CH2 4.11Å; D179-W435 WeakPolarHBondContact O-CZ2 3.49Å; P181-W435 HydrophobicContact CG-CB 4.47Å; P181-W435 HydrophobicContact CG-CD2 4.21Å; P181-W435 HydrophobicContact CG-CG 3.91Å; L221-W435 HydrophobicContact CD2-CH2 3.49Å; L221-W435 VanDerWaalsContact CD2-CH2 3.49Å; L221-W435 HydrophobicContact CD2-CZ3 3.38Å; L221-W435 HydrophobicContact CG-CZ3 3.96Å; S433-W435 PolarHBondContact O-N 2.81Å; W435-E437 PolarHBondContact O-N 2.92Å; W435-L438 HydrophobicContact CB-CD1 3.83Å; W435-L438 WeakPolarHBondContact O-CB 3.26Å; W435-L438 VanDerWaalsContact O-CD1 3.32Å; W435-L438 WeakPolarHBondContact O-CD1 3.48Å; W435-L438 PolarHBondContact O-N 2.84Å
436	R	81.2	Confident	77.9	Confident	187 Å²	187	63.4 Å²	63.4	71%	0.706	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.2	-20.4	175	-67.6	177.4	66.5	-135.2	0.1	113.6	D434 W439	D434-R436 PolarHBondContact O-N 2.87Å; R436-W439 PolarHBondContact O-NE1 2.78Å
437	E	81.4	Confident	78.8	Confident	90 Å²	90	65 Å²	65	42%	0.421	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-99	1.9	-178.8	-62.7	-174.4	-175.3	0	0	113.3	F426 D434 W435 W439 V440	F426-E437 HydrophobicContact CZ-CB 4.4Å; D434-E437 PolarHBondContact O-N 3.05Å; W435-E437 PolarHBondContact O-N 2.92Å; E437-W439 VanDerWaalsContact C-N 3.3Å; E437-W439 PolarHBondContact O-N 3.38Å; E437-V440 HydrophobicContact CB-CG2 4.38Å; E437-V440 VanDerWaalsContact O-CB 3.23Å; E437-V440 WeakPolarHBondContact O-CB 3.44Å; E437-V440 WeakPolarHBondContact O-CG2 3.17Å; E437-V440 PolarHBondContact O-N 3.45Å
438	L	78.6	Confident	79.6	Confident	34 Å²	34	59.8 Å²	59.8	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-52.3	-44.3	-179.7	-91.9	155.2	0	0	0	113.2	I58 Y90 W435 V440 D441	I58-L438 HydrophobicContact CD1-CD1 3.94Å; Y90-L438 HydrophobicContact CD1-CD1 3.93Å; Y90-L438 HydrophobicContact CD2-CD1 4.05Å; Y90-L438 HydrophobicContact CE1-CD1 3.84Å; Y90-L438 HydrophobicContact CE1-CD2 4.11Å; Y90-L438 HydrophobicContact CE2-CD1 3.99Å; Y90-L438 HydrophobicContact CG-CD1 4.02Å; W435-L438 HydrophobicContact CB-CD1 3.83Å; W435-L438 WeakPolarHBondContact O-CB 3.26Å; W435-L438 VanDerWaalsContact O-CD1 3.32Å; W435-L438 WeakPolarHBondContact O-CD1 3.48Å; W435-L438 PolarHBondContact O-N 2.84Å; L438-V440 PolarHBondContact O-N 2.81Å; L438-V440 VanDerWaalsContact O-N 3.1Å; L438-D441 PolarHBondContact O-N 2.97Å; L438-D441 VanDerWaalsContact O-N 3.15Å
439	W	83.1	Confident	80.5	Confident	83 Å²	83	57 Å²	57	31%	0.314	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-21	-179.2	70.4	-87.3	0	0	0	113.5	P225 F229 R436 E437 D441 D442 A443	P225-W439 HydrophobicContact CB-CD2 3.82Å; P225-W439 HydrophobicContact CB-CE3 4.41Å; P225-W439 HydrophobicContact CB-CG 3.92Å; P225-W439 HydrophobicContact CB-CZ2 4.38Å; P225-W439 HydrophobicContact CG-CB 4.1Å; P225-W439 VanDerWaalsContact CG-CD1 3.48Å; P225-W439 HydrophobicContact CG-CD2 4.08Å; P225-W439 HydrophobicContact CG-CG 3.61Å; F229-W439 HydrophobicContact CB-CZ3 4.43Å; F229-W439 HydrophobicContact CD2-CZ3 4.44Å; R436-W439 PolarHBondContact O-NE1 2.78Å; E437-W439 VanDerWaalsContact C-N 3.3Å; E437-W439 PolarHBondContact O-N 3.38Å; W439-D441 VanDerWaalsContact C-N 3.28Å; W439-D441 PolarHBondContact O-N 3.04Å; W439-D442 PolarHBondContact O-N 3.21Å; W439-A443 HydrophobicContact CE3-CB 3.8Å; W439-A443 HydrophobicContact CZ3-CB 3.81Å; W439-A443 WeakPolarHBondContact O-CB 3.34Å; W439-A443 PolarHBondContact O-N 3.45Å
440	V	84.5	Confident	81.3	Confident	58 Å²	58	54.3 Å²	54.3	35%	0.352	27%	0.271	S	S	.	.	H	α-helix	trans	-65.8	-33.7	179.3	-179.6	0	0	0	0	110.8	E437 L438 D442 A443 I444	E437-V440 HydrophobicContact CB-CG2 4.38Å; E437-V440 VanDerWaalsContact O-CB 3.23Å; E437-V440 WeakPolarHBondContact O-CB 3.44Å; E437-V440 WeakPolarHBondContact O-CG2 3.17Å; E437-V440 PolarHBondContact O-N 3.45Å; L438-V440 PolarHBondContact O-N 2.81Å; L438-V440 VanDerWaalsContact O-N 3.1Å; V440-D442 VanDerWaalsContact C-N 3.32Å; V440-D442 PolarHBondContact O-N 3.14Å; V440-A443 PolarHBondContact O-N 3.28Å; V440-I444 WeakPolarHBondContact O-CB 3.41Å; V440-I444 WeakPolarHBondContact O-CG2 3.49Å; V440-I444 PolarHBondContact O-N 3.02Å
441	D	78.8	Confident	82.4	Confident	26 Å²	26	53.3 Å²	53.3	14%	0.139	26%	0.258	C	S	.	.	H	α-helix	trans	-61.1	-41.9	177.7	-168.6	76.6	0	0	0	111.1	A32 T422 L438 W439 W445	A32-D441 WeakPolarHBondContact CB-OD2 3.36Å; A32-D441 PolarHBondContact N-OD2 2.91Å; T422-D441 WeakPolarHBondContact CG2-OD1 2.91Å; L438-D441 PolarHBondContact O-N 2.97Å; L438-D441 VanDerWaalsContact O-N 3.15Å; W439-D441 VanDerWaalsContact C-N 3.28Å; W439-D441 PolarHBondContact O-N 3.04Å; D441-W445 PolarHBondContact O-NE1 3.39Å
442	D	77.8	Confident	83.3	Confident	14 Å²	14	53.1 Å²	53.1	8%	0.075	25%	0.254	C	S	.	.	H	α-helix	trans	-74.6	-39	176.6	-171.8	64.3	0	0	0	112.4	W439 V440 R446	W439-D442 PolarHBondContact O-N 3.21Å; V440-D442 VanDerWaalsContact C-N 3.32Å; V440-D442 PolarHBondContact O-N 3.14Å; D442-R446 VanDerWaalsContact CG-CZ 3.41Å; D442-R446 PolarHBondContact O-NH1 3.12Å; D442-R446 IonicContact OD1-CZ 3.64Å; D442-R446 IonicContact OD1-NH1 2.62Å; D442-R446 PolarHBondContact OD1-NH1 2.95Å; D442-R446 IonicContact OD1-NH2 3.16Å; D442-R446 PolarHBondContact OD1-NH2 3.35Å; D442-R446 IonicContact OD2-CZ 3.39Å; D442-R446 IonicContact OD2-NE 3.7Å; D442-R446 IonicContact OD2-NH1 3.04Å; D442-R446 PolarHBondContact OD2-NH1 3.49Å; D442-R446 IonicContact OD2-NH2 2.71Å; D442-R446 PolarHBondContact OD2-NH2 3.22Å; D442-R446 VanDerWaalsContact OD2-NH2 3.15Å
