A0A096NM57_PAPAN Loading...

Mannosyltransferase

Alpha-1,2-mannosyltransferase that catalyzes the transfer of the third mannose, via an alpha-1,2 bond, from a dolichol-phosphate-mannose (Dol-P-Man) to an alpha-D-Man-(1->6)-2-PEtn-alpha-D-Man-(1->4)-alpha-D-GlcN-(1->6)-(1-radyl,2-acyl-sn-glycero-3-phospho)-2-acyl-inositol intermediate to generate an alpha-D-Man-(1->2)-alpha-D-Man-(1->6)-2-PEtn-alpha-D-Man-(1->4)-alpha-D-GlcN-(1->6)-(1-radyl,2-acyl-sn-glycero-3-phospho)-2-acyl-inositol (also termed H6) and participates in the nineth step of the glycosylphosphatidylinositol-anchor biosynthesis. May also add the third mannose to an alpha-D-Man-(1->6)-alpha-D-Man-(1->4)-alpha-D-GlcN-(1->6)-(1-radyl,2-acyl-sn-glycero-3-phospho)-2-acyl-inositol (also termed H3) intermediate generating an alpha-D-Man-(1->2)-alpha-D-Man-(1->6)-alpha-D-Man-(1->4)-alpha-D-GlcN-(1->6)-(1-radyl,2-acyl-sn-glycero-3-phospho)-2-acyl-inositol (also termed H4).

AlphaFold DB , UniProt , Accession A0A096NM57, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 551 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	30.8	Very low	239 Å²	239	163.1 Å²	163.1	100%	1.177	85%	0.849	S	S	*	*				0	135.5	0	-130.9	169.8	176.7	0	0	105.6
2	E	27.7	Very low	30.7	Very low	184 Å²	184	160.9 Å²	160.9	86%	0.86	84%	0.838	S	S	*	*			trans	74.2	116.1	-171.1	-59.4	-173.3	139.5	0	0	114.4
3	R	28.4	Very low	30.5	Very low	251 Å²	251	166.7 Å²	166.7	95%	0.947	84%	0.842	S	S	*	*				66	131.4	92	-96.5	-171.7	-166.3	-179.1	5.5	114.4
4	G	27.7	Very low	30.4	Very low	71 Å²	71	160.4 Å²	160.4	73%	0.732	84%	0.839	S	S	*	*			trans	142.7	89.6	166.3	0	0	0	0	0	110.3
5	R	29	Very low	30.4	Very low	240 Å²	240	160.9 Å²	160.9	91%	0.906	84%	0.842	S	S	*	*				66.1	116	77.7	-155.3	-174	-155.4	172.9	4.2	110.8
6	E	30.4	Very low	30.4	Very low	191 Å²	191	161.5 Å²	161.5	89%	0.893	84%	0.839	S	S	*	*			trans	-175.1	116.6	132.8	-102.5	168	-166.6	0	0	112
7	D	30.8	Very low	30.5	Very low	158 Å²	158	160.8 Å²	160.8	85%	0.845	84%	0.837	S	S	*	*			trans	-60.3	139.2	149.7	-68.9	-56	0	0	0	109.3
8	A	32.9	Very low	30.6	Very low	87 Å²	87	166.1 Å²	166.1	72%	0.719	84%	0.844	S	S	*	*			trans	-166.3	104.2	144	0	0	0	0	0	111.3
9	S	28.5	Very low	30.8	Very low	115 Å²	115	163.4 Å²	163.4	80%	0.804	84%	0.842	S	S	*	*			trans	-49.6	134.2	151	53.7	0	0	0	0	111.7
10	L	32.5	Very low	30.9	Very low	142 Å²	142	164.7 Å²	164.7	74%	0.743	84%	0.844	S	S	*	*			trans	-147.6	111	153.2	-105.3	130.5	0	0	0	110.1
11	T	32.4	Very low	31	Very low	116 Å²	116	166.2 Å²	166.2	71%	0.712	85%	0.848	S	S	*	*			trans	62.4	144	131.5	53.6	0	0	0	0	119.3
12	L	29.6	Very low	30.9	Very low	137 Å²	137	164.1 Å²	164.1	72%	0.717	83%	0.832	S	S	*	*			cis	-176.3	126.4	-14.7	-169.1	98.4	0	0	0	101.6
13	R	28.1	Very low	31.4	Very low	236 Å²	236	163 Å²	163	89%	0.891	83%	0.83	S	S	*	*			trans	49.2	110.9	153.4	-75.3	174.1	173.8	177.1	-2.1	119.4
14	G	29.6	Very low	31.7	Very low	78 Å²	78	160.9 Å²	160.9	80%	0.804	83%	0.828	S	S	*	*			trans	-150.8	95.9	148.4	0	0	0	0	0	109.8	Q16	G14-Q16 PolarHBondContact O-N 2.83Å
15	L	30	Very low	32.4	Very low	168 Å²	168	165.2 Å²	165.2	88%	0.88	83%	0.833	S	S	*	*			trans	-55.8	127.4	168.8	-81.2	144.4	0	0	0	110.3
16	Q	30.8	Very low	32.8	Very low	171 Å²	171	165.2 Å²	165.2	80%	0.799	83%	0.833	S	S	*	*				162.6	133.2	123	-89.8	169.8	-14.1	0	0	113.1	G14	G14-Q16 PolarHBondContact O-N 2.83Å
17	N	31.7	Very low	33.4	Very low	150 Å²	150	165.4 Å²	165.4	80%	0.802	83%	0.831	S	S	*	*			trans	62.5	102.5	150.2	-70.1	-14.2	0	0	0	119.9
18	R	32.3	Very low	33.7	Very low	255 Å²	255	169.3 Å²	169.3	96%	0.962	83%	0.834	S	S	*	*			trans	-132.8	122.2	139.5	-96	-175.3	178	-180	-0.2	112
19	S	33.8	Very low	34.1	Very low	116 Å²	116	173.8 Å²	173.8	81%	0.811	84%	0.837	S	S	*	*			trans	-77.6	154.9	-176.2	41.4	0	0	0	0	113	E21	S19-E21 PolarHBondContact O-N 3.33Å
20	H	33.8	Very low	34.7	Very low	189 Å²	189	171.4 Å²	171.4	88%	0.875	82%	0.821	S	S	*	*			trans	-36.3	123	172	-81.9	-81.7	0	0	0	115.7	K22	H20-K22 PolarHBondContact O-N 3.5Å
21	E	32.1	Very low	35.5	Very low	197 Å²	197	170.6 Å²	170.6	92%	0.921	82%	0.821	S	S	*	*			trans	-82.3	110.1	164.1	-140.1	175.1	-172	0	0	109.4	S19	S19-E21 PolarHBondContact O-N 3.33Å
22	K	36.2	Very low	35.8	Very low	195 Å²	195	171.4 Å²	171.4	85%	0.848	82%	0.821	S	S	*	*			trans	-90	117.7	173.4	-86.8	-179.4	177.3	174.9	0	110.1	H20 K24	H20-K22 PolarHBondContact O-N 3.5Å; K22-K24 PolarHBondContact O-N 3.14Å
23	I	38.3	Very low	36.3	Very low	160 Å²	160	173.5 Å²	173.5	82%	0.821	82%	0.82	S	S	*	*			trans	-57.9	117.2	170.2	-62.8	170	0	0	0	109.6	L25	I23-L25 PolarHBondContact O-N 3.31Å
24	K	36.1	Very low	36.9	Very low	206 Å²	206	168.2 Å²	168.2	90%	0.896	80%	0.804	S	S	*	*			trans	-80.3	102.7	176.4	-88.4	-179	177.4	171.7	0	110.8	K22 R26	K22-K24 PolarHBondContact O-N 3.14Å; K24-R26 PolarHBondContact O-N 3.28Å
25	L	41.2	Very low	37.6	Very low	162 Å²	162	166.8 Å²	166.8	85%	0.848	78%	0.782	S	S	*	*			trans	-69.2	117.6	163.2	-73.8	165.4	0	0	0	110.1	I23 K27	I23-L25 PolarHBondContact O-N 3.31Å; L25-K27 PolarHBondContact O-N 3.1Å
26	R	38.5	Very low	38	Very low	241 Å²	241	162.1 Å²	162.1	91%	0.909	76%	0.76	S	S	*	*			trans	-70.9	95.4	176.1	-170.2	177.8	-174.7	176.8	2.2	109.7	K24 R28	K24-R26 PolarHBondContact O-N 3.28Å; R26-R28 PolarHBondContact O-N 2.95Å
27	K	41.5	Very low	38.4	Very low	194 Å²	194	160.7 Å²	160.7	84%	0.843	75%	0.754	S	S	*	*			trans	-62.4	104.8	168.4	-83.7	-178	175	178.5	0	109.6	L25 K29	L25-K27 PolarHBondContact O-N 3.1Å; K27-K29 PolarHBondContact O-N 3.37Å; K27-K29 VanDerWaalsContact O-N 3.14Å
28	R	38.9	Very low	38.9	Very low	241 Å²	241	159 Å²	159	91%	0.909	74%	0.741	S	S	*	*			trans	-64.1	107.4	163	-100.7	-178.5	172.8	175.4	-1.4	107.7	R26 S30	R26-R28 PolarHBondContact O-N 2.95Å; R28-S30 PolarHBondContact O-N 3.36Å
29	K	40.5	Very low	39.3	Very low	181 Å²	181	153.5 Å²	153.5	79%	0.787	72%	0.724	S	S	*	*			trans	-68.1	114.4	167.7	-73.3	-177.8	176.9	-179.3	0	107.5	K27 T31	K27-K29 PolarHBondContact O-N 3.37Å; K27-K29 VanDerWaalsContact O-N 3.14Å; K29-T31 PolarHBondContact O-N 3.32Å
30	S	41.6	Very low	39.4	Very low	65 Å²	65	152.4 Å²	152.4	46%	0.455	71%	0.709	S	S	.	*			trans	-69.5	123.4	177	93.3	0	0	0	0	109.6	R28 L32 Y33	R28-S30 PolarHBondContact O-N 3.36Å; S30-L32 PolarHBondContact O-N 2.86Å; S30-Y33 WeakPolarHBondContact OG-CD2 3.36Å
31	T	47.8	Very low	39.9	Very low	124 Å²	124	146.9 Å²	146.9	76%	0.761	70%	0.697	S	S	*	*	H	α-helix	trans	-65.7	-20.5	179.9	-24.6	0	0	0	0	112.2	K29 S35	K29-T31 PolarHBondContact O-N 3.32Å; T31-S35 PolarHBondContact O-N 3.49Å
32	L	39.9	Very low	40.5	Very low	134 Å²	134	146 Å²	146	70%	0.702	69%	0.685	S	S	*	*	H	α-helix	trans	-70.6	-42.4	-175.4	-137.8	93.5	0	0	0	112.6	S30 S35 T36	S30-L32 PolarHBondContact O-N 2.86Å; L32-S35 PolarHBondContact O-N 3.1Å; L32-S35 PolarHBondContact O-OG 3.43Å; L32-T36 PolarHBondContact O-N 3.01Å; L32-T36 PolarHBondContact O-OG1 2.86Å
33	Y	40.7	Very low	40.9	Very low	180 Å²	180	147 Å²	147	71%	0.706	68%	0.683	S	S	*	*	H	α-helix	trans	-71.7	-35.6	179.6	-88.5	-90.8	0	0	0	112.5	S30 T36 Q37	S30-Y33 WeakPolarHBondContact OG-CD2 3.36Å; Y33-T36 PolarHBondContact O-N 2.93Å; Y33-Q37 PolarHBondContact O-N 3.1Å
34	F	39.8	Very low	41.2	Very low	125 Å²	125	150.8 Å²	150.8	55%	0.548	69%	0.687	S	S	.	*	H	α-helix	trans	-63.7	-41.5	174.5	-119.8	-89.9	0	0	0	111.9	T36 Q37 E38	F34-T36 VanDerWaalsContact C-N 3.28Å; F34-T36 PolarHBondContact O-N 3.46Å; F34-Q37 PolarHBondContact O-N 3.22Å; F34-E38 PolarHBondContact O-N 3.34Å
35	S	43.6	Very low	41.9	Very low	49 Å²	49	142 Å²	142	34%	0.343	66%	0.656	S	S	.	*	H	α-helix	trans	-66.1	-30.2	178	86.2	0	0	0	0	113.3	T31 L32 K39	T31-S35 PolarHBondContact O-N 3.49Å; L32-S35 PolarHBondContact O-N 3.1Å; L32-S35 PolarHBondContact O-OG 3.43Å; S35-K39 VanDerWaalsContact O-CB 3.29Å; S35-K39 WeakPolarHBondContact O-CB 3.2Å; S35-K39 VanDerWaalsContact O-CG 3.27Å; S35-K39 WeakPolarHBondContact O-CG 3.29Å; S35-K39 PolarHBondContact O-N 3.02Å
36	T	39.2	Very low	43.1	Very low	69 Å²	69	138.8 Å²	138.8	42%	0.423	64%	0.639	S	S	.	*	H	α-helix	trans	-79.9	-35.9	179.9	-49.8	0	0	0	0	110.8	L32 Y33 F34 N40	L32-T36 PolarHBondContact O-N 3.01Å; L32-T36 PolarHBondContact O-OG1 2.86Å; Y33-T36 PolarHBondContact O-N 2.93Å; F34-T36 VanDerWaalsContact C-N 3.28Å; F34-T36 PolarHBondContact O-N 3.46Å; T36-N40 VanDerWaalsContact O-CB 3.29Å; T36-N40 WeakPolarHBondContact O-CB 3.38Å; T36-N40 VanDerWaalsContact O-CG 3.24Å; T36-N40 PolarHBondContact O-N 3.34Å; T36-N40 PolarHBondContact O-ND2 2.97Å
37	Q	38.6	Very low	44.7	Very low	141 Å²	141	131 Å²	131	66%	0.659	62%	0.615	S	S	*	*	H	α-helix	trans	-71.6	-38	174.6	-137.4	172.7	-4.8	0	0	112.1	Y33 F34 N40 A41	Y33-Q37 PolarHBondContact O-N 3.1Å; F34-Q37 PolarHBondContact O-N 3.22Å; Q37-N40 PolarHBondContact O-N 3.23Å; Q37-A41 VanDerWaalsContact O-CB 3.28Å; Q37-A41 WeakPolarHBondContact O-CB 3.29Å; Q37-A41 PolarHBondContact O-N 3.47Å
38	E	42	Very low	46.5	Very low	115 Å²	115	124.7 Å²	124.7	54%	0.537	59%	0.59	S	S	.	*	H	α-helix	trans	-67.7	-38.4	171.1	-82.1	-173.3	155.7	0	0	112.8	F34 R42	F34-E38 PolarHBondContact O-N 3.34Å; E38-R42 WeakPolarHBondContact O-CB 3.29Å; E38-R42 WeakPolarHBondContact O-CG 3.16Å; E38-R42 PolarHBondContact O-N 3.13Å
39	K	41.4	Very low	48.4	Very low	139 Å²	139	115.6 Å²	115.6	60%	0.604	57%	0.571	S	S	*	*	H	α-helix	trans	-66.5	-38	173.6	-83	177.6	177	177.8	0	112.3	S35 R43	S35-K39 VanDerWaalsContact O-CB 3.29Å; S35-K39 WeakPolarHBondContact O-CB 3.2Å; S35-K39 VanDerWaalsContact O-CG 3.27Å; S35-K39 WeakPolarHBondContact O-CG 3.29Å; S35-K39 PolarHBondContact O-N 3.02Å; K39-R43 PolarHBondContact O-N 3.35Å; K39-R43 VanDerWaalsContact O-N 3.08Å
40	N	36.3	Very low	50.8	Low	93 Å²	93	107.5 Å²	107.5	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-76.2	-30.6	177.6	-74.2	-16.2	0	0	0	112.7	T36 Q37 R44	T36-N40 VanDerWaalsContact O-CB 3.29Å; T36-N40 WeakPolarHBondContact O-CB 3.38Å; T36-N40 VanDerWaalsContact O-CG 3.24Å; T36-N40 PolarHBondContact O-N 3.34Å; T36-N40 PolarHBondContact O-ND2 2.97Å; Q37-N40 PolarHBondContact O-N 3.23Å; N40-R44 PolarHBondContact O-N 3.44Å
41	A	43.2	Very low	53.1	Low	74 Å²	74	108.4 Å²	108.4	61%	0.612	54%	0.536	S	S	*	.	H	α-helix	trans	-71.7	-38.4	170.4	0	0	0	0	0	112.3	Q37 R43 R44	Q37-A41 VanDerWaalsContact O-CB 3.28Å; Q37-A41 WeakPolarHBondContact O-CB 3.29Å; Q37-A41 PolarHBondContact O-N 3.47Å; A41-R43 VanDerWaalsContact C-N 3.35Å; A41-R43 PolarHBondContact O-N 2.93Å; A41-R44 PolarHBondContact O-N 3.47Å
42	R	45.6	Very low	55.3	Low	179 Å²	179	105.7 Å²	105.7	68%	0.675	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-36.7	171.7	-85.3	178.1	173.3	167.1	1.1	112.9	E38 R44	E38-R42 WeakPolarHBondContact O-CB 3.29Å; E38-R42 WeakPolarHBondContact O-CG 3.16Å; E38-R42 PolarHBondContact O-N 3.13Å; R42-R44 PolarHBondContact O-N 3.02Å
43	R	43.6	Very low	57.8	Low	216 Å²	216	105.9 Å²	105.9	82%	0.815	51%	0.513	S	S	*	.	H	α-helix	trans	-74.3	-20.6	-179.9	-87.3	-177.3	171.4	180	-3.5	114.9	K39 A41	K39-R43 PolarHBondContact O-N 3.35Å; K39-R43 VanDerWaalsContact O-N 3.08Å; A41-R43 VanDerWaalsContact C-N 3.35Å; A41-R43 PolarHBondContact O-N 2.93Å
44	R	45.3	Very low	60.5	Low	238 Å²	238	98.8 Å²	98.8	90%	0.898	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-0.8	-169.1	-129.7	174.6	-172.9	176.2	1.3	114.9	N40 A41 R42	N40-R44 PolarHBondContact O-N 3.44Å; A41-R44 PolarHBondContact O-N 3.47Å; R42-R44 PolarHBondContact O-N 3.02Å
45	G	51.3	Low	63.2	Low	23 Å²	23	93 Å²	93	24%	0.237	46%	0.462	C	S	.	.	S	Bend	trans	-144	12.4	-173.1	0	0	0	0	0	116.4	I52	G45-I52 WeakPolarHBondContact O-CB 3.28Å; G45-I52 PolarHBondContact O-N 2.89Å
46	D	65.1	Low	65.7	Low	93 Å²	93	95 Å²	95	50%	0.497	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	99.2	-177.1	-74.3	-9.6	0	0	0	111.2	E50	D46-E50 CarbonylContact C-O 3.54Å; D46-E50 VanDerWaalsContact CA-O 3.28Å; D46-E50 WeakPolarHBondContact CA-O 3.41Å
47	L	72.4	Confident	68.5	Low	79 Å²	79	97.3 Å²	97.3	41%	0.414	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.6	169	-177.8	61.8	0	0	0	108.2	G49 E50 V55	L47-G49 PolarHBondContact O-N 3.36Å; L47-E50 PolarHBondContact N-O 2.7Å; L47-E50 PolarHBondContact O-N 2.94Å; L47-E50 VanDerWaalsContact O-O 3.07Å; L47-V55 HydrophobicContact CB-CG2 4.34Å; L47-V55 HydrophobicContact CD2-CB 4.29Å; L47-V55 HydrophobicContact CD2-CG1 3.72Å; L47-V55 HydrophobicContact CG-CG1 4.21Å; L47-V55 WeakPolarHBondContact O-CG2 3.4Å
48	L	78.9	Confident	71.3	Confident	60 Å²	60	90.6 Å²	90.6	31%	0.314	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	12.7	-171.6	-59.6	168.7	0	0	0	114.9	V55 V144 V147 R148	L48-V55 HydrophobicContact CD1-CG1 4.26Å; L48-V144 HydrophobicContact CD1-CG1 4.45Å; L48-V144 HydrophobicContact CD1-CG2 4.32Å; L48-V147 HydrophobicContact CD1-CG1 4.33Å; L48-R148 PolarHBondContact O-NH1 2.98Å
49	G	79.1	Confident	74	Confident	50 Å²	50	87.2 Å²	87.2	52%	0.515	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	12.5	-175.3	0	0	0	0	0	114.5	L47	L47-G49 PolarHBondContact O-N 3.36Å
50	E	90.8	Very high	76.7	Confident	11 Å²	11	83.4 Å²	83.4	5%	0.051	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	164.6	176.8	-66.1	-61.7	161.5	0	0	112	D46 L47 I52 V55 V147 Y150 S151 K154	D46-E50 CarbonylContact C-O 3.54Å; D46-E50 VanDerWaalsContact CA-O 3.28Å; D46-E50 WeakPolarHBondContact CA-O 3.41Å; L47-E50 PolarHBondContact N-O 2.7Å; L47-E50 PolarHBondContact O-N 2.94Å; L47-E50 VanDerWaalsContact O-O 3.07Å; E50-I52 PolarHBondContact O-N 3.15Å; E50-V55 HydrophobicContact CB-CG2 4.41Å; E50-V147 HydrophobicContact CB-CG1 4.49Å; E50-V147 HydrophobicContact CG-CG1 4.25Å; E50-Y150 HydrophobicContact CG-CD1 4.31Å; E50-Y150 HydrophobicContact CG-CE1 4.42Å; E50-Y150 WeakPolarHBondContact OE2-CE1 3.43Å; E50-S151 VanDerWaalsContact CD-OG 3.29Å; E50-S151 WeakPolarHBondContact CG-OG 3.44Å; E50-S151 WeakPolarHBondContact OE1-CB 3.23Å; E50-S151 PolarHBondContact OE1-OG 2.89Å; E50-K154 IonicContact OE1-NZ 3.08Å; E50-K154 IonicContact OE2-NZ 3.25Å; E50-K154 PolarHBondContact OE2-NZ 3.24Å
51	N	90.6	Very high	79.6	Confident	85 Å²	85	80.2 Å²	80.2	46%	0.455	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	123.3	177.1	-176.1	-41.1	0	0	0	111	H53 L54 V55	N51-H53 PolarHBondContact O-N 2.9Å; N51-H53 VanDerWaalsContact O-N 3.12Å; N51-H53 WeakPolarHBondContact OD1-CB 3.21Å; N51-H53 PolarHBondContact OD1-CD2 3.46Å; N51-H53 VanDerWaalsContact OD1-CD2 3.29Å; N51-H53 PolarHBondContact OD1-N 3.29Å; N51-L54 HydrophobicContact CB-CB 4.49Å; N51-L54 WeakPolarHBondContact O-CB 3.24Å; N51-L54 PolarHBondContact O-N 3.47Å; N51-V55 PolarHBondContact O-N 2.93Å
52	I	93	Very high	82.2	Confident	66 Å²	66	76.7 Å²	76.7	34%	0.338	38%	0.375	S	S	.	.	H	α-helix	trans	-51.4	-36.4	-179.3	-169.2	167.6	0	0	0	113.4	G45 E50 L54 V55 L56	G45-I52 WeakPolarHBondContact O-CB 3.28Å; G45-I52 PolarHBondContact O-N 2.89Å; E50-I52 PolarHBondContact O-N 3.15Å; I52-L54 VanDerWaalsContact C-N 3.33Å; I52-L54 PolarHBondContact O-N 3Å; I52-V55 PolarHBondContact O-N 3.48Å; I52-L56 HydrophobicContact CD1-CD1 4.43Å; I52-L56 HydrophobicContact CG1-CD1 3.9Å; I52-L56 HydrophobicContact CG1-CG 4.11Å; I52-L56 WeakPolarHBondContact O-CB 3.38Å; I52-L56 VanDerWaalsContact O-CG 3.31Å; I52-L56 WeakPolarHBondContact O-CG 3.5Å; I52-L56 PolarHBondContact O-N 3.09Å
53	H	94.4	Very high	84.7	Confident	138 Å²	138	70.8 Å²	70.8	64%	0.639	36%	0.356	S	S	*	.	H	α-helix	trans	-65.9	-35.5	178.3	-62.5	-69	0	0	0	112.3	N51 F57	N51-H53 PolarHBondContact O-N 2.9Å; N51-H53 VanDerWaalsContact O-N 3.12Å; N51-H53 WeakPolarHBondContact OD1-CB 3.21Å; N51-H53 PolarHBondContact OD1-CD2 3.46Å; N51-H53 VanDerWaalsContact OD1-CD2 3.29Å; N51-H53 PolarHBondContact OD1-N 3.29Å; H53-F57 WeakPolarHBondContact O-CB 3.5Å; H53-F57 PolarHBondContact O-N 2.63Å
54	L	95.3	Very high	87.2	Confident	32 Å²	32	64.5 Å²	64.5	17%	0.168	34%	0.338	C	S	.	.	H	α-helix	trans	-66.9	-43.9	175.3	-178.9	149.9	0	0	0	110.3	N51 I52 F57 T58 V147 Y150 F166	N51-L54 HydrophobicContact CB-CB 4.49Å; N51-L54 WeakPolarHBondContact O-CB 3.24Å; N51-L54 PolarHBondContact O-N 3.47Å; I52-L54 VanDerWaalsContact C-N 3.33Å; I52-L54 PolarHBondContact O-N 3Å; L54-F57 PolarHBondContact O-N 2.86Å; L54-T58 PolarHBondContact O-N 3.16Å; L54-T58 PolarHBondContact O-OG1 2.9Å; L54-V147 HydrophobicContact CD2-CG1 4.36Å; L54-V147 HydrophobicContact CD2-CG2 4.01Å; L54-Y150 HydrophobicContact CD1-CD1 3.84Å; L54-Y150 HydrophobicContact CD1-CD2 4.49Å; L54-Y150 HydrophobicContact CD1-CE1 3.5Å; L54-Y150 VanDerWaalsContact CD1-CE1 3.5Å; L54-Y150 HydrophobicContact CD1-CE2 4.21Å; L54-Y150 HydrophobicContact CD1-CG 4.31Å; L54-Y150 HydrophobicContact CD2-CD1 4.19Å; L54-F166 HydrophobicContact CD2-CZ 4.45Å
55	V	96.7	Very high	89.7	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-49.2	178.6	-177.8	0	0	0	0	110.8	L47 L48 E50 N51 I52 F57 T58 I59 V147	L47-V55 HydrophobicContact CB-CG2 4.34Å; L47-V55 HydrophobicContact CD2-CB 4.29Å; L47-V55 HydrophobicContact CD2-CG1 3.72Å; L47-V55 HydrophobicContact CG-CG1 4.21Å; L47-V55 WeakPolarHBondContact O-CG2 3.4Å; L48-V55 HydrophobicContact CD1-CG1 4.26Å; E50-V55 HydrophobicContact CB-CG2 4.41Å; N51-V55 PolarHBondContact O-N 2.93Å; I52-V55 PolarHBondContact O-N 3.48Å; V55-F57 VanDerWaalsContact C-N 3.35Å; V55-F57 PolarHBondContact O-N 2.77Å; V55-T58 PolarHBondContact O-N 2.98Å; V55-I59 HydrophobicContact CG1-CD1 3.9Å; V55-I59 WeakPolarHBondContact O-CG1 3.33Å; V55-I59 PolarHBondContact O-N 3.41Å; V55-V147 HydrophobicContact CG2-CG1 4.16Å; V55-V147 HydrophobicContact CG2-CG2 4.34Å
56	L	96.8	Very high	91.8	Very high	91 Å²	91	52 Å²	52	48%	0.476	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-39.9	178.1	-69.1	177.4	0	0	0	112.2	I52 I59 A60	I52-L56 HydrophobicContact CD1-CD1 4.43Å; I52-L56 HydrophobicContact CG1-CD1 3.9Å; I52-L56 HydrophobicContact CG1-CG 4.11Å; I52-L56 WeakPolarHBondContact O-CB 3.38Å; I52-L56 VanDerWaalsContact O-CG 3.31Å; I52-L56 WeakPolarHBondContact O-CG 3.5Å; I52-L56 PolarHBondContact O-N 3.09Å; L56-I59 PolarHBondContact O-N 3.49Å; L56-A60 VanDerWaalsContact O-CB 3.28Å; L56-A60 WeakPolarHBondContact O-CB 3.28Å; L56-A60 PolarHBondContact O-N 3.39Å
57	F	97.6	Very high	93.2	Very high	117 Å²	117	52.6 Å²	52.6	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-59.8	-45.7	173.5	170.2	-100.7	0	0	0	111.6	H53 L54 V55 I59 A60 L61 L170	H53-F57 WeakPolarHBondContact O-CB 3.5Å; H53-F57 PolarHBondContact O-N 2.63Å; L54-F57 PolarHBondContact O-N 2.86Å; V55-F57 VanDerWaalsContact C-N 3.35Å; V55-F57 PolarHBondContact O-N 2.77Å; F57-I59 PolarHBondContact O-N 3.14Å; F57-A60 PolarHBondContact O-N 3.16Å; F57-L61 HydrophobicContact CE1-CD2 4.41Å; F57-L61 HydrophobicContact CZ-CD2 4.42Å; F57-L61 WeakPolarHBondContact O-CB 3.19Å; F57-L61 PolarHBondContact O-N 3.15Å; F57-L170 HydrophobicContact CE1-CD1 3.77Å
58	T	97.8	Very high	94.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-44.4	179.9	-46.4	0	0	0	0	111.2	L54 V55 L61 R62 A143 D146 V147 F166 L170	L54-T58 PolarHBondContact O-N 3.16Å; L54-T58 PolarHBondContact O-OG1 2.9Å; V55-T58 PolarHBondContact O-N 2.98Å; T58-L61 PolarHBondContact O-N 3.32Å; T58-R62 WeakPolarHBondContact O-CG 3.23Å; T58-R62 PolarHBondContact O-N 3.38Å; T58-A143 HydrophobicContact CG2-CB 3.94Å; T58-D146 HydrophobicContact CG2-CB 3.97Å; T58-V147 HydrophobicContact CG2-CG2 4.15Å; T58-F166 HydrophobicContact CG2-CE2 4.28Å; T58-F166 HydrophobicContact CG2-CZ 4.2Å; T58-F166 VanDerWaalsContact OG1-CZ 3.32Å; T58-F166 WeakPolarHBondContact OG1-CZ 3.25Å; T58-L170 HydrophobicContact CG2-CD2 4.39Å
59	I	98	Very high	95.3	Very high	45 Å²	45	47.9 Å²	47.9	23%	0.231	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-49.9	176.3	-70.8	169.6	0	0	0	110.4	V55 L56 F57 L61 R62 I63 L140 A143	V55-I59 HydrophobicContact CG1-CD1 3.9Å; V55-I59 WeakPolarHBondContact O-CG1 3.33Å; V55-I59 PolarHBondContact O-N 3.41Å; L56-I59 PolarHBondContact O-N 3.49Å; F57-I59 PolarHBondContact O-N 3.14Å; I59-L61 VanDerWaalsContact C-N 3.28Å; I59-L61 PolarHBondContact O-N 2.94Å; I59-R62 PolarHBondContact O-N 2.92Å; I59-I63 HydrophobicContact CG2-CD1 3.65Å; I59-I63 HydrophobicContact CG2-CG1 4.36Å; I59-I63 WeakPolarHBondContact O-CB 3.46Å; I59-I63 VanDerWaalsContact O-CG1 3.3Å; I59-I63 WeakPolarHBondContact O-CG1 3.24Å; I59-I63 PolarHBondContact O-N 3.48Å; I59-L140 HydrophobicContact CG1-CD2 4.28Å; I59-L140 HydrophobicContact CG2-CD2 3.7Å; I59-A143 HydrophobicContact CG1-CB 3.94Å
60	A	98.1	Very high	96.1	Very high	58 Å²	58	48 Å²	48	48%	0.479	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-41.2	178.9	0	0	0	0	0	111.7	L56 F57 I63 L64	L56-A60 VanDerWaalsContact O-CB 3.28Å; L56-A60 WeakPolarHBondContact O-CB 3.28Å; L56-A60 PolarHBondContact O-N 3.39Å; F57-A60 PolarHBondContact O-N 3.16Å; A60-I63 PolarHBondContact O-N 3.27Å; A60-L64 WeakPolarHBondContact O-CB 3.13Å; A60-L64 PolarHBondContact O-N 3.36Å
61	L	97.8	Very high	96.3	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.141	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-44.9	176.4	-177.7	65.7	0	0	0	112.1	F57 T58 I59 I63 L64 N65 L170	F57-L61 HydrophobicContact CE1-CD2 4.41Å; F57-L61 HydrophobicContact CZ-CD2 4.42Å; F57-L61 WeakPolarHBondContact O-CB 3.19Å; F57-L61 PolarHBondContact O-N 3.15Å; T58-L61 PolarHBondContact O-N 3.32Å; I59-L61 VanDerWaalsContact C-N 3.28Å; I59-L61 PolarHBondContact O-N 2.94Å; L61-I63 VanDerWaalsContact C-N 3.33Å; L61-I63 PolarHBondContact O-N 3.28Å; L61-L64 WeakPolarHBondContact O-CB 3.17Å; L61-L64 PolarHBondContact O-N 3.27Å; L61-N65 PolarHBondContact O-N 3.14Å; L61-N65 PolarHBondContact O-OD1 2.91Å; L61-N65 VanDerWaalsContact O-OD1 3.06Å; L61-L170 HydrophobicContact CD2-CB 4.07Å; L61-L170 HydrophobicContact CD2-CD1 3.7Å; L61-L170 HydrophobicContact CD2-CD2 3.96Å; L61-L170 HydrophobicContact CD2-CG 4.12Å
62	R	97.6	Very high	96.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-32.4	178.6	-65.5	-54.1	-176.1	-162.5	2.7	112.7	T58 I59 N65 C66 A139 A143 D146 T175 T180	T58-R62 WeakPolarHBondContact O-CG 3.23Å; T58-R62 PolarHBondContact O-N 3.38Å; I59-R62 PolarHBondContact O-N 2.92Å; R62-N65 PolarHBondContact NH1-ND2 3.31Å; R62-N65 PolarHBondContact O-N 3.3Å; R62-C66 PolarHBondContact O-N 3.35Å; R62-C66 VanDerWaalsContact O-N 3.1Å; R62-A139 HydrophobicContact CB-CB 4.15Å; R62-A139 WeakPolarHBondContact CB-O 3.28Å; R62-A143 HydrophobicContact CB-CB 4.17Å; R62-A143 HydrophobicContact CG-CB 3.84Å; R62-D146 IonicContact CZ-OD2 3.12Å; R62-D146 IonicContact NE-OD2 3.95Å; R62-D146 PolarHBondContact NE-OD2 3.16Å; R62-D146 VanDerWaalsContact NH2-CG 3.28Å; R62-D146 IonicContact NH2-OD1 3.98Å; R62-D146 PolarHBondContact NH2-OD1 2.88Å; R62-D146 IonicContact NH2-OD2 3.08Å; R62-D146 PolarHBondContact NH2-OD2 3Å; R62-T175 VanDerWaalsContact NH2-CG2 3.3Å; R62-T180 WeakPolarHBondContact O-CG2 3.08Å
63	I	97.4	Very high	96.5	Very high	54 Å²	54	42.5 Å²	42.5	28%	0.277	22%	0.216	S	C	.	.	H	α-helix	trans	-64.8	-45	169.4	-69.5	172	0	0	0	110.3	I59 A60 L61 N65 C66 F67 L136	I59-I63 HydrophobicContact CG2-CD1 3.65Å; I59-I63 HydrophobicContact CG2-CG1 4.36Å; I59-I63 WeakPolarHBondContact O-CB 3.46Å; I59-I63 VanDerWaalsContact O-CG1 3.3Å; I59-I63 WeakPolarHBondContact O-CG1 3.24Å; I59-I63 PolarHBondContact O-N 3.48Å; A60-I63 PolarHBondContact O-N 3.27Å; L61-I63 VanDerWaalsContact C-N 3.33Å; L61-I63 PolarHBondContact O-N 3.28Å; I63-N65 VanDerWaalsContact C-N 3.31Å; I63-N65 PolarHBondContact O-N 3.04Å; I63-C66 WeakPolarHBondContact O-CA 3.2Å; I63-C66 WeakPolarHBondContact O-CB 3.42Å; I63-C66 PolarHBondContact O-N 3.15Å; I63-F67 HydrophobicContact CG2-CD2 4.07Å; I63-F67 HydrophobicContact CG2-CE2 3.56Å; I63-F67 WeakPolarHBondContact O-CD2 3.37Å; I63-F67 PolarHBondContact O-N 2.96Å; I63-L136 HydrophobicContact CG1-CD2 4.17Å; I63-L136 HydrophobicContact CG2-CD2 4.14Å
64	L	97.3	Very high	96.5	Very high	84 Å²	84	36.8 Å²	36.8	44%	0.44	19%	0.19	S	C	.	.	H	α-helix	trans	-58.4	-43.5	174.6	179	64	0	0	0	111.5	A60 L61 C66 F67 L68	A60-L64 WeakPolarHBondContact O-CB 3.13Å; A60-L64 PolarHBondContact O-N 3.36Å; L61-L64 WeakPolarHBondContact O-CB 3.17Å; L61-L64 PolarHBondContact O-N 3.27Å; L64-C66 PolarHBondContact O-N 3.15Å; L64-F67 PolarHBondContact O-N 3.4Å; L64-L68 HydrophobicContact CD1-CD1 4.01Å; L64-L68 HydrophobicContact CD1-CG 4.19Å; L64-L68 HydrophobicContact CD2-CD1 4.28Å; L64-L68 HydrophobicContact CG-CD1 3.74Å; L64-L68 HydrophobicContact CG-CG 4.31Å; L64-L68 WeakPolarHBondContact O-CG 3.35Å; L64-L68 PolarHBondContact O-N 3.47Å
65	N	97.1	Very high	96.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.2	-35.5	174.2	-69.5	11.1	0	0	0	111.9	L61 R62 I63 F67 L68 V69 W176 T180	L61-N65 PolarHBondContact O-N 3.14Å; L61-N65 PolarHBondContact O-OD1 2.91Å; L61-N65 VanDerWaalsContact O-OD1 3.06Å; R62-N65 PolarHBondContact NH1-ND2 3.31Å; R62-N65 PolarHBondContact O-N 3.3Å; I63-N65 VanDerWaalsContact C-N 3.31Å; I63-N65 PolarHBondContact O-N 3.04Å; N65-F67 VanDerWaalsContact C-N 3.3Å; N65-F67 PolarHBondContact O-N 3.38Å; N65-L68 PolarHBondContact O-N 3.36Å; N65-V69 WeakPolarHBondContact O-CB 3.27Å; N65-V69 VanDerWaalsContact O-CG2 3.28Å; N65-V69 WeakPolarHBondContact O-CG2 3.29Å; N65-V69 PolarHBondContact O-N 3.4Å; N65-W176 VanDerWaalsContact OD1-CZ2 3.31Å; N65-W176 WeakPolarHBondContact OD1-CZ2 3.23Å; N65-W176 PolarHBondContact OD1-NE1 2.98Å; N65-T180 HydrophobicContact CB-CG2 3.88Å
66	C	95	Very high	96.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-40.1	176.7	-166.7	0	0	0	0	111.3	R62 I63 L64 R135 L136 T180	R62-C66 PolarHBondContact O-N 3.35Å; R62-C66 VanDerWaalsContact O-N 3.1Å; I63-C66 WeakPolarHBondContact O-CA 3.2Å; I63-C66 WeakPolarHBondContact O-CB 3.42Å; I63-C66 PolarHBondContact O-N 3.15Å; L64-C66 PolarHBondContact O-N 3.15Å; C66-R135 PolarHBondContact O-NH2 3.22Å; C66-R135 VanDerWaalsContact O-NH2 3.11Å; C66-R135 WeakPolarHBondContact SG-CB 3.47Å; C66-L136 HydrophobicContact CB-CD2 4.38Å; C66-T180 HydrophobicContact CB-CG2 4.08Å
67	F	95.9	Very high	96.1	Very high	105 Å²	105	34.6 Å²	34.6	46%	0.461	18%	0.182	S	C	.	.	H	α-helix	trans	-73.5	-30.8	175.5	-67.6	-69.4	0	0	0	113.2	I63 L64 N65 Q70 W132	I63-F67 HydrophobicContact CG2-CD2 4.07Å; I63-F67 HydrophobicContact CG2-CE2 3.56Å; I63-F67 WeakPolarHBondContact O-CD2 3.37Å; I63-F67 PolarHBondContact O-N 2.96Å; L64-F67 PolarHBondContact O-N 3.4Å; N65-F67 VanDerWaalsContact C-N 3.3Å; N65-F67 PolarHBondContact O-N 3.38Å; F67-Q70 WeakPolarHBondContact O-CG 3.5Å; F67-Q70 PolarHBondContact O-NE2 2.81Å; F67-W132 AromaticContact CD1-CH2 3.42Å; F67-W132 HydrophobicContact CD1-CH2 3.42Å; F67-W132 VanDerWaalsContact CD1-CH2 3.42Å; F67-W132 HydrophobicContact CD1-CZ2 4.3Å; F67-W132 AromaticContact CD1-CZ3 3.58Å; F67-W132 HydrophobicContact CD1-CZ3 3.58Å; F67-W132 HydrophobicContact CE1-CE3 4.28Å; F67-W132 AromaticContact CE1-CH2 3.83Å; F67-W132 HydrophobicContact CE1-CH2 3.83Å; F67-W132 HydrophobicContact CE1-CZ2 4.44Å; F67-W132 AromaticContact CE1-CZ3 3.77Å; F67-W132 HydrophobicContact CE1-CZ3 3.77Å; F67-W132 HydrophobicContact CG-CH2 4.35Å; F67-W132 HydrophobicContact CG-CZ3 4.29Å
68	L	96.9	Very high	96	Very high	39 Å²	39	29.3 Å²	29.3	20%	0.204	16%	0.159	C	C	.	.	H	α-helix	trans	-85.7	-13	-179.4	-65.2	174.3	0	0	0	114.1	L64 N65 W176 L392 G395 L396	L64-L68 HydrophobicContact CD1-CD1 4.01Å; L64-L68 HydrophobicContact CD1-CG 4.19Å; L64-L68 HydrophobicContact CD2-CD1 4.28Å; L64-L68 HydrophobicContact CG-CD1 3.74Å; L64-L68 HydrophobicContact CG-CG 4.31Å; L64-L68 WeakPolarHBondContact O-CG 3.35Å; L64-L68 PolarHBondContact O-N 3.47Å; N65-L68 PolarHBondContact O-N 3.36Å; L68-W176 HydrophobicContact CD1-CZ2 3.72Å; L68-L392 HydrophobicContact CD1-CD2 4.23Å; L68-L392 HydrophobicContact CD2-CD2 4.33Å; L68-G395 CarbonylContact O-C 3.58Å; L68-G395 VanDerWaalsContact O-C 3.25Å; L68-L396 HydrophobicContact CD2-CD1 4.36Å; L68-L396 WeakPolarHBondContact O-CD2 3.43Å; L68-L396 VanDerWaalsContact O-CG 3.32Å; L68-L396 WeakPolarHBondContact O-CG 3.49Å
69	V	97.2	Very high	95.9	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	16%	0.16	C	C	.	.			trans	-98.3	102.1	172.1	178	0	0	0	0	108.1	N65 R135 R181 G395	N65-V69 WeakPolarHBondContact O-CB 3.27Å; N65-V69 VanDerWaalsContact O-CG2 3.28Å; N65-V69 WeakPolarHBondContact O-CG2 3.29Å; N65-V69 PolarHBondContact O-N 3.4Å; V69-R135 PolarHBondContact O-NH1 3.43Å; V69-R135 VanDerWaalsContact O-NH1 3.12Å; V69-R135 PolarHBondContact O-NH2 2.76Å; V69-R181 VanDerWaalsContact CG1-NH2 3.34Å; V69-G395 CarbonylContact C-O 3.09Å; V69-G395 WeakPolarHBondContact CA-O 3.33Å
70	Q	95.7	Very high	95.7	Very high	51 Å²	51	28 Å²	28	24%	0.238	15%	0.151	C	C	.	.			trans	-124.6	21.3	-178	-61.8	-58.8	-31.8	0	0	112	F67 G395 L396	F67-Q70 WeakPolarHBondContact O-CG 3.5Å; F67-Q70 PolarHBondContact O-NE2 2.81Å; Q70-G395 PolarHBondContact N-O 2.63Å; Q70-L396 HydrophobicContact CB-CD2 4.45Å; Q70-L396 HydrophobicContact CG-CD2 4.15Å
71	T	96.4	Very high	95.6	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.012	13%	0.128	C	C	.	.	S	Bend	trans	-120.8	157.8	-174.7	52.6	0	0	0	0	111.3	R181 T394 G395 H398 R400 L403	T71-R181 VanDerWaalsContact O-CZ 3.32Å; T71-R181 PolarHBondContact O-NH1 2.86Å; T71-R181 PolarHBondContact O-NH2 2.99Å; T71-R181 PolarHBondContact OG1-NH2 2.91Å; T71-R181 VanDerWaalsContact OG1-NH2 3.12Å; T71-T394 WeakPolarHBondContact CB-O 3.3Å; T71-T394 WeakPolarHBondContact CG2-O 3.31Å; T71-T394 PolarHBondContact OG1-O 3.02Å; T71-G395 WeakPolarHBondContact CG2-O 2.9Å; T71-G395 PolarHBondContact N-O 3.49Å; T71-G395 PolarHBondContact OG1-O 3.12Å; T71-H398 WeakPolarHBondContact CB-O 3.45Å; T71-H398 WeakPolarHBondContact CG2-O 3.34Å; T71-R400 HydrophobicContact CG2-CB 4.02Å; T71-L403 VanDerWaalsContact C-CD1 3.49Å
72	S	93.9	Very high	95.5	Very high	9 Å²	9	24 Å²	24	6%	0.063	12%	0.122	C	C	.	.			trans	-77.1	159.3	167.6	-163.2	0	0	0	0	111.2	Y177 Q399 T402	S72-Y177 PolarHBondContact O-OH 3.21Å; S72-Y177 VanDerWaalsContact O-OH 3.08Å; S72-Q399 PolarHBondContact N-O 2.99Å; S72-T402 WeakPolarHBondContact CB-OG1 3.29Å
73	F	94.4	Very high	95.5	Very high	37 Å²	37	24.1 Å²	24.1	16%	0.162	12%	0.122	C	C	.	.			trans	-128.5	-57	170.5	178.6	-153.8	0	0	0	111.1	F174 Y177 L183 R352	F73-F174 HydrophobicContact CZ-CE2 4.22Å; F73-F174 HydrophobicContact CZ-CZ 4.45Å; F73-Y177 WeakPolarHBondContact CA-OH 3.4Å; F73-Y177 HydrophobicContact CB-CE1 3.92Å; F73-Y177 VanDerWaalsContact CB-OH 3.26Å; F73-Y177 WeakPolarHBondContact CB-OH 3.31Å; F73-Y177 HydrophobicContact CD1-CD1 4.41Å; F73-Y177 AromaticContact CD1-CE1 3.78Å; F73-Y177 HydrophobicContact CD1-CE1 3.78Å; F73-Y177 AromaticContact CD2-CE1 3.5Å; F73-Y177 HydrophobicContact CD2-CE1 3.5Å; F73-Y177 AromaticContact CD2-CZ 3.93Å; F73-Y177 WeakPolarHBondContact CD2-OH 3.29Å; F73-Y177 HydrophobicContact CE1-CE1 4.15Å; F73-Y177 AromaticContact CE2-CE1 3.9Å; F73-Y177 HydrophobicContact CE2-CE1 3.9Å; F73-Y177 HydrophobicContact CG-CD1 4.47Å; F73-Y177 AromaticContact CG-CE1 3.46Å; F73-Y177 HydrophobicContact CG-CE1 3.46Å; F73-Y177 VanDerWaalsContact CG-CE1 3.46Å; F73-Y177 AromaticContact CG-CZ 3.83Å; F73-Y177 HydrophobicContact CZ-CE1 4.21Å; F73-L183 HydrophobicContact CD1-CD1 4.13Å; F73-R352 HydrophobicContact CE1-CB 4.13Å
74	V	94	Very high	95.5	Very high	18 Å²	18	21.6 Å²	21.6	11%	0.109	11%	0.11	C	C	.	.			trans	-151.6	145.2	-170.1	-78.3	0	0	0	0	109.8	D76 E77 L183 R352	V74-D76 VanDerWaalsContact C-N 3.3Å; V74-D76 PolarHBondContact O-N 3.06Å; V74-E77 WeakPolarHBondContact O-CB 3.28Å; V74-E77 PolarHBondContact O-N 2.97Å; V74-L183 HydrophobicContact CG2-CD1 4.17Å; V74-L183 HydrophobicContact CG2-CD2 3.64Å; V74-R352 VanDerWaalsContact CB-NH1 3.34Å
75	P	93.2	Very high	95.5	Very high	54 Å²	54	17.6 Å²	17.6	35%	0.351	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-40.1	-179.9	-34	39.9	0	0	0	115.5	E77 Y78 W79 H431	P75-E77 PolarHBondContact O-N 2.81Å; P75-Y78 PolarHBondContact O-N 3.47Å; P75-W79 PolarHBondContact O-N 3.14Å; P75-H431 HydrophobicContact CB-CB 3.75Å; P75-H431 HydrophobicContact CG-CB 4.02Å
76	D	92.9	Very high	95.5	Very high	22 Å²	22	17.6 Å²	17.6	12%	0.118	9%	0.089	C	C	.	.	H	α-helix	trans	-61.4	-17.9	-174.6	-45.1	34.5	0	0	0	112.8	V74 Y78 Q80 L183 R352	V74-D76 VanDerWaalsContact C-N 3.3Å; V74-D76 PolarHBondContact O-N 3.06Å; D76-Y78 PolarHBondContact O-N 3.23Å; D76-Q80 HydrophobicContact CB-CB 4.16Å; D76-Q80 VanDerWaalsContact CB-CD 3.46Å; D76-Q80 HydrophobicContact CB-CG 4.01Å; D76-Q80 VanDerWaalsContact CG-CD 3.41Å; D76-Q80 PolarHBondContact O-N 3.35Å; D76-Q80 VanDerWaalsContact OD2-CD 3.22Å; D76-Q80 PolarHBondContact OD2-NE2 2.83Å; D76-Q80 PolarHBondContact OD2-OE1 3.21Å; D76-L183 HydrophobicContact CB-CD2 4.37Å; D76-R352 VanDerWaalsContact CG-CZ 3.43Å; D76-R352 IonicContact OD1-CZ 2.84Å; D76-R352 IonicContact OD1-NH1 3.27Å; D76-R352 PolarHBondContact OD1-NH1 3.4Å; D76-R352 VanDerWaalsContact OD1-NH1 3.08Å; D76-R352 IonicContact OD1-NH2 3.1Å; D76-R352 PolarHBondContact OD1-NH2 3.22Å; D76-R352 IonicContact OD2-CZ 3.82Å; D76-R352 IonicContact OD2-NH1 3.8Å; D76-R352 PolarHBondContact OD2-NH1 3.45Å; D76-R352 IonicContact OD2-NH2 3.28Å; D76-R352 PolarHBondContact OD2-NH2 3.09Å
77	E	94.5	Very high	95.6	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.019	10%	0.102	C	C	.	.	H	α-helix	trans	-59.1	-26.5	173.4	-175.2	170.4	-177.2	0	0	112.8	V74 P75 S81 R181 T182 L183	V74-E77 WeakPolarHBondContact O-CB 3.28Å; V74-E77 PolarHBondContact O-N 2.97Å; P75-E77 PolarHBondContact O-N 2.81Å; E77-S81 PolarHBondContact O-OG 2.97Å; E77-R181 HydrophobicContact CG-CB 4.33Å; E77-R181 WeakPolarHBondContact OE1-CB 3.49Å; E77-R181 WeakPolarHBondContact OE1-CG 3.4Å; E77-R181 IonicContact OE1-NH1 3.07Å; E77-R181 WeakPolarHBondContact OE2-CD 3.43Å; E77-R181 IonicContact OE2-CZ 3.7Å; E77-R181 IonicContact OE2-NE 3.97Å; E77-R181 IonicContact OE2-NH1 2.6Å; E77-R181 PolarHBondContact OE2-NH1 3.29Å; E77-T182 PolarHBondContact O-OG1 3.37Å; E77-T182 VanDerWaalsContact O-OG1 3.05Å; E77-L183 HydrophobicContact CB-CD2 3.85Å; E77-L183 HydrophobicContact CB-CG 4.36Å
78	Y	95.2	Very high	95.5	Very high	5 Å²	5	17 Å²	17	2%	0.02	9%	0.088	C	C	.	.	I	π-helix	trans	-117.4	-47.5	-178.6	-44.3	-61.8	0	0	0	110.8	P75 D76 Q80 S81 L82 E83 P434 H438	P75-Y78 PolarHBondContact O-N 3.47Å; D76-Y78 PolarHBondContact O-N 3.23Å; Y78-Q80 VanDerWaalsContact C-N 3.31Å; Y78-Q80 PolarHBondContact O-N 3.32Å; Y78-S81 PolarHBondContact O-N 2.85Å; Y78-L82 HydrophobicContact CD1-CD1 4.36Å; Y78-L82 PolarHBondContact O-N 2.97Å; Y78-E83 VanDerWaalsContact O-CB 3.29Å; Y78-E83 WeakPolarHBondContact O-CB 3.43Å; Y78-E83 PolarHBondContact O-N 3.49Å; Y78-P434 HydrophobicContact CD1-CB 4.04Å; Y78-P434 HydrophobicContact CD1-CG 4.05Å; Y78-P434 HydrophobicContact CD2-CB 3.94Å; Y78-P434 HydrophobicContact CD2-CG 3.72Å; Y78-P434 HydrophobicContact CE1-CB 4.47Å; Y78-P434 HydrophobicContact CE1-CG 3.99Å; Y78-P434 HydrophobicContact CE2-CB 4.4Å; Y78-P434 HydrophobicContact CE2-CG 3.69Å; Y78-P434 HydrophobicContact CG-CB 3.74Å; Y78-P434 HydrophobicContact CG-CG 3.91Å; Y78-H438 AromaticContact CD1-CE1 3.38Å; Y78-H438 WeakPolarHBondContact CD1-CE1 3.49Å; Y78-H438 AromaticContact CD1-NE2 3.96Å; Y78-H438 AromaticContact CE1-CE1 3.61Å; Y78-H438 AromaticContact CE1-NE2 3.68Å
79	W	95.5	Very high	95.5	Very high	8 Å²	8	15.9 Å²	15.9	3%	0.03	8%	0.082	C	C	.	.	I	π-helix	trans	-78	-11.8	-169.7	-63.3	97.7	0	0	0	114.3	P75 E83 V84 Y94 T96 W99 H431 T433 Y435 F447	P75-W79 PolarHBondContact O-N 3.14Å; W79-E83 HydrophobicContact CE3-CG 4.18Å; W79-E83 HydrophobicContact CZ3-CG 4.29Å; W79-V84 WeakPolarHBondContact O-CG2 3.35Å; W79-Y94 HydrophobicContact CE3-CD1 4.21Å; W79-Y94 HydrophobicContact CH2-CD1 4.44Å; W79-Y94 AromaticContact CZ3-CD1 3.53Å; W79-Y94 HydrophobicContact CZ3-CD1 3.53Å; W79-Y94 HydrophobicContact CZ3-CE1 4.37Å; W79-Y94 HydrophobicContact CZ3-CG 4.07Å; W79-T96 HydrophobicContact CB-CG2 4.17Å; W79-T96 HydrophobicContact CD2-CG2 4.31Å; W79-T96 HydrophobicContact CE3-CG2 3.68Å; W79-T96 HydrophobicContact CZ3-CG2 4.44Å; W79-W99 PolarHBondContact O-NE1 3.12Å; W79-H431 AromaticContact CD1-ND1 3.98Å; W79-H431 HydrophobicContact CD2-CB 4.39Å; W79-H431 AromaticContact CD2-ND1 3.31Å; W79-H431 VanDerWaalsContact CD2-ND1 3.31Å; W79-H431 AromaticContact CE2-CG 3.97Å; W79-H431 AromaticContact CE2-ND1 3.3Å; W79-H431 VanDerWaalsContact CE2-ND1 3.3Å; W79-H431 AromaticContact CE3-ND1 3.66Å; W79-H431 HydrophobicContact CG-CB 4.24Å; W79-H431 AromaticContact CG-ND1 3.77Å; W79-H431 AromaticContact CH2-ND1 3.93Å; W79-H431 HydrophobicContact CZ2-CB 4.49Å; W79-H431 AromaticContact CZ2-ND1 3.62Å; W79-H431 AromaticContact CZ3-ND1 3.95Å; W79-H431 AromaticContact NE1-CG 3.97Å; W79-H431 AromaticContact NE1-ND1 3.76Å; W79-H431 PolarHBondContact NE1-O 3.33Å; W79-T433 WeakPolarHBondContact CZ2-O 3.46Å; W79-T433 PolarHBondContact NE1-O 2.86Å; W79-T433 VanDerWaalsContact NE1-O 3.15Å; W79-Y435 HydrophobicContact CH2-CD1 4.02Å; W79-Y435 HydrophobicContact CH2-CD2 4.25Å; W79-Y435 AromaticContact CH2-CG 3.74Å; W79-Y435 HydrophobicContact CH2-CG 3.74Å; W79-Y435 HydrophobicContact CZ2-CG 4.36Å; W79-Y435 HydrophobicContact CZ3-CD1 4.38Å; W79-Y435 HydrophobicContact CZ3-CG 4.45Å; W79-F447 HydrophobicContact CH2-CD1 4.15Å; W79-F447 AromaticContact CH2-CE1 3.5Å; W79-F447 HydrophobicContact CH2-CE1 3.5Å; W79-F447 HydrophobicContact CH2-CE2 4.35Å; W79-F447 AromaticContact CH2-CZ 3.63Å; W79-F447 HydrophobicContact CH2-CZ 3.63Å; W79-F447 HydrophobicContact CZ2-CE1 4.41Å; W79-F447 HydrophobicContact CZ2-CZ 4.36Å; W79-F447 HydrophobicContact CZ3-CE1 4.07Å; W79-F447 AromaticContact CZ3-CZ 3.99Å; W79-F447 HydrophobicContact CZ3-CZ 3.99Å
80	Q	94.5	Very high	95.5	Very high	9 Å²	9	17.2 Å²	17.2	4%	0.042	9%	0.088	C	C	.	.	I	π-helix	trans	-114.8	2.9	174.3	-66.8	176.1	11.7	0	0	113.8	D76 Y78 E98 R104	D76-Q80 HydrophobicContact CB-CB 4.16Å; D76-Q80 VanDerWaalsContact CB-CD 3.46Å; D76-Q80 HydrophobicContact CB-CG 4.01Å; D76-Q80 VanDerWaalsContact CG-CD 3.41Å; D76-Q80 PolarHBondContact O-N 3.35Å; D76-Q80 VanDerWaalsContact OD2-CD 3.22Å; D76-Q80 PolarHBondContact OD2-NE2 2.83Å; D76-Q80 PolarHBondContact OD2-OE1 3.21Å; Y78-Q80 VanDerWaalsContact C-N 3.31Å; Y78-Q80 PolarHBondContact O-N 3.32Å; Q80-E98 PolarHBondContact NE2-OE2 3.43Å; Q80-R104 VanDerWaalsContact CD-NH1 3.32Å
81	S	94.9	Very high	95.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	I	π-helix	trans	-138.7	-81.8	-176.9	57.4	0	0	0	0	111.2	E77 Y78 V84 A85 T182	E77-S81 PolarHBondContact O-OG 2.97Å; Y78-S81 PolarHBondContact O-N 2.85Å; S81-V84 PolarHBondContact O-N 3.23Å; S81-A85 VanDerWaalsContact O-CB 3.27Å; S81-A85 WeakPolarHBondContact O-CB 3.49Å; S81-A85 PolarHBondContact O-N 2.92Å; S81-T182 WeakPolarHBondContact CB-O 3.11Å; S81-T182 PolarHBondContact OG-O 2.82Å; S81-T182 PolarHBondContact OG-OG1 2.73Å
82	L	96.8	Very high	95.2	Very high	3 Å²	3	24 Å²	24	2%	0.016	12%	0.122	C	C	.	.	I	π-helix	trans	-70	-40.7	-167.6	-58.3	-176.3	0	0	0	113.4	Y78 V84 A85 H86 F112 P134 T182	Y78-L82 HydrophobicContact CD1-CD1 4.36Å; Y78-L82 PolarHBondContact O-N 2.97Å; L82-V84 VanDerWaalsContact C-N 3.33Å; L82-V84 PolarHBondContact O-N 2.93Å; L82-A85 PolarHBondContact O-N 2.78Å; L82-H86 VanDerWaalsContact O-CB 3.28Å; L82-H86 WeakPolarHBondContact O-CB 3.31Å; L82-H86 PolarHBondContact O-N 3.11Å; L82-F112 HydrophobicContact CD2-CB 4.18Å; L82-F112 HydrophobicContact CD2-CD1 4.28Å; L82-F112 HydrophobicContact CD2-CD2 4.12Å; L82-F112 HydrophobicContact CD2-CG 3.93Å; L82-P134 HydrophobicContact CD2-CB 3.64Å; L82-P134 HydrophobicContact CD2-CG 3.93Å; L82-T182 HydrophobicContact CD2-CG2 4.2Å; L82-T182 WeakPolarHBondContact CG-OG1 3.27Å
83	E	97.1	Very high	95.1	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-65.4	-40.5	178.5	-171.9	61.9	-161.3	0	0	111.4	Y78 W79 H86 H87 Y94 Y436 S437	Y78-E83 VanDerWaalsContact O-CB 3.29Å; Y78-E83 WeakPolarHBondContact O-CB 3.43Å; Y78-E83 PolarHBondContact O-N 3.49Å; W79-E83 HydrophobicContact CE3-CG 4.18Å; W79-E83 HydrophobicContact CZ3-CG 4.29Å; E83-H86 WeakPolarHBondContact O-CB 3.34Å; E83-H86 PolarHBondContact O-N 3.21Å; E83-H87 PolarHBondContact O-N 3.19Å; E83-Y94 WeakPolarHBondContact CG-O 3.26Å; E83-Y94 PolarHBondContact OE1-N 3.04Å; E83-Y436 WeakPolarHBondContact OE1-CB 3.37Å; E83-Y436 PolarHBondContact OE1-N 2.92Å; E83-Y436 PolarHBondContact OE2-N 3.19Å; E83-S437 WeakPolarHBondContact OE2-CB 3.28Å; E83-S437 PolarHBondContact OE2-N 3.42Å; E83-S437 PolarHBondContact OE2-OG 3.33Å
84	V	97.1	Very high	95	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-45.7	178.2	-177	0	0	0	0	109.8	W79 S81 L82 H86 H87 M88 L95 W99 Y106 P109	W79-V84 WeakPolarHBondContact O-CG2 3.35Å; S81-V84 PolarHBondContact O-N 3.23Å; L82-V84 VanDerWaalsContact C-N 3.33Å; L82-V84 PolarHBondContact O-N 2.93Å; V84-H86 VanDerWaalsContact C-N 3.29Å; V84-H86 PolarHBondContact O-N 2.99Å; V84-H87 PolarHBondContact O-N 3.23Å; V84-M88 HydrophobicContact CG1-SD 4.28Å; V84-M88 WeakPolarHBondContact O-CG 3.39Å; V84-M88 PolarHBondContact O-N 2.99Å; V84-L95 HydrophobicContact CB-CD2 4.31Å; V84-L95 HydrophobicContact CG1-CD2 4.01Å; V84-L95 HydrophobicContact CG2-CD2 4.13Å; V84-W99 HydrophobicContact CB-CZ2 4.14Å; V84-W99 HydrophobicContact CG1-CD2 4.18Å; V84-W99 HydrophobicContact CG1-CE3 4.16Å; V84-W99 HydrophobicContact CG1-CH2 3.9Å; V84-W99 HydrophobicContact CG1-CZ2 3.88Å; V84-W99 HydrophobicContact CG1-CZ3 4.02Å; V84-W99 HydrophobicContact CG2-CD2 4.13Å; V84-W99 HydrophobicContact CG2-CH2 4.36Å; V84-W99 HydrophobicContact CG2-CZ2 3.49Å; V84-W99 VanDerWaalsContact CG2-CZ2 3.49Å; V84-W99 VanDerWaalsContact CG2-NE1 3.29Å; V84-Y106 HydrophobicContact CG1-CD1 3.99Å; V84-Y106 HydrophobicContact CG1-CE1 3.6Å; V84-P109 HydrophobicContact CB-CB 4.11Å; V84-P109 HydrophobicContact CB-CG 4.15Å; V84-P109 HydrophobicContact CG1-CB 3.91Å; V84-P109 HydrophobicContact CG1-CG 3.94Å
85	A	97.4	Very high	95.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-39	174.8	0	0	0	0	0	112.5	S81 L82 M88 V89 P109 F112 A113 Y116	S81-A85 VanDerWaalsContact O-CB 3.27Å; S81-A85 WeakPolarHBondContact O-CB 3.49Å; S81-A85 PolarHBondContact O-N 2.92Å; L82-A85 PolarHBondContact O-N 2.78Å; A85-M88 PolarHBondContact O-N 3.49Å; A85-V89 PolarHBondContact O-N 3.04Å; A85-P109 HydrophobicContact CB-CB 4.49Å; A85-F112 HydrophobicContact CB-CB 3.75Å; A85-A113 HydrophobicContact CB-CB 4.05Å; A85-Y116 HydrophobicContact CB-CD2 4Å; A85-Y116 HydrophobicContact CB-CE2 3.94Å
86	H	97.5	Very high	95.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-50.6	174.1	177.8	-73.1	0	0	0	110.6	L82 E83 V84 M88 V89 F90 Y92 Y116 H440	L82-H86 VanDerWaalsContact O-CB 3.28Å; L82-H86 WeakPolarHBondContact O-CB 3.31Å; L82-H86 PolarHBondContact O-N 3.11Å; E83-H86 WeakPolarHBondContact O-CB 3.34Å; E83-H86 PolarHBondContact O-N 3.21Å; V84-H86 VanDerWaalsContact C-N 3.29Å; V84-H86 PolarHBondContact O-N 2.99Å; H86-M88 VanDerWaalsContact C-N 3.3Å; H86-M88 PolarHBondContact O-N 3.08Å; H86-V89 PolarHBondContact O-N 2.91Å; H86-V89 VanDerWaalsContact O-N 3.14Å; H86-F90 HydrophobicContact CB-CD2 4.45Å; H86-F90 AromaticContact CD2-CD2 3.48Å; H86-F90 VanDerWaalsContact CD2-CD2 3.48Å; H86-F90 WeakPolarHBondContact CD2-CD2 3.49Å; H86-F90 AromaticContact CD2-CE2 3.81Å; H86-F90 AromaticContact CE1-CD2 3.84Å; H86-F90 AromaticContact CG-CD2 3.77Å; H86-F90 AromaticContact NE2-CD2 3.54Å; H86-F90 VanDerWaalsContact O-CD2 3.32Å; H86-F90 WeakPolarHBondContact O-CD2 3.38Å; H86-F90 PolarHBondContact O-N 2.87Å; H86-Y92 AromaticContact CE1-CD2 3.83Å; H86-Y92 AromaticContact CE1-CE1 3.74Å; H86-Y92 AromaticContact CE1-CE2 3.37Å; H86-Y92 WeakPolarHBondContact CE1-CE2 3.29Å; H86-Y92 AromaticContact CE1-CZ 3.3Å; H86-Y92 PolarHBondContact CE1-O 2.93Å; H86-Y92 PolarHBondContact ND1-O 3.45Å; H86-Y92 AromaticContact NE2-CE2 3.94Å; H86-Y92 AromaticContact NE2-CZ 3.61Å; H86-Y92 PolarHBondContact NE2-OH 2.94Å; H86-Y116 HydrophobicContact CB-CD2 4.45Å; H86-Y116 HydrophobicContact CB-CE2 4.15Å; H86-H440 AromaticContact CD2-ND1 3.6Å; H86-H440 AromaticContact NE2-CE1 3.81Å; H86-H440 AromaticContact NE2-ND1 2.97Å; H86-H440 PolarHBondContact NE2-ND1 2.9Å
87	H	96.1	Very high	95	Very high	61 Å²	61	24.9 Å²	24.9	28%	0.282	12%	0.124	S	C	.	.	H	α-helix	trans	-57.7	-41	177.2	-176.4	-80	0	0	0	112.5	E83 V84 V89 N91 Y92 L95	E83-H87 PolarHBondContact O-N 3.19Å; V84-H87 PolarHBondContact O-N 3.23Å; H87-V89 VanDerWaalsContact C-N 3.26Å; H87-V89 PolarHBondContact O-N 3.05Å; H87-N91 WeakPolarHBondContact O-CA 3.37Å; H87-N91 PolarHBondContact O-N 2.81Å; H87-N91 VanDerWaalsContact O-N 3.07Å; H87-Y92 WeakPolarHBondContact CA-O 3.29Å; H87-L95 HydrophobicContact CB-CD2 4.27Å
88	M	95.5	Very high	94.8	Very high	33 Å²	33	26 Å²	26	16%	0.163	13%	0.129	C	C	.	.	H	α-helix	trans	-60.3	-31.3	177.9	-69.3	164.2	79.1	0	0	113.8	V84 A85 H86 Y106 P109 L110 A113 F270	V84-M88 HydrophobicContact CG1-SD 4.28Å; V84-M88 WeakPolarHBondContact O-CG 3.39Å; V84-M88 PolarHBondContact O-N 2.99Å; A85-M88 PolarHBondContact O-N 3.49Å; H86-M88 VanDerWaalsContact C-N 3.3Å; H86-M88 PolarHBondContact O-N 3.08Å; M88-Y106 HydrophobicContact CE-CD1 4.05Å; M88-Y106 HydrophobicContact CG-CD1 4.32Å; M88-Y106 HydrophobicContact CG-CE1 4.26Å; M88-Y106 HydrophobicContact SD-CD1 3.76Å; M88-Y106 HydrophobicContact SD-CE1 4.23Å; M88-P109 HydrophobicContact SD-CB 3.91Å; M88-L110 HydrophobicContact CE-CB 4.21Å; M88-L110 HydrophobicContact CE-CD1 3.74Å; M88-A113 HydrophobicContact CB-CB 4.12Å; M88-A113 HydrophobicContact CE-CB 3.94Å; M88-A113 HydrophobicContact SD-CB 3.89Å; M88-F270 HydrophobicContact CE-CD1 4.04Å; M88-F270 HydrophobicContact CE-CD2 4.26Å; M88-F270 HydrophobicContact CE-CE1 3.43Å; M88-F270 VanDerWaalsContact CE-CE1 3.43Å; M88-F270 HydrophobicContact CE-CE2 3.69Å; M88-F270 HydrophobicContact CE-CG 4.44Å; M88-F270 HydrophobicContact CE-CZ 3.24Å; M88-F270 HydrophobicContact CG-CD1 4.48Å; M88-F270 HydrophobicContact CG-CE1 4.26Å
89	V	96.9	Very high	94.7	Very high	15 Å²	15	26 Å²	26	9%	0.091	13%	0.129	C	C	.	.	H	α-helix	trans	-97.4	-41.9	-174.2	175	0	0	0	0	112.2	A85 H86 H87 A113 K117 H120	A85-V89 PolarHBondContact O-N 3.04Å; H86-V89 PolarHBondContact O-N 2.91Å; H86-V89 VanDerWaalsContact O-N 3.14Å; H87-V89 VanDerWaalsContact C-N 3.26Å; H87-V89 PolarHBondContact O-N 3.05Å; V89-A113 HydrophobicContact CG2-CB 3.99Å; V89-A113 WeakPolarHBondContact CG2-O 3.24Å; V89-K117 HydrophobicContact CG1-CB 4.34Å; V89-K117 HydrophobicContact CG1-CD 4.02Å; V89-K117 HydrophobicContact CG2-CB 4.16Å; V89-H120 HydrophobicContact CG1-CB 4.33Å
90	F	95.6	Very high	94.4	Very high	29 Å²	29	29.6 Å²	29.6	13%	0.127	15%	0.152	C	C	.	.	H	α-helix	trans	-102.3	-5.9	-170.1	-57.5	-70.9	0	0	0	113.8	H86 Y92 Y116 H120 D125 L130 H440	H86-F90 HydrophobicContact CB-CD2 4.45Å; H86-F90 AromaticContact CD2-CD2 3.48Å; H86-F90 VanDerWaalsContact CD2-CD2 3.48Å; H86-F90 WeakPolarHBondContact CD2-CD2 3.49Å; H86-F90 AromaticContact CD2-CE2 3.81Å; H86-F90 AromaticContact CE1-CD2 3.84Å; H86-F90 AromaticContact CG-CD2 3.77Å; H86-F90 AromaticContact NE2-CD2 3.54Å; H86-F90 VanDerWaalsContact O-CD2 3.32Å; H86-F90 WeakPolarHBondContact O-CD2 3.38Å; H86-F90 PolarHBondContact O-N 2.87Å; F90-Y92 HydrophobicContact CB-CD1 3.78Å; F90-Y92 HydrophobicContact CB-CE1 3.57Å; F90-Y92 HydrophobicContact CG-CE1 4.39Å; F90-Y92 WeakPolarHBondContact O-CD1 3.45Å; F90-Y92 PolarHBondContact O-N 3.41Å; F90-Y116 HydrophobicContact CE2-CD2 4.42Å; F90-H120 HydrophobicContact CE1-CB 3.95Å; F90-H120 AromaticContact CE1-CG 3.89Å; F90-H120 AromaticContact CE1-ND1 3.65Å; F90-H120 HydrophobicContact CZ-CB 4.38Å; F90-D125 HydrophobicContact CE1-CB 4.12Å; F90-D125 HydrophobicContact CZ-CB 4.04Å; F90-L130 HydrophobicContact CE2-CD1 4.04Å; F90-L130 HydrophobicContact CE2-CD2 4.38Å; F90-L130 HydrophobicContact CZ-CD1 4.1Å; F90-L130 HydrophobicContact CZ-CD2 4.22Å; F90-H440 AromaticContact CD1-CE1 3.69Å; F90-H440 AromaticContact CD2-CE1 3.83Å; F90-H440 AromaticContact CE1-CE1 3.47Å; F90-H440 VanDerWaalsContact CE1-CE1 3.47Å; F90-H440 WeakPolarHBondContact CE1-CE1 3.31Å; F90-H440 AromaticContact CE2-CE1 3.63Å; F90-H440 AromaticContact CE2-ND1 3.99Å; F90-H440 AromaticContact CG-CE1 3.87Å; F90-H440 AromaticContact CZ-CE1 3.44Å; F90-H440 VanDerWaalsContact CZ-CE1 3.44Å; F90-H440 WeakPolarHBondContact CZ-CE1 3.44Å
91	N	93.4	Very high	94.1	Very high	138 Å²	138	33.6 Å²	33.6	74%	0.738	17%	0.171	S	C	*	.	S	Bend	trans	59	23.3	179.9	-58.1	-40.3	0	0	0	114.6	H87	H87-N91 WeakPolarHBondContact O-CA 3.37Å; H87-N91 PolarHBondContact O-N 2.81Å; H87-N91 VanDerWaalsContact O-N 3.07Å
92	Y	93.1	Very high	94	Very high	57 Å²	57	37.8 Å²	37.8	22%	0.224	19%	0.186	C	C	.	.			trans	-144.6	156.4	165.9	74.3	-84.7	0	0	0	109.4	H86 H87 F90 Y436 H440 C441 P442	H86-Y92 AromaticContact CE1-CD2 3.83Å; H86-Y92 AromaticContact CE1-CE1 3.74Å; H86-Y92 AromaticContact CE1-CE2 3.37Å; H86-Y92 WeakPolarHBondContact CE1-CE2 3.29Å; H86-Y92 AromaticContact CE1-CZ 3.3Å; H86-Y92 PolarHBondContact CE1-O 2.93Å; H86-Y92 PolarHBondContact ND1-O 3.45Å; H86-Y92 AromaticContact NE2-CE2 3.94Å; H86-Y92 AromaticContact NE2-CZ 3.61Å; H86-Y92 PolarHBondContact NE2-OH 2.94Å; H87-Y92 WeakPolarHBondContact CA-O 3.29Å; F90-Y92 HydrophobicContact CB-CD1 3.78Å; F90-Y92 HydrophobicContact CB-CE1 3.57Å; F90-Y92 HydrophobicContact CG-CE1 4.39Å; F90-Y92 WeakPolarHBondContact O-CD1 3.45Å; F90-Y92 PolarHBondContact O-N 3.41Å; Y92-Y436 AromaticContact CD2-CD1 3.92Å; Y92-Y436 HydrophobicContact CD2-CD1 3.92Å; Y92-Y436 HydrophobicContact CD2-CE1 4.29Å; Y92-Y436 HydrophobicContact CD2-CG 4.06Å; Y92-Y436 AromaticContact CE2-CD1 3.64Å; Y92-Y436 HydrophobicContact CE2-CD1 3.64Å; Y92-Y436 HydrophobicContact CE2-CE1 4.28Å; Y92-Y436 HydrophobicContact CE2-CG 4.01Å; Y92-H440 PolarHBondContact OH-ND1 3.36Å; Y92-C441 PolarHBondContact OH-N 3.02Å; Y92-P442 HydrophobicContact CE2-CB 4.44Å
93	G	91.9	Very high	93.7	Very high	24 Å²	24	38.1 Å²	38.1	25%	0.247	19%	0.188	C	C	.	.	S	Bend	trans	145	-169.1	-169.1	0	0	0	0	0	110.4
94	Y	92.8	Very high	93.4	Very high	59 Å²	59	39.9 Å²	39.9	23%	0.231	20%	0.195	C	C	.	.			trans	-127.7	130.8	171.1	-174.2	-84.2	0	0	0	111.2	W79 E83 T96 F447 Q449	W79-Y94 HydrophobicContact CE3-CD1 4.21Å; W79-Y94 HydrophobicContact CH2-CD1 4.44Å; W79-Y94 AromaticContact CZ3-CD1 3.53Å; W79-Y94 HydrophobicContact CZ3-CD1 3.53Å; W79-Y94 HydrophobicContact CZ3-CE1 4.37Å; W79-Y94 HydrophobicContact CZ3-CG 4.07Å; E83-Y94 WeakPolarHBondContact CG-O 3.26Å; E83-Y94 PolarHBondContact OE1-N 3.04Å; Y94-T96 HydrophobicContact CD1-CG2 4.27Å; Y94-T96 HydrophobicContact CE1-CG2 4.16Å; Y94-F447 HydrophobicContact CD1-CE1 4.15Å; Y94-F447 AromaticContact CD1-CZ 3.99Å; Y94-F447 HydrophobicContact CD1-CZ 3.99Å; Y94-F447 HydrophobicContact CD2-CE1 4.15Å; Y94-F447 HydrophobicContact CE1-CE1 4.18Å; Y94-F447 AromaticContact CE1-CZ 3.68Å; Y94-F447 HydrophobicContact CE1-CZ 3.68Å; Y94-F447 HydrophobicContact CE2-CE1 4.22Å; Y94-F447 HydrophobicContact CE2-CZ 4.32Å; Y94-F447 HydrophobicContact CG-CE1 4.1Å; Y94-F447 HydrophobicContact CG-CZ 4.4Å; Y94-F447 AromaticContact CZ-CZ 3.88Å; Y94-Q449 PolarHBondContact OH-NE2 3.41Å; Y94-Q449 PolarHBondContact OH-OE1 3.08Å
95	L	94.4	Very high	93.1	Very high	46 Å²	46	40.4 Å²	40.4	24%	0.241	20%	0.198	C	C	.	.			trans	-103.1	125.2	170.2	-65.9	-180	0	0	0	108.7	V84 H87 W99	V84-L95 HydrophobicContact CB-CD2 4.31Å; V84-L95 HydrophobicContact CG1-CD2 4.01Å; V84-L95 HydrophobicContact CG2-CD2 4.13Å; H87-L95 HydrophobicContact CB-CD2 4.27Å; L95-W99 HydrophobicContact CB-CB 4.15Å; L95-W99 HydrophobicContact CD2-CG 4.33Å
96	T	93.8	Very high	92.9	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	20%	0.201	C	C	.	.			trans	-69.5	165.6	178	66.8	0	0	0	0	111.7	W79 Y94 E98 W99 T100 H431	W79-T96 HydrophobicContact CB-CG2 4.17Å; W79-T96 HydrophobicContact CD2-CG2 4.31Å; W79-T96 HydrophobicContact CE3-CG2 3.68Å; W79-T96 HydrophobicContact CZ3-CG2 4.44Å; Y94-T96 HydrophobicContact CD1-CG2 4.27Å; Y94-T96 HydrophobicContact CE1-CG2 4.16Å; T96-E98 PolarHBondContact O-N 3.32Å; T96-E98 VanDerWaalsContact O-N 3.09Å; T96-W99 WeakPolarHBondContact O-CB 3.33Å; T96-W99 PolarHBondContact O-N 3.25Å; T96-W99 VanDerWaalsContact OG1-CD1 3.32Å; T96-T100 PolarHBondContact O-N 3.26Å; T96-H431 VanDerWaalsContact CG2-CE1 3.45Å; T96-H431 WeakPolarHBondContact CG2-CE1 3.33Å
97	W	90.4	Very high	92.7	Very high	27 Å²	27	41.9 Å²	41.9	10%	0.102	21%	0.206	C	C	.	.	H	α-helix	trans	-54.8	-27.9	176.8	69.8	-91.2	0	0	0	112.8	W99 T100 E101 L103 F284 Y294 P451 P452 L454	W97-W99 PolarHBondContact O-N 3.14Å; W97-T100 VanDerWaalsContact CA-OG1 3.28Å; W97-T100 WeakPolarHBondContact CA-OG1 3.29Å; W97-T100 PolarHBondContact O-N 3.21Å; W97-T100 PolarHBondContact O-OG1 3.16Å; W97-E101 HydrophobicContact CE3-CG 4.18Å; W97-E101 WeakPolarHBondContact O-CB 3.28Å; W97-E101 WeakPolarHBondContact O-CG 3.46Å; W97-E101 PolarHBondContact O-N 2.65Å; W97-L103 HydrophobicContact CE3-CD1 4.36Å; W97-L103 HydrophobicContact CH2-CD1 3.67Å; W97-L103 HydrophobicContact CZ3-CD1 3.37Å; W97-F284 AromaticContact CH2-CE1 3.68Å; W97-F284 HydrophobicContact CH2-CE1 3.68Å; W97-F284 HydrophobicContact CH2-CE2 4.14Å; W97-F284 AromaticContact CH2-CZ 3.39Å; W97-F284 HydrophobicContact CH2-CZ 3.39Å; W97-F284 HydrophobicContact CZ3-CE1 4.25Å; W97-F284 AromaticContact CZ3-CE2 3.89Å; W97-F284 HydrophobicContact CZ3-CE2 3.89Å; W97-F284 AromaticContact CZ3-CZ 3.62Å; W97-F284 HydrophobicContact CZ3-CZ 3.62Å; W97-Y294 VanDerWaalsContact CE2-OH 3.3Å; W97-Y294 HydrophobicContact CZ2-CE2 4.16Å; W97-Y294 AromaticContact CZ2-CZ 3.93Å; W97-Y294 WeakPolarHBondContact CZ2-OH 3.43Å; W97-Y294 PolarHBondContact NE1-OH 3.12Å; W97-P451 HydrophobicContact CB-CB 4.19Å; W97-P451 HydrophobicContact CG-CB 4.19Å; W97-P452 HydrophobicContact CD2-CG 3.81Å; W97-P452 HydrophobicContact CE3-CG 3.75Å; W97-P452 HydrophobicContact CH2-CG 3.58Å; W97-P452 HydrophobicContact CZ2-CG 3.64Å; W97-P452 HydrophobicContact CZ3-CG 3.61Å; W97-L454 HydrophobicContact CZ3-CD2 4.49Å
98	E	90.9	Very high	92.7	Very high	26 Å²	26	39.2 Å²	39.2	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-32.9	176.5	-63.1	-173	99.3	0	0	112.2	Q80 T96 R102 L103 R104	Q80-E98 PolarHBondContact NE2-OE2 3.43Å; T96-E98 PolarHBondContact O-N 3.32Å; T96-E98 VanDerWaalsContact O-N 3.09Å; E98-R102 PolarHBondContact O-N 3.38Å; E98-R102 VanDerWaalsContact O-N 3.16Å; E98-L103 WeakPolarHBondContact O-CB 3.5Å; E98-L103 PolarHBondContact O-N 3.24Å; E98-R104 HydrophobicContact CB-CG 4.02Å; E98-R104 IonicContact OE1-CZ 3.5Å; E98-R104 IonicContact OE1-NE 3.16Å; E98-R104 PolarHBondContact OE1-NE 3.35Å; E98-R104 IonicContact OE1-NH2 2.67Å; E98-R104 PolarHBondContact OE1-NH2 2.85Å; E98-R104 IonicContact OE2-NE 3.77Å
99	W	92.6	Very high	92.7	Very high	6 Å²	6	37.7 Å²	37.7	2%	0.023	19%	0.186	C	C	.	.	H	α-helix	trans	-80.6	-37.1	177.3	-63.3	93.6	0	0	0	111	W79 V84 L95 T96 W97 E101 R102 R104 Y106 P109 F271	W79-W99 PolarHBondContact O-NE1 3.12Å; V84-W99 HydrophobicContact CB-CZ2 4.14Å; V84-W99 HydrophobicContact CG1-CD2 4.18Å; V84-W99 HydrophobicContact CG1-CE3 4.16Å; V84-W99 HydrophobicContact CG1-CH2 3.9Å; V84-W99 HydrophobicContact CG1-CZ2 3.88Å; V84-W99 HydrophobicContact CG1-CZ3 4.02Å; V84-W99 HydrophobicContact CG2-CD2 4.13Å; V84-W99 HydrophobicContact CG2-CH2 4.36Å; V84-W99 HydrophobicContact CG2-CZ2 3.49Å; V84-W99 VanDerWaalsContact CG2-CZ2 3.49Å; V84-W99 VanDerWaalsContact CG2-NE1 3.29Å; L95-W99 HydrophobicContact CB-CB 4.15Å; L95-W99 HydrophobicContact CD2-CG 4.33Å; T96-W99 WeakPolarHBondContact O-CB 3.33Å; T96-W99 PolarHBondContact O-N 3.25Å; T96-W99 VanDerWaalsContact OG1-CD1 3.32Å; W97-W99 PolarHBondContact O-N 3.14Å; W99-E101 VanDerWaalsContact C-N 3.3Å; W99-E101 PolarHBondContact O-N 3.49Å; W99-R102 PolarHBondContact O-N 3.22Å; W99-R102 VanDerWaalsContact O-N 3.12Å; W99-R104 HydrophobicContact CD2-CB 4.29Å; W99-R104 HydrophobicContact CE3-CB 4.26Å; W99-R104 HydrophobicContact CH2-CB 3.69Å; W99-R104 HydrophobicContact CZ2-CB 3.73Å; W99-R104 HydrophobicContact CZ2-CG 4.45Å; W99-R104 HydrophobicContact CZ3-CB 3.99Å; W99-Y106 HydrophobicContact CE3-CD1 4.28Å; W99-Y106 HydrophobicContact CE3-CD2 4.32Å; W99-Y106 AromaticContact CE3-CE1 3.77Å; W99-Y106 HydrophobicContact CE3-CE1 3.77Å; W99-Y106 AromaticContact CE3-CE2 3.84Å; W99-Y106 HydrophobicContact CE3-CE2 3.84Å; W99-Y106 AromaticContact CE3-CZ 3.52Å; W99-Y106 AromaticContact CZ3-CD1 3.75Å; W99-Y106 HydrophobicContact CZ3-CD1 3.75Å; W99-Y106 AromaticContact CZ3-CD2 3.96Å; W99-Y106 HydrophobicContact CZ3-CD2 3.96Å; W99-Y106 AromaticContact CZ3-CE1 3.72Å; W99-Y106 HydrophobicContact CZ3-CE1 3.72Å; W99-Y106 AromaticContact CZ3-CE2 3.95Å; W99-Y106 HydrophobicContact CZ3-CE2 3.95Å; W99-Y106 AromaticContact CZ3-CG 3.87Å; W99-Y106 HydrophobicContact CZ3-CG 3.87Å; W99-Y106 AromaticContact CZ3-CZ 3.82Å; W99-P109 HydrophobicContact CH2-CG 3.58Å; W99-P109 HydrophobicContact CZ2-CG 4.09Å; W99-P109 HydrophobicContact CZ3-CG 4.47Å; W99-F271 HydrophobicContact CE3-CZ 4.29Å; W99-F271 VanDerWaalsContact O-CE1 3.23Å; W99-F271 WeakPolarHBondContact O-CE1 3.47Å
100	T	89.1	Confident	92.7	Very high	84 Å²	84	39.4 Å²	39.4	52%	0.515	19%	0.194	S	C	.	.	H	α-helix	trans	-63.9	-39	174.9	60.7	0	0	0	0	111.4	T96 W97 R102	T96-T100 PolarHBondContact O-N 3.26Å; W97-T100 VanDerWaalsContact CA-OG1 3.28Å; W97-T100 WeakPolarHBondContact CA-OG1 3.29Å; W97-T100 PolarHBondContact O-N 3.21Å; W97-T100 PolarHBondContact O-OG1 3.16Å; T100-R102 VanDerWaalsContact C-N 3.28Å; T100-R102 PolarHBondContact O-N 3.25Å
101	E	89.3	Confident	92.7	Very high	93 Å²	93	41.3 Å²	41.3	44%	0.435	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	0.9	175.2	-65.1	-53	128.9	0	0	114.1	W97 W99 L103 L454	W97-E101 HydrophobicContact CE3-CG 4.18Å; W97-E101 WeakPolarHBondContact O-CB 3.28Å; W97-E101 WeakPolarHBondContact O-CG 3.46Å; W97-E101 PolarHBondContact O-N 2.65Å; W99-E101 VanDerWaalsContact C-N 3.3Å; W99-E101 PolarHBondContact O-N 3.49Å; E101-L103 VanDerWaalsContact C-N 3.29Å; E101-L103 HydrophobicContact CB-CD1 4.26Å; E101-L103 HydrophobicContact CB-CG 4Å; E101-L103 PolarHBondContact O-N 3.16Å; E101-L454 HydrophobicContact CG-CD1 3.59Å
102	R	92.9	Very high	92.9	Very high	87 Å²	87	35 Å²	35	33%	0.328	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	42	173.3	-39.8	173.3	-164.3	137.4	8.9	112.7	E98 W99 T100 F271 T275 N280	E98-R102 PolarHBondContact O-N 3.38Å; E98-R102 VanDerWaalsContact O-N 3.16Å; W99-R102 PolarHBondContact O-N 3.22Å; W99-R102 VanDerWaalsContact O-N 3.12Å; T100-R102 VanDerWaalsContact C-N 3.28Å; T100-R102 PolarHBondContact O-N 3.25Å; R102-F271 HydrophobicContact CB-CD1 4.27Å; R102-F271 HydrophobicContact CB-CE1 3.95Å; R102-F271 HydrophobicContact CB-CE2 4.22Å; R102-F271 HydrophobicContact CB-CZ 3.92Å; R102-F271 HydrophobicContact CG-CD1 3.73Å; R102-F271 HydrophobicContact CG-CE1 3.79Å; R102-F271 HydrophobicContact CG-CG 4.17Å; R102-F271 HydrophobicContact CG-CZ 4.27Å; R102-T275 HydrophobicContact CB-CG2 3.65Å; R102-T275 HydrophobicContact CG-CG2 4.38Å; R102-N280 PolarHBondContact O-ND2 3Å; R102-N280 VanDerWaalsContact O-ND2 3.14Å
103	L	89.2	Confident	93.1	Very high	10 Å²	10	32.5 Å²	32.5	5%	0.052	16%	0.163	C	C	.	.			trans	-87.6	-15.7	178.8	-64	179.6	0	0	0	113.1	W97 E98 E101 V277 N280 F284	W97-L103 HydrophobicContact CE3-CD1 4.36Å; W97-L103 HydrophobicContact CH2-CD1 3.67Å; W97-L103 HydrophobicContact CZ3-CD1 3.37Å; E98-L103 WeakPolarHBondContact O-CB 3.5Å; E98-L103 PolarHBondContact O-N 3.24Å; E101-L103 VanDerWaalsContact C-N 3.29Å; E101-L103 HydrophobicContact CB-CD1 4.26Å; E101-L103 HydrophobicContact CB-CG 4Å; E101-L103 PolarHBondContact O-N 3.16Å; L103-V277 WeakPolarHBondContact O-CG1 3.38Å; L103-N280 HydrophobicContact CD2-CB 4.09Å; L103-F284 HydrophobicContact CD1-CB 4.3Å; L103-F284 HydrophobicContact CD1-CD1 3.88Å; L103-F284 HydrophobicContact CD1-CD2 3.87Å; L103-F284 HydrophobicContact CD1-CE1 4.16Å; L103-F284 HydrophobicContact CD1-CE2 4.13Å; L103-F284 HydrophobicContact CD1-CG 3.73Å; L103-F284 HydrophobicContact CD1-CZ 4.28Å; L103-F284 HydrophobicContact CD2-CB 3.59Å; L103-F284 HydrophobicContact CD2-CD2 4.23Å; L103-F284 HydrophobicContact CD2-CG 3.93Å
104	R	90.9	Very high	93.3	Very high	38 Å²	38	34.2 Å²	34.2	14%	0.143	17%	0.171	C	C	.	.	S	Bend	trans	-123.3	143.3	-175	-57.4	-63	-176.5	146.3	-3.3	110.9	Q80 E98 W99 F271 V277	Q80-R104 VanDerWaalsContact CD-NH1 3.32Å; E98-R104 HydrophobicContact CB-CG 4.02Å; E98-R104 IonicContact OE1-CZ 3.5Å; E98-R104 IonicContact OE1-NE 3.16Å; E98-R104 PolarHBondContact OE1-NE 3.35Å; E98-R104 IonicContact OE1-NH2 2.67Å; E98-R104 PolarHBondContact OE1-NH2 2.85Å; E98-R104 IonicContact OE2-NE 3.77Å; W99-R104 HydrophobicContact CD2-CB 4.29Å; W99-R104 HydrophobicContact CE3-CB 4.26Å; W99-R104 HydrophobicContact CH2-CB 3.69Å; W99-R104 HydrophobicContact CZ2-CB 3.73Å; W99-R104 HydrophobicContact CZ2-CG 4.45Å; W99-R104 HydrophobicContact CZ3-CB 3.99Å; R104-F271 WeakPolarHBondContact O-CZ 3.09Å; R104-V277 VanDerWaalsContact C-CG1 3.41Å
105	S	91.3	Very high	93.5	Very high	12 Å²	12	33 Å²	33	8%	0.084	17%	0.168	C	C	.	.			trans	-91.7	141	-177	178.3	0	0	0	0	109.8	T107 P109 D267	S105-T107 PolarHBondContact O-N 3.33Å; S105-T107 PolarHBondContact OG-N 3.07Å; S105-T107 PolarHBondContact OG-OG1 3.3Å; S105-T107 VanDerWaalsContact OG-OG1 3.14Å; S105-P109 WeakPolarHBondContact O-CD 3.28Å; S105-D267 PolarHBondContact OG-OD1 2.97Å; S105-D267 PolarHBondContact OG-OD2 3.4Å
106	Y	93.8	Very high	93.7	Very high	15 Å²	15	30.8 Å²	30.8	6%	0.059	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-7.4	176	-78.9	-81.1	0	0	0	113.4	V84 M88 W99 Y108 P109 L110 D267 F270 F271	V84-Y106 HydrophobicContact CG1-CD1 3.99Å; V84-Y106 HydrophobicContact CG1-CE1 3.6Å; M88-Y106 HydrophobicContact CE-CD1 4.05Å; M88-Y106 HydrophobicContact CG-CD1 4.32Å; M88-Y106 HydrophobicContact CG-CE1 4.26Å; M88-Y106 HydrophobicContact SD-CD1 3.76Å; M88-Y106 HydrophobicContact SD-CE1 4.23Å; W99-Y106 HydrophobicContact CE3-CD1 4.28Å; W99-Y106 HydrophobicContact CE3-CD2 4.32Å; W99-Y106 AromaticContact CE3-CE1 3.77Å; W99-Y106 HydrophobicContact CE3-CE1 3.77Å; W99-Y106 AromaticContact CE3-CE2 3.84Å; W99-Y106 HydrophobicContact CE3-CE2 3.84Å; W99-Y106 AromaticContact CE3-CZ 3.52Å; W99-Y106 AromaticContact CZ3-CD1 3.75Å; W99-Y106 HydrophobicContact CZ3-CD1 3.75Å; W99-Y106 AromaticContact CZ3-CD2 3.96Å; W99-Y106 HydrophobicContact CZ3-CD2 3.96Å; W99-Y106 AromaticContact CZ3-CE1 3.72Å; W99-Y106 HydrophobicContact CZ3-CE1 3.72Å; W99-Y106 AromaticContact CZ3-CE2 3.95Å; W99-Y106 HydrophobicContact CZ3-CE2 3.95Å; W99-Y106 AromaticContact CZ3-CG 3.87Å; W99-Y106 HydrophobicContact CZ3-CG 3.87Å; W99-Y106 AromaticContact CZ3-CZ 3.82Å; Y106-Y108 VanDerWaalsContact C-N 3.32Å; Y106-Y108 PolarHBondContact O-N 3.31Å; Y106-P109 WeakPolarHBondContact O-CD 3.45Å; Y106-L110 WeakPolarHBondContact O-CB 3.43Å; Y106-L110 PolarHBondContact O-N 3.47Å; Y106-D267 PolarHBondContact N-OD1 3.46Å; Y106-D267 VanDerWaalsContact N-OD1 3.12Å; Y106-F270 HydrophobicContact CD1-CB 4.16Å; Y106-F270 HydrophobicContact CD1-CD2 4.39Å; Y106-F270 HydrophobicContact CD1-CG 4.12Å; Y106-F270 HydrophobicContact CD2-CB 3.42Å; Y106-F270 VanDerWaalsContact CD2-CB 3.42Å; Y106-F270 HydrophobicContact CD2-CD2 4.34Å; Y106-F270 HydrophobicContact CD2-CG 4.1Å; Y106-F270 HydrophobicContact CE1-CB 4.26Å; Y106-F270 HydrophobicContact CE1-CG 4.5Å; Y106-F270 HydrophobicContact CE2-CB 3.49Å; Y106-F270 VanDerWaalsContact CE2-CB 3.49Å; Y106-F270 HydrophobicContact CE2-CG 4.44Å; Y106-F270 HydrophobicContact CG-CB 3.76Å; Y106-F270 AromaticContact CG-CD2 3.93Å; Y106-F270 HydrophobicContact CG-CD2 3.93Å; Y106-F270 AromaticContact CG-CG 3.91Å; Y106-F270 HydrophobicContact CG-CG 3.91Å; Y106-F271 HydrophobicContact CD2-CD2 4.16Å; Y106-F271 HydrophobicContact CD2-CE1 4.29Å; Y106-F271 AromaticContact CD2-CE2 3.68Å; Y106-F271 HydrophobicContact CD2-CE2 3.68Å; Y106-F271 AromaticContact CD2-CZ 3.76Å; Y106-F271 HydrophobicContact CD2-CZ 3.76Å; Y106-F271 AromaticContact CE2-CD1 3.81Å; Y106-F271 HydrophobicContact CE2-CD1 3.81Å; Y106-F271 HydrophobicContact CE2-CD2 4.03Å; Y106-F271 AromaticContact CE2-CE1 3.4Å; Y106-F271 HydrophobicContact CE2-CE1 3.4Å; Y106-F271 VanDerWaalsContact CE2-CE1 3.4Å; Y106-F271 AromaticContact CE2-CE2 3.64Å; Y106-F271 HydrophobicContact CE2-CE2 3.64Å; Y106-F271 HydrophobicContact CE2-CG 4.11Å; Y106-F271 AromaticContact CE2-CZ 3.31Å; Y106-F271 HydrophobicContact CE2-CZ 3.31Å
107	T	93.7	Very high	93.9	Very high	17 Å²	17	35.1 Å²	35.1	10%	0.104	18%	0.175	C	C	.	.	H	α-helix	trans	-58.5	-40.6	-175.8	-62.1	0	0	0	0	112.7	S105 L218 I221 I222	S105-T107 PolarHBondContact O-N 3.33Å; S105-T107 PolarHBondContact OG-N 3.07Å; S105-T107 PolarHBondContact OG-OG1 3.3Å; S105-T107 VanDerWaalsContact OG-OG1 3.14Å; T107-L218 HydrophobicContact CG2-CD1 4.4Å; T107-I221 HydrophobicContact CG2-CG2 4.08Å; T107-I222 HydrophobicContact CG2-CG1 4.26Å
108	Y	94.4	Very high	94.3	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-76.7	-50.1	178.8	-174.6	-117.8	0	0	0	113	Y106 L110 I111 F112 Q138 T182 L183 T184 M187 I222	Y106-Y108 VanDerWaalsContact C-N 3.32Å; Y106-Y108 PolarHBondContact O-N 3.31Å; Y108-L110 PolarHBondContact O-N 3.2Å; Y108-I111 HydrophobicContact CD2-CD1 4.16Å; Y108-I111 WeakPolarHBondContact O-CB 3.29Å; Y108-I111 PolarHBondContact O-N 3.45Å; Y108-F112 HydrophobicContact CD1-CE2 4.2Å; Y108-F112 AromaticContact CE1-CE2 3.67Å; Y108-F112 HydrophobicContact CE1-CE2 3.67Å; Y108-F112 HydrophobicContact CE1-CZ 4.34Å; Y108-F112 AromaticContact CE2-CE2 3.97Å; Y108-F112 HydrophobicContact CE2-CE2 3.97Å; Y108-F112 HydrophobicContact CE2-CZ 4.12Å; Y108-F112 AromaticContact CZ-CE2 3.53Å; Y108-F112 AromaticContact CZ-CZ 3.76Å; Y108-Q138 PolarHBondContact OH-OE1 3.35Å; Y108-Q138 VanDerWaalsContact OH-OE1 3.06Å; Y108-T182 VanDerWaalsContact OH-C 3.26Å; Y108-T182 PolarHBondContact OH-O 3.2Å; Y108-L183 PolarHBondContact OH-O 3.35Å; Y108-T184 HydrophobicContact CD1-CG2 3.43Å; Y108-T184 VanDerWaalsContact CD1-CG2 3.43Å; Y108-T184 HydrophobicContact CE1-CG2 3.81Å; Y108-T184 HydrophobicContact CG-CG2 4.06Å; Y108-M187 HydrophobicContact CD2-CB 4.24Å; Y108-M187 HydrophobicContact CD2-CG 4.1Å; Y108-M187 HydrophobicContact CE2-CB 3.56Å; Y108-M187 HydrophobicContact CE2-CG 3.71Å; Y108-M187 HydrophobicContact CE2-SD 4.47Å; Y108-I222 HydrophobicContact CD2-CD1 4.34Å; Y108-I222 HydrophobicContact CD2-CG2 4.16Å; Y108-I222 HydrophobicContact CG-CG2 4.11Å
109	P	96.4	Very high	94.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-54.9	-33.9	172.1	-26.4	32.4	0	0	0	114.1	V84 A85 M88 W99 S105 Y106 I111 F112 A113	V84-P109 HydrophobicContact CB-CB 4.11Å; V84-P109 HydrophobicContact CB-CG 4.15Å; V84-P109 HydrophobicContact CG1-CB 3.91Å; V84-P109 HydrophobicContact CG1-CG 3.94Å; A85-P109 HydrophobicContact CB-CB 4.49Å; M88-P109 HydrophobicContact SD-CB 3.91Å; W99-P109 HydrophobicContact CH2-CG 3.58Å; W99-P109 HydrophobicContact CZ2-CG 4.09Å; W99-P109 HydrophobicContact CZ3-CG 4.47Å; S105-P109 WeakPolarHBondContact O-CD 3.28Å; Y106-P109 WeakPolarHBondContact O-CD 3.45Å; P109-I111 PolarHBondContact O-N 3.33Å; P109-F112 PolarHBondContact O-N 3.1Å; P109-A113 WeakPolarHBondContact O-CB 3.31Å; P109-A113 PolarHBondContact O-N 2.87Å
110	L	96.3	Very high	94.7	Very high	51 Å²	51	41.4 Å²	41.4	27%	0.267	21%	0.208	S	C	.	.	H	α-helix	trans	-58.6	-31	-179.2	-175.2	63.4	0	0	0	112.8	M88 Y106 Y108 A113 S114 I266 F270	M88-L110 HydrophobicContact CE-CB 4.21Å; M88-L110 HydrophobicContact CE-CD1 3.74Å; Y106-L110 WeakPolarHBondContact O-CB 3.43Å; Y106-L110 PolarHBondContact O-N 3.47Å; Y108-L110 PolarHBondContact O-N 3.2Å; L110-A113 PolarHBondContact O-N 3.05Å; L110-S114 WeakPolarHBondContact O-CB 3.32Å; L110-S114 PolarHBondContact O-N 3.31Å; L110-S114 PolarHBondContact O-OG 3.12Å; L110-I266 HydrophobicContact CD2-CD1 4.12Å; L110-I266 HydrophobicContact CD2-CG1 4.31Å; L110-I266 HydrophobicContact CD2-CG2 4.27Å; L110-F270 HydrophobicContact CD1-CE2 4.11Å; L110-F270 HydrophobicContact CD1-CZ 3.98Å
111	I	95.5	Very high	95.1	Very high	70 Å²	70	43.5 Å²	43.5	36%	0.359	22%	0.216	S	C	.	.	H	α-helix	trans	-61.3	-46.9	175.1	-59.1	173.5	0	0	0	109.8	Y108 P109 I115	Y108-I111 HydrophobicContact CD2-CD1 4.16Å; Y108-I111 WeakPolarHBondContact O-CB 3.29Å; Y108-I111 PolarHBondContact O-N 3.45Å; P109-I111 PolarHBondContact O-N 3.33Å; I111-I115 PolarHBondContact O-N 3.29Å
112	F	97.4	Very high	95.5	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-76.1	-35.5	179.2	-55.1	-58.4	0	0	0	112.3	L82 A85 Y108 P109 S114 I115 Y116 P134 T182	L82-F112 HydrophobicContact CD2-CB 4.18Å; L82-F112 HydrophobicContact CD2-CD1 4.28Å; L82-F112 HydrophobicContact CD2-CD2 4.12Å; L82-F112 HydrophobicContact CD2-CG 3.93Å; A85-F112 HydrophobicContact CB-CB 3.75Å; Y108-F112 HydrophobicContact CD1-CE2 4.2Å; Y108-F112 AromaticContact CE1-CE2 3.67Å; Y108-F112 HydrophobicContact CE1-CE2 3.67Å; Y108-F112 HydrophobicContact CE1-CZ 4.34Å; Y108-F112 AromaticContact CE2-CE2 3.97Å; Y108-F112 HydrophobicContact CE2-CE2 3.97Å; Y108-F112 HydrophobicContact CE2-CZ 4.12Å; Y108-F112 AromaticContact CZ-CE2 3.53Å; Y108-F112 AromaticContact CZ-CZ 3.76Å; P109-F112 PolarHBondContact O-N 3.1Å; F112-S114 PolarHBondContact O-N 3.14Å; F112-I115 HydrophobicContact CD1-CD1 4.3Å; F112-I115 WeakPolarHBondContact O-CB 3.38Å; F112-I115 PolarHBondContact O-N 2.94Å; F112-I115 VanDerWaalsContact O-N 3.09Å; F112-Y116 PolarHBondContact O-N 3.39Å; F112-P134 HydrophobicContact CD1-CB 3.57Å; F112-P134 HydrophobicContact CD1-CG 4.24Å; F112-P134 HydrophobicContact CE1-CB 3.86Å; F112-P134 HydrophobicContact CG-CB 4.39Å; F112-T182 HydrophobicContact CE1-CG2 3.79Å; F112-T182 HydrophobicContact CE2-CG2 4.33Å; F112-T182 HydrophobicContact CZ-CG2 3.61Å
113	A	97.6	Very high	95.6	Very high	5 Å²	5	43.3 Å²	43.3	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-36.7	174.3	0	0	0	0	0	110.9	A85 M88 V89 P109 L110 Y116 K117	A85-A113 HydrophobicContact CB-CB 4.05Å; M88-A113 HydrophobicContact CB-CB 4.12Å; M88-A113 HydrophobicContact CE-CB 3.94Å; M88-A113 HydrophobicContact SD-CB 3.89Å; V89-A113 HydrophobicContact CG2-CB 3.99Å; V89-A113 WeakPolarHBondContact CG2-O 3.24Å; P109-A113 WeakPolarHBondContact O-CB 3.31Å; P109-A113 PolarHBondContact O-N 2.87Å; L110-A113 PolarHBondContact O-N 3.05Å; A113-Y116 PolarHBondContact O-N 3.15Å; A113-K117 WeakPolarHBondContact O-CB 3.48Å; A113-K117 PolarHBondContact O-N 3.29Å
114	S	97.5	Very high	95.8	Very high	60 Å²	60	49.2 Å²	49.2	42%	0.42	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-42.9	174.2	-58.2	0	0	0	0	111.6	L110 F112 K117 I118	L110-S114 WeakPolarHBondContact O-CB 3.32Å; L110-S114 PolarHBondContact O-N 3.31Å; L110-S114 PolarHBondContact O-OG 3.12Å; F112-S114 PolarHBondContact O-N 3.14Å; S114-K117 PolarHBondContact O-N 3.01Å; S114-I118 WeakPolarHBondContact O-CD1 3.48Å; S114-I118 VanDerWaalsContact O-CG1 3.28Å; S114-I118 WeakPolarHBondContact O-CG1 3.34Å; S114-I118 PolarHBondContact O-N 3.43Å
115	I	97.2	Very high	95.9	Very high	33 Å²	33	49.5 Å²	49.5	17%	0.169	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-48.5	174.5	-64.8	171.2	0	0	0	110.3	I111 F112 K117 I118 L119 I133 A137	I111-I115 PolarHBondContact O-N 3.29Å; F112-I115 HydrophobicContact CD1-CD1 4.3Å; F112-I115 WeakPolarHBondContact O-CB 3.38Å; F112-I115 PolarHBondContact O-N 2.94Å; F112-I115 VanDerWaalsContact O-N 3.09Å; I115-K117 VanDerWaalsContact C-N 3.34Å; I115-K117 PolarHBondContact O-N 3.22Å; I115-I118 PolarHBondContact O-N 3.24Å; I115-L119 HydrophobicContact CG2-CD1 4.1Å; I115-L119 WeakPolarHBondContact O-CG 3.48Å; I115-L119 PolarHBondContact O-N 2.92Å; I115-I133 HydrophobicContact CG2-CB 4.15Å; I115-I133 HydrophobicContact CG2-CG2 3.45Å; I115-I133 VanDerWaalsContact CG2-CG2 3.45Å; I115-A137 HydrophobicContact CD1-CB 4.1Å
116	Y	97.9	Very high	96	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-41.1	179.4	-69.1	-5.3	0	0	0	112	A85 H86 F90 F112 A113 I118 L119 H120 L130 P134	A85-Y116 HydrophobicContact CB-CD2 4Å; A85-Y116 HydrophobicContact CB-CE2 3.94Å; H86-Y116 HydrophobicContact CB-CD2 4.45Å; H86-Y116 HydrophobicContact CB-CE2 4.15Å; F90-Y116 HydrophobicContact CE2-CD2 4.42Å; F112-Y116 PolarHBondContact O-N 3.39Å; A113-Y116 PolarHBondContact O-N 3.15Å; Y116-I118 VanDerWaalsContact C-N 3.35Å; Y116-I118 PolarHBondContact O-N 3.23Å; Y116-L119 PolarHBondContact O-N 2.89Å; Y116-H120 WeakPolarHBondContact O-CB 2.95Å; Y116-H120 PolarHBondContact O-N 3.44Å; Y116-L130 HydrophobicContact CD1-CB 4.45Å; Y116-L130 HydrophobicContact CD1-CD2 3.4Å; Y116-L130 HydrophobicContact CD1-CG 4.5Å; Y116-L130 HydrophobicContact CE1-CB 3.88Å; Y116-L130 HydrophobicContact CE1-CD2 3.74Å; Y116-L130 HydrophobicContact CE1-CG 4.41Å; Y116-L130 WeakPolarHBondContact CE1-O 3.27Å; Y116-L130 HydrophobicContact CG-CD2 3.82Å; Y116-L130 PolarHBondContact OH-O 3.46Å; Y116-P134 HydrophobicContact CD1-CG 4.45Å; Y116-P134 HydrophobicContact CE1-CG 3.5Å; Y116-P134 VanDerWaalsContact CE1-CG 3.5Å
117	K	97.8	Very high	96.1	Very high	95 Å²	95	52.3 Å²	52.3	41%	0.413	29%	0.288	S	S	.	.	H	α-helix	trans	-63.5	-41.5	177.4	-170.5	64.4	176.1	-177.5	0	111.5	V89 A113 S114 I115 H120 L121	V89-K117 HydrophobicContact CG1-CB 4.34Å; V89-K117 HydrophobicContact CG1-CD 4.02Å; V89-K117 HydrophobicContact CG2-CB 4.16Å; A113-K117 WeakPolarHBondContact O-CB 3.48Å; A113-K117 PolarHBondContact O-N 3.29Å; S114-K117 PolarHBondContact O-N 3.01Å; I115-K117 VanDerWaalsContact C-N 3.34Å; I115-K117 PolarHBondContact O-N 3.22Å; K117-H120 PolarHBondContact O-N 3.28Å; K117-L121 HydrophobicContact CG-CD1 4.2Å; K117-L121 HydrophobicContact CG-CG 4.47Å; K117-L121 WeakPolarHBondContact O-CB 3.48Å; K117-L121 WeakPolarHBondContact O-CG 3.45Å; K117-L121 PolarHBondContact O-N 3.32Å
118	I	97.6	Very high	96.2	Very high	101 Å²	101	55.5 Å²	55.5	52%	0.518	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-46.4	175.1	-68.2	163.7	0	0	0	110.4	S114 I115 Y116 H120 L121 L122	S114-I118 WeakPolarHBondContact O-CD1 3.48Å; S114-I118 VanDerWaalsContact O-CG1 3.28Å; S114-I118 WeakPolarHBondContact O-CG1 3.34Å; S114-I118 PolarHBondContact O-N 3.43Å; I115-I118 PolarHBondContact O-N 3.24Å; Y116-I118 VanDerWaalsContact C-N 3.35Å; Y116-I118 PolarHBondContact O-N 3.23Å; I118-H120 VanDerWaalsContact C-N 3.35Å; I118-H120 PolarHBondContact O-N 2.96Å; I118-L121 PolarHBondContact O-N 2.97Å; I118-L122 HydrophobicContact CG2-CD1 3.96Å; I118-L122 VanDerWaalsContact O-CG 3.28Å; I118-L122 WeakPolarHBondContact O-CG 3.49Å; I118-L122 PolarHBondContact O-N 3.04Å
119	L	97.2	Very high	96.3	Very high	15 Å²	15	58.2 Å²	58.2	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-43	178.7	-69.1	168.9	0	0	0	112.3	I115 Y116 L122 G123 K124 L129 L130 I133	I115-L119 HydrophobicContact CG2-CD1 4.1Å; I115-L119 WeakPolarHBondContact O-CG 3.48Å; I115-L119 PolarHBondContact O-N 2.92Å; Y116-L119 PolarHBondContact O-N 2.89Å; L119-L122 PolarHBondContact O-N 3.47Å; L119-G123 PolarHBondContact O-N 2.8Å; L119-K124 CarbonylContact O-C 3.53Å; L119-K124 PolarHBondContact O-N 3.49Å; L119-L129 HydrophobicContact CD1-CB 4.31Å; L119-L130 HydrophobicContact CD1-CD2 3.9Å; L119-I133 HydrophobicContact CD1-CD1 3.82Å; L119-I133 HydrophobicContact CD2-CD1 3.65Å; L119-I133 HydrophobicContact CG-CD1 4.27Å
120	H	96.6	Very high	96.3	Very high	75 Å²	75	58.2 Å²	58.2	35%	0.347	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-45	176.6	-179.3	64.5	0	0	0	112	V89 F90 Y116 K117 I118 L122 G123 D125	V89-H120 HydrophobicContact CG1-CB 4.33Å; F90-H120 HydrophobicContact CE1-CB 3.95Å; F90-H120 AromaticContact CE1-CG 3.89Å; F90-H120 AromaticContact CE1-ND1 3.65Å; F90-H120 HydrophobicContact CZ-CB 4.38Å; Y116-H120 WeakPolarHBondContact O-CB 2.95Å; Y116-H120 PolarHBondContact O-N 3.44Å; K117-H120 PolarHBondContact O-N 3.28Å; I118-H120 VanDerWaalsContact C-N 3.35Å; I118-H120 PolarHBondContact O-N 2.96Å; H120-L122 PolarHBondContact O-N 3.44Å; H120-G123 PolarHBondContact O-N 2.86Å; H120-D125 HydrophobicContact CB-CB 4.46Å; H120-D125 IonicContact CE1-OD2 3.18Å; H120-D125 IonicContact CG-OD2 2.86Å; H120-D125 IonicContact ND1-OD2 2.72Å; H120-D125 PolarHBondContact ND1-OD2 3.27Å
121	L	97.1	Very high	96.2	Very high	128 Å²	128	56.7 Å²	56.7	67%	0.67	31%	0.308	S	S	*	.	H	α-helix	trans	-63.3	-28.2	176.2	-70.8	173.7	0	0	0	113	K117 I118 G123	K117-L121 HydrophobicContact CG-CD1 4.2Å; K117-L121 HydrophobicContact CG-CG 4.47Å; K117-L121 WeakPolarHBondContact O-CB 3.48Å; K117-L121 WeakPolarHBondContact O-CG 3.45Å; K117-L121 PolarHBondContact O-N 3.32Å; I118-L121 PolarHBondContact O-N 2.97Å; L121-G123 VanDerWaalsContact C-N 3.31Å
122	L	97	Very high	96.3	Very high	115 Å²	115	55.9 Å²	55.9	60%	0.602	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.7	174.6	-66.7	174.3	0	0	0	113.5	I118 L119 H120 K124	I118-L122 HydrophobicContact CG2-CD1 3.96Å; I118-L122 VanDerWaalsContact O-CG 3.28Å; I118-L122 WeakPolarHBondContact O-CG 3.49Å; I118-L122 PolarHBondContact O-N 3.04Å; L119-L122 PolarHBondContact O-N 3.47Å; H120-L122 PolarHBondContact O-N 3.44Å; L122-K124 PolarHBondContact O-N 3.25Å
123	G	95.1	Very high	96.3	Very high	61 Å²	61	58.2 Å²	58.2	63%	0.629	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	28.4	-173.6	0	0	0	0	0	113.5	L119 H120 L121	L119-G123 PolarHBondContact O-N 2.8Å; H120-G123 PolarHBondContact O-N 2.86Å; L121-G123 VanDerWaalsContact C-N 3.31Å
124	K	94.1	Very high	96.2	Very high	134 Å²	134	58 Å²	58	58%	0.583	31%	0.311	S	S	*	.			trans	-123.3	39.4	-177.1	-67.2	-176.8	179.5	179.9	0	111.6	L119 L122 S126 L129	L119-K124 CarbonylContact O-C 3.53Å; L119-K124 PolarHBondContact O-N 3.49Å; L122-K124 PolarHBondContact O-N 3.25Å; K124-S126 PolarHBondContact O-N 2.99Å; K124-S126 VanDerWaalsContact O-N 3.17Å; K124-L129 HydrophobicContact CB-CD1 4.16Å; K124-L129 VanDerWaalsContact O-CD1 3.26Å; K124-L129 WeakPolarHBondContact O-CD1 3.26Å
125	D	91.8	Very high	96.2	Very high	43 Å²	43	55.9 Å²	55.9	23%	0.23	29%	0.294	C	S	.	.			trans	-84.1	38.3	178.3	51.9	-3.4	0	0	0	113.1	F90 H120 H440	F90-D125 HydrophobicContact CE1-CB 4.12Å; F90-D125 HydrophobicContact CZ-CB 4.04Å; H120-D125 HydrophobicContact CB-CB 4.46Å; H120-D125 IonicContact CE1-OD2 3.18Å; H120-D125 IonicContact CG-OD2 2.86Å; H120-D125 IonicContact ND1-OD2 2.72Å; H120-D125 PolarHBondContact ND1-OD2 3.27Å; D125-H440 PolarHBondContact O-CD2 3.07Å; D125-H440 PolarHBondContact O-NE2 2.93Å; D125-H440 IonicContact OD2-NE2 3.02Å
126	S	94.4	Very high	96.2	Very high	62 Å²	62	56.7 Å²	56.7	43%	0.434	30%	0.298	S	S	.	.			trans	-64.2	141.7	173.5	73.3	0	0	0	0	110.8	K124 Q128 L129 L130	K124-S126 PolarHBondContact O-N 2.99Å; K124-S126 VanDerWaalsContact O-N 3.17Å; S126-Q128 PolarHBondContact O-N 2.89Å; S126-L129 PolarHBondContact O-N 3.21Å; S126-L129 WeakPolarHBondContact OG-CG 3.11Å; S126-L130 PolarHBondContact O-N 3.34Å; S126-L130 VanDerWaalsContact O-N 3.08Å
127	V	95	Very high	96.2	Very high	24 Å²	24	58.1 Å²	58.1	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-52	-36.4	-178.1	67.6	0	0	0	0	112.7	L130 I131 Q410 H438 H440	V127-L130 PolarHBondContact O-N 3.16Å; V127-I131 HydrophobicContact CG2-CD1 4.02Å; V127-I131 VanDerWaalsContact O-CG1 3.28Å; V127-I131 WeakPolarHBondContact O-CG1 3.41Å; V127-I131 PolarHBondContact O-N 3.36Å; V127-Q410 HydrophobicContact CG1-CG 4.31Å; V127-Q410 HydrophobicContact CG2-CG 4.41Å; V127-H438 WeakPolarHBondContact CG2-O 3.34Å; V127-H440 HydrophobicContact CB-CB 3.9Å; V127-H440 HydrophobicContact CG2-CB 3.94Å
128	Q	95.4	Very high	96.2	Very high	84 Å²	84	53.7 Å²	53.7	39%	0.393	29%	0.291	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.6	-62.8	-59.6	-36	0	0	111.6	S126 L130 I131 W132	S126-Q128 PolarHBondContact O-N 2.89Å; Q128-L130 VanDerWaalsContact C-N 3.34Å; Q128-L130 PolarHBondContact O-N 2.88Å; Q128-I131 PolarHBondContact O-N 3.38Å; Q128-W132 WeakPolarHBondContact O-CB 3.4Å; Q128-W132 PolarHBondContact O-N 2.65Å
129	L	96.8	Very high	96.2	Very high	62 Å²	62	48.9 Å²	48.9	33%	0.325	27%	0.266	S	S	.	.	H	α-helix	trans	-67.4	-36.7	176.9	-67	176.3	0	0	0	111.7	L119 K124 S126 I131 I133	L119-L129 HydrophobicContact CD1-CB 4.31Å; K124-L129 HydrophobicContact CB-CD1 4.16Å; K124-L129 VanDerWaalsContact O-CD1 3.26Å; K124-L129 WeakPolarHBondContact O-CD1 3.26Å; S126-L129 PolarHBondContact O-N 3.21Å; S126-L129 WeakPolarHBondContact OG-CG 3.11Å; L129-I131 VanDerWaalsContact C-N 3.28Å; L129-I131 PolarHBondContact O-N 3.1Å; L129-I133 HydrophobicContact CB-CD1 4.06Å; L129-I133 HydrophobicContact CD2-CD1 4.03Å; L129-I133 HydrophobicContact CD2-CG1 4.46Å; L129-I133 WeakPolarHBondContact O-CB 3.37Å; L129-I133 WeakPolarHBondContact O-CG1 3.46Å; L129-I133 PolarHBondContact O-N 3.05Å
130	L	96.3	Very high	96.2	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-29.3	175.4	-59.9	179.2	0	0	0	112.8	F90 Y116 L119 S126 V127 Q128 P134 H440	F90-L130 HydrophobicContact CE2-CD1 4.04Å; F90-L130 HydrophobicContact CE2-CD2 4.38Å; F90-L130 HydrophobicContact CZ-CD1 4.1Å; F90-L130 HydrophobicContact CZ-CD2 4.22Å; Y116-L130 HydrophobicContact CD1-CB 4.45Å; Y116-L130 HydrophobicContact CD1-CD2 3.4Å; Y116-L130 HydrophobicContact CD1-CG 4.5Å; Y116-L130 HydrophobicContact CE1-CB 3.88Å; Y116-L130 HydrophobicContact CE1-CD2 3.74Å; Y116-L130 HydrophobicContact CE1-CG 4.41Å; Y116-L130 WeakPolarHBondContact CE1-O 3.27Å; Y116-L130 HydrophobicContact CG-CD2 3.82Å; Y116-L130 PolarHBondContact OH-O 3.46Å; L119-L130 HydrophobicContact CD1-CD2 3.9Å; S126-L130 PolarHBondContact O-N 3.34Å; S126-L130 VanDerWaalsContact O-N 3.08Å; V127-L130 PolarHBondContact O-N 3.16Å; Q128-L130 VanDerWaalsContact C-N 3.34Å; Q128-L130 PolarHBondContact O-N 2.88Å; L130-P134 VanDerWaalsContact O-CD 3.25Å; L130-P134 WeakPolarHBondContact O-CD 3.26Å; L130-P134 VanDerWaalsContact O-CG 3.29Å; L130-P134 WeakPolarHBondContact O-CG 3.49Å; L130-H440 HydrophobicContact CD1-CB 3.96Å; L130-H440 VanDerWaalsContact CD1-CG 3.41Å; L130-H440 WeakPolarHBondContact CD1-ND1 3.37Å
131	I	95.8	Very high	96.3	Very high	19 Å²	19	51.5 Å²	51.5	10%	0.097	28%	0.282	C	S	.	.	H	α-helix	trans	-80.8	-49.9	174.3	-65.7	166.2	0	0	0	110.8	V127 Q128 L129 R135 H438	V127-I131 HydrophobicContact CG2-CD1 4.02Å; V127-I131 VanDerWaalsContact O-CG1 3.28Å; V127-I131 WeakPolarHBondContact O-CG1 3.41Å; V127-I131 PolarHBondContact O-N 3.36Å; Q128-I131 PolarHBondContact O-N 3.38Å; L129-I131 VanDerWaalsContact C-N 3.28Å; L129-I131 PolarHBondContact O-N 3.1Å; I131-R135 WeakPolarHBondContact O-CG 3.31Å; I131-H438 HydrophobicContact CD1-CB 4.2Å
132	W	96.5	Very high	96.4	Very high	53 Å²	53	45.6 Å²	45.6	20%	0.201	25%	0.252	C	S	.	.	H	α-helix	trans	-78	-40.7	-168	-76.1	109	0	0	0	114.1	F67 Q128 R135 L136	F67-W132 AromaticContact CD1-CH2 3.42Å; F67-W132 HydrophobicContact CD1-CH2 3.42Å; F67-W132 VanDerWaalsContact CD1-CH2 3.42Å; F67-W132 HydrophobicContact CD1-CZ2 4.3Å; F67-W132 AromaticContact CD1-CZ3 3.58Å; F67-W132 HydrophobicContact CD1-CZ3 3.58Å; F67-W132 HydrophobicContact CE1-CE3 4.28Å; F67-W132 AromaticContact CE1-CH2 3.83Å; F67-W132 HydrophobicContact CE1-CH2 3.83Å; F67-W132 HydrophobicContact CE1-CZ2 4.44Å; F67-W132 AromaticContact CE1-CZ3 3.77Å; F67-W132 HydrophobicContact CE1-CZ3 3.77Å; F67-W132 HydrophobicContact CG-CH2 4.35Å; F67-W132 HydrophobicContact CG-CZ3 4.29Å; Q128-W132 WeakPolarHBondContact O-CB 3.4Å; Q128-W132 PolarHBondContact O-N 2.65Å; W132-R135 PolarHBondContact O-N 2.86Å; W132-L136 WeakPolarHBondContact O-CG 3.32Å; W132-L136 PolarHBondContact O-N 2.94Å
133	I	97.1	Very high	96.4	Very high	53 Å²	53	40.2 Å²	40.2	27%	0.272	22%	0.223	S	C	.	.	H	α-helix	trans	-65.4	-45.3	-173.1	-64.7	175.3	0	0	0	112.4	I115 L119 L129 R135 L136 A137	I115-I133 HydrophobicContact CG2-CB 4.15Å; I115-I133 HydrophobicContact CG2-CG2 3.45Å; I115-I133 VanDerWaalsContact CG2-CG2 3.45Å; L119-I133 HydrophobicContact CD1-CD1 3.82Å; L119-I133 HydrophobicContact CD2-CD1 3.65Å; L119-I133 HydrophobicContact CG-CD1 4.27Å; L129-I133 HydrophobicContact CB-CD1 4.06Å; L129-I133 HydrophobicContact CD2-CD1 4.03Å; L129-I133 HydrophobicContact CD2-CG1 4.46Å; L129-I133 WeakPolarHBondContact O-CB 3.37Å; L129-I133 WeakPolarHBondContact O-CG1 3.46Å; L129-I133 PolarHBondContact O-N 3.05Å; I133-R135 VanDerWaalsContact C-N 3.29Å; I133-R135 PolarHBondContact O-N 2.87Å; I133-L136 PolarHBondContact O-N 2.82Å; I133-A137 WeakPolarHBondContact O-CB 3.23Å; I133-A137 PolarHBondContact O-N 3.4Å
134	P	97.1	Very high	96.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-55.1	-42.5	173.3	-31.1	39.6	0	0	0	113.6	L82 F112 Y116 L130 A137 Q138 T182	L82-P134 HydrophobicContact CD2-CB 3.64Å; L82-P134 HydrophobicContact CD2-CG 3.93Å; F112-P134 HydrophobicContact CD1-CB 3.57Å; F112-P134 HydrophobicContact CD1-CG 4.24Å; F112-P134 HydrophobicContact CE1-CB 3.86Å; F112-P134 HydrophobicContact CG-CB 4.39Å; Y116-P134 HydrophobicContact CD1-CG 4.45Å; Y116-P134 HydrophobicContact CE1-CG 3.5Å; Y116-P134 VanDerWaalsContact CE1-CG 3.5Å; L130-P134 VanDerWaalsContact O-CD 3.25Å; L130-P134 WeakPolarHBondContact O-CD 3.26Å; L130-P134 VanDerWaalsContact O-CG 3.29Å; L130-P134 WeakPolarHBondContact O-CG 3.49Å; P134-A137 PolarHBondContact O-N 3.04Å; P134-Q138 PolarHBondContact O-N 3.05Å; P134-T182 HydrophobicContact CB-CG2 4.03Å
135	R	97	Very high	96.8	Very high	16 Å²	16	33.2 Å²	33.2	6%	0.06	18%	0.18	C	C	.	.	H	α-helix	trans	-68.3	-40.7	179.7	-61.9	-178.7	66.5	-158	-6.6	112	C66 V69 I131 W132 I133 Q138 A139 T182	C66-R135 PolarHBondContact O-NH2 3.22Å; C66-R135 VanDerWaalsContact O-NH2 3.11Å; C66-R135 WeakPolarHBondContact SG-CB 3.47Å; V69-R135 PolarHBondContact O-NH1 3.43Å; V69-R135 VanDerWaalsContact O-NH1 3.12Å; V69-R135 PolarHBondContact O-NH2 2.76Å; I131-R135 WeakPolarHBondContact O-CG 3.31Å; W132-R135 PolarHBondContact O-N 2.86Å; I133-R135 VanDerWaalsContact C-N 3.29Å; I133-R135 PolarHBondContact O-N 2.87Å; R135-Q138 PolarHBondContact O-N 2.67Å; R135-A139 WeakPolarHBondContact O-CB 3.01Å; R135-A139 PolarHBondContact O-N 3.48Å; R135-T182 HydrophobicContact CG-CG2 4.45Å
136	L	97.8	Very high	97.1	Very high	50 Å²	50	31.3 Å²	31.3	26%	0.262	17%	0.169	S	C	.	.	H	α-helix	trans	-64.2	-41	173.7	-71.4	171.2	0	0	0	111.7	I63 C66 W132 I133 A139 L140	I63-L136 HydrophobicContact CG1-CD2 4.17Å; I63-L136 HydrophobicContact CG2-CD2 4.14Å; C66-L136 HydrophobicContact CB-CD2 4.38Å; W132-L136 WeakPolarHBondContact O-CG 3.32Å; W132-L136 PolarHBondContact O-N 2.94Å; I133-L136 PolarHBondContact O-N 2.82Å; L136-A139 PolarHBondContact O-N 3.44Å; L136-L140 WeakPolarHBondContact O-CG 3.45Å; L136-L140 PolarHBondContact O-N 3.49Å
137	A	97.4	Very high	97.3	Very high	30 Å²	30	28.4 Å²	28.4	25%	0.248	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-45.3	174.7	0	0	0	0	0	111.2	I115 I133 P134 A139 L140 L141	I115-A137 HydrophobicContact CD1-CB 4.1Å; I133-A137 WeakPolarHBondContact O-CB 3.23Å; I133-A137 PolarHBondContact O-N 3.4Å; P134-A137 PolarHBondContact O-N 3.04Å; A137-A139 PolarHBondContact O-N 3.48Å; A137-L140 PolarHBondContact O-N 3.47Å; A137-L141 WeakPolarHBondContact O-CG 3.39Å; A137-L141 PolarHBondContact O-N 2.92Å
138	Q	97.4	Very high	97.4	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-40.4	175.4	-171	63.9	62.7	0	0	112.1	Y108 P134 R135 L140 L141 S142 R181 T182 T186	Y108-Q138 PolarHBondContact OH-OE1 3.35Å; Y108-Q138 VanDerWaalsContact OH-OE1 3.06Å; P134-Q138 PolarHBondContact O-N 3.05Å; R135-Q138 PolarHBondContact O-N 2.67Å; Q138-L140 PolarHBondContact O-N 2.95Å; Q138-L141 PolarHBondContact O-N 3.47Å; Q138-S142 PolarHBondContact O-N 2.97Å; Q138-S142 PolarHBondContact O-OG 3.16Å; Q138-R181 WeakPolarHBondContact CG-O 3.45Å; Q138-T182 HydrophobicContact CB-CG2 4.46Å; Q138-T186 HydrophobicContact CG-CG2 4.04Å
139	A	97.7	Very high	97.5	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-39.9	176.2	0	0	0	0	0	112.5	R62 R135 L136 A137 S142 A143 T180	R62-A139 HydrophobicContact CB-CB 4.15Å; R62-A139 WeakPolarHBondContact CB-O 3.28Å; R135-A139 WeakPolarHBondContact O-CB 3.01Å; R135-A139 PolarHBondContact O-N 3.48Å; L136-A139 PolarHBondContact O-N 3.44Å; A137-A139 PolarHBondContact O-N 3.48Å; A139-S142 PolarHBondContact O-N 3.38Å; A139-A143 PolarHBondContact O-N 3.46Å; A139-T180 HydrophobicContact CB-CG2 3.84Å
140	L	98	Very high	97.6	Very high	78 Å²	78	22.5 Å²	22.5	41%	0.408	12%	0.116	S	C	.	.	H	α-helix	trans	-64.2	-44.6	174.6	-72.6	172.9	0	0	0	111.6	I59 L136 A137 Q138 S142 A143 V144	I59-L140 HydrophobicContact CG1-CD2 4.28Å; I59-L140 HydrophobicContact CG2-CD2 3.7Å; L136-L140 WeakPolarHBondContact O-CG 3.45Å; L136-L140 PolarHBondContact O-N 3.49Å; A137-L140 PolarHBondContact O-N 3.47Å; Q138-L140 PolarHBondContact O-N 2.95Å; L140-S142 VanDerWaalsContact C-N 3.32Å; L140-S142 PolarHBondContact O-N 3.32Å; L140-A143 WeakPolarHBondContact O-CB 3.42Å; L140-A143 PolarHBondContact O-N 3.29Å; L140-V144 WeakPolarHBondContact O-CG2 3.42Å; L140-V144 PolarHBondContact O-N 2.82Å
141	L	97.9	Very high	97.6	Very high	66 Å²	66	22.5 Å²	22.5	35%	0.346	12%	0.117	S	C	.	.	H	α-helix	trans	-60.1	-42.6	175.4	-73.3	176.6	0	0	0	111.6	A137 Q138 V144 A145 M187 V190	A137-L141 WeakPolarHBondContact O-CG 3.39Å; A137-L141 PolarHBondContact O-N 2.92Å; Q138-L141 PolarHBondContact O-N 3.47Å; L141-V144 PolarHBondContact O-N 3.45Å; L141-A145 PolarHBondContact O-N 2.94Å; L141-M187 HydrophobicContact CD1-CE 4.39Å; L141-M187 HydrophobicContact CD1-SD 4.09Å; L141-V190 HydrophobicContact CB-CG1 4.17Å
142	S	98.2	Very high	97.6	Very high	5 Å²	5	21.8 Å²	21.8	4%	0.035	11%	0.113	C	C	.	.	H	α-helix	trans	-62.7	-40.9	173.5	-65.5	0	0	0	0	112.7	Q138 A139 L140 V144 A145 D146 C179	Q138-S142 PolarHBondContact O-N 2.97Å; Q138-S142 PolarHBondContact O-OG 3.16Å; A139-S142 PolarHBondContact O-N 3.38Å; L140-S142 VanDerWaalsContact C-N 3.32Å; L140-S142 PolarHBondContact O-N 3.32Å; S142-V144 VanDerWaalsContact C-N 3.35Å; S142-V144 PolarHBondContact O-N 3.48Å; S142-A145 WeakPolarHBondContact O-CB 3.36Å; S142-A145 PolarHBondContact O-N 3.23Å; S142-D146 VanDerWaalsContact O-CG 3.31Å; S142-D146 PolarHBondContact O-N 2.88Å; S142-C179 WeakPolarHBondContact CB-O 3.37Å; S142-C179 PolarHBondContact OG-O 3.01Å
143	A	98.3	Very high	97.7	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-62.4	-41.4	175.3	0	0	0	0	0	112	T58 I59 R62 A139 L140 A145 D146 V147	T58-A143 HydrophobicContact CG2-CB 3.94Å; I59-A143 HydrophobicContact CG1-CB 3.94Å; R62-A143 HydrophobicContact CB-CB 4.17Å; R62-A143 HydrophobicContact CG-CB 3.84Å; A139-A143 PolarHBondContact O-N 3.46Å; L140-A143 WeakPolarHBondContact O-CB 3.42Å; L140-A143 PolarHBondContact O-N 3.29Å; A143-A145 VanDerWaalsContact C-N 3.32Å; A143-A145 PolarHBondContact O-N 3.47Å; A143-D146 PolarHBondContact O-N 3.12Å; A143-V147 WeakPolarHBondContact O-CG2 3.37Å; A143-V147 PolarHBondContact O-N 3.16Å
144	V	98.2	Very high	97.6	Very high	47 Å²	47	20.5 Å²	20.5	29%	0.285	11%	0.107	S	C	.	.	H	α-helix	trans	-61.2	-44	173.7	174.7	0	0	0	0	110.5	L48 L140 L141 S142 D146 V147 R148 I194	L48-V144 HydrophobicContact CD1-CG1 4.45Å; L48-V144 HydrophobicContact CD1-CG2 4.32Å; L140-V144 WeakPolarHBondContact O-CG2 3.42Å; L140-V144 PolarHBondContact O-N 2.82Å; L141-V144 PolarHBondContact O-N 3.45Å; S142-V144 VanDerWaalsContact C-N 3.35Å; S142-V144 PolarHBondContact O-N 3.48Å; V144-D146 PolarHBondContact O-N 3.01Å; V144-V147 PolarHBondContact O-N 3.03Å; V144-R148 HydrophobicContact CG1-CG 4.33Å; V144-R148 VanDerWaalsContact O-CG 3.26Å; V144-R148 WeakPolarHBondContact O-CG 3.38Å; V144-R148 PolarHBondContact O-N 2.98Å; V144-I194 HydrophobicContact CG1-CD1 4.24Å
145	A	98.4	Very high	97.5	Very high	1 Å²	1	23 Å²	23	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-48.1	177.1	0	0	0	0	0	111.7	L141 S142 A143 V147 R148 L149 V190 I193 I194	L141-A145 PolarHBondContact O-N 2.94Å; S142-A145 WeakPolarHBondContact O-CB 3.36Å; S142-A145 PolarHBondContact O-N 3.23Å; A143-A145 VanDerWaalsContact C-N 3.32Å; A143-A145 PolarHBondContact O-N 3.47Å; A145-V147 PolarHBondContact O-N 3.44Å; A145-R148 CarbonylContact O-C 3.57Å; A145-R148 WeakPolarHBondContact O-CB 3.38Å; A145-R148 PolarHBondContact O-N 2.82Å; A145-R148 VanDerWaalsContact O-N 3.09Å; A145-L149 PolarHBondContact O-N 3.29Å; A145-V190 HydrophobicContact CB-CB 4.33Å; A145-V190 HydrophobicContact CB-CG1 4.13Å; A145-V190 HydrophobicContact CB-CG2 4.15Å; A145-I193 HydrophobicContact CB-CB 4.1Å; A145-I193 HydrophobicContact CB-CD1 3.95Å; A145-I193 HydrophobicContact CB-CG2 4.15Å; A145-I193 WeakPolarHBondContact O-CG2 3.46Å; A145-I194 HydrophobicContact CB-CG1 4.34Å
146	D	98.4	Very high	97.3	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-41	179.7	-62.8	-44.7	0	0	0	112.6	T58 R62 S142 A143 V144 R148 L149 Y150 F166 Q169 L170	T58-D146 HydrophobicContact CG2-CB 3.97Å; R62-D146 IonicContact CZ-OD2 3.12Å; R62-D146 IonicContact NE-OD2 3.95Å; R62-D146 PolarHBondContact NE-OD2 3.16Å; R62-D146 VanDerWaalsContact NH2-CG 3.28Å; R62-D146 IonicContact NH2-OD1 3.98Å; R62-D146 PolarHBondContact NH2-OD1 2.88Å; R62-D146 IonicContact NH2-OD2 3.08Å; R62-D146 PolarHBondContact NH2-OD2 3Å; S142-D146 VanDerWaalsContact O-CG 3.31Å; S142-D146 PolarHBondContact O-N 2.88Å; A143-D146 PolarHBondContact O-N 3.12Å; V144-D146 PolarHBondContact O-N 3.01Å; D146-R148 VanDerWaalsContact C-N 3.31Å; D146-R148 PolarHBondContact O-N 3.08Å; D146-L149 PolarHBondContact O-N 3.47Å; D146-Y150 PolarHBondContact O-N 2.73Å; D146-F166 HydrophobicContact CB-CE2 4.03Å; D146-Q169 WeakPolarHBondContact OD1-CG 3.37Å; D146-Q169 PolarHBondContact OD1-NE2 3.29Å; D146-L170 HydrophobicContact CB-CD2 4.3Å