443	A	85.7	Confident	84	Confident	5 Å²	5	53 Å²	53	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-68.7	-38.7	-176.3	0	0	0	0	0	113.2	F229 W439 V440 W445 R446 L447	F229-A443 HydrophobicContact CD1-CB 4.13Å; F229-A443 HydrophobicContact CD2-CB 3.93Å; F229-A443 HydrophobicContact CE1-CB 3.96Å; F229-A443 HydrophobicContact CE2-CB 3.73Å; F229-A443 HydrophobicContact CG-CB 4.11Å; F229-A443 HydrophobicContact CZ-CB 3.75Å; F229-A443 VanDerWaalsContact CZ-O 3.29Å; F229-A443 WeakPolarHBondContact CZ-O 3.37Å; W439-A443 HydrophobicContact CE3-CB 3.8Å; W439-A443 HydrophobicContact CZ3-CB 3.81Å; W439-A443 WeakPolarHBondContact O-CB 3.34Å; W439-A443 PolarHBondContact O-N 3.45Å; V440-A443 PolarHBondContact O-N 3.28Å; A443-W445 PolarHBondContact O-N 3.45Å; A443-R446 PolarHBondContact O-N 3.46Å; A443-L447 PolarHBondContact O-N 3.08Å
444	I	84.4	Confident	85	Confident	27 Å²	27	53.5 Å²	53.5	14%	0.138	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-39.5	-170.3	-163.7	65.3	0	0	0	112.7	F418 V440 R446 L447 L448	F418-I444 HydrophobicContact CD1-CD1 4.3Å; F418-I444 HydrophobicContact CD1-CG1 3.91Å; F418-I444 HydrophobicContact CD2-CG1 4.04Å; F418-I444 HydrophobicContact CE1-CD1 3.76Å; F418-I444 HydrophobicContact CE1-CG1 3.9Å; F418-I444 HydrophobicContact CE2-CD1 4.04Å; F418-I444 HydrophobicContact CE2-CG1 4.04Å; F418-I444 HydrophobicContact CG-CG1 4.01Å; F418-I444 HydrophobicContact CZ-CD1 3.63Å; F418-I444 HydrophobicContact CZ-CG1 3.98Å; V440-I444 WeakPolarHBondContact O-CB 3.41Å; V440-I444 WeakPolarHBondContact O-CG2 3.49Å; V440-I444 PolarHBondContact O-N 3.02Å; I444-R446 VanDerWaalsContact C-N 3.32Å; I444-R446 PolarHBondContact O-N 3.07Å; I444-L447 PolarHBondContact O-N 3.03Å; I444-L448 WeakPolarHBondContact O-CB 2.96Å; I444-L448 PolarHBondContact O-N 2.87Å
445	W	84.6	Confident	85.6	Confident	71 Å²	71	52.5 Å²	52.5	27%	0.269	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-38.5	178.6	-63.3	107.5	0	0	0	112.1	P31 I419 D441 A443 F449	P31-W445 HydrophobicContact CB-CG 3.98Å; I419-W445 HydrophobicContact CD1-CH2 3.98Å; I419-W445 HydrophobicContact CG1-CH2 3.8Å; I419-W445 HydrophobicContact CG1-CZ2 4.04Å; D441-W445 PolarHBondContact O-NE1 3.39Å; A443-W445 PolarHBondContact O-N 3.45Å; W445-F449 PolarHBondContact O-N 3.14Å
446	R	86.1	Confident	86.1	Confident	27 Å²	27	51.8 Å²	51.8	10%	0.102	24%	0.241	C	C	.	.	H	α-helix	trans	-69.2	-40.4	176.3	-70	165.1	176.3	73.1	-10.7	111.4	F229 D442 A443 I444 F449 S450	F229-R446 HydrophobicContact CE1-CB 4.05Å; F229-R446 HydrophobicContact CZ-CB 4.01Å; D442-R446 VanDerWaalsContact CG-CZ 3.41Å; D442-R446 PolarHBondContact O-NH1 3.12Å; D442-R446 IonicContact OD1-CZ 3.64Å; D442-R446 IonicContact OD1-NH1 2.62Å; D442-R446 PolarHBondContact OD1-NH1 2.95Å; D442-R446 IonicContact OD1-NH2 3.16Å; D442-R446 PolarHBondContact OD1-NH2 3.35Å; D442-R446 IonicContact OD2-CZ 3.39Å; D442-R446 IonicContact OD2-NE 3.7Å; D442-R446 IonicContact OD2-NH1 3.04Å; D442-R446 PolarHBondContact OD2-NH1 3.49Å; D442-R446 IonicContact OD2-NH2 2.71Å; D442-R446 PolarHBondContact OD2-NH2 3.22Å; D442-R446 VanDerWaalsContact OD2-NH2 3.15Å; A443-R446 PolarHBondContact O-N 3.46Å; I444-R446 VanDerWaalsContact C-N 3.32Å; I444-R446 PolarHBondContact O-N 3.07Å; R446-F449 PolarHBondContact O-N 3.06Å; R446-S450 WeakPolarHBondContact O-CB 2.88Å; R446-S450 PolarHBondContact O-N 3Å
447	L	89.7	Confident	86.5	Confident	65 Å²	65	43 Å²	43	34%	0.34	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-45.5	175.9	-173.2	149.8	0	0	0	110.9	M233 A443 I444 F449 S450 M451	M233-L447 HydrophobicContact CE-CB 3.92Å; M233-L447 HydrophobicContact CE-CD1 3.84Å; M233-L447 HydrophobicContact CE-CG 3.88Å; A443-L447 PolarHBondContact O-N 3.08Å; I444-L447 PolarHBondContact O-N 3.03Å; L447-F449 PolarHBondContact O-N 3.43Å; L447-S450 CarbonylContact O-C 3.6Å; L447-S450 WeakPolarHBondContact O-CB 3.44Å; L447-S450 PolarHBondContact O-N 3.19Å; L447-S450 VanDerWaalsContact O-N 3.13Å; L447-M451 HydrophobicContact CD2-CG 3.93Å; L447-M451 WeakPolarHBondContact O-CG 3.18Å; L447-M451 PolarHBondContact O-N 3.22Å
448	L	86.8	Confident	86.9	Confident	31 Å²	31	41.5 Å²	41.5	16%	0.162	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-45.9	177.4	-171.4	156.5	0	0	0	111	I444 S450 M451 I452	I444-L448 WeakPolarHBondContact O-CB 2.96Å; I444-L448 PolarHBondContact O-N 2.87Å; L448-S450 VanDerWaalsContact C-N 3.33Å; L448-S450 PolarHBondContact O-N 3.12Å; L448-M451 PolarHBondContact O-N 3.31Å; L448-I452 HydrophobicContact CD2-CD1 3.49Å; L448-I452 VanDerWaalsContact CD2-CD1 3.49Å; L448-I452 HydrophobicContact CD2-CG1 4.19Å; L448-I452 WeakPolarHBondContact O-CG1 3.26Å; L448-I452 PolarHBondContact O-N 2.7Å
449	F	89.4	Confident	87.2	Confident	47 Å²	47	41.7 Å²	41.7	21%	0.206	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-45.3	173.5	178.8	-87.7	0	0	0	111.9	Y237 V265 K304 A308 W445 R446 L447 M451 I452 L453	Y237-F449 WeakPolarHBondContact OH-CD1 2.65Å; V265-F449 HydrophobicContact CG1-CZ 4.06Å; K304-F449 HydrophobicContact CD-CE1 4.05Å; K304-F449 HydrophobicContact CD-CZ 4.25Å; K304-F449 HydrophobicContact CG-CZ 4.31Å; A308-F449 HydrophobicContact CB-CE2 3.56Å; A308-F449 HydrophobicContact CB-CZ 3.77Å; W445-F449 PolarHBondContact O-N 3.14Å; R446-F449 PolarHBondContact O-N 3.06Å; L447-F449 PolarHBondContact O-N 3.43Å; F449-M451 VanDerWaalsContact C-N 3.33Å; F449-M451 PolarHBondContact O-N 3.13Å; F449-I452 PolarHBondContact O-N 3.4Å; F449-L453 HydrophobicContact CE1-CD1 4.19Å; F449-L453 HydrophobicContact CZ-CD1 4.4Å; F449-L453 WeakPolarHBondContact O-CB 3.32Å; F449-L453 PolarHBondContact O-N 3.42Å
450	S	90.5	Very high	87.3	Confident	7 Å²	7	38.1 Å²	38.1	5%	0.049	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-39.9	177.6	-165.8	0	0	0	0	112.2	R446 L447 L448 L453 F454	R446-S450 WeakPolarHBondContact O-CB 2.88Å; R446-S450 PolarHBondContact O-N 3Å; L447-S450 CarbonylContact O-C 3.6Å; L447-S450 WeakPolarHBondContact O-CB 3.44Å; L447-S450 PolarHBondContact O-N 3.19Å; L447-S450 VanDerWaalsContact O-N 3.13Å; L448-S450 VanDerWaalsContact C-N 3.33Å; L448-S450 PolarHBondContact O-N 3.12Å; S450-L453 PolarHBondContact O-N 2.94Å; S450-F454 WeakPolarHBondContact O-CB 3.48Å; S450-F454 PolarHBondContact O-N 2.95Å
451	M	91.2	Very high	87.4	Confident	115 Å²	115	42.1 Å²	42.1	57%	0.567	20%	0.201	S	C	*	.	H	α-helix	trans	-66	-43.8	176.6	-75.3	-59.5	-142	0	0	112	L447 L448 F449 L453 F454 V455	L447-M451 HydrophobicContact CD2-CG 3.93Å; L447-M451 WeakPolarHBondContact O-CG 3.18Å; L447-M451 PolarHBondContact O-N 3.22Å; L448-M451 PolarHBondContact O-N 3.31Å; F449-M451 VanDerWaalsContact C-N 3.33Å; F449-M451 PolarHBondContact O-N 3.13Å; M451-L453 VanDerWaalsContact C-N 3.34Å; M451-L453 PolarHBondContact O-N 2.87Å; M451-F454 PolarHBondContact O-N 2.75Å; M451-V455 WeakPolarHBondContact O-CG2 3.14Å; M451-V455 PolarHBondContact O-N 2.8Å
452	I	89.8	Confident	87.3	Confident	44 Å²	44	41.2 Å²	41.2	23%	0.226	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-46.7	174.6	-66.3	172.2	0	0	0	110.3	A411 L448 F449 F454 V455 I456	A411-I452 HydrophobicContact CB-CD1 3.77Å; A411-I452 HydrophobicContact CB-CG1 3.95Å; L448-I452 HydrophobicContact CD2-CD1 3.49Å; L448-I452 VanDerWaalsContact CD2-CD1 3.49Å; L448-I452 HydrophobicContact CD2-CG1 4.19Å; L448-I452 WeakPolarHBondContact O-CG1 3.26Å; L448-I452 PolarHBondContact O-N 2.7Å; F449-I452 PolarHBondContact O-N 3.4Å; I452-F454 VanDerWaalsContact C-N 3.3Å; I452-F454 PolarHBondContact O-N 2.79Å; I452-V455 PolarHBondContact O-N 2.92Å; I452-I456 HydrophobicContact CG2-CD1 3.74Å; I452-I456 HydrophobicContact CG2-CG1 4.3Å; I452-I456 WeakPolarHBondContact O-CG1 3.34Å; I452-I456 PolarHBondContact O-N 2.79Å
453	L	90.9	Very high	86.9	Confident	12 Å²	12	42.8 Å²	42.8	6%	0.063	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-41.9	178.9	-177.5	114.4	0	0	0	111.5	Y237 F240 V265 I266 F449 S450 M451 I456 M457	Y237-L453 HydrophobicContact CE1-CD2 4.09Å; F240-L453 HydrophobicContact CD2-CD2 3.59Å; F240-L453 HydrophobicContact CE2-CD2 3.94Å; V265-L453 HydrophobicContact CB-CD1 4.37Å; V265-L453 HydrophobicContact CG1-CD1 3.55Å; I266-L453 HydrophobicContact CG1-CD1 4.36Å; I266-L453 HydrophobicContact CG1-CD2 4.03Å; I266-L453 HydrophobicContact CG1-CG 4.48Å; F449-L453 HydrophobicContact CE1-CD1 4.19Å; F449-L453 HydrophobicContact CZ-CD1 4.4Å; F449-L453 WeakPolarHBondContact O-CB 3.32Å; F449-L453 PolarHBondContact O-N 3.42Å; S450-L453 PolarHBondContact O-N 2.94Å; M451-L453 VanDerWaalsContact C-N 3.34Å; M451-L453 PolarHBondContact O-N 2.87Å; L453-I456 PolarHBondContact O-N 2.87Å; L453-M457 WeakPolarHBondContact O-CB 3.39Å; L453-M457 PolarHBondContact O-N 2.88Å
454	F	92.7	Very high	85.2	Confident	84 Å²	84	45.2 Å²	45.2	37%	0.368	23%	0.229	S	C	.	.	H	α-helix	trans	-60.6	-45.2	174.5	178.9	-106.1	0	0	0	112.3	F240 S450 M451 I452 I456 M457 V458	F240-F454 HydrophobicContact CD1-CD2 4.26Å; F240-F454 HydrophobicContact CE1-CB 4.4Å; F240-F454 AromaticContact CE1-CD2 3.45Å; F240-F454 HydrophobicContact CE1-CD2 3.45Å; F240-F454 VanDerWaalsContact CE1-CD2 3.45Å; F240-F454 HydrophobicContact CE1-CE2 4.14Å; F240-F454 HydrophobicContact CE1-CG 4.29Å; F240-F454 HydrophobicContact CE2-CB 4.21Å; F240-F454 HydrophobicContact CZ-CB 3.75Å; F240-F454 AromaticContact CZ-CD2 3.69Å; F240-F454 HydrophobicContact CZ-CD2 3.69Å; F240-F454 HydrophobicContact CZ-CG 4.07Å; S450-F454 WeakPolarHBondContact O-CB 3.48Å; S450-F454 PolarHBondContact O-N 2.95Å; M451-F454 PolarHBondContact O-N 2.75Å; I452-F454 VanDerWaalsContact C-N 3.3Å; I452-F454 PolarHBondContact O-N 2.79Å; F454-I456 PolarHBondContact O-N 2.85Å; F454-M457 HydrophobicContact CD2-CE 3.93Å; F454-M457 HydrophobicContact CE2-CE 3.89Å; F454-M457 WeakPolarHBondContact O-CB 3.39Å; F454-M457 PolarHBondContact O-N 2.86Å; F454-M457 VanDerWaalsContact O-N 3.17Å; F454-V458 HydrophobicContact CE1-CG2 4.3Å; F454-V458 HydrophobicContact CE2-CG2 4.48Å; F454-V458 HydrophobicContact CZ-CG2 4.17Å; F454-V458 PolarHBondContact O-N 3.12Å; F454-V458 VanDerWaalsContact O-N 3.08Å
455	V	91.3	Very high	83.9	Confident	43 Å²	43	47.2 Å²	47.2	26%	0.261	24%	0.24	S	C	.	.	H	α-helix	trans	-64.2	-42.5	177	179.6	0	0	0	0	110.9	T407 M451 I452 M457 V458 L459	T407-V455 HydrophobicContact CG2-CB 3.87Å; T407-V455 HydrophobicContact CG2-CG1 3.56Å; T407-V455 HydrophobicContact CG2-CG2 4.08Å; T407-V455 WeakPolarHBondContact OG1-CG1 3.35Å; M451-V455 WeakPolarHBondContact O-CG2 3.14Å; M451-V455 PolarHBondContact O-N 2.8Å; I452-V455 PolarHBondContact O-N 2.92Å; V455-M457 VanDerWaalsContact C-N 3.26Å; V455-M457 PolarHBondContact O-N 2.85Å; V455-V458 PolarHBondContact O-N 2.83Å; V455-L459 HydrophobicContact CG1-CD1 3.71Å; V455-L459 HydrophobicContact CG1-CD2 4.47Å; V455-L459 VanDerWaalsContact O-CD1 3.31Å; V455-L459 WeakPolarHBondContact O-CD1 3.49Å; V455-L459 PolarHBondContact O-N 3.23Å
456	I	88.9	Confident	82.6	Confident	17 Å²	17	46.2 Å²	46.2	9%	0.087	24%	0.24	C	C	.	.	H	α-helix	trans	-58.1	-42	173.9	-68.5	171	0	0	0	110.5	I262 V312 F404 I452 L453 F454 V458 L459 W460	I262-I456 HydrophobicContact CD1-CG2 4.09Å; I262-I456 HydrophobicContact CG1-CG2 4.36Å; V312-I456 HydrophobicContact CG2-CD1 4.43Å; F404-I456 HydrophobicContact CE2-CD1 4.49Å; F404-I456 HydrophobicContact CE2-CG1 4.28Å; I452-I456 HydrophobicContact CG2-CD1 3.74Å; I452-I456 HydrophobicContact CG2-CG1 4.3Å; I452-I456 WeakPolarHBondContact O-CG1 3.34Å; I452-I456 PolarHBondContact O-N 2.79Å; L453-I456 PolarHBondContact O-N 2.87Å; F454-I456 PolarHBondContact O-N 2.85Å; I456-V458 VanDerWaalsContact C-N 3.32Å; I456-V458 PolarHBondContact O-N 2.66Å; I456-L459 PolarHBondContact O-N 2.93Å; I456-W460 WeakPolarHBondContact O-CB 3.37Å; I456-W460 PolarHBondContact O-N 3.45Å