147	V	98.2	Very high	97.2	Very high	1 Å²	1	23 Å²	23	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-40.9	173.9	173.4	0	0	0	0	110.4	L48 E50 L54 V55 T58 A143 V144 A145 Y150 S151	L48-V147 HydrophobicContact CD1-CG1 4.33Å; E50-V147 HydrophobicContact CB-CG1 4.49Å; E50-V147 HydrophobicContact CG-CG1 4.25Å; L54-V147 HydrophobicContact CD2-CG1 4.36Å; L54-V147 HydrophobicContact CD2-CG2 4.01Å; V55-V147 HydrophobicContact CG2-CG1 4.16Å; V55-V147 HydrophobicContact CG2-CG2 4.34Å; T58-V147 HydrophobicContact CG2-CG2 4.15Å; A143-V147 WeakPolarHBondContact O-CG2 3.37Å; A143-V147 PolarHBondContact O-N 3.16Å; V144-V147 PolarHBondContact O-N 3.03Å; A145-V147 PolarHBondContact O-N 3.44Å; V147-Y150 PolarHBondContact O-N 3.19Å; V147-S151 PolarHBondContact O-N 2.96Å; V147-S151 PolarHBondContact O-OG 3.26Å
148	R	97.6	Very high	97	Very high	34 Å²	34	25.2 Å²	25.2	13%	0.128	13%	0.126	C	C	.	.	H	α-helix	trans	-66.1	-36.5	176.6	-69.9	-62.2	-179.4	-153.7	-2.2	112.6	L48 V144 A145 D146 S151 L152 I194 F197	L48-R148 PolarHBondContact O-NH1 2.98Å; V144-R148 HydrophobicContact CG1-CG 4.33Å; V144-R148 VanDerWaalsContact O-CG 3.26Å; V144-R148 WeakPolarHBondContact O-CG 3.38Å; V144-R148 PolarHBondContact O-N 2.98Å; A145-R148 CarbonylContact O-C 3.57Å; A145-R148 WeakPolarHBondContact O-CB 3.38Å; A145-R148 PolarHBondContact O-N 2.82Å; A145-R148 VanDerWaalsContact O-N 3.09Å; D146-R148 VanDerWaalsContact C-N 3.31Å; D146-R148 PolarHBondContact O-N 3.08Å; R148-S151 PolarHBondContact O-N 2.7Å; R148-L152 VanDerWaalsContact O-CB 3.32Å; R148-L152 WeakPolarHBondContact O-CB 3.44Å; R148-L152 PolarHBondContact O-N 3.43Å; R148-I194 HydrophobicContact CG-CG1 4.44Å; R148-F197 HydrophobicContact CB-CB 4.24Å; R148-F197 HydrophobicContact CB-CD2 4.48Å; R148-F197 HydrophobicContact CB-CG 4.4Å; R148-F197 WeakPolarHBondContact O-CD2 3.49Å
149	L	98	Very high	96.9	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-45.9	172.2	-175.7	63.7	0	0	0	111.2	A145 D146 L152 M153 V165 Q169 I193 P359 V363	A145-L149 PolarHBondContact O-N 3.29Å; D146-L149 PolarHBondContact O-N 3.47Å; L149-L152 PolarHBondContact O-N 3Å; L149-M153 WeakPolarHBondContact O-CG 3.13Å; L149-M153 PolarHBondContact O-N 2.92Å; L149-V165 HydrophobicContact CD2-CG1 4.09Å; L149-V165 HydrophobicContact CG-CG1 4.17Å; L149-Q169 HydrophobicContact CD2-CB 4.06Å; L149-Q169 HydrophobicContact CD2-CG 3.87Å; L149-I193 HydrophobicContact CB-CG2 3.82Å; L149-P359 HydrophobicContact CD2-CB 4.16Å; L149-V363 HydrophobicContact CD1-CG2 4.35Å
150	Y	98.1	Very high	96.8	Very high	10 Å²	10	33.9 Å²	33.9	4%	0.039	17%	0.166	C	C	.	.	H	α-helix	trans	-59.7	-48.8	175.3	171.5	-99.1	0	0	0	111.7	E50 L54 D146 V147 L152 M153 K154 A162 R163 F166	E50-Y150 HydrophobicContact CG-CD1 4.31Å; E50-Y150 HydrophobicContact CG-CE1 4.42Å; E50-Y150 WeakPolarHBondContact OE2-CE1 3.43Å; L54-Y150 HydrophobicContact CD1-CD1 3.84Å; L54-Y150 HydrophobicContact CD1-CD2 4.49Å; L54-Y150 HydrophobicContact CD1-CE1 3.5Å; L54-Y150 VanDerWaalsContact CD1-CE1 3.5Å; L54-Y150 HydrophobicContact CD1-CE2 4.21Å; L54-Y150 HydrophobicContact CD1-CG 4.31Å; L54-Y150 HydrophobicContact CD2-CD1 4.19Å; D146-Y150 PolarHBondContact O-N 2.73Å; V147-Y150 PolarHBondContact O-N 3.19Å; Y150-L152 VanDerWaalsContact C-N 3.33Å; Y150-L152 PolarHBondContact O-N 2.92Å; Y150-M153 PolarHBondContact O-N 3.15Å; Y150-K154 HydrophobicContact CE1-CD 4.04Å; Y150-K154 WeakPolarHBondContact O-CB 3.32Å; Y150-K154 PolarHBondContact O-N 3.32Å; Y150-A162 HydrophobicContact CD2-CB 3.8Å; Y150-A162 WeakPolarHBondContact CD2-O 3.37Å; Y150-A162 HydrophobicContact CE2-CB 3.7Å; Y150-R163 HydrophobicContact CE2-CG 4.21Å; Y150-F166 HydrophobicContact CD2-CB 3.84Å; Y150-F166 HydrophobicContact CD2-CG 4.16Å; Y150-F166 HydrophobicContact CG-CB 4.46Å; Y150-F166 HydrophobicContact CG-CD2 4.49Å; Y150-F166 HydrophobicContact CG-CG 4.46Å
151	S	96.9	Very high	96.7	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-41.2	177.4	-68.3	0	0	0	0	112.3	E50 V147 R148 K154 Q155	E50-S151 VanDerWaalsContact CD-OG 3.29Å; E50-S151 WeakPolarHBondContact CG-OG 3.44Å; E50-S151 WeakPolarHBondContact OE1-CB 3.23Å; E50-S151 PolarHBondContact OE1-OG 2.89Å; V147-S151 PolarHBondContact O-N 2.96Å; V147-S151 PolarHBondContact O-OG 3.26Å; R148-S151 PolarHBondContact O-N 2.7Å; S151-K154 PolarHBondContact O-N 3.32Å; S151-Q155 WeakPolarHBondContact O-CB 3.3Å; S151-Q155 VanDerWaalsContact O-CG 3.23Å; S151-Q155 WeakPolarHBondContact O-CG 3.36Å; S151-Q155 PolarHBondContact O-N 2.81Å
152	L	96.4	Very high	96.7	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-51.9	176.2	177.7	60.3	0	0	0	110.5	R148 L149 Y150 K154 Q155 L156 L196 F197 L201	R148-L152 VanDerWaalsContact O-CB 3.32Å; R148-L152 WeakPolarHBondContact O-CB 3.44Å; R148-L152 PolarHBondContact O-N 3.43Å; L149-L152 PolarHBondContact O-N 3Å; Y150-L152 VanDerWaalsContact C-N 3.33Å; Y150-L152 PolarHBondContact O-N 2.92Å; L152-K154 VanDerWaalsContact C-N 3.3Å; L152-K154 PolarHBondContact O-N 3.44Å; L152-Q155 WeakPolarHBondContact O-CB 3.1Å; L152-Q155 PolarHBondContact O-N 2.85Å; L152-Q155 VanDerWaalsContact O-N 3.1Å; L152-L156 HydrophobicContact CD1-CD1 3.73Å; L152-L156 HydrophobicContact CD1-CG 3.93Å; L152-L156 HydrophobicContact CG-CD1 3.85Å; L152-L156 HydrophobicContact CG-CG 4.36Å; L152-L156 WeakPolarHBondContact O-CG 3.31Å; L152-L156 PolarHBondContact O-N 2.73Å; L152-L196 HydrophobicContact CD2-CB 4.33Å; L152-L196 HydrophobicContact CD2-CD2 3.65Å; L152-L196 HydrophobicContact CD2-CG 3.67Å; L152-F197 HydrophobicContact CB-CD2 4.04Å; L152-L201 HydrophobicContact CD1-CD1 4.44Å; L152-L201 HydrophobicContact CD2-CD1 4.33Å
153	M	96.8	Very high	96.7	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-33.2	-178.3	-67.1	-48.7	-52.1	0	0	112.8	L149 Y150 Q155 L156 E157 V161 A162 V165 V363 Y367	L149-M153 WeakPolarHBondContact O-CG 3.13Å; L149-M153 PolarHBondContact O-N 2.92Å; Y150-M153 PolarHBondContact O-N 3.15Å; M153-Q155 VanDerWaalsContact C-N 3.32Å; M153-L156 HydrophobicContact SD-CD1 4.41Å; M153-E157 HydrophobicContact CE-CG 3.95Å; M153-E157 WeakPolarHBondContact O-CA 3.45Å; M153-E157 WeakPolarHBondContact O-CB 3.28Å; M153-E157 PolarHBondContact O-N 2.93Å; M153-V161 HydrophobicContact CE-CG1 4.22Å; M153-A162 HydrophobicContact CB-CB 3.99Å; M153-V165 HydrophobicContact CG-CB 4.23Å; M153-V165 HydrophobicContact CG-CG1 4Å; M153-V165 HydrophobicContact CG-CG2 4.15Å; M153-V363 HydrophobicContact CE-CG1 3.72Å; M153-V363 HydrophobicContact CG-CG2 4.41Å; M153-V363 HydrophobicContact SD-CB 4.46Å; M153-V363 HydrophobicContact SD-CG1 3.82Å; M153-V363 HydrophobicContact SD-CG2 3.82Å; M153-Y367 HydrophobicContact CE-CE2 4.26Å
154	K	95.8	Very high	96.7	Very high	78 Å²	78	36.2 Å²	36.2	34%	0.339	17%	0.165	S	C	.	.	H	α-helix	trans	-66.7	-34	173.2	-175.6	-173.8	173.8	-160.6	0	112.1	E50 Y150 S151 L152 A162	E50-K154 IonicContact OE1-NZ 3.08Å; E50-K154 IonicContact OE2-NZ 3.25Å; E50-K154 PolarHBondContact OE2-NZ 3.24Å; Y150-K154 HydrophobicContact CE1-CD 4.04Å; Y150-K154 WeakPolarHBondContact O-CB 3.32Å; Y150-K154 PolarHBondContact O-N 3.32Å; S151-K154 PolarHBondContact O-N 3.32Å; L152-K154 VanDerWaalsContact C-N 3.3Å; L152-K154 PolarHBondContact O-N 3.44Å; K154-A162 HydrophobicContact CB-CB 3.83Å
155	Q	94.3	Very high	96.7	Very high	54 Å²	54	34 Å²	34	25%	0.252	15%	0.151	S	C	.	.	H	α-helix	trans	-74.1	-43.2	175.8	-73.9	177.1	19.5	0	0	112.2	S151 L152 M153 S206	S151-Q155 WeakPolarHBondContact O-CB 3.3Å; S151-Q155 VanDerWaalsContact O-CG 3.23Å; S151-Q155 WeakPolarHBondContact O-CG 3.36Å; S151-Q155 PolarHBondContact O-N 2.81Å; L152-Q155 WeakPolarHBondContact O-CB 3.1Å; L152-Q155 PolarHBondContact O-N 2.85Å; L152-Q155 VanDerWaalsContact O-N 3.1Å; M153-Q155 VanDerWaalsContact C-N 3.32Å; Q155-S206 VanDerWaalsContact CD-OG 3.32Å; Q155-S206 PolarHBondContact NE2-OG 3.09Å; Q155-S206 PolarHBondContact OE1-OG 2.72Å
156	L	94.5	Very high	96.7	Very high	12 Å²	12	34.9 Å²	34.9	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-72.2	-47.4	-178.5	-66.8	177.7	0	0	0	111	L152 M153 L201 E202 R328	L152-L156 HydrophobicContact CD1-CD1 3.73Å; L152-L156 HydrophobicContact CD1-CG 3.93Å; L152-L156 HydrophobicContact CG-CD1 3.85Å; L152-L156 HydrophobicContact CG-CG 4.36Å; L152-L156 WeakPolarHBondContact O-CG 3.31Å; L152-L156 PolarHBondContact O-N 2.73Å; M153-L156 HydrophobicContact SD-CD1 4.41Å; L156-L201 HydrophobicContact CD1-CB 4.3Å; L156-L201 HydrophobicContact CD1-CD1 3.74Å; L156-L201 HydrophobicContact CD2-CB 3.96Å; L156-E202 WeakPolarHBondContact CD2-O 3.38Å; L156-R328 PolarHBondContact O-NH1 3.29Å; L156-R328 PolarHBondContact O-NH2 3.35Å
157	E	94.3	Very high	96.7	Very high	53 Å²	53	37.1 Å²	37.1	25%	0.248	17%	0.165	C	C	.	.	S	Bend	trans	-112	-116.6	-172.2	-67.1	-67.6	169.4	0	0	111.8	M153 V161 R328 H329 Y367	M153-E157 HydrophobicContact CE-CG 3.95Å; M153-E157 WeakPolarHBondContact O-CA 3.45Å; M153-E157 WeakPolarHBondContact O-CB 3.28Å; M153-E157 PolarHBondContact O-N 2.93Å; E157-V161 HydrophobicContact CB-CB 4.13Å; E157-V161 HydrophobicContact CB-CG1 4.31Å; E157-V161 HydrophobicContact CB-CG2 4.42Å; E157-V161 HydrophobicContact CG-CG1 4.35Å; E157-R328 IonicContact OE1-CZ 3.98Å; E157-R328 VanDerWaalsContact OE1-CZ 3.25Å; E157-R328 IonicContact OE1-NE 3.93Å; E157-R328 PolarHBondContact OE1-NE 3.44Å; E157-R328 IonicContact OE1-NH2 2.69Å; E157-R328 PolarHBondContact OE1-NH2 3.21Å; E157-R328 IonicContact OE2-NH2 2.73Å; E157-R328 PolarHBondContact OE2-NH2 3.06Å; E157-H329 IonicContact OE1-CE1 3.21Å; E157-H329 PolarHBondContact OE1-CE1 3.02Å; E157-H329 IonicContact OE1-ND1 3.05Å; E157-Y367 HydrophobicContact CG-CE1 4.4Å; E157-Y367 WeakPolarHBondContact CG-OH 3.36Å; E157-Y367 PolarHBondContact OE1-OH 3.26Å
158	N	93.6	Very high	96.7	Very high	77 Å²	77	37 Å²	37	41%	0.412	16%	0.164	S	C	.	.			trans	-139.7	172	-179.2	65.7	35.4	0	0	0	109.7	E160 V161 A162	N158-E160 VanDerWaalsContact C-N 3.25Å; N158-E160 PolarHBondContact O-N 2.89Å; N158-E160 PolarHBondContact OD1-N 3.29Å; N158-V161 WeakPolarHBondContact OD1-CG2 3.46Å; N158-V161 PolarHBondContact OD1-N 3.47Å; N158-A162 WeakPolarHBondContact O-CB 3.33Å; N158-A162 PolarHBondContact O-N 3.18Å
159	Q	95.4	Very high	96.7	Very high	96 Å²	96	35.5 Å²	35.5	45%	0.449	16%	0.159	S	C	.	.	H	α-helix	trans	-65.6	-27.6	-177.6	-170.7	172.5	8.6	0	0	113.1	R163	Q159-R163 WeakPolarHBondContact O-CD 3.31Å; Q159-R163 WeakPolarHBondContact O-CG 3.46Å; Q159-R163 PolarHBondContact O-N 3.28Å; Q159-R163 VanDerWaalsContact O-N 3.16Å
160	E	95.7	Very high	96.7	Very high	88 Å²	88	36.1 Å²	36.1	41%	0.411	16%	0.162	S	C	.	.	H	α-helix	trans	-70.1	-52.3	179.3	-173.4	178.7	-178	0	0	111.3	N158 A162 R163 W164 T370 K376	N158-E160 VanDerWaalsContact C-N 3.25Å; N158-E160 PolarHBondContact O-N 2.89Å; N158-E160 PolarHBondContact OD1-N 3.29Å; E160-A162 VanDerWaalsContact C-N 3.29Å; E160-A162 PolarHBondContact O-N 2.88Å; E160-R163 WeakPolarHBondContact O-CB 3.45Å; E160-R163 PolarHBondContact O-N 3.27Å; E160-R163 VanDerWaalsContact O-N 3.17Å; E160-W164 PolarHBondContact O-N 2.9Å; E160-W164 PolarHBondContact OE1-NE1 2.96Å; E160-T370 HydrophobicContact CG-CG2 4.18Å; E160-K376 IonicContact OE1-NZ 2.84Å; E160-K376 PolarHBondContact OE1-NZ 3.12Å; E160-K376 VanDerWaalsContact OE1-NZ 3.12Å
161	V	96.6	Very high	96.6	Very high	5 Å²	5	36 Å²	36	3%	0.03	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-45.6	177.9	176.3	0	0	0	0	110	M153 E157 N158 R163 W164 V165 Y367 T370	M153-V161 HydrophobicContact CE-CG1 4.22Å; E157-V161 HydrophobicContact CB-CB 4.13Å; E157-V161 HydrophobicContact CB-CG1 4.31Å; E157-V161 HydrophobicContact CB-CG2 4.42Å; E157-V161 HydrophobicContact CG-CG1 4.35Å; N158-V161 WeakPolarHBondContact OD1-CG2 3.46Å; N158-V161 PolarHBondContact OD1-N 3.47Å; V161-R163 VanDerWaalsContact C-N 3.31Å; V161-R163 PolarHBondContact O-N 2.83Å; V161-W164 PolarHBondContact O-N 3.49Å; V161-W164 VanDerWaalsContact O-N 3.13Å; V161-V165 HydrophobicContact CG1-CG2 4.19Å; V161-V165 WeakPolarHBondContact O-CG2 3.36Å; V161-V165 PolarHBondContact O-N 3.29Å; V161-Y367 HydrophobicContact CG1-CD1 4.41Å; V161-Y367 HydrophobicContact CG1-CD2 4.47Å; V161-Y367 HydrophobicContact CG1-CE1 4.2Å; V161-Y367 HydrophobicContact CG1-CE2 4.26Å; V161-Y367 HydrophobicContact CG2-CE1 4.36Å; V161-T370 HydrophobicContact CG2-CG2 3.97Å
162	A	97.6	Very high	96.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.3	-42.3	178.7	0	0	0	0	0	112.7	Y150 M153 K154 N158 E160 W164 V165 F166	Y150-A162 HydrophobicContact CD2-CB 3.8Å; Y150-A162 WeakPolarHBondContact CD2-O 3.37Å; Y150-A162 HydrophobicContact CE2-CB 3.7Å; M153-A162 HydrophobicContact CB-CB 3.99Å; K154-A162 HydrophobicContact CB-CB 3.83Å; N158-A162 WeakPolarHBondContact O-CB 3.33Å; N158-A162 PolarHBondContact O-N 3.18Å; E160-A162 VanDerWaalsContact C-N 3.29Å; E160-A162 PolarHBondContact O-N 2.88Å; A162-W164 PolarHBondContact O-N 3.4Å; A162-V165 PolarHBondContact O-N 2.85Å; A162-F166 VanDerWaalsContact O-CB 3.24Å; A162-F166 WeakPolarHBondContact O-CB 3.49Å; A162-F166 PolarHBondContact O-N 2.5Å
163	R	97.4	Very high	96.7	Very high	142 Å²	142	36.8 Å²	36.8	54%	0.536	17%	0.165	S	C	.	.	H	α-helix	trans	-61.8	-41.4	176.9	-76.1	169.3	-178.5	-178.4	4.6	112.1	Y150 Q159 E160 V161 F166 F167	Y150-R163 HydrophobicContact CE2-CG 4.21Å; Q159-R163 WeakPolarHBondContact O-CD 3.31Å; Q159-R163 WeakPolarHBondContact O-CG 3.46Å; Q159-R163 PolarHBondContact O-N 3.28Å; Q159-R163 VanDerWaalsContact O-N 3.16Å; E160-R163 WeakPolarHBondContact O-CB 3.45Å; E160-R163 PolarHBondContact O-N 3.27Å; E160-R163 VanDerWaalsContact O-N 3.17Å; V161-R163 VanDerWaalsContact C-N 3.31Å; V161-R163 PolarHBondContact O-N 2.83Å; R163-F166 PolarHBondContact O-N 3.16Å; R163-F167 WeakPolarHBondContact O-CB 3.21Å; R163-F167 PolarHBondContact O-N 2.64Å
164	W	97.8	Very high	96.7	Very high	53 Å²	53	36.9 Å²	36.9	20%	0.201	17%	0.165	C	C	.	.	H	α-helix	trans	-74.6	-37.2	-179.3	-62.6	123.5	0	0	0	113	E160 V161 A162 F166 F167 C168 L369 T370 K376 L380	E160-W164 PolarHBondContact O-N 2.9Å; E160-W164 PolarHBondContact OE1-NE1 2.96Å; V161-W164 PolarHBondContact O-N 3.49Å; V161-W164 VanDerWaalsContact O-N 3.13Å; A162-W164 PolarHBondContact O-N 3.4Å; W164-F166 VanDerWaalsContact C-N 3.31Å; W164-F167 HydrophobicContact CE3-CB 4.37Å; W164-F167 PolarHBondContact O-N 2.96Å; W164-C168 PolarHBondContact O-N 2.93Å; W164-C168 PolarHBondContact O-SG 3Å; W164-L369 HydrophobicContact CB-CB 4.02Å; W164-L369 HydrophobicContact CB-CD1 4.35Å; W164-L369 HydrophobicContact CD2-CB 4.36Å; W164-L369 HydrophobicContact CE3-CD1 4.35Å; W164-L369 HydrophobicContact CG-CB 4.07Å; W164-T370 VanDerWaalsContact CD1-OG1 3.32Å; W164-K376 HydrophobicContact CH2-CD 4.45Å; W164-K376 HydrophobicContact CZ2-CD 3.87Å; W164-L380 HydrophobicContact CE3-CD1 4.38Å; W164-L380 HydrophobicContact CE3-CD2 3.67Å; W164-L380 HydrophobicContact CH2-CD1 3.45Å; W164-L380 VanDerWaalsContact CH2-CD1 3.45Å; W164-L380 HydrophobicContact CH2-CD2 4.29Å; W164-L380 HydrophobicContact CH2-CG 4.49Å; W164-L380 HydrophobicContact CZ2-CD1 4.5Å; W164-L380 HydrophobicContact CZ3-CD1 3.38Å; W164-L380 HydrophobicContact CZ3-CD2 3.39Å; W164-L380 HydrophobicContact CZ3-CG 4.01Å
165	V	98.4	Very high	96.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-45.7	170.7	174.8	0	0	0	0	110.3	L149 M153 V161 A162 C168 Q169 V363	L149-V165 HydrophobicContact CD2-CG1 4.09Å; L149-V165 HydrophobicContact CG-CG1 4.17Å; M153-V165 HydrophobicContact CG-CB 4.23Å; M153-V165 HydrophobicContact CG-CG1 4Å; M153-V165 HydrophobicContact CG-CG2 4.15Å; V161-V165 HydrophobicContact CG1-CG2 4.19Å; V161-V165 WeakPolarHBondContact O-CG2 3.36Å; V161-V165 PolarHBondContact O-N 3.29Å; A162-V165 PolarHBondContact O-N 2.85Å; V165-C168 PolarHBondContact O-N 3.04Å; V165-Q169 WeakPolarHBondContact O-CB 3.35Å; V165-Q169 PolarHBondContact O-N 3.18Å; V165-V363 HydrophobicContact CG1-CG2 4.23Å
166	F	98.3	Very high	96.9	Very high	19 Å²	19	31.3 Å²	31.3	8%	0.083	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-43	178.1	-175.1	-113.8	0	0	0	112.1	L54 T58 D146 Y150 A162 R163 W164 Q169 L170	L54-F166 HydrophobicContact CD2-CZ 4.45Å; T58-F166 HydrophobicContact CG2-CE2 4.28Å; T58-F166 HydrophobicContact CG2-CZ 4.2Å; T58-F166 VanDerWaalsContact OG1-CZ 3.32Å; T58-F166 WeakPolarHBondContact OG1-CZ 3.25Å; D146-F166 HydrophobicContact CB-CE2 4.03Å; Y150-F166 HydrophobicContact CD2-CB 3.84Å; Y150-F166 HydrophobicContact CD2-CG 4.16Å; Y150-F166 HydrophobicContact CG-CB 4.46Å; Y150-F166 HydrophobicContact CG-CD2 4.49Å; Y150-F166 HydrophobicContact CG-CG 4.46Å; A162-F166 VanDerWaalsContact O-CB 3.24Å; A162-F166 WeakPolarHBondContact O-CB 3.49Å; A162-F166 PolarHBondContact O-N 2.5Å; R163-F166 PolarHBondContact O-N 3.16Å; W164-F166 VanDerWaalsContact C-N 3.31Å; F166-Q169 PolarHBondContact O-N 3.03Å; F166-L170 HydrophobicContact CD1-CD1 3.89Å; F166-L170 HydrophobicContact CD1-CG 4.39Å; F166-L170 HydrophobicContact CD2-CD1 4.47Å; F166-L170 HydrophobicContact CD2-CG 4.28Å; F166-L170 HydrophobicContact CE1-CD1 3.33Å; F166-L170 HydrophobicContact CE1-CG 4.14Å; F166-L170 HydrophobicContact CE2-CD1 3.99Å; F166-L170 HydrophobicContact CE2-CD2 4.06Å; F166-L170 HydrophobicContact CE2-CG 4.02Å; F166-L170 HydrophobicContact CG-CD1 4.43Å; F166-L170 HydrophobicContact CG-CG 4.47Å; F166-L170 HydrophobicContact CZ-CD1 3.39Å; F166-L170 HydrophobicContact CZ-CD2 4.17Å; F166-L170 HydrophobicContact CZ-CG 3.94Å; F166-L170 WeakPolarHBondContact O-CB 3.21Å; F166-L170 VanDerWaalsContact O-CG 3.31Å; F166-L170 WeakPolarHBondContact O-CG 3.42Å; F166-L170 PolarHBondContact O-N 3.42Å
167	F	98.3	Very high	97.1	Very high	50 Å²	50	31 Å²	31	22%	0.219	14%	0.138	C	C	.	.	H	α-helix	trans	-56.4	-51.5	172.9	172	-95.6	0	0	0	111.7	R163 W164 Q169 L170 C171 L369 L380 L383 F384	R163-F167 WeakPolarHBondContact O-CB 3.21Å; R163-F167 PolarHBondContact O-N 2.64Å; W164-F167 HydrophobicContact CE3-CB 4.37Å; W164-F167 PolarHBondContact O-N 2.96Å; F167-Q169 VanDerWaalsContact C-N 3.32Å; F167-Q169 PolarHBondContact O-N 2.88Å; F167-L170 PolarHBondContact O-N 3.09Å; F167-C171 HydrophobicContact CZ-CB 4.44Å; F167-C171 WeakPolarHBondContact O-CB 3.46Å; F167-C171 PolarHBondContact O-N 3.47Å; F167-C171 PolarHBondContact O-SG 2.74Å; F167-L369 HydrophobicContact CD1-CD1 4.03Å; F167-L369 HydrophobicContact CE1-CD1 4.42Å; F167-L380 HydrophobicContact CD1-CD2 3.7Å; F167-L380 HydrophobicContact CE1-CD2 3.42Å; F167-L380 VanDerWaalsContact CE1-CD2 3.42Å; F167-L380 HydrophobicContact CG-CD2 4.39Å; F167-L380 HydrophobicContact CZ-CB 4.33Å; F167-L380 HydrophobicContact CZ-CD2 3.89Å; F167-L383 HydrophobicContact CE1-CB 4.34Å; F167-L383 HydrophobicContact CE1-CD1 4.48Å; F167-F384 HydrophobicContact CZ-CB 4.17Å
168	C	98.4	Very high	97.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59	-42.3	178.2	-72.8	0	0	0	0	112.6	W164 V165 S172 M362 C365 L369	W164-C168 PolarHBondContact O-N 2.93Å; W164-C168 PolarHBondContact O-SG 3Å; V165-C168 PolarHBondContact O-N 3.04Å; C168-S172 WeakPolarHBondContact O-CB 3.15Å; C168-S172 PolarHBondContact O-N 2.81Å; C168-M362 HydrophobicContact CB-CB 4.24Å; C168-M362 HydrophobicContact CB-CG 4.45Å; C168-M362 HydrophobicContact CB-SD 3.73Å; C168-C365 HydrophobicContact CB-CB 4.06Å; C168-C365 VanDerWaalsContact SG-CB 3.59Å; C168-L369 WeakPolarHBondContact SG-CD1 3.35Å
169	Q	98.2	Very high	97.3	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-64.9	-42.2	178	175.8	63.5	11.6	0	0	112.5	D146 L149 V165 F166 F167 T175 M362	D146-Q169 WeakPolarHBondContact OD1-CG 3.37Å; D146-Q169 PolarHBondContact OD1-NE2 3.29Å; L149-Q169 HydrophobicContact CD2-CB 4.06Å; L149-Q169 HydrophobicContact CD2-CG 3.87Å; V165-Q169 WeakPolarHBondContact O-CB 3.35Å; V165-Q169 PolarHBondContact O-N 3.18Å; F166-Q169 PolarHBondContact O-N 3.03Å; F167-Q169 VanDerWaalsContact C-N 3.32Å; F167-Q169 PolarHBondContact O-N 2.88Å; Q169-T175 WeakPolarHBondContact O-CG2 3.42Å; Q169-M362 HydrophobicContact CB-CB 4.36Å; Q169-M362 HydrophobicContact CB-CG 4.36Å
170	L	97.6	Very high	97.4	Very high	14 Å²	14	20.3 Å²	20.3	7%	0.073	9%	0.085	C	C	.	.	H	α-helix	trans	-73	-36.2	179.3	-69.1	-170.2	0	0	0	112.7	F57 T58 L61 D146 F166 F167	F57-L170 HydrophobicContact CE1-CD1 3.77Å; T58-L170 HydrophobicContact CG2-CD2 4.39Å; L61-L170 HydrophobicContact CD2-CB 4.07Å; L61-L170 HydrophobicContact CD2-CD1 3.7Å; L61-L170 HydrophobicContact CD2-CD2 3.96Å; L61-L170 HydrophobicContact CD2-CG 4.12Å; D146-L170 HydrophobicContact CB-CD2 4.3Å; F166-L170 HydrophobicContact CD1-CD1 3.89Å; F166-L170 HydrophobicContact CD1-CG 4.39Å; F166-L170 HydrophobicContact CD2-CD1 4.47Å; F166-L170 HydrophobicContact CD2-CG 4.28Å; F166-L170 HydrophobicContact CE1-CD1 3.33Å; F166-L170 HydrophobicContact CE1-CG 4.14Å; F166-L170 HydrophobicContact CE2-CD1 3.99Å; F166-L170 HydrophobicContact CE2-CD2 4.06Å; F166-L170 HydrophobicContact CE2-CG 4.02Å; F166-L170 HydrophobicContact CG-CD1 4.43Å; F166-L170 HydrophobicContact CG-CG 4.47Å; F166-L170 HydrophobicContact CZ-CD1 3.39Å; F166-L170 HydrophobicContact CZ-CD2 4.17Å; F166-L170 HydrophobicContact CZ-CG 3.94Å; F166-L170 WeakPolarHBondContact O-CB 3.21Å; F166-L170 VanDerWaalsContact O-CG 3.31Å; F166-L170 WeakPolarHBondContact O-CG 3.42Å; F166-L170 PolarHBondContact O-N 3.42Å; F167-L170 PolarHBondContact O-N 3.09Å
171	C	96.1	Very high	97.4	Very high	7 Å²	7	16.2 Å²	16.2	5%	0.047	7%	0.066	C	C	.	.	H	α-helix	trans	-87.1	-15.2	-177.1	77	0	0	0	0	113.8	F167 W173 H314 N387	F167-C171 HydrophobicContact CZ-CB 4.44Å; F167-C171 WeakPolarHBondContact O-CB 3.46Å; F167-C171 PolarHBondContact O-N 3.47Å; F167-C171 PolarHBondContact O-SG 2.74Å; C171-W173 PolarHBondContact O-N 3.35Å; C171-H314 VanDerWaalsContact SG-CE1 3.55Å; C171-H314 PolarHBondContact SG-NE2 3.02Å; C171-H314 VanDerWaalsContact SG-NE2 3.36Å; C171-N387 WeakPolarHBondContact O-CB 3.45Å
172	S	98	Very high	97.4	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.065	C	C	.	.			trans	-53.4	121.7	176	171.6	0	0	0	0	111.7	C168 F174 T175 W176	C168-S172 WeakPolarHBondContact O-CB 3.15Å; C168-S172 PolarHBondContact O-N 2.81Å; S172-F174 VanDerWaalsContact C-N 3.27Å; S172-F174 PolarHBondContact O-N 3.42Å; S172-T175 PolarHBondContact O-N 3.06Å; S172-T175 PolarHBondContact OG-N 3.34Å; S172-W176 PolarHBondContact O-N 3.33Å
173	W	97.7	Very high	97.3	Very high	22 Å²	22	16 Å²	16	8%	0.083	7%	0.065	C	C	.	.	H	α-helix	trans	-59.4	-39.6	-178.1	79	-87.6	0	0	0	111.7	C171 W176 Y177 V309 I310 N387 L390 A391 T394	C171-W173 PolarHBondContact O-N 3.35Å; W173-W176 WeakPolarHBondContact O-CB 3.34Å; W173-W176 PolarHBondContact O-N 3.3Å; W173-Y177 HydrophobicContact CZ3-CD1 4.39Å; W173-Y177 VanDerWaalsContact O-CB 3.29Å; W173-Y177 WeakPolarHBondContact O-CB 3.19Å; W173-Y177 PolarHBondContact O-N 3.09Å; W173-V309 HydrophobicContact CH2-CG1 4.39Å; W173-V309 HydrophobicContact CZ2-CG1 3.89Å; W173-V309 VanDerWaalsContact CZ2-O 3.31Å; W173-V309 WeakPolarHBondContact CZ2-O 2.82Å; W173-V309 PolarHBondContact NE1-O 3.49Å; W173-I310 PolarHBondContact NE1-O 3.23Å; W173-N387 HydrophobicContact CB-CB 3.95Å; W173-N387 PolarHBondContact N-OD1 3.04Å; W173-L390 HydrophobicContact CB-CB 4.34Å; W173-L390 HydrophobicContact CB-CD2 4.23Å; W173-L390 HydrophobicContact CB-CG 4.32Å; W173-L390 HydrophobicContact CD2-CD2 3.54Å; W173-L390 HydrophobicContact CD2-CG 3.95Å; W173-L390 HydrophobicContact CE3-CD2 4.03Å; W173-L390 HydrophobicContact CE3-CG 3.98Å; W173-L390 HydrophobicContact CG-CD2 3.62Å; W173-L390 HydrophobicContact CG-CG 4.11Å; W173-L390 HydrophobicContact CZ2-CD2 4.45Å; W173-A391 HydrophobicContact CB-CB 4.28Å; W173-T394 HydrophobicContact CE3-CG2 4.5Å; W173-T394 HydrophobicContact CZ3-CG2 4.14Å
174	F	97.8	Very high	97.2	Very high	2 Å²	2	9.7 Å²	9.7	1%	0.009	4%	0.042	C	C	.	.	H	α-helix	trans	-73.3	-38.8	-177.5	-165.3	-105.9	0	0	0	112	F73 S172 W176 Y177 C178 I310 F351 Y355 L358	F73-F174 HydrophobicContact CZ-CE2 4.22Å; F73-F174 HydrophobicContact CZ-CZ 4.45Å; S172-F174 VanDerWaalsContact C-N 3.27Å; S172-F174 PolarHBondContact O-N 3.42Å; F174-W176 VanDerWaalsContact C-N 3.33Å; F174-Y177 PolarHBondContact O-N 3.42Å; F174-C178 WeakPolarHBondContact O-CB 3.33Å; F174-C178 PolarHBondContact O-N 3.17Å; F174-C178 PolarHBondContact O-SG 3.32Å; F174-C178 VanDerWaalsContact O-SG 3.4Å; F174-I310 HydrophobicContact CB-CG2 4.02Å; F174-I310 HydrophobicContact CD1-CB 4.46Å; F174-I310 HydrophobicContact CD1-CD1 4.49Å; F174-I310 HydrophobicContact CD1-CG1 4.25Å; F174-I310 HydrophobicContact CD1-CG2 3.57Å; F174-I310 HydrophobicContact CD2-CG1 4.19Å; F174-I310 HydrophobicContact CE1-CD1 4.07Å; F174-I310 HydrophobicContact CE1-CG1 4.21Å; F174-I310 HydrophobicContact CE1-CG2 4.14Å; F174-I310 HydrophobicContact CE2-CG1 4.17Å; F174-I310 HydrophobicContact CG-CB 4.4Å; F174-I310 HydrophobicContact CG-CG1 4.22Å; F174-I310 HydrophobicContact CG-CG2 3.82Å; F174-I310 HydrophobicContact CZ-CD1 4.13Å; F174-I310 HydrophobicContact CZ-CG1 4.18Å; F174-F351 HydrophobicContact CE2-CB 4.12Å; F174-F351 HydrophobicContact CZ-CB 4.06Å; F174-Y355 AromaticContact CD1-CD2 3.69Å; F174-Y355 HydrophobicContact CD1-CD2 3.69Å; F174-Y355 HydrophobicContact CD1-CE2 4.18Å; F174-Y355 HydrophobicContact CD1-CG 4.35Å; F174-Y355 AromaticContact CE1-CD2 3.76Å; F174-Y355 HydrophobicContact CE1-CD2 3.76Å; F174-Y355 AromaticContact CE1-CG 3.95Å; F174-Y355 HydrophobicContact CE1-CG 3.95Å; F174-L358 HydrophobicContact CB-CD2 4.16Å; F174-L358 HydrophobicContact CD1-CD2 3.98Å
175	T	97.5	Very high	97.2	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-60.9	-45.7	170.1	-65.4	0	0	0	0	110.3	R62 Q169 S172 Y177 C178 C179	R62-T175 VanDerWaalsContact NH2-CG2 3.3Å; Q169-T175 WeakPolarHBondContact O-CG2 3.42Å; S172-T175 PolarHBondContact O-N 3.06Å; S172-T175 PolarHBondContact OG-N 3.34Å; T175-Y177 VanDerWaalsContact C-N 3.3Å; T175-Y177 PolarHBondContact O-N 2.8Å; T175-C178 PolarHBondContact O-N 3.49Å; T175-C179 HydrophobicContact CG2-CB 4.33Å; T175-C179 WeakPolarHBondContact O-CB 3.47Å; T175-C179 PolarHBondContact O-N 2.94Å; T175-C179 PolarHBondContact O-SG 3.47Å
176	W	96.4	Very high	97.1	Very high	15 Å²	15	7.2 Å²	7.2	6%	0.057	3%	0.033	C	C	.	.	H	α-helix	trans	-56	-47.5	176.2	-165.5	-52.4	0	0	0	111.5	N65 L68 S172 W173 F174 F388 A391	N65-W176 VanDerWaalsContact OD1-CZ2 3.31Å; N65-W176 WeakPolarHBondContact OD1-CZ2 3.23Å; N65-W176 PolarHBondContact OD1-NE1 2.98Å; L68-W176 HydrophobicContact CD1-CZ2 3.72Å; S172-W176 PolarHBondContact O-N 3.33Å; W173-W176 WeakPolarHBondContact O-CB 3.34Å; W173-W176 PolarHBondContact O-N 3.3Å; F174-W176 VanDerWaalsContact C-N 3.33Å; W176-F388 AromaticContact CH2-CD2 3.84Å; W176-F388 HydrophobicContact CH2-CD2 3.84Å; W176-F388 AromaticContact CH2-CE2 3.98Å; W176-F388 HydrophobicContact CH2-CE2 3.98Å; W176-F388 HydrophobicContact CZ3-CD2 4.15Å; W176-A391 HydrophobicContact CB-CB 3.99Å; W176-A391 HydrophobicContact CD2-CB 4.02Å; W176-A391 HydrophobicContact CE3-CB 4.45Å; W176-A391 HydrophobicContact CG-CB 3.82Å
177	Y	96.9	Very high	97	Very high	7 Å²	7	7 Å²	7	3%	0.027	3%	0.032	C	C	.	.	H	α-helix	trans	-67.4	-34	-177.1	-175.3	-121	0	0	0	113.7	S72 F73 W173 F174 T175 R181 T394	S72-Y177 PolarHBondContact O-OH 3.21Å; S72-Y177 VanDerWaalsContact O-OH 3.08Å; F73-Y177 WeakPolarHBondContact CA-OH 3.4Å; F73-Y177 HydrophobicContact CB-CE1 3.92Å; F73-Y177 VanDerWaalsContact CB-OH 3.26Å; F73-Y177 WeakPolarHBondContact CB-OH 3.31Å; F73-Y177 HydrophobicContact CD1-CD1 4.41Å; F73-Y177 AromaticContact CD1-CE1 3.78Å; F73-Y177 HydrophobicContact CD1-CE1 3.78Å; F73-Y177 AromaticContact CD2-CE1 3.5Å; F73-Y177 HydrophobicContact CD2-CE1 3.5Å; F73-Y177 AromaticContact CD2-CZ 3.93Å; F73-Y177 WeakPolarHBondContact CD2-OH 3.29Å; F73-Y177 HydrophobicContact CE1-CE1 4.15Å; F73-Y177 AromaticContact CE2-CE1 3.9Å; F73-Y177 HydrophobicContact CE2-CE1 3.9Å; F73-Y177 HydrophobicContact CG-CD1 4.47Å; F73-Y177 AromaticContact CG-CE1 3.46Å; F73-Y177 HydrophobicContact CG-CE1 3.46Å; F73-Y177 VanDerWaalsContact CG-CE1 3.46Å; F73-Y177 AromaticContact CG-CZ 3.83Å; F73-Y177 HydrophobicContact CZ-CE1 4.21Å; W173-Y177 HydrophobicContact CZ3-CD1 4.39Å; W173-Y177 VanDerWaalsContact O-CB 3.29Å; W173-Y177 WeakPolarHBondContact O-CB 3.19Å; W173-Y177 PolarHBondContact O-N 3.09Å; F174-Y177 PolarHBondContact O-N 3.42Å; T175-Y177 VanDerWaalsContact C-N 3.3Å; T175-Y177 PolarHBondContact O-N 2.8Å; Y177-R181 WeakPolarHBondContact O-CD 3.32Å; Y177-R181 PolarHBondContact O-NE 3.46Å; Y177-T394 VanDerWaalsContact CE2-O 3.27Å; Y177-T394 WeakPolarHBondContact CE2-O 3.44Å
178	C	97.4	Very high	97	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-100.3	-28.6	-174.2	-62.4	0	0	0	0	114.9	F174 T175 T180 R181 T186 Y355	F174-C178 WeakPolarHBondContact O-CB 3.33Å; F174-C178 PolarHBondContact O-N 3.17Å; F174-C178 PolarHBondContact O-SG 3.32Å; F174-C178 VanDerWaalsContact O-SG 3.4Å; T175-C178 PolarHBondContact O-N 3.49Å; C178-T180 PolarHBondContact O-N 3.39Å; C178-R181 WeakPolarHBondContact O-CB 3.41Å; C178-R181 PolarHBondContact O-N 3.49Å; C178-T186 WeakPolarHBondContact O-CG2 3.47Å; C178-T186 PolarHBondContact O-OG1 2.92Å; C178-Y355 HydrophobicContact CB-CD1 4.21Å; C178-Y355 HydrophobicContact CB-CE1 3.76Å
179	C	96	Very high	96.9	Very high	1 Å²	1	4.7 Å²	4.7	1%	0.007	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.2	-165.7	64	0	0	0	0	115.8	S142 T175	S142-C179 WeakPolarHBondContact CB-O 3.37Å; S142-C179 PolarHBondContact OG-O 3.01Å; T175-C179 HydrophobicContact CG2-CB 4.33Å; T175-C179 WeakPolarHBondContact O-CB 3.47Å; T175-C179 PolarHBondContact O-N 2.94Å; T175-C179 PolarHBondContact O-SG 3.47Å
180	T	96.3	Very high	96.9	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-5.9	179.2	65.2	0	0	0	0	113.2	R62 N65 C66 A139 C178	R62-T180 WeakPolarHBondContact O-CG2 3.08Å; N65-T180 HydrophobicContact CB-CG2 3.88Å; C66-T180 HydrophobicContact CB-CG2 4.08Å; A139-T180 HydrophobicContact CB-CG2 3.84Å; C178-T180 PolarHBondContact O-N 3.39Å
181	R	96.9	Very high	97	Very high	1 Å²	1	4.5 Å²	4.5	0%	0.004	2%	0.022	C	C	.	.	S	Bend	trans	-80.5	139.4	178.3	-61.6	-175.4	178.4	-85.3	-3.3	109.9	V69 T71 E77 Q138 Y177 C178 L183	V69-R181 VanDerWaalsContact CG1-NH2 3.34Å; T71-R181 VanDerWaalsContact O-CZ 3.32Å; T71-R181 PolarHBondContact O-NH1 2.86Å; T71-R181 PolarHBondContact O-NH2 2.99Å; T71-R181 PolarHBondContact OG1-NH2 2.91Å; T71-R181 VanDerWaalsContact OG1-NH2 3.12Å; E77-R181 HydrophobicContact CG-CB 4.33Å; E77-R181 WeakPolarHBondContact OE1-CB 3.49Å; E77-R181 WeakPolarHBondContact OE1-CG 3.4Å; E77-R181 IonicContact OE1-NH1 3.07Å; E77-R181 WeakPolarHBondContact OE2-CD 3.43Å; E77-R181 IonicContact OE2-CZ 3.7Å; E77-R181 IonicContact OE2-NE 3.97Å; E77-R181 IonicContact OE2-NH1 2.6Å; E77-R181 PolarHBondContact OE2-NH1 3.29Å; Q138-R181 WeakPolarHBondContact CG-O 3.45Å; Y177-R181 WeakPolarHBondContact O-CD 3.32Å; Y177-R181 PolarHBondContact O-NE 3.46Å; C178-R181 WeakPolarHBondContact O-CB 3.41Å; C178-R181 PolarHBondContact O-N 3.49Å; R181-L183 HydrophobicContact CB-CD1 3.98Å; R181-L183 HydrophobicContact CB-CG 4.03Å; R181-L183 PolarHBondContact O-N 2.88Å
182	T	96.3	Very high	97.1	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.019	C	C	.	.			trans	-81.4	51.7	-177.5	58.7	0	0	0	0	112.1	E77 S81 L82 Y108 F112 P134 R135 Q138	E77-T182 PolarHBondContact O-OG1 3.37Å; E77-T182 VanDerWaalsContact O-OG1 3.05Å; S81-T182 WeakPolarHBondContact CB-O 3.11Å; S81-T182 PolarHBondContact OG-O 2.82Å; S81-T182 PolarHBondContact OG-OG1 2.73Å; L82-T182 HydrophobicContact CD2-CG2 4.2Å; L82-T182 WeakPolarHBondContact CG-OG1 3.27Å; Y108-T182 VanDerWaalsContact OH-C 3.26Å; Y108-T182 PolarHBondContact OH-O 3.2Å; F112-T182 HydrophobicContact CE1-CG2 3.79Å; F112-T182 HydrophobicContact CE2-CG2 4.33Å; F112-T182 HydrophobicContact CZ-CG2 3.61Å; P134-T182 HydrophobicContact CB-CG2 4.03Å; R135-T182 HydrophobicContact CG-CG2 4.45Å; Q138-T182 HydrophobicContact CB-CG2 4.46Å
183	L	95.9	Very high	97.1	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.02	C	C	.	.			trans	-91.5	140.7	178.7	-68.5	169.9	0	0	0	111	F73 V74 D76 E77 Y108 R181 N185 T186 M187	F73-L183 HydrophobicContact CD1-CD1 4.13Å; V74-L183 HydrophobicContact CG2-CD1 4.17Å; V74-L183 HydrophobicContact CG2-CD2 3.64Å; D76-L183 HydrophobicContact CB-CD2 4.37Å; E77-L183 HydrophobicContact CB-CD2 3.85Å; E77-L183 HydrophobicContact CB-CG 4.36Å; Y108-L183 PolarHBondContact OH-O 3.35Å; R181-L183 HydrophobicContact CB-CD1 3.98Å; R181-L183 HydrophobicContact CB-CG 4.03Å; R181-L183 PolarHBondContact O-N 2.88Å; L183-N185 PolarHBondContact O-N 3.06Å; L183-T186 WeakPolarHBondContact O-CB 3.37Å; L183-T186 PolarHBondContact O-N 3.34Å; L183-M187 PolarHBondContact O-N 3.42Å; L183-M187 VanDerWaalsContact O-N 3.1Å
184	T	95.4	Very high	97.1	Very high	10 Å²	10	4.6 Å²	4.6	6%	0.061	2%	0.023	C	C	.	.	H	α-helix	trans	-57.7	-36.2	170.4	52.8	0	0	0	0	111.7	Y108 T186 M187 E188 I222 R223	Y108-T184 HydrophobicContact CD1-CG2 3.43Å; Y108-T184 VanDerWaalsContact CD1-CG2 3.43Å; Y108-T184 HydrophobicContact CE1-CG2 3.81Å; Y108-T184 HydrophobicContact CG-CG2 4.06Å; T184-T186 VanDerWaalsContact C-N 3.34Å; T184-T186 PolarHBondContact O-N 3.46Å; T184-M187 PolarHBondContact O-N 3.28Å; T184-E188 WeakPolarHBondContact O-CB 3.5Å; T184-E188 PolarHBondContact O-N 3.29Å; T184-I222 HydrophobicContact CG2-CG2 4.16Å; T184-R223 PolarHBondContact OG1-NH1 3.45Å
185	N	96.3	Very high	97.1	Very high	1 Å²	1	4.5 Å²	4.5	1%	0.005	2%	0.022	C	C	.	.	H	α-helix	trans	-65.6	-33.7	174.2	-65.4	106.7	0	0	0	113.1	L183 E188 T189 R223 R352	L183-N185 PolarHBondContact O-N 3.06Å; N185-E188 PolarHBondContact ND2-OE2 3.12Å; N185-E188 PolarHBondContact O-N 2.92Å; N185-T189 PolarHBondContact O-N 3.31Å; N185-T189 PolarHBondContact O-OG1 3.19Å; N185-R223 VanDerWaalsContact ND2-CZ 3.29Å; N185-R223 PolarHBondContact ND2-NE 3.43Å; N185-R223 VanDerWaalsContact ND2-NE 3.12Å; N185-R223 PolarHBondContact OD1-NH1 3.37Å; N185-R352 HydrophobicContact CB-CB 4.34Å; N185-R352 WeakPolarHBondContact OD1-CD 3.37Å
186	T	97.1	Very high	97.1	Very high	1 Å²	1	4.5 Å²	4.5	1%	0.006	2%	0.023	C	C	.	.	H	α-helix	trans	-66.8	-42.9	174.3	-60.4	0	0	0	0	110.2	Q138 C178 L183 T184 T189 V190 Y355	Q138-T186 HydrophobicContact CG-CG2 4.04Å; C178-T186 WeakPolarHBondContact O-CG2 3.47Å; C178-T186 PolarHBondContact O-OG1 2.92Å; L183-T186 WeakPolarHBondContact O-CB 3.37Å; L183-T186 PolarHBondContact O-N 3.34Å; T184-T186 VanDerWaalsContact C-N 3.34Å; T184-T186 PolarHBondContact O-N 3.46Å; T186-T189 PolarHBondContact O-N 3.05Å; T186-V190 WeakPolarHBondContact O-CG2 3.08Å; T186-V190 PolarHBondContact O-N 3.03Å; T186-Y355 HydrophobicContact CG2-CE1 4.34Å
187	M	96.9	Very high	97.1	Very high	14 Å²	14	4.2 Å²	4.2	7%	0.069	2%	0.022	C	C	.	.	H	α-helix	trans	-64.8	-40.4	175.3	-169.6	59.9	178.4	0	0	112.4	Y108 L141 L183 T184 T189 V190 L191 I222	Y108-M187 HydrophobicContact CD2-CB 4.24Å; Y108-M187 HydrophobicContact CD2-CG 4.1Å; Y108-M187 HydrophobicContact CE2-CB 3.56Å; Y108-M187 HydrophobicContact CE2-CG 3.71Å; Y108-M187 HydrophobicContact CE2-SD 4.47Å; L141-M187 HydrophobicContact CD1-CE 4.39Å; L141-M187 HydrophobicContact CD1-SD 4.09Å; L183-M187 PolarHBondContact O-N 3.42Å; L183-M187 VanDerWaalsContact O-N 3.1Å; T184-M187 PolarHBondContact O-N 3.28Å; M187-T189 PolarHBondContact O-N 3.2Å; M187-V190 PolarHBondContact O-N 2.87Å; M187-L191 HydrophobicContact CE-CD1 4.05Å; M187-L191 HydrophobicContact CE-CD2 4.01Å; M187-L191 HydrophobicContact CE-CG 3.98Å; M187-L191 HydrophobicContact CG-CD1 4.13Å; M187-L191 HydrophobicContact CG-CG 4.41Å; M187-L191 WeakPolarHBondContact O-CB 3.28Å; M187-L191 WeakPolarHBondContact O-CG 3.41Å; M187-L191 PolarHBondContact O-N 2.88Å; M187-L191 HydrophobicContact SD-CG 4.44Å; M187-I222 HydrophobicContact CE-CD1 4.39Å; M187-I222 HydrophobicContact CG-CD1 3.89Å
188	E	96.9	Very high	97.1	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-57.4	-45.9	173.1	-177.8	-176.7	-154.8	0	0	111.4	T184 N185 T192 R223 T225 A226 P356	T184-E188 WeakPolarHBondContact O-CB 3.5Å; T184-E188 PolarHBondContact O-N 3.29Å; N185-E188 PolarHBondContact ND2-OE2 3.12Å; N185-E188 PolarHBondContact O-N 2.92Å; E188-T192 WeakPolarHBondContact O-CB 3.44Å; E188-T192 PolarHBondContact O-N 3.23Å; E188-T192 PolarHBondContact O-OG1 3.26Å; E188-R223 WeakPolarHBondContact OE2-CD 3.37Å; E188-R223 IonicContact OE2-NE 2.64Å; E188-T225 PolarHBondContact OE1-OG1 3.06Å; E188-A226 HydrophobicContact CG-CB 3.99Å; E188-A226 WeakPolarHBondContact OE1-CA 3.42Å; E188-A226 PolarHBondContact OE1-N 3.1Å; E188-A226 VanDerWaalsContact OE1-N 3.08Å; E188-P356 HydrophobicContact CB-CG 4.21Å; E188-P356 HydrophobicContact CG-CB 4.15Å; E188-P356 HydrophobicContact CG-CG 3.57Å; E188-P356 VanDerWaalsContact OE2-CG 3.27Å; E188-P356 WeakPolarHBondContact OE2-CG 3.42Å
189	T	98.1	Very high	97.1	Very high	2 Å²	2	6 Å²	6	1%	0.012	3%	0.028	C	C	.	.	H	α-helix	trans	-62.1	-47.1	174.7	-58.8	0	0	0	0	111.7	N185 T186 M187 T192 I193 Y355 P356 P359	N185-T189 PolarHBondContact O-N 3.31Å; N185-T189 PolarHBondContact O-OG1 3.19Å; T186-T189 PolarHBondContact O-N 3.05Å; M187-T189 PolarHBondContact O-N 3.2Å; T189-T192 PolarHBondContact O-N 3.19Å; T189-I193 HydrophobicContact CG2-CD1 4.01Å; T189-I193 WeakPolarHBondContact O-CG1 3.32Å; T189-I193 PolarHBondContact O-N 3.25Å; T189-Y355 HydrophobicContact CG2-CD1 4.24Å; T189-Y355 HydrophobicContact CG2-CE1 4.01Å; T189-Y355 HydrophobicContact CG2-CE2 4.33Å; T189-Y355 HydrophobicContact CG2-CG 4.49Å; T189-Y355 WeakPolarHBondContact OG1-CD1 3.49Å; T189-P356 VanDerWaalsContact OG1-CA 3.26Å; T189-P356 WeakPolarHBondContact OG1-CA 3.34Å; T189-P359 HydrophobicContact CG2-CG 3.79Å
190	V	98.3	Very high	96.9	Very high	4 Å²	4	6.5 Å²	6.5	2%	0.024	3%	0.032	C	C	.	.	H	α-helix	trans	-59.2	-51.3	178.7	164.5	0	0	0	0	111.3	L141 A145 T186 M187 T192 I193 I194	L141-V190 HydrophobicContact CB-CG1 4.17Å; A145-V190 HydrophobicContact CB-CB 4.33Å; A145-V190 HydrophobicContact CB-CG1 4.13Å; A145-V190 HydrophobicContact CB-CG2 4.15Å; T186-V190 WeakPolarHBondContact O-CG2 3.08Å; T186-V190 PolarHBondContact O-N 3.03Å; M187-V190 PolarHBondContact O-N 2.87Å; V190-T192 VanDerWaalsContact C-N 3.28Å; V190-T192 PolarHBondContact O-N 3.39Å; V190-I193 PolarHBondContact O-N 3.4Å; V190-I194 HydrophobicContact CG1-CD1 3.74Å; V190-I194 VanDerWaalsContact O-CG1 3.32Å; V190-I194 WeakPolarHBondContact O-CG1 3.33Å; V190-I194 PolarHBondContact O-N 3.5Å
191	L	98.3	Very high	96.7	Very high	8 Å²	8	7 Å²	7	4%	0.042	4%	0.035	C	C	.	.	H	α-helix	trans	-62.2	-38.6	178.7	-70.6	175	0	0	0	111.2	M187 I194 A195 L215 L218 A219 I222	M187-L191 HydrophobicContact CE-CD1 4.05Å; M187-L191 HydrophobicContact CE-CD2 4.01Å; M187-L191 HydrophobicContact CE-CG 3.98Å; M187-L191 HydrophobicContact CG-CD1 4.13Å; M187-L191 HydrophobicContact CG-CG 4.41Å; M187-L191 WeakPolarHBondContact O-CB 3.28Å; M187-L191 WeakPolarHBondContact O-CG 3.41Å; M187-L191 PolarHBondContact O-N 2.88Å; M187-L191 HydrophobicContact SD-CG 4.44Å; L191-I194 PolarHBondContact O-N 2.93Å; L191-A195 WeakPolarHBondContact O-CB 3.21Å; L191-A195 PolarHBondContact O-N 3.21Å; L191-L215 HydrophobicContact CD2-CD2 3.79Å; L191-L218 HydrophobicContact CD1-CB 4.44Å; L191-L218 HydrophobicContact CD1-CD2 4.19Å; L191-L218 HydrophobicContact CD1-CG 4Å; L191-L218 HydrophobicContact CD2-CD2 4.05Å; L191-A219 HydrophobicContact CB-CB 4Å; L191-A219 HydrophobicContact CD1-CB 3.81Å; L191-I222 HydrophobicContact CD1-CD1 3.98Å
192	T	98.2	Very high	96.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.4	-44.9	177	-66.2	0	0	0	0	111.9	E188 T189 V190 A195 L196 W230 F360	E188-T192 WeakPolarHBondContact O-CB 3.44Å; E188-T192 PolarHBondContact O-N 3.23Å; E188-T192 PolarHBondContact O-OG1 3.26Å; T189-T192 PolarHBondContact O-N 3.19Å; V190-T192 VanDerWaalsContact C-N 3.28Å; V190-T192 PolarHBondContact O-N 3.39Å; T192-A195 PolarHBondContact O-N 3.44Å; T192-L196 VanDerWaalsContact O-CB 3.31Å; T192-L196 WeakPolarHBondContact O-CB 3.43Å; T192-L196 PolarHBondContact O-N 3.27Å; T192-W230 HydrophobicContact CG2-CZ2 4.14Å; T192-W230 PolarHBondContact OG1-NE1 3.27Å; T192-F360 HydrophobicContact CG2-CE1 3.97Å; T192-F360 HydrophobicContact CG2-CZ 3.59Å
193	I	98.2	Very high	95.5	Very high	4 Å²	4	14 Å²	14	2%	0.021	8%	0.081	C	C	.	.	H	α-helix	trans	-66.1	-45.1	178.2	-64.1	165.5	0	0	0	111.1	A145 L149 T189 V190 A195 L196 F197 P359	A145-I193 HydrophobicContact CB-CB 4.1Å; A145-I193 HydrophobicContact CB-CD1 3.95Å; A145-I193 HydrophobicContact CB-CG2 4.15Å; A145-I193 WeakPolarHBondContact O-CG2 3.46Å; L149-I193 HydrophobicContact CB-CG2 3.82Å; T189-I193 HydrophobicContact CG2-CD1 4.01Å; T189-I193 WeakPolarHBondContact O-CG1 3.32Å; T189-I193 PolarHBondContact O-N 3.25Å; V190-I193 PolarHBondContact O-N 3.4Å; I193-A195 VanDerWaalsContact C-N 3.34Å; I193-L196 PolarHBondContact O-N 3.2Å; I193-F197 PolarHBondContact O-N 3.49Å; I193-F197 VanDerWaalsContact O-N 3.16Å; I193-P359 HydrophobicContact CD1-CB 3.92Å; I193-P359 HydrophobicContact CD1-CG 3.49Å; I193-P359 VanDerWaalsContact CD1-CG 3.49Å; I193-P359 HydrophobicContact CG1-CB 3.83Å; I193-P359 HydrophobicContact CG1-CG 3.65Å
194	I	98.3	Very high	95.2	Very high	26 Å²	26	15 Å²	15	13%	0.133	9%	0.087	C	C	.	.	H	α-helix	trans	-66.5	-39.5	-179.9	-61	171.1	0	0	0	110.3	V144 A145 R148 V190 L191 F197 Y198 L215	V144-I194 HydrophobicContact CG1-CD1 4.24Å; A145-I194 HydrophobicContact CB-CG1 4.34Å; R148-I194 HydrophobicContact CG-CG1 4.44Å; V190-I194 HydrophobicContact CG1-CD1 3.74Å; V190-I194 VanDerWaalsContact O-CG1 3.32Å; V190-I194 WeakPolarHBondContact O-CG1 3.33Å; V190-I194 PolarHBondContact O-N 3.5Å; L191-I194 PolarHBondContact O-N 2.93Å; I194-F197 WeakPolarHBondContact O-CB 3.28Å; I194-F197 PolarHBondContact O-N 2.92Å; I194-Y198 HydrophobicContact CG2-CE2 4.14Å; I194-Y198 VanDerWaalsContact O-CD2 3.29Å; I194-Y198 WeakPolarHBondContact O-CD2 3.34Å; I194-L215 HydrophobicContact CB-CD1 4.29Å; I194-L215 HydrophobicContact CG2-CD1 3.68Å
195	A	97.9	Very high	94.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.7	-41.2	174.3	0	0	0	0	0	111.3	L191 T192 I193 F197 Y198 Y199 Y212 L215 V216 W230	L191-A195 WeakPolarHBondContact O-CB 3.21Å; L191-A195 PolarHBondContact O-N 3.21Å; T192-A195 PolarHBondContact O-N 3.44Å; I193-A195 VanDerWaalsContact C-N 3.34Å; A195-F197 PolarHBondContact O-N 2.92Å; A195-Y198 CarbonylContact O-C 3.54Å; A195-Y198 PolarHBondContact O-N 2.82Å; A195-Y199 PolarHBondContact O-N 2.98Å; A195-Y212 WeakPolarHBondContact O-CB 3.26Å; A195-L215 HydrophobicContact CB-CB 3.79Å; A195-L215 HydrophobicContact CB-CD1 4.18Å; A195-V216 HydrophobicContact CB-CG2 4.02Å; A195-W230 HydrophobicContact CB-CH2 3.64Å; A195-W230 HydrophobicContact CB-CZ2 3.42Å; A195-W230 VanDerWaalsContact CB-CZ2 3.42Å
196	L	97.4	Very high	94.4	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-33.3	177.4	-168.8	71.5	0	0	0	112.2	L152 T192 I193 Y198 Y199 L201 L233 L332 F360	L152-L196 HydrophobicContact CD2-CB 4.33Å; L152-L196 HydrophobicContact CD2-CD2 3.65Å; L152-L196 HydrophobicContact CD2-CG 3.67Å; T192-L196 VanDerWaalsContact O-CB 3.31Å; T192-L196 WeakPolarHBondContact O-CB 3.43Å; T192-L196 PolarHBondContact O-N 3.27Å; I193-L196 PolarHBondContact O-N 3.2Å; L196-Y198 VanDerWaalsContact C-N 3.27Å; L196-Y198 PolarHBondContact O-N 3.09Å; L196-Y199 HydrophobicContact CD1-CD1 4.2Å; L196-Y199 PolarHBondContact O-N 3.4Å; L196-L201 HydrophobicContact CD1-CD1 4.19Å; L196-L201 HydrophobicContact CG-CD1 4.37Å; L196-L233 HydrophobicContact CD1-CD1 4.39Å; L196-L332 HydrophobicContact CD1-CD2 4.08Å; L196-L332 HydrophobicContact CD2-CD2 4.22Å; L196-F360 HydrophobicContact CD2-CD1 4.06Å; L196-F360 HydrophobicContact CD2-CE1 3.68Å
197	F	97.1	Very high	94	Very high	9 Å²	9	29.9 Å²	29.9	4%	0.039	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-34.7	174.1	178.2	-96.1	0	0	0	113.2	R148 L152 I193 I194 A195 S206	R148-F197 HydrophobicContact CB-CB 4.24Å; R148-F197 HydrophobicContact CB-CD2 4.48Å; R148-F197 HydrophobicContact CB-CG 4.4Å; R148-F197 WeakPolarHBondContact O-CD2 3.49Å; L152-F197 HydrophobicContact CB-CD2 4.04Å; I193-F197 PolarHBondContact O-N 3.49Å; I193-F197 VanDerWaalsContact O-N 3.16Å; I194-F197 WeakPolarHBondContact O-CB 3.28Å; I194-F197 PolarHBondContact O-N 2.92Å; A195-F197 PolarHBondContact O-N 2.92Å; F197-S206 VanDerWaalsContact CZ-OG 3.26Å; F197-S206 WeakPolarHBondContact CZ-OG 3.39Å
198	Y	96.7	Very high	93.8	Very high	43 Å²	43	31.9 Å²	31.9	17%	0.169	17%	0.169	C	C	.	.	H	α-helix	trans	-93.2	-8.3	177.9	-64.2	-66.3	0	0	0	113.6	I194 A195 L196 S206 M207 N208 K211 L215	I194-Y198 HydrophobicContact CG2-CE2 4.14Å; I194-Y198 VanDerWaalsContact O-CD2 3.29Å; I194-Y198 WeakPolarHBondContact O-CD2 3.34Å; A195-Y198 CarbonylContact O-C 3.54Å; A195-Y198 PolarHBondContact O-N 2.82Å; L196-Y198 VanDerWaalsContact C-N 3.27Å; L196-Y198 PolarHBondContact O-N 3.09Å; Y198-S206 VanDerWaalsContact CD1-O 3.31Å; Y198-S206 WeakPolarHBondContact CD1-O 3.37Å; Y198-M207 WeakPolarHBondContact O-CA 3.49Å; Y198-N208 HydrophobicContact CD1-CB 4.37Å; Y198-N208 PolarHBondContact O-N 2.88Å; Y198-K211 HydrophobicContact CD1-CB 4.27Å; Y198-K211 HydrophobicContact CD1-CD 3.9Å; Y198-K211 HydrophobicContact CD2-CB 4.07Å; Y198-K211 HydrophobicContact CE1-CD 3.75Å; Y198-K211 HydrophobicContact CE2-CD 4.43Å; Y198-K211 HydrophobicContact CG-CB 3.93Å; Y198-K211 HydrophobicContact CG-CD 4.35Å; Y198-L215 HydrophobicContact CD2-CD1 4.03Å; Y198-L215 HydrophobicContact CE2-CD1 4.35Å
199	Y	95.7	Very high	93.4	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-72.6	143.3	-177.4	175.8	-95.4	0	0	0	111.2	A195 L196 L201 Y212 W230 L233 H237	A195-Y199 PolarHBondContact O-N 2.98Å; L196-Y199 HydrophobicContact CD1-CD1 4.2Å; L196-Y199 PolarHBondContact O-N 3.4Å; Y199-L201 HydrophobicContact CD1-CD2 4Å; Y199-L201 HydrophobicContact CD1-CG 3.78Å; Y199-L201 HydrophobicContact CE1-CD2 3.81Å; Y199-L201 HydrophobicContact CE1-CG 4.09Å; Y199-L201 PolarHBondContact O-N 3.21Å; Y199-Y212 HydrophobicContact CD2-CD2 4.13Å; Y199-Y212 HydrophobicContact CD2-CE1 4.47Å; Y199-Y212 HydrophobicContact CD2-CE2 4.06Å; Y199-Y212 HydrophobicContact CD2-CG 4.45Å; Y199-W230 HydrophobicContact CD2-CH2 4.47Å; Y199-W230 AromaticContact CD2-CZ3 3.72Å; Y199-W230 HydrophobicContact CD2-CZ3 3.72Å; Y199-W230 HydrophobicContact CE2-CZ3 4.42Å; Y199-W230 HydrophobicContact CG-CZ3 4.19Å; Y199-L233 HydrophobicContact CE1-CD2 4.04Å; Y199-L233 HydrophobicContact CE2-CB 3.93Å; Y199-L233 WeakPolarHBondContact CE2-O 3.38Å; Y199-L233 PolarHBondContact OH-O 3.46Å; Y199-H237 HydrophobicContact CE2-CB 4.02Å
200	P	92.8	Very high	93.1	Very high	12 Å²	12	36.1 Å²	36.1	8%	0.078	20%	0.196	C	C	.	.			trans	-67.6	63.6	-178.5	29.6	-41.5	0	0	0	114.5	M207 H237	P200-M207 HydrophobicContact CB-CG 3.75Å; P200-M207 HydrophobicContact CB-SD 3.35Å; P200-M207 WeakPolarHBondContact CB-SD 3.49Å; P200-H237 HydrophobicContact CG-CB 4.11Å
201	L	91.6	Very high	92.9	Very high	12 Å²	12	40.9 Å²	40.9	6%	0.063	22%	0.216	C	C	.	.			trans	-76.1	145.6	166.9	-70.6	170.1	0	0	0	111.1	L152 L156 L196 Y199 G203 S204 I331	L152-L201 HydrophobicContact CD1-CD1 4.44Å; L152-L201 HydrophobicContact CD2-CD1 4.33Å; L156-L201 HydrophobicContact CD1-CB 4.3Å; L156-L201 HydrophobicContact CD1-CD1 3.74Å; L156-L201 HydrophobicContact CD2-CB 3.96Å; L196-L201 HydrophobicContact CD1-CD1 4.19Å; L196-L201 HydrophobicContact CG-CD1 4.37Å; Y199-L201 HydrophobicContact CD1-CD2 4Å; Y199-L201 HydrophobicContact CD1-CG 3.78Å; Y199-L201 HydrophobicContact CE1-CD2 3.81Å; Y199-L201 HydrophobicContact CE1-CG 4.09Å; Y199-L201 PolarHBondContact O-N 3.21Å; L201-G203 PolarHBondContact O-N 2.95Å; L201-G203 VanDerWaalsContact O-N 3.11Å; L201-S204 VanDerWaalsContact O-CB 3.24Å; L201-S204 WeakPolarHBondContact O-CB 3.43Å; L201-S204 PolarHBondContact O-N 2.99Å; L201-I331 HydrophobicContact CD2-CG2 3.93Å
202	E	86.8	Confident	92.8	Very high	98 Å²	98	40.5 Å²	40.5	46%	0.458	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	114.6	175	-72.7	167	-158.7	0	0	111.4	L156 R236 R328	L156-E202 WeakPolarHBondContact CD2-O 3.38Å; E202-R236 VanDerWaalsContact CD-NH2 3.28Å; E202-R236 IonicContact OE1-CZ 3.97Å; E202-R236 IonicContact OE1-NH2 3.89Å; E202-R236 PolarHBondContact OE1-NH2 2.69Å; E202-R236 IonicContact OE2-NH2 3.36Å; E202-R328 HydrophobicContact CB-CB 4.43Å; E202-R328 PolarHBondContact O-NH1 3.37Å; E202-R328 WeakPolarHBondContact OE2-CB 3.45Å
203	G	82.4	Confident	92.6	Very high	50 Å²	50	40.9 Å²	40.9	52%	0.515	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	-2.7	-176.9	0	0	0	0	0	114.8	L201	L201-G203 PolarHBondContact O-N 2.95Å; L201-G203 VanDerWaalsContact O-N 3.11Å
204	S	88.3	Confident	92.5	Very high	19 Å²	19	42.9 Å²	42.9	13%	0.133	23%	0.231	C	C	.	.			trans	-70.1	130.2	175.4	-175.6	0	0	0	0	111	L201	L201-S204 VanDerWaalsContact O-CB 3.24Å; L201-S204 WeakPolarHBondContact O-CB 3.43Å; L201-S204 PolarHBondContact O-N 2.99Å
205	K	87	Confident	92.5	Very high	181 Å²	181	43.4 Å²	43.4	79%	0.787	23%	0.234	S	C	*	.	S	Bend	trans	-93.8	-14.7	176.9	-61.4	-179.3	-176	176.9	0	112.9
206	S	87.9	Confident	92.5	Very high	30 Å²	30	44 Å²	44	21%	0.21	24%	0.238	C	C	.	.	S	Bend	trans	-100	14.2	-172.3	-51.5	0	0	0	0	112.7	Q155 F197 Y198 N208	Q155-S206 VanDerWaalsContact CD-OG 3.32Å; Q155-S206 PolarHBondContact NE2-OG 3.09Å; Q155-S206 PolarHBondContact OE1-OG 2.72Å; F197-S206 VanDerWaalsContact CZ-OG 3.26Å; F197-S206 WeakPolarHBondContact CZ-OG 3.39Å; Y198-S206 VanDerWaalsContact CD1-O 3.31Å; Y198-S206 WeakPolarHBondContact CD1-O 3.37Å; S206-N208 PolarHBondContact O-N 2.86Å
207	M	90.1	Very high	92.4	Very high	114 Å²	114	44.8 Å²	44.8	56%	0.562	24%	0.244	S	C	*	.			trans	-56.6	128.4	-174	-173.8	178.4	81.9	0	0	112.3	Y198 P200	Y198-M207 WeakPolarHBondContact O-CA 3.49Å; P200-M207 HydrophobicContact CB-CG 3.75Å; P200-M207 HydrophobicContact CB-SD 3.35Å; P200-M207 WeakPolarHBondContact CB-SD 3.49Å
208	N	91.1	Very high	92.4	Very high	57 Å²	57	47.4 Å²	47.4	31%	0.305	26%	0.259	S	S	.	.			trans	-154.4	109.7	173.8	-173.2	-54.7	0	0	0	111	Y198 S206 V210 K211 Y212	Y198-N208 HydrophobicContact CD1-CB 4.37Å; Y198-N208 PolarHBondContact O-N 2.88Å; S206-N208 PolarHBondContact O-N 2.86Å; N208-V210 PolarHBondContact O-N 3.26Å; N208-V210 PolarHBondContact OD1-N 3.03Å; N208-V210 VanDerWaalsContact OD1-N 3.14Å; N208-K211 HydrophobicContact CB-CB 4.06Å; N208-K211 HydrophobicContact CB-CD 4.06Å; N208-K211 HydrophobicContact CB-CG 4.15Å; N208-K211 PolarHBondContact O-N 3.12Å; N208-K211 PolarHBondContact OD1-N 3.27Å; N208-Y212 WeakPolarHBondContact O-CD1 3.28Å; N208-Y212 PolarHBondContact O-N 3.34Å; N208-Y212 VanDerWaalsContact O-N 3.15Å
209	S	89.7	Confident	92.4	Very high	23 Å²	23	45.4 Å²	45.4	16%	0.161	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-38.1	-174.5	-58.2	0	0	0	0	113.7	Y212 S213	S209-Y212 WeakPolarHBondContact O-CD1 3.45Å; S209-S213 VanDerWaalsContact O-CB 3.23Å; S209-S213 WeakPolarHBondContact O-CB 3.4Å; S209-S213 PolarHBondContact O-N 3.15Å; S209-S213 VanDerWaalsContact O-N 3.16Å; S209-S213 PolarHBondContact O-OG 3.3Å
210	V	91.3	Very high	92.3	Very high	68 Å²	68	48.5 Å²	48.5	41%	0.412	26%	0.264	S	S	.	.	H	α-helix	trans	-68.4	-47.9	177.7	-178.5	0	0	0	0	110.4	N208 Y212 S213 S214 V255	N208-V210 PolarHBondContact O-N 3.26Å; N208-V210 PolarHBondContact OD1-N 3.03Å; N208-V210 VanDerWaalsContact OD1-N 3.14Å; V210-Y212 PolarHBondContact O-N 2.96Å; V210-S213 PolarHBondContact O-N 3.2Å; V210-S213 PolarHBondContact O-OG 3.31Å; V210-S213 VanDerWaalsContact O-OG 3.09Å; V210-S214 WeakPolarHBondContact O-CB 3.49Å; V210-S214 PolarHBondContact O-N 3.05Å; V210-S214 PolarHBondContact O-OG 3.3Å; V210-V255 HydrophobicContact CG1-CG2 4.38Å
211	K	94.6	Very high	92.4	Very high	104 Å²	104	48.2 Å²	48.2	45%	0.452	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-48.8	-176.5	-70.9	-178.4	-177.9	-178.3	0	112.7	Y198 N208 L215	Y198-K211 HydrophobicContact CD1-CB 4.27Å; Y198-K211 HydrophobicContact CD1-CD 3.9Å; Y198-K211 HydrophobicContact CD2-CB 4.07Å; Y198-K211 HydrophobicContact CE1-CD 3.75Å; Y198-K211 HydrophobicContact CE2-CD 4.43Å; Y198-K211 HydrophobicContact CG-CB 3.93Å; Y198-K211 HydrophobicContact CG-CD 4.35Å; N208-K211 HydrophobicContact CB-CB 4.06Å; N208-K211 HydrophobicContact CB-CD 4.06Å; N208-K211 HydrophobicContact CB-CG 4.15Å; N208-K211 PolarHBondContact O-N 3.12Å; N208-K211 PolarHBondContact OD1-N 3.27Å; K211-L215 WeakPolarHBondContact O-CD1 3.29Å; K211-L215 VanDerWaalsContact O-CG 3.29Å; K211-L215 WeakPolarHBondContact O-CG 3.33Å; K211-L215 PolarHBondContact O-N 3.04Å
212	Y	95.6	Very high	92.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.9	-42.9	-179.2	94.7	-102.4	0	0	0	110.3	A195 Y199 N208 S209 V210 S214 L215 V216 W230 L234 H237 F252	A195-Y212 WeakPolarHBondContact O-CB 3.26Å; Y199-Y212 HydrophobicContact CD2-CD2 4.13Å; Y199-Y212 HydrophobicContact CD2-CE1 4.47Å; Y199-Y212 HydrophobicContact CD2-CE2 4.06Å; Y199-Y212 HydrophobicContact CD2-CG 4.45Å; N208-Y212 WeakPolarHBondContact O-CD1 3.28Å; N208-Y212 PolarHBondContact O-N 3.34Å; N208-Y212 VanDerWaalsContact O-N 3.15Å; S209-Y212 WeakPolarHBondContact O-CD1 3.45Å; V210-Y212 PolarHBondContact O-N 2.96Å; Y212-S214 PolarHBondContact O-N 3.05Å; Y212-L215 PolarHBondContact O-N 2.88Å; Y212-V216 HydrophobicContact CD2-CG2 4.13Å; Y212-V216 VanDerWaalsContact O-CG2 3.26Å; Y212-V216 WeakPolarHBondContact O-CG2 3.34Å; Y212-V216 PolarHBondContact O-N 3Å; Y212-W230 HydrophobicContact CD2-CH2 4.39Å; Y212-W230 AromaticContact CD2-CZ3 3.93Å; Y212-W230 HydrophobicContact CD2-CZ3 3.93Å; Y212-W230 HydrophobicContact CE2-CZ3 4.29Å; Y212-L234 HydrophobicContact CE2-CD2 3.74Å; Y212-H237 AromaticContact CE1-CE1 3.81Å; Y212-H237 AromaticContact CE1-ND1 3.68Å; Y212-H237 AromaticContact CZ-ND1 3.55Å; Y212-H237 PolarHBondContact OH-CE1 3.49Å; Y212-H237 PolarHBondContact OH-ND1 3.28Å; Y212-F252 WeakPolarHBondContact OH-CE1 3.48Å; Y212-F252 WeakPolarHBondContact OH-CZ 3.44Å
213	S	95.3	Very high	92.7	Very high	8 Å²	8	44.3 Å²	44.3	6%	0.056	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-37.6	-179.8	58.9	0	0	0	0	112.4	S209 V210 L215 V216 A217	S209-S213 VanDerWaalsContact O-CB 3.23Å; S209-S213 WeakPolarHBondContact O-CB 3.4Å; S209-S213 PolarHBondContact O-N 3.15Å; S209-S213 VanDerWaalsContact O-N 3.16Å; S209-S213 PolarHBondContact O-OG 3.3Å; V210-S213 PolarHBondContact O-N 3.2Å; V210-S213 PolarHBondContact O-OG 3.31Å; V210-S213 VanDerWaalsContact O-OG 3.09Å; S213-L215 PolarHBondContact O-N 3.33Å; S213-V216 PolarHBondContact O-N 3.09Å; S213-A217 VanDerWaalsContact O-CB 3.28Å; S213-A217 WeakPolarHBondContact O-CB 3.47Å; S213-A217 PolarHBondContact O-N 3.19Å
214	S	96.2	Very high	93.2	Very high	46 Å²	46	43 Å²	43	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-40.1	174	-63.3	0	0	0	0	112.7	V210 Y212 L218	V210-S214 WeakPolarHBondContact O-CB 3.49Å; V210-S214 PolarHBondContact O-N 3.05Å; V210-S214 PolarHBondContact O-OG 3.3Å; Y212-S214 PolarHBondContact O-N 3.05Å; S214-L218 WeakPolarHBondContact O-CB 3.45Å; S214-L218 PolarHBondContact O-N 3.49Å
215	L	97.2	Very high	93.4	Very high	37 Å²	37	42.8 Å²	42.8	19%	0.194	22%	0.224	C	C	.	.	H	α-helix	trans	-68.4	-38.5	176.6	-70	167	0	0	0	111.9	L191 I194 A195 Y198 K211 Y212 S213 L218 A219	L191-L215 HydrophobicContact CD2-CD2 3.79Å; I194-L215 HydrophobicContact CB-CD1 4.29Å; I194-L215 HydrophobicContact CG2-CD1 3.68Å; A195-L215 HydrophobicContact CB-CB 3.79Å; A195-L215 HydrophobicContact CB-CD1 4.18Å; Y198-L215 HydrophobicContact CD2-CD1 4.03Å; Y198-L215 HydrophobicContact CE2-CD1 4.35Å; K211-L215 WeakPolarHBondContact O-CD1 3.29Å; K211-L215 VanDerWaalsContact O-CG 3.29Å; K211-L215 WeakPolarHBondContact O-CG 3.33Å; K211-L215 PolarHBondContact O-N 3.04Å; Y212-L215 PolarHBondContact O-N 2.88Å; S213-L215 PolarHBondContact O-N 3.33Å; L215-L218 PolarHBondContact O-N 3.42Å; L215-A219 WeakPolarHBondContact O-CB 3.42Å; L215-A219 PolarHBondContact O-N 3.19Å
216	V	97.1	Very high	93.8	Very high	13 Å²	13	34.2 Å²	34.2	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-43.4	174.9	174.3	0	0	0	0	111.1	A195 Y212 S213 A219 F220 W230	A195-V216 HydrophobicContact CB-CG2 4.02Å; Y212-V216 HydrophobicContact CD2-CG2 4.13Å; Y212-V216 VanDerWaalsContact O-CG2 3.26Å; Y212-V216 WeakPolarHBondContact O-CG2 3.34Å; Y212-V216 PolarHBondContact O-N 3Å; S213-V216 PolarHBondContact O-N 3.09Å; V216-A219 WeakPolarHBondContact O-CB 3.41Å; V216-A219 PolarHBondContact O-N 3.27Å; V216-F220 PolarHBondContact O-N 3.44Å; V216-W230 HydrophobicContact CB-CD2 4.37Å; V216-W230 HydrophobicContact CG1-CB 4.01Å; V216-W230 HydrophobicContact CG1-CD2 4.06Å; V216-W230 HydrophobicContact CG1-CG 3.75Å; V216-W230 HydrophobicContact CG2-CD2 3.33Å; V216-W230 HydrophobicContact CG2-CE3 3.57Å; V216-W230 HydrophobicContact CG2-CG 3.89Å; V216-W230 HydrophobicContact CG2-CH2 3.86Å; V216-W230 HydrophobicContact CG2-CZ2 3.67Å; V216-W230 HydrophobicContact CG2-CZ3 3.81Å
217	A	96.5	Very high	94.2	Very high	17 Å²	17	35.8 Å²	35.8	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175.9	0	0	0	0	0	111.1	S213 A219 F220 I221 V255 T259	S213-A217 VanDerWaalsContact O-CB 3.28Å; S213-A217 WeakPolarHBondContact O-CB 3.47Å; S213-A217 PolarHBondContact O-N 3.19Å; A217-A219 PolarHBondContact O-N 2.92Å; A217-F220 WeakPolarHBondContact O-CB 3.39Å; A217-F220 PolarHBondContact O-N 2.94Å; A217-I221 WeakPolarHBondContact O-CG1 3.15Å; A217-I221 PolarHBondContact O-N 3.29Å; A217-V255 HydrophobicContact CB-CG1 3.82Å; A217-T259 HydrophobicContact CB-CG2 3.82Å
218	L	96.3	Very high	94.5	Very high	64 Å²	64	31.4 Å²	31.4	34%	0.335	17%	0.173	S	C	.	.	H	α-helix	trans	-60.4	-43.2	172.8	180	61.7	0	0	0	112.1	T107 L191 S214 L215 F220 I221 I222	T107-L218 HydrophobicContact CG2-CD1 4.4Å; L191-L218 HydrophobicContact CD1-CB 4.44Å; L191-L218 HydrophobicContact CD1-CD2 4.19Å; L191-L218 HydrophobicContact CD1-CG 4Å; L191-L218 HydrophobicContact CD2-CD2 4.05Å; S214-L218 WeakPolarHBondContact O-CB 3.45Å; S214-L218 PolarHBondContact O-N 3.49Å; L215-L218 PolarHBondContact O-N 3.42Å; L218-F220 VanDerWaalsContact C-N 3.31Å; L218-F220 PolarHBondContact O-N 3.33Å; L218-I221 PolarHBondContact O-N 3.07Å; L218-I222 HydrophobicContact CD1-CD1 4.11Å; L218-I222 HydrophobicContact CD1-CG1 4.4Å; L218-I222 HydrophobicContact CG-CD1 4.07Å; L218-I222 WeakPolarHBondContact O-CG1 3.36Å; L218-I222 PolarHBondContact O-N 3.23Å
219	A	96.3	Very high	94.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-41.3	176.2	0	0	0	0	0	111.5	L191 L215 V216 A217 I222 R223 A226	L191-A219 HydrophobicContact CB-CB 4Å; L191-A219 HydrophobicContact CD1-CB 3.81Å; L215-A219 WeakPolarHBondContact O-CB 3.42Å; L215-A219 PolarHBondContact O-N 3.19Å; V216-A219 WeakPolarHBondContact O-CB 3.41Å; V216-A219 PolarHBondContact O-N 3.27Å; A217-A219 PolarHBondContact O-N 2.92Å; A219-I222 PolarHBondContact O-N 3.41Å; A219-R223 CarbonylContact O-C 3.25Å; A219-R223 PolarHBondContact O-N 2.91Å; A219-R223 VanDerWaalsContact O-O 3.04Å; A219-A226 HydrophobicContact CB-CB 3.82Å
220	F	95.4	Very high	95.1	Very high	65 Å²	65	27.6 Å²	27.6	29%	0.285	15%	0.151	S	C	.	.	H	α-helix	trans	-64.5	-40.9	175.7	179.1	-97.1	0	0	0	113	V216 A217 L218 R223 P224 V227 Q278	V216-F220 PolarHBondContact O-N 3.44Å; A217-F220 WeakPolarHBondContact O-CB 3.39Å; A217-F220 PolarHBondContact O-N 2.94Å; L218-F220 VanDerWaalsContact C-N 3.31Å; L218-F220 PolarHBondContact O-N 3.33Å; F220-R223 WeakPolarHBondContact CA-O 3.27Å; F220-R223 CarbonylContact O-C 3.26Å; F220-R223 PolarHBondContact O-N 3.46Å; F220-P224 HydrophobicContact CD2-CB 4.43Å; F220-P224 VanDerWaalsContact CD2-O 3.31Å; F220-P224 WeakPolarHBondContact CD2-O 3.27Å; F220-P224 HydrophobicContact CE2-CB 4Å; F220-P224 WeakPolarHBondContact CE2-O 3.26Å; F220-P224 HydrophobicContact CZ-CB 4.37Å; F220-P224 WeakPolarHBondContact O-CA 3.19Å; F220-P224 VanDerWaalsContact O-N 3.11Å; F220-V227 HydrophobicContact CD2-CB 3.96Å; F220-V227 HydrophobicContact CE2-CB 4.12Å; F220-V227 HydrophobicContact CE2-CG1 4.4Å; F220-Q278 HydrophobicContact CE1-CB 4.2Å; F220-Q278 HydrophobicContact CE1-CG 4Å; F220-Q278 HydrophobicContact CZ-CB 4.4Å
221	I	94.7	Very high	95.4	Very high	6 Å²	6	27 Å²	27	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-62.9	-45.9	175.8	-67.7	-54.5	0	0	0	111.1	T107 A217 L218 R223 L260 S263 Q278	T107-I221 HydrophobicContact CG2-CG2 4.08Å; A217-I221 WeakPolarHBondContact O-CG1 3.15Å; A217-I221 PolarHBondContact O-N 3.29Å; L218-I221 PolarHBondContact O-N 3.07Å; I221-R223 VanDerWaalsContact C-N 3.34Å; I221-L260 HydrophobicContact CD1-CD2 3.62Å; I221-L260 HydrophobicContact CD1-CG 4.25Å; I221-S263 WeakPolarHBondContact CG2-OG 3.41Å; I221-Q278 PolarHBondContact O-NE2 3.23Å
222	I	92.9	Very high	95.6	Very high	18 Å²	18	22.7 Å²	22.7	9%	0.092	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-42.3	177.2	-70.7	171.5	0	0	0	110.5	T107 Y108 T184 M187 L191 L218 A219	T107-I222 HydrophobicContact CG2-CG1 4.26Å; Y108-I222 HydrophobicContact CD2-CD1 4.34Å; Y108-I222 HydrophobicContact CD2-CG2 4.16Å; Y108-I222 HydrophobicContact CG-CG2 4.11Å; T184-I222 HydrophobicContact CG2-CG2 4.16Å; M187-I222 HydrophobicContact CE-CD1 4.39Å; M187-I222 HydrophobicContact CG-CD1 3.89Å; L191-I222 HydrophobicContact CD1-CD1 3.98Å; L218-I222 HydrophobicContact CD1-CD1 4.11Å; L218-I222 HydrophobicContact CD1-CG1 4.4Å; L218-I222 HydrophobicContact CG-CD1 4.07Å; L218-I222 WeakPolarHBondContact O-CG1 3.36Å; L218-I222 PolarHBondContact O-N 3.23Å; A219-I222 PolarHBondContact O-N 3.41Å
223	R	91.9	Very high	95.6	Very high	11 Å²	11	22.7 Å²	22.7	4%	0.042	13%	0.131	C	C	.	.			trans	-149.1	108.9	-178.4	-159.5	-179.3	173.2	98	1.6	110.7	T184 N185 E188 A219 F220 I221 T225 A226 F353	T184-R223 PolarHBondContact OG1-NH1 3.45Å; N185-R223 VanDerWaalsContact ND2-CZ 3.29Å; N185-R223 PolarHBondContact ND2-NE 3.43Å; N185-R223 VanDerWaalsContact ND2-NE 3.12Å; N185-R223 PolarHBondContact OD1-NH1 3.37Å; E188-R223 WeakPolarHBondContact OE2-CD 3.37Å; E188-R223 IonicContact OE2-NE 2.64Å; A219-R223 CarbonylContact O-C 3.25Å; A219-R223 PolarHBondContact O-N 2.91Å; A219-R223 VanDerWaalsContact O-O 3.04Å; F220-R223 WeakPolarHBondContact CA-O 3.27Å; F220-R223 CarbonylContact O-C 3.26Å; F220-R223 PolarHBondContact O-N 3.46Å; I221-R223 VanDerWaalsContact C-N 3.34Å; R223-T225 VanDerWaalsContact CD-OG1 3.28Å; R223-T225 WeakPolarHBondContact CD-OG1 3.44Å; R223-T225 WeakPolarHBondContact CG-OG1 3.31Å; R223-T225 PolarHBondContact NE-OG1 3.2Å; R223-T225 PolarHBondContact O-N 3.48Å; R223-A226 VanDerWaalsContact O-CB 3.31Å; R223-A226 WeakPolarHBondContact O-CB 3.48Å; R223-A226 PolarHBondContact O-N 3.33Å; R223-F353 VanDerWaalsContact NH2-CD1 3.31Å
224	P	92.6	Very high	95.6	Very high	21 Å²	21	24.5 Å²	24.5	14%	0.136	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-57.1	-25.4	-177.5	-30.5	37.4	0	0	0	114.6	F220 A226 V227 Q278 F281	F220-P224 HydrophobicContact CD2-CB 4.43Å; F220-P224 VanDerWaalsContact CD2-O 3.31Å; F220-P224 WeakPolarHBondContact CD2-O 3.27Å; F220-P224 HydrophobicContact CE2-CB 4Å; F220-P224 WeakPolarHBondContact CE2-O 3.26Å; F220-P224 HydrophobicContact CZ-CB 4.37Å; F220-P224 WeakPolarHBondContact O-CA 3.19Å; F220-P224 VanDerWaalsContact O-N 3.11Å; P224-A226 PolarHBondContact O-N 3.48Å; P224-A226 VanDerWaalsContact O-N 3.16Å; P224-V227 VanDerWaalsContact O-CG1 3.28Å; P224-V227 WeakPolarHBondContact O-CG1 3.4Å; P224-V227 PolarHBondContact O-N 2.97Å; P224-Q278 HydrophobicContact CG-CB 4.15Å; P224-Q278 HydrophobicContact CG-CG 3.98Å; P224-F281 HydrophobicContact CB-CD1 3.79Å; P224-F281 HydrophobicContact CB-CE1 4.08Å; P224-F281 HydrophobicContact CG-CB 4.25Å; P224-F281 HydrophobicContact CG-CD1 3.74Å; P224-F281 HydrophobicContact CG-CE1 4.31Å; P224-F281 HydrophobicContact CG-CG 3.97Å
225	T	92.3	Very high	95.6	Very high	16 Å²	16	28.9 Å²	28.9	10%	0.098	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-64.3	-15.7	177.3	61.9	0	0	0	0	114	E188 R223 V227 I228 P229 F281 Y343	E188-T225 PolarHBondContact OE1-OG1 3.06Å; R223-T225 VanDerWaalsContact CD-OG1 3.28Å; R223-T225 WeakPolarHBondContact CD-OG1 3.44Å; R223-T225 WeakPolarHBondContact CG-OG1 3.31Å; R223-T225 PolarHBondContact NE-OG1 3.2Å; R223-T225 PolarHBondContact O-N 3.48Å; T225-V227 PolarHBondContact O-N 3.26Å; T225-V227 VanDerWaalsContact O-N 3.07Å; T225-I228 VanDerWaalsContact O-CB 3.31Å; T225-I228 WeakPolarHBondContact O-CB 3.43Å; T225-I228 WeakPolarHBondContact O-CG1 3.03Å; T225-I228 PolarHBondContact O-N 3.29Å; T225-P229 WeakPolarHBondContact O-CD 3.23Å; T225-F281 HydrophobicContact CG2-CE1 4.15Å; T225-F281 HydrophobicContact CG2-CZ 4.08Å; T225-Y343 VanDerWaalsContact CB-OH 3.3Å; T225-Y343 WeakPolarHBondContact CB-OH 3.3Å; T225-Y343 PolarHBondContact OG1-OH 3.27Å
226	A	95.1	Very high	95.5	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-59.7	-21.3	176.1	0	0	0	0	0	112.7	E188 A219 R223 P224 I228 P229 W230	E188-A226 HydrophobicContact CG-CB 3.99Å; E188-A226 WeakPolarHBondContact OE1-CA 3.42Å; E188-A226 PolarHBondContact OE1-N 3.1Å; E188-A226 VanDerWaalsContact OE1-N 3.08Å; A219-A226 HydrophobicContact CB-CB 3.82Å; R223-A226 VanDerWaalsContact O-CB 3.31Å; R223-A226 WeakPolarHBondContact O-CB 3.48Å; R223-A226 PolarHBondContact O-N 3.33Å; P224-A226 PolarHBondContact O-N 3.48Å; P224-A226 VanDerWaalsContact O-N 3.16Å; A226-I228 PolarHBondContact O-N 2.99Å; A226-P229 WeakPolarHBondContact O-CD 3.47Å; A226-P229 WeakPolarHBondContact O-CG 3.27Å; A226-W230 VanDerWaalsContact O-CD1 3.3Å; A226-W230 PolarHBondContact O-N 2.97Å
227	V	95.6	Very high	95.3	Very high	63 Å²	63	28.6 Å²	28.6	38%	0.382	15%	0.148	S	C	.	.	H	α-helix	trans	-61.2	-30.1	172.8	74.9	0	0	0	0	112.2	F220 P224 T225 W230 T231	F220-V227 HydrophobicContact CD2-CB 3.96Å; F220-V227 HydrophobicContact CE2-CB 4.12Å; F220-V227 HydrophobicContact CE2-CG1 4.4Å; P224-V227 VanDerWaalsContact O-CG1 3.28Å; P224-V227 WeakPolarHBondContact O-CG1 3.4Å; P224-V227 PolarHBondContact O-N 2.97Å; T225-V227 PolarHBondContact O-N 3.26Å; T225-V227 VanDerWaalsContact O-N 3.07Å; V227-W230 PolarHBondContact O-N 3.1Å; V227-T231 WeakPolarHBondContact O-CB 3.49Å; V227-T231 PolarHBondContact O-N 3.21Å; V227-T231 PolarHBondContact O-OG1 3.26Å
228	I	96.5	Very high	95.1	Very high	21 Å²	21	30.9 Å²	30.9	11%	0.108	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-61	-175.2	-61.1	169.7	0	0	0	110.8	T225 A226 W230 T231 W338 T339 V342 Y343	T225-I228 VanDerWaalsContact O-CB 3.31Å; T225-I228 WeakPolarHBondContact O-CB 3.43Å; T225-I228 WeakPolarHBondContact O-CG1 3.03Å; T225-I228 PolarHBondContact O-N 3.29Å; A226-I228 PolarHBondContact O-N 2.99Å; I228-W230 PolarHBondContact O-N 3.05Å; I228-T231 PolarHBondContact O-N 3.23Å; I228-W338 PolarHBondContact O-NE1 3.37Å; I228-T339 HydrophobicContact CG2-CG2 4.21Å; I228-V342 HydrophobicContact CD1-CG1 3.93Å; I228-V342 HydrophobicContact CG1-CG1 4.13Å; I228-V342 HydrophobicContact CG2-CB 3.91Å; I228-V342 HydrophobicContact CG2-CG1 3.94Å; I228-V342 HydrophobicContact CG2-CG2 4.29Å; I228-Y343 HydrophobicContact CD1-CD1 4.5Å; I228-Y343 HydrophobicContact CD1-CE1 3.94Å; I228-Y343 HydrophobicContact CD1-CE2 4.18Å; I228-Y343 HydrophobicContact CG2-CE2 4.46Å
229	P	96.9	Very high	94.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-26.8	177.7	26.9	-35.9	0	0	0	112.7	T225 A226 T335 P356 V357	T225-P229 WeakPolarHBondContact O-CD 3.23Å; A226-P229 WeakPolarHBondContact O-CD 3.47Å; A226-P229 WeakPolarHBondContact O-CG 3.27Å; P229-T335 HydrophobicContact CB-CG2 4.13Å; P229-T335 WeakPolarHBondContact O-CG2 3.47Å; P229-P356 HydrophobicContact CG-CB 4.45Å; P229-V357 HydrophobicContact CB-CG1 3.8Å
230	W	97.6	Very high	94.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-81.1	-17.9	179.9	-80.5	96.3	0	0	0	114.2	T192 A195 Y199 Y212 V216 A226 V227 I228 L233 L234	T192-W230 HydrophobicContact CG2-CZ2 4.14Å; T192-W230 PolarHBondContact OG1-NE1 3.27Å; A195-W230 HydrophobicContact CB-CH2 3.64Å; A195-W230 HydrophobicContact CB-CZ2 3.42Å; A195-W230 VanDerWaalsContact CB-CZ2 3.42Å; Y199-W230 HydrophobicContact CD2-CH2 4.47Å; Y199-W230 AromaticContact CD2-CZ3 3.72Å; Y199-W230 HydrophobicContact CD2-CZ3 3.72Å; Y199-W230 HydrophobicContact CE2-CZ3 4.42Å; Y199-W230 HydrophobicContact CG-CZ3 4.19Å; Y212-W230 HydrophobicContact CD2-CH2 4.39Å; Y212-W230 AromaticContact CD2-CZ3 3.93Å; Y212-W230 HydrophobicContact CD2-CZ3 3.93Å; Y212-W230 HydrophobicContact CE2-CZ3 4.29Å; V216-W230 HydrophobicContact CB-CD2 4.37Å; V216-W230 HydrophobicContact CG1-CB 4.01Å; V216-W230 HydrophobicContact CG1-CD2 4.06Å; V216-W230 HydrophobicContact CG1-CG 3.75Å; V216-W230 HydrophobicContact CG2-CD2 3.33Å; V216-W230 HydrophobicContact CG2-CE3 3.57Å; V216-W230 HydrophobicContact CG2-CG 3.89Å; V216-W230 HydrophobicContact CG2-CH2 3.86Å; V216-W230 HydrophobicContact CG2-CZ2 3.67Å; V216-W230 HydrophobicContact CG2-CZ3 3.81Å; A226-W230 VanDerWaalsContact O-CD1 3.3Å; A226-W230 PolarHBondContact O-N 2.97Å; V227-W230 PolarHBondContact O-N 3.1Å; I228-W230 PolarHBondContact O-N 3.05Å; W230-L233 HydrophobicContact CD2-CD1 4.16Å; W230-L233 HydrophobicContact CE3-CB 3.89Å; W230-L233 HydrophobicContact CE3-CD1 3.78Å; W230-L233 HydrophobicContact CE3-CG 4.5Å; W230-L233 HydrophobicContact CH2-CD1 4.27Å; W230-L233 HydrophobicContact CZ3-CB 4.19Å; W230-L233 HydrophobicContact CZ3-CD1 3.87Å; W230-L233 PolarHBondContact O-N 2.97Å; W230-L234 HydrophobicContact CB-CD1 4.16Å; W230-L234 HydrophobicContact CB-CG 4.34Å; W230-L234 WeakPolarHBondContact O-CB 3.21Å; W230-L234 VanDerWaalsContact O-CG 3.28Å; W230-L234 WeakPolarHBondContact O-CG 3.32Å; W230-L234 PolarHBondContact O-N 3.15Å
231	T	97.4	Very high	94.3	Very high	55 Å²	55	34.9 Å²	34.9	34%	0.337	18%	0.18	S	C	.	.	H	α-helix	trans	-57.2	-51.7	-177.2	-66.9	0	0	0	0	112.8	V227 I228 L233 L234 F235 W338	V227-T231 WeakPolarHBondContact O-CB 3.49Å; V227-T231 PolarHBondContact O-N 3.21Å; V227-T231 PolarHBondContact O-OG1 3.26Å; I228-T231 PolarHBondContact O-N 3.23Å; T231-L233 VanDerWaalsContact C-N 3.3Å; T231-L233 PolarHBondContact O-N 3.42Å; T231-L234 PolarHBondContact O-N 2.89Å; T231-F235 VanDerWaalsContact O-CB 3.29Å; T231-F235 WeakPolarHBondContact O-CB 3.47Å; T231-F235 PolarHBondContact O-N 2.96Å; T231-W338 HydrophobicContact CG2-CZ2 4.19Å
232	P	97.5	Very high	94	Very high	14 Å²	14	39.8 Å²	39.8	9%	0.091	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-34.6	178.6	-22.9	35.7	0	0	0	113.2	R236 I331 V334 W338	P232-R236 WeakPolarHBondContact O-CB 3.44Å; P232-R236 PolarHBondContact O-N 3.36Å; P232-I331 HydrophobicContact CB-CD1 4.41Å; P232-V334 HydrophobicContact CB-CG1 4.32Å; P232-W338 HydrophobicContact CG-CB 3.8Å; P232-W338 VanDerWaalsContact CG-CD1 3.44Å; P232-W338 HydrophobicContact CG-CD2 4.16Å; P232-W338 HydrophobicContact CG-CG 3.5Å; P232-W338 VanDerWaalsContact CG-CG 3.5Å
233	L	96.8	Very high	93.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70.5	-49.6	179.2	-64.2	171.2	0	0	0	111.2	L196 Y199 W230 T231 F235 R236 H237 I331 T335 F360	L196-L233 HydrophobicContact CD1-CD1 4.39Å; Y199-L233 HydrophobicContact CE1-CD2 4.04Å; Y199-L233 HydrophobicContact CE2-CB 3.93Å; Y199-L233 WeakPolarHBondContact CE2-O 3.38Å; Y199-L233 PolarHBondContact OH-O 3.46Å; W230-L233 HydrophobicContact CD2-CD1 4.16Å; W230-L233 HydrophobicContact CE3-CB 3.89Å; W230-L233 HydrophobicContact CE3-CD1 3.78Å; W230-L233 HydrophobicContact CE3-CG 4.5Å; W230-L233 HydrophobicContact CH2-CD1 4.27Å; W230-L233 HydrophobicContact CZ3-CB 4.19Å; W230-L233 HydrophobicContact CZ3-CD1 3.87Å; W230-L233 PolarHBondContact O-N 2.97Å; T231-L233 VanDerWaalsContact C-N 3.3Å; T231-L233 PolarHBondContact O-N 3.42Å; L233-F235 VanDerWaalsContact C-N 3.3Å; L233-F235 PolarHBondContact O-N 3.14Å; L233-R236 PolarHBondContact O-N 2.84Å; L233-H237 PolarHBondContact O-N 3.16Å; L233-I331 HydrophobicContact CD2-CG1 3.69Å; L233-I331 HydrophobicContact CD2-CG2 4.21Å; L233-T335 HydrophobicContact CD1-CG2 4.5Å; L233-F360 HydrophobicContact CD1-CE2 4.46Å; L233-F360 HydrophobicContact CD1-CZ 4.42Å
234	L	95.3	Very high	93.8	Very high	45 Å²	45	51.1 Å²	51.1	24%	0.236	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-41.6	176.5	-68.6	174.9	0	0	0	111.2	Y212 W230 T231 H237 F238 F252	Y212-L234 HydrophobicContact CE2-CD2 3.74Å; W230-L234 HydrophobicContact CB-CD1 4.16Å; W230-L234 HydrophobicContact CB-CG 4.34Å; W230-L234 WeakPolarHBondContact O-CB 3.21Å; W230-L234 VanDerWaalsContact O-CG 3.28Å; W230-L234 WeakPolarHBondContact O-CG 3.32Å; W230-L234 PolarHBondContact O-N 3.15Å; T231-L234 PolarHBondContact O-N 2.89Å; L234-H237 PolarHBondContact O-N 3.2Å; L234-F238 WeakPolarHBondContact O-CB 3.14Å; L234-F238 PolarHBondContact O-N 2.96Å; L234-F252 HydrophobicContact CD2-CZ 4.26Å
235	F	95.4	Very high	93.7	Very high	138 Å²	138	55.9 Å²	55.9	61%	0.605	28%	0.28	S	S	*	.	H	α-helix	trans	-62.9	-43.3	175.5	-175.3	-106.1	0	0	0	112.1	T231 L233 H237 F238 C239	T231-F235 VanDerWaalsContact O-CB 3.29Å; T231-F235 WeakPolarHBondContact O-CB 3.47Å; T231-F235 PolarHBondContact O-N 2.96Å; L233-F235 VanDerWaalsContact C-N 3.3Å; L233-F235 PolarHBondContact O-N 3.14Å; F235-H237 PolarHBondContact O-N 2.91Å; F235-F238 PolarHBondContact O-N 2.94Å; F235-C239 WeakPolarHBondContact O-CB 3.38Å; F235-C239 PolarHBondContact O-N 3.13Å; F235-C239 PolarHBondContact O-SG 2.88Å; F235-C239 VanDerWaalsContact O-SG 3.34Å
236	R	94.7	Very high	93.5	Very high	38 Å²	38	57.9 Å²	57.9	14%	0.143	29%	0.29	C	S	.	.	H	α-helix	trans	-59.1	-48.7	175	177.6	179.3	176	174.5	4.4	111.3	E202 P232 L233 F238 C239 Q240 R328 I331	E202-R236 VanDerWaalsContact CD-NH2 3.28Å; E202-R236 IonicContact OE1-CZ 3.97Å; E202-R236 IonicContact OE1-NH2 3.89Å; E202-R236 PolarHBondContact OE1-NH2 2.69Å; E202-R236 IonicContact OE2-NH2 3.36Å; P232-R236 WeakPolarHBondContact O-CB 3.44Å; P232-R236 PolarHBondContact O-N 3.36Å; L233-R236 PolarHBondContact O-N 2.84Å; R236-F238 VanDerWaalsContact C-N 3.34Å; R236-F238 PolarHBondContact O-N 3.5Å; R236-C239 PolarHBondContact O-N 3.33Å; R236-Q240 HydrophobicContact CG-CG 4.4Å; R236-Q240 VanDerWaalsContact NE-NE2 3.18Å; R236-Q240 WeakPolarHBondContact O-CG 3.49Å; R236-Q240 PolarHBondContact O-N 3.25Å; R236-R328 PolarHBondContact NH1-O 3.47Å; R236-I331 HydrophobicContact CB-CD1 4.02Å; R236-I331 HydrophobicContact CB-CG1 4.39Å; R236-I331 HydrophobicContact CG-CD1 4.48Å
237	H	92.8	Very high	93.2	Very high	6 Å²	6	58.1 Å²	58.1	3%	0.028	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-43.4	179.4	-178.5	-160.4	0	0	0	111.5	Y199 P200 Y212 L233 L234 F235 C239 Q240 E241	Y199-H237 HydrophobicContact CE2-CB 4.02Å; P200-H237 HydrophobicContact CG-CB 4.11Å; Y212-H237 AromaticContact CE1-CE1 3.81Å; Y212-H237 AromaticContact CE1-ND1 3.68Å; Y212-H237 AromaticContact CZ-ND1 3.55Å; Y212-H237 PolarHBondContact OH-CE1 3.49Å; Y212-H237 PolarHBondContact OH-ND1 3.28Å; L233-H237 PolarHBondContact O-N 3.16Å; L234-H237 PolarHBondContact O-N 3.2Å; F235-H237 PolarHBondContact O-N 2.91Å; H237-C239 VanDerWaalsContact C-N 3.29Å; H237-C239 PolarHBondContact O-N 2.73Å; H237-Q240 PolarHBondContact O-N 3.46Å; H237-Q240 VanDerWaalsContact O-N 3.13Å; H237-E241 PolarHBondContact O-N 3.45Å
238	F	92.6	Very high	92.9	Very high	65 Å²	65	58.1 Å²	58.1	29%	0.285	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-38.8	175.7	179.9	-102.5	0	0	0	113.1	L234 F235 R236 K244 I248	L234-F238 WeakPolarHBondContact O-CB 3.14Å; L234-F238 PolarHBondContact O-N 2.96Å; F235-F238 PolarHBondContact O-N 2.94Å; R236-F238 VanDerWaalsContact C-N 3.34Å; R236-F238 PolarHBondContact O-N 3.5Å; F238-K244 HydrophobicContact CE1-CD 4.19Å; F238-K244 HydrophobicContact CE2-CB 3.79Å; F238-K244 HydrophobicContact CE2-CD 4.2Å; F238-K244 HydrophobicContact CE2-CG 4.02Å; F238-K244 HydrophobicContact CZ-CB 4.14Å; F238-K244 HydrophobicContact CZ-CD 3.79Å; F238-K244 HydrophobicContact CZ-CG 4.15Å; F238-I248 HydrophobicContact CD2-CD1 4.46Å; F238-I248 HydrophobicContact CE2-CD1 3.66Å; F238-I248 HydrophobicContact CE2-CG1 4.24Å; F238-I248 HydrophobicContact CZ-CD1 4.43Å
239	C	92.1	Very high	92.6	Very high	72 Å²	72	61.6 Å²	61.6	49%	0.486	31%	0.307	S	S	.	.	H	α-helix	trans	-72.4	-29.1	176.7	-72.3	0	0	0	0	113.3	F235 R236 H237	F235-C239 WeakPolarHBondContact O-CB 3.38Å; F235-C239 PolarHBondContact O-N 3.13Å; F235-C239 PolarHBondContact O-SG 2.88Å; F235-C239 VanDerWaalsContact O-SG 3.34Å; R236-C239 PolarHBondContact O-N 3.33Å; H237-C239 VanDerWaalsContact C-N 3.29Å; H237-C239 PolarHBondContact O-N 2.73Å
240	Q	89.8	Confident	92.1	Very high	85 Å²	85	67.8 Å²	67.8	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-81.2	-27.7	179.4	-73.1	176.8	-37.3	0	0	112.9	R236 H237 P242	R236-Q240 HydrophobicContact CG-CG 4.4Å; R236-Q240 VanDerWaalsContact NE-NE2 3.18Å; R236-Q240 WeakPolarHBondContact O-CG 3.49Å; R236-Q240 PolarHBondContact O-N 3.25Å; H237-Q240 PolarHBondContact O-N 3.46Å; H237-Q240 VanDerWaalsContact O-N 3.13Å; Q240-P242 WeakPolarHBondContact O-CD 3.45Å
241	E	89.8	Confident	91.7	Very high	56 Å²	56	70.5 Å²	70.5	26%	0.262	35%	0.348	S	S	.	.			trans	-79.1	120.2	-175.8	-171.4	56.6	-135.2	0	0	111.5	H237 K244 L247	H237-E241 PolarHBondContact O-N 3.45Å; E241-K244 WeakPolarHBondContact O-CG 3.36Å; E241-L247 HydrophobicContact CB-CD2 3.97Å; E241-L247 HydrophobicContact CG-CB 4.09Å; E241-L247 HydrophobicContact CG-CD2 4.12Å
242	P	87.9	Confident	91.4	Very high	110 Å²	110	70.4 Å²	70.4	71%	0.714	34%	0.343	S	S	*	.	S	Bend	trans	-67.1	-36.7	178.5	25.2	-34.4	0	0	0	112.1	Q240 K244	Q240-P242 WeakPolarHBondContact O-CD 3.45Å; P242-K244 PolarHBondContact O-N 2.97Å
243	R	90.9	Very high	91.1	Very high	165 Å²	165	74.7 Å²	74.7	62%	0.623	37%	0.365	S	S	*	.			trans	-96.7	69.6	-178.5	-68.2	-175.1	-73.2	165.6	-13.3	111.1	L245 D246 L247	R243-L245 VanDerWaalsContact C-N 3.31Å; R243-L245 PolarHBondContact O-N 3.37Å; R243-D246 HydrophobicContact CB-CB 4.02Å; R243-D246 WeakPolarHBondContact CD-OD2 3.47Å; R243-D246 IonicContact CZ-OD2 3.43Å; R243-D246 IonicContact NE-OD2 3.38Å; R243-D246 IonicContact NH1-OD2 3.41Å; R243-D246 PolarHBondContact NH1-OD2 3.49Å; R243-D246 PolarHBondContact O-N 3.32Å; R243-D246 VanDerWaalsContact O-N 3.14Å; R243-L247 PolarHBondContact O-N 2.89Å; R243-L247 VanDerWaalsContact O-N 3.1Å
244	K	90.8	Very high	91	Very high	101 Å²	101	77.4 Å²	77.4	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-55.1	-42.9	-176.6	-64	178.2	-178.8	179.2	0	113.4	F238 E241 P242 L247 I248	F238-K244 HydrophobicContact CE1-CD 4.19Å; F238-K244 HydrophobicContact CE2-CB 3.79Å; F238-K244 HydrophobicContact CE2-CD 4.2Å; F238-K244 HydrophobicContact CE2-CG 4.02Å; F238-K244 HydrophobicContact CZ-CB 4.14Å; F238-K244 HydrophobicContact CZ-CD 3.79Å; F238-K244 HydrophobicContact CZ-CG 4.15Å; E241-K244 WeakPolarHBondContact O-CG 3.36Å; P242-K244 PolarHBondContact O-N 2.97Å; K244-L247 PolarHBondContact O-N 3.35Å; K244-I248 WeakPolarHBondContact O-CG1 3.38Å; K244-I248 PolarHBondContact O-N 3.33Å; K244-I248 VanDerWaalsContact O-N 3.1Å
245	L	89.7	Confident	91	Very high	121 Å²	121	76 Å²	76	63%	0.634	38%	0.376	S	S	*	.	H	α-helix	trans	-66.2	-40	179.5	-67.2	178	0	0	0	111.7	R243 L247 I248 L249	R243-L245 VanDerWaalsContact C-N 3.31Å; R243-L245 PolarHBondContact O-N 3.37Å; L245-L247 PolarHBondContact O-N 2.88Å; L245-I248 PolarHBondContact O-N 3.27Å; L245-L249 VanDerWaalsContact O-CB 3.29Å; L245-L249 WeakPolarHBondContact O-CB 3.46Å; L245-L249 WeakPolarHBondContact O-CG 3.39Å; L245-L249 PolarHBondContact O-N 3.34Å
246	D	88.2	Confident	90.9	Very high	59 Å²	59	70.4 Å²	70.4	32%	0.316	36%	0.357	S	S	.	.	H	α-helix	trans	-65	-41.2	177.5	-68.8	-7.5	0	0	0	111.2	R243 I248 H250 H251	R243-D246 HydrophobicContact CB-CB 4.02Å; R243-D246 WeakPolarHBondContact CD-OD2 3.47Å; R243-D246 IonicContact CZ-OD2 3.43Å; R243-D246 IonicContact NE-OD2 3.38Å; R243-D246 IonicContact NH1-OD2 3.41Å; R243-D246 PolarHBondContact NH1-OD2 3.49Å; R243-D246 PolarHBondContact O-N 3.32Å; R243-D246 VanDerWaalsContact O-N 3.14Å; D246-I248 PolarHBondContact O-N 2.92Å; D246-H250 VanDerWaalsContact O-CB 3.29Å; D246-H250 WeakPolarHBondContact O-CB 3.34Å; D246-H250 PolarHBondContact O-N 2.85Å; D246-H251 PolarHBondContact O-ND1 3.05Å
247	L	88.7	Confident	90.9	Very high	6 Å²	6	75.7 Å²	75.7	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-60.6	-45.8	175.7	-177.5	65	0	0	0	111.5	E241 R243 K244 L245 H251 F252	E241-L247 HydrophobicContact CB-CD2 3.97Å; E241-L247 HydrophobicContact CG-CB 4.09Å; E241-L247 HydrophobicContact CG-CD2 4.12Å; R243-L247 PolarHBondContact O-N 2.89Å; R243-L247 VanDerWaalsContact O-N 3.1Å; K244-L247 PolarHBondContact O-N 3.35Å; L245-L247 PolarHBondContact O-N 2.88Å; L247-H251 HydrophobicContact CD1-CB 4.31Å; L247-H251 VanDerWaalsContact O-CB 3.24Å; L247-H251 WeakPolarHBondContact O-CB 3.32Å; L247-H251 PolarHBondContact O-N 2.94Å; L247-F252 HydrophobicContact CD1-CE1 4.03Å; L247-F252 HydrophobicContact CD1-CZ 3.99Å; L247-F252 HydrophobicContact CD2-CE2 3.95Å; L247-F252 HydrophobicContact CD2-CZ 3.88Å; L247-F252 HydrophobicContact CG-CD2 4.45Å; L247-F252 HydrophobicContact CG-CE1 4.29Å; L247-F252 HydrophobicContact CG-CE2 3.97Å; L247-F252 HydrophobicContact CG-CZ 3.88Å; L247-F252 PolarHBondContact O-N 3.46Å; L247-F252 VanDerWaalsContact O-N 3.1Å
248	I	90.6	Very high	91	Very high	63 Å²	63	78.1 Å²	78.1	32%	0.323	40%	0.402	S	S	.	.	I	π-helix	trans	-67.6	-56.5	179.4	-67	168.9	0	0	0	110.6	F238 K244 L245 D246 F252 L253	F238-I248 HydrophobicContact CD2-CD1 4.46Å; F238-I248 HydrophobicContact CE2-CD1 3.66Å; F238-I248 HydrophobicContact CE2-CG1 4.24Å; F238-I248 HydrophobicContact CZ-CD1 4.43Å; K244-I248 WeakPolarHBondContact O-CG1 3.38Å; K244-I248 PolarHBondContact O-N 3.33Å; K244-I248 VanDerWaalsContact O-N 3.1Å; L245-I248 PolarHBondContact O-N 3.27Å; D246-I248 PolarHBondContact O-N 2.92Å; I248-F252 PolarHBondContact O-N 3.49Å; I248-L253 VanDerWaalsContact O-CB 3.29Å; I248-L253 WeakPolarHBondContact O-CB 3.48Å; I248-L253 PolarHBondContact O-N 3.27Å
249	L	89.8	Confident	91.1	Very high	94 Å²	94	76.4 Å²	76.4	49%	0.492	40%	0.397	S	S	.	.	I	π-helix	trans	-73	-34.2	-168.9	-67.3	174.2	0	0	0	113.4	L245 P254	L245-L249 VanDerWaalsContact O-CB 3.29Å; L245-L249 WeakPolarHBondContact O-CB 3.46Å; L245-L249 WeakPolarHBondContact O-CG 3.39Å; L245-L249 PolarHBondContact O-N 3.34Å; L249-P254 WeakPolarHBondContact O-CD 3.48Å; L249-P254 WeakPolarHBondContact O-CG 3.33Å
250	H	86.9	Confident	91.1	Very high	130 Å²	130	76 Å²	76	60%	0.602	39%	0.39	S	S	*	.	I	π-helix	trans	-101.8	-13.5	-175.7	-63.4	83.6	0	0	0	113.9	D246	D246-H250 VanDerWaalsContact O-CB 3.29Å; D246-H250 WeakPolarHBondContact O-CB 3.34Å; D246-H250 PolarHBondContact O-N 2.85Å
251	H	87.3	Confident	91.4	Very high	57 Å²	57	73.7 Å²	73.7	26%	0.264	38%	0.383	S	S	.	.	I	π-helix	trans	-120.8	-64.7	-179.3	-53.8	74.4	0	0	0	112.1	D246 L247 P254 V255	D246-H251 PolarHBondContact O-ND1 3.05Å; L247-H251 HydrophobicContact CD1-CB 4.31Å; L247-H251 VanDerWaalsContact O-CB 3.24Å; L247-H251 WeakPolarHBondContact O-CB 3.32Å; L247-H251 PolarHBondContact O-N 2.94Å; H251-P254 WeakPolarHBondContact O-CD 3.4Å; H251-V255 VanDerWaalsContact O-CB 3.24Å; H251-V255 WeakPolarHBondContact O-CB 3.39Å; H251-V255 WeakPolarHBondContact O-CG2 3.24Å; H251-V255 PolarHBondContact O-N 2.93Å; H251-V255 VanDerWaalsContact O-N 3.16Å
252	F	91.1	Very high	91.6	Very high	53 Å²	53	76 Å²	76	23%	0.232	40%	0.396	C	S	.	.	I	π-helix	trans	-69.9	-43.5	-172	-65.2	-12.4	0	0	0	113	Y212 L234 L247 I248 G256	Y212-F252 WeakPolarHBondContact OH-CE1 3.48Å; Y212-F252 WeakPolarHBondContact OH-CZ 3.44Å; L234-F252 HydrophobicContact CD2-CZ 4.26Å; L247-F252 HydrophobicContact CD1-CE1 4.03Å; L247-F252 HydrophobicContact CD1-CZ 3.99Å; L247-F252 HydrophobicContact CD2-CE2 3.95Å; L247-F252 HydrophobicContact CD2-CZ 3.88Å; L247-F252 HydrophobicContact CG-CD2 4.45Å; L247-F252 HydrophobicContact CG-CE1 4.29Å; L247-F252 HydrophobicContact CG-CE2 3.97Å; L247-F252 HydrophobicContact CG-CZ 3.88Å; L247-F252 PolarHBondContact O-N 3.46Å; L247-F252 VanDerWaalsContact O-N 3.1Å; I248-F252 PolarHBondContact O-N 3.49Å; F252-G256 PolarHBondContact O-N 3.39Å
253	L	92.7	Very high	91.9	Very high	105 Å²	105	70.8 Å²	70.8	55%	0.55	36%	0.363	S	S	.	.	H	α-helix	trans	-68.6	-45.9	-178.2	-171.1	129.3	0	0	0	112.4	I248 G256 F257	I248-L253 VanDerWaalsContact O-CB 3.29Å; I248-L253 WeakPolarHBondContact O-CB 3.48Å; I248-L253 PolarHBondContact O-N 3.27Å; L253-G256 PolarHBondContact O-N 2.97Å; L253-F257 WeakPolarHBondContact O-CB 3.41Å; L253-F257 PolarHBondContact O-N 3.19Å
254	P	94.6	Very high	92.1	Very high	57 Å²	57	65.2 Å²	65.2	37%	0.37	35%	0.345	S	S	.	.	H	α-helix	trans	-64.8	-41.4	176.4	-24.7	37	0	0	0	112.8	L249 H251 A258	L249-P254 WeakPolarHBondContact O-CD 3.48Å; L249-P254 WeakPolarHBondContact O-CG 3.33Å; H251-P254 WeakPolarHBondContact O-CD 3.4Å; P254-A258 VanDerWaalsContact O-CB 3.28Å; P254-A258 WeakPolarHBondContact O-CB 3.2Å; P254-A258 PolarHBondContact O-N 2.9Å
255	V	94.3	Very high	92.3	Very high	16 Å²	16	65.7 Å²	65.7	10%	0.097	35%	0.35	C	S	.	.	H	α-helix	trans	-63.5	-50.4	176.8	169.2	0	0	0	0	110.4	V210 A217 H251 F257 A258 T259	V210-V255 HydrophobicContact CG1-CG2 4.38Å; A217-V255 HydrophobicContact CB-CG1 3.82Å; H251-V255 VanDerWaalsContact O-CB 3.24Å; H251-V255 WeakPolarHBondContact O-CB 3.39Å; H251-V255 WeakPolarHBondContact O-CG2 3.24Å; H251-V255 PolarHBondContact O-N 2.93Å; H251-V255 VanDerWaalsContact O-N 3.16Å; V255-F257 PolarHBondContact O-N 3.38Å; V255-A258 PolarHBondContact O-N 3.47Å; V255-T259 WeakPolarHBondContact O-CG2 3.36Å; V255-T259 PolarHBondContact O-N 3.21Å; V255-T259 PolarHBondContact O-OG1 3.46Å
256	G	93.4	Very high	92.5	Very high	20 Å²	20	60.9 Å²	60.9	21%	0.206	33%	0.325	C	S	.	.	H	α-helix	trans	-59.9	-45.2	178.9	0	0	0	0	0	112.2	F252 L253 T259 L260	F252-G256 PolarHBondContact O-N 3.39Å; L253-G256 PolarHBondContact O-N 2.97Å; G256-T259 PolarHBondContact O-N 3.17Å; G256-T259 PolarHBondContact O-OG1 3.05Å; G256-L260 VanDerWaalsContact O-CB 3.23Å; G256-L260 WeakPolarHBondContact O-CB 3.31Å; G256-L260 VanDerWaalsContact O-CG 3.29Å; G256-L260 WeakPolarHBondContact O-CG 3.39Å; G256-L260 PolarHBondContact O-N 2.7Å
257	F	94.6	Very high	92.8	Very high	148 Å²	148	58 Å²	58	65%	0.649	31%	0.31	S	S	*	.	H	α-helix	trans	-60.4	-47.7	176.3	-179.1	-98.2	0	0	0	111.7	L253 V255 S261	L253-F257 WeakPolarHBondContact O-CB 3.41Å; L253-F257 PolarHBondContact O-N 3.19Å; V255-F257 PolarHBondContact O-N 3.38Å; F257-S261 WeakPolarHBondContact O-CB 3.39Å; F257-S261 PolarHBondContact O-N 3.16Å; F257-S261 PolarHBondContact O-OG 2.99Å
258	A	95.1	Very high	93.1	Very high	57 Å²	57	62.3 Å²	62.3	47%	0.471	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-46.5	179.2	0	0	0	0	0	112	P254 V255 L262	P254-A258 VanDerWaalsContact O-CB 3.28Å; P254-A258 WeakPolarHBondContact O-CB 3.2Å; P254-A258 PolarHBondContact O-N 2.9Å; V255-A258 PolarHBondContact O-N 3.47Å; A258-L262 WeakPolarHBondContact O-CB 3.12Å; A258-L262 PolarHBondContact O-N 3.28Å
259	T	93.9	Very high	93.3	Very high	29 Å²	29	65 Å²	65	18%	0.178	34%	0.339	C	S	.	.	H	α-helix	trans	-70.5	-39.3	-178.8	53.7	0	0	0	0	113	A217 V255 G256 L262 S263	A217-T259 HydrophobicContact CB-CG2 3.82Å; V255-T259 WeakPolarHBondContact O-CG2 3.36Å; V255-T259 PolarHBondContact O-N 3.21Å; V255-T259 PolarHBondContact O-OG1 3.46Å; G256-T259 PolarHBondContact O-N 3.17Å; G256-T259 PolarHBondContact O-OG1 3.05Å; T259-L262 PolarHBondContact O-N 2.89Å; T259-S263 PolarHBondContact O-N 3.25Å
260	L	93.9	Very high	93.4	Very high	64 Å²	64	64.1 Å²	64.1	34%	0.335	33%	0.332	S	S	.	.	H	α-helix	trans	-68.3	-41.7	176.4	-75.5	167	0	0	0	111.1	I221 G256 L262 S263 L264 L276	I221-L260 HydrophobicContact CD1-CD2 3.62Å; I221-L260 HydrophobicContact CD1-CG 4.25Å; G256-L260 VanDerWaalsContact O-CB 3.23Å; G256-L260 WeakPolarHBondContact O-CB 3.31Å; G256-L260 VanDerWaalsContact O-CG 3.29Å; G256-L260 WeakPolarHBondContact O-CG 3.39Å; G256-L260 PolarHBondContact O-N 2.7Å; L260-L262 VanDerWaalsContact C-N 3.31Å; L260-L262 PolarHBondContact O-N 3.22Å; L260-S263 PolarHBondContact O-N 3.04Å; L260-L264 WeakPolarHBondContact O-CB 3.33Å; L260-L264 VanDerWaalsContact O-CG 3.31Å; L260-L264 WeakPolarHBondContact O-CG 3.36Å; L260-L264 PolarHBondContact O-N 2.95Å; L260-L276 HydrophobicContact CD2-CD1 4.42Å
261	S	94.8	Very high	93.7	Very high	37 Å²	37	59.2 Å²	59.2	26%	0.259	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-43.9	175.5	-60.5	0	0	0	0	111	F257 L264 M265	F257-S261 WeakPolarHBondContact O-CB 3.39Å; F257-S261 PolarHBondContact O-N 3.16Å; F257-S261 PolarHBondContact O-OG 2.99Å; S261-L264 PolarHBondContact O-N 3.37Å; S261-M265 VanDerWaalsContact O-CG 3.28Å; S261-M265 WeakPolarHBondContact O-CG 3.38Å; S261-M265 PolarHBondContact O-N 2.84Å
262	L	93.8	Very high	94	Very high	103 Å²	103	58.7 Å²	58.7	54%	0.539	32%	0.318	S	S	.	.	H	α-helix	trans	-61.2	-46	175	-179.1	62	0	0	0	111.9	A258 T259 L260 M265 I266	A258-L262 WeakPolarHBondContact O-CB 3.12Å; A258-L262 PolarHBondContact O-N 3.28Å; T259-L262 PolarHBondContact O-N 2.89Å; L260-L262 VanDerWaalsContact C-N 3.31Å; L260-L262 PolarHBondContact O-N 3.22Å; L262-M265 PolarHBondContact O-N 2.68Å; L262-I266 HydrophobicContact CD1-CD1 4.12Å; L262-I266 HydrophobicContact CD1-CG1 4.39Å; L262-I266 HydrophobicContact CG-CD1 3.96Å; L262-I266 VanDerWaalsContact O-CG1 3.31Å; L262-I266 WeakPolarHBondContact O-CG1 2.99Å; L262-I266 PolarHBondContact O-N 3.45Å
263	S	94.1	Very high	94.1	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.014	33%	0.325	C	S	.	.	H	α-helix	trans	-59	-48.3	175.8	-170.6	0	0	0	0	111.3	I221 T259 L260 M265 I266 D267 Q278	I221-S263 WeakPolarHBondContact CG2-OG 3.41Å; T259-S263 PolarHBondContact O-N 3.25Å; L260-S263 PolarHBondContact O-N 3.04Å; S263-M265 VanDerWaalsContact C-N 3.29Å; S263-M265 PolarHBondContact O-N 3.2Å; S263-I266 PolarHBondContact O-N 3.5Å; S263-D267 WeakPolarHBondContact O-CB 3.24Å; S263-D267 VanDerWaalsContact O-CG 3.25Å; S263-D267 PolarHBondContact O-N 3.43Å; S263-D267 VanDerWaalsContact O-OD2 3.1Å; S263-D267 PolarHBondContact OG-OD2 2.89Å; S263-D267 VanDerWaalsContact OG-OD2 3.05Å; S263-Q278 PolarHBondContact OG-NE2 2.81Å
264	L	94.8	Very high	94.2	Very high	48 Å²	48	63.4 Å²	63.4	25%	0.251	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-38.9	179.6	-74.4	173.7	0	0	0	111.9	L260 S261 R268 W274 T275 L276	L260-L264 WeakPolarHBondContact O-CB 3.33Å; L260-L264 VanDerWaalsContact O-CG 3.31Å; L260-L264 WeakPolarHBondContact O-CG 3.36Å; L260-L264 PolarHBondContact O-N 2.95Å; S261-L264 PolarHBondContact O-N 3.37Å; L264-R268 WeakPolarHBondContact O-CB 3.45Å; L264-R268 PolarHBondContact O-N 2.87Å; L264-W274 HydrophobicContact CB-CE3 4.18Å; L264-W274 HydrophobicContact CB-CZ3 4Å; L264-T275 WeakPolarHBondContact CD2-O 3.33Å; L264-L276 HydrophobicContact CD2-CB 4.19Å; L264-L276 HydrophobicContact CD2-CD1 3.97Å
265	M	95.9	Very high	94.1	Very high	110 Å²	110	61 Å²	61	54%	0.542	32%	0.315	S	S	.	.	H	α-helix	trans	-65.7	-47.6	175.2	-73	177.5	70	0	0	111.7	S261 L262 S263 R268 I269	S261-M265 VanDerWaalsContact O-CG 3.28Å; S261-M265 WeakPolarHBondContact O-CG 3.38Å; S261-M265 PolarHBondContact O-N 2.84Å; L262-M265 PolarHBondContact O-N 2.68Å; S263-M265 VanDerWaalsContact C-N 3.29Å; S263-M265 PolarHBondContact O-N 3.2Å; M265-R268 PolarHBondContact O-N 3.27Å; M265-I269 WeakPolarHBondContact O-CD1 3.35Å; M265-I269 VanDerWaalsContact O-CG1 3.27Å; M265-I269 WeakPolarHBondContact O-CG1 3.37Å; M265-I269 PolarHBondContact O-N 2.69Å
266	I	94.5	Very high	94	Very high	20 Å²	20	63.9 Å²	63.9	10%	0.103	33%	0.329	C	S	.	.	H	α-helix	trans	-58.6	-51.8	177.1	-69.3	167.1	0	0	0	109.7	L110 L262 S263 R268 I269 F270	L110-I266 HydrophobicContact CD2-CD1 4.12Å; L110-I266 HydrophobicContact CD2-CG1 4.31Å; L110-I266 HydrophobicContact CD2-CG2 4.27Å; L262-I266 HydrophobicContact CD1-CD1 4.12Å; L262-I266 HydrophobicContact CD1-CG1 4.39Å; L262-I266 HydrophobicContact CG-CD1 3.96Å; L262-I266 VanDerWaalsContact O-CG1 3.31Å; L262-I266 WeakPolarHBondContact O-CG1 2.99Å; L262-I266 PolarHBondContact O-N 3.45Å; S263-I266 PolarHBondContact O-N 3.5Å; I266-R268 VanDerWaalsContact C-N 3.31Å; I266-R268 PolarHBondContact O-N 3.44Å; I266-I269 WeakPolarHBondContact O-CB 3.13Å; I266-I269 PolarHBondContact O-N 2.62Å; I266-I269 VanDerWaalsContact O-N 3.14Å; I266-F270 HydrophobicContact CG2-CD2 4Å; I266-F270 HydrophobicContact CG2-CE2 4.12Å; I266-F270 VanDerWaalsContact O-CD2 3.27Å; I266-F270 WeakPolarHBondContact O-CD2 3.18Å; I266-F270 PolarHBondContact O-N 3.39Å
267	D	93.9	Very high	94	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-34.5	-177.6	-65.7	-36.3	0	0	0	110.9	S105 Y106 S263 I269 F270 F271 V277	S105-D267 PolarHBondContact OG-OD1 2.97Å; S105-D267 PolarHBondContact OG-OD2 3.4Å; Y106-D267 PolarHBondContact N-OD1 3.46Å; Y106-D267 VanDerWaalsContact N-OD1 3.12Å; S263-D267 WeakPolarHBondContact O-CB 3.24Å; S263-D267 VanDerWaalsContact O-CG 3.25Å; S263-D267 PolarHBondContact O-N 3.43Å; S263-D267 VanDerWaalsContact O-OD2 3.1Å; S263-D267 PolarHBondContact OG-OD2 2.89Å; S263-D267 VanDerWaalsContact OG-OD2 3.05Å; D267-I269 PolarHBondContact O-N 2.78Å; D267-F270 PolarHBondContact O-N 3.27Å; D267-F271 HydrophobicContact CB-CD2 3.94Å; D267-F271 HydrophobicContact CB-CE2 4.2Å; D267-F271 VanDerWaalsContact O-CB 3.29Å; D267-F271 WeakPolarHBondContact O-CB 3.44Å; D267-F271 WeakPolarHBondContact O-CD2 3.44Å; D267-F271 PolarHBondContact O-N 3.11Å; D267-V277 HydrophobicContact CB-CG2 4.32Å; D267-V277 WeakPolarHBondContact OD2-CG2 3.43Å