457	M	90.3	Very high	81	Confident	2 Å²	2	48 Å²	48	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-56.9	-44.9	176.8	-162.5	-169.8	68.4	0	0	111.8	F240 W244 W247 L453 F454 V455 R461	F240-M457 HydrophobicContact CB-SD 4.47Å; W244-M457 HydrophobicContact CD2-CG 4.36Å; W244-M457 HydrophobicContact CE3-CB 4.48Å; W244-M457 HydrophobicContact CE3-CG 3.34Å; W244-M457 HydrophobicContact CE3-SD 4.33Å; W244-M457 HydrophobicContact CZ3-CB 4.46Å; W244-M457 HydrophobicContact CZ3-CG 3.69Å; W247-M457 HydrophobicContact CH2-CE 3.85Å; W247-M457 HydrophobicContact CZ3-CE 3.56Å; W247-M457 HydrophobicContact CZ3-CG 4.03Å; W247-M457 HydrophobicContact CZ3-SD 4.03Å; L453-M457 WeakPolarHBondContact O-CB 3.39Å; L453-M457 PolarHBondContact O-N 2.88Å; F454-M457 HydrophobicContact CD2-CE 3.93Å; F454-M457 HydrophobicContact CE2-CE 3.89Å; F454-M457 WeakPolarHBondContact O-CB 3.39Å; F454-M457 PolarHBondContact O-N 2.86Å; F454-M457 VanDerWaalsContact O-N 3.17Å; V455-M457 VanDerWaalsContact C-N 3.26Å; V455-M457 PolarHBondContact O-N 2.85Å; M457-R461 PolarHBondContact O-N 2.82Å; M457-R461 VanDerWaalsContact O-N 3.16Å
458	V	89.3	Confident	79.1	Confident	59 Å²	59	54.2 Å²	54.2	36%	0.358	27%	0.268	S	S	.	.	H	α-helix	trans	-69.7	-43.1	179.3	175.4	0	0	0	0	111.7	F454 V455 I456	F454-V458 HydrophobicContact CE1-CG2 4.3Å; F454-V458 HydrophobicContact CE2-CG2 4.48Å; F454-V458 HydrophobicContact CZ-CG2 4.17Å; F454-V458 PolarHBondContact O-N 3.12Å; F454-V458 VanDerWaalsContact O-N 3.08Å; V455-V458 PolarHBondContact O-N 2.83Å; I456-V458 VanDerWaalsContact C-N 3.32Å; I456-V458 PolarHBondContact O-N 2.66Å
459	L	86.1	Confident	77.3	Confident	39 Å²	39	57.2 Å²	57.2	20%	0.204	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-35.7	-178.5	-93.6	61.5	0	0	0	112.5	H403 F404 V455 I456	H403-L459 HydrophobicContact CB-CD2 4.19Å; F404-L459 HydrophobicContact CB-CD2 3.84Å; F404-L459 HydrophobicContact CD2-CD2 4.39Å; V455-L459 HydrophobicContact CG1-CD1 3.71Å; V455-L459 HydrophobicContact CG1-CD2 4.47Å; V455-L459 VanDerWaalsContact O-CD1 3.31Å; V455-L459 WeakPolarHBondContact O-CD1 3.49Å; V455-L459 PolarHBondContact O-N 3.23Å; I456-L459 PolarHBondContact O-N 2.93Å
460	W	84.7	Confident	75.2	Confident	8 Å²	8	56.1 Å²	56.1	3%	0.03	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	13.3	-173.5	-74.1	79.2	0	0	0	114.1	I258 Q259 I262 V315 I321 L400 I456	I258-W460 HydrophobicContact CB-CZ3 4.2Å; I258-W460 HydrophobicContact CD1-CH2 3.99Å; I258-W460 HydrophobicContact CD1-CZ3 3.8Å; I258-W460 HydrophobicContact CG2-CE3 3.92Å; I258-W460 HydrophobicContact CG2-CH2 4.46Å; I258-W460 HydrophobicContact CG2-CZ3 3.82Å; Q259-W460 PolarHBondContact NE2-O 3.08Å; Q259-W460 VanDerWaalsContact NE2-O 3.11Å; I262-W460 HydrophobicContact CD1-CB 3.56Å; I262-W460 HydrophobicContact CD1-CG 4.04Å; V315-W460 HydrophobicContact CB-CZ2 4.19Å; V315-W460 HydrophobicContact CG1-CH2 4.34Å; V315-W460 HydrophobicContact CG1-CZ2 3.5Å; V315-W460 VanDerWaalsContact CG1-CZ2 3.5Å; V315-W460 HydrophobicContact CG2-CH2 4.04Å; V315-W460 HydrophobicContact CG2-CZ2 3.79Å; I321-W460 HydrophobicContact CD1-CE3 4.3Å; I321-W460 HydrophobicContact CD1-CH2 3.11Å; I321-W460 HydrophobicContact CD1-CZ2 3.69Å; I321-W460 HydrophobicContact CD1-CZ3 3.46Å; I321-W460 VanDerWaalsContact CD1-CZ3 3.46Å; I321-W460 HydrophobicContact CG1-CH2 3.71Å; I321-W460 HydrophobicContact CG1-CZ3 3.91Å; L400-W460 HydrophobicContact CD2-CZ2 4.33Å; I456-W460 WeakPolarHBondContact O-CB 3.37Å; I456-W460 PolarHBondContact O-N 3.45Å
461	R	85.9	Confident	73	Confident	142 Å²	142	61.8 Å²	61.8	54%	0.536	30%	0.304	S	S	.	.			trans	-49.4	135.8	179.3	74.2	-175	-167.7	-149.4	2.4	111	W247 M457 S463	W247-R461 HydrophobicContact CE3-CB 4.44Å; M457-R461 PolarHBondContact O-N 2.82Å; M457-R461 VanDerWaalsContact O-N 3.16Å; R461-S463 PolarHBondContact O-N 2.84Å
462	P	76.9	Confident	70.5	Confident	7 Å²	7	59.2 Å²	59.2	5%	0.045	30%	0.298	C	S	.	.			trans	-52.6	130	171.6	-25.3	34	0	0	0	111.2	W247 Y251 L255	W247-P462 HydrophobicContact CB-CG 4.19Å; Y251-P462 HydrophobicContact CD2-CB 3.86Å; Y251-P462 HydrophobicContact CG-CB 4.18Å; L255-P462 HydrophobicContact CD1-CB 4.01Å; L255-P462 HydrophobicContact CD1-CG 3.81Å
463	S	69.1	Low	68.2	Low	47 Å²	47	62.8 Å²	62.8	33%	0.329	32%	0.324	S	S	.	.			trans	-142	135.4	178	176.5	0	0	0	0	108.7	R461 N465 N466	R461-S463 PolarHBondContact O-N 2.84Å; S463-N465 PolarHBondContact O-N 2.86Å; S463-N466 WeakPolarHBondContact O-CB 3.48Å; S463-N466 PolarHBondContact O-N 3.27Å
464	A	51.6	Low	65.9	Low	55 Å²	55	68.1 Å²	68.1	46%	0.455	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.9	-175.8	0	0	0	0	0	114.2	Y251	Y251-A464 HydrophobicContact CD1-CB 4.15Å; Y251-A464 HydrophobicContact CE1-CB 3.89Å
465	N	56	Low	63.2	Low	69 Å²	69	68 Å²	68	37%	0.369	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.2	-178.6	-142.8	9	0	0	0	113.9	S463 Q467 R468 F469	S463-N465 PolarHBondContact O-N 2.86Å; N465-Q467 PolarHBondContact O-N 3.28Å; N465-R468 PolarHBondContact O-N 2.88Å; N465-F469 HydrophobicContact CB-CD2 4.02Å; N465-F469 HydrophobicContact CB-CE2 3.77Å; N465-F469 WeakPolarHBondContact ND2-CE2 3.09Å; N465-F469 WeakPolarHBondContact ND2-CZ 3.3Å; N465-F469 WeakPolarHBondContact O-CD2 3.38Å; N465-F469 PolarHBondContact O-N 3.28Å; N465-F469 VanDerWaalsContact O-N 3.17Å
466	N	58.4	Low	60.8	Low	51 Å²	51	75.8 Å²	75.8	27%	0.273	40%	0.395	S	S	.	.	H	α-helix	trans	-69	-33.4	-171.7	-74.3	-8.6	0	0	0	113.5	L256 S463 A470	L256-N466 HydrophobicContact CD1-CB 4.4Å; S463-N466 WeakPolarHBondContact O-CB 3.48Å; S463-N466 PolarHBondContact O-N 3.27Å; N466-A470 VanDerWaalsContact O-CB 3.22Å; N466-A470 WeakPolarHBondContact O-CB 3.33Å; N466-A470 PolarHBondContact O-N 2.53Å; N466-A470 VanDerWaalsContact O-N 3.08Å