268	R	94.9	Very high	93.9	Very high	96 Å²	96	56.7 Å²	56.7	36%	0.362	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-37.2	173.1	174.8	61.1	-176.2	88.1	-10.7	113.3	L264 M265 I266 G272 W274	L264-R268 WeakPolarHBondContact O-CB 3.45Å; L264-R268 PolarHBondContact O-N 2.87Å; M265-R268 PolarHBondContact O-N 3.27Å; I266-R268 VanDerWaalsContact C-N 3.31Å; I266-R268 PolarHBondContact O-N 3.44Å; R268-G272 PolarHBondContact NH1-O 3.16Å; R268-G272 PolarHBondContact NH2-O 3.12Å; R268-G272 WeakPolarHBondContact O-CA 3.14Å; R268-G272 PolarHBondContact O-N 3.48Å; R268-W274 HydrophobicContact CB-CD2 4.18Å; R268-W274 HydrophobicContact CB-CE3 3.85Å; R268-W274 HydrophobicContact CB-CZ3 4.03Å; R268-W274 HydrophobicContact CG-CD2 4Å; R268-W274 HydrophobicContact CG-CE3 4.14Å; R268-W274 HydrophobicContact CG-CH2 4.36Å; R268-W274 HydrophobicContact CG-CZ2 4.22Å; R268-W274 HydrophobicContact CG-CZ3 4.32Å
269	I	94.5	Very high	93.6	Very high	119 Å²	119	59.3 Å²	59.3	61%	0.61	29%	0.294	S	S	*	.	H	α-helix	trans	-66.7	-47.2	179	-70.7	163.3	0	0	0	109.8	M265 I266 D267	M265-I269 WeakPolarHBondContact O-CD1 3.35Å; M265-I269 VanDerWaalsContact O-CG1 3.27Å; M265-I269 WeakPolarHBondContact O-CG1 3.37Å; M265-I269 PolarHBondContact O-N 2.69Å; I266-I269 WeakPolarHBondContact O-CB 3.13Å; I266-I269 PolarHBondContact O-N 2.62Å; I266-I269 VanDerWaalsContact O-N 3.14Å; D267-I269 PolarHBondContact O-N 2.78Å
270	F	92.3	Very high	93.5	Very high	76 Å²	76	60 Å²	60	33%	0.333	30%	0.296	S	S	.	.	H	α-helix	trans	-85	-37.7	-173.9	-69.2	-72.2	0	0	0	114	M88 Y106 L110 I266 D267	M88-F270 HydrophobicContact CE-CD1 4.04Å; M88-F270 HydrophobicContact CE-CD2 4.26Å; M88-F270 HydrophobicContact CE-CE1 3.43Å; M88-F270 VanDerWaalsContact CE-CE1 3.43Å; M88-F270 HydrophobicContact CE-CE2 3.69Å; M88-F270 HydrophobicContact CE-CG 4.44Å; M88-F270 HydrophobicContact CE-CZ 3.24Å; M88-F270 HydrophobicContact CG-CD1 4.48Å; M88-F270 HydrophobicContact CG-CE1 4.26Å; Y106-F270 HydrophobicContact CD1-CB 4.16Å; Y106-F270 HydrophobicContact CD1-CD2 4.39Å; Y106-F270 HydrophobicContact CD1-CG 4.12Å; Y106-F270 HydrophobicContact CD2-CB 3.42Å; Y106-F270 VanDerWaalsContact CD2-CB 3.42Å; Y106-F270 HydrophobicContact CD2-CD2 4.34Å; Y106-F270 HydrophobicContact CD2-CG 4.1Å; Y106-F270 HydrophobicContact CE1-CB 4.26Å; Y106-F270 HydrophobicContact CE1-CG 4.5Å; Y106-F270 HydrophobicContact CE2-CB 3.49Å; Y106-F270 VanDerWaalsContact CE2-CB 3.49Å; Y106-F270 HydrophobicContact CE2-CG 4.44Å; Y106-F270 HydrophobicContact CG-CB 3.76Å; Y106-F270 AromaticContact CG-CD2 3.93Å; Y106-F270 HydrophobicContact CG-CD2 3.93Å; Y106-F270 AromaticContact CG-CG 3.91Å; Y106-F270 HydrophobicContact CG-CG 3.91Å; L110-F270 HydrophobicContact CD1-CE2 4.11Å; L110-F270 HydrophobicContact CD1-CZ 3.98Å; I266-F270 HydrophobicContact CG2-CD2 4Å; I266-F270 HydrophobicContact CG2-CE2 4.12Å; I266-F270 VanDerWaalsContact O-CD2 3.27Å; I266-F270 WeakPolarHBondContact O-CD2 3.18Å; I266-F270 PolarHBondContact O-N 3.39Å; D267-F270 PolarHBondContact O-N 3.27Å
271	F	93.3	Very high	93.2	Very high	27 Å²	27	57.9 Å²	57.9	12%	0.118	28%	0.284	C	S	.	.	H	α-helix	trans	-84.9	-8.5	177.9	-68	-60.8	0	0	0	114.2	W99 R102 R104 Y106 D267 Q273 T275 V277	W99-F271 HydrophobicContact CE3-CZ 4.29Å; W99-F271 VanDerWaalsContact O-CE1 3.23Å; W99-F271 WeakPolarHBondContact O-CE1 3.47Å; R102-F271 HydrophobicContact CB-CD1 4.27Å; R102-F271 HydrophobicContact CB-CE1 3.95Å; R102-F271 HydrophobicContact CB-CE2 4.22Å; R102-F271 HydrophobicContact CB-CZ 3.92Å; R102-F271 HydrophobicContact CG-CD1 3.73Å; R102-F271 HydrophobicContact CG-CE1 3.79Å; R102-F271 HydrophobicContact CG-CG 4.17Å; R102-F271 HydrophobicContact CG-CZ 4.27Å; R104-F271 WeakPolarHBondContact O-CZ 3.09Å; Y106-F271 HydrophobicContact CD2-CD2 4.16Å; Y106-F271 HydrophobicContact CD2-CE1 4.29Å; Y106-F271 AromaticContact CD2-CE2 3.68Å; Y106-F271 HydrophobicContact CD2-CE2 3.68Å; Y106-F271 AromaticContact CD2-CZ 3.76Å; Y106-F271 HydrophobicContact CD2-CZ 3.76Å; Y106-F271 AromaticContact CE2-CD1 3.81Å; Y106-F271 HydrophobicContact CE2-CD1 3.81Å; Y106-F271 HydrophobicContact CE2-CD2 4.03Å; Y106-F271 AromaticContact CE2-CE1 3.4Å; Y106-F271 HydrophobicContact CE2-CE1 3.4Å; Y106-F271 VanDerWaalsContact CE2-CE1 3.4Å; Y106-F271 AromaticContact CE2-CE2 3.64Å; Y106-F271 HydrophobicContact CE2-CE2 3.64Å; Y106-F271 HydrophobicContact CE2-CG 4.11Å; Y106-F271 AromaticContact CE2-CZ 3.31Å; Y106-F271 HydrophobicContact CE2-CZ 3.31Å; D267-F271 HydrophobicContact CB-CD2 3.94Å; D267-F271 HydrophobicContact CB-CE2 4.2Å; D267-F271 VanDerWaalsContact O-CB 3.29Å; D267-F271 WeakPolarHBondContact O-CB 3.44Å; D267-F271 WeakPolarHBondContact O-CD2 3.44Å; D267-F271 PolarHBondContact O-N 3.11Å; F271-Q273 PolarHBondContact O-N 3.38Å; F271-Q273 VanDerWaalsContact O-N 3.16Å; F271-Q273 PolarHBondContact O-NE2 3.1Å; F271-T275 HydrophobicContact CD2-CG2 4.44Å; F271-V277 HydrophobicContact CE2-CG2 3.94Å
272	G	93.4	Very high	92.8	Very high	45 Å²	45	59.9 Å²	59.9	46%	0.464	29%	0.292	S	S	.	.	S	Bend	trans	71.4	1.8	-177.3	0	0	0	0	0	115.1	R268	R268-G272 PolarHBondContact NH1-O 3.16Å; R268-G272 PolarHBondContact NH2-O 3.12Å; R268-G272 WeakPolarHBondContact O-CA 3.14Å; R268-G272 PolarHBondContact O-N 3.48Å
273	Q	93.4	Very high	92.4	Very high	79 Å²	79	59.7 Å²	59.7	37%	0.369	29%	0.287	S	S	.	.	S	Bend	trans	-150.2	156.9	178.5	72.5	-155.6	-78.3	0	0	112	F271 T275	F271-Q273 PolarHBondContact O-N 3.38Å; F271-Q273 VanDerWaalsContact O-N 3.16Å; F271-Q273 PolarHBondContact O-NE2 3.1Å; Q273-T275 PolarHBondContact O-N 3.13Å; Q273-T275 VanDerWaalsContact O-N 3.15Å; Q273-T275 PolarHBondContact O-OG1 3.18Å
274	W	94.4	Very high	91.8	Very high	179 Å²	179	60.2 Å²	60.2	68%	0.678	29%	0.289	S	S	*	.			trans	-66.1	115.7	178.8	-68.8	108.2	0	0	0	109.8	L264 R268	L264-W274 HydrophobicContact CB-CE3 4.18Å; L264-W274 HydrophobicContact CB-CZ3 4Å; R268-W274 HydrophobicContact CB-CD2 4.18Å; R268-W274 HydrophobicContact CB-CE3 3.85Å; R268-W274 HydrophobicContact CB-CZ3 4.03Å; R268-W274 HydrophobicContact CG-CD2 4Å; R268-W274 HydrophobicContact CG-CE3 4.14Å; R268-W274 HydrophobicContact CG-CH2 4.36Å; R268-W274 HydrophobicContact CG-CZ2 4.22Å; R268-W274 HydrophobicContact CG-CZ3 4.32Å
275	T	92.2	Very high	91.1	Very high	7 Å²	7	60 Å²	60	4%	0.043	29%	0.288	C	S	.	.			trans	-132.8	121.4	-174.5	-55.2	0	0	0	0	109.2	R102 L264 F271 Q273 V277 N280	R102-T275 HydrophobicContact CB-CG2 3.65Å; R102-T275 HydrophobicContact CG-CG2 4.38Å; L264-T275 WeakPolarHBondContact CD2-O 3.33Å; F271-T275 HydrophobicContact CD2-CG2 4.44Å; Q273-T275 PolarHBondContact O-N 3.13Å; Q273-T275 VanDerWaalsContact O-N 3.15Å; Q273-T275 PolarHBondContact O-OG1 3.18Å; T275-V277 HydrophobicContact CG2-CG2 4.11Å; T275-V277 PolarHBondContact O-N 3.19Å; T275-N280 WeakPolarHBondContact CG2-ND2 2.99Å
276	L	93.3	Very high	90.2	Very high	75 Å²	75	58.3 Å²	58.3	39%	0.393	28%	0.284	S	S	.	.			trans	-91.8	86.6	170.6	-175.2	63.7	0	0	0	109.4	L260 L264 Q278 F279 N280	L260-L276 HydrophobicContact CD2-CD1 4.42Å; L264-L276 HydrophobicContact CD2-CB 4.19Å; L264-L276 HydrophobicContact CD2-CD1 3.97Å; L276-Q278 VanDerWaalsContact C-N 3.26Å; L276-Q278 PolarHBondContact O-N 2.64Å; L276-F279 HydrophobicContact CB-CB 4.28Å; L276-F279 HydrophobicContact CD2-CB 3.7Å; L276-F279 HydrophobicContact CG-CB 3.85Å; L276-F279 WeakPolarHBondContact O-CB 3.18Å; L276-F279 PolarHBondContact O-N 2.68Å; L276-F279 VanDerWaalsContact O-N 3.12Å; L276-N280 PolarHBondContact O-N 3.27Å
277	V	92.3	Very high	89.2	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-55.9	-40.8	-175.3	172.3	0	0	0	0	112.2	L103 R104 D267 F271 T275 F279 N280 F281	L103-V277 WeakPolarHBondContact O-CG1 3.38Å; R104-V277 VanDerWaalsContact C-CG1 3.41Å; D267-V277 HydrophobicContact CB-CG2 4.32Å; D267-V277 WeakPolarHBondContact OD2-CG2 3.43Å; F271-V277 HydrophobicContact CE2-CG2 3.94Å; T275-V277 HydrophobicContact CG2-CG2 4.11Å; T275-V277 PolarHBondContact O-N 3.19Å; V277-F279 PolarHBondContact O-N 3.27Å; V277-N280 PolarHBondContact O-N 3.07Å; V277-N280 VanDerWaalsContact O-N 3.12Å; V277-F281 WeakPolarHBondContact O-CB 3.32Å; V277-F281 PolarHBondContact O-N 2.92Å
278	Q	92.2	Very high	88.3	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.065	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-32.1	-176.6	-62.3	74.9	17.1	0	0	111.6	F220 I221 P224 S263 L276 L282	F220-Q278 HydrophobicContact CE1-CB 4.2Å; F220-Q278 HydrophobicContact CE1-CG 4Å; F220-Q278 HydrophobicContact CZ-CB 4.4Å; I221-Q278 PolarHBondContact O-NE2 3.23Å; P224-Q278 HydrophobicContact CG-CB 4.15Å; P224-Q278 HydrophobicContact CG-CG 3.98Å; S263-Q278 PolarHBondContact OG-NE2 2.81Å; L276-Q278 VanDerWaalsContact C-N 3.26Å; L276-Q278 PolarHBondContact O-N 2.64Å; Q278-L282 PolarHBondContact O-N 3.36Å; Q278-L282 VanDerWaalsContact O-N 3.16Å
279	F	90.1	Very high	87.2	Confident	112 Å²	112	66.3 Å²	66.3	49%	0.491	33%	0.33	S	S	.	.	H	α-helix	trans	-73.4	-43.4	173.1	177.9	-99.4	0	0	0	111.9	L276 V277 F281 L282 K283	L276-F279 HydrophobicContact CB-CB 4.28Å; L276-F279 HydrophobicContact CD2-CB 3.7Å; L276-F279 HydrophobicContact CG-CB 3.85Å; L276-F279 WeakPolarHBondContact O-CB 3.18Å; L276-F279 PolarHBondContact O-N 2.68Å; L276-F279 VanDerWaalsContact O-N 3.12Å; V277-F279 PolarHBondContact O-N 3.27Å; F279-F281 VanDerWaalsContact C-N 3.31Å; F279-F281 PolarHBondContact O-N 3.3Å; F279-L282 PolarHBondContact O-N 3.27Å; F279-K283 WeakPolarHBondContact O-CB 3.48Å; F279-K283 PolarHBondContact O-N 3.02Å
280	N	90.9	Very high	85.9	Confident	42 Å²	42	63 Å²	63	23%	0.225	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-42.6	175.6	-67.6	-13.4	0	0	0	111.5	R102 L103 T275 L276 V277 L282 K283 F284	R102-N280 PolarHBondContact O-ND2 3Å; R102-N280 VanDerWaalsContact O-ND2 3.14Å; L103-N280 HydrophobicContact CD2-CB 4.09Å; T275-N280 WeakPolarHBondContact CG2-ND2 2.99Å; L276-N280 PolarHBondContact O-N 3.27Å; V277-N280 PolarHBondContact O-N 3.07Å; V277-N280 VanDerWaalsContact O-N 3.12Å; N280-L282 PolarHBondContact O-N 2.75Å; N280-K283 PolarHBondContact O-N 2.84Å; N280-F284 WeakPolarHBondContact O-CB 3.31Å; N280-F284 PolarHBondContact O-N 2.6Å
281	F	88.3	Confident	84.6	Confident	20 Å²	20	59.7 Å²	59.7	9%	0.088	30%	0.301	C	S	.	.	H	α-helix	trans	-58	-47.7	174.6	178.6	-87.6	0	0	0	111.6	P224 T225 V277 F279 F284 N285	P224-F281 HydrophobicContact CB-CD1 3.79Å; P224-F281 HydrophobicContact CB-CE1 4.08Å; P224-F281 HydrophobicContact CG-CB 4.25Å; P224-F281 HydrophobicContact CG-CD1 3.74Å; P224-F281 HydrophobicContact CG-CE1 4.31Å; P224-F281 HydrophobicContact CG-CG 3.97Å; T225-F281 HydrophobicContact CG2-CE1 4.15Å; T225-F281 HydrophobicContact CG2-CZ 4.08Å; V277-F281 WeakPolarHBondContact O-CB 3.32Å; V277-F281 PolarHBondContact O-N 2.92Å; F279-F281 VanDerWaalsContact C-N 3.31Å; F279-F281 PolarHBondContact O-N 3.3Å; F281-F284 PolarHBondContact O-N 3.3Å; F281-N285 VanDerWaalsContact CD2-ND2 3.29Å; F281-N285 WeakPolarHBondContact CD2-ND2 3.34Å; F281-N285 HydrophobicContact CE1-CB 4.39Å; F281-N285 VanDerWaalsContact CE2-ND2 3.33Å; F281-N285 WeakPolarHBondContact CE2-ND2 3.13Å; F281-N285 HydrophobicContact CZ-CB 4.33Å; F281-N285 WeakPolarHBondContact O-CB 3.47Å; F281-N285 PolarHBondContact O-N 3.42Å; F281-N285 PolarHBondContact O-ND2 3.08Å
282	L	86	Confident	83.4	Confident	80 Å²	80	61.5 Å²	61.5	42%	0.419	31%	0.314	S	S	.	.	H	α-helix	trans	-61.7	-46.8	177.6	-179.8	69.9	0	0	0	111.2	Q278 F279 N280 F284 V286 L287	Q278-L282 PolarHBondContact O-N 3.36Å; Q278-L282 VanDerWaalsContact O-N 3.16Å; F279-L282 PolarHBondContact O-N 3.27Å; N280-L282 PolarHBondContact O-N 2.75Å; L282-F284 PolarHBondContact O-N 3.37Å; L282-V286 HydrophobicContact CD1-CB 3.89Å; L282-V286 HydrophobicContact CD1-CG1 4.33Å; L282-V286 HydrophobicContact CD1-CG2 3.83Å; L282-V286 WeakPolarHBondContact O-CB 3.49Å; L282-V286 PolarHBondContact O-N 3.14Å; L282-L287 PolarHBondContact O-N 3.44Å; L282-L287 VanDerWaalsContact O-N 3.16Å
283	K	85.8	Confident	82.3	Confident	98 Å²	98	63 Å²	63	43%	0.426	31%	0.308	S	S	.	.	I	π-helix	trans	-57.8	-48.2	178.7	-175.2	-175.1	176.4	-172.5	0	111.3	F279 N280 L287 Q288	F279-K283 WeakPolarHBondContact O-CB 3.48Å; F279-K283 PolarHBondContact O-N 3.02Å; N280-K283 PolarHBondContact O-N 2.84Å; K283-L287 WeakPolarHBondContact O-CB 3.45Å; K283-L287 PolarHBondContact O-N 2.8Å; K283-Q288 WeakPolarHBondContact O-CG 3.29Å; K283-Q288 PolarHBondContact O-N 3.43Å
284	F	82.4	Confident	81.3	Confident	13 Å²	13	63.7 Å²	63.7	6%	0.057	31%	0.308	C	S	.	.	I	π-helix	trans	-72.8	-51.5	-176	-171.9	-89.2	0	0	0	112.9	W97 L103 N280 F281 L282 N289 L290 P452 L454	W97-F284 AromaticContact CH2-CE1 3.68Å; W97-F284 HydrophobicContact CH2-CE1 3.68Å; W97-F284 HydrophobicContact CH2-CE2 4.14Å; W97-F284 AromaticContact CH2-CZ 3.39Å; W97-F284 HydrophobicContact CH2-CZ 3.39Å; W97-F284 HydrophobicContact CZ3-CE1 4.25Å; W97-F284 AromaticContact CZ3-CE2 3.89Å; W97-F284 HydrophobicContact CZ3-CE2 3.89Å; W97-F284 AromaticContact CZ3-CZ 3.62Å; W97-F284 HydrophobicContact CZ3-CZ 3.62Å; L103-F284 HydrophobicContact CD1-CB 4.3Å; L103-F284 HydrophobicContact CD1-CD1 3.88Å; L103-F284 HydrophobicContact CD1-CD2 3.87Å; L103-F284 HydrophobicContact CD1-CE1 4.16Å; L103-F284 HydrophobicContact CD1-CE2 4.13Å; L103-F284 HydrophobicContact CD1-CG 3.73Å; L103-F284 HydrophobicContact CD1-CZ 4.28Å; L103-F284 HydrophobicContact CD2-CB 3.59Å; L103-F284 HydrophobicContact CD2-CD2 4.23Å; L103-F284 HydrophobicContact CD2-CG 3.93Å; N280-F284 WeakPolarHBondContact O-CB 3.31Å; N280-F284 PolarHBondContact O-N 2.6Å; F281-F284 PolarHBondContact O-N 3.3Å; L282-F284 PolarHBondContact O-N 3.37Å; F284-N289 PolarHBondContact O-N 3.23Å; F284-L290 HydrophobicContact CD1-CB 4.47Å; F284-L290 HydrophobicContact CD2-CD1 3.83Å; F284-L290 HydrophobicContact CE1-CB 3.87Å; F284-L290 HydrophobicContact CE2-CB 4.12Å; F284-L290 HydrophobicContact CE2-CD1 3.38Å; F284-L290 HydrophobicContact CE2-CG 4.4Å; F284-L290 HydrophobicContact CZ-CB 3.67Å; F284-L290 HydrophobicContact CZ-CD1 3.82Å; F284-L290 HydrophobicContact CZ-CG 4.41Å; F284-P452 HydrophobicContact CZ-CG 4.24Å; F284-L454 HydrophobicContact CE2-CD2 3.88Å
285	N	79.5	Confident	80.6	Confident	45 Å²	45	56.9 Å²	56.9	24%	0.241	29%	0.293	C	S	.	.	I	π-helix	trans	-82.3	-33.6	-170.2	-69.7	-83.9	0	0	0	113.2	F281	F281-N285 VanDerWaalsContact CD2-ND2 3.29Å; F281-N285 WeakPolarHBondContact CD2-ND2 3.34Å; F281-N285 HydrophobicContact CE1-CB 4.39Å; F281-N285 VanDerWaalsContact CE2-ND2 3.33Å; F281-N285 WeakPolarHBondContact CE2-ND2 3.13Å; F281-N285 HydrophobicContact CZ-CB 4.33Å; F281-N285 WeakPolarHBondContact O-CB 3.47Å; F281-N285 PolarHBondContact O-N 3.42Å; F281-N285 PolarHBondContact O-ND2 3.08Å
286	V	76.9	Confident	80.3	Confident	74 Å²	74	60.5 Å²	60.5	45%	0.448	32%	0.318	S	S	.	.	I	π-helix	trans	-104.7	-48.7	-173.8	-176	0	0	0	0	111.4	L282	L282-V286 HydrophobicContact CD1-CB 3.89Å; L282-V286 HydrophobicContact CD1-CG1 4.33Å; L282-V286 HydrophobicContact CD1-CG2 3.83Å; L282-V286 WeakPolarHBondContact O-CB 3.49Å; L282-V286 PolarHBondContact O-N 3.14Å
287	L	73.4	Confident	80.2	Confident	120 Å²	120	60.7 Å²	60.7	63%	0.628	32%	0.317	S	S	*	.	I	π-helix	trans	-78.1	-40.2	-175	-56.3	-179.5	0	0	0	112.6	L282 K283	L282-L287 PolarHBondContact O-N 3.44Å; L282-L287 VanDerWaalsContact O-N 3.16Å; K283-L287 WeakPolarHBondContact O-CB 3.45Å; K283-L287 PolarHBondContact O-N 2.8Å
288	Q	74.4	Confident	80.4	Confident	98 Å²	98	63.8 Å²	63.8	46%	0.458	34%	0.338	S	S	.	.	S	Bend	trans	-92.1	-12.5	-179.7	-66.1	174.4	-36.7	0	0	113.1	K283 L290	K283-Q288 WeakPolarHBondContact O-CG 3.29Å; K283-Q288 PolarHBondContact O-N 3.43Å; Q288-L290 HydrophobicContact CB-CD1 4.02Å; Q288-L290 HydrophobicContact CB-CG 4Å; Q288-L290 PolarHBondContact O-N 3.34Å
289	N	72.4	Confident	80.5	Confident	66 Å²	66	71.7 Å²	71.7	35%	0.353	37%	0.367	S	S	.	.			trans	48.4	30.1	179.9	-160.3	18	0	0	0	114.4	F284 G291 T292	F284-N289 PolarHBondContact O-N 3.23Å; N289-G291 PolarHBondContact O-N 3.38Å; N289-G291 VanDerWaalsContact O-N 3.16Å; N289-T292 PolarHBondContact O-N 3.08Å; N289-T292 PolarHBondContact O-OG1 3.23Å; N289-T292 VanDerWaalsContact O-OG1 3.11Å
290	L	68.1	Low	80.8	Confident	50 Å²	50	69.9 Å²	69.9	26%	0.262	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-70.8	-7.6	-178.9	-70.3	169.7	0	0	0	112.9	F284 Q288 T292 F293	F284-L290 HydrophobicContact CD1-CB 4.47Å; F284-L290 HydrophobicContact CD2-CD1 3.83Å; F284-L290 HydrophobicContact CE1-CB 3.87Å; F284-L290 HydrophobicContact CE2-CB 4.12Å; F284-L290 HydrophobicContact CE2-CD1 3.38Å; F284-L290 HydrophobicContact CE2-CG 4.4Å; F284-L290 HydrophobicContact CZ-CB 3.67Å; F284-L290 HydrophobicContact CZ-CD1 3.82Å; F284-L290 HydrophobicContact CZ-CG 4.41Å; Q288-L290 HydrophobicContact CB-CD1 4.02Å; Q288-L290 HydrophobicContact CB-CG 4Å; Q288-L290 PolarHBondContact O-N 3.34Å; L290-T292 PolarHBondContact O-N 3.13Å; L290-F293 VanDerWaalsContact O-CB 3.24Å; L290-F293 WeakPolarHBondContact O-CB 3.48Å; L290-F293 PolarHBondContact O-N 3.24Å; L290-F293 VanDerWaalsContact O-N 3.13Å
291	G	63.4	Low	81.1	Confident	6 Å²	6	68.2 Å²	68.2	6%	0.062	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-61	-19.7	172.4	0	0	0	0	0	113.8	N289 F293 Y294 H348	N289-G291 PolarHBondContact O-N 3.38Å; N289-G291 VanDerWaalsContact O-N 3.16Å; G291-F293 PolarHBondContact O-N 2.86Å; G291-Y294 PolarHBondContact O-N 3.36Å; G291-Y294 VanDerWaalsContact O-N 3.1Å; G291-H348 WeakPolarHBondContact O-CB 3.39Å
292	T	68.9	Low	81.5	Confident	65 Å²	65	67.2 Å²	67.2	40%	0.399	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-58.7	-24.6	172.8	51.5	0	0	0	0	113.2	N289 L290 Y294 G295	N289-T292 PolarHBondContact O-N 3.08Å; N289-T292 PolarHBondContact O-OG1 3.23Å; N289-T292 VanDerWaalsContact O-OG1 3.11Å; L290-T292 PolarHBondContact O-N 3.13Å; T292-Y294 PolarHBondContact O-N 2.96Å; T292-G295 PolarHBondContact O-N 3.49Å; T292-G295 VanDerWaalsContact O-N 3.12Å
293	F	70.8	Confident	82	Confident	75 Å²	75	67.6 Å²	67.6	33%	0.329	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-58.1	-32.9	175.1	-174.6	-99.9	0	0	0	112.3	L290 G291 G295 P452 Y460 D462	L290-F293 VanDerWaalsContact O-CB 3.24Å; L290-F293 WeakPolarHBondContact O-CB 3.48Å; L290-F293 PolarHBondContact O-N 3.24Å; L290-F293 VanDerWaalsContact O-N 3.13Å; G291-F293 PolarHBondContact O-N 2.86Å; F293-G295 PolarHBondContact O-N 2.83Å; F293-P452 HydrophobicContact CD1-CB 3.95Å; F293-P452 HydrophobicContact CE1-CB 4.19Å; F293-P452 HydrophobicContact CG-CB 4.16Å; F293-Y460 HydrophobicContact CE2-CD1 4.4Å; F293-D462 WeakPolarHBondContact CZ-OD2 3.42Å
294	Y	70.9	Confident	82.5	Confident	95 Å²	95	65.7 Å²	65.7	37%	0.373	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-88.6	19.5	179.9	-61.4	-69	0	0	0	113.5	W97 G291 T292 H348	W97-Y294 VanDerWaalsContact CE2-OH 3.3Å; W97-Y294 HydrophobicContact CZ2-CE2 4.16Å; W97-Y294 AromaticContact CZ2-CZ 3.93Å; W97-Y294 WeakPolarHBondContact CZ2-OH 3.43Å; W97-Y294 PolarHBondContact NE1-OH 3.12Å; G291-Y294 PolarHBondContact O-N 3.36Å; G291-Y294 VanDerWaalsContact O-N 3.1Å; T292-Y294 PolarHBondContact O-N 2.96Å; Y294-H348 PolarHBondContact O-CE1 3.36Å; Y294-H348 VanDerWaalsContact O-CE1 3.26Å; Y294-H348 PolarHBondContact O-ND1 3.26Å
295	G	79.5	Confident	83.2	Confident	36 Å²	36	69.7 Å²	69.7	37%	0.371	36%	0.362	S	S	.	.			trans	95.7	155.5	-177.3	0	0	0	0	0	112.9	T292 F293 H348	T292-G295 PolarHBondContact O-N 3.49Å; T292-G295 VanDerWaalsContact O-N 3.12Å; F293-G295 PolarHBondContact O-N 2.83Å; G295-H348 PolarHBondContact O-ND1 3.02Å
296	S	86.1	Confident	84	Confident	82 Å²	82	67.6 Å²	67.6	57%	0.573	35%	0.351	S	S	*	.			trans	-134.6	149.9	-178.6	70.5	0	0	0	0	111.4	S347	S296-S347 WeakPolarHBondContact CA-O 3.38Å
297	H	92.6	Very high	85	Confident	79 Å²	79	65 Å²	65	37%	0.366	33%	0.334	S	S	.	.			trans	-129.3	149.4	178.1	-71.7	-66.4	0	0	0	110.7	W301 S347 K349	H297-W301 HydrophobicContact CB-CB 3.87Å; H297-W301 HydrophobicContact CB-CD2 4.26Å; H297-W301 HydrophobicContact CB-CG 3.75Å; H297-W301 AromaticContact CE1-NE1 3.93Å; H297-W301 AromaticContact CG-CD1 3.85Å; H297-W301 AromaticContact CG-CG 3.99Å; H297-W301 AromaticContact CG-NE1 3.98Å; H297-W301 AromaticContact ND1-CD1 3.7Å; H297-W301 AromaticContact ND1-NE1 3.67Å; H297-S347 PolarHBondContact N-O 2.01Å; H297-K349 HydrophobicContact CB-CB 4.26Å; H297-K349 HydrophobicContact CB-CD 3.92Å; H297-K349 HydrophobicContact CB-CG 4.25Å; H297-K349 PolarHBondContact O-NZ 3.44Å
298	P	94.9	Very high	86.1	Confident	70 Å²	70	61 Å²	61	46%	0.455	32%	0.315	S	S	.	.			trans	-54.1	155.1	174.6	-26	34.5	0	0	0	113.1	H300 W301 K349	P298-H300 WeakPolarHBondContact CB-NE2 3.41Å; P298-H300 PolarHBondContact O-N 3.19Å; P298-W301 WeakPolarHBondContact O-CB 3.5Å; P298-W301 PolarHBondContact O-N 3.34Å; P298-K349 WeakPolarHBondContact O-CE 3.17Å; P298-K349 PolarHBondContact O-NZ 2.8Å
299	W	95.3	Very high	87.2	Confident	179 Å²	179	59.4 Å²	59.4	68%	0.678	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-35.3	-177.6	70.5	-94.2	0	0	0	112.9	W301 S344	W299-W301 PolarHBondContact O-N 2.95Å; W299-S344 WeakPolarHBondContact CA-O 3.49Å; W299-S344 WeakPolarHBondContact O-CB 3.48Å; W299-S344 PolarHBondContact O-OG 3.19Å
300	H	95.8	Very high	88.4	Confident	74 Å²	74	56.4 Å²	56.4	34%	0.343	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-6.6	-178.6	66	77.1	0	0	0	113.6	P298 Y302 F303 S304	P298-H300 WeakPolarHBondContact CB-NE2 3.41Å; P298-H300 PolarHBondContact O-N 3.19Å; H300-Y302 VanDerWaalsContact C-N 3.3Å; H300-Y302 PolarHBondContact O-N 3.35Å; H300-F303 WeakPolarHBondContact O-CA 3.45Å; H300-F303 PolarHBondContact O-N 3.5Å; H300-S304 PolarHBondContact ND1-OG 2.72Å; H300-S304 PolarHBondContact O-N 2.87Å; H300-S304 PolarHBondContact O-OG 3.19Å; H300-S304 VanDerWaalsContact O-OG 3.06Å
301	W	97.3	Very high	89.8	Confident	7 Å²	7	54 Å²	54	3%	0.027	28%	0.283	C	S	.	.	H	α-helix	trans	-54.9	-41.1	-170.2	-177.3	87.8	0	0	0	113.4	H297 P298 W299 F303 S304 Q305 G306 K349 F351	H297-W301 HydrophobicContact CB-CB 3.87Å; H297-W301 HydrophobicContact CB-CD2 4.26Å; H297-W301 HydrophobicContact CB-CG 3.75Å; H297-W301 AromaticContact CE1-NE1 3.93Å; H297-W301 AromaticContact CG-CD1 3.85Å; H297-W301 AromaticContact CG-CG 3.99Å; H297-W301 AromaticContact CG-NE1 3.98Å; H297-W301 AromaticContact ND1-CD1 3.7Å; H297-W301 AromaticContact ND1-NE1 3.67Å; P298-W301 WeakPolarHBondContact O-CB 3.5Å; P298-W301 PolarHBondContact O-N 3.34Å; W299-W301 PolarHBondContact O-N 2.95Å; W301-F303 VanDerWaalsContact C-N 3.33Å; W301-F303 PolarHBondContact O-N 2.93Å; W301-S304 PolarHBondContact O-N 3.44Å; W301-Q305 HydrophobicContact CG-CB 4.47Å; W301-Q305 CarbonylContact O-C 3.54Å; W301-Q305 WeakPolarHBondContact O-CA 3.31Å; W301-Q305 WeakPolarHBondContact O-CB 3.37Å; W301-Q305 PolarHBondContact O-N 3.35Å; W301-G306 PolarHBondContact O-N 3.15Å; W301-K349 HydrophobicContact CB-CD 3.9Å; W301-K349 HydrophobicContact CD2-CB 4.46Å; W301-K349 HydrophobicContact CD2-CD 4.38Å; W301-K349 HydrophobicContact CE3-CB 3.79Å; W301-K349 HydrophobicContact CE3-CD 3.93Å; W301-K349 HydrophobicContact CG-CD 4.41Å; W301-K349 HydrophobicContact CZ3-CB 4Å; W301-F351 AromaticContact CH2-CD1 3.65Å; W301-F351 HydrophobicContact CH2-CD1 3.65Å; W301-F351 HydrophobicContact CH2-CD2 4.17Å; W301-F351 AromaticContact CH2-CE1 3.54Å; W301-F351 HydrophobicContact CH2-CE1 3.54Å; W301-F351 HydrophobicContact CH2-CE2 4.06Å; W301-F351 AromaticContact CH2-CG 3.97Å; W301-F351 HydrophobicContact CH2-CG 3.97Å; W301-F351 AromaticContact CH2-CZ 3.76Å; W301-F351 HydrophobicContact CH2-CZ 3.76Å; W301-F351 HydrophobicContact CZ2-CD1 4.26Å; W301-F351 AromaticContact CZ2-CE1 3.67Å; W301-F351 HydrophobicContact CZ2-CE1 3.67Å; W301-F351 AromaticContact CZ2-CE2 3.99Å; W301-F351 HydrophobicContact CZ2-CE2 3.99Å; W301-F351 AromaticContact CZ2-CZ 3.52Å; W301-F351 HydrophobicContact CZ2-CZ 3.52Å; W301-F351 HydrophobicContact CZ3-CD1 4.49Å
302	Y	97.6	Very high	91.4	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.294	C	S	.	.	I	π-helix	trans	-64.5	-36.8	176	-82.7	-63	0	0	0	112.8	H300 F307 Y343 K349 E350 I354	H300-Y302 VanDerWaalsContact C-N 3.3Å; H300-Y302 PolarHBondContact O-N 3.35Å; Y302-F307 WeakPolarHBondContact O-CA 3.48Å; Y302-F307 WeakPolarHBondContact O-CB 3.28Å; Y302-F307 PolarHBondContact O-N 3.05Å; Y302-Y343 VanDerWaalsContact CE2-CB 3.43Å; Y302-Y343 HydrophobicContact CE2-CG 4.4Å; Y302-K349 HydrophobicContact CD2-CD 3.68Å; Y302-K349 HydrophobicContact CD2-CG 4.2Å; Y302-K349 HydrophobicContact CE2-CB 3.67Å; Y302-K349 HydrophobicContact CE2-CD 3.6Å; Y302-K349 HydrophobicContact CE2-CG 3.58Å; Y302-E350 WeakPolarHBondContact CE1-O 3.4Å; Y302-E350 PolarHBondContact OH-N 3.47Å; Y302-E350 VanDerWaalsContact OH-N 3.07Å; Y302-E350 PolarHBondContact OH-O 2.86Å; Y302-I354 HydrophobicContact CD1-CD1 3.79Å; Y302-I354 HydrophobicContact CD1-CG1 4.36Å; Y302-I354 HydrophobicContact CD1-CG2 3.93Å; Y302-I354 HydrophobicContact CE1-CB 4.48Å; Y302-I354 HydrophobicContact CE1-CD1 4.05Å; Y302-I354 HydrophobicContact CE1-CG1 4.12Å; Y302-I354 HydrophobicContact CE1-CG2 3.58Å
303	F	96.5	Very high	92.7	Very high	87 Å²	87	53.6 Å²	53.6	38%	0.382	29%	0.285	S	S	.	.	I	π-helix	trans	-76	-37.3	178.1	-63.2	-76.9	0	0	0	112.5	H300 W301 P308 L340 S344	H300-F303 WeakPolarHBondContact O-CA 3.45Å; H300-F303 PolarHBondContact O-N 3.5Å; W301-F303 VanDerWaalsContact C-N 3.33Å; W301-F303 PolarHBondContact O-N 2.93Å; F303-P308 WeakPolarHBondContact O-CD 3.06Å; F303-P308 WeakPolarHBondContact O-CG 3.47Å; F303-L340 HydrophobicContact CD1-CD1 4.48Å; F303-L340 HydrophobicContact CE1-CB 3.94Å; F303-L340 HydrophobicContact CE1-CD1 4.16Å; F303-L340 HydrophobicContact CZ-CB 3.9Å; F303-S344 WeakPolarHBondContact CE2-OG 3.38Å
304	S	96.2	Very high	94	Very high	59 Å²	59	50 Å²	50	41%	0.413	27%	0.269	S	S	.	.	I	π-helix	trans	-88.2	-30.9	-175.6	58.4	0	0	0	0	114.4	H300 W301	H300-S304 PolarHBondContact ND1-OG 2.72Å; H300-S304 PolarHBondContact O-N 2.87Å; H300-S304 PolarHBondContact O-OG 3.19Å; H300-S304 VanDerWaalsContact O-OG 3.06Å; W301-S304 PolarHBondContact O-N 3.44Å
305	Q	95.8	Very high	95.3	Very high	97 Å²	97	47.6 Å²	47.6	45%	0.453	26%	0.262	S	S	.	.	I	π-helix	trans	-132.4	-58.6	-171	-62.5	178.4	31.5	0	0	111.8	W301 F307 P308 V309	W301-Q305 HydrophobicContact CG-CB 4.47Å; W301-Q305 CarbonylContact O-C 3.54Å; W301-Q305 WeakPolarHBondContact O-CA 3.31Å; W301-Q305 WeakPolarHBondContact O-CB 3.37Å; W301-Q305 PolarHBondContact O-N 3.35Å; Q305-F307 PolarHBondContact O-N 3.04Å; Q305-P308 WeakPolarHBondContact O-CD 3.48Å; Q305-V309 VanDerWaalsContact O-CB 3.3Å; Q305-V309 WeakPolarHBondContact O-CB 3.39Å; Q305-V309 WeakPolarHBondContact O-CG2 3.39Å; Q305-V309 PolarHBondContact O-N 3.05Å
306	G	96.3	Very high	96.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-52.4	-60	-173	0	0	0	0	0	114	W301 I310	W301-G306 PolarHBondContact O-N 3.15Å; G306-I310 WeakPolarHBondContact O-CG1 3.42Å; G306-I310 PolarHBondContact O-N 3.35Å
307	F	97.9	Very high	96.7	Very high	21 Å²	21	47.1 Å²	47.1	9%	0.092	25%	0.248	C	C	.	.	H	α-helix	trans	-69	-44.8	-178.5	-175	-108.8	0	0	0	113	Y302 Q305 V309 I310 L311 L315 F318 V336 L340 I354 C361	Y302-F307 WeakPolarHBondContact O-CA 3.48Å; Y302-F307 WeakPolarHBondContact O-CB 3.28Å; Y302-F307 PolarHBondContact O-N 3.05Å; Q305-F307 PolarHBondContact O-N 3.04Å; F307-V309 VanDerWaalsContact C-N 3.34Å; F307-V309 PolarHBondContact O-N 3.26Å; F307-I310 PolarHBondContact O-N 2.84Å; F307-L311 HydrophobicContact CD1-CD1 3.99Å; F307-L311 HydrophobicContact CD2-CD1 4.36Å; F307-L311 HydrophobicContact CE1-CD1 3.39Å; F307-L311 HydrophobicContact CE2-CD1 3.82Å; F307-L311 HydrophobicContact CE2-CG 4.31Å; F307-L311 HydrophobicContact CG-CD1 4.45Å; F307-L311 HydrophobicContact CZ-CD1 3.31Å; F307-L311 HydrophobicContact CZ-CG 4.27Å; F307-L311 PolarHBondContact O-N 3.26Å; F307-L311 VanDerWaalsContact O-N 3.09Å; F307-L315 HydrophobicContact CD1-CD1 4.35Å; F307-L315 HydrophobicContact CE1-CD1 4.18Å; F307-F318 HydrophobicContact CE1-CD1 4.01Å; F307-F318 AromaticContact CE1-CE1 3.71Å; F307-F318 HydrophobicContact CE1-CE1 3.71Å; F307-F318 HydrophobicContact CE1-CZ 4.42Å; F307-F318 HydrophobicContact CZ-CD1 4.03Å; F307-F318 AromaticContact CZ-CE1 3.61Å; F307-F318 HydrophobicContact CZ-CE1 3.61Å; F307-F318 AromaticContact CZ-CZ 3.89Å; F307-F318 HydrophobicContact CZ-CZ 3.89Å; F307-V336 HydrophobicContact CE2-CG1 3.81Å; F307-V336 HydrophobicContact CZ-CG1 3.9Å; F307-L340 HydrophobicContact CB-CD1 4.25Å; F307-L340 HydrophobicContact CB-CD2 4.01Å; F307-L340 HydrophobicContact CD1-CD1 4.14Å; F307-L340 HydrophobicContact CD2-CD1 3.83Å; F307-L340 HydrophobicContact CD2-CD2 3.84Å; F307-L340 HydrophobicContact CD2-CG 4.37Å; F307-L340 HydrophobicContact CE1-CD1 4.38Å; F307-L340 HydrophobicContact CE2-CD1 4.09Å; F307-L340 HydrophobicContact CG-CD1 3.83Å; F307-L340 HydrophobicContact CG-CD2 4.15Å; F307-L340 HydrophobicContact CZ-CD1 4.34Å; F307-I354 HydrophobicContact CB-CD1 4.15Å; F307-I354 HydrophobicContact CD2-CD1 4.13Å; F307-C361 VanDerWaalsContact CE2-SG 3.59Å
308	P	97.9	Very high	97	Very high	36 Å²	36	44 Å²	44	23%	0.234	23%	0.234	C	C	.	.	H	α-helix	trans	-56.1	-42.3	172.7	-29.6	37	0	0	0	114.4	F303 Q305 G312 L315	F303-P308 WeakPolarHBondContact O-CD 3.06Å; F303-P308 WeakPolarHBondContact O-CG 3.47Å; Q305-P308 WeakPolarHBondContact O-CD 3.48Å; P308-G312 WeakPolarHBondContact O-CA 3.09Å; P308-G312 PolarHBondContact O-N 3.35Å; P308-L315 HydrophobicContact CB-CD2 4.01Å; P308-L315 HydrophobicContact CG-CD2 4.37Å
309	V	96.9	Very high	97.2	Very high	64 Å²	64	44.5 Å²	44.5	39%	0.388	23%	0.232	S	C	.	.	H	α-helix	trans	-65.3	-47.4	-179.6	166.4	0	0	0	0	111.1	W173 Q305 F307 L311 G312 F351	W173-V309 HydrophobicContact CH2-CG1 4.39Å; W173-V309 HydrophobicContact CZ2-CG1 3.89Å; W173-V309 VanDerWaalsContact CZ2-O 3.31Å; W173-V309 WeakPolarHBondContact CZ2-O 2.82Å; W173-V309 PolarHBondContact NE1-O 3.49Å; Q305-V309 VanDerWaalsContact O-CB 3.3Å; Q305-V309 WeakPolarHBondContact O-CB 3.39Å; Q305-V309 WeakPolarHBondContact O-CG2 3.39Å; Q305-V309 PolarHBondContact O-N 3.05Å; F307-V309 VanDerWaalsContact C-N 3.34Å; F307-V309 PolarHBondContact O-N 3.26Å; V309-L311 PolarHBondContact O-N 3.01Å; V309-G312 PolarHBondContact O-N 3.46Å; V309-G312 VanDerWaalsContact O-N 3.15Å; V309-F351 HydrophobicContact CB-CD1 4.31Å; V309-F351 HydrophobicContact CB-CE1 3.71Å; V309-F351 HydrophobicContact CB-CZ 4.46Å; V309-F351 HydrophobicContact CG1-CD1 4.14Å; V309-F351 HydrophobicContact CG1-CE1 3.7Å; V309-F351 HydrophobicContact CG1-CZ 4.17Å; V309-F351 HydrophobicContact CG2-CE1 4.13Å
310	I	96.9	Very high	97.3	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-41.4	-177.7	-69	174.5	0	0	0	112	W173 F174 G306 F307 G312 F351 I354 L358	W173-I310 PolarHBondContact NE1-O 3.23Å; F174-I310 HydrophobicContact CB-CG2 4.02Å; F174-I310 HydrophobicContact CD1-CB 4.46Å; F174-I310 HydrophobicContact CD1-CD1 4.49Å; F174-I310 HydrophobicContact CD1-CG1 4.25Å; F174-I310 HydrophobicContact CD1-CG2 3.57Å; F174-I310 HydrophobicContact CD2-CG1 4.19Å; F174-I310 HydrophobicContact CE1-CD1 4.07Å; F174-I310 HydrophobicContact CE1-CG1 4.21Å; F174-I310 HydrophobicContact CE1-CG2 4.14Å; F174-I310 HydrophobicContact CE2-CG1 4.17Å; F174-I310 HydrophobicContact CG-CB 4.4Å; F174-I310 HydrophobicContact CG-CG1 4.22Å; F174-I310 HydrophobicContact CG-CG2 3.82Å; F174-I310 HydrophobicContact CZ-CD1 4.13Å; F174-I310 HydrophobicContact CZ-CG1 4.18Å; G306-I310 WeakPolarHBondContact O-CG1 3.42Å; G306-I310 PolarHBondContact O-N 3.35Å; F307-I310 PolarHBondContact O-N 2.84Å; I310-G312 VanDerWaalsContact C-N 3.33Å; I310-F351 HydrophobicContact CD1-CB 3.83Å; I310-F351 HydrophobicContact CD1-CD1 4.22Å; I310-F351 WeakPolarHBondContact CD1-O 3.49Å; I310-F351 HydrophobicContact CG1-CB 4.09Å; I310-F351 HydrophobicContact CG1-CD1 4.01Å; I310-F351 HydrophobicContact CG1-CG 4.49Å; I310-I354 HydrophobicContact CD1-CD1 3.66Å; I310-I354 HydrophobicContact CD1-CG1 3.4Å; I310-I354 VanDerWaalsContact CD1-CG1 3.4Å; I310-L358 HydrophobicContact CG2-CD1 3.73Å; I310-L358 HydrophobicContact CG2-CD2 3.83Å; I310-L358 HydrophobicContact CG2-CG 4.29Å
311	L	97.8	Very high	97.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.6	-34	173.2	-77.6	177.3	0	0	0	111.9	F307 V309 T313 H314 L315 F318 L358 C361 M362	F307-L311 HydrophobicContact CD1-CD1 3.99Å; F307-L311 HydrophobicContact CD2-CD1 4.36Å; F307-L311 HydrophobicContact CE1-CD1 3.39Å; F307-L311 HydrophobicContact CE2-CD1 3.82Å; F307-L311 HydrophobicContact CE2-CG 4.31Å; F307-L311 HydrophobicContact CG-CD1 4.45Å; F307-L311 HydrophobicContact CZ-CD1 3.31Å; F307-L311 HydrophobicContact CZ-CG 4.27Å; F307-L311 PolarHBondContact O-N 3.26Å; F307-L311 VanDerWaalsContact O-N 3.09Å; V309-L311 PolarHBondContact O-N 3.01Å; L311-T313 PolarHBondContact O-N 3.19Å; L311-H314 HydrophobicContact CB-CB 4.49Å; L311-H314 HydrophobicContact CD2-CB 4.27Å; L311-H314 VanDerWaalsContact O-CB 3.25Å; L311-H314 WeakPolarHBondContact O-CB 3.44Å; L311-H314 PolarHBondContact O-N 3.22Å; L311-L315 HydrophobicContact CB-CB 4.04Å; L311-L315 HydrophobicContact CD1-CB 4.46Å; L311-L315 HydrophobicContact CD1-CD1 3.69Å; L311-F318 HydrophobicContact CD1-CB 4.03Å; L311-F318 HydrophobicContact CD1-CD1 3.96Å; L311-F318 HydrophobicContact CD1-CG 3.96Å; L311-L358 HydrophobicContact CD2-CD1 3.64Å; L311-L358 HydrophobicContact CG-CD1 4.38Å; L311-C361 HydrophobicContact CD2-CB 3.67Å; L311-M362 HydrophobicContact CD2-CE 3.84Å
312	G	96.7	Very high	97.4	Very high	28 Å²	28	37.4 Å²	37.4	29%	0.289	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	51.3	-126.3	-175.3	0	0	0	0	0	110.8	P308 V309 I310 H314 L315	P308-G312 WeakPolarHBondContact O-CA 3.09Å; P308-G312 PolarHBondContact O-N 3.35Å; V309-G312 PolarHBondContact O-N 3.46Å; V309-G312 VanDerWaalsContact O-N 3.15Å; I310-G312 VanDerWaalsContact C-N 3.33Å; G312-H314 PolarHBondContact O-N 3.23Å; G312-H314 VanDerWaalsContact O-N 3.14Å; G312-L315 WeakPolarHBondContact O-CB 3.18Å; G312-L315 PolarHBondContact O-N 2.97Å; G312-L315 VanDerWaalsContact O-N 3.08Å
313	T	97.3	Very high	97.3	Very high	35 Å²	35	46.5 Å²	46.5	22%	0.215	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-68.7	-9.7	180	54.7	0	0	0	0	114.5	L311 L315 P316 F317 F382 L383 S386 N387	L311-T313 PolarHBondContact O-N 3.19Å; T313-L315 VanDerWaalsContact C-N 3.29Å; T313-P316 WeakPolarHBondContact O-CD 3.25Å; T313-F317 WeakPolarHBondContact O-CD2 3.34Å; T313-F382 HydrophobicContact CG2-CE1 3.8Å; T313-F382 HydrophobicContact CG2-CZ 3.7Å; T313-L383 WeakPolarHBondContact O-CD2 3.2Å; T313-S386 WeakPolarHBondContact CB-OG 3.45Å; T313-S386 WeakPolarHBondContact CG2-OG 3.32Å; T313-S386 PolarHBondContact OG1-OG 3.36Å; T313-N387 PolarHBondContact OG1-ND2 2.82Å
314	H	98.3	Very high	97.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-75	-16.9	170.7	-69.2	86.4	0	0	0	113.1	C171 L311 G312 F317 F318 N387	C171-H314 VanDerWaalsContact SG-CE1 3.55Å; C171-H314 PolarHBondContact SG-NE2 3.02Å; C171-H314 VanDerWaalsContact SG-NE2 3.36Å; L311-H314 HydrophobicContact CB-CB 4.49Å; L311-H314 HydrophobicContact CD2-CB 4.27Å; L311-H314 VanDerWaalsContact O-CB 3.25Å; L311-H314 WeakPolarHBondContact O-CB 3.44Å; L311-H314 PolarHBondContact O-N 3.22Å; G312-H314 PolarHBondContact O-N 3.23Å; G312-H314 VanDerWaalsContact O-N 3.14Å; H314-F317 WeakPolarHBondContact O-CB 3.42Å; H314-F317 PolarHBondContact O-N 3.38Å; H314-F318 PolarHBondContact O-N 3.04Å; H314-N387 PolarHBondContact CE1-ND2 3.37Å
315	L	98.1	Very high	97.2	Very high	43 Å²	43	43.1 Å²	43.1	23%	0.225	23%	0.228	C	C	.	.	H	α-helix	trans	-55.9	-47	-173.7	179.5	67	0	0	0	113.8	F307 P308 L311 G312 T313 F317 F318 I319	F307-L315 HydrophobicContact CD1-CD1 4.35Å; F307-L315 HydrophobicContact CE1-CD1 4.18Å; P308-L315 HydrophobicContact CB-CD2 4.01Å; P308-L315 HydrophobicContact CG-CD2 4.37Å; L311-L315 HydrophobicContact CB-CB 4.04Å; L311-L315 HydrophobicContact CD1-CB 4.46Å; L311-L315 HydrophobicContact CD1-CD1 3.69Å; G312-L315 WeakPolarHBondContact O-CB 3.18Å; G312-L315 PolarHBondContact O-N 2.97Å; G312-L315 VanDerWaalsContact O-N 3.08Å; T313-L315 VanDerWaalsContact C-N 3.29Å; L315-F317 VanDerWaalsContact C-N 3.27Å; L315-F317 PolarHBondContact O-N 2.76Å; L315-F318 WeakPolarHBondContact O-CB 3.35Å; L315-F318 PolarHBondContact O-N 3.03Å; L315-I319 HydrophobicContact CD1-CD1 4.24Å; L315-I319 HydrophobicContact CD1-CG1 4.44Å; L315-I319 HydrophobicContact CG-CD1 4.15Å; L315-I319 WeakPolarHBondContact O-CG1 3.48Å; L315-I319 PolarHBondContact O-N 3.06Å
316	P	97.5	Very high	97.1	Very high	82 Å²	82	40.9 Å²	40.9	53%	0.532	22%	0.222	S	C	.	.	H	α-helix	trans	-62.1	-35.2	176.5	-23	35	0	0	0	112.9	T313 I319 H320	T313-P316 WeakPolarHBondContact O-CD 3.25Å; P316-I319 PolarHBondContact O-N 2.91Å; P316-H320 WeakPolarHBondContact O-CB 3.33Å; P316-H320 PolarHBondContact O-N 3.39Å
317	F	98.1	Very high	96.9	Very high	26 Å²	26	48.4 Å²	48.4	11%	0.114	26%	0.255	C	S	.	.	H	α-helix	trans	-72.8	-35.6	178.4	-60.2	-92.7	0	0	0	111.9	T313 H314 L315 G321 C365 S368 L369 L372 A379 L383	T313-F317 WeakPolarHBondContact O-CD2 3.34Å; H314-F317 WeakPolarHBondContact O-CB 3.42Å; H314-F317 PolarHBondContact O-N 3.38Å; L315-F317 VanDerWaalsContact C-N 3.27Å; L315-F317 PolarHBondContact O-N 2.76Å; F317-G321 WeakPolarHBondContact O-CA 3.49Å; F317-G321 PolarHBondContact O-N 2.69Å; F317-C365 HydrophobicContact CB-CB 4.31Å; F317-S368 WeakPolarHBondContact O-CB 3.29Å; F317-L369 HydrophobicContact CD1-CD2 3.79Å; F317-L369 HydrophobicContact CD1-CG 4.37Å; F317-L369 HydrophobicContact CE1-CD2 3.75Å; F317-L372 HydrophobicContact CD1-CD1 4.25Å; F317-L372 HydrophobicContact CE1-CD1 3.79Å; F317-A379 HydrophobicContact CE1-CB 3.67Å; F317-A379 HydrophobicContact CZ-CB 3.72Å; F317-L383 HydrophobicContact CD1-CD1 4.35Å; F317-L383 HydrophobicContact CD2-CD1 4.05Å; F317-L383 HydrophobicContact CD2-CD2 3.8Å; F317-L383 HydrophobicContact CD2-CG 4.23Å; F317-L383 HydrophobicContact CE1-CD1 4.23Å; F317-L383 HydrophobicContact CE2-CD1 3.91Å; F317-L383 HydrophobicContact CE2-CD2 3.61Å; F317-L383 HydrophobicContact CE2-CG 3.77Å; F317-L383 HydrophobicContact CG-CD1 4.27Å; F317-L383 HydrophobicContact CZ-CD1 4Å; F317-L383 HydrophobicContact CZ-CD2 4.41Å; F317-L383 HydrophobicContact CZ-CG 4.07Å
318	F	98.4	Very high	96.5	Very high	13 Å²	13	50.2 Å²	50.2	6%	0.057	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-50.2	171.7	170.7	-104.2	0	0	0	110.5	F307 L311 H314 L315 G321 C322 L333 V336 C361 F364	F307-F318 HydrophobicContact CE1-CD1 4.01Å; F307-F318 AromaticContact CE1-CE1 3.71Å; F307-F318 HydrophobicContact CE1-CE1 3.71Å; F307-F318 HydrophobicContact CE1-CZ 4.42Å; F307-F318 HydrophobicContact CZ-CD1 4.03Å; F307-F318 AromaticContact CZ-CE1 3.61Å; F307-F318 HydrophobicContact CZ-CE1 3.61Å; F307-F318 AromaticContact CZ-CZ 3.89Å; F307-F318 HydrophobicContact CZ-CZ 3.89Å; L311-F318 HydrophobicContact CD1-CB 4.03Å; L311-F318 HydrophobicContact CD1-CD1 3.96Å; L311-F318 HydrophobicContact CD1-CG 3.96Å; H314-F318 PolarHBondContact O-N 3.04Å; L315-F318 WeakPolarHBondContact O-CB 3.35Å; L315-F318 PolarHBondContact O-N 3.03Å; F318-G321 PolarHBondContact O-N 3.27Å; F318-C322 VanDerWaalsContact CZ-SG 3.59Å; F318-C322 PolarHBondContact O-N 2.93Å; F318-C322 PolarHBondContact O-SG 3.16Å; F318-L333 HydrophobicContact CE2-CD1 4.43Å; F318-L333 HydrophobicContact CZ-CD1 3.79Å; F318-V336 HydrophobicContact CZ-CG1 4.36Å; F318-C361 HydrophobicContact CD2-CB 3.63Å; F318-C361 HydrophobicContact CE2-CB 3.87Å; F318-C361 HydrophobicContact CG-CB 4.45Å; F318-F364 HydrophobicContact CD2-CB 3.89Å; F318-F364 HydrophobicContact CD2-CD2 4.2Å; F318-F364 HydrophobicContact CD2-CG 4.35Å; F318-F364 HydrophobicContact CE2-CB 4.26Å; F318-F364 AromaticContact CE2-CD2 3.76Å; F318-F364 HydrophobicContact CE2-CD2 3.76Å; F318-F364 HydrophobicContact CE2-CG 4.21Å
319	I	98	Very high	96.4	Very high	82 Å²	82	48.7 Å²	48.7	42%	0.421	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-52.3	179.3	-66.1	168.1	0	0	0	110.4	L315 P316 G321 C322 Y323	L315-I319 HydrophobicContact CD1-CD1 4.24Å; L315-I319 HydrophobicContact CD1-CG1 4.44Å; L315-I319 HydrophobicContact CG-CD1 4.15Å; L315-I319 WeakPolarHBondContact O-CG1 3.48Å; L315-I319 PolarHBondContact O-N 3.06Å; P316-I319 PolarHBondContact O-N 2.91Å; I319-G321 VanDerWaalsContact C-N 3.29Å; I319-G321 PolarHBondContact O-N 2.91Å; I319-C322 WeakPolarHBondContact O-CB 3.31Å; I319-C322 PolarHBondContact O-N 3.32Å; I319-Y323 HydrophobicContact CG2-CE2 3.87Å; I319-Y323 WeakPolarHBondContact O-CD2 3.45Å; I319-Y323 WeakPolarHBondContact O-CE2 3.45Å
320	H	97.6	Very high	96.2	Very high	76 Å²	76	52.9 Å²	52.9	35%	0.352	26%	0.26	S	S	.	.	H	α-helix	trans	-58.5	-41.9	177.1	179.9	-125.1	0	0	0	112	P316 C322 Y323 L324 S368	P316-H320 WeakPolarHBondContact O-CB 3.33Å; P316-H320 PolarHBondContact O-N 3.39Å; H320-C322 VanDerWaalsContact C-N 3.34Å; H320-C322 PolarHBondContact O-N 2.97Å; H320-Y323 PolarHBondContact O-N 2.89Å; H320-L324 WeakPolarHBondContact CE1-CD1 3.36Å; H320-L324 PolarHBondContact O-N 3.43Å; H320-S368 PolarHBondContact ND1-OG 3.21Å
321	G	97.7	Very high	96.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-33.5	177.6	0	0	0	0	0	114	F317 F318 I319 Y323 L324 A325 F364	F317-G321 WeakPolarHBondContact O-CA 3.49Å; F317-G321 PolarHBondContact O-N 2.69Å; F318-G321 PolarHBondContact O-N 3.27Å; I319-G321 VanDerWaalsContact C-N 3.29Å; I319-G321 PolarHBondContact O-N 2.91Å; G321-Y323 PolarHBondContact O-N 3.33Å; G321-L324 PolarHBondContact O-N 3.4Å; G321-A325 VanDerWaalsContact O-CB 3.31Å; G321-A325 WeakPolarHBondContact O-CB 3.26Å; G321-A325 PolarHBondContact O-N 2.99Å; G321-F364 VanDerWaalsContact CA-O 3.31Å; G321-F364 WeakPolarHBondContact CA-O 3.43Å
322	C	97.6	Very high	96.2	Very high	34 Å²	34	53.9 Å²	53.9	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-32.8	176.7	-70.6	0	0	0	0	112.7	F318 I319 H320 L333	F318-C322 VanDerWaalsContact CZ-SG 3.59Å; F318-C322 PolarHBondContact O-N 2.93Å; F318-C322 PolarHBondContact O-SG 3.16Å; I319-C322 WeakPolarHBondContact O-CB 3.31Å; I319-C322 PolarHBondContact O-N 3.32Å; H320-C322 VanDerWaalsContact C-N 3.34Å; H320-C322 PolarHBondContact O-N 2.97Å; C322-L333 HydrophobicContact CB-CD2 4.29Å
323	Y	96.1	Very high	96.2	Very high	191 Å²	191	54.3 Å²	54.3	75%	0.749	26%	0.261	S	S	*	.	H	α-helix	trans	-78.2	-30.7	176.7	-64	-75.6	0	0	0	113	I319 H320 G321	I319-Y323 HydrophobicContact CG2-CE2 3.87Å; I319-Y323 WeakPolarHBondContact O-CD2 3.45Å; I319-Y323 WeakPolarHBondContact O-CE2 3.45Å; H320-Y323 PolarHBondContact O-N 2.89Å; G321-Y323 PolarHBondContact O-N 3.33Å
324	L	95.6	Very high	96.3	Very high	61 Å²	61	56.2 Å²	56.2	32%	0.319	27%	0.272	S	S	.	.	H	α-helix	trans	-91.1	-29.4	-174.3	-65	177.5	0	0	0	113.9	H320 G321 H371	H320-L324 WeakPolarHBondContact CE1-CD1 3.36Å; H320-L324 PolarHBondContact O-N 3.43Å; G321-L324 PolarHBondContact O-N 3.4Å; L324-H371 HydrophobicContact CD1-CB 3.74Å
325	A	95	Very high	96.3	Very high	14 Å²	14	56.2 Å²	56.2	12%	0.116	27%	0.272	C	S	.	.	S	Bend	trans	-63	138.6	-174.2	0	0	0	0	0	111.6	G321 F364 Y367	G321-A325 VanDerWaalsContact O-CB 3.31Å; G321-A325 WeakPolarHBondContact O-CB 3.26Å; G321-A325 PolarHBondContact O-N 2.99Å; A325-F364 HydrophobicContact CB-CD1 3.54Å; A325-F364 HydrophobicContact CB-CE1 3.6Å; A325-Y367 HydrophobicContact CB-CD2 3.86Å; A325-Y367 HydrophobicContact CB-CE2 4.12Å; A325-Y367 HydrophobicContact CB-CG 4.11Å
326	P	94.1	Very high	96.3	Very high	50 Å²	50	54.2 Å²	54.2	33%	0.325	26%	0.261	S	S	.	.			trans	-57	148	177.5	-26.8	35.6	0	0	0	112.7	R328 H329 Y367	P326-R328 HydrophobicContact CB-CG 4.22Å; P326-R328 PolarHBondContact O-N 2.97Å; P326-H329 PolarHBondContact O-N 3.39Å; P326-Y367 VanDerWaalsContact CD-CZ 3.43Å; P326-Y367 WeakPolarHBondContact CD-OH 3.17Å; P326-Y367 HydrophobicContact CG-CE1 4Å
327	K	91.9	Very high	96.3	Very high	158 Å²	158	54.6 Å²	54.6	69%	0.687	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-53.2	-29.6	-175.5	-65.1	-171.8	-178.9	175.7	0	114	H329 R330	K327-H329 PolarHBondContact O-N 3.22Å; K327-R330 WeakPolarHBondContact O-CB 3.41Å; K327-R330 VanDerWaalsContact O-CG 3.25Å; K327-R330 WeakPolarHBondContact O-CG 3.38Å; K327-R330 PolarHBondContact O-N 3.38Å
328	R	90.3	Very high	96.3	Very high	60 Å²	60	58 Å²	58	23%	0.226	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-59.9	-28.3	177.8	67.5	179.1	175	158.4	-17.9	114.3	L156 E157 E202 R236 P326 R330	L156-R328 PolarHBondContact O-NH1 3.29Å; L156-R328 PolarHBondContact O-NH2 3.35Å; E157-R328 IonicContact OE1-CZ 3.98Å; E157-R328 VanDerWaalsContact OE1-CZ 3.25Å; E157-R328 IonicContact OE1-NE 3.93Å; E157-R328 PolarHBondContact OE1-NE 3.44Å; E157-R328 IonicContact OE1-NH2 2.69Å; E157-R328 PolarHBondContact OE1-NH2 3.21Å; E157-R328 IonicContact OE2-NH2 2.73Å; E157-R328 PolarHBondContact OE2-NH2 3.06Å; E202-R328 HydrophobicContact CB-CB 4.43Å; E202-R328 PolarHBondContact O-NH1 3.37Å; E202-R328 WeakPolarHBondContact OE2-CB 3.45Å; R236-R328 PolarHBondContact NH1-O 3.47Å; P326-R328 HydrophobicContact CB-CG 4.22Å; P326-R328 PolarHBondContact O-N 2.97Å; R328-R330 VanDerWaalsContact C-N 3.32Å
329	H	93.8	Very high	96.3	Very high	3 Å²	3	57.6 Å²	57.6	1%	0.014	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-83.7	-5.1	178	-65.7	91.3	0	0	0	113.2	E157 P326 K327 I331 L332 F364 Y367	E157-H329 IonicContact OE1-CE1 3.21Å; E157-H329 PolarHBondContact OE1-CE1 3.02Å; E157-H329 IonicContact OE1-ND1 3.05Å; P326-H329 PolarHBondContact O-N 3.39Å; K327-H329 PolarHBondContact O-N 3.22Å; H329-I331 PolarHBondContact O-N 3.08Å; H329-I331 VanDerWaalsContact O-N 3.1Å; H329-L332 WeakPolarHBondContact O-CB 3.3Å; H329-L332 PolarHBondContact O-N 2.91Å; H329-F364 HydrophobicContact CB-CE1 4.48Å; H329-F364 HydrophobicContact CB-CZ 4.48Å; H329-Y367 PolarHBondContact CE1-OH 2.81Å; H329-Y367 AromaticContact ND1-CZ 4Å; H329-Y367 PolarHBondContact ND1-OH 2.94Å
330	R	94.1	Very high	96.3	Very high	153 Å²	153	53.8 Å²	53.8	58%	0.577	25%	0.249	S	C	*	.	H	α-helix	trans	-57.5	-28	179.3	-74.8	177.8	176	-165.7	-3.7	113.1	K327 R328 L332 L333 V334	K327-R330 WeakPolarHBondContact O-CB 3.41Å; K327-R330 VanDerWaalsContact O-CG 3.25Å; K327-R330 WeakPolarHBondContact O-CG 3.38Å; K327-R330 PolarHBondContact O-N 3.38Å; R328-R330 VanDerWaalsContact C-N 3.32Å; R330-L332 PolarHBondContact O-N 3.3Å; R330-L333 WeakPolarHBondContact O-CB 3.35Å; R330-L333 PolarHBondContact O-N 3.26Å; R330-L333 VanDerWaalsContact O-N 3.15Å; R330-V334 WeakPolarHBondContact O-CG2 3.28Å; R330-V334 PolarHBondContact O-N 3.42Å
331	I	96.4	Very high	96.3	Very high	21 Å²	21	54.5 Å²	54.5	11%	0.108	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-34.5	175.4	-166.6	61.9	0	0	0	112.4	L201 P232 L233 R236 H329 V334 T335	L201-I331 HydrophobicContact CD2-CG2 3.93Å; P232-I331 HydrophobicContact CB-CD1 4.41Å; L233-I331 HydrophobicContact CD2-CG1 3.69Å; L233-I331 HydrophobicContact CD2-CG2 4.21Å; R236-I331 HydrophobicContact CB-CD1 4.02Å; R236-I331 HydrophobicContact CB-CG1 4.39Å; R236-I331 HydrophobicContact CG-CD1 4.48Å; H329-I331 PolarHBondContact O-N 3.08Å; H329-I331 VanDerWaalsContact O-N 3.1Å; I331-V334 PolarHBondContact O-N 3.5Å; I331-T335 WeakPolarHBondContact O-CB 3.42Å; I331-T335 PolarHBondContact O-N 2.89Å; I331-T335 PolarHBondContact O-OG1 3.17Å
332	L	97.5	Very high	96.2	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-68.1	-40.4	177.6	-59.3	-177.6	0	0	0	110	L196 H329 R330 T335 V336 F360 V363 F364	L196-L332 HydrophobicContact CD1-CD2 4.08Å; L196-L332 HydrophobicContact CD2-CD2 4.22Å; H329-L332 WeakPolarHBondContact O-CB 3.3Å; H329-L332 PolarHBondContact O-N 2.91Å; R330-L332 PolarHBondContact O-N 3.3Å; L332-T335 WeakPolarHBondContact O-CB 3.13Å; L332-T335 PolarHBondContact O-N 3.48Å; L332-V336 WeakPolarHBondContact O-CG2 3.46Å; L332-V336 PolarHBondContact O-N 3.05Å; L332-F360 HydrophobicContact CB-CB 4.26Å; L332-F360 HydrophobicContact CD2-CD1 4.46Å; L332-F360 HydrophobicContact CD2-CD2 4.44Å; L332-F360 HydrophobicContact CD2-CG 4.34Å; L332-V363 HydrophobicContact CD1-CB 4.48Å; L332-V363 HydrophobicContact CD1-CG1 4.34Å; L332-V363 HydrophobicContact CD1-CG2 4.28Å; L332-F364 HydrophobicContact CB-CE2 4.09Å; L332-F364 HydrophobicContact CB-CZ 4.27Å
333	L	97.8	Very high	96.1	Very high	37 Å²	37	54.7 Å²	54.7	19%	0.194	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-45.7	174.2	-179.2	58.9	0	0	0	111.8	F318 C322 R330 T335 V336 L337 F364	F318-L333 HydrophobicContact CE2-CD1 4.43Å; F318-L333 HydrophobicContact CZ-CD1 3.79Å; C322-L333 HydrophobicContact CB-CD2 4.29Å; R330-L333 WeakPolarHBondContact O-CB 3.35Å; R330-L333 PolarHBondContact O-N 3.26Å; R330-L333 VanDerWaalsContact O-N 3.15Å; L333-T335 PolarHBondContact O-N 3.12Å; L333-V336 PolarHBondContact O-N 2.89Å; L333-L337 HydrophobicContact CD1-CD1 4.3Å; L333-L337 HydrophobicContact CD1-CG 4.24Å; L333-L337 HydrophobicContact CG-CD1 4.13Å; L333-L337 HydrophobicContact CG-CG 4.48Å; L333-L337 WeakPolarHBondContact O-CG 3.18Å; L333-L337 PolarHBondContact O-N 3.1Å; L333-F364 HydrophobicContact CB-CE1 4.33Å; L333-F364 HydrophobicContact CB-CE2 4.07Å; L333-F364 HydrophobicContact CB-CZ 3.61Å
334	V	98.1	Very high	96.1	Very high	75 Å²	75	45.8 Å²	45.8	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-57	-40.5	174.6	170	0	0	0	0	110.2	P232 R330 I331 L337 W338	P232-V334 HydrophobicContact CB-CG1 4.32Å; R330-V334 WeakPolarHBondContact O-CG2 3.28Å; R330-V334 PolarHBondContact O-N 3.42Å; I331-V334 PolarHBondContact O-N 3.5Å; V334-L337 PolarHBondContact O-N 3.06Å; V334-W338 WeakPolarHBondContact O-CB 3.43Å; V334-W338 PolarHBondContact O-N 3.48Å
335	T	98.3	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-41.8	178.3	-56.4	0	0	0	0	112.5	P229 L233 I331 L332 L333 T339 V357 F360	P229-T335 HydrophobicContact CB-CG2 4.13Å; P229-T335 WeakPolarHBondContact O-CG2 3.47Å; L233-T335 HydrophobicContact CD1-CG2 4.5Å; I331-T335 WeakPolarHBondContact O-CB 3.42Å; I331-T335 PolarHBondContact O-N 2.89Å; I331-T335 PolarHBondContact O-OG1 3.17Å; L332-T335 WeakPolarHBondContact O-CB 3.13Å; L332-T335 PolarHBondContact O-N 3.48Å; L333-T335 PolarHBondContact O-N 3.12Å; T335-T339 WeakPolarHBondContact O-CB 3.44Å; T335-T339 PolarHBondContact O-N 2.88Å; T335-T339 PolarHBondContact O-OG1 3.37Å; T335-V357 HydrophobicContact CG2-CG1 4.46Å; T335-F360 HydrophobicContact CG2-CD2 4.02Å; T335-F360 HydrophobicContact CG2-CE2 3.61Å
336	V	98.5	Very high	95.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-53.6	173.1	172.2	0	0	0	0	109.9	F307 F318 L332 L333 W338 T339 L340 V357 F360	F307-V336 HydrophobicContact CE2-CG1 3.81Å; F307-V336 HydrophobicContact CZ-CG1 3.9Å; F318-V336 HydrophobicContact CZ-CG1 4.36Å; L332-V336 WeakPolarHBondContact O-CG2 3.46Å; L332-V336 PolarHBondContact O-N 3.05Å; L333-V336 PolarHBondContact O-N 2.89Å; V336-W338 PolarHBondContact O-N 3.47Å; V336-T339 PolarHBondContact O-N 2.86Å; V336-L340 HydrophobicContact CG1-CD1 4.2Å; V336-L340 WeakPolarHBondContact O-CG 3.39Å; V336-L340 PolarHBondContact O-N 3.13Å; V336-V357 HydrophobicContact CG2-CB 4.12Å; V336-F360 HydrophobicContact CG2-CB 3.83Å; V336-F360 HydrophobicContact CG2-CD2 4.4Å
337	L	98.3	Very high	95.4	Very high	90 Å²	90	51.9 Å²	51.9	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-41.8	-177.6	-66.6	175.3	0	0	0	112.5	L333 V334 L340 L341	L333-L337 HydrophobicContact CD1-CD1 4.3Å; L333-L337 HydrophobicContact CD1-CG 4.24Å; L333-L337 HydrophobicContact CG-CD1 4.13Å; L333-L337 HydrophobicContact CG-CG 4.48Å; L333-L337 WeakPolarHBondContact O-CG 3.18Å; L333-L337 PolarHBondContact O-N 3.1Å; V334-L337 PolarHBondContact O-N 3.06Å; L337-L340 PolarHBondContact O-N 2.79Å; L337-L341 WeakPolarHBondContact O-CB 3.02Å; L337-L341 PolarHBondContact O-N 2.95Å
338	W	98.1	Very high	95.3	Very high	99 Å²	99	46 Å²	46	38%	0.375	22%	0.224	S	C	.	.	H	α-helix	trans	-58	-48.1	174.1	170.4	-99.1	0	0	0	111.4	I228 T231 P232 V334 V336 L340 L341 V342	I228-W338 PolarHBondContact O-NE1 3.37Å; T231-W338 HydrophobicContact CG2-CZ2 4.19Å; P232-W338 HydrophobicContact CG-CB 3.8Å; P232-W338 VanDerWaalsContact CG-CD1 3.44Å; P232-W338 HydrophobicContact CG-CD2 4.16Å; P232-W338 HydrophobicContact CG-CG 3.5Å; P232-W338 VanDerWaalsContact CG-CG 3.5Å; V334-W338 WeakPolarHBondContact O-CB 3.43Å; V334-W338 PolarHBondContact O-N 3.48Å; V336-W338 PolarHBondContact O-N 3.47Å; W338-L340 PolarHBondContact O-N 3.21Å; W338-L341 PolarHBondContact O-N 2.95Å; W338-V342 HydrophobicContact CD2-CG2 4.02Å; W338-V342 HydrophobicContact CE3-CG2 4.46Å; W338-V342 HydrophobicContact CH2-CG2 4.23Å; W338-V342 HydrophobicContact CZ2-CG2 3.74Å; W338-V342 WeakPolarHBondContact O-CG2 3.05Å; W338-V342 PolarHBondContact O-N 3.35Å
339	T	97.8	Very high	95.4	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-44.6	-179.6	-58	0	0	0	0	111.1	I228 T335 V336 L341 Y343 I354 V357	I228-T339 HydrophobicContact CG2-CG2 4.21Å; T335-T339 WeakPolarHBondContact O-CB 3.44Å; T335-T339 PolarHBondContact O-N 2.88Å; T335-T339 PolarHBondContact O-OG1 3.37Å; V336-T339 PolarHBondContact O-N 2.86Å; T339-L341 PolarHBondContact O-N 3.12Å; T339-Y343 HydrophobicContact CG2-CD2 3.6Å; T339-Y343 HydrophobicContact CG2-CE2 3.62Å; T339-Y343 VanDerWaalsContact O-CD2 3.26Å; T339-Y343 WeakPolarHBondContact O-CD2 3.48Å; T339-Y343 PolarHBondContact O-N 3.04Å; T339-Y343 VanDerWaalsContact O-N 3.09Å; T339-I354 HydrophobicContact CG2-CG2 4.49Å; T339-V357 HydrophobicContact CG2-CG1 3.92Å; T339-V357 HydrophobicContact CG2-CG2 4.18Å; T339-V357 WeakPolarHBondContact OG1-CG1 2.94Å
340	L	97.9	Very high	95.4	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-44	175.3	-64.9	178.7	0	0	0	111.7	F303 F307 V336 L337 W338 S344 I354	F303-L340 HydrophobicContact CD1-CD1 4.48Å; F303-L340 HydrophobicContact CE1-CB 3.94Å; F303-L340 HydrophobicContact CE1-CD1 4.16Å; F303-L340 HydrophobicContact CZ-CB 3.9Å; F307-L340 HydrophobicContact CB-CD1 4.25Å; F307-L340 HydrophobicContact CB-CD2 4.01Å; F307-L340 HydrophobicContact CD1-CD1 4.14Å; F307-L340 HydrophobicContact CD2-CD1 3.83Å; F307-L340 HydrophobicContact CD2-CD2 3.84Å; F307-L340 HydrophobicContact CD2-CG 4.37Å; F307-L340 HydrophobicContact CE1-CD1 4.38Å; F307-L340 HydrophobicContact CE2-CD1 4.09Å; F307-L340 HydrophobicContact CG-CD1 3.83Å; F307-L340 HydrophobicContact CG-CD2 4.15Å; F307-L340 HydrophobicContact CZ-CD1 4.34Å; V336-L340 HydrophobicContact CG1-CD1 4.2Å; V336-L340 WeakPolarHBondContact O-CG 3.39Å; V336-L340 PolarHBondContact O-N 3.13Å; L337-L340 PolarHBondContact O-N 2.79Å; W338-L340 PolarHBondContact O-N 3.21Å; L340-S344 WeakPolarHBondContact O-CB 3.4Å; L340-S344 PolarHBondContact O-N 3.29Å; L340-S344 PolarHBondContact O-OG 2.94Å; L340-I354 HydrophobicContact CD2-CB 4.44Å; L340-I354 HydrophobicContact CD2-CD1 3.73Å; L340-I354 HydrophobicContact CD2-CG2 4.1Å
341	L	97.6	Very high	95.5	Very high	91 Å²	91	41 Å²	41	48%	0.476	21%	0.209	S	C	.	.	H	α-helix	trans	-61.5	-50.3	179.4	-174.8	75.8	0	0	0	111.7	L337 W338 T339 S344 M345	L337-L341 WeakPolarHBondContact O-CB 3.02Å; L337-L341 PolarHBondContact O-N 2.95Å; W338-L341 PolarHBondContact O-N 2.95Å; T339-L341 PolarHBondContact O-N 3.12Å; L341-S344 WeakPolarHBondContact O-CB 3.5Å; L341-S344 PolarHBondContact O-N 3.29Å; L341-M345 WeakPolarHBondContact O-CG 3.45Å; L341-M345 PolarHBondContact O-N 3.06Å
342	V	96.3	Very high	95.5	Very high	34 Å²	34	40.2 Å²	40.2	21%	0.206	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-48.1	-178.3	173	0	0	0	0	110.7	I228 W338 S344 M345	I228-V342 HydrophobicContact CD1-CG1 3.93Å; I228-V342 HydrophobicContact CG1-CG1 4.13Å; I228-V342 HydrophobicContact CG2-CB 3.91Å; I228-V342 HydrophobicContact CG2-CG1 3.94Å; I228-V342 HydrophobicContact CG2-CG2 4.29Å; W338-V342 HydrophobicContact CD2-CG2 4.02Å; W338-V342 HydrophobicContact CE3-CG2 4.46Å; W338-V342 HydrophobicContact CH2-CG2 4.23Å; W338-V342 HydrophobicContact CZ2-CG2 3.74Å; W338-V342 WeakPolarHBondContact O-CG2 3.05Å; W338-V342 PolarHBondContact O-N 3.35Å; V342-S344 VanDerWaalsContact C-N 3.29Å; V342-S344 PolarHBondContact O-N 2.99Å; V342-M345 PolarHBondContact O-N 2.9Å
343	Y	94.6	Very high	95.4	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-27.8	177.8	-79	-63.6	0	0	0	113	T225 I228 Y302 T339 M345 L346 F353 I354	T225-Y343 VanDerWaalsContact CB-OH 3.3Å; T225-Y343 WeakPolarHBondContact CB-OH 3.3Å; T225-Y343 PolarHBondContact OG1-OH 3.27Å; I228-Y343 HydrophobicContact CD1-CD1 4.5Å; I228-Y343 HydrophobicContact CD1-CE1 3.94Å; I228-Y343 HydrophobicContact CD1-CE2 4.18Å; I228-Y343 HydrophobicContact CG2-CE2 4.46Å; Y302-Y343 VanDerWaalsContact CE2-CB 3.43Å; Y302-Y343 HydrophobicContact CE2-CG 4.4Å; T339-Y343 HydrophobicContact CG2-CD2 3.6Å; T339-Y343 HydrophobicContact CG2-CE2 3.62Å; T339-Y343 VanDerWaalsContact O-CD2 3.26Å; T339-Y343 WeakPolarHBondContact O-CD2 3.48Å; T339-Y343 PolarHBondContact O-N 3.04Å; T339-Y343 VanDerWaalsContact O-N 3.09Å; Y343-M345 PolarHBondContact O-N 3.19Å; Y343-L346 HydrophobicContact CD1-CD1 3.98Å; Y343-L346 HydrophobicContact CE1-CD1 4.46Å; Y343-L346 PolarHBondContact O-N 2.89Å; Y343-F353 HydrophobicContact CD1-CB 4.26Å; Y343-F353 HydrophobicContact CD1-CD2 4.35Å; Y343-F353 HydrophobicContact CE1-CB 3.87Å; Y343-F353 HydrophobicContact CE1-CD2 4.2Å; Y343-F353 HydrophobicContact CE1-CG 4.28Å; Y343-F353 HydrophobicContact CE2-CB 4.33Å; Y343-F353 WeakPolarHBondContact CE2-O 3.44Å; Y343-F353 PolarHBondContact OH-O 3.02Å; Y343-I354 HydrophobicContact CD2-CG2 3.8Å; Y343-I354 HydrophobicContact CE2-CG2 4.31Å; Y343-I354 HydrophobicContact CG-CG2 4.43Å
344	S	95.8	Very high	95.3	Very high	5 Å²	5	39.5 Å²	39.5	4%	0.035	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-29.2	172.9	-94.4	0	0	0	0	113.4	W299 F303 L340 L341 V342 L346 K349	W299-S344 WeakPolarHBondContact CA-O 3.49Å; W299-S344 WeakPolarHBondContact O-CB 3.48Å; W299-S344 PolarHBondContact O-OG 3.19Å; F303-S344 WeakPolarHBondContact CE2-OG 3.38Å; L340-S344 WeakPolarHBondContact O-CB 3.4Å; L340-S344 PolarHBondContact O-N 3.29Å; L340-S344 PolarHBondContact O-OG 2.94Å; L341-S344 WeakPolarHBondContact O-CB 3.5Å; L341-S344 PolarHBondContact O-N 3.29Å; V342-S344 VanDerWaalsContact C-N 3.29Å; V342-S344 PolarHBondContact O-N 2.99Å; S344-L346 VanDerWaalsContact C-N 3.31Å; S344-K349 WeakPolarHBondContact O-CE 3.3Å; S344-K349 PolarHBondContact O-NZ 2.86Å
345	M	92.4	Very high	95.3	Very high	151 Å²	151	36.2 Å²	36.2	74%	0.744	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-16.4	177.2	-63.8	176.8	73	0	0	113.3	L341 V342 Y343	L341-M345 WeakPolarHBondContact O-CG 3.45Å; L341-M345 PolarHBondContact O-N 3.06Å; V342-M345 PolarHBondContact O-N 2.9Å; Y343-M345 PolarHBondContact O-N 3.19Å
346	L	90.3	Very high	95.3	Very high	61 Å²	61	36.4 Å²	36.4	32%	0.319	18%	0.18	S	C	.	.	S	Bend	trans	-85.7	138.1	177.6	-58.9	-179.6	0	0	0	110.5	Y343 S344 K349	Y343-L346 HydrophobicContact CD1-CD1 3.98Å; Y343-L346 HydrophobicContact CE1-CD1 4.46Å; Y343-L346 PolarHBondContact O-N 2.89Å; S344-L346 VanDerWaalsContact C-N 3.31Å; L346-K349 WeakPolarHBondContact O-CE 3.39Å; L346-K349 PolarHBondContact O-NZ 3.45Å
347	S	88.2	Confident	95.2	Very high	40 Å²	40	36.4 Å²	36.4	28%	0.28	18%	0.18	S	C	.	.	S	Bend	trans	-65.8	-45.6	-177	-59.1	0	0	0	0	112.5	S296 H297	S296-S347 WeakPolarHBondContact CA-O 3.38Å; H297-S347 PolarHBondContact N-O 2.01Å
348	H	89.6	Confident	95.2	Very high	36 Å²	36	32.3 Å²	32.3	17%	0.167	16%	0.159	C	C	.	.	S	Bend	trans	-84.1	132.9	177.1	-176.6	68.6	0	0	0	111	G291 Y294 G295 E350 F353	G291-H348 WeakPolarHBondContact O-CB 3.39Å; Y294-H348 PolarHBondContact O-CE1 3.36Å; Y294-H348 VanDerWaalsContact O-CE1 3.26Å; Y294-H348 PolarHBondContact O-ND1 3.26Å; G295-H348 PolarHBondContact O-ND1 3.02Å; H348-E350 IonicContact CE1-OE1 2.8Å; H348-E350 IonicContact NE2-OE1 3.98Å; H348-E350 PolarHBondContact NE2-OE1 2.8Å; H348-F353 AromaticContact CD2-CE2 3.9Å
349	K	92.8	Very high	95.3	Very high	6 Å²	6	27.7 Å²	27.7	3%	0.026	14%	0.141	C	C	.	.			trans	-141.6	141.7	-173.2	-56.5	-176	175.3	64.8	0	110.1	H297 P298 W301 Y302 S344 L346	H297-K349 HydrophobicContact CB-CB 4.26Å; H297-K349 HydrophobicContact CB-CD 3.92Å; H297-K349 HydrophobicContact CB-CG 4.25Å; H297-K349 PolarHBondContact O-NZ 3.44Å; P298-K349 WeakPolarHBondContact O-CE 3.17Å; P298-K349 PolarHBondContact O-NZ 2.8Å; W301-K349 HydrophobicContact CB-CD 3.9Å; W301-K349 HydrophobicContact CD2-CB 4.46Å; W301-K349 HydrophobicContact CD2-CD 4.38Å; W301-K349 HydrophobicContact CE3-CB 3.79Å; W301-K349 HydrophobicContact CE3-CD 3.93Å; W301-K349 HydrophobicContact CG-CD 4.41Å; W301-K349 HydrophobicContact CZ3-CB 4Å; Y302-K349 HydrophobicContact CD2-CD 3.68Å; Y302-K349 HydrophobicContact CD2-CG 4.2Å; Y302-K349 HydrophobicContact CE2-CB 3.67Å; Y302-K349 HydrophobicContact CE2-CD 3.6Å; Y302-K349 HydrophobicContact CE2-CG 3.58Å; S344-K349 WeakPolarHBondContact O-CE 3.3Å; S344-K349 PolarHBondContact O-NZ 2.86Å; L346-K349 WeakPolarHBondContact O-CE 3.39Å; L346-K349 PolarHBondContact O-NZ 3.45Å
350	E	93.8	Very high	95.3	Very high	40 Å²	40	27.6 Å²	27.6	19%	0.187	14%	0.141	C	C	.	.			trans	-143.1	154.4	175	-61.9	-178.2	179	0	0	110.8	Y302 H348 R352 F353	Y302-E350 WeakPolarHBondContact CE1-O 3.4Å; Y302-E350 PolarHBondContact OH-N 3.47Å; Y302-E350 VanDerWaalsContact OH-N 3.07Å; Y302-E350 PolarHBondContact OH-O 2.86Å; H348-E350 IonicContact CE1-OE1 2.8Å; H348-E350 IonicContact NE2-OE1 3.98Å; H348-E350 PolarHBondContact NE2-OE1 2.8Å; E350-R352 HydrophobicContact CB-CG 4.43Å; E350-R352 PolarHBondContact O-N 3.22Å; E350-R352 IonicContact OE1-NH2 3.86Å; E350-R352 PolarHBondContact OE1-NH2 3.42Å; E350-R352 VanDerWaalsContact OE1-NH2 3.08Å; E350-R352 IonicContact OE2-CZ 3.6Å; E350-R352 IonicContact OE2-NE 2.69Å; E350-R352 PolarHBondContact OE2-NE 2.92Å; E350-R352 IonicContact OE2-NH2 2.7Å; E350-R352 PolarHBondContact OE2-NH2 3.15Å; E350-F353 HydrophobicContact CB-CD1 4.16Å; E350-F353 HydrophobicContact CB-CD2 4.09Å; E350-F353 HydrophobicContact CB-CE1 4.01Å; E350-F353 HydrophobicContact CB-CE2 3.96Å; E350-F353 HydrophobicContact CB-CG 4.18Å; E350-F353 HydrophobicContact CB-CZ 3.91Å; E350-F353 VanDerWaalsContact CD-CZ 3.43Å; E350-F353 HydrophobicContact CG-CE1 4.13Å; E350-F353 HydrophobicContact CG-CE2 3.93Å; E350-F353 HydrophobicContact CG-CZ 3.68Å; E350-F353 PolarHBondContact O-N 3.4Å; E350-F353 WeakPolarHBondContact OE2-CE1 3.44Å; E350-F353 WeakPolarHBondContact OE2-CZ 3.33Å
351	F	95.7	Very high	95.3	Very high	65 Å²	65	27.5 Å²	27.5	29%	0.285	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-60.6	-43.9	179.3	-63.8	-73.3	0	0	0	112.2	F174 W301 V309 I310 F353 I354	F174-F351 HydrophobicContact CE2-CB 4.12Å; F174-F351 HydrophobicContact CZ-CB 4.06Å; W301-F351 AromaticContact CH2-CD1 3.65Å; W301-F351 HydrophobicContact CH2-CD1 3.65Å; W301-F351 HydrophobicContact CH2-CD2 4.17Å; W301-F351 AromaticContact CH2-CE1 3.54Å; W301-F351 HydrophobicContact CH2-CE1 3.54Å; W301-F351 HydrophobicContact CH2-CE2 4.06Å; W301-F351 AromaticContact CH2-CG 3.97Å; W301-F351 HydrophobicContact CH2-CG 3.97Å; W301-F351 AromaticContact CH2-CZ 3.76Å; W301-F351 HydrophobicContact CH2-CZ 3.76Å; W301-F351 HydrophobicContact CZ2-CD1 4.26Å; W301-F351 AromaticContact CZ2-CE1 3.67Å; W301-F351 HydrophobicContact CZ2-CE1 3.67Å; W301-F351 AromaticContact CZ2-CE2 3.99Å; W301-F351 HydrophobicContact CZ2-CE2 3.99Å; W301-F351 AromaticContact CZ2-CZ 3.52Å; W301-F351 HydrophobicContact CZ2-CZ 3.52Å; W301-F351 HydrophobicContact CZ3-CD1 4.49Å; V309-F351 HydrophobicContact CB-CD1 4.31Å; V309-F351 HydrophobicContact CB-CE1 3.71Å; V309-F351 HydrophobicContact CB-CZ 4.46Å; V309-F351 HydrophobicContact CG1-CD1 4.14Å; V309-F351 HydrophobicContact CG1-CE1 3.7Å; V309-F351 HydrophobicContact CG1-CZ 4.17Å; V309-F351 HydrophobicContact CG2-CE1 4.13Å; I310-F351 HydrophobicContact CD1-CB 3.83Å; I310-F351 HydrophobicContact CD1-CD1 4.22Å; I310-F351 WeakPolarHBondContact CD1-O 3.49Å; I310-F351 HydrophobicContact CG1-CB 4.09Å; I310-F351 HydrophobicContact CG1-CD1 4.01Å; I310-F351 HydrophobicContact CG1-CG 4.49Å; F351-F353 PolarHBondContact O-N 3.22Å; F351-F353 VanDerWaalsContact O-N 3.14Å; F351-I354 WeakPolarHBondContact O-CG1 3.46Å; F351-I354 PolarHBondContact O-N 2.95Å
352	R	95.4	Very high	95.4	Very high	3 Å²	3	23.1 Å²	23.1	1%	0.011	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-64.6	-20.9	-175.4	65.5	179.7	173.3	-172.9	-7.9	114.5	F73 V74 D76 N185 E350 I354 Y355	F73-R352 HydrophobicContact CE1-CB 4.13Å; V74-R352 VanDerWaalsContact CB-NH1 3.34Å; D76-R352 VanDerWaalsContact CG-CZ 3.43Å; D76-R352 IonicContact OD1-CZ 2.84Å; D76-R352 IonicContact OD1-NH1 3.27Å; D76-R352 PolarHBondContact OD1-NH1 3.4Å; D76-R352 VanDerWaalsContact OD1-NH1 3.08Å; D76-R352 IonicContact OD1-NH2 3.1Å; D76-R352 PolarHBondContact OD1-NH2 3.22Å; D76-R352 IonicContact OD2-CZ 3.82Å; D76-R352 IonicContact OD2-NH1 3.8Å; D76-R352 PolarHBondContact OD2-NH1 3.45Å; D76-R352 IonicContact OD2-NH2 3.28Å; D76-R352 PolarHBondContact OD2-NH2 3.09Å; N185-R352 HydrophobicContact CB-CB 4.34Å; N185-R352 WeakPolarHBondContact OD1-CD 3.37Å; E350-R352 HydrophobicContact CB-CG 4.43Å; E350-R352 PolarHBondContact O-N 3.22Å; E350-R352 IonicContact OE1-NH2 3.86Å; E350-R352 PolarHBondContact OE1-NH2 3.42Å; E350-R352 VanDerWaalsContact OE1-NH2 3.08Å; E350-R352 IonicContact OE2-CZ 3.6Å; E350-R352 IonicContact OE2-NE 2.69Å; E350-R352 PolarHBondContact OE2-NE 2.92Å; E350-R352 IonicContact OE2-NH2 2.7Å; E350-R352 PolarHBondContact OE2-NH2 3.15Å; R352-I354 PolarHBondContact O-N 2.96Å; R352-Y355 WeakPolarHBondContact O-CB 3.34Å; R352-Y355 PolarHBondContact O-N 3.2Å; R352-Y355 VanDerWaalsContact O-N 3.13Å
353	F	95.8	Very high	95.5	Very high	22 Å²	22	21.6 Å²	21.6	10%	0.096	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-64.9	-28.5	-178.5	-65.5	-8.8	0	0	0	113.4	R223 Y343 H348 E350 F351 P356	R223-F353 VanDerWaalsContact NH2-CD1 3.31Å; Y343-F353 HydrophobicContact CD1-CB 4.26Å; Y343-F353 HydrophobicContact CD1-CD2 4.35Å; Y343-F353 HydrophobicContact CE1-CB 3.87Å; Y343-F353 HydrophobicContact CE1-CD2 4.2Å; Y343-F353 HydrophobicContact CE1-CG 4.28Å; Y343-F353 HydrophobicContact CE2-CB 4.33Å; Y343-F353 WeakPolarHBondContact CE2-O 3.44Å; Y343-F353 PolarHBondContact OH-O 3.02Å; H348-F353 AromaticContact CD2-CE2 3.9Å; E350-F353 HydrophobicContact CB-CD1 4.16Å; E350-F353 HydrophobicContact CB-CD2 4.09Å; E350-F353 HydrophobicContact CB-CE1 4.01Å; E350-F353 HydrophobicContact CB-CE2 3.96Å; E350-F353 HydrophobicContact CB-CG 4.18Å; E350-F353 HydrophobicContact CB-CZ 3.91Å; E350-F353 VanDerWaalsContact CD-CZ 3.43Å; E350-F353 HydrophobicContact CG-CE1 4.13Å; E350-F353 HydrophobicContact CG-CE2 3.93Å; E350-F353 HydrophobicContact CG-CZ 3.68Å; E350-F353 PolarHBondContact O-N 3.4Å; E350-F353 WeakPolarHBondContact OE2-CE1 3.44Å; E350-F353 WeakPolarHBondContact OE2-CZ 3.33Å; F351-F353 PolarHBondContact O-N 3.22Å; F351-F353 VanDerWaalsContact O-N 3.14Å; F353-P356 WeakPolarHBondContact O-CD 3.36Å
354	I	97.2	Very high	95.6	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.015	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-98.8	6.7	178.1	66.2	168.1	0	0	0	112.6	Y302 F307 I310 T339 L340 Y343 F351 R352 P356 V357	Y302-I354 HydrophobicContact CD1-CD1 3.79Å; Y302-I354 HydrophobicContact CD1-CG1 4.36Å; Y302-I354 HydrophobicContact CD1-CG2 3.93Å; Y302-I354 HydrophobicContact CE1-CB 4.48Å; Y302-I354 HydrophobicContact CE1-CD1 4.05Å; Y302-I354 HydrophobicContact CE1-CG1 4.12Å; Y302-I354 HydrophobicContact CE1-CG2 3.58Å; F307-I354 HydrophobicContact CB-CD1 4.15Å; F307-I354 HydrophobicContact CD2-CD1 4.13Å; I310-I354 HydrophobicContact CD1-CD1 3.66Å; I310-I354 HydrophobicContact CD1-CG1 3.4Å; I310-I354 VanDerWaalsContact CD1-CG1 3.4Å; T339-I354 HydrophobicContact CG2-CG2 4.49Å; L340-I354 HydrophobicContact CD2-CB 4.44Å; L340-I354 HydrophobicContact CD2-CD1 3.73Å; L340-I354 HydrophobicContact CD2-CG2 4.1Å; Y343-I354 HydrophobicContact CD2-CG2 3.8Å; Y343-I354 HydrophobicContact CE2-CG2 4.31Å; Y343-I354 HydrophobicContact CG-CG2 4.43Å; F351-I354 WeakPolarHBondContact O-CG1 3.46Å; F351-I354 PolarHBondContact O-N 2.95Å; R352-I354 PolarHBondContact O-N 2.96Å; I354-P356 VanDerWaalsContact C-N 3.32Å; I354-V357 HydrophobicContact CB-CG2 4.3Å; I354-V357 WeakPolarHBondContact O-CG2 3.38Å; I354-V357 PolarHBondContact O-N 3.32Å
355	Y	97.6	Very high	95.8	Very high	6 Å²	6	21.3 Å²	21.3	2%	0.024	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-55.1	-38.8	174.5	-171.7	-143.8	0	0	0	113.9	F174 C178 T186 T189 R352 V357 L358 P359	F174-Y355 AromaticContact CD1-CD2 3.69Å; F174-Y355 HydrophobicContact CD1-CD2 3.69Å; F174-Y355 HydrophobicContact CD1-CE2 4.18Å; F174-Y355 HydrophobicContact CD1-CG 4.35Å; F174-Y355 AromaticContact CE1-CD2 3.76Å; F174-Y355 HydrophobicContact CE1-CD2 3.76Å; F174-Y355 AromaticContact CE1-CG 3.95Å; F174-Y355 HydrophobicContact CE1-CG 3.95Å; C178-Y355 HydrophobicContact CB-CD1 4.21Å; C178-Y355 HydrophobicContact CB-CE1 3.76Å; T186-Y355 HydrophobicContact CG2-CE1 4.34Å; T189-Y355 HydrophobicContact CG2-CD1 4.24Å; T189-Y355 HydrophobicContact CG2-CE1 4.01Å; T189-Y355 HydrophobicContact CG2-CE2 4.33Å; T189-Y355 HydrophobicContact CG2-CG 4.49Å; T189-Y355 WeakPolarHBondContact OG1-CD1 3.49Å; R352-Y355 WeakPolarHBondContact O-CB 3.34Å; R352-Y355 PolarHBondContact O-N 3.2Å; R352-Y355 VanDerWaalsContact O-N 3.13Å; Y355-V357 PolarHBondContact O-N 2.81Å; Y355-V357 VanDerWaalsContact O-N 3.09Å; Y355-L358 HydrophobicContact CD2-CB 4.12Å; Y355-L358 HydrophobicContact CD2-CD2 3.92Å; Y355-L358 HydrophobicContact CE2-CD2 3.93Å; Y355-L358 VanDerWaalsContact O-CB 3.27Å; Y355-L358 WeakPolarHBondContact O-CB 3.13Å; Y355-L358 PolarHBondContact O-N 3.49Å; Y355-P359 WeakPolarHBondContact O-CD 3.23Å
356	P	97.3	Very high	96	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.019	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-60.3	-23.8	-178.3	-25.9	35.4	0	0	0	115	E188 T189 P229 F353 I354	E188-P356 HydrophobicContact CB-CG 4.21Å; E188-P356 HydrophobicContact CG-CB 4.15Å; E188-P356 HydrophobicContact CG-CG 3.57Å; E188-P356 VanDerWaalsContact OE2-CG 3.27Å; E188-P356 WeakPolarHBondContact OE2-CG 3.42Å; T189-P356 VanDerWaalsContact OG1-CA 3.26Å; T189-P356 WeakPolarHBondContact OG1-CA 3.34Å; P229-P356 HydrophobicContact CG-CB 4.45Å; F353-P356 WeakPolarHBondContact O-CD 3.36Å; I354-P356 VanDerWaalsContact C-N 3.32Å
357	V	97.9	Very high	96.4	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.006	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	-96.1	-7.1	178	-63	0	0	0	0	113.6	P229 T335 V336 T339 I354 Y355 P359 F360 C361	P229-V357 HydrophobicContact CB-CG1 3.8Å; T335-V357 HydrophobicContact CG2-CG1 4.46Å; V336-V357 HydrophobicContact CG2-CB 4.12Å; T339-V357 HydrophobicContact CG2-CG1 3.92Å; T339-V357 HydrophobicContact CG2-CG2 4.18Å; T339-V357 WeakPolarHBondContact OG1-CG1 2.94Å; I354-V357 HydrophobicContact CB-CG2 4.3Å; I354-V357 WeakPolarHBondContact O-CG2 3.38Å; I354-V357 PolarHBondContact O-N 3.32Å; Y355-V357 PolarHBondContact O-N 2.81Å; Y355-V357 VanDerWaalsContact O-N 3.09Å; V357-P359 VanDerWaalsContact C-CD 3.46Å; V357-F360 HydrophobicContact CB-CD2 4.24Å; V357-F360 HydrophobicContact CG1-CD2 4.17Å; V357-F360 HydrophobicContact CG1-CE2 4.22Å; V357-F360 VanDerWaalsContact O-CB 3.3Å; V357-F360 WeakPolarHBondContact O-CB 3.33Å; V357-F360 PolarHBondContact O-N 3.15Å; V357-C361 PolarHBondContact O-N 2.61Å
358	L	98.3	Very high	96.8	Very high	4 Å²	4	9.7 Å²	9.7	2%	0.021	4%	0.044	C	C	.	.	H	α-helix	trans	-56.8	-42.6	176.7	-174	61.3	0	0	0	113.3	F174 I310 L311 Y355 F360 C361 M362	F174-L358 HydrophobicContact CB-CD2 4.16Å; F174-L358 HydrophobicContact CD1-CD2 3.98Å; I310-L358 HydrophobicContact CG2-CD1 3.73Å; I310-L358 HydrophobicContact CG2-CD2 3.83Å; I310-L358 HydrophobicContact CG2-CG 4.29Å; L311-L358 HydrophobicContact CD2-CD1 3.64Å; L311-L358 HydrophobicContact CG-CD1 4.38Å; Y355-L358 HydrophobicContact CD2-CB 4.12Å; Y355-L358 HydrophobicContact CD2-CD2 3.92Å; Y355-L358 HydrophobicContact CE2-CD2 3.93Å; Y355-L358 VanDerWaalsContact O-CB 3.27Å; Y355-L358 WeakPolarHBondContact O-CB 3.13Å; Y355-L358 PolarHBondContact O-N 3.49Å; L358-F360 PolarHBondContact O-N 3.08Å; L358-C361 VanDerWaalsContact O-CB 3.32Å; L358-C361 WeakPolarHBondContact O-CB 3.4Å; L358-C361 PolarHBondContact O-N 3.01Å; L358-M362 HydrophobicContact CD1-CE 3.34Å; L358-M362 HydrophobicContact CD2-CE 4.35Å; L358-M362 HydrophobicContact CG-CE 3.72Å; L358-M362 WeakPolarHBondContact O-CG 3.42Å; L358-M362 PolarHBondContact O-N 2.85Å; L358-M362 VanDerWaalsContact O-N 3.1Å
359	P	98.3	Very high	97.2	Very high	1 Å²	1	8 Å²	8	1%	0.006	4%	0.036	C	C	.	.	H	α-helix	trans	-59.8	-29.9	175.9	-23	34.2	0	0	0	113	L149 T189 I193 Y355 V357 C361 M362 V363	L149-P359 HydrophobicContact CD2-CB 4.16Å; T189-P359 HydrophobicContact CG2-CG 3.79Å; I193-P359 HydrophobicContact CD1-CB 3.92Å; I193-P359 HydrophobicContact CD1-CG 3.49Å; I193-P359 VanDerWaalsContact CD1-CG 3.49Å; I193-P359 HydrophobicContact CG1-CB 3.83Å; I193-P359 HydrophobicContact CG1-CG 3.65Å; Y355-P359 WeakPolarHBondContact O-CD 3.23Å; V357-P359 VanDerWaalsContact C-CD 3.46Å; P359-C361 VanDerWaalsContact C-N 3.35Å; P359-M362 PolarHBondContact O-N 2.78Å; P359-V363 PolarHBondContact O-N 3.33Å
360	F	98.4	Very high	97.3	Very high	1 Å²	1	8.7 Å²	8.7	0%	0.004	4%	0.041	C	C	.	.	H	α-helix	trans	-69.9	-37.4	177.5	-56.9	-6.1	0	0	0	110.3	T192 L196 L233 L332 T335 V336 V357 L358 M362 V363 F364	T192-F360 HydrophobicContact CG2-CE1 3.97Å; T192-F360 HydrophobicContact CG2-CZ 3.59Å; L196-F360 HydrophobicContact CD2-CD1 4.06Å; L196-F360 HydrophobicContact CD2-CE1 3.68Å; L233-F360 HydrophobicContact CD1-CE2 4.46Å; L233-F360 HydrophobicContact CD1-CZ 4.42Å; L332-F360 HydrophobicContact CB-CB 4.26Å; L332-F360 HydrophobicContact CD2-CD1 4.46Å; L332-F360 HydrophobicContact CD2-CD2 4.44Å; L332-F360 HydrophobicContact CD2-CG 4.34Å; T335-F360 HydrophobicContact CG2-CD2 4.02Å; T335-F360 HydrophobicContact CG2-CE2 3.61Å; V336-F360 HydrophobicContact CG2-CB 3.83Å; V336-F360 HydrophobicContact CG2-CD2 4.4Å; V357-F360 HydrophobicContact CB-CD2 4.24Å; V357-F360 HydrophobicContact CG1-CD2 4.17Å; V357-F360 HydrophobicContact CG1-CE2 4.22Å; V357-F360 VanDerWaalsContact O-CB 3.3Å; V357-F360 WeakPolarHBondContact O-CB 3.33Å; V357-F360 PolarHBondContact O-N 3.15Å; L358-F360 PolarHBondContact O-N 3.08Å; F360-M362 VanDerWaalsContact C-N 3.31Å; F360-M362 PolarHBondContact O-N 3.03Å; F360-V363 WeakPolarHBondContact O-CB 3.26Å; F360-V363 PolarHBondContact O-N 3.48Å; F360-F364 WeakPolarHBondContact O-CD2 3.29Å
361	C	98.6	Very high	97.4	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.8	-39	171.7	-57.7	0	0	0	0	111.9	F307 L311 F318 V357 L358 P359 V363 F364 C365	F307-C361 VanDerWaalsContact CE2-SG 3.59Å; L311-C361 HydrophobicContact CD2-CB 3.67Å; F318-C361 HydrophobicContact CD2-CB 3.63Å; F318-C361 HydrophobicContact CE2-CB 3.87Å; F318-C361 HydrophobicContact CG-CB 4.45Å; V357-C361 PolarHBondContact O-N 2.61Å; L358-C361 VanDerWaalsContact O-CB 3.32Å; L358-C361 WeakPolarHBondContact O-CB 3.4Å; L358-C361 PolarHBondContact O-N 3.01Å; P359-C361 VanDerWaalsContact C-N 3.35Å; C361-V363 PolarHBondContact O-N 2.89Å; C361-F364 PolarHBondContact O-N 3.38Å; C361-C365 PolarHBondContact O-N 3.32Å; C361-C365 PolarHBondContact O-SG 3.34Å; C361-C365 VanDerWaalsContact O-SG 3.35Å
362	M	98.4	Very high	97.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63	-27.8	178.4	-60.2	-54.9	148	0	0	112.9	C168 Q169 L311 L358 P359 F360 C365 G366	C168-M362 HydrophobicContact CB-CB 4.24Å; C168-M362 HydrophobicContact CB-CG 4.45Å; C168-M362 HydrophobicContact CB-SD 3.73Å; Q169-M362 HydrophobicContact CB-CB 4.36Å; Q169-M362 HydrophobicContact CB-CG 4.36Å; L311-M362 HydrophobicContact CD2-CE 3.84Å; L358-M362 HydrophobicContact CD1-CE 3.34Å; L358-M362 HydrophobicContact CD2-CE 4.35Å; L358-M362 HydrophobicContact CG-CE 3.72Å; L358-M362 WeakPolarHBondContact O-CG 3.42Å; L358-M362 PolarHBondContact O-N 2.85Å; L358-M362 VanDerWaalsContact O-N 3.1Å; P359-M362 PolarHBondContact O-N 2.78Å; F360-M362 VanDerWaalsContact C-N 3.31Å; F360-M362 PolarHBondContact O-N 3.03Å; M362-C365 PolarHBondContact O-N 2.69Å; M362-G366 PolarHBondContact O-N 2.76Å
363	V	98.3	Very high	97.1	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-57.8	-50.6	170.3	176.2	0	0	0	0	110.6	L149 M153 V165 L332 P359 F360 C361 G366 Y367	L149-V363 HydrophobicContact CD1-CG2 4.35Å; M153-V363 HydrophobicContact CE-CG1 3.72Å; M153-V363 HydrophobicContact CG-CG2 4.41Å; M153-V363 HydrophobicContact SD-CB 4.46Å; M153-V363 HydrophobicContact SD-CG1 3.82Å; M153-V363 HydrophobicContact SD-CG2 3.82Å; V165-V363 HydrophobicContact CG1-CG2 4.23Å; L332-V363 HydrophobicContact CD1-CB 4.48Å; L332-V363 HydrophobicContact CD1-CG1 4.34Å; L332-V363 HydrophobicContact CD1-CG2 4.28Å; P359-V363 PolarHBondContact O-N 3.33Å; F360-V363 WeakPolarHBondContact O-CB 3.26Å; F360-V363 PolarHBondContact O-N 3.48Å; C361-V363 PolarHBondContact O-N 2.89Å; V363-G366 PolarHBondContact O-N 3.4Å; V363-Y367 HydrophobicContact CG1-CD2 4.23Å; V363-Y367 HydrophobicContact CG1-CE2 3.87Å; V363-Y367 VanDerWaalsContact O-CD2 3.23Å; V363-Y367 WeakPolarHBondContact O-CD2 3.4Å; V363-Y367 PolarHBondContact O-N 2.96Å
364	F	98.5	Very high	96.9	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-66.2	-40.1	178.8	-63.1	-80.4	0	0	0	112.2	F318 G321 A325 H329 L332 L333 F360 C361 G366 Y367 S368	F318-F364 HydrophobicContact CD2-CB 3.89Å; F318-F364 HydrophobicContact CD2-CD2 4.2Å; F318-F364 HydrophobicContact CD2-CG 4.35Å; F318-F364 HydrophobicContact CE2-CB 4.26Å; F318-F364 AromaticContact CE2-CD2 3.76Å; F318-F364 HydrophobicContact CE2-CD2 3.76Å; F318-F364 HydrophobicContact CE2-CG 4.21Å; G321-F364 VanDerWaalsContact CA-O 3.31Å; G321-F364 WeakPolarHBondContact CA-O 3.43Å; A325-F364 HydrophobicContact CB-CD1 3.54Å; A325-F364 HydrophobicContact CB-CE1 3.6Å; H329-F364 HydrophobicContact CB-CE1 4.48Å; H329-F364 HydrophobicContact CB-CZ 4.48Å; L332-F364 HydrophobicContact CB-CE2 4.09Å; L332-F364 HydrophobicContact CB-CZ 4.27Å; L333-F364 HydrophobicContact CB-CE1 4.33Å; L333-F364 HydrophobicContact CB-CE2 4.07Å; L333-F364 HydrophobicContact CB-CZ 3.61Å; F360-F364 WeakPolarHBondContact O-CD2 3.29Å; C361-F364 PolarHBondContact O-N 3.38Å; F364-G366 VanDerWaalsContact C-N 3.28Å; F364-G366 PolarHBondContact O-N 3.47Å; F364-Y367 WeakPolarHBondContact O-CB 3.25Å; F364-Y367 PolarHBondContact O-N 3.3Å; F364-Y367 VanDerWaalsContact O-N 3.15Å; F364-S368 PolarHBondContact O-N 2.75Å
365	C	98.4	Very high	96.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.3	-42	174	-62.1	0	0	0	0	111.9	C168 F317 C361 M362 Y367 S368 L369	C168-C365 HydrophobicContact CB-CB 4.06Å; C168-C365 VanDerWaalsContact SG-CB 3.59Å; F317-C365 HydrophobicContact CB-CB 4.31Å; C361-C365 PolarHBondContact O-N 3.32Å; C361-C365 PolarHBondContact O-SG 3.34Å; C361-C365 VanDerWaalsContact O-SG 3.35Å; M362-C365 PolarHBondContact O-N 2.69Å; C365-Y367 PolarHBondContact O-N 3.31Å; C365-S368 WeakPolarHBondContact O-CB 3.35Å; C365-S368 PolarHBondContact O-N 3.19Å; C365-L369 PolarHBondContact O-N 2.89Å
366	G	97.8	Very high	96.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-37.6	176.2	0	0	0	0	0	113.6	M362 V363 F364 L369 T370	M362-G366 PolarHBondContact O-N 2.76Å; V363-G366 PolarHBondContact O-N 3.4Å; F364-G366 VanDerWaalsContact C-N 3.28Å; F364-G366 PolarHBondContact O-N 3.47Å; G366-L369 PolarHBondContact O-N 2.92Å; G366-T370 PolarHBondContact O-N 3.36Å; G366-T370 PolarHBondContact O-OG1 3.33Å
367	Y	97.3	Very high	96.4	Very high	5 Å²	5	43.2 Å²	43.2	2%	0.02	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-44.6	172.4	-82.8	-79	0	0	0	112.8	M153 E157 V161 A325 P326 H329 V363 F364 C365 L369 T370 H371	M153-Y367 HydrophobicContact CE-CE2 4.26Å; E157-Y367 HydrophobicContact CG-CE1 4.4Å; E157-Y367 WeakPolarHBondContact CG-OH 3.36Å; E157-Y367 PolarHBondContact OE1-OH 3.26Å; V161-Y367 HydrophobicContact CG1-CD1 4.41Å; V161-Y367 HydrophobicContact CG1-CD2 4.47Å; V161-Y367 HydrophobicContact CG1-CE1 4.2Å; V161-Y367 HydrophobicContact CG1-CE2 4.26Å; V161-Y367 HydrophobicContact CG2-CE1 4.36Å; A325-Y367 HydrophobicContact CB-CD2 3.86Å; A325-Y367 HydrophobicContact CB-CE2 4.12Å; A325-Y367 HydrophobicContact CB-CG 4.11Å; P326-Y367 VanDerWaalsContact CD-CZ 3.43Å; P326-Y367 WeakPolarHBondContact CD-OH 3.17Å; P326-Y367 HydrophobicContact CG-CE1 4Å; H329-Y367 PolarHBondContact CE1-OH 2.81Å; H329-Y367 AromaticContact ND1-CZ 4Å; H329-Y367 PolarHBondContact ND1-OH 2.94Å; V363-Y367 HydrophobicContact CG1-CD2 4.23Å; V363-Y367 HydrophobicContact CG1-CE2 3.87Å; V363-Y367 VanDerWaalsContact O-CD2 3.23Å; V363-Y367 WeakPolarHBondContact O-CD2 3.4Å; V363-Y367 PolarHBondContact O-N 2.96Å; F364-Y367 WeakPolarHBondContact O-CB 3.25Å; F364-Y367 PolarHBondContact O-N 3.3Å; F364-Y367 VanDerWaalsContact O-N 3.15Å; C365-Y367 PolarHBondContact O-N 3.31Å; Y367-L369 VanDerWaalsContact C-N 3.35Å; Y367-L369 PolarHBondContact O-N 3.19Å; Y367-T370 WeakPolarHBondContact O-CB 3.35Å; Y367-T370 PolarHBondContact O-N 2.95Å; Y367-H371 PolarHBondContact O-N 3.37Å; Y367-H371 PolarHBondContact O-ND1 3.27Å
368	S	97.6	Very high	96.3	Very high	2 Å²	2	46 Å²	46	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-55.4	-52.2	175.8	171.8	0	0	0	0	110.3	F317 H320 F364 C365 T370 H371 L372	F317-S368 WeakPolarHBondContact O-CB 3.29Å; H320-S368 PolarHBondContact ND1-OG 3.21Å; F364-S368 PolarHBondContact O-N 2.75Å; C365-S368 WeakPolarHBondContact O-CB 3.35Å; C365-S368 PolarHBondContact O-N 3.19Å; S368-T370 VanDerWaalsContact C-N 3.33Å; S368-T370 PolarHBondContact O-N 3.2Å; S368-H371 PolarHBondContact O-N 3.1Å; S368-L372 WeakPolarHBondContact O-CG 3.47Å; S368-L372 PolarHBondContact O-N 2.95Å
369	L	97.3	Very high	96.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-39.4	178.7	-71.3	-179.4	0	0	0	112.9	W164 F167 C168 F317 C365 G366 Y367 H371 L372 K376 A379 L380 L383	W164-L369 HydrophobicContact CB-CB 4.02Å; W164-L369 HydrophobicContact CB-CD1 4.35Å; W164-L369 HydrophobicContact CD2-CB 4.36Å; W164-L369 HydrophobicContact CE3-CD1 4.35Å; W164-L369 HydrophobicContact CG-CB 4.07Å; F167-L369 HydrophobicContact CD1-CD1 4.03Å; F167-L369 HydrophobicContact CE1-CD1 4.42Å; C168-L369 WeakPolarHBondContact SG-CD1 3.35Å; F317-L369 HydrophobicContact CD1-CD2 3.79Å; F317-L369 HydrophobicContact CD1-CG 4.37Å; F317-L369 HydrophobicContact CE1-CD2 3.75Å; C365-L369 PolarHBondContact O-N 2.89Å; G366-L369 PolarHBondContact O-N 2.92Å; Y367-L369 VanDerWaalsContact C-N 3.35Å; Y367-L369 PolarHBondContact O-N 3.19Å; L369-H371 VanDerWaalsContact C-N 3.28Å; L369-H371 PolarHBondContact O-N 3.44Å; L369-L372 HydrophobicContact CD2-CD1 4.04Å; L369-L372 PolarHBondContact O-N 3.28Å; L369-K376 WeakPolarHBondContact O-CE 3.37Å; L369-A379 HydrophobicContact CD2-CB 4.33Å; L369-L380 HydrophobicContact CD1-CD2 3.78Å; L369-L380 HydrophobicContact CD2-CD2 4.18Å; L369-L383 HydrophobicContact CD1-CD1 4.22Å; L369-L383 HydrophobicContact CD2-CD1 4.08Å
370	T	96.2	Very high	96.2	Very high	21 Å²	21	47.6 Å²	47.6	13%	0.129	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-43.8	178.5	-56.4	0	0	0	0	111.4	E160 V161 W164 G366 Y367 S368 K376	E160-T370 HydrophobicContact CG-CG2 4.18Å; V161-T370 HydrophobicContact CG2-CG2 3.97Å; W164-T370 VanDerWaalsContact CD1-OG1 3.32Å; G366-T370 PolarHBondContact O-N 3.36Å; G366-T370 PolarHBondContact O-OG1 3.33Å; Y367-T370 WeakPolarHBondContact O-CB 3.35Å; Y367-T370 PolarHBondContact O-N 2.95Å; S368-T370 VanDerWaalsContact C-N 3.33Å; S368-T370 PolarHBondContact O-N 3.2Å; T370-K376 PolarHBondContact O-NZ 2.97Å
371	H	94.6	Very high	96.1	Very high	104 Å²	104	50.6 Å²	50.6	48%	0.481	25%	0.249	S	C	.	.	H	α-helix	trans	-82	-14.6	-176.3	-70.4	84.2	0	0	0	114.3	L324 Y367 S368 L369 K373	L324-H371 HydrophobicContact CD1-CB 3.74Å; Y367-H371 PolarHBondContact O-N 3.37Å; Y367-H371 PolarHBondContact O-ND1 3.27Å; S368-H371 PolarHBondContact O-N 3.1Å; L369-H371 VanDerWaalsContact C-N 3.28Å; L369-H371 PolarHBondContact O-N 3.44Å; H371-K373 PolarHBondContact O-N 3.19Å
372	L	94.1	Very high	96.1	Very high	37 Å²	37	56 Å²	56	19%	0.194	27%	0.272	C	S	.	.			trans	-66.8	128.8	172.4	-69.9	175.3	0	0	0	110.2	F317 S368 L369 K376 A379	F317-L372 HydrophobicContact CD1-CD1 4.25Å; F317-L372 HydrophobicContact CE1-CD1 3.79Å; S368-L372 WeakPolarHBondContact O-CG 3.47Å; S368-L372 PolarHBondContact O-N 2.95Å; L369-L372 HydrophobicContact CD2-CD1 4.04Å; L369-L372 PolarHBondContact O-N 3.28Å; L372-K376 HydrophobicContact CB-CB 4.05Å; L372-K376 WeakPolarHBondContact O-CE 3.28Å; L372-K376 PolarHBondContact O-NZ 3Å; L372-A379 HydrophobicContact CD1-CB 4.04Å
373	K	90.8	Very high	96	Very high	192 Å²	192	56 Å²	56	84%	0.835	27%	0.272	S	S	*	.	S	Bend	trans	-96.9	-93.1	174.1	-63.1	-176.7	-178.3	179.1	0	109.9	H371 W375 K376	H371-K373 PolarHBondContact O-N 3.19Å; K373-W375 VanDerWaalsContact C-N 3.31Å; K373-W375 PolarHBondContact O-N 2.89Å; K373-K376 WeakPolarHBondContact O-CB 3.44Å; K373-K376 PolarHBondContact O-N 3.28Å
374	T	91.1	Very high	96	Very high	129 Å²	129	60.2 Å²	60.2	79%	0.791	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-40.2	-174.9	-43.7	0	0	0	0	113	K376	T374-K376 VanDerWaalsContact C-N 3.35Å; T374-K376 PolarHBondContact O-N 3.42Å
375	W	92.3	Very high	96	Very high	186 Å²	186	63.5 Å²	63.5	71%	0.705	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	3.3	-175.9	-66.9	96.7	0	0	0	114.6	K373 P378 A379	K373-W375 VanDerWaalsContact C-N 3.31Å; K373-W375 PolarHBondContact O-N 2.89Å; W375-P378 HydrophobicContact CE3-CG 3.88Å; W375-P378 WeakPolarHBondContact O-CD 2.92Å; W375-P378 WeakPolarHBondContact O-CG 3.24Å; W375-A379 WeakPolarHBondContact O-CB 3.36Å; W375-A379 PolarHBondContact O-N 3.06Å
376	K	94.1	Very high	95.9	Very high	40 Å²	40	65.1 Å²	65.1	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-53.7	-176.8	-178.1	177.3	-86.2	167.7	0	112	E160 W164 L369 T370 L372 K373 T374 A379 L380	E160-K376 IonicContact OE1-NZ 2.84Å; E160-K376 PolarHBondContact OE1-NZ 3.12Å; E160-K376 VanDerWaalsContact OE1-NZ 3.12Å; W164-K376 HydrophobicContact CH2-CD 4.45Å; W164-K376 HydrophobicContact CZ2-CD 3.87Å; L369-K376 WeakPolarHBondContact O-CE 3.37Å; T370-K376 PolarHBondContact O-NZ 2.97Å; L372-K376 HydrophobicContact CB-CB 4.05Å; L372-K376 WeakPolarHBondContact O-CE 3.28Å; L372-K376 PolarHBondContact O-NZ 3Å; K373-K376 WeakPolarHBondContact O-CB 3.44Å; K373-K376 PolarHBondContact O-N 3.28Å; T374-K376 VanDerWaalsContact C-N 3.35Å; T374-K376 PolarHBondContact O-N 3.42Å; K376-A379 PolarHBondContact O-N 2.68Å; K376-L380 HydrophobicContact CG-CD1 4.07Å; K376-L380 VanDerWaalsContact O-CG 3.24Å; K376-L380 WeakPolarHBondContact O-CG 3.35Å; K376-L380 PolarHBondContact O-N 3.11Å
377	K	95.1	Very high	95.9	Very high	179 Å²	179	65.2 Å²	65.2	78%	0.778	32%	0.32	S	S	*	.	H	α-helix	trans	-59.2	-51.3	-179.7	-69.5	-174.7	179	-178.7	0	113.9	A379 L380 S381	K377-A379 VanDerWaalsContact C-N 3.31Å; K377-A379 PolarHBondContact O-N 3.25Å; K377-L380 PolarHBondContact O-N 3.27Å; K377-S381 PolarHBondContact O-N 2.92Å
378	P	96.8	Very high	95.9	Very high	59 Å²	59	67.7 Å²	67.7	38%	0.383	33%	0.331	S	S	.	.	H	α-helix	trans	-63.6	-37.1	177.6	22.6	-32	0	0	0	112	W375 L380 S381 F382	W375-P378 HydrophobicContact CE3-CG 3.88Å; W375-P378 WeakPolarHBondContact O-CD 2.92Å; W375-P378 WeakPolarHBondContact O-CG 3.24Å; P378-L380 PolarHBondContact O-N 3Å; P378-S381 PolarHBondContact O-N 3.44Å; P378-F382 VanDerWaalsContact O-CB 3.29Å; P378-F382 WeakPolarHBondContact O-CB 3.47Å; P378-F382 PolarHBondContact O-N 3.25Å
379	A	96.9	Very high	95.9	Very high	12 Å²	12	73.9 Å²	73.9	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-60.6	-43.3	174.7	0	0	0	0	0	112.7	F317 L369 L372 W375 K376 K377 F382 L383	F317-A379 HydrophobicContact CE1-CB 3.67Å; F317-A379 HydrophobicContact CZ-CB 3.72Å; L369-A379 HydrophobicContact CD2-CB 4.33Å; L372-A379 HydrophobicContact CD1-CB 4.04Å; W375-A379 WeakPolarHBondContact O-CB 3.36Å; W375-A379 PolarHBondContact O-N 3.06Å; K376-A379 PolarHBondContact O-N 2.68Å; K377-A379 VanDerWaalsContact C-N 3.31Å; K377-A379 PolarHBondContact O-N 3.25Å; A379-F382 PolarHBondContact O-N 3.25Å; A379-L383 WeakPolarHBondContact O-CB 3.31Å; A379-L383 WeakPolarHBondContact O-CG 3.39Å; A379-L383 PolarHBondContact O-N 2.85Å
380	L	97.1	Very high	95.9	Very high	28 Å²	28	77.1 Å²	77.1	15%	0.147	37%	0.374	C	S	.	.	H	α-helix	trans	-63.5	-45.4	176.9	-67.3	169.2	0	0	0	111.9	W164 F167 L369 K376 K377 P378 L383 F384	W164-L380 HydrophobicContact CE3-CD1 4.38Å; W164-L380 HydrophobicContact CE3-CD2 3.67Å; W164-L380 HydrophobicContact CH2-CD1 3.45Å; W164-L380 VanDerWaalsContact CH2-CD1 3.45Å; W164-L380 HydrophobicContact CH2-CD2 4.29Å; W164-L380 HydrophobicContact CH2-CG 4.49Å; W164-L380 HydrophobicContact CZ2-CD1 4.5Å; W164-L380 HydrophobicContact CZ3-CD1 3.38Å; W164-L380 HydrophobicContact CZ3-CD2 3.39Å; W164-L380 HydrophobicContact CZ3-CG 4.01Å; F167-L380 HydrophobicContact CD1-CD2 3.7Å; F167-L380 HydrophobicContact CE1-CD2 3.42Å; F167-L380 VanDerWaalsContact CE1-CD2 3.42Å; F167-L380 HydrophobicContact CG-CD2 4.39Å; F167-L380 HydrophobicContact CZ-CB 4.33Å; F167-L380 HydrophobicContact CZ-CD2 3.89Å; L369-L380 HydrophobicContact CD1-CD2 3.78Å; L369-L380 HydrophobicContact CD2-CD2 4.18Å; K376-L380 HydrophobicContact CG-CD1 4.07Å; K376-L380 VanDerWaalsContact O-CG 3.24Å; K376-L380 WeakPolarHBondContact O-CG 3.35Å; K376-L380 PolarHBondContact O-N 3.11Å; K377-L380 PolarHBondContact O-N 3.27Å; P378-L380 PolarHBondContact O-N 3Å; L380-L383 PolarHBondContact O-N 3.4Å; L380-F384 WeakPolarHBondContact O-CB 3.41Å; L380-F384 PolarHBondContact O-N 2.89Å
381	S	97.2	Very high	95.9	Very high	64 Å²	64	76.1 Å²	76.1	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-61	-46.5	177.1	-172.4	0	0	0	0	111.1	K377 P378 F384 L385	K377-S381 PolarHBondContact O-N 2.92Å; P378-S381 PolarHBondContact O-N 3.44Å; S381-F384 PolarHBondContact O-N 3.06Å; S381-L385 WeakPolarHBondContact O-CB 3.28Å; S381-L385 VanDerWaalsContact O-CG 3.31Å; S381-L385 WeakPolarHBondContact O-CG 3.16Å; S381-L385 PolarHBondContact O-N 2.91Å
382	F	97.4	Very high	96.1	Very high	113 Å²	113	73 Å²	73	50%	0.496	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-48.9	177.2	174.5	-104.9	0	0	0	112.3	T313 P378 A379 F384 S386	T313-F382 HydrophobicContact CG2-CE1 3.8Å; T313-F382 HydrophobicContact CG2-CZ 3.7Å; P378-F382 VanDerWaalsContact O-CB 3.29Å; P378-F382 WeakPolarHBondContact O-CB 3.47Å; P378-F382 PolarHBondContact O-N 3.25Å; A379-F382 PolarHBondContact O-N 3.25Å; F382-F384 PolarHBondContact O-N 3.2Å; F382-S386 VanDerWaalsContact O-CB 3.23Å; F382-S386 WeakPolarHBondContact O-CB 3.3Å; F382-S386 PolarHBondContact O-N 3.06Å; F382-S386 PolarHBondContact O-OG 3.23Å
383	L	97.9	Very high	96.3	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-60	-47.6	177.5	-78.2	175.9	0	0	0	111.3	F167 T313 F317 L369 A379 L380 S386 N387	F167-L383 HydrophobicContact CE1-CB 4.34Å; F167-L383 HydrophobicContact CE1-CD1 4.48Å; T313-L383 WeakPolarHBondContact O-CD2 3.2Å; F317-L383 HydrophobicContact CD1-CD1 4.35Å; F317-L383 HydrophobicContact CD2-CD1 4.05Å; F317-L383 HydrophobicContact CD2-CD2 3.8Å; F317-L383 HydrophobicContact CD2-CG 4.23Å; F317-L383 HydrophobicContact CE1-CD1 4.23Å; F317-L383 HydrophobicContact CE2-CD1 3.91Å; F317-L383 HydrophobicContact CE2-CD2 3.61Å; F317-L383 HydrophobicContact CE2-CG 3.77Å; F317-L383 HydrophobicContact CG-CD1 4.27Å; F317-L383 HydrophobicContact CZ-CD1 4Å; F317-L383 HydrophobicContact CZ-CD2 4.41Å; F317-L383 HydrophobicContact CZ-CG 4.07Å; L369-L383 HydrophobicContact CD1-CD1 4.22Å; L369-L383 HydrophobicContact CD2-CD1 4.08Å; A379-L383 WeakPolarHBondContact O-CB 3.31Å; A379-L383 WeakPolarHBondContact O-CG 3.39Å; A379-L383 PolarHBondContact O-N 2.85Å; L380-L383 PolarHBondContact O-N 3.4Å; L383-S386 PolarHBondContact O-OG 2.76Å; L383-N387 WeakPolarHBondContact O-CB 3.46Å; L383-N387 PolarHBondContact O-N 2.71Å; L383-N387 VanDerWaalsContact O-N 3.15Å; L383-N387 PolarHBondContact O-ND2 2.84Å
384	F	97.9	Very high	96.5	Very high	90 Å²	90	66.2 Å²	66.2	40%	0.395	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-55.4	179.2	178.6	-103.3	0	0	0	111.5	F167 L380 S381 F382 S386 N387 F388	F167-F384 HydrophobicContact CZ-CB 4.17Å; L380-F384 WeakPolarHBondContact O-CB 3.41Å; L380-F384 PolarHBondContact O-N 2.89Å; S381-F384 PolarHBondContact O-N 3.06Å; F382-F384 PolarHBondContact O-N 3.2Å; F384-S386 PolarHBondContact O-N 2.86Å; F384-N387 PolarHBondContact O-N 2.76Å; F384-F388 HydrophobicContact CE1-CB 4.49Å; F384-F388 HydrophobicContact CE1-CG 4.47Å; F384-F388 HydrophobicContact CZ-CB 4.43Å; F384-F388 HydrophobicContact CZ-CD2 4.14Å; F384-F388 HydrophobicContact CZ-CG 4.27Å; F384-F388 WeakPolarHBondContact O-CB 3.37Å; F384-F388 PolarHBondContact O-N 3.4Å