467	Q	51.6	Low	58.6	Low	63 Å²	63	83 Å²	83	29%	0.294	43%	0.428	S	S	.	.	H	α-helix	trans	-70.6	-42.9	175.4	-69.4	-90.7	-26.3	0	0	111.5	D254 N465 F469 A470 F471	D254-Q467 HydrophobicContact CB-CG 3.76Å; D254-Q467 PolarHBondContact O-NE2 2.9Å; D254-Q467 VanDerWaalsContact O-NE2 3.15Å; N465-Q467 PolarHBondContact O-N 3.28Å; Q467-F469 VanDerWaalsContact C-N 3.31Å; Q467-F469 PolarHBondContact O-N 3.16Å; Q467-A470 PolarHBondContact O-N 2.03Å; Q467-F471 PolarHBondContact O-N 3.33Å; Q467-F471 VanDerWaalsContact O-N 3.14Å
468	R	49.2	Very low	56.1	Low	196 Å²	196	91.1 Å²	91.1	74%	0.74	47%	0.466	S	S	*	.	H	α-helix	trans	-61.9	-35.3	177.8	-75.2	-177.4	178.7	-177.4	-1.2	112.2	N465 S472	N465-R468 PolarHBondContact O-N 2.88Å; R468-S472 VanDerWaalsContact O-CB 3.24Å; R468-S472 WeakPolarHBondContact O-CB 3.45Å; R468-S472 PolarHBondContact O-N 3.32Å; R468-S472 VanDerWaalsContact O-N 3.17Å
469	F	49.1	Very low	53.9	Low	94 Å²	94	97.7 Å²	97.7	41%	0.412	49%	0.492	S	S	.	.	H	α-helix	trans	-85.3	-19.7	174.4	-66.5	-59	0	0	0	115.2	K397 N465 Q467	K397-F469 WeakPolarHBondContact CE-O 3.27Å; K397-F469 PolarHBondContact NZ-O 2.95Å; N465-F469 HydrophobicContact CB-CD2 4.02Å; N465-F469 HydrophobicContact CB-CE2 3.77Å; N465-F469 WeakPolarHBondContact ND2-CE2 3.09Å; N465-F469 WeakPolarHBondContact ND2-CZ 3.3Å; N465-F469 WeakPolarHBondContact O-CD2 3.38Å; N465-F469 PolarHBondContact O-N 3.28Å; N465-F469 VanDerWaalsContact O-N 3.17Å; Q467-F469 VanDerWaalsContact C-N 3.31Å; Q467-F469 PolarHBondContact O-N 3.16Å
470	A	46.4	Very low	51.8	Low	25 Å²	25	104.1 Å²	104.1	21%	0.207	52%	0.522	C	S	.	.	H	α-helix	trans	-81.1	-29	178.9	0	0	0	0	0	112.7	N466 Q467	N466-A470 VanDerWaalsContact O-CB 3.22Å; N466-A470 WeakPolarHBondContact O-CB 3.33Å; N466-A470 PolarHBondContact O-N 2.53Å; N466-A470 VanDerWaalsContact O-N 3.08Å; Q467-A470 PolarHBondContact O-N 2.03Å
471	F	44.8	Very low	49.6	Very low	125 Å²	125	110.7 Å²	110.7	55%	0.548	56%	0.557	S	S	.	*	H	α-helix	trans	-127.6	8.7	-175.2	-64.9	-74.9	0	0	0	115.1	P324 Q467 P473	P324-F471 HydrophobicContact CB-CE1 4.06Å; Q467-F471 PolarHBondContact O-N 3.33Å; Q467-F471 VanDerWaalsContact O-N 3.14Å; F471-P473 WeakPolarHBondContact O-CD 3.12Å
472	S	38.1	Very low	47.2	Very low	62 Å²	62	110.5 Å²	110.5	43%	0.434	56%	0.562	S	S	.	*			trans	-61.7	114.7	165.7	-165.8	0	0	0	0	107.1	R468 L474	R468-S472 VanDerWaalsContact O-CB 3.24Å; R468-S472 WeakPolarHBondContact O-CB 3.45Å; R468-S472 PolarHBondContact O-N 3.32Å; R468-S472 VanDerWaalsContact O-N 3.17Å; S472-L474 PolarHBondContact O-N 3.45Å
473	P	41.6	Very low	45.6	Very low	119 Å²	119	119.5 Å²	119.5	77%	0.773	60%	0.604	S	S	*	*			trans	-64.1	97	156	29.4	-24	0	0	0	102.8	F471 S475	F471-P473 WeakPolarHBondContact O-CD 3.12Å; P473-S475 PolarHBondContact O-N 3.41Å
474	L	41.6	Very low	43.9	Very low	123 Å²	123	125.1 Å²	125.1	64%	0.644	62%	0.622	S	S	*	*			trans	-68.6	94.5	164.2	-70	173.5	0	0	0	103.1	S472 E476	S472-L474 PolarHBondContact O-N 3.45Å; L474-E476 PolarHBondContact O-N 3.15Å
475	S	36.9	Very low	43.1	Very low	81 Å²	81	130 Å²	130	57%	0.566	64%	0.636	S	S	*	*			trans	24.6	96.9	152.4	44.6	0	0	0	0	113.4	P473 E477	P473-S475 PolarHBondContact O-N 3.41Å; S475-E477 PolarHBondContact O-N 2.98Å
476	E	40.9	Very low	42.2	Very low	208 Å²	208	133.2 Å²	133.2	97%	0.972	66%	0.66	S	S	*	*	S	Bend	trans	-69.7	13	154.8	-70.7	-177.9	160.6	0	0	111.4	L474	L474-E476 PolarHBondContact O-N 3.15Å
477	E	41.7	Very low	40.8	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	68%	0.682	S	S	*	*			trans	-118	89.6	171.4	-66.2	177.4	-175.5	0	0	108.2	S475	S475-E477 PolarHBondContact O-N 2.98Å
478	E	39.3	Very low	40.3	Very low	173 Å²	173	142.5 Å²	142.5	81%	0.808	71%	0.708	S	S	*	*			trans	175	57.9	147.8	-97	173.6	-170	0	0	108.1
479	E	41.8	Very low	39.5	Very low	196 Å²	196	143.1 Å²	143.1	92%	0.916	72%	0.716	S	S	*	*	S	Bend	trans	-109.2	47.9	150.1	-74.5	-162.8	171.6	0	0	108.8
480	E	42.2	Very low	38.9	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	74%	0.738	S	S	*	*	S	Bend	trans	-171.4	78.6	160.5	-110.5	172.6	-166.7	0	0	107.3
481	D	38.5	Very low	38.8	Very low	145 Å²	145	151.8 Å²	151.8	78%	0.775	77%	0.767	S	S	*	*	S	Bend	trans	177.8	119.6	132.7	-88.2	-24	0	0	0	112.4
482	E	36.1	Very low	38.4	Very low	139 Å²	139	155.4 Å²	155.4	65%	0.65	78%	0.782	S	S	*	*			trans	46.6	100.9	146.1	-60.5	-165.5	153.2	0	0	120.2	K484	E482-K484 PolarHBondContact O-N 2.92Å; E482-K484 IonicContact OE2-NZ 2.73Å; E482-K484 PolarHBondContact OE2-NZ 3.22Å
483	Q	42.7	Very low	38.4	Very low	196 Å²	196	162.4 Å²	162.4	92%	0.916	81%	0.808	S	S	*	*				-5.7	90.4	124.3	-172.6	158.7	0.8	0	0	116.1
484	K	32.9	Very low	38.5	Very low	164 Å²	164	159.6 Å²	159.6	71%	0.713	80%	0.801	S	S	*	*			trans	-137.1	107.7	154.7	-71.4	-173.8	179.9	112.8	0	110.2	E482	E482-K484 PolarHBondContact O-N 2.92Å; E482-K484 IonicContact OE2-NZ 2.73Å; E482-K484 PolarHBondContact OE2-NZ 3.22Å
485	E	35.2	Very low	38.3	Very low	158 Å²	158	161.6 Å²	161.6	74%	0.738	81%	0.809	S	S	*	*			trans	-56.9	147.4	164.3	-63.8	179	147.8	0	0	110.5	M487	E485-M487 VanDerWaalsContact C-N 3.29Å; E485-M487 PolarHBondContact O-N 2.81Å
486	P	36.5	Very low	38.1	Very low	136 Å²	136	167.4 Å²	167.4	88%	0.883	82%	0.824	S	S	*	*			trans	-78.5	83	166	32.3	-30.3	0	0	0	109.2
487	M	30.3	Very low	38	Very low	150 Å²	150	166 Å²	166	74%	0.739	82%	0.819	S	S	*	*			trans	-81.7	111.9	162.5	-89.6	-167.9	64.8	0	0	110.1	E485	E485-M487 VanDerWaalsContact C-N 3.29Å; E485-M487 PolarHBondContact O-N 2.81Å
488	L	40.3	Very low	37.5	Very low	160 Å²	160	169.3 Å²	169.3	84%	0.838	83%	0.825	S	S	*	*			trans	18.7	106.9	146.9	-78.8	157.7	0	0	0	117.5
489	K	32.2	Very low	37	Very low	209 Å²	209	166.2 Å²	166.2	91%	0.909	82%	0.822	S	S	*	*			trans	-143.2	73.1	152.9	-93.9	-171.6	178.3	178.4	0	111.2