385	L	97.9	Very high	96.8	Very high	73 Å²	73	60.1 Å²	60.1	38%	0.382	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-47.1	-176.1	-71.4	171.7	0	0	0	112	S381 N387 F388 F389	S381-L385 WeakPolarHBondContact O-CB 3.28Å; S381-L385 VanDerWaalsContact O-CG 3.31Å; S381-L385 WeakPolarHBondContact O-CG 3.16Å; S381-L385 PolarHBondContact O-N 2.91Å; L385-N387 PolarHBondContact O-N 3.11Å; L385-F388 PolarHBondContact O-N 3.47Å; L385-F389 HydrophobicContact CB-CE2 4.36Å; L385-F389 HydrophobicContact CD2-CE2 4.02Å; L385-F389 WeakPolarHBondContact O-CD2 3.12Å; L385-F389 PolarHBondContact O-N 3.4Å
386	S	97.3	Very high	97.1	Very high	34 Å²	34	53.6 Å²	53.6	24%	0.238	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-44.8	-178.8	58	0	0	0	0	112.5	T313 F382 L383 F384 L390	T313-S386 WeakPolarHBondContact CB-OG 3.45Å; T313-S386 WeakPolarHBondContact CG2-OG 3.32Å; T313-S386 PolarHBondContact OG1-OG 3.36Å; F382-S386 VanDerWaalsContact O-CB 3.23Å; F382-S386 WeakPolarHBondContact O-CB 3.3Å; F382-S386 PolarHBondContact O-N 3.06Å; F382-S386 PolarHBondContact O-OG 3.23Å; L383-S386 PolarHBondContact O-OG 2.76Å; F384-S386 PolarHBondContact O-N 2.86Å; S386-L390 WeakPolarHBondContact O-CB 3.33Å; S386-L390 PolarHBondContact O-N 3.44Å
387	N	98	Very high	97.2	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-74.3	-35.4	178.3	-72.8	-96	0	0	0	111.9	C171 W173 T313 H314 L383 F384 L385 L390 A391	C171-N387 WeakPolarHBondContact O-CB 3.45Å; W173-N387 HydrophobicContact CB-CB 3.95Å; W173-N387 PolarHBondContact N-OD1 3.04Å; T313-N387 PolarHBondContact OG1-ND2 2.82Å; H314-N387 PolarHBondContact CE1-ND2 3.37Å; L383-N387 WeakPolarHBondContact O-CB 3.46Å; L383-N387 PolarHBondContact O-N 2.71Å; L383-N387 VanDerWaalsContact O-N 3.15Å; L383-N387 PolarHBondContact O-ND2 2.84Å; F384-N387 PolarHBondContact O-N 2.76Å; L385-N387 PolarHBondContact O-N 3.11Å; N387-L390 PolarHBondContact O-N 2.89Å; N387-A391 WeakPolarHBondContact O-CB 3.23Å; N387-A391 PolarHBondContact O-N 3.06Å
388	F	97.1	Very high	97.3	Very high	58 Å²	58	47 Å²	47	25%	0.254	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-49.9	-179.6	178.1	-105.2	0	0	0	111.7	W176 F384 L385 L390 A391 L392	W176-F388 AromaticContact CH2-CD2 3.84Å; W176-F388 HydrophobicContact CH2-CD2 3.84Å; W176-F388 AromaticContact CH2-CE2 3.98Å; W176-F388 HydrophobicContact CH2-CE2 3.98Å; W176-F388 HydrophobicContact CZ3-CD2 4.15Å; F384-F388 HydrophobicContact CE1-CB 4.49Å; F384-F388 HydrophobicContact CE1-CG 4.47Å; F384-F388 HydrophobicContact CZ-CB 4.43Å; F384-F388 HydrophobicContact CZ-CD2 4.14Å; F384-F388 HydrophobicContact CZ-CG 4.27Å; F384-F388 WeakPolarHBondContact O-CB 3.37Å; F384-F388 PolarHBondContact O-N 3.4Å; L385-F388 PolarHBondContact O-N 3.47Å; F388-L390 VanDerWaalsContact C-N 3.35Å; F388-L390 PolarHBondContact O-N 2.6Å; F388-A391 PolarHBondContact O-N 3.46Å; F388-L392 HydrophobicContact CD1-CD1 3.99Å; F388-L392 HydrophobicContact CD2-CG 4.48Å; F388-L392 HydrophobicContact CE1-CD1 3.38Å; F388-L392 HydrophobicContact CE1-CG 4.22Å; F388-L392 HydrophobicContact CE2-CD1 4.07Å; F388-L392 HydrophobicContact CE2-CD2 4.38Å; F388-L392 HydrophobicContact CE2-CG 4.18Å; F388-L392 HydrophobicContact CZ-CD1 3.43Å; F388-L392 VanDerWaalsContact CZ-CD1 3.43Å; F388-L392 HydrophobicContact CZ-CD2 4.43Å; F388-L392 HydrophobicContact CZ-CG 4.06Å; F388-L392 WeakPolarHBondContact O-CB 3.28Å; F388-L392 WeakPolarHBondContact O-CG 3.35Å; F388-L392 PolarHBondContact O-N 2.89Å
389	F	97.2	Very high	97.2	Very high	131 Å²	131	46.5 Å²	46.5	58%	0.575	23%	0.233	S	C	*	.	H	α-helix	trans	-64.4	-40.3	178.2	-71.8	-60.2	0	0	0	112.2	L385 L392 Y393	L385-F389 HydrophobicContact CB-CE2 4.36Å; L385-F389 HydrophobicContact CD2-CE2 4.02Å; L385-F389 WeakPolarHBondContact O-CD2 3.12Å; L385-F389 PolarHBondContact O-N 3.4Å; F389-L392 PolarHBondContact O-N 2.71Å; F389-Y393 WeakPolarHBondContact O-CB 3.42Å; F389-Y393 PolarHBondContact O-N 2.84Å
390	L	97.1	Very high	97.2	Very high	68 Å²	68	50.3 Å²	50.3	36%	0.356	25%	0.245	S	C	.	.	H	α-helix	trans	-65.4	-42.5	176.5	-176.9	58.1	0	0	0	111.8	W173 S386 N387 F388 Y393 T394	W173-L390 HydrophobicContact CB-CB 4.34Å; W173-L390 HydrophobicContact CB-CD2 4.23Å; W173-L390 HydrophobicContact CB-CG 4.32Å; W173-L390 HydrophobicContact CD2-CD2 3.54Å; W173-L390 HydrophobicContact CD2-CG 3.95Å; W173-L390 HydrophobicContact CE3-CD2 4.03Å; W173-L390 HydrophobicContact CE3-CG 3.98Å; W173-L390 HydrophobicContact CG-CD2 3.62Å; W173-L390 HydrophobicContact CG-CG 4.11Å; W173-L390 HydrophobicContact CZ2-CD2 4.45Å; S386-L390 WeakPolarHBondContact O-CB 3.33Å; S386-L390 PolarHBondContact O-N 3.44Å; N387-L390 PolarHBondContact O-N 2.89Å; F388-L390 VanDerWaalsContact C-N 3.35Å; F388-L390 PolarHBondContact O-N 2.6Å; L390-Y393 PolarHBondContact O-N 3.15Å; L390-T394 HydrophobicContact CD1-CG2 4.07Å; L390-T394 WeakPolarHBondContact O-CB 3.18Å; L390-T394 WeakPolarHBondContact O-CG2 3.49Å; L390-T394 PolarHBondContact O-N 3.31Å; L390-T394 PolarHBondContact O-OG1 3.14Å
391	A	97.1	Very high	97.2	Very high	1 Å²	1	49 Å²	49	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-40.4	175.9	0	0	0	0	0	112.1	W173 W176 N387 F388 T394 G395	W173-A391 HydrophobicContact CB-CB 4.28Å; W176-A391 HydrophobicContact CB-CB 3.99Å; W176-A391 HydrophobicContact CD2-CB 4.02Å; W176-A391 HydrophobicContact CE3-CB 4.45Å; W176-A391 HydrophobicContact CG-CB 3.82Å; N387-A391 WeakPolarHBondContact O-CB 3.23Å; N387-A391 PolarHBondContact O-N 3.06Å; F388-A391 PolarHBondContact O-N 3.46Å; A391-T394 PolarHBondContact O-OG1 3.03Å; A391-G395 WeakPolarHBondContact O-CA 3.34Å; A391-G395 PolarHBondContact O-N 2.95Å
392	L	97.5	Very high	97.1	Very high	38 Å²	38	46.1 Å²	46.1	20%	0.199	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-44.2	175	-73.7	-174.4	0	0	0	111.9	L68 F388 F389 G395 L396	L68-L392 HydrophobicContact CD1-CD2 4.23Å; L68-L392 HydrophobicContact CD2-CD2 4.33Å; F388-L392 HydrophobicContact CD1-CD1 3.99Å; F388-L392 HydrophobicContact CD2-CG 4.48Å; F388-L392 HydrophobicContact CE1-CD1 3.38Å; F388-L392 HydrophobicContact CE1-CG 4.22Å; F388-L392 HydrophobicContact CE2-CD1 4.07Å; F388-L392 HydrophobicContact CE2-CD2 4.38Å; F388-L392 HydrophobicContact CE2-CG 4.18Å; F388-L392 HydrophobicContact CZ-CD1 3.43Å; F388-L392 VanDerWaalsContact CZ-CD1 3.43Å; F388-L392 HydrophobicContact CZ-CD2 4.43Å; F388-L392 HydrophobicContact CZ-CG 4.06Å; F388-L392 WeakPolarHBondContact O-CB 3.28Å; F388-L392 WeakPolarHBondContact O-CG 3.35Å; F388-L392 PolarHBondContact O-N 2.89Å; F389-L392 PolarHBondContact O-N 2.71Å; L392-G395 PolarHBondContact O-N 3.08Å; L392-L396 HydrophobicContact CD2-CD1 3.96Å; L392-L396 VanDerWaalsContact O-CB 3.26Å; L392-L396 WeakPolarHBondContact O-CB 3.18Å; L392-L396 PolarHBondContact O-N 2.96Å
393	Y	97.7	Very high	97.1	Very high	73 Å²	73	42 Å²	42	29%	0.286	20%	0.201	S	C	.	.	H	α-helix	trans	-62.6	-50.2	178.8	176.6	-101.5	0	0	0	111.6	F389 L390 G395 V397 H398 H518	F389-Y393 WeakPolarHBondContact O-CB 3.42Å; F389-Y393 PolarHBondContact O-N 2.84Å; L390-Y393 PolarHBondContact O-N 3.15Å; Y393-G395 VanDerWaalsContact C-N 3.31Å; Y393-G395 PolarHBondContact O-N 3.03Å; Y393-V397 HydrophobicContact CD2-CB 3.96Å; Y393-V397 HydrophobicContact CD2-CG1 4.12Å; Y393-V397 HydrophobicContact CD2-CG2 4.42Å; Y393-V397 HydrophobicContact CE2-CB 4.08Å; Y393-V397 HydrophobicContact CE2-CG1 3.77Å; Y393-V397 WeakPolarHBondContact O-CB 3.41Å; Y393-V397 PolarHBondContact O-N 3.3Å; Y393-H398 HydrophobicContact CD1-CB 4.24Å; Y393-H398 HydrophobicContact CE1-CB 3.76Å; Y393-H398 PolarHBondContact O-N 2.85Å; Y393-H518 AromaticContact CE2-CE1 3.93Å; Y393-H518 AromaticContact CE2-ND1 3.49Å; Y393-H518 WeakPolarHBondContact CE2-ND1 3.24Å; Y393-H518 AromaticContact CZ-ND1 3.68Å; Y393-H518 PolarHBondContact OH-ND1 3.34Å
394	T	96.8	Very high	97	Very high	14 Å²	14	44.2 Å²	44.2	9%	0.086	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-33.7	178.2	52.9	0	0	0	0	111.9	T71 W173 Y177 L390 A391	T71-T394 WeakPolarHBondContact CB-O 3.3Å; T71-T394 WeakPolarHBondContact CG2-O 3.31Å; T71-T394 PolarHBondContact OG1-O 3.02Å; W173-T394 HydrophobicContact CE3-CG2 4.5Å; W173-T394 HydrophobicContact CZ3-CG2 4.14Å; Y177-T394 VanDerWaalsContact CE2-O 3.27Å; Y177-T394 WeakPolarHBondContact CE2-O 3.44Å; L390-T394 HydrophobicContact CD1-CG2 4.07Å; L390-T394 WeakPolarHBondContact O-CB 3.18Å; L390-T394 WeakPolarHBondContact O-CG2 3.49Å; L390-T394 PolarHBondContact O-N 3.31Å; L390-T394 PolarHBondContact O-OG1 3.14Å; A391-T394 PolarHBondContact O-OG1 3.03Å
395	G	97.1	Very high	97	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-78.4	-33.4	179.4	0	0	0	0	0	115.1	L68 V69 Q70 T71 A391 L392 Y393	L68-G395 CarbonylContact O-C 3.58Å; L68-G395 VanDerWaalsContact O-C 3.25Å; V69-G395 CarbonylContact C-O 3.09Å; V69-G395 WeakPolarHBondContact CA-O 3.33Å; Q70-G395 PolarHBondContact N-O 2.63Å; T71-G395 WeakPolarHBondContact CG2-O 2.9Å; T71-G395 PolarHBondContact N-O 3.49Å; T71-G395 PolarHBondContact OG1-O 3.12Å; A391-G395 WeakPolarHBondContact O-CA 3.34Å; A391-G395 PolarHBondContact O-N 2.95Å; L392-G395 PolarHBondContact O-N 3.08Å; Y393-G395 VanDerWaalsContact C-N 3.31Å; Y393-G395 PolarHBondContact O-N 3.03Å
396	L	97.4	Very high	96.9	Very high	49 Å²	49	36.6 Å²	36.6	26%	0.257	18%	0.177	S	C	.	.	H	α-helix	trans	-115.4	-16.6	-170.3	-65.6	173.5	0	0	0	115.1	L68 Q70 L392 R400	L68-L396 HydrophobicContact CD2-CD1 4.36Å; L68-L396 WeakPolarHBondContact O-CD2 3.43Å; L68-L396 VanDerWaalsContact O-CG 3.32Å; L68-L396 WeakPolarHBondContact O-CG 3.49Å; Q70-L396 HydrophobicContact CB-CD2 4.45Å; Q70-L396 HydrophobicContact CG-CD2 4.15Å; L392-L396 HydrophobicContact CD2-CD1 3.96Å; L392-L396 VanDerWaalsContact O-CB 3.26Å; L392-L396 WeakPolarHBondContact O-CB 3.18Å; L392-L396 PolarHBondContact O-N 2.96Å; L396-R400 VanDerWaalsContact O-CD 3.22Å; L396-R400 WeakPolarHBondContact O-CD 3.4Å; L396-R400 PolarHBondContact O-NH1 2.72Å
397	V	96.9	Very high	96.8	Very high	48 Å²	48	37.6 Å²	37.6	29%	0.291	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-57.5	-167.2	-177.6	0	0	0	0	111.9	Y393 Q399 R400 F515	Y393-V397 HydrophobicContact CD2-CB 3.96Å; Y393-V397 HydrophobicContact CD2-CG1 4.12Å; Y393-V397 HydrophobicContact CD2-CG2 4.42Å; Y393-V397 HydrophobicContact CE2-CB 4.08Å; Y393-V397 HydrophobicContact CE2-CG1 3.77Å; Y393-V397 WeakPolarHBondContact O-CB 3.41Å; Y393-V397 PolarHBondContact O-N 3.3Å; V397-Q399 PolarHBondContact O-N 3.22Å; V397-R400 WeakPolarHBondContact O-CB 3.37Å; V397-R400 PolarHBondContact O-N 2.84Å; V397-F515 HydrophobicContact CG1-CE1 3.69Å; V397-F515 HydrophobicContact CG1-CZ 4.42Å
398	H	96.5	Very high	96.6	Very high	34 Å²	34	39.6 Å²	39.6	16%	0.157	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	127.4	-174.4	-177.6	64.4	0	0	0	111.9	T71 Y393 T517	T71-H398 WeakPolarHBondContact CB-O 3.45Å; T71-H398 WeakPolarHBondContact CG2-O 3.34Å; Y393-H398 HydrophobicContact CD1-CB 4.24Å; Y393-H398 HydrophobicContact CE1-CB 3.76Å; Y393-H398 PolarHBondContact O-N 2.85Å; H398-T517 PolarHBondContact CE1-OG1 2.82Å; H398-T517 PolarHBondContact ND1-OG1 2.78Å
399	Q	95.6	Very high	96.4	Very high	48 Å²	48	36.9 Å²	36.9	22%	0.224	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	36.2	-177	-58.3	-177.2	20.6	0	0	115	S72 V397 T402 H516	S72-Q399 PolarHBondContact N-O 2.99Å; V397-Q399 PolarHBondContact O-N 3.22Å; Q399-T402 PolarHBondContact O-OG1 3.27Å; Q399-H516 WeakPolarHBondContact CA-CE1 3.45Å; Q399-H516 WeakPolarHBondContact CA-O 3.27Å; Q399-H516 PolarHBondContact N-O 2.65Å
400	R	96.5	Very high	96.3	Very high	91 Å²	91	32.2 Å²	32.2	34%	0.343	16%	0.161	S	C	.	.			trans	-79.8	-38.2	-179.1	-174.9	169.6	171.1	166.9	-0	114.3	T71 L396 V397 T402 L403 D404 H516	T71-R400 HydrophobicContact CG2-CB 4.02Å; L396-R400 VanDerWaalsContact O-CD 3.22Å; L396-R400 WeakPolarHBondContact O-CD 3.4Å; L396-R400 PolarHBondContact O-NH1 2.72Å; V397-R400 WeakPolarHBondContact O-CB 3.37Å; V397-R400 PolarHBondContact O-N 2.84Å; R400-T402 PolarHBondContact O-N 3.37Å; R400-L403 PolarHBondContact O-N 2.71Å; R400-D404 WeakPolarHBondContact CG-OD2 3.4Å; R400-D404 IonicContact NE-OD1 3.2Å; R400-D404 PolarHBondContact NE-OD1 3.4Å; R400-D404 IonicContact NE-OD2 3.16Å; R400-D404 PolarHBondContact NE-OD2 3.4Å; R400-D404 VanDerWaalsContact NE-OD2 3.16Å; R400-D404 IonicContact NH2-OD1 3.96Å; R400-D404 PolarHBondContact O-N 2.8Å; R400-D404 VanDerWaalsContact O-N 3.17Å; R400-H516 PolarHBondContact N-O 2.71Å
401	G	96.9	Very high	96	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.2	-27.4	-171.2	0	0	0	0	0	115.6	L403 V405 F515	G401-L403 VanDerWaalsContact C-N 3.28Å; G401-L403 PolarHBondContact O-N 3.23Å; G401-V405 WeakPolarHBondContact O-CB 3.42Å; G401-V405 WeakPolarHBondContact O-CG1 3.37Å; G401-V405 PolarHBondContact O-N 2.94Å; G401-F515 WeakPolarHBondContact CA-O 3.4Å; G401-F515 PolarHBondContact N-O 3.4Å
402	T	95.8	Very high	95.6	Very high	4 Å²	4	35.9 Å²	35.9	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-71.2	-21.2	177.3	47.3	0	0	0	0	113.4	S72 Q399 R400 M406 M428 S432 T433 F492 H516	S72-T402 WeakPolarHBondContact CB-OG1 3.29Å; Q399-T402 PolarHBondContact O-OG1 3.27Å; R400-T402 PolarHBondContact O-N 3.37Å; T402-M406 WeakPolarHBondContact O-CG 3.35Å; T402-M428 HydrophobicContact CG2-CE 3.79Å; T402-S432 VanDerWaalsContact CB-O 3.3Å; T402-S432 WeakPolarHBondContact CB-O 3.13Å; T402-S432 WeakPolarHBondContact CG2-O 3.35Å; T402-T433 HydrophobicContact CG2-CG2 4.22Å; T402-F492 HydrophobicContact CG2-CZ 4.12Å; T402-H516 VanDerWaalsContact CG2-CE1 3.43Å; T402-H516 WeakPolarHBondContact CG2-CE1 3.47Å
403	L	96.3	Very high	94.9	Very high	27 Å²	27	35.1 Å²	35.1	14%	0.141	17%	0.173	C	C	.	.	H	α-helix	trans	-92.9	-41.2	171.3	-68.7	-177	0	0	0	111.9	T71 R400 G401 V405 M406 P434	T71-L403 VanDerWaalsContact C-CD1 3.49Å; R400-L403 PolarHBondContact O-N 2.71Å; G401-L403 VanDerWaalsContact C-N 3.28Å; G401-L403 PolarHBondContact O-N 3.23Å; L403-V405 VanDerWaalsContact C-N 3.26Å; L403-V405 PolarHBondContact O-N 2.88Å; L403-M406 WeakPolarHBondContact O-CB 3.47Å; L403-M406 PolarHBondContact O-N 3.33Å; L403-P434 HydrophobicContact CD2-CG 3.42Å; L403-P434 VanDerWaalsContact CD2-CG 3.42Å
404	D	96.9	Very high	94	Very high	47 Å²	47	41.4 Å²	41.4	25%	0.251	20%	0.197	S	C	.	.	H	α-helix	trans	-60.5	-38.3	179.6	-74.3	-10.2	0	0	0	111.3	R400 M406 S407 H408 F514	R400-D404 WeakPolarHBondContact CG-OD2 3.4Å; R400-D404 IonicContact NE-OD1 3.2Å; R400-D404 PolarHBondContact NE-OD1 3.4Å; R400-D404 IonicContact NE-OD2 3.16Å; R400-D404 PolarHBondContact NE-OD2 3.4Å; R400-D404 VanDerWaalsContact NE-OD2 3.16Å; R400-D404 IonicContact NH2-OD1 3.96Å; R400-D404 PolarHBondContact O-N 2.8Å; R400-D404 VanDerWaalsContact O-N 3.17Å; D404-M406 VanDerWaalsContact C-N 3.26Å; D404-M406 PolarHBondContact O-N 3.46Å; D404-S407 WeakPolarHBondContact O-CB 3.19Å; D404-S407 PolarHBondContact O-N 3.15Å; D404-S407 VanDerWaalsContact O-N 3.16Å; D404-H408 PolarHBondContact O-N 3.47Å; D404-F514 HydrophobicContact CB-CB 4.31Å; D404-F514 HydrophobicContact CB-CD1 3.73Å; D404-F514 HydrophobicContact CB-CE1 4.4Å; D404-F514 HydrophobicContact CB-CG 4.16Å
405	V	97.1	Very high	92.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-31.6	176.7	74	0	0	0	0	112.7	G401 L403 S407 H408 I409 T433 I490 F514 V528 V530	G401-V405 WeakPolarHBondContact O-CB 3.42Å; G401-V405 WeakPolarHBondContact O-CG1 3.37Å; G401-V405 PolarHBondContact O-N 2.94Å; L403-V405 VanDerWaalsContact C-N 3.26Å; L403-V405 PolarHBondContact O-N 2.88Å; V405-S407 VanDerWaalsContact C-N 3.27Å; V405-S407 PolarHBondContact O-N 3.48Å; V405-H408 WeakPolarHBondContact O-CA 3.42Å; V405-H408 VanDerWaalsContact O-CB 3.27Å; V405-H408 WeakPolarHBondContact O-CB 3.32Å; V405-H408 PolarHBondContact O-N 2.81Å; V405-I409 WeakPolarHBondContact O-CG1 3.35Å; V405-I409 PolarHBondContact O-N 2.88Å; V405-T433 HydrophobicContact CG1-CG2 4.03Å; V405-I490 HydrophobicContact CG2-CD1 3.89Å; V405-I490 HydrophobicContact CG2-CG1 4.44Å; V405-I490 HydrophobicContact CG2-CG2 3.86Å; V405-F514 HydrophobicContact CB-CD2 4.01Å; V405-F514 HydrophobicContact CB-CE2 4.24Å; V405-F514 HydrophobicContact CG2-CD2 4.14Å; V405-F514 HydrophobicContact CG2-CE2 4.08Å; V405-V528 HydrophobicContact CB-CG1 4.16Å; V405-V528 HydrophobicContact CG1-CG1 4.42Å; V405-V528 HydrophobicContact CG2-CG1 4.06Å; V405-V530 HydrophobicContact CG2-CG2 3.72Å
406	M	96.3	Very high	91.2	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-35	178.1	-56.2	-55.5	-72.6	0	0	111.4	T402 L403 D404 H408 I409 Q410 T433 P434 Y435 H438 V439	T402-M406 WeakPolarHBondContact O-CG 3.35Å; L403-M406 WeakPolarHBondContact O-CB 3.47Å; L403-M406 PolarHBondContact O-N 3.33Å; D404-M406 VanDerWaalsContact C-N 3.26Å; D404-M406 PolarHBondContact O-N 3.46Å; M406-H408 PolarHBondContact O-N 2.81Å; M406-I409 HydrophobicContact CE-CD1 4.45Å; M406-I409 PolarHBondContact O-N 3.36Å; M406-I409 HydrophobicContact SD-CD1 3.85Å; M406-Q410 VanDerWaalsContact O-CG 3.32Å; M406-Q410 WeakPolarHBondContact O-CG 3.19Å; M406-Q410 PolarHBondContact O-N 3.45Å; M406-T433 HydrophobicContact SD-CG2 4.34Å; M406-P434 VanDerWaalsContact CE-C 3.44Å; M406-P434 HydrophobicContact CE-CB 4.4Å; M406-P434 WeakPolarHBondContact CE-O 3.05Å; M406-P434 HydrophobicContact CG-CG 4.31Å; M406-Y435 WeakPolarHBondContact CE-O 2.95Å; M406-H438 HydrophobicContact CB-CB 4.28Å; M406-H438 HydrophobicContact CE-CB 4.09Å; M406-H438 HydrophobicContact CG-CB 4.42Å; M406-V439 HydrophobicContact CE-CG2 3.49Å; M406-V439 VanDerWaalsContact CE-CG2 3.49Å
407	S	94.2	Very high	89.3	Confident	55 Å²	55	52.4 Å²	52.4	39%	0.385	26%	0.263	S	S	.	.	H	α-helix	trans	-66.6	-29.1	174	-60	0	0	0	0	112.1	D404 V405	D404-S407 WeakPolarHBondContact O-CB 3.19Å; D404-S407 PolarHBondContact O-N 3.15Å; D404-S407 VanDerWaalsContact O-N 3.16Å; V405-S407 VanDerWaalsContact C-N 3.27Å; V405-S407 PolarHBondContact O-N 3.48Å
408	H	94.1	Very high	87.5	Confident	44 Å²	44	55.6 Å²	55.6	20%	0.204	28%	0.278	C	S	.	.	H	α-helix	trans	-70.8	-45	171.6	-174.7	90.3	0	0	0	111.1	D404 V405 M406 Q410 K411 V412 F514	D404-H408 PolarHBondContact O-N 3.47Å; V405-H408 WeakPolarHBondContact O-CA 3.42Å; V405-H408 VanDerWaalsContact O-CB 3.27Å; V405-H408 WeakPolarHBondContact O-CB 3.32Å; V405-H408 PolarHBondContact O-N 2.81Å; M406-H408 PolarHBondContact O-N 2.81Å; H408-Q410 VanDerWaalsContact C-N 3.3Å; H408-Q410 PolarHBondContact O-N 3.46Å; H408-K411 WeakPolarHBondContact O-CB 3.14Å; H408-K411 PolarHBondContact O-N 3.5Å; H408-V412 PolarHBondContact O-N 3.46Å; H408-F514 HydrophobicContact CB-CE2 4.06Å; H408-F514 HydrophobicContact CB-CZ 3.7Å
409	I	94.4	Very high	85.5	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-58.5	-40.9	176.1	-63.1	173.6	0	0	0	111.6	V405 M406 K411 V412 C413 I424 V439 L443 M445 I490	V405-I409 WeakPolarHBondContact O-CG1 3.35Å; V405-I409 PolarHBondContact O-N 2.88Å; M406-I409 HydrophobicContact CE-CD1 4.45Å; M406-I409 PolarHBondContact O-N 3.36Å; M406-I409 HydrophobicContact SD-CD1 3.85Å; I409-K411 PolarHBondContact O-N 3.41Å; I409-V412 WeakPolarHBondContact O-CB 3.03Å; I409-V412 PolarHBondContact O-N 2.87Å; I409-V412 VanDerWaalsContact O-N 3.1Å; I409-C413 PolarHBondContact O-N 2.96Å; I409-I424 HydrophobicContact CB-CD1 4.11Å; I409-I424 HydrophobicContact CD1-CD1 4.34Å; I409-I424 HydrophobicContact CG1-CD1 3.86Å; I409-I424 HydrophobicContact CG2-CD1 3.44Å; I409-I424 VanDerWaalsContact CG2-CD1 3.44Å; I409-V439 HydrophobicContact CB-CG2 4.27Å; I409-V439 HydrophobicContact CG2-CB 4.41Å; I409-V439 HydrophobicContact CG2-CG1 3.81Å; I409-V439 HydrophobicContact CG2-CG2 3.64Å; I409-L443 HydrophobicContact CG2-CD2 4.3Å; I409-M445 HydrophobicContact CG2-SD 3.98Å; I409-I490 HydrophobicContact CD1-CD1 3.48Å; I409-I490 VanDerWaalsContact CD1-CD1 3.48Å; I409-I490 HydrophobicContact CG1-CD1 3.77Å
410	Q	93.3	Very high	83.6	Confident	33 Å²	33	63.1 Å²	63.1	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-54.9	-39.5	174.6	-72.1	167.8	25.9	0	0	112.2	V127 M406 H408 C413 Y414 H438	V127-Q410 HydrophobicContact CG1-CG 4.31Å; V127-Q410 HydrophobicContact CG2-CG 4.41Å; M406-Q410 VanDerWaalsContact O-CG 3.32Å; M406-Q410 WeakPolarHBondContact O-CG 3.19Å; M406-Q410 PolarHBondContact O-N 3.45Å; H408-Q410 VanDerWaalsContact C-N 3.3Å; H408-Q410 PolarHBondContact O-N 3.46Å; Q410-C413 PolarHBondContact O-N 3.44Å; Q410-Y414 PolarHBondContact O-N 3.47Å; Q410-H438 PolarHBondContact NE2-O 2.88Å
411	K	90.9	Very high	82.3	Confident	133 Å²	133	62.1 Å²	62.1	58%	0.578	33%	0.331	S	S	*	.	H	α-helix	trans	-68.8	-34.5	178.7	-65.7	172.9	-178	177.9	0	112.5	H408 I409 C413 Y414 N415	H408-K411 WeakPolarHBondContact O-CB 3.14Å; H408-K411 PolarHBondContact O-N 3.5Å; I409-K411 PolarHBondContact O-N 3.41Å; K411-C413 PolarHBondContact O-N 2.87Å; K411-Y414 PolarHBondContact O-N 3.29Å; K411-N415 WeakPolarHBondContact O-CB 3.41Å; K411-N415 PolarHBondContact O-N 2.91Å
412	V	88.6	Confident	81.8	Confident	12 Å²	12	62.3 Å²	62.3	7%	0.073	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-37.9	175.4	178.9	0	0	0	0	110.8	H408 I409 N416 A422	H408-V412 PolarHBondContact O-N 3.46Å; I409-V412 WeakPolarHBondContact O-CB 3.03Å; I409-V412 PolarHBondContact O-N 2.87Å; I409-V412 VanDerWaalsContact O-N 3.1Å; V412-N416 PolarHBondContact O-ND2 3.44Å; V412-A422 HydrophobicContact CG1-CB 3.96Å
413	C	83.6	Confident	81.7	Confident	23 Å²	23	63.8 Å²	63.8	16%	0.155	34%	0.343	C	S	.	.	H	α-helix	trans	-69	-40.5	175.7	176.1	0	0	0	0	113.1	I409 Q410 K411 C441	I409-C413 PolarHBondContact O-N 2.96Å; Q410-C413 PolarHBondContact O-N 3.44Å; K411-C413 PolarHBondContact O-N 2.87Å; C413-C441 HydrophobicContact CB-CB 3.64Å; C413-C441 WeakPolarHBondContact CB-SG 3.15Å; C413-C441 WeakPolarHBondContact SG-CB 3.35Å; C413-C441 CovalentContact SG-SG 2.02Å; C413-C441 PolarHBondContact SG-SG 3.43Å
414	Y	78.9	Confident	81.6	Confident	204 Å²	204	62.7 Å²	62.7	80%	0.8	34%	0.337	S	S	*	.	H	α-helix	trans	-71.7	-37.6	-178.1	-170.3	-94.2	0	0	0	112.9	Q410 K411	Q410-Y414 PolarHBondContact O-N 3.47Å; K411-Y414 PolarHBondContact O-N 3.29Å
415	N	70.4	Confident	81.6	Confident	118 Å²	118	60.6 Å²	60.6	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-82.7	-12.7	-173.4	-69.6	-12.7	0	0	0	114.2	K411 P417	K411-N415 WeakPolarHBondContact O-CB 3.41Å; K411-N415 PolarHBondContact O-N 2.91Å; N415-P417 VanDerWaalsContact O-CD 3.23Å; N415-P417 WeakPolarHBondContact O-CD 3.37Å
416	N	65.4	Low	81.6	Confident	54 Å²	54	60.8 Å²	60.8	29%	0.289	33%	0.327	S	S	.	.			trans	-99.7	103	177.3	-91.2	-55.7	0	0	0	111	V412 N418	V412-N416 PolarHBondContact O-ND2 3.44Å; N416-N418 PolarHBondContact O-N 3.02Å
417	P	57	Low	81.6	Confident	123 Å²	123	60.7 Å²	60.7	80%	0.799	33%	0.326	S	S	*	.	S	Bend	trans	-62.8	-28.9	176.2	22.7	-30.7	0	0	0	112.1	N415 K419	N415-P417 VanDerWaalsContact O-CD 3.23Å; N415-P417 WeakPolarHBondContact O-CD 3.37Å; P417-K419 PolarHBondContact O-N 3.35Å
418	N	58.5	Low	81.7	Confident	114 Å²	114	58.1 Å²	58.1	61%	0.61	31%	0.308	S	S	*	.	S	Bend	trans	-92.5	85.3	166.4	-73.7	-10.3	0	0	0	109.4	N416 S420 S421	N416-N418 PolarHBondContact O-N 3.02Å; N418-S420 PolarHBondContact O-N 3.43Å; N418-S421 PolarHBondContact O-N 2.02Å; N418-S421 VanDerWaalsContact O-N 3.09Å; N418-S421 PolarHBondContact O-OG 2.82Å; N418-S421 VanDerWaalsContact O-OG 3.08Å
419	K	54.8	Low	81.7	Confident	126 Å²	126	57.2 Å²	57.2	55%	0.548	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-19.2	176.5	-67	177.4	179.1	176.9	0	114	P417	P417-K419 PolarHBondContact O-N 3.35Å
420	S	54.8	Low	81.6	Confident	115 Å²	115	58.6 Å²	58.6	80%	0.804	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-12.6	-177.4	-39.1	0	0	0	0	115.6	N418	N418-S420 PolarHBondContact O-N 3.43Å
421	S	70.8	Confident	81.7	Confident	70 Å²	70	58.3 Å²	58.3	49%	0.49	31%	0.314	S	S	.	.	S	Bend	trans	-95.4	-11.6	-173.2	57.4	0	0	0	0	115	N418 T487	N418-S421 PolarHBondContact O-N 2.02Å; N418-S421 VanDerWaalsContact O-N 3.09Å; N418-S421 PolarHBondContact O-OG 2.82Å; N418-S421 VanDerWaalsContact O-OG 3.08Å; S421-T487 VanDerWaalsContact O-CG2 3.25Å; S421-T487 WeakPolarHBondContact O-CG2 3.36Å
422	A	86.6	Confident	81.8	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.033	30%	0.295	C	S	.	.			trans	-103.7	140	179.4	0	0	0	0	0	111.3	V412 L443 P444 T487	V412-A422 HydrophobicContact CG1-CB 3.96Å; A422-L443 HydrophobicContact CB-CD1 3.75Å; A422-L443 WeakPolarHBondContact O-CD1 3.47Å; A422-P444 WeakPolarHBondContact O-CD 3.42Å; A422-T487 WeakPolarHBondContact CA-OG1 3.4Å
423	S	92.3	Very high	82.2	Confident	34 Å²	34	52.8 Å²	52.8	24%	0.238	29%	0.293	C	S	.	.			trans	-141.3	137.6	177.3	52.3	0	0	0	0	109.4	P444 P486 T487 H488	S423-P444 WeakPolarHBondContact CA-O 3.42Å; S423-P486 VanDerWaalsContact OG-CA 3.3Å; S423-P486 WeakPolarHBondContact OG-CA 3.29Å; S423-T487 PolarHBondContact N-OG1 2.94Å; S423-T487 PolarHBondContact O-N 3.06Å; S423-T487 PolarHBondContact O-OG1 2.95Å; S423-T487 VanDerWaalsContact O-OG1 3.07Å; S423-T487 PolarHBondContact OG-N 3.39Å; S423-T487 VanDerWaalsContact OG-N 3.12Å; S423-H488 PolarHBondContact O-N 3.3Å
424	I	95.3	Very high	82.7	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.8	-174.5	-53.9	-169.9	0	0	0	109.7	I409 I426 L443 P444 M445 R446 H488 I490	I409-I424 HydrophobicContact CB-CD1 4.11Å; I409-I424 HydrophobicContact CD1-CD1 4.34Å; I409-I424 HydrophobicContact CG1-CD1 3.86Å; I409-I424 HydrophobicContact CG2-CD1 3.44Å; I409-I424 VanDerWaalsContact CG2-CD1 3.44Å; I424-I426 HydrophobicContact CG2-CG1 4.13Å; I424-L443 HydrophobicContact CD1-CD2 3.35Å; I424-L443 HydrophobicContact CG1-CD2 3.66Å; I424-L443 HydrophobicContact CG1-CG 4.49Å; I424-P444 PolarHBondContact N-O 3.05Å; I424-M445 HydrophobicContact CB-CG 4.09Å; I424-M445 HydrophobicContact CD1-SD 4.45Å; I424-M445 HydrophobicContact CG1-CG 4.48Å; I424-M445 CarbonylContact O-C 3.57Å; I424-M445 WeakPolarHBondContact O-CA 3.24Å; I424-R446 PolarHBondContact O-N 3.48Å; I424-H488 HydrophobicContact CG1-CB 4.18Å; I424-I490 HydrophobicContact CG2-CD1 3.64Å; I424-I490 HydrophobicContact CG2-CG1 4.12Å
425	F	96.6	Very high	83.5	Confident	3 Å²	3	42.4 Å²	42.4	1%	0.013	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.1	169.5	-175.6	-138.8	0	0	0	111	M427 R446 L448 W474 L475 F479 P486 H488 L489 I490	F425-M427 HydrophobicContact CD1-CG 3.41Å; F425-M427 VanDerWaalsContact CD1-CG 3.41Å; F425-M427 HydrophobicContact CD1-SD 3.83Å; F425-M427 HydrophobicContact CE1-CG 3.3Å; F425-M427 HydrophobicContact CE1-SD 3.78Å; F425-M427 HydrophobicContact CG-CG 4.15Å; F425-M427 HydrophobicContact CZ-CG 3.94Å; F425-R446 WeakPolarHBondContact CA-O 3.49Å; F425-R446 HydrophobicContact CD2-CB 3.93Å; F425-R446 HydrophobicContact CD2-CG 3.89Å; F425-R446 HydrophobicContact CE2-CB 4.5Å; F425-R446 HydrophobicContact CE2-CG 3.95Å; F425-L448 HydrophobicContact CE2-CD2 4.39Å; F425-L448 HydrophobicContact CZ-CD2 3.88Å; F425-L448 HydrophobicContact CZ-CG 4.3Å; F425-W474 HydrophobicContact CE1-CH2 4.5Å; F425-W474 HydrophobicContact CE1-CZ3 4.04Å; F425-W474 AromaticContact CZ-CH2 3.95Å; F425-W474 HydrophobicContact CZ-CH2 3.95Å; F425-W474 AromaticContact CZ-CZ3 3.93Å; F425-W474 HydrophobicContact CZ-CZ3 3.93Å; F425-L475 HydrophobicContact CE1-CD2 4.3Å; F425-F479 AromaticContact CD1-CE2 3.99Å; F425-F479 HydrophobicContact CD1-CE2 3.99Å; F425-F479 AromaticContact CD1-CZ 3.88Å; F425-F479 HydrophobicContact CD1-CZ 3.88Å; F425-F479 AromaticContact CE1-CE2 3.93Å; F425-F479 HydrophobicContact CE1-CE2 3.93Å; F425-F479 HydrophobicContact CE1-CZ 4.05Å; F425-F479 HydrophobicContact CG-CZ 4.49Å; F425-P486 HydrophobicContact CB-CB 3.86Å; F425-P486 HydrophobicContact CB-CG 3.72Å; F425-H488 PolarHBondContact N-O 3.48Å; F425-L489 HydrophobicContact CB-CD2 3.95Å; F425-L489 HydrophobicContact CD1-CD2 3.97Å; F425-L489 HydrophobicContact CG-CD2 4.47Å; F425-L489 WeakPolarHBondContact O-CA 3.29Å; F425-I490 PolarHBondContact O-N 3.11Å
426	I	97.3	Very high	84.7	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	98.2	-179.4	-51.5	179	0	0	0	108.4	I424 M428 R446 F447 L448 I490	I424-I426 HydrophobicContact CG2-CG1 4.13Å; I426-M428 HydrophobicContact CG2-CB 3.99Å; I426-M428 HydrophobicContact CG2-CG 3.87Å; I426-M428 HydrophobicContact CG2-SD 3.75Å; I426-M428 PolarHBondContact O-N 2.67Å; I426-R446 PolarHBondContact N-O 3.43Å; I426-F447 HydrophobicContact CB-CB 3.95Å; I426-F447 WeakPolarHBondContact O-CA 3.41Å; I426-L448 PolarHBondContact O-N 3Å; I426-I490 HydrophobicContact CG1-CB 4.44Å; I426-I490 HydrophobicContact CG1-CD1 4.28Å; I426-I490 HydrophobicContact CG2-CB 4.48Å
427	M	96.1	Very high	86.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	52.5	178.1	-60.5	-179.7	-54.7	0	0	110.8	F425 F467 Y468 L475 L489 I490 L495 I499	F425-M427 HydrophobicContact CD1-CG 3.41Å; F425-M427 VanDerWaalsContact CD1-CG 3.41Å; F425-M427 HydrophobicContact CD1-SD 3.83Å; F425-M427 HydrophobicContact CE1-CG 3.3Å; F425-M427 HydrophobicContact CE1-SD 3.78Å; F425-M427 HydrophobicContact CG-CG 4.15Å; F425-M427 HydrophobicContact CZ-CG 3.94Å; M427-F467 HydrophobicContact CB-CE1 4.4Å; M427-F467 HydrophobicContact CB-CZ 4.01Å; M427-F467 HydrophobicContact CG-CZ 4.22Å; M427-F467 HydrophobicContact SD-CE2 4.49Å; M427-F467 HydrophobicContact SD-CZ 4.2Å; M427-Y468 PolarHBondContact O-OH 3.1Å; M427-L475 HydrophobicContact SD-CD1 4.32Å; M427-L475 HydrophobicContact SD-CD2 3.72Å; M427-L489 HydrophobicContact CE-CB 3.86Å; M427-L489 HydrophobicContact CE-CD1 4.04Å; M427-L489 HydrophobicContact CE-CD2 3.96Å; M427-L489 HydrophobicContact CE-CG 4.18Å; M427-L489 HydrophobicContact SD-CD2 4.1Å; M427-I490 PolarHBondContact N-O 3.3Å; M427-L495 HydrophobicContact CB-CD2 4.13Å; M427-I499 HydrophobicContact CE-CD1 3.6Å
428	M	95.9	Very high	88	Confident	1 Å²	1	30 Å²	30	1%	0.005	17%	0.174	C	C	.	.	S	Bend	trans	-117.1	163.9	175.9	-59.7	171.4	69.8	0	0	107.7	T402 I426 C430 T433 Y468 I490 F492 V528	T402-M428 HydrophobicContact CG2-CE 3.79Å; I426-M428 HydrophobicContact CG2-CB 3.99Å; I426-M428 HydrophobicContact CG2-CG 3.87Å; I426-M428 HydrophobicContact CG2-SD 3.75Å; I426-M428 PolarHBondContact O-N 2.67Å; M428-C430 PolarHBondContact O-N 3.07Å; M428-T433 HydrophobicContact CE-CG2 4.35Å; M428-T433 HydrophobicContact SD-CG2 4.06Å; M428-Y468 VanDerWaalsContact C-OH 3.3Å; M428-Y468 WeakPolarHBondContact CA-OH 3.4Å; M428-I490 HydrophobicContact SD-CG2 3.79Å; M428-F492 HydrophobicContact CB-CD2 4.17Å; M428-F492 HydrophobicContact CB-CE2 4.23Å; M428-F492 HydrophobicContact CE-CD1 3.81Å; M428-F492 HydrophobicContact CE-CD2 3.74Å; M428-F492 HydrophobicContact CE-CE1 3.38Å; M428-F492 HydrophobicContact CE-CE2 3.33Å; M428-F492 HydrophobicContact CE-CG 3.97Å; M428-F492 HydrophobicContact CE-CZ 3.14Å; M428-F492 HydrophobicContact CG-CD2 4.17Å; M428-F492 HydrophobicContact CG-CE2 4.45Å; M428-V528 HydrophobicContact CE-CG1 4.39Å; M428-V528 HydrophobicContact CE-CG2 3.82Å; M428-V528 HydrophobicContact SD-CG1 4.18Å
429	P	94.7	Very high	89.7	Confident	24 Å²	24	24.9 Å²	24.9	16%	0.156	15%	0.147	C	C	.	.	S	Bend	trans	-48.2	142.2	170.1	-26.9	36.6	0	0	0	110.4	H431 S432 Y468 F492 R523	P429-H431 PolarHBondContact O-N 2.84Å; P429-S432 VanDerWaalsContact O-CB 3.23Å; P429-S432 WeakPolarHBondContact O-CB 3.31Å; P429-S432 PolarHBondContact O-N 2.9Å; P429-S432 VanDerWaalsContact O-N 3.15Å; P429-S432 PolarHBondContact O-OG 3.5Å; P429-Y468 VanDerWaalsContact CD-OH 3.24Å; P429-Y468 WeakPolarHBondContact CD-OH 3.4Å; P429-Y468 HydrophobicContact CG-CE2 4.45Å; P429-F492 HydrophobicContact CG-CD2 4.47Å; P429-F492 HydrophobicContact CG-CE2 4.38Å; P429-R523 HydrophobicContact CG-CB 3.61Å
430	C	92.7	Very high	91.6	Very high	31 Å²	31	20.7 Å²	20.7	21%	0.209	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	142.2	-175.3	60.3	0	0	0	0	111.8	M428 S432 L448 C450	M428-C430 PolarHBondContact O-N 3.07Å; C430-S432 PolarHBondContact O-N 2.92Å; C430-L448 WeakPolarHBondContact CA-O 3.41Å; C430-L448 WeakPolarHBondContact CB-O 3.43Å; C430-C450 HydrophobicContact CB-CB 3.63Å; C430-C450 WeakPolarHBondContact CB-SG 3.19Å; C430-C450 WeakPolarHBondContact SG-CB 3.41Å; C430-C450 CovalentContact SG-SG 2.01Å; C430-C450 PolarHBondContact SG-SG 3.09Å
431	H	93.9	Very high	93.3	Very high	27 Å²	27	15.4 Å²	15.4	13%	0.125	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	15.1	177.6	-50.4	-58.1	0	0	0	116.3	P75 W79 T96 P429 T433 F447	P75-H431 HydrophobicContact CB-CB 3.75Å; P75-H431 HydrophobicContact CG-CB 4.02Å; W79-H431 AromaticContact CD1-ND1 3.98Å; W79-H431 HydrophobicContact CD2-CB 4.39Å; W79-H431 AromaticContact CD2-ND1 3.31Å; W79-H431 VanDerWaalsContact CD2-ND1 3.31Å; W79-H431 AromaticContact CE2-CG 3.97Å; W79-H431 AromaticContact CE2-ND1 3.3Å; W79-H431 VanDerWaalsContact CE2-ND1 3.3Å; W79-H431 AromaticContact CE3-ND1 3.66Å; W79-H431 HydrophobicContact CG-CB 4.24Å; W79-H431 AromaticContact CG-ND1 3.77Å; W79-H431 AromaticContact CH2-ND1 3.93Å; W79-H431 HydrophobicContact CZ2-CB 4.49Å; W79-H431 AromaticContact CZ2-ND1 3.62Å; W79-H431 AromaticContact CZ3-ND1 3.95Å; W79-H431 AromaticContact NE1-CG 3.97Å; W79-H431 AromaticContact NE1-ND1 3.76Å; W79-H431 PolarHBondContact NE1-O 3.33Å; T96-H431 VanDerWaalsContact CG2-CE1 3.45Å; T96-H431 WeakPolarHBondContact CG2-CE1 3.33Å; P429-H431 PolarHBondContact O-N 2.84Å; H431-T433 VanDerWaalsContact C-N 3.27Å; H431-T433 PolarHBondContact O-N 3.39Å; H431-F447 AromaticContact CE1-CE2 3.68Å; H431-F447 AromaticContact CE1-CZ 3.81Å; H431-F447 AromaticContact ND1-CE2 3.76Å; H431-F447 AromaticContact ND1-CZ 3.99Å
432	S	94.4	Very high	94.1	Very high	25 Å²	25	15.9 Å²	15.9	18%	0.175	9%	0.094	C	C	.	.			trans	-61.6	-31.1	179.5	-70.8	0	0	0	0	114.1	T402 P429 C430	T402-S432 VanDerWaalsContact CB-O 3.3Å; T402-S432 WeakPolarHBondContact CB-O 3.13Å; T402-S432 WeakPolarHBondContact CG2-O 3.35Å; P429-S432 VanDerWaalsContact O-CB 3.23Å; P429-S432 WeakPolarHBondContact O-CB 3.31Å; P429-S432 PolarHBondContact O-N 2.9Å; P429-S432 VanDerWaalsContact O-N 3.15Å; P429-S432 PolarHBondContact O-OG 3.5Å; C430-S432 PolarHBondContact O-N 2.92Å
433	T	95.8	Very high	94.3	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.025	9%	0.093	C	C	.	.	S	Bend	trans	-112.5	155.1	176.7	65.5	0	0	0	0	109.7	W79 T402 V405 M406 M428 H431	W79-T433 WeakPolarHBondContact CZ2-O 3.46Å; W79-T433 PolarHBondContact NE1-O 2.86Å; W79-T433 VanDerWaalsContact NE1-O 3.15Å; T402-T433 HydrophobicContact CG2-CG2 4.22Å; V405-T433 HydrophobicContact CG1-CG2 4.03Å; M406-T433 HydrophobicContact SD-CG2 4.34Å; M428-T433 HydrophobicContact CE-CG2 4.35Å; M428-T433 HydrophobicContact SD-CG2 4.06Å; H431-T433 VanDerWaalsContact C-N 3.27Å; H431-T433 PolarHBondContact O-N 3.39Å
434	P	95.3	Very high	94.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.			trans	-58.6	175.7	156.7	-7.8	19.8	0	0	0	110.5	Y78 L403 M406 H438	Y78-P434 HydrophobicContact CD1-CB 4.04Å; Y78-P434 HydrophobicContact CD1-CG 4.05Å; Y78-P434 HydrophobicContact CD2-CB 3.94Å; Y78-P434 HydrophobicContact CD2-CG 3.72Å; Y78-P434 HydrophobicContact CE1-CB 4.47Å; Y78-P434 HydrophobicContact CE1-CG 3.99Å; Y78-P434 HydrophobicContact CE2-CB 4.4Å; Y78-P434 HydrophobicContact CE2-CG 3.69Å; Y78-P434 HydrophobicContact CG-CB 3.74Å; Y78-P434 HydrophobicContact CG-CG 3.91Å; L403-P434 HydrophobicContact CD2-CG 3.42Å; L403-P434 VanDerWaalsContact CD2-CG 3.42Å; M406-P434 VanDerWaalsContact CE-C 3.44Å; M406-P434 HydrophobicContact CE-CB 4.4Å; M406-P434 WeakPolarHBondContact CE-O 3.05Å; M406-P434 HydrophobicContact CG-CG 4.31Å; P434-H438 HydrophobicContact CB-CB 3.81Å; P434-H438 VanDerWaalsContact CB-CG 3.41Å; P434-H438 WeakPolarHBondContact CB-ND1 3.36Å; P434-H438 HydrophobicContact CG-CB 4.3Å
435	Y	95.4	Very high	94.3	Very high	8 Å²	8	18.2 Å²	18.2	3%	0.031	11%	0.106	C	C	.	.			trans	-130.3	-127.5	-175.3	-154.5	-130.5	0	0	0	111.8	W79 M406 S437 H438 V439 M445 R446 F447	W79-Y435 HydrophobicContact CH2-CD1 4.02Å; W79-Y435 HydrophobicContact CH2-CD2 4.25Å; W79-Y435 AromaticContact CH2-CG 3.74Å; W79-Y435 HydrophobicContact CH2-CG 3.74Å; W79-Y435 HydrophobicContact CZ2-CG 4.36Å; W79-Y435 HydrophobicContact CZ3-CD1 4.38Å; W79-Y435 HydrophobicContact CZ3-CG 4.45Å; M406-Y435 WeakPolarHBondContact CE-O 2.95Å; Y435-S437 PolarHBondContact O-N 3.48Å; Y435-H438 PolarHBondContact O-N 3.14Å; Y435-V439 PolarHBondContact O-N 3.12Å; Y435-M445 HydrophobicContact CD2-CE 3.89Å; Y435-M445 HydrophobicContact CE2-CB 3.57Å; Y435-M445 HydrophobicContact CE2-CE 3.81Å; Y435-M445 HydrophobicContact CE2-SD 4.28Å; Y435-M445 HydrophobicContact CG-CE 4.3Å; Y435-M445 WeakPolarHBondContact OH-CB 3.39Å; Y435-M445 PolarHBondContact OH-O 3.26Å; Y435-R446 PolarHBondContact OH-N 2.73Å; Y435-F447 HydrophobicContact CE2-CD1 4.01Å
436	Y	95.9	Very high	94.2	Very high	24 Å²	24	22.2 Å²	22.2	9%	0.094	12%	0.121	C	C	.	.	H	α-helix	trans	-63.4	-26.1	-176.2	-70	-74.3	0	0	0	113.6	E83 Y92 H438 V439 H440 C441 L443 M445	E83-Y436 WeakPolarHBondContact OE1-CB 3.37Å; E83-Y436 PolarHBondContact OE1-N 2.92Å; E83-Y436 PolarHBondContact OE2-N 3.19Å; Y92-Y436 AromaticContact CD2-CD1 3.92Å; Y92-Y436 HydrophobicContact CD2-CD1 3.92Å; Y92-Y436 HydrophobicContact CD2-CE1 4.29Å; Y92-Y436 HydrophobicContact CD2-CG 4.06Å; Y92-Y436 AromaticContact CE2-CD1 3.64Å; Y92-Y436 HydrophobicContact CE2-CD1 3.64Å; Y92-Y436 HydrophobicContact CE2-CE1 4.28Å; Y92-Y436 HydrophobicContact CE2-CG 4.01Å; Y436-H438 PolarHBondContact O-N 2.95Å; Y436-H438 VanDerWaalsContact O-N 3.1Å; Y436-V439 PolarHBondContact O-N 2.95Å; Y436-H440 WeakPolarHBondContact O-CA 3.11Å; Y436-H440 PolarHBondContact O-N 2.96Å; Y436-C441 WeakPolarHBondContact CD1-O 3.44Å; Y436-C441 WeakPolarHBondContact CE1-O 3.32Å; Y436-L443 WeakPolarHBondContact CE1-O 3.38Å; Y436-L443 PolarHBondContact OH-O 2.77Å; Y436-M445 HydrophobicContact CD1-CE 3.51Å; Y436-M445 HydrophobicContact CD2-CE 4.22Å; Y436-M445 HydrophobicContact CE1-CE 3.35Å; Y436-M445 HydrophobicContact CE2-CE 4.12Å; Y436-M445 HydrophobicContact CG-CE 3.96Å; Y436-M445 PolarHBondContact OH-N 2.94Å
437	S	95.3	Very high	94.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-54.7	-25.1	169.2	48.9	0	0	0	0	114.3	E83 Y435	E83-S437 WeakPolarHBondContact OE2-CB 3.28Å; E83-S437 PolarHBondContact OE2-N 3.42Å; E83-S437 PolarHBondContact OE2-OG 3.33Å; Y435-S437 PolarHBondContact O-N 3.48Å
438	H	95.8	Very high	94.1	Very high	11 Å²	11	22.4 Å²	22.4	5%	0.051	12%	0.122	C	C	.	.	H	α-helix	trans	-117.2	2.9	179.6	-69.3	61.4	0	0	0	113.6	Y78 V127 I131 M406 Q410 P434 Y435 Y436	Y78-H438 AromaticContact CD1-CE1 3.38Å; Y78-H438 WeakPolarHBondContact CD1-CE1 3.49Å; Y78-H438 AromaticContact CD1-NE2 3.96Å; Y78-H438 AromaticContact CE1-CE1 3.61Å; Y78-H438 AromaticContact CE1-NE2 3.68Å; V127-H438 WeakPolarHBondContact CG2-O 3.34Å; I131-H438 HydrophobicContact CD1-CB 4.2Å; M406-H438 HydrophobicContact CB-CB 4.28Å; M406-H438 HydrophobicContact CE-CB 4.09Å; M406-H438 HydrophobicContact CG-CB 4.42Å; Q410-H438 PolarHBondContact NE2-O 2.88Å; P434-H438 HydrophobicContact CB-CB 3.81Å; P434-H438 VanDerWaalsContact CB-CG 3.41Å; P434-H438 WeakPolarHBondContact CB-ND1 3.36Å; P434-H438 HydrophobicContact CG-CB 4.3Å; Y435-H438 PolarHBondContact O-N 3.14Å; Y436-H438 PolarHBondContact O-N 2.95Å; Y436-H438 VanDerWaalsContact O-N 3.1Å
439	V	94.9	Very high	94	Very high	6 Å²	6	25.7 Å²	25.7	4%	0.036	14%	0.137	C	C	.	.	H	α-helix	trans	-111.4	-39.1	173.2	178	0	0	0	0	110.6	M406 I409 Y435 Y436 C441 M445	M406-V439 HydrophobicContact CE-CG2 3.49Å; M406-V439 VanDerWaalsContact CE-CG2 3.49Å; I409-V439 HydrophobicContact CB-CG2 4.27Å; I409-V439 HydrophobicContact CG2-CB 4.41Å; I409-V439 HydrophobicContact CG2-CG1 3.81Å; I409-V439 HydrophobicContact CG2-CG2 3.64Å; Y435-V439 PolarHBondContact O-N 3.12Å; Y436-V439 PolarHBondContact O-N 2.95Å; V439-C441 VanDerWaalsContact C-N 3.25Å; V439-C441 HydrophobicContact CG1-CB 3.94Å; V439-C441 PolarHBondContact O-N 3.33Å; V439-M445 HydrophobicContact CB-CE 4.18Å; V439-M445 HydrophobicContact CG1-CE 4.4Å; V439-M445 HydrophobicContact CG2-CE 3.92Å; V439-M445 HydrophobicContact CG2-SD 4.18Å
440	H	94.2	Very high	93.8	Very high	38 Å²	38	25 Å²	25	18%	0.176	13%	0.133	C	C	.	.			trans	43.7	50.4	-175.8	-165.3	58.2	0	0	0	112.9	H86 F90 Y92 D125 V127 L130 Y436	H86-H440 AromaticContact CD2-ND1 3.6Å; H86-H440 AromaticContact NE2-CE1 3.81Å; H86-H440 AromaticContact NE2-ND1 2.97Å; H86-H440 PolarHBondContact NE2-ND1 2.9Å; F90-H440 AromaticContact CD1-CE1 3.69Å; F90-H440 AromaticContact CD2-CE1 3.83Å; F90-H440 AromaticContact CE1-CE1 3.47Å; F90-H440 VanDerWaalsContact CE1-CE1 3.47Å; F90-H440 WeakPolarHBondContact CE1-CE1 3.31Å; F90-H440 AromaticContact CE2-CE1 3.63Å; F90-H440 AromaticContact CE2-ND1 3.99Å; F90-H440 AromaticContact CG-CE1 3.87Å; F90-H440 AromaticContact CZ-CE1 3.44Å; F90-H440 VanDerWaalsContact CZ-CE1 3.44Å; F90-H440 WeakPolarHBondContact CZ-CE1 3.44Å; Y92-H440 PolarHBondContact OH-ND1 3.36Å; D125-H440 PolarHBondContact O-CD2 3.07Å; D125-H440 PolarHBondContact O-NE2 2.93Å; D125-H440 IonicContact OD2-NE2 3.02Å; V127-H440 HydrophobicContact CB-CB 3.9Å; V127-H440 HydrophobicContact CG2-CB 3.94Å; L130-H440 HydrophobicContact CD1-CB 3.96Å; L130-H440 VanDerWaalsContact CD1-CG 3.41Å; L130-H440 WeakPolarHBondContact CD1-ND1 3.37Å; Y436-H440 WeakPolarHBondContact O-CA 3.11Å; Y436-H440 PolarHBondContact O-N 2.96Å
441	C	90	Very high	93.7	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.034	13%	0.134	C	C	.	.	S	Bend	trans	-148.2	136.3	175.9	175.4	0	0	0	0	109.1	Y92 C413 Y436 V439 L443	Y92-C441 PolarHBondContact OH-N 3.02Å; C413-C441 HydrophobicContact CB-CB 3.64Å; C413-C441 WeakPolarHBondContact CB-SG 3.15Å; C413-C441 WeakPolarHBondContact SG-CB 3.35Å; C413-C441 CovalentContact SG-SG 2.02Å; C413-C441 PolarHBondContact SG-SG 3.43Å; Y436-C441 WeakPolarHBondContact CD1-O 3.44Å; Y436-C441 WeakPolarHBondContact CE1-O 3.32Å; V439-C441 VanDerWaalsContact C-N 3.25Å; V439-C441 HydrophobicContact CG1-CB 3.94Å; V439-C441 PolarHBondContact O-N 3.33Å; C441-L443 PolarHBondContact O-N 3.02Å
442	P	88.5	Confident	93.2	Very high	80 Å²	80	24.2 Å²	24.2	52%	0.519	13%	0.13	S	C	.	.			trans	-77.2	49.7	-179.1	34.6	-37.9	0	0	0	111.8	Y92	Y92-P442 HydrophobicContact CE2-CB 4.44Å
443	L	90.5	Very high	92.6	Very high	4 Å²	4	24 Å²	24	2%	0.021	13%	0.127	C	C	.	.			trans	-77.4	134.5	174.8	-175.7	69.6	0	0	0	109.2	I409 A422 I424 Y436 C441 M445	I409-L443 HydrophobicContact CG2-CD2 4.3Å; A422-L443 HydrophobicContact CB-CD1 3.75Å; A422-L443 WeakPolarHBondContact O-CD1 3.47Å; I424-L443 HydrophobicContact CD1-CD2 3.35Å; I424-L443 HydrophobicContact CG1-CD2 3.66Å; I424-L443 HydrophobicContact CG1-CG 4.49Å; Y436-L443 WeakPolarHBondContact CE1-O 3.38Å; Y436-L443 PolarHBondContact OH-O 2.77Å; C441-L443 PolarHBondContact O-N 3.02Å; L443-M445 HydrophobicContact CB-CG 4.38Å; L443-M445 HydrophobicContact CD2-CG 4.31Å; L443-M445 HydrophobicContact CG-CG 4.34Å; L443-M445 WeakPolarHBondContact O-CG 3.41Å; L443-M445 PolarHBondContact O-N 2.99Å
444	P	92.4	Very high	91.8	Very high	69 Å²	69	27.9 Å²	27.9	45%	0.448	15%	0.147	S	C	.	.			trans	-58.4	111.3	170.2	-23.8	33.5	0	0	0	110.5	A422 S423 I424	A422-P444 WeakPolarHBondContact O-CD 3.42Å; S423-P444 WeakPolarHBondContact CA-O 3.42Å; I424-P444 PolarHBondContact N-O 3.05Å
445	M	94.5	Very high	90.8	Very high	19 Å²	19	32.7 Å²	32.7	9%	0.094	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.4	176.3	-61.6	-164.5	-69.1	0	0	108.9	I409 I424 Y435 Y436 V439 L443	I409-M445 HydrophobicContact CG2-SD 3.98Å; I424-M445 HydrophobicContact CB-CG 4.09Å; I424-M445 HydrophobicContact CD1-SD 4.45Å; I424-M445 HydrophobicContact CG1-CG 4.48Å; I424-M445 CarbonylContact O-C 3.57Å; I424-M445 WeakPolarHBondContact O-CA 3.24Å; Y435-M445 HydrophobicContact CD2-CE 3.89Å; Y435-M445 HydrophobicContact CE2-CB 3.57Å; Y435-M445 HydrophobicContact CE2-CE 3.81Å; Y435-M445 HydrophobicContact CE2-SD 4.28Å; Y435-M445 HydrophobicContact CG-CE 4.3Å; Y435-M445 WeakPolarHBondContact OH-CB 3.39Å; Y435-M445 PolarHBondContact OH-O 3.26Å; Y436-M445 HydrophobicContact CD1-CE 3.51Å; Y436-M445 HydrophobicContact CD2-CE 4.22Å; Y436-M445 HydrophobicContact CE1-CE 3.35Å; Y436-M445 HydrophobicContact CE2-CE 4.12Å; Y436-M445 HydrophobicContact CG-CE 3.96Å; Y436-M445 PolarHBondContact OH-N 2.94Å; V439-M445 HydrophobicContact CB-CE 4.18Å; V439-M445 HydrophobicContact CG1-CE 4.4Å; V439-M445 HydrophobicContact CG2-CE 3.92Å; V439-M445 HydrophobicContact CG2-SD 4.18Å; L443-M445 HydrophobicContact CB-CG 4.38Å; L443-M445 HydrophobicContact CD2-CG 4.31Å; L443-M445 HydrophobicContact CG-CG 4.34Å; L443-M445 WeakPolarHBondContact O-CG 3.41Å; L443-M445 PolarHBondContact O-N 2.99Å
446	R	94.7	Very high	89.5	Confident	86 Å²	86	35.7 Å²	35.7	33%	0.325	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	150.2	171.1	-179.3	178.5	171.7	-176.6	-3	109	I424 F425 I426 Y435 E463 E478	I424-R446 PolarHBondContact O-N 3.48Å; F425-R446 WeakPolarHBondContact CA-O 3.49Å; F425-R446 HydrophobicContact CD2-CB 3.93Å; F425-R446 HydrophobicContact CD2-CG 3.89Å; F425-R446 HydrophobicContact CE2-CB 4.5Å; F425-R446 HydrophobicContact CE2-CG 3.95Å; I426-R446 PolarHBondContact N-O 3.43Å; Y435-R446 PolarHBondContact OH-N 2.73Å; R446-E463 IonicContact CZ-OE1 3.61Å; R446-E463 IonicContact NE-OE1 3.65Å; R446-E463 IonicContact NH2-OE1 2.76Å; R446-E463 PolarHBondContact NH2-OE1 3.02Å; R446-E478 IonicContact CZ-OE1 3.2Å; R446-E478 IonicContact NH1-OE1 2.67Å; R446-E478 PolarHBondContact NH1-OE1 3.1Å; R446-E478 IonicContact NH2-OE1 2.84Å; R446-E478 PolarHBondContact NH2-OE1 3.33Å
447	F	96.1	Very high	88.4	Confident	8 Å²	8	41.7 Å²	41.7	4%	0.035	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	163.1	170.6	66.6	-82.5	0	0	0	108.8	W79 Y94 I426 H431 Y435 Q449	W79-F447 HydrophobicContact CH2-CD1 4.15Å; W79-F447 AromaticContact CH2-CE1 3.5Å; W79-F447 HydrophobicContact CH2-CE1 3.5Å; W79-F447 HydrophobicContact CH2-CE2 4.35Å; W79-F447 AromaticContact CH2-CZ 3.63Å; W79-F447 HydrophobicContact CH2-CZ 3.63Å; W79-F447 HydrophobicContact CZ2-CE1 4.41Å; W79-F447 HydrophobicContact CZ2-CZ 4.36Å; W79-F447 HydrophobicContact CZ3-CE1 4.07Å; W79-F447 AromaticContact CZ3-CZ 3.99Å; W79-F447 HydrophobicContact CZ3-CZ 3.99Å; Y94-F447 HydrophobicContact CD1-CE1 4.15Å; Y94-F447 AromaticContact CD1-CZ 3.99Å; Y94-F447 HydrophobicContact CD1-CZ 3.99Å; Y94-F447 HydrophobicContact CD2-CE1 4.15Å; Y94-F447 HydrophobicContact CE1-CE1 4.18Å; Y94-F447 AromaticContact CE1-CZ 3.68Å; Y94-F447 HydrophobicContact CE1-CZ 3.68Å; Y94-F447 HydrophobicContact CE2-CE1 4.22Å; Y94-F447 HydrophobicContact CE2-CZ 4.32Å; Y94-F447 HydrophobicContact CG-CE1 4.1Å; Y94-F447 HydrophobicContact CG-CZ 4.4Å; Y94-F447 AromaticContact CZ-CZ 3.88Å; I426-F447 HydrophobicContact CB-CB 3.95Å; I426-F447 WeakPolarHBondContact O-CA 3.41Å; H431-F447 AromaticContact CE1-CE2 3.68Å; H431-F447 AromaticContact CE1-CZ 3.81Å; H431-F447 AromaticContact ND1-CE2 3.76Å; H431-F447 AromaticContact ND1-CZ 3.99Å; Y435-F447 HydrophobicContact CE2-CD1 4.01Å; F447-Q449 HydrophobicContact CE2-CG 4.45Å; F447-Q449 PolarHBondContact O-N 2.93Å