490	E	36.6	Very low	36.6	Very low	186 Å²	186	163.8 Å²	163.8	87%	0.869	82%	0.821	S	S	*	*			trans	-120	81.7	152.3	-81.7	-165.4	154.4	0	0	107.4
491	S	44.2	Very low	36.1	Very low	115 Å²	115	164.3 Å²	164.3	80%	0.804	82%	0.821	S	S	*	*	S	Bend	trans	171.2	76.2	160.8	-81.6	0	0	0	0	109
492	F	37.8	Very low	35.6	Very low	201 Å²	201	166.7 Å²	166.7	88%	0.882	83%	0.827	S	S	*	*			trans	176.9	85.3	142.6	-121	-99	0	0	0	109.1
493	E	36.2	Very low	35.2	Very low	208 Å²	208	168.6 Å²	168.6	97%	0.972	84%	0.836	S	S	*	*			trans	-134.2	62.6	162.5	-134.5	175.8	-168.2	0	0	109
494	G	45.3	Very low	35.3	Very low	60 Å²	60	164.2 Å²	164.2	62%	0.619	83%	0.825	S	S	*	*			trans	-129.9	63	172.8	0	0	0	0	0	109.3
495	M	35.7	Very low	35.1	Very low	166 Å²	166	164.4 Å²	164.4	82%	0.818	83%	0.833	S	S	*	*			trans	-139.9	97.2	166.7	-155.3	68.7	177.2	0	0	111.1	M497	M495-M497 PolarHBondContact O-N 3.23Å
496	K	34.3	Very low	34.9	Very low	203 Å²	203	160.4 Å²	160.4	88%	0.883	84%	0.835	S	S	*	*			trans	-56.9	110.6	169.6	178.5	-178.4	-178.1	178	0	110.3
497	M	37.8	Very low	34.5	Very low	177 Å²	177	161.5 Å²	161.5	87%	0.872	83%	0.833	S	S	*	*			trans	-104.2	136.1	162	-81.9	-68.2	-164.9	0	0	110.7	M495	M495-M497 PolarHBondContact O-N 3.23Å
498	R	32.2	Very low	35.1	Very low	238 Å²	238	159.3 Å²	159.3	90%	0.898	83%	0.833	S	S	*	*			trans	-80.6	134.5	-163.4	-171	175.1	179.9	166	-2	110.6
499	S	28.1	Very low	35.2	Very low	109 Å²	109	161.3 Å²	161.3	76%	0.762	84%	0.835	S	S	*	*			trans	-49.2	129.8	173.1	-176.7	0	0	0	0	113.2
500	T	33.5	Very low	35.6	Very low	145 Å²	145	157.4 Å²	157.4	89%	0.89	83%	0.828	S	S	*	*			trans	-122.6	127.9	152.9	-53.3	0	0	0	0	108.5
501	K	30.9	Very low	36.1	Very low	186 Å²	186	155.1 Å²	155.1	81%	0.809	82%	0.821	S	S	*	*			trans	-81.2	130.9	-169.7	175.2	-176.3	-177.4	-179.7	0	112
502	Q	28.1	Very low	36.3	Very low	194 Å²	194	157.5 Å²	157.5	91%	0.907	82%	0.817	S	S	*	*			trans	-168.8	118.7	135.8	-116.7	172.2	-4.2	0	0	111.6
503	E	29.3	Very low	37	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	80%	0.799	S	S	*	*			trans	-105.1	179.4	159.6	-80.1	-145	157.8	0	0	108.4
504	P	44.3	Very low	38	Very low	105 Å²	105	147.5 Å²	147.5	68%	0.682	78%	0.784	S	S	*	*				-134.2	159	-52.2	36.4	-21	0	0	0	111.2
505	N	28.2	Very low	38.5	Very low	167 Å²	167	151 Å²	151	89%	0.893	78%	0.784	S	S	*	*			trans	-163.4	113.9	140.1	-138.4	-2.4	0	0	0	111
506	G	30.8	Very low	39.7	Very low	74 Å²	74	148.1 Å²	148.1	76%	0.763	77%	0.772	S	S	*	*			trans	-84.2	131.9	177.6	0	0	0	0	0	111.4
507	N	28.5	Very low	41	Very low	160 Å²	160	143.9 Å²	143.9	86%	0.856	76%	0.759	S	S	*	*			trans	-138.5	117.8	154.7	-148.2	18	0	0	0	108.7	K509	N507-K509 PolarHBondContact O-N 3.33Å
508	S	42.6	Very low	42.4	Very low	104 Å²	104	141 Å²	141	73%	0.727	75%	0.747	S	S	*	*			trans	-66.4	119.4	178.5	50	0	0	0	0	111.2
509	K	42.3	Very low	43.9	Very low	202 Å²	202	135.9 Å²	135.9	88%	0.878	73%	0.731	S	S	*	*			trans	-179.7	84.7	155.2	-106.2	172.2	-174.1	-177.9	0	111.3	N507	N507-K509 PolarHBondContact O-N 3.33Å
510	V	40	Very low	46.1	Very low	126 Å²	126	138.4 Å²	138.4	76%	0.764	72%	0.724	S	S	*	*			trans	-150.2	98.1	151.8	-175.3	0	0	0	0	107.2
511	N	47.6	Very low	47.7	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	70%	0.703	S	S	*	*	S	Bend	trans	-155.8	27.7	162.8	-100.8	-4.9	0	0	0	110.4
512	K	49.4	Very low	49.4	Very low	165 Å²	165	134.1 Å²	134.1	72%	0.717	70%	0.701	S	S	*	*	S	Bend	trans	-117	-24.9	-179.6	-137.3	175.8	-176.9	178.8	0	113.5
513	A	52.5	Low	51.3	Low	61 Å²	61	132.4 Å²	132.4	50%	0.504	69%	0.694	S	S	.	*	H	α-helix	trans	-73.1	-34.5	177.8	0	0	0	0	0	112.7	D517	A513-D517 PolarHBondContact O-N 3.42Å
514	Q	56.7	Low	52.8	Low	139 Å²	139	128.3 Å²	128.3	65%	0.65	68%	0.677	S	S	*	*	H	α-helix	trans	-76	-24.8	-176.4	-163.3	167.2	-11.8	0	0	113.1	L518	Q514-L518 WeakPolarHBondContact O-CD1 3.36Å; Q514-L518 WeakPolarHBondContact O-CG 3.46Å; Q514-L518 PolarHBondContact O-N 3.08Å
515	E	56	Low	53.5	Low	133 Å²	133	127.8 Å²	127.8	62%	0.621	67%	0.672	S	S	*	*	H	α-helix	trans	-78.7	-36.2	174.9	-70.8	-175.5	163.5	0	0	112.2	L518 K519	E515-L518 PolarHBondContact O-N 3.22Å; E515-K519 PolarHBondContact O-N 2.81Å; E515-K519 VanDerWaalsContact O-N 3.11Å
516	D	60.7	Low	54.3	Low	105 Å²	105	124.1 Å²	124.1	56%	0.561	66%	0.657	S	S	*	*	H	α-helix	trans	-70.1	-35.6	176.6	-77.9	-22.1	0	0	0	111.6	K519 W520	D516-K519 PolarHBondContact O-N 3.4Å; D516-W520 PolarHBondContact O-N 2.92Å
517	D	62.3	Low	55.3	Low	115 Å²	115	126.3 Å²	126.3	62%	0.615	66%	0.661	S	S	*	*	H	α-helix	trans	-66.2	-39.1	174.4	-80	-12.5	0	0	0	112.2	A513 K519 W520 V521	A513-D517 PolarHBondContact O-N 3.42Å; D517-K519 VanDerWaalsContact C-N 3.35Å; D517-W520 PolarHBondContact O-N 3.47Å; D517-V521 WeakPolarHBondContact O-CG2 3.5Å; D517-V521 PolarHBondContact O-N 3.01Å
518	L	66.3	Low	56.4	Low	117 Å²	117	122.1 Å²	122.1	61%	0.613	64%	0.644	S	S	*	*	H	α-helix	trans	-66.3	-37.8	175.4	-75.4	165.6	0	0	0	111.7	Q514 E515 V521 E522	Q514-L518 WeakPolarHBondContact O-CD1 3.36Å; Q514-L518 WeakPolarHBondContact O-CG 3.46Å; Q514-L518 PolarHBondContact O-N 3.08Å; E515-L518 PolarHBondContact O-N 3.22Å; L518-V521 PolarHBondContact O-N 2.87Å; L518-E522 PolarHBondContact O-N 2.74Å
519	K	63.8	Low	56.7	Low	129 Å²	129	122.7 Å²	122.7	56%	0.561	64%	0.643	S	S	*	*	H	α-helix	trans	-67.9	-38.4	177.5	-117.9	-178.1	177.1	-174.9	0	113.2	E515 D516 D517 V521 E522 E523	E515-K519 PolarHBondContact O-N 2.81Å; E515-K519 VanDerWaalsContact O-N 3.11Å; D516-K519 PolarHBondContact O-N 3.4Å; D517-K519 VanDerWaalsContact C-N 3.35Å; K519-V521 VanDerWaalsContact C-N 3.3Å; K519-V521 PolarHBondContact O-N 2.83Å; K519-E522 PolarHBondContact O-N 2.98Å; K519-E523 PolarHBondContact O-N 2.71Å; K519-E523 VanDerWaalsContact O-N 3.09Å
520	W	75.2	Confident	56.9	Low	162 Å²	162	118.4 Å²	118.4	61%	0.614	63%	0.634	S	S	*	*	H	α-helix	trans	-62.6	-39.5	176.5	-176.4	88.4	0	0	0	111.7	D516 D517 E523 N524	D516-W520 PolarHBondContact O-N 2.92Å; D517-W520 PolarHBondContact O-N 3.47Å; W520-E523 PolarHBondContact O-N 3.17Å; W520-N524 HydrophobicContact CH2-CB 4.46Å; W520-N524 HydrophobicContact CZ2-CB 4.27Å; W520-N524 PolarHBondContact NE1-ND2 2.94Å; W520-N524 WeakPolarHBondContact O-CB 3.37Å; W520-N524 PolarHBondContact O-N 3.28Å; W520-N524 VanDerWaalsContact O-N 3.1Å; W520-N524 PolarHBondContact O-ND2 3.03Å
521	V	65.6	Low	57.2	Low	76 Å²	76	119 Å²	119	46%	0.461	63%	0.633	S	S	.	*	H	α-helix	trans	-66.3	-40.4	177.1	175.2	0	0	0	0	111.3	D517 L518 K519 E523 V525	D517-V521 WeakPolarHBondContact O-CG2 3.5Å; D517-V521 PolarHBondContact O-N 3.01Å; L518-V521 PolarHBondContact O-N 2.87Å; K519-V521 VanDerWaalsContact C-N 3.3Å; K519-V521 PolarHBondContact O-N 2.83Å; V521-E523 VanDerWaalsContact C-N 3.34Å; V521-E523 PolarHBondContact O-N 3.27Å; V521-V525 HydrophobicContact CG1-CG2 4.12Å; V521-V525 WeakPolarHBondContact O-CB 3.41Å; V521-V525 WeakPolarHBondContact O-CG2 3.46Å; V521-V525 PolarHBondContact O-N 3.36Å
522	E	67.4	Low	57.2	Low	165 Å²	165	117.9 Å²	117.9	77%	0.771	63%	0.631	S	S	*	*	H	α-helix	trans	-67.3	-31.6	178.3	-128.4	169.3	-168.8	0	0	112.9	L518 K519	L518-E522 PolarHBondContact O-N 2.74Å; K519-E522 PolarHBondContact O-N 2.98Å
523	E	67.9	Low	57.1	Low	159 Å²	159	112.8 Å²	112.8	74%	0.743	62%	0.619	S	S	*	*	H	α-helix	trans	-86.6	-23.8	179.3	-76.5	-177	167.9	0	0	114.5	K519 W520 V521	K519-E523 PolarHBondContact O-N 2.71Å; K519-E523 VanDerWaalsContact O-N 3.09Å; W520-E523 PolarHBondContact O-N 3.17Å; V521-E523 VanDerWaalsContact C-N 3.34Å; V521-E523 PolarHBondContact O-N 3.27Å
524	N	59.9	Low	56.7	Low	92 Å²	92	116 Å²	116	49%	0.492	63%	0.627	S	S	.	*	H	α-helix	trans	-110.6	-9.3	-172.1	-68.6	-86.4	0	0	0	115	W520 P526	W520-N524 HydrophobicContact CH2-CB 4.46Å; W520-N524 HydrophobicContact CZ2-CB 4.27Å; W520-N524 PolarHBondContact NE1-ND2 2.94Å; W520-N524 WeakPolarHBondContact O-CB 3.37Å; W520-N524 PolarHBondContact O-N 3.28Å; W520-N524 VanDerWaalsContact O-N 3.1Å; W520-N524 PolarHBondContact O-ND2 3.03Å; N524-P526 WeakPolarHBondContact O-CD 3.26Å
525	V	60	Low	56.1	Low	94 Å²	94	113.5 Å²	113.5	57%	0.57	62%	0.623	S	S	*	*	S	Bend	trans	-98.5	109.2	172.5	-177	0	0	0	0	108.9	V521 S527	V521-V525 HydrophobicContact CG1-CG2 4.12Å; V521-V525 WeakPolarHBondContact O-CB 3.41Å; V521-V525 WeakPolarHBondContact O-CG2 3.46Å; V521-V525 PolarHBondContact O-N 3.36Å; V525-S527 PolarHBondContact O-N 2.97Å
526	P	44.2	Very low	55.7	Low	90 Å²	90	110.5 Å²	110.5	58%	0.584	62%	0.621	S	S	*	*			trans	-64.6	123.8	-177.8	23.3	-30.6	0	0	0	111.2	N524 S528	N524-P526 WeakPolarHBondContact O-CD 3.26Å; P526-S528 PolarHBondContact O-N 2.9Å
527	S	52.7	Low	55.1	Low	120 Å²	120	112 Å²	112	84%	0.839	63%	0.629	S	S	*	*	S	Bend	trans	-74.5	48	179.3	63.7	0	0	0	0	113.4	V525	V525-S527 PolarHBondContact O-N 2.97Å
528	S	51.3	Low	54.5	Low	72 Å²	72	113 Å²	113	50%	0.503	63%	0.633	S	S	.	*			trans	-140.8	21.7	-171.6	75.8	0	0	0	0	116.1	P526	P526-S528 PolarHBondContact O-N 2.9Å
529	V	48.5	Very low	53.7	Low	117 Å²	117	112.6 Å²	112.6	71%	0.709	63%	0.632	S	S	*	*	S	Bend	trans	-96.7	-12.7	176.8	-146.7	0	0	0	0	112.9
530	T	47.2	Very low	53.5	Low	112 Å²	112	109.7 Å²	109.7	69%	0.687	63%	0.628	S	S	*	*	S	Bend	trans	-90.7	-24.1	178.5	34	0	0	0	0	114.1
531	D	46	Very low	52.8	Low	137 Å²	137	107.2 Å²	107.2	73%	0.733	63%	0.627	S	S	*	*	S	Bend	trans	-88.1	-12.1	-179.5	-85.7	-36.4	0	0	0	114.8
532	V	48.4	Very low	52.9	Low	116 Å²	116	109.6 Å²	109.6	70%	0.703	63%	0.632	S	S	*	*	S	Bend	trans	-96.8	-17.8	-178.2	-178.5	0	0	0	0	113
533	A	46.3	Very low	52.7	Low	57 Å²	57	107.9 Å²	107.9	47%	0.471	63%	0.625	S	S	.	*	S	Bend	trans	-97.5	-15.1	-175.1	0	0	0	0	0	115.1
534	L	43.6	Very low	52.7	Low	128 Å²	128	108.3 Å²	108.3	67%	0.67	62%	0.62	S	S	*	*	S	Bend	trans	-79.8	-30.9	-178.9	-108.5	86.7	0	0	0	115.7
535	P	44.9	Very low	53.2	Low	88 Å²	88	110.7 Å²	110.7	57%	0.571	63%	0.629	S	S	*	*	H	α-helix	trans	-72.7	-29	176.9	-19	32.3	0	0	0	113.3	L537	P535-L537 PolarHBondContact O-N 2.82Å
536	A	48.2	Very low	53.9	Low	70 Å²	70	110.5 Å²	110.5	58%	0.579	62%	0.624	S	S	*	*	H	α-helix	trans	-78.7	-17.7	-173.1	0	0	0	0	0	114.6
537	L	48.1	Very low	55.2	Low	136 Å²	136	110.2 Å²	110.2	71%	0.712	62%	0.621	S	S	*	*	H	α-helix	trans	-93.8	-17.6	178.3	-71.6	176.6	0	0	0	113.6	P535	P535-L537 PolarHBondContact O-N 2.82Å
538	L	48.7	Very low	56	Low	136 Å²	136	110.6 Å²	110.6	71%	0.712	61%	0.609	S	S	*	*	H	α-helix	trans	-83.8	-25.8	175.5	-78.3	166.8	0	0	0	112.8
539	D	50	Low	57.3	Low	108 Å²	108	113.1 Å²	113.1	58%	0.578	61%	0.611	S	S	*	*	H	α-helix	trans	-75	-24	176.1	-120.2	-8.5	0	0	0	112.8	E543	D539-E543 PolarHBondContact O-N 2.97Å
540	S	59.6	Low	58.8	Low	69 Å²	69	113.3 Å²	113.3	48%	0.483	60%	0.604	S	S	.	*	H	α-helix	trans	-75.2	-32.9	-174.5	-171.2	0	0	0	0	114	R544	S540-R544 WeakPolarHBondContact O-CB 3.06Å; S540-R544 PolarHBondContact O-N 3.12Å
541	D	61.2	Low	59.9	Low	110 Å²	110	116.8 Å²	116.8	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-81.5	-28.7	179.8	-88.5	-16.7	0	0	0	112.6	M545	D541-M545 PolarHBondContact O-N 2.95Å; D541-M545 VanDerWaalsContact O-N 3.11Å
542	E	67	Low	61	Low	125 Å²	125	113.6 Å²	113.6	58%	0.584	59%	0.593	S	S	*	*	H	α-helix	trans	-73.4	-42.7	175.5	-162.9	157.2	-170.6	0	0	110.9	R544 M545 I546	E542-R544 VanDerWaalsContact C-N 3.33Å; E542-R544 PolarHBondContact O-N 3.37Å; E542-M545 PolarHBondContact O-N 2.86Å; E542-I546 HydrophobicContact CG-CD1 4.13Å; E542-I546 WeakPolarHBondContact O-CD1 3.36Å; E542-I546 VanDerWaalsContact O-CG1 3.23Å; E542-I546 WeakPolarHBondContact O-CG1 3.46Å; E542-I546 PolarHBondContact O-N 3.44Å
543	E	63.6	Low	61.8	Low	130 Å²	130	115.4 Å²	115.4	61%	0.607	59%	0.592	S	S	*	*	H	α-helix	trans	-62	-37.2	170.9	-82	-167.8	146.5	0	0	112.8	D539 M545 I546 T547	D539-E543 PolarHBondContact O-N 2.97Å; E543-M545 VanDerWaalsContact C-N 3.32Å; E543-M545 PolarHBondContact O-N 3.23Å; E543-I546 PolarHBondContact O-N 3.18Å; E543-T547 WeakPolarHBondContact O-CB 3.38Å; E543-T547 VanDerWaalsContact O-CG2 3.28Å; E543-T547 WeakPolarHBondContact O-CG2 3.37Å; E543-T547 PolarHBondContact O-N 3.19Å; E543-T547 PolarHBondContact O-OG1 3.02Å
544	R	68.2	Low	62.6	Low	168 Å²	168	120.9 Å²	120.9	63%	0.634	61%	0.61	S	S	*	*	H	α-helix	trans	-68.5	-31.7	177.5	-161.1	176.4	-171.2	176.2	4.3	112.6	S540 E542 T547 H548	S540-R544 WeakPolarHBondContact O-CB 3.06Å; S540-R544 PolarHBondContact O-N 3.12Å; E542-R544 VanDerWaalsContact C-N 3.33Å; E542-R544 PolarHBondContact O-N 3.37Å; R544-T547 WeakPolarHBondContact CA-OG1 3.46Å; R544-T547 PolarHBondContact O-OG1 3.1Å; R544-T547 VanDerWaalsContact O-OG1 3.08Å; R544-H548 PolarHBondContact O-N 3.08Å
545	M	70.3	Confident	62.9	Low	141 Å²	141	125.4 Å²	125.4	70%	0.695	63%	0.627	S	S	*	*	H	α-helix	trans	-76	-40.4	175.9	-151.6	-171.7	-50.4	0	0	111.6	D541 E542 E543 H548 F549	D541-M545 PolarHBondContact O-N 2.95Å; D541-M545 VanDerWaalsContact O-N 3.11Å; E542-M545 PolarHBondContact O-N 2.86Å; E543-M545 VanDerWaalsContact C-N 3.32Å; E543-M545 PolarHBondContact O-N 3.23Å; M545-H548 PolarHBondContact O-N 3.29Å; M545-F549 WeakPolarHBondContact O-CB 3.44Å; M545-F549 PolarHBondContact O-N 3.35Å
546	I	73.7	Confident	63.8	Low	91 Å²	91	127.3 Å²	127.3	47%	0.467	63%	0.63	S	S	.	*	H	α-helix	trans	-65.5	-44.5	176.6	-65.7	163.7	0	0	0	110.7	E542 E543 H548 F549 E550	E542-I546 HydrophobicContact CG-CD1 4.13Å; E542-I546 WeakPolarHBondContact O-CD1 3.36Å; E542-I546 VanDerWaalsContact O-CG1 3.23Å; E542-I546 WeakPolarHBondContact O-CG1 3.46Å; E542-I546 PolarHBondContact O-N 3.44Å; E543-I546 PolarHBondContact O-N 3.18Å; I546-H548 PolarHBondContact O-N 3.34Å; I546-F549 WeakPolarHBondContact O-CB 3.37Å; I546-F549 PolarHBondContact O-N 2.91Å; I546-F549 VanDerWaalsContact O-N 3.15Å; I546-E550 HydrophobicContact CG2-CG 4.45Å; I546-E550 WeakPolarHBondContact O-CG 3.43Å; I546-E550 PolarHBondContact O-N 3.14Å
547	T	71.1	Confident	64.7	Low	84 Å²	84	130.3 Å²	130.3	52%	0.515	63%	0.633	S	S	.	*	H	α-helix	trans	-64.1	-37.5	176.8	49	0	0	0	0	112.7	E543 R544 R551	E543-T547 WeakPolarHBondContact O-CB 3.38Å; E543-T547 VanDerWaalsContact O-CG2 3.28Å; E543-T547 WeakPolarHBondContact O-CG2 3.37Å; E543-T547 PolarHBondContact O-N 3.19Å; E543-T547 PolarHBondContact O-OG1 3.02Å; R544-T547 WeakPolarHBondContact CA-OG1 3.46Å; R544-T547 PolarHBondContact O-OG1 3.1Å; R544-T547 VanDerWaalsContact O-OG1 3.08Å; T547-R551 VanDerWaalsContact O-CB 3.22Å; T547-R551 WeakPolarHBondContact O-CB 3.23Å; T547-R551 PolarHBondContact O-N 3.35Å
548	H	71.2	Confident	65.6	Low	127 Å²	127	130 Å²	130	59%	0.588	63%	0.628	S	S	*	*	H	α-helix	trans	-65.9	-38.8	171.8	-104.7	-81.2	0	0	0	112.6	R544 M545 I546 S552	R544-H548 PolarHBondContact O-N 3.08Å; M545-H548 PolarHBondContact O-N 3.29Å; I546-H548 PolarHBondContact O-N 3.34Å; H548-S552 PolarHBondContact O-N 3.33Å; H548-S552 VanDerWaalsContact O-N 3.09Å
549	F	78.2	Confident	66.6	Low	126 Å²	126	129.6 Å²	129.6	55%	0.553	62%	0.624	S	S	*	*	H	α-helix	trans	-67	-43.9	177.6	-176.7	-103	0	0	0	112	M545 I546 S552 K553	M545-F549 WeakPolarHBondContact O-CB 3.44Å; M545-F549 PolarHBondContact O-N 3.35Å; I546-F549 WeakPolarHBondContact O-CB 3.37Å; I546-F549 PolarHBondContact O-N 2.91Å; I546-F549 VanDerWaalsContact O-N 3.15Å; F549-S552 PolarHBondContact O-N 2.94Å; F549-S552 PolarHBondContact O-OG 3.37Å; F549-K553 PolarHBondContact O-N 3.4Å
550	E	79.2	Confident	67.6	Low	121 Å²	121	131 Å²	131	57%	0.565	63%	0.626	S	S	*	*	H	α-helix	trans	-67.3	-37	176.3	-68.5	-149.6	152.4	0	0	112.4	I546 S552 K553	I546-E550 HydrophobicContact CG2-CG 4.45Å; I546-E550 WeakPolarHBondContact O-CG 3.43Å; I546-E550 PolarHBondContact O-N 3.14Å; E550-S552 VanDerWaalsContact C-N 3.29Å; E550-S552 PolarHBondContact O-N 3.46Å; E550-K553 WeakPolarHBondContact O-CB 3.47Å; E550-K553 PolarHBondContact O-N 3.04Å; E550-K553 VanDerWaalsContact O-N 3.15Å
551	R	70.8	Confident	68.1	Low	185 Å²	185	135.1 Å²	135.1	70%	0.698	64%	0.636	S	S	*	*	H	α-helix	trans	-65.9	-32.3	176.1	-158.6	173.3	176.1	-179.7	-1.2	112.5	T547 K553 M554	T547-R551 VanDerWaalsContact O-CB 3.22Å; T547-R551 WeakPolarHBondContact O-CB 3.23Å; T547-R551 PolarHBondContact O-N 3.35Å; R551-K553 VanDerWaalsContact C-N 3.27Å; R551-K553 PolarHBondContact O-N 3.13Å; R551-M554 PolarHBondContact O-N 3.46Å
552	S	68.8	Low	68.6	Low	69 Å²	69	136.9 Å²	136.9	48%	0.483	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.7	-12.4	174.5	76.8	0	0	0	0	114.8	H548 F549 E550	H548-S552 PolarHBondContact O-N 3.33Å; H548-S552 VanDerWaalsContact O-N 3.09Å; F549-S552 PolarHBondContact O-N 2.94Å; F549-S552 PolarHBondContact O-OG 3.37Å; E550-S552 VanDerWaalsContact C-N 3.29Å; E550-S552 PolarHBondContact O-N 3.46Å
553	K	65.9	Low	68.8	Low	155 Å²	155	137.8 Å²	137.8	67%	0.674	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-13.1	174.4	-94	-176.9	175	179.5	0	113.3	F549 E550 R551	F549-K553 PolarHBondContact O-N 3.4Å; E550-K553 WeakPolarHBondContact O-CB 3.47Å; E550-K553 PolarHBondContact O-N 3.04Å; E550-K553 VanDerWaalsContact O-N 3.15Å; R551-K553 VanDerWaalsContact C-N 3.27Å; R551-K553 PolarHBondContact O-N 3.13Å
554	M	62.1	Low	69.2	Low	172 Å²	172	138.5 Å²	138.5	85%	0.847	65%	0.647	S	S	*	*			trans	-105.5	-4.2	-178.5	-68.4	-152.1	-98.6	0	0	113.8	R551	R551-M554 PolarHBondContact O-N 3.46Å
555	E	50.8	Low	69.3	Low	223 Å²	223	135.8 Å²	135.8	100%	1.042	65%	0.648	S	S	*	*			trans	-94	0	160.1	-71.9	-179.5	164.4	0	0	109.3

Retrieved 555 of 555 residues in 210.2 ms (Link to these results)

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