448	L	95.5	Very high	86.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.278	C	S	.	.			trans	-67.5	122	175.6	-65	166.3	0	0	0	110.4	F425 I426 C430 E463 A464 F467 Y468 W474	F425-L448 HydrophobicContact CE2-CD2 4.39Å; F425-L448 HydrophobicContact CZ-CD2 3.88Å; F425-L448 HydrophobicContact CZ-CG 4.3Å; I426-L448 PolarHBondContact O-N 3Å; C430-L448 WeakPolarHBondContact CA-O 3.41Å; C430-L448 WeakPolarHBondContact CB-O 3.43Å; L448-E463 HydrophobicContact CD2-CG 4.3Å; L448-A464 HydrophobicContact CB-CB 3.92Å; L448-F467 HydrophobicContact CD1-CB 4.32Å; L448-F467 HydrophobicContact CD1-CD1 3.3Å; L448-F467 HydrophobicContact CD1-CE1 3.58Å; L448-F467 HydrophobicContact CD1-CG 3.82Å; L448-F467 HydrophobicContact CD1-CZ 4.3Å; L448-F467 HydrophobicContact CD2-CB 3.85Å; L448-F467 HydrophobicContact CD2-CD1 4.19Å; L448-F467 HydrophobicContact CD2-CD2 4.14Å; L448-F467 HydrophobicContact CD2-CG 3.8Å; L448-F467 HydrophobicContact CG-CD1 4.39Å; L448-F467 HydrophobicContact CG-CG 4.49Å; L448-Y468 HydrophobicContact CD1-CE2 4.04Å; L448-W474 HydrophobicContact CD2-CH2 4.24Å; L448-W474 HydrophobicContact CD2-CZ2 4.4Å
449	Q	93.6	Very high	85.8	Confident	71 Å²	71	55.6 Å²	55.6	33%	0.332	32%	0.315	S	S	.	.			trans	-86.9	152.7	-179	-56.9	-176.6	18.2	0	0	111.9	Y94 F447 E463 A464	Y94-Q449 PolarHBondContact OH-NE2 3.41Å; Y94-Q449 PolarHBondContact OH-OE1 3.08Å; F447-Q449 HydrophobicContact CE2-CG 4.45Å; F447-Q449 PolarHBondContact O-N 2.93Å; Q449-E463 VanDerWaalsContact CB-OE2 3.32Å; Q449-E463 WeakPolarHBondContact CB-OE2 3.4Å; Q449-E463 WeakPolarHBondContact CG-OE2 3.45Å; Q449-E463 PolarHBondContact N-OE2 3.2Å; Q449-E463 WeakPolarHBondContact O-CB 3.23Å; Q449-A464 PolarHBondContact O-N 2.81Å; Q449-A464 VanDerWaalsContact O-N 3.11Å
450	C	91.3	Very high	85.2	Confident	9 Å²	9	59 Å²	59	6%	0.061	33%	0.328	C	S	.	.			trans	-138.8	56.2	178.3	64.6	0	0	0	0	112.8	C430 D462	C430-C450 HydrophobicContact CB-CB 3.63Å; C430-C450 WeakPolarHBondContact CB-SG 3.19Å; C430-C450 WeakPolarHBondContact SG-CB 3.41Å; C430-C450 CovalentContact SG-SG 2.01Å; C430-C450 PolarHBondContact SG-SG 3.09Å; C450-D462 HydrophobicContact CB-CB 4.47Å
451	P	89.1	Confident	84.8	Confident	37 Å²	37	61.4 Å²	61.4	24%	0.24	34%	0.342	C	S	.	.			trans	-67.8	140	175.8	28.3	-30.2	0	0	0	109.8	W97 Y460	W97-P451 HydrophobicContact CB-CB 4.19Å; W97-P451 HydrophobicContact CG-CB 4.19Å; P451-Y460 WeakPolarHBondContact O-CE1 3.47Å; P451-Y460 PolarHBondContact O-OH 3.45Å
452	P	84.8	Confident	84.8	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.032	34%	0.342	C	S	.	.			trans	-69.2	161.7	176.6	31.8	-35.4	0	0	0	110.5	W97 F284 F293 L454	W97-P452 HydrophobicContact CD2-CG 3.81Å; W97-P452 HydrophobicContact CE3-CG 3.75Å; W97-P452 HydrophobicContact CH2-CG 3.58Å; W97-P452 HydrophobicContact CZ2-CG 3.64Å; W97-P452 HydrophobicContact CZ3-CG 3.61Å; F284-P452 HydrophobicContact CZ-CG 4.24Å; F293-P452 HydrophobicContact CD1-CB 3.95Å; F293-P452 HydrophobicContact CE1-CB 4.19Å; F293-P452 HydrophobicContact CG-CB 4.16Å; P452-L454 HydrophobicContact CG-CD2 4.23Å; P452-L454 PolarHBondContact O-N 3.35Å; P452-L454 VanDerWaalsContact O-N 3.12Å
453	D	81.8	Confident	85	Confident	20 Å²	20	59.8 Å²	59.8	11%	0.107	33%	0.327	C	S	.	.			trans	-71.6	108.9	174.4	-168.1	6	0	0	0	111.6	T455 G456 K457 Y460	D453-T455 WeakPolarHBondContact OD1-CA 3.39Å; D453-T455 WeakPolarHBondContact OD1-CB 3.17Å; D453-T455 PolarHBondContact OD1-N 3.16Å; D453-T455 PolarHBondContact OD1-OG1 3.31Å; D453-G456 PolarHBondContact OD1-N 3Å; D453-G456 PolarHBondContact OD2-N 3.07Å; D453-K457 WeakPolarHBondContact OD2-CA 2.98Å; D453-K457 WeakPolarHBondContact OD2-CB 3.09Å; D453-K457 PolarHBondContact OD2-N 3.01Å; D453-K457 VanDerWaalsContact OD2-O 3.13Å; D453-Y460 HydrophobicContact CB-CD1 3.63Å; D453-Y460 HydrophobicContact CB-CD2 4.1Å; D453-Y460 HydrophobicContact CB-CE1 4.28Å; D453-Y460 HydrophobicContact CB-CG 3.5Å; D453-Y460 VanDerWaalsContact CB-CG 3.5Å
454	L	78.9	Confident	85.1	Confident	85 Å²	85	59.7 Å²	59.7	45%	0.445	33%	0.327	S	S	.	.	S	Bend	trans	-89.5	-5.5	173.4	-56.2	178.3	0	0	0	112.5	W97 E101 F284 P452	W97-L454 HydrophobicContact CZ3-CD2 4.49Å; E101-L454 HydrophobicContact CG-CD1 3.59Å; F284-L454 HydrophobicContact CE2-CD2 3.88Å; P452-L454 HydrophobicContact CG-CD2 4.23Å; P452-L454 PolarHBondContact O-N 3.35Å; P452-L454 VanDerWaalsContact O-N 3.12Å
455	T	73.5	Confident	85.1	Confident	101 Å²	101	58 Å²	58	62%	0.62	31%	0.314	S	S	*	.	S	Bend	trans	-99.6	-14.5	-174.8	69.9	0	0	0	0	114.2	D453	D453-T455 WeakPolarHBondContact OD1-CA 3.39Å; D453-T455 WeakPolarHBondContact OD1-CB 3.17Å; D453-T455 PolarHBondContact OD1-N 3.16Å; D453-T455 PolarHBondContact OD1-OG1 3.31Å
456	G	68.1	Low	85.1	Confident	71 Å²	71	59.5 Å²	59.5	73%	0.732	32%	0.324	S	S	*	.			trans	82.6	25.2	172.4	0	0	0	0	0	115.5	D453	D453-G456 PolarHBondContact OD1-N 3Å; D453-G456 PolarHBondContact OD2-N 3.07Å
457	K	73.4	Confident	85.2	Confident	151 Å²	151	55.4 Å²	55.4	66%	0.657	31%	0.308	S	S	*	.			trans	-78.4	135.6	174.5	-64	177.5	-177.7	177	0	110.5	D453 Q459	D453-K457 WeakPolarHBondContact OD2-CA 2.98Å; D453-K457 WeakPolarHBondContact OD2-CB 3.09Å; D453-K457 PolarHBondContact OD2-N 3.01Å; D453-K457 VanDerWaalsContact OD2-O 3.13Å; K457-Q459 PolarHBondContact O-N 3.33Å; K457-Q459 VanDerWaalsContact O-N 3.13Å
458	S	62.1	Low	85.1	Confident	126 Å²	126	56.7 Å²	56.7	88%	0.881	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-1.1	-173.4	50.8	0	0	0	0	115.7
459	Q	74.3	Confident	85.1	Confident	177 Å²	177	62.7 Å²	62.7	83%	0.827	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.8	43.9	-178.9	-65.9	-175.2	-13.7	0	0	111.8	K457	K457-Q459 PolarHBondContact O-N 3.33Å; K457-Q459 VanDerWaalsContact O-N 3.13Å
460	Y	81.8	Confident	85.1	Confident	76 Å²	76	63.2 Å²	63.2	30%	0.298	35%	0.35	S	S	.	.			trans	-70.3	131.8	175.5	172.6	-95.5	0	0	0	111	F293 P451 D453 D462	F293-Y460 HydrophobicContact CE2-CD1 4.4Å; P451-Y460 WeakPolarHBondContact O-CE1 3.47Å; P451-Y460 PolarHBondContact O-OH 3.45Å; D453-Y460 HydrophobicContact CB-CD1 3.63Å; D453-Y460 HydrophobicContact CB-CD2 4.1Å; D453-Y460 HydrophobicContact CB-CE1 4.28Å; D453-Y460 HydrophobicContact CB-CG 3.5Å; D453-Y460 VanDerWaalsContact CB-CG 3.5Å; Y460-D462 HydrophobicContact CE1-CB 3.86Å
461	L	85.3	Confident	85.4	Confident	90 Å²	90	63 Å²	63	47%	0.471	35%	0.348	S	S	.	.			trans	-119.1	128.3	169.7	-63.2	174.3	0	0	0	107.8	D465 V466 L469	L461-D465 HydrophobicContact CB-CB 4.17Å; L461-D465 HydrophobicContact CD2-CB 4.13Å; L461-V466 HydrophobicContact CB-CG2 3.74Å; L461-L469 HydrophobicContact CD1-CD1 3.64Å
462	D	89.9	Confident	85.7	Confident	7 Å²	7	63.9 Å²	63.9	4%	0.037	35%	0.351	C	S	.	.			trans	-78.1	173.9	175.1	67.2	58.2	0	0	0	112.7	F293 C450 Y460 A464 D465 V466	F293-D462 WeakPolarHBondContact CZ-OD2 3.42Å; C450-D462 HydrophobicContact CB-CB 4.47Å; Y460-D462 HydrophobicContact CE1-CB 3.86Å; D462-A464 VanDerWaalsContact C-N 3.3Å; D462-A464 PolarHBondContact O-N 3.2Å; D462-A464 WeakPolarHBondContact OD1-CA 3.27Å; D462-A464 VanDerWaalsContact OD1-CB 3.28Å; D462-A464 WeakPolarHBondContact OD1-CB 3.45Å; D462-A464 PolarHBondContact OD1-N 2.91Å; D462-D465 PolarHBondContact O-N 3.17Å; D462-D465 PolarHBondContact OD1-N 3.46Å; D462-V466 VanDerWaalsContact O-CG2 3.3Å; D462-V466 WeakPolarHBondContact O-CG2 3.45Å; D462-V466 PolarHBondContact O-N 2.91Å
463	E	93.6	Very high	86.1	Confident	43 Å²	43	68.5 Å²	68.5	20%	0.201	38%	0.375	C	S	.	.	H	α-helix	trans	-56.2	-44.1	-179.4	179	-169.9	-162.4	0	0	111.9	R446 L448 Q449 V466 F467 W474	R446-E463 IonicContact CZ-OE1 3.61Å; R446-E463 IonicContact NE-OE1 3.65Å; R446-E463 IonicContact NH2-OE1 2.76Å; R446-E463 PolarHBondContact NH2-OE1 3.02Å; L448-E463 HydrophobicContact CD2-CG 4.3Å; Q449-E463 VanDerWaalsContact CB-OE2 3.32Å; Q449-E463 WeakPolarHBondContact CB-OE2 3.4Å; Q449-E463 WeakPolarHBondContact CG-OE2 3.45Å; Q449-E463 PolarHBondContact N-OE2 3.2Å; Q449-E463 WeakPolarHBondContact O-CB 3.23Å; E463-V466 PolarHBondContact O-N 3.2Å; E463-F467 WeakPolarHBondContact O-CB 3.41Å; E463-F467 PolarHBondContact O-N 3.3Å; E463-W474 HydrophobicContact CG-CZ2 3.97Å
464	A	93.2	Very high	86.8	Confident	2 Å²	2	68.1 Å²	68.1	2%	0.017	37%	0.372	C	S	.	.	H	α-helix	trans	-65.8	-42.9	178.9	0	0	0	0	0	111.2	L448 Q449 D462 F467 Y468	L448-A464 HydrophobicContact CB-CB 3.92Å; Q449-A464 PolarHBondContact O-N 2.81Å; Q449-A464 VanDerWaalsContact O-N 3.11Å; D462-A464 VanDerWaalsContact C-N 3.3Å; D462-A464 PolarHBondContact O-N 3.2Å; D462-A464 WeakPolarHBondContact OD1-CA 3.27Å; D462-A464 VanDerWaalsContact OD1-CB 3.28Å; D462-A464 WeakPolarHBondContact OD1-CB 3.45Å; D462-A464 PolarHBondContact OD1-N 2.91Å; A464-F467 WeakPolarHBondContact O-CB 3.22Å; A464-F467 PolarHBondContact O-N 3.36Å; A464-Y468 WeakPolarHBondContact O-CD2 3.39Å; A464-Y468 PolarHBondContact O-N 3.35Å
465	D	92.4	Very high	87.6	Confident	35 Å²	35	64.1 Å²	64.1	19%	0.187	35%	0.351	C	S	.	.	H	α-helix	trans	-61.6	-46.6	176	-78.6	-15.1	0	0	0	112.2	L461 D462 F467 Y468 L469 R523	L461-D465 HydrophobicContact CB-CB 4.17Å; L461-D465 HydrophobicContact CD2-CB 4.13Å; D462-D465 PolarHBondContact O-N 3.17Å; D462-D465 PolarHBondContact OD1-N 3.46Å; D465-F467 VanDerWaalsContact C-N 3.28Å; D465-F467 PolarHBondContact O-N 3.32Å; D465-Y468 PolarHBondContact O-N 3.38Å; D465-L469 WeakPolarHBondContact O-CG 3.26Å; D465-L469 PolarHBondContact O-N 3.05Å; D465-L469 VanDerWaalsContact O-N 3.11Å; D465-R523 IonicContact OD1-CZ 3.2Å; D465-R523 IonicContact OD1-NH1 2.76Å; D465-R523 PolarHBondContact OD1-NH1 3.28Å; D465-R523 IonicContact OD1-NH2 2.71Å; D465-R523 PolarHBondContact OD1-NH2 3.45Å
466	V	93.9	Very high	88.5	Confident	49 Å²	49	63.1 Å²	63.1	30%	0.297	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-37.5	177.2	178.7	0	0	0	0	111.1	L461 D462 E463	L461-V466 HydrophobicContact CB-CG2 3.74Å; D462-V466 VanDerWaalsContact O-CG2 3.3Å; D462-V466 WeakPolarHBondContact O-CG2 3.45Å; D462-V466 PolarHBondContact O-N 2.91Å; E463-V466 PolarHBondContact O-N 3.2Å
467	F	95.8	Very high	89.7	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-52.6	174	172.4	-100.4	0	0	0	111.9	M427 L448 E463 A464 D465 L469 N470 P471 W474 L475 L495	M427-F467 HydrophobicContact CB-CE1 4.4Å; M427-F467 HydrophobicContact CB-CZ 4.01Å; M427-F467 HydrophobicContact CG-CZ 4.22Å; M427-F467 HydrophobicContact SD-CE2 4.49Å; M427-F467 HydrophobicContact SD-CZ 4.2Å; L448-F467 HydrophobicContact CD1-CB 4.32Å; L448-F467 HydrophobicContact CD1-CD1 3.3Å; L448-F467 HydrophobicContact CD1-CE1 3.58Å; L448-F467 HydrophobicContact CD1-CG 3.82Å; L448-F467 HydrophobicContact CD1-CZ 4.3Å; L448-F467 HydrophobicContact CD2-CB 3.85Å; L448-F467 HydrophobicContact CD2-CD1 4.19Å; L448-F467 HydrophobicContact CD2-CD2 4.14Å; L448-F467 HydrophobicContact CD2-CG 3.8Å; L448-F467 HydrophobicContact CG-CD1 4.39Å; L448-F467 HydrophobicContact CG-CG 4.49Å; E463-F467 WeakPolarHBondContact O-CB 3.41Å; E463-F467 PolarHBondContact O-N 3.3Å; A464-F467 WeakPolarHBondContact O-CB 3.22Å; A464-F467 PolarHBondContact O-N 3.36Å; D465-F467 VanDerWaalsContact C-N 3.28Å; D465-F467 PolarHBondContact O-N 3.32Å; F467-L469 PolarHBondContact O-N 3.3Å; F467-N470 CarbonylContact O-C 3.58Å; F467-N470 VanDerWaalsContact O-C 3.26Å; F467-N470 PolarHBondContact O-N 3Å; F467-P471 HydrophobicContact CE1-CB 4.4Å; F467-P471 HydrophobicContact CE2-CB 4.12Å; F467-P471 HydrophobicContact CZ-CB 4.05Å; F467-P471 VanDerWaalsContact O-CA 3.29Å; F467-P471 WeakPolarHBondContact O-CA 3.49Å; F467-P471 WeakPolarHBondContact O-CD 3.23Å; F467-P471 WeakPolarHBondContact O-CG 3.44Å; F467-P471 VanDerWaalsContact O-N 3.07Å; F467-W474 HydrophobicContact CB-CD2 4.32Å; F467-W474 HydrophobicContact CB-CG 4.29Å; F467-W474 HydrophobicContact CD2-CB 4.15Å; F467-W474 AromaticContact CD2-CD2 3.67Å; F467-W474 HydrophobicContact CD2-CD2 3.67Å; F467-W474 AromaticContact CD2-CE3 3.52Å; F467-W474 HydrophobicContact CD2-CE3 3.52Å; F467-W474 AromaticContact CD2-CG 3.95Å; F467-W474 HydrophobicContact CD2-CG 3.95Å; F467-W474 HydrophobicContact CD2-CZ3 4.12Å; F467-W474 AromaticContact CE2-CE3 3.99Å; F467-W474 HydrophobicContact CE2-CE3 3.99Å; F467-W474 HydrophobicContact CE2-CZ3 4.46Å; F467-L475 HydrophobicContact CE2-CD1 4.42Å; F467-L475 HydrophobicContact CE2-CD2 4.08Å; F467-L475 HydrophobicContact CE2-CG 4.01Å; F467-L495 HydrophobicContact CE1-CD1 4.29Å; F467-L495 HydrophobicContact CE1-CD2 3.77Å; F467-L495 HydrophobicContact CZ-CD2 3.71Å
468	Y	94.8	Very high	90.6	Very high	35 Å²	35	62.1 Å²	62.1	14%	0.137	31%	0.312	C	S	.	.	H	α-helix	trans	-70.9	-10.4	-176.5	-79.2	-69.8	0	0	0	114.3	M427 M428 P429 L448 A464 D465 L495 R523	M427-Y468 PolarHBondContact O-OH 3.1Å; M428-Y468 VanDerWaalsContact C-OH 3.3Å; M428-Y468 WeakPolarHBondContact CA-OH 3.4Å; P429-Y468 VanDerWaalsContact CD-OH 3.24Å; P429-Y468 WeakPolarHBondContact CD-OH 3.4Å; P429-Y468 HydrophobicContact CG-CE2 4.45Å; L448-Y468 HydrophobicContact CD1-CE2 4.04Å; A464-Y468 WeakPolarHBondContact O-CD2 3.39Å; A464-Y468 PolarHBondContact O-N 3.35Å; D465-Y468 PolarHBondContact O-N 3.38Å; Y468-L495 HydrophobicContact CD1-CD1 4.48Å; Y468-L495 HydrophobicContact CE1-CD1 4.19Å; Y468-R523 HydrophobicContact CD1-CG 4.07Å; Y468-R523 VanDerWaalsContact CD2-CD 3.46Å; Y468-R523 HydrophobicContact CD2-CG 4.3Å; Y468-R523 HydrophobicContact CE1-CB 4.22Å; Y468-R523 HydrophobicContact CE1-CG 4.2Å; Y468-R523 HydrophobicContact CE2-CG 4.44Å; Y468-R523 HydrophobicContact CG-CG 4.14Å
469	L	94.7	Very high	92.1	Very high	126 Å²	126	57.2 Å²	57.2	66%	0.66	28%	0.275	S	S	*	.	H	α-helix	trans	-73.5	-37.1	170.3	-76.7	174.4	0	0	0	112.9	L461 D465 F467	L461-L469 HydrophobicContact CD1-CD1 3.64Å; D465-L469 WeakPolarHBondContact O-CG 3.26Å; D465-L469 PolarHBondContact O-N 3.05Å; D465-L469 VanDerWaalsContact O-N 3.11Å; F467-L469 PolarHBondContact O-N 3.3Å
470	N	95.3	Very high	92.5	Very high	83 Å²	83	55.7 Å²	55.7	44%	0.444	27%	0.268	S	S	.	.			trans	-156.4	82.7	176.1	-168.4	-36	0	0	0	110.4	F467 L472 N473 W474	F467-N470 CarbonylContact O-C 3.58Å; F467-N470 VanDerWaalsContact O-C 3.26Å; F467-N470 PolarHBondContact O-N 3Å; N470-L472 PolarHBondContact O-N 3.26Å; N470-N473 HydrophobicContact CB-CB 4.39Å; N470-N473 PolarHBondContact O-N 3.03Å; N470-N473 VanDerWaalsContact OD1-CB 3.26Å; N470-N473 WeakPolarHBondContact OD1-CB 3.4Å; N470-N473 PolarHBondContact OD1-N 3.35Å; N470-N473 VanDerWaalsContact OD1-N 3.14Å; N470-W474 WeakPolarHBondContact O-CB 3.37Å; N470-W474 PolarHBondContact O-N 3.04Å
471	P	96	Very high	92.6	Very high	4 Å²	4	57.5 Å²	57.5	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-41.9	-172.1	-29.6	38.5	0	0	0	113.6	F467 W474 L475 L495 E498 I499	F467-P471 HydrophobicContact CE1-CB 4.4Å; F467-P471 HydrophobicContact CE2-CB 4.12Å; F467-P471 HydrophobicContact CZ-CB 4.05Å; F467-P471 VanDerWaalsContact O-CA 3.29Å; F467-P471 WeakPolarHBondContact O-CA 3.49Å; F467-P471 WeakPolarHBondContact O-CD 3.23Å; F467-P471 WeakPolarHBondContact O-CG 3.44Å; F467-P471 VanDerWaalsContact O-N 3.07Å; P471-W474 PolarHBondContact O-N 3.47Å; P471-L475 WeakPolarHBondContact O-CB 3.48Å; P471-L475 VanDerWaalsContact O-CG 3.24Å; P471-L475 WeakPolarHBondContact O-CG 3.1Å; P471-L475 PolarHBondContact O-N 3.37Å; P471-L495 HydrophobicContact CB-CD1 3.89Å; P471-L495 HydrophobicContact CG-CD1 3.67Å; P471-E498 WeakPolarHBondContact CD-OE2 3.41Å; P471-E498 VanDerWaalsContact CG-OE2 3.23Å; P471-E498 WeakPolarHBondContact CG-OE2 3.39Å; P471-I499 HydrophobicContact CB-CG2 3.65Å
472	L	95.2	Very high	92.4	Very high	55 Å²	55	58.9 Å²	58.9	29%	0.288	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-50.5	-177.9	-169.2	85	0	0	0	111.7	N470 W474 L475 H476 A501 F502	N470-L472 PolarHBondContact O-N 3.26Å; L472-W474 VanDerWaalsContact C-N 3.33Å; L472-W474 PolarHBondContact O-N 3.03Å; L472-L475 PolarHBondContact O-N 3.46Å; L472-H476 PolarHBondContact O-CD2 3.2Å; L472-H476 VanDerWaalsContact O-CD2 3.23Å; L472-H476 PolarHBondContact O-N 3.21Å; L472-H476 VanDerWaalsContact O-N 3.1Å; L472-A501 HydrophobicContact CD1-CB 3.95Å; L472-F502 HydrophobicContact CD1-CB 3.92Å
473	N	95.1	Very high	92	Very high	103 Å²	103	63.3 Å²	63.3	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-66.6	-38.1	-179.7	-169.2	21.4	0	0	0	111.2	N470 H476 R477	N470-N473 HydrophobicContact CB-CB 4.39Å; N470-N473 PolarHBondContact O-N 3.03Å; N470-N473 VanDerWaalsContact OD1-CB 3.26Å; N470-N473 WeakPolarHBondContact OD1-CB 3.4Å; N470-N473 PolarHBondContact OD1-N 3.35Å; N470-N473 VanDerWaalsContact OD1-N 3.14Å; N473-H476 PolarHBondContact O-N 3.49Å; N473-R477 WeakPolarHBondContact O-CB 3.45Å; N473-R477 PolarHBondContact O-N 3.39Å
474	W	96	Very high	91.6	Very high	12 Å²	12	63.9 Å²	63.9	5%	0.045	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-46	175	-169	103.9	0	0	0	111.6	F425 L448 E463 F467 N470 P471 L472 R477 E478	F425-W474 HydrophobicContact CE1-CH2 4.5Å; F425-W474 HydrophobicContact CE1-CZ3 4.04Å; F425-W474 AromaticContact CZ-CH2 3.95Å; F425-W474 HydrophobicContact CZ-CH2 3.95Å; F425-W474 AromaticContact CZ-CZ3 3.93Å; F425-W474 HydrophobicContact CZ-CZ3 3.93Å; L448-W474 HydrophobicContact CD2-CH2 4.24Å; L448-W474 HydrophobicContact CD2-CZ2 4.4Å; E463-W474 HydrophobicContact CG-CZ2 3.97Å; F467-W474 HydrophobicContact CB-CD2 4.32Å; F467-W474 HydrophobicContact CB-CG 4.29Å; F467-W474 HydrophobicContact CD2-CB 4.15Å; F467-W474 AromaticContact CD2-CD2 3.67Å; F467-W474 HydrophobicContact CD2-CD2 3.67Å; F467-W474 AromaticContact CD2-CE3 3.52Å; F467-W474 HydrophobicContact CD2-CE3 3.52Å; F467-W474 AromaticContact CD2-CG 3.95Å; F467-W474 HydrophobicContact CD2-CG 3.95Å; F467-W474 HydrophobicContact CD2-CZ3 4.12Å; F467-W474 AromaticContact CE2-CE3 3.99Å; F467-W474 HydrophobicContact CE2-CE3 3.99Å; F467-W474 HydrophobicContact CE2-CZ3 4.46Å; N470-W474 WeakPolarHBondContact O-CB 3.37Å; N470-W474 PolarHBondContact O-N 3.04Å; P471-W474 PolarHBondContact O-N 3.47Å; L472-W474 VanDerWaalsContact C-N 3.33Å; L472-W474 PolarHBondContact O-N 3.03Å; W474-R477 VanDerWaalsContact CD1-NH2 3.3Å; W474-R477 PolarHBondContact O-N 3.21Å; W474-E478 HydrophobicContact CD2-CB 4.44Å; W474-E478 HydrophobicContact CE3-CB 3.85Å; W474-E478 HydrophobicContact CE3-CG 4.42Å; W474-E478 HydrophobicContact CH2-CB 3.97Å; W474-E478 HydrophobicContact CH2-CG 3.64Å; W474-E478 HydrophobicContact CZ2-CG 4.37Å; W474-E478 HydrophobicContact CZ3-CB 3.59Å; W474-E478 HydrophobicContact CZ3-CG 3.67Å; W474-E478 WeakPolarHBondContact O-CB 3.36Å; W474-E478 PolarHBondContact O-N 3.42Å
475	L	95.1	Very high	91.5	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.2	-42.8	179.7	-73.7	169.3	0	0	0	112.5	F425 M427 F467 P471 L472 R477 E478 F479 I499 F502	F425-L475 HydrophobicContact CE1-CD2 4.3Å; M427-L475 HydrophobicContact SD-CD1 4.32Å; M427-L475 HydrophobicContact SD-CD2 3.72Å; F467-L475 HydrophobicContact CE2-CD1 4.42Å; F467-L475 HydrophobicContact CE2-CD2 4.08Å; F467-L475 HydrophobicContact CE2-CG 4.01Å; P471-L475 WeakPolarHBondContact O-CB 3.48Å; P471-L475 VanDerWaalsContact O-CG 3.24Å; P471-L475 WeakPolarHBondContact O-CG 3.1Å; P471-L475 PolarHBondContact O-N 3.37Å; L472-L475 PolarHBondContact O-N 3.46Å; L475-R477 VanDerWaalsContact C-N 3.27Å; L475-R477 PolarHBondContact O-N 2.92Å; L475-E478 PolarHBondContact O-N 3.17Å; L475-F479 HydrophobicContact CD2-CD2 4.02Å; L475-F479 HydrophobicContact CD2-CE2 3.82Å; L475-F479 PolarHBondContact O-N 2.92Å; L475-I499 HydrophobicContact CD1-CB 3.94Å; L475-I499 HydrophobicContact CD1-CG2 3.58Å; L475-F502 HydrophobicContact CB-CD1 4.34Å; L475-F502 HydrophobicContact CB-CD2 3.81Å; L475-F502 HydrophobicContact CB-CE1 4.38Å; L475-F502 HydrophobicContact CB-CE2 3.87Å; L475-F502 HydrophobicContact CB-CG 4.05Å; L475-F502 HydrophobicContact CB-CZ 4.14Å; L475-F502 HydrophobicContact CD1-CB 4.31Å; L475-F502 HydrophobicContact CD1-CD1 3.77Å; L475-F502 HydrophobicContact CD1-CE1 4.19Å; L475-F502 HydrophobicContact CD1-CG 3.97Å; L475-F502 HydrophobicContact CD2-CE1 4.29Å; L475-F502 HydrophobicContact CD2-CZ 4.42Å; L475-F502 HydrophobicContact CG-CD1 4.49Å
476	H	92.9	Very high	91.6	Very high	80 Å²	80	62.8 Å²	62.8	37%	0.37	33%	0.331	S	S	.	.	H	α-helix	trans	-66.5	-29.3	175.8	-75.5	-55.3	0	0	0	113.1	L472 N473 H480 F502	L472-H476 PolarHBondContact O-CD2 3.2Å; L472-H476 VanDerWaalsContact O-CD2 3.23Å; L472-H476 PolarHBondContact O-N 3.21Å; L472-H476 VanDerWaalsContact O-N 3.1Å; N473-H476 PolarHBondContact O-N 3.49Å; H476-H480 PolarHBondContact O-CE1 2.65Å; H476-H480 PolarHBondContact O-ND1 3.13Å; H476-F502 AromaticContact CE1-CD2 3.79Å; H476-F502 AromaticContact ND1-CD2 3.91Å
477	R	92.9	Very high	91.6	Very high	133 Å²	133	61.8 Å²	61.8	50%	0.502	33%	0.325	S	S	.	.	H	α-helix	trans	-76.8	-37.6	174.1	-171.6	-176.2	66	-169	-2.3	112.7	N473 W474 L475 H480	N473-R477 WeakPolarHBondContact O-CB 3.45Å; N473-R477 PolarHBondContact O-N 3.39Å; W474-R477 VanDerWaalsContact CD1-NH2 3.3Å; W474-R477 PolarHBondContact O-N 3.21Å; L475-R477 VanDerWaalsContact C-N 3.27Å; L475-R477 PolarHBondContact O-N 2.92Å; R477-H480 VanDerWaalsContact CA-CE1 3.48Å; R477-H480 WeakPolarHBondContact CA-CE1 3.23Å; R477-H480 PolarHBondContact O-CD2 2.91Å; R477-H480 PolarHBondContact O-CE1 3.36Å; R477-H480 PolarHBondContact O-NE2 2.84Å
478	E	93.3	Very high	91.5	Very high	68 Å²	68	62.3 Å²	62.3	32%	0.318	33%	0.328	S	S	.	.	H	α-helix	trans	-75.7	-39.6	-179	-169.6	67.8	-172.7	0	0	111.4	R446 W474 L475	R446-E478 IonicContact CZ-OE1 3.2Å; R446-E478 IonicContact NH1-OE1 2.67Å; R446-E478 PolarHBondContact NH1-OE1 3.1Å; R446-E478 IonicContact NH2-OE1 2.84Å; R446-E478 PolarHBondContact NH2-OE1 3.33Å; W474-E478 HydrophobicContact CD2-CB 4.44Å; W474-E478 HydrophobicContact CE3-CB 3.85Å; W474-E478 HydrophobicContact CE3-CG 4.42Å; W474-E478 HydrophobicContact CH2-CB 3.97Å; W474-E478 HydrophobicContact CH2-CG 3.64Å; W474-E478 HydrophobicContact CZ2-CG 4.37Å; W474-E478 HydrophobicContact CZ3-CB 3.59Å; W474-E478 HydrophobicContact CZ3-CG 3.67Å; W474-E478 WeakPolarHBondContact O-CB 3.36Å; W474-E478 PolarHBondContact O-N 3.42Å; L475-E478 PolarHBondContact O-N 3.17Å
479	F	91.9	Very high	91.7	Very high	24 Å²	24	60.7 Å²	60.7	11%	0.105	32%	0.321	C	S	.	.			trans	-114	71.5	-174.3	-57.2	-66.7	0	0	0	111.5	F425 L475 S484 L485 P486 F502	F425-F479 AromaticContact CD1-CE2 3.99Å; F425-F479 HydrophobicContact CD1-CE2 3.99Å; F425-F479 AromaticContact CD1-CZ 3.88Å; F425-F479 HydrophobicContact CD1-CZ 3.88Å; F425-F479 AromaticContact CE1-CE2 3.93Å; F425-F479 HydrophobicContact CE1-CE2 3.93Å; F425-F479 HydrophobicContact CE1-CZ 4.05Å; F425-F479 HydrophobicContact CG-CZ 4.49Å; L475-F479 HydrophobicContact CD2-CD2 4.02Å; L475-F479 HydrophobicContact CD2-CE2 3.82Å; L475-F479 PolarHBondContact O-N 2.92Å; F479-S484 WeakPolarHBondContact CD1-O 3.33Å; F479-S484 WeakPolarHBondContact CE1-O 3.36Å; F479-L485 HydrophobicContact CB-CD2 3.59Å; F479-L485 HydrophobicContact CB-CG 4.24Å; F479-L485 HydrophobicContact CD1-CD2 4.33Å; F479-L485 HydrophobicContact CD2-CD2 4.35Å; F479-L485 HydrophobicContact CG-CD2 3.85Å; F479-P486 HydrophobicContact CZ-CG 4.32Å; F479-F502 HydrophobicContact CB-CE2 4.46Å; F479-F502 HydrophobicContact CB-CZ 4.38Å; F479-F502 AromaticContact CD2-CZ 3.96Å; F479-F502 HydrophobicContact CD2-CZ 3.96Å
480	H	83.6	Confident	91.8	Very high	145 Å²	145	54.8 Å²	54.8	67%	0.671	29%	0.29	S	S	*	.			trans	-72.6	-31.4	176.5	-69.2	-55.2	0	0	0	113.3	H476 R477	H476-H480 PolarHBondContact O-CE1 2.65Å; H476-H480 PolarHBondContact O-ND1 3.13Å; R477-H480 VanDerWaalsContact CA-CE1 3.48Å; R477-H480 WeakPolarHBondContact CA-CE1 3.23Å; R477-H480 PolarHBondContact O-CD2 2.91Å; R477-H480 PolarHBondContact O-CE1 3.36Å; R477-H480 PolarHBondContact O-NE2 2.84Å
481	D	84	Confident	91.9	Very high	113 Å²	113	50.8 Å²	50.8	60%	0.604	27%	0.269	S	S	*	.	S	Bend	trans	-113	141.1	-175.7	-68.7	-34.3	0	0	0	112.2	A483 S484	D481-A483 PolarHBondContact O-N 2.91Å; D481-S484 WeakPolarHBondContact O-CB 3.24Å; D481-S484 PolarHBondContact O-N 3.04Å; D481-S484 PolarHBondContact O-OG 3.2Å
482	D	80.9	Confident	92	Very high	119 Å²	119	50.8 Å²	50.8	64%	0.636	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.5	175.2	-85.9	-16.9	0	0	0	113.4	R533	D482-R533 PolarHBondContact O-NH1 3.32Å; D482-R533 PolarHBondContact O-NH2 2.94Å
483	A	81.8	Confident	92.1	Very high	100 Å²	100	49.1 Å²	49.1	83%	0.826	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-26.6	176.5	0	0	0	0	0	113.2	D481	D481-A483 PolarHBondContact O-N 2.91Å
484	S	85.4	Confident	92.1	Very high	56 Å²	56	48.2 Å²	48.2	39%	0.392	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-18.9	-179.1	69.9	0	0	0	0	113.3	F479 D481	F479-S484 WeakPolarHBondContact CD1-O 3.33Å; F479-S484 WeakPolarHBondContact CE1-O 3.36Å; D481-S484 WeakPolarHBondContact O-CB 3.24Å; D481-S484 PolarHBondContact O-N 3.04Å; D481-S484 PolarHBondContact O-OG 3.2Å
485	L	91.6	Very high	92.1	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	25%	0.254	C	S	.	.	S	Bend	trans	-66.2	131.3	-175.7	-79.6	174.2	0	0	0	112.1	F479 F502 Y508 R533	F479-L485 HydrophobicContact CB-CD2 3.59Å; F479-L485 HydrophobicContact CB-CG 4.24Å; F479-L485 HydrophobicContact CD1-CD2 4.33Å; F479-L485 HydrophobicContact CD2-CD2 4.35Å; F479-L485 HydrophobicContact CG-CD2 3.85Å; L485-F502 HydrophobicContact CD2-CE1 4.39Å; L485-F502 HydrophobicContact CD2-CE2 4.2Å; L485-F502 HydrophobicContact CD2-CZ 3.52Å; L485-Y508 HydrophobicContact CD2-CE2 4.38Å; L485-R533 VanDerWaalsContact CD1-NH1 3.31Å
486	P	93.7	Very high	92	Very high	7 Å²	7	50.3 Å²	50.3	5%	0.045	27%	0.266	C	S	.	.			trans	-68.1	148.8	177.9	29.3	-35.9	0	0	0	111.3	S423 F425 F479 H488 L489 Y508	S423-P486 VanDerWaalsContact OG-CA 3.3Å; S423-P486 WeakPolarHBondContact OG-CA 3.29Å; F425-P486 HydrophobicContact CB-CB 3.86Å; F425-P486 HydrophobicContact CB-CG 3.72Å; F479-P486 HydrophobicContact CZ-CG 4.32Å; P486-H488 VanDerWaalsContact C-N 3.33Å; P486-L489 HydrophobicContact CB-CD2 4.39Å; P486-L489 HydrophobicContact CG-CD2 3.33Å; P486-L489 HydrophobicContact CG-CG 4.23Å; P486-Y508 WeakPolarHBondContact O-CE1 3.41Å; P486-Y508 PolarHBondContact O-OH 3.18Å
487	T	93.3	Very high	92.1	Very high	27 Å²	27	54.6 Å²	54.6	17%	0.166	29%	0.286	C	S	.	.	S	Bend	trans	-71.8	-31.5	176.5	64.2	0	0	0	0	112.6	S421 A422 S423 R533	S421-T487 VanDerWaalsContact O-CG2 3.25Å; S421-T487 WeakPolarHBondContact O-CG2 3.36Å; A422-T487 WeakPolarHBondContact CA-OG1 3.4Å; S423-T487 PolarHBondContact N-OG1 2.94Å; S423-T487 PolarHBondContact O-N 3.06Å; S423-T487 PolarHBondContact O-OG1 2.95Å; S423-T487 VanDerWaalsContact O-OG1 3.07Å; S423-T487 PolarHBondContact OG-N 3.39Å; S423-T487 VanDerWaalsContact OG-N 3.12Å; T487-R533 PolarHBondContact O-N 2.78Å
488	H	95.3	Very high	92.1	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.056	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138.7	177.8	-61.6	66.2	0	0	0	111.7	S423 I424 F425 P486 Y531	S423-H488 PolarHBondContact O-N 3.3Å; I424-H488 HydrophobicContact CG1-CB 4.18Å; F425-H488 PolarHBondContact N-O 3.48Å; P486-H488 VanDerWaalsContact C-N 3.33Å; H488-Y531 CarbonylContact C-O 3.57Å; H488-Y531 VanDerWaalsContact CA-O 3.25Å; H488-Y531 WeakPolarHBondContact CA-O 3.34Å
489	L	97.1	Very high	92.3	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.4	172.5	-65.1	177.1	0	0	0	109.3	F425 M427 P486 F502 L503 Y508 V530 Y531	F425-L489 HydrophobicContact CB-CD2 3.95Å; F425-L489 HydrophobicContact CD1-CD2 3.97Å; F425-L489 HydrophobicContact CG-CD2 4.47Å; F425-L489 WeakPolarHBondContact O-CA 3.29Å; M427-L489 HydrophobicContact CE-CB 3.86Å; M427-L489 HydrophobicContact CE-CD1 4.04Å; M427-L489 HydrophobicContact CE-CD2 3.96Å; M427-L489 HydrophobicContact CE-CG 4.18Å; M427-L489 HydrophobicContact SD-CD2 4.1Å; P486-L489 HydrophobicContact CB-CD2 4.39Å; P486-L489 HydrophobicContact CG-CD2 3.33Å; P486-L489 HydrophobicContact CG-CG 4.23Å; L489-F502 HydrophobicContact CD1-CE1 4.17Å; L489-L503 HydrophobicContact CD1-CD2 3.68Å; L489-Y508 HydrophobicContact CD1-CD1 3.8Å; L489-Y508 HydrophobicContact CD1-CD2 3.82Å; L489-Y508 HydrophobicContact CD1-CE1 3.63Å; L489-Y508 HydrophobicContact CD1-CE2 3.65Å; L489-Y508 HydrophobicContact CD1-CG 3.9Å; L489-Y508 HydrophobicContact CG-CD1 4.05Å; L489-Y508 HydrophobicContact CG-CE1 3.61Å; L489-Y508 HydrophobicContact CG-CE2 4.44Å; L489-V530 WeakPolarHBondContact O-CA 3.25Å; L489-Y531 PolarHBondContact N-O 2.88Å; L489-Y531 PolarHBondContact O-N 3.29Å
490	I	97.9	Very high	92.4	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.3	177	-56.6	178	0	0	0	108.1	V405 I409 I424 F425 I426 M427 M428 V528 Y529 V530	V405-I490 HydrophobicContact CG2-CD1 3.89Å; V405-I490 HydrophobicContact CG2-CG1 4.44Å; V405-I490 HydrophobicContact CG2-CG2 3.86Å; I409-I490 HydrophobicContact CD1-CD1 3.48Å; I409-I490 VanDerWaalsContact CD1-CD1 3.48Å; I409-I490 HydrophobicContact CG1-CD1 3.77Å; I424-I490 HydrophobicContact CG2-CD1 3.64Å; I424-I490 HydrophobicContact CG2-CG1 4.12Å; F425-I490 PolarHBondContact O-N 3.11Å; I426-I490 HydrophobicContact CG1-CB 4.44Å; I426-I490 HydrophobicContact CG1-CD1 4.28Å; I426-I490 HydrophobicContact CG2-CB 4.48Å; M427-I490 PolarHBondContact N-O 3.3Å; M428-I490 HydrophobicContact SD-CG2 3.79Å; I490-V528 HydrophobicContact CG2-CG1 3.61Å; I490-Y529 WeakPolarHBondContact CA-O 3.31Å; I490-V530 HydrophobicContact CG1-CG1 4.48Å; I490-V530 HydrophobicContact CG1-CG2 4.36Å
491	T	97.4	Very high	93	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	157	-176.3	178.6	0	0	0	0	111.6	L495 V528 Y529 Y531	T491-L495 VanDerWaalsContact OG1-CB 3.29Å; T491-L495 WeakPolarHBondContact OG1-CB 3.43Å; T491-L495 VanDerWaalsContact OG1-CD2 3.31Å; T491-L495 WeakPolarHBondContact OG1-CD2 3.3Å; T491-V528 CarbonylContact O-C 3.6Å; T491-V528 WeakPolarHBondContact O-CA 3.44Å; T491-Y529 PolarHBondContact N-O 2.57Å; T491-Y529 PolarHBondContact O-N 2.8Å; T491-Y531 HydrophobicContact CG2-CD2 4.21Å; T491-Y531 HydrophobicContact CG2-CE2 3.67Å
492	F	97.8	Very high	93.5	Very high	3 Å²	3	41.8 Å²	41.8	1%	0.013	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	152.7	161.4	-80.5	-54.8	0	0	0	111.3	T402 M428 P429 I494 L495 H516 R523 I524 G525 H527 V528	T402-F492 HydrophobicContact CG2-CZ 4.12Å; M428-F492 HydrophobicContact CB-CD2 4.17Å; M428-F492 HydrophobicContact CB-CE2 4.23Å; M428-F492 HydrophobicContact CE-CD1 3.81Å; M428-F492 HydrophobicContact CE-CD2 3.74Å; M428-F492 HydrophobicContact CE-CE1 3.38Å; M428-F492 HydrophobicContact CE-CE2 3.33Å; M428-F492 HydrophobicContact CE-CG 3.97Å; M428-F492 HydrophobicContact CE-CZ 3.14Å; M428-F492 HydrophobicContact CG-CD2 4.17Å; M428-F492 HydrophobicContact CG-CE2 4.45Å; P429-F492 HydrophobicContact CG-CD2 4.47Å; P429-F492 HydrophobicContact CG-CE2 4.38Å; F492-I494 HydrophobicContact CB-CG2 4.27Å; F492-I494 PolarHBondContact O-N 2.85Å; F492-L495 PolarHBondContact O-N 3.25Å; F492-H516 HydrophobicContact CE1-CB 4.23Å; F492-H516 AromaticContact CE1-CD2 3.41Å; F492-H516 VanDerWaalsContact CE1-CD2 3.41Å; F492-H516 WeakPolarHBondContact CE1-CD2 3.39Å; F492-H516 AromaticContact CE1-CG 3.66Å; F492-H516 AromaticContact CE1-NE2 3.73Å; F492-H516 AromaticContact CZ-CD2 3.86Å; F492-H516 AromaticContact CZ-NE2 3.7Å; F492-R523 WeakPolarHBondContact CD2-O 3.49Å; F492-I524 HydrophobicContact CE1-CG2 4.2Å; F492-I524 HydrophobicContact CE2-CB 4.31Å; F492-I524 HydrophobicContact CE2-CG1 4.12Å; F492-I524 HydrophobicContact CE2-CG2 4.17Å; F492-I524 HydrophobicContact CZ-CG2 3.89Å; F492-G525 VanDerWaalsContact CG-N 3.35Å; F492-H527 CarbonylContact C-O 3.57Å; F492-H527 WeakPolarHBondContact CA-O 3.14Å; F492-V528 HydrophobicContact CD1-CG2 3.88Å; F492-V528 HydrophobicContact CE1-CG2 3.68Å
493	S	96.7	Very high	94.2	Very high	20 Å²	20	36.6 Å²	36.6	14%	0.14	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-59.3	-28.4	-177.7	61.6	0	0	0	0	114.3	L495 E496 S526 H527 Y529	S493-L495 PolarHBondContact O-N 3.34Å; S493-E496 PolarHBondContact O-N 2.91Å; S493-S526 PolarHBondContact OG-N 3.42Å; S493-S526 PolarHBondContact OG-OG 3.02Å; S493-H527 PolarHBondContact N-O 2.95Å; S493-H527 PolarHBondContact OG-N 3.35Å; S493-Y529 VanDerWaalsContact CA-CE2 3.44Å; S493-Y529 VanDerWaalsContact CB-CE2 3.44Å; S493-Y529 WeakPolarHBondContact CB-OH 3.2Å
494	I	95.8	Very high	94.8	Very high	85 Å²	85	38.2 Å²	38.2	44%	0.436	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-65.4	-26.4	-178.1	-164.7	158.1	0	0	0	113.2	F492 G522	F492-I494 HydrophobicContact CB-CG2 4.27Å; F492-I494 PolarHBondContact O-N 2.85Å; I494-G522 WeakPolarHBondContact CD1-O 3.43Å
495	L	95.5	Very high	95.1	Very high	3 Å²	3	39 Å²	39	2%	0.016	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-82	-17.1	-177.5	-168	65.5	0	0	0	112.8	M427 F467 Y468 P471 T491 F492 S493 E497 E498 I499	M427-L495 HydrophobicContact CB-CD2 4.13Å; F467-L495 HydrophobicContact CE1-CD1 4.29Å; F467-L495 HydrophobicContact CE1-CD2 3.77Å; F467-L495 HydrophobicContact CZ-CD2 3.71Å; Y468-L495 HydrophobicContact CD1-CD1 4.48Å; Y468-L495 HydrophobicContact CE1-CD1 4.19Å; P471-L495 HydrophobicContact CB-CD1 3.89Å; P471-L495 HydrophobicContact CG-CD1 3.67Å; T491-L495 VanDerWaalsContact OG1-CB 3.29Å; T491-L495 WeakPolarHBondContact OG1-CB 3.43Å; T491-L495 VanDerWaalsContact OG1-CD2 3.31Å; T491-L495 WeakPolarHBondContact OG1-CD2 3.3Å; F492-L495 PolarHBondContact O-N 3.25Å; S493-L495 PolarHBondContact O-N 3.34Å; L495-E497 VanDerWaalsContact C-N 3.29Å; L495-E497 PolarHBondContact O-N 3.01Å; L495-E498 HydrophobicContact CD1-CB 4.46Å; L495-E498 PolarHBondContact O-N 2.87Å; L495-E498 VanDerWaalsContact O-N 3.15Å; L495-I499 HydrophobicContact CD1-CG2 4.17Å; L495-I499 HydrophobicContact CD2-CD1 4.05Å; L495-I499 HydrophobicContact CD2-CG2 4.3Å; L495-I499 HydrophobicContact CG-CD1 4.13Å; L495-I499 HydrophobicContact CG-CG1 4.33Å; L495-I499 HydrophobicContact CG-CG2 3.91Å; L495-I499 WeakPolarHBondContact O-CG1 3.44Å; L495-I499 PolarHBondContact O-N 2.8Å
496	E	94.1	Very high	95.2	Very high	53 Å²	53	39.5 Å²	39.5	25%	0.248	22%	0.219	C	C	.	.	H	α-helix	trans	-56.2	-42.1	-170	178.2	169.2	-136.6	0	0	112.6	S493 S500 R510 Y529 Y531	S493-E496 PolarHBondContact O-N 2.91Å; E496-S500 WeakPolarHBondContact O-CA 3.41Å; E496-S500 WeakPolarHBondContact O-CB 3.46Å; E496-S500 PolarHBondContact O-N 3.16Å; E496-R510 IonicContact OE1-CZ 3.81Å; E496-R510 IonicContact OE1-NH1 2.78Å; E496-R510 PolarHBondContact OE1-NH1 2.89Å; E496-R510 IonicContact OE2-NH1 3.13Å; E496-R510 PolarHBondContact OE2-NH1 2.84Å; E496-R510 VanDerWaalsContact OE2-NH1 3.13Å; E496-Y529 HydrophobicContact CB-CD2 4.35Å; E496-Y529 HydrophobicContact CB-CE2 4.26Å; E496-Y529 WeakPolarHBondContact OE2-CE2 3.4Å; E496-Y531 WeakPolarHBondContact CG-OH 3.4Å; E496-Y531 PolarHBondContact OE1-OH 3.05Å
497	E	93.3	Very high	95.2	Very high	169 Å²	169	41.8 Å²	41.8	79%	0.79	23%	0.231	S	C	*	.	H	α-helix	trans	-63.1	-45	-179.3	-169.6	172.4	179.6	0	0	111.5	L495 I499 S500	L495-E497 VanDerWaalsContact C-N 3.29Å; L495-E497 PolarHBondContact O-N 3.01Å; E497-I499 PolarHBondContact O-N 3.46Å; E497-S500 PolarHBondContact O-OG 3.23Å
498	E	94.8	Very high	95.3	Very high	106 Å²	106	40.9 Å²	40.9	50%	0.495	23%	0.225	S	C	.	.	H	α-helix	trans	-69.2	-30.4	-176.2	-63.7	-176.8	-150.2	0	0	113.6	P471 L495	P471-E498 WeakPolarHBondContact CD-OE2 3.41Å; P471-E498 VanDerWaalsContact CG-OE2 3.23Å; P471-E498 WeakPolarHBondContact CG-OE2 3.39Å; L495-E498 HydrophobicContact CD1-CB 4.46Å; L495-E498 PolarHBondContact O-N 2.87Å; L495-E498 VanDerWaalsContact O-N 3.15Å
499	I	95.8	Very high	95.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-106.6	4.3	-177.6	70.2	172.5	0	0	0	113.5	M427 P471 L475 L495 E497 A501 F502 L503	M427-I499 HydrophobicContact CE-CD1 3.6Å; P471-I499 HydrophobicContact CB-CG2 3.65Å; L475-I499 HydrophobicContact CD1-CB 3.94Å; L475-I499 HydrophobicContact CD1-CG2 3.58Å; L495-I499 HydrophobicContact CD1-CG2 4.17Å; L495-I499 HydrophobicContact CD2-CD1 4.05Å; L495-I499 HydrophobicContact CD2-CG2 4.3Å; L495-I499 HydrophobicContact CG-CD1 4.13Å; L495-I499 HydrophobicContact CG-CG1 4.33Å; L495-I499 HydrophobicContact CG-CG2 3.91Å; L495-I499 WeakPolarHBondContact O-CG1 3.44Å; L495-I499 PolarHBondContact O-N 2.8Å; E497-I499 PolarHBondContact O-N 3.46Å; I499-A501 VanDerWaalsContact C-N 3.31Å; I499-A501 PolarHBondContact O-N 3.09Å; I499-F502 WeakPolarHBondContact O-CB 3.37Å; I499-F502 PolarHBondContact O-N 2.81Å; I499-L503 HydrophobicContact CD1-CD1 4.11Å; I499-L503 HydrophobicContact CD1-CD2 4.3Å; I499-L503 HydrophobicContact CD1-CG 4.22Å; I499-L503 HydrophobicContact CG1-CD1 3.88Å; I499-L503 HydrophobicContact CG1-CG 4.08Å; I499-L503 WeakPolarHBondContact O-CG 3.41Å; I499-L503 PolarHBondContact O-N 2.98Å
500	S	95.5	Very high	95.3	Very high	53 Å²	53	49.8 Å²	49.8	37%	0.371	26%	0.263	S	S	.	.	H	α-helix	trans	-53.2	-43.8	-175.6	57.5	0	0	0	0	113.3	E496 E497 F502 L503 I504	E496-S500 WeakPolarHBondContact O-CA 3.41Å; E496-S500 WeakPolarHBondContact O-CB 3.46Å; E496-S500 PolarHBondContact O-N 3.16Å; E497-S500 PolarHBondContact O-OG 3.23Å; S500-F502 VanDerWaalsContact C-N 3.33Å; S500-F502 PolarHBondContact O-N 3.11Å; S500-L503 PolarHBondContact O-N 3.25Å; S500-I504 WeakPolarHBondContact O-CG1 3.39Å; S500-I504 PolarHBondContact O-N 3.14Å
501	A	95.1	Very high	95.1	Very high	54 Å²	54	52.9 Å²	52.9	45%	0.446	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-37.3	177.7	0	0	0	0	0	112.7	L472 I499 S505	L472-A501 HydrophobicContact CD1-CB 3.95Å; I499-A501 VanDerWaalsContact C-N 3.31Å; I499-A501 PolarHBondContact O-N 3.09Å; A501-S505 WeakPolarHBondContact O-CB 3.25Å; A501-S505 PolarHBondContact O-N 2.99Å; A501-S505 PolarHBondContact O-OG 3Å
502	F	95.2	Very high	95.1	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-68.3	-43.3	174.9	176.3	-94.8	0	0	0	111.6	L472 L475 H476 F479 L485 L489 I499 S500 I504 S505 S506 Y508	L472-F502 HydrophobicContact CD1-CB 3.92Å; L475-F502 HydrophobicContact CB-CD1 4.34Å; L475-F502 HydrophobicContact CB-CD2 3.81Å; L475-F502 HydrophobicContact CB-CE1 4.38Å; L475-F502 HydrophobicContact CB-CE2 3.87Å; L475-F502 HydrophobicContact CB-CG 4.05Å; L475-F502 HydrophobicContact CB-CZ 4.14Å; L475-F502 HydrophobicContact CD1-CB 4.31Å; L475-F502 HydrophobicContact CD1-CD1 3.77Å; L475-F502 HydrophobicContact CD1-CE1 4.19Å; L475-F502 HydrophobicContact CD1-CG 3.97Å; L475-F502 HydrophobicContact CD2-CE1 4.29Å; L475-F502 HydrophobicContact CD2-CZ 4.42Å; L475-F502 HydrophobicContact CG-CD1 4.49Å; H476-F502 AromaticContact CE1-CD2 3.79Å; H476-F502 AromaticContact ND1-CD2 3.91Å; F479-F502 HydrophobicContact CB-CE2 4.46Å; F479-F502 HydrophobicContact CB-CZ 4.38Å; F479-F502 AromaticContact CD2-CZ 3.96Å; F479-F502 HydrophobicContact CD2-CZ 3.96Å; L485-F502 HydrophobicContact CD2-CE1 4.39Å; L485-F502 HydrophobicContact CD2-CE2 4.2Å; L485-F502 HydrophobicContact CD2-CZ 3.52Å; L489-F502 HydrophobicContact CD1-CE1 4.17Å; I499-F502 WeakPolarHBondContact O-CB 3.37Å; I499-F502 PolarHBondContact O-N 2.81Å; S500-F502 VanDerWaalsContact C-N 3.33Å; S500-F502 PolarHBondContact O-N 3.11Å; F502-I504 PolarHBondContact O-N 3.44Å; F502-S505 WeakPolarHBondContact CA-OG 3.29Å; F502-S505 PolarHBondContact O-N 3.08Å; F502-S505 PolarHBondContact O-OG 3.47Å; F502-S505 VanDerWaalsContact O-OG 3.08Å; F502-S506 VanDerWaalsContact O-CB 3.24Å; F502-S506 WeakPolarHBondContact O-CB 3.25Å; F502-S506 PolarHBondContact O-N 2.96Å; F502-S506 PolarHBondContact O-OG 3.33Å; F502-S506 VanDerWaalsContact O-OG 3.11Å; F502-Y508 HydrophobicContact CE1-CE2 4.16Å
503	L	95.6	Very high	95.1	Very high	9 Å²	9	57 Å²	57	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-44.1	178.3	-66.3	173.4	0	0	0	111.7	L489 I499 S500 N507 Y508 Y531	L489-L503 HydrophobicContact CD1-CD2 3.68Å; I499-L503 HydrophobicContact CD1-CD1 4.11Å; I499-L503 HydrophobicContact CD1-CD2 4.3Å; I499-L503 HydrophobicContact CD1-CG 4.22Å; I499-L503 HydrophobicContact CG1-CD1 3.88Å; I499-L503 HydrophobicContact CG1-CG 4.08Å; I499-L503 WeakPolarHBondContact O-CG 3.41Å; I499-L503 PolarHBondContact O-N 2.98Å; S500-L503 PolarHBondContact O-N 3.25Å; L503-N507 PolarHBondContact O-N 3.23Å; L503-Y508 HydrophobicContact CD2-CD2 4.26Å; L503-Y508 HydrophobicContact CD2-CG 4.16Å; L503-Y508 PolarHBondContact O-N 3.31Å; L503-Y531 HydrophobicContact CD1-CD1 4.11Å; L503-Y531 HydrophobicContact CD1-CE1 3.66Å; L503-Y531 HydrophobicContact CD1-CE2 4.22Å; L503-Y531 HydrophobicContact CD2-CD1 4.19Å; L503-Y531 HydrophobicContact CD2-CD2 4.43Å; L503-Y531 HydrophobicContact CD2-CG 4.15Å
504	I	94.1	Very high	95.2	Very high	135 Å²	135	58 Å²	58	69%	0.692	31%	0.311	S	S	*	.	H	α-helix	trans	-67.8	-50.3	179.1	-65.4	165.8	0	0	0	110.9	S500 F502 S506 N507	S500-I504 WeakPolarHBondContact O-CG1 3.39Å; S500-I504 PolarHBondContact O-N 3.14Å; F502-I504 PolarHBondContact O-N 3.44Å; I504-S506 VanDerWaalsContact C-N 3.25Å; I504-S506 PolarHBondContact O-N 3.43Å; I504-N507 PolarHBondContact O-N 3.23Å; I504-N507 VanDerWaalsContact O-N 3.16Å
505	S	92.3	Very high	95.3	Very high	72 Å²	72	57.1 Å²	57.1	50%	0.503	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-34.3	-178.2	53.9	0	0	0	0	112.6	A501 F502	A501-S505 WeakPolarHBondContact O-CB 3.25Å; A501-S505 PolarHBondContact O-N 2.99Å; A501-S505 PolarHBondContact O-OG 3Å; F502-S505 WeakPolarHBondContact CA-OG 3.29Å; F502-S505 PolarHBondContact O-N 3.08Å; F502-S505 PolarHBondContact O-OG 3.47Å; F502-S505 VanDerWaalsContact O-OG 3.08Å
506	S	92.5	Very high	95.4	Very high	17 Å²	17	57.2 Å²	57.2	12%	0.119	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	8.4	179.8	-54.7	0	0	0	0	114.1	F502 I504 Y508 R533	F502-S506 VanDerWaalsContact O-CB 3.24Å; F502-S506 WeakPolarHBondContact O-CB 3.25Å; F502-S506 PolarHBondContact O-N 2.96Å; F502-S506 PolarHBondContact O-OG 3.33Å; F502-S506 VanDerWaalsContact O-OG 3.11Å; I504-S506 VanDerWaalsContact C-N 3.25Å; I504-S506 PolarHBondContact O-N 3.43Å; S506-Y508 VanDerWaalsContact CB-CE2 3.45Å; S506-Y508 PolarHBondContact O-N 3.22Å; S506-R533 WeakPolarHBondContact O-CG 3.42Å
507	N	94.1	Very high	95.5	Very high	55 Å²	55	54.8 Å²	54.8	29%	0.294	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	42	175.2	-158.7	30.1	0	0	0	114.6	L503 I504 K534	L503-N507 PolarHBondContact O-N 3.23Å; I504-N507 PolarHBondContact O-N 3.23Å; I504-N507 VanDerWaalsContact O-N 3.16Å; N507-K534 WeakPolarHBondContact ND2-CB 3.39Å; N507-K534 PolarHBondContact ND2-O 3.13Å; N507-K534 PolarHBondContact O-N 2.9Å
508	Y	95.5	Very high	95.7	Very high	9 Å²	9	52.1 Å²	52.1	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.6	173.3	-75.4	-81.1	0	0	0	111.3	L485 P486 L489 F502 L503 S506 R533	L485-Y508 HydrophobicContact CD2-CE2 4.38Å; P486-Y508 WeakPolarHBondContact O-CE1 3.41Å; P486-Y508 PolarHBondContact O-OH 3.18Å; L489-Y508 HydrophobicContact CD1-CD1 3.8Å; L489-Y508 HydrophobicContact CD1-CD2 3.82Å; L489-Y508 HydrophobicContact CD1-CE1 3.63Å; L489-Y508 HydrophobicContact CD1-CE2 3.65Å; L489-Y508 HydrophobicContact CD1-CG 3.9Å; L489-Y508 HydrophobicContact CG-CD1 4.05Å; L489-Y508 HydrophobicContact CG-CE1 3.61Å; L489-Y508 HydrophobicContact CG-CE2 4.44Å; F502-Y508 HydrophobicContact CE1-CE2 4.16Å; L503-Y508 HydrophobicContact CD2-CD2 4.26Å; L503-Y508 HydrophobicContact CD2-CG 4.16Å; L503-Y508 PolarHBondContact O-N 3.31Å; S506-Y508 VanDerWaalsContact CB-CE2 3.45Å; S506-Y508 PolarHBondContact O-N 3.22Å; Y508-R533 HydrophobicContact CD1-CB 3.82Å; Y508-R533 HydrophobicContact CD1-CG 4.42Å; Y508-R533 HydrophobicContact CE1-CB 3.5Å; Y508-R533 HydrophobicContact CE1-CG 4.13Å; Y508-R533 HydrophobicContact CE2-CG 4.49Å
509	N	95.5	Very high	95.7	Very high	73 Å²	73	52.9 Å²	52.9	39%	0.39	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.3	172.5	-81.8	15	0	0	0	110.6	T511 Y531 E532 K534	N509-T511 PolarHBondContact O-N 3.47Å; N509-Y531 CarbonylContact O-C 3.55Å; N509-Y531 VanDerWaalsContact O-CA 3.25Å; N509-Y531 WeakPolarHBondContact O-CA 3.36Å; N509-E532 PolarHBondContact N-O 3.2Å; N509-E532 PolarHBondContact O-N 3.16Å; N509-K534 PolarHBondContact ND2-NZ 2.59Å
510	R	96.4	Very high	95.6	Very high	126 Å²	126	56.2 Å²	56.2	48%	0.475	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	121.3	174.2	-168.1	167	62.2	-159	3.3	110.1	E496 V513 V530 Y531	E496-R510 IonicContact OE1-CZ 3.81Å; E496-R510 IonicContact OE1-NH1 2.78Å; E496-R510 PolarHBondContact OE1-NH1 2.89Å; E496-R510 IonicContact OE2-NH1 3.13Å; E496-R510 PolarHBondContact OE2-NH1 2.84Å; E496-R510 VanDerWaalsContact OE2-NH1 3.13Å; R510-V513 HydrophobicContact CG-CG2 4.29Å; R510-V530 WeakPolarHBondContact CA-O 3.45Å; R510-Y531 HydrophobicContact CB-CD1 3.86Å; R510-Y531 HydrophobicContact CB-CE1 3.66Å; R510-Y531 HydrophobicContact CG-CE1 4.17Å
511	T	94.8	Very high	95.4	Very high	67 Å²	67	61.4 Å²	61.4	41%	0.411	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-26.1	-176.4	54.5	0	0	0	0	113.5	N509 V530 E532	N509-T511 PolarHBondContact O-N 3.47Å; T511-V530 PolarHBondContact N-O 3.26Å; T511-V530 PolarHBondContact OG1-O 3.42Å; T511-E532 HydrophobicContact CG2-CB 3.58Å
512	A	96.8	Very high	95.2	Very high	16 Å²	16	61.8 Å²	61.8	13%	0.132	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	152.9	176.3	0	0	0	0	0	112.5	F514 V530	A512-F514 HydrophobicContact CB-CE2 3.69Å; A512-F514 HydrophobicContact CB-CZ 3.79Å; A512-V530 HydrophobicContact CB-CB 4.06Å; A512-V530 HydrophobicContact CB-CG2 4.19Å; A512-V530 PolarHBondContact N-O 3.02Å; A512-V530 PolarHBondContact O-N 3.04Å
513	V	98	Very high	95.1	Very high	74 Å²	74	66.4 Å²	66.4	45%	0.448	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	128.8	177.6	176.7	0	0	0	0	108.5	R510 H527 Y529	R510-V513 HydrophobicContact CG-CG2 4.29Å; V513-H527 HydrophobicContact CG1-CB 4.17Å; V513-Y529 HydrophobicContact CB-CD1 4.22Å; V513-Y529 HydrophobicContact CB-CE1 4.39Å; V513-Y529 HydrophobicContact CG1-CD1 3.84Å; V513-Y529 HydrophobicContact CG1-CE1 3.63Å; V513-Y529 HydrophobicContact CG2-CD1 3.78Å; V513-Y529 HydrophobicContact CG2-CE1 4Å
514	F	98.1	Very high	95.1	Very high	41 Å²	41	68.9 Å²	68.9	18%	0.18	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.4	178.1	-56.6	-76.2	0	0	0	110	D404 V405 H408 A512 H516 H527 V528 V530	D404-F514 HydrophobicContact CB-CB 4.31Å; D404-F514 HydrophobicContact CB-CD1 3.73Å; D404-F514 HydrophobicContact CB-CE1 4.4Å; D404-F514 HydrophobicContact CB-CG 4.16Å; V405-F514 HydrophobicContact CB-CD2 4.01Å; V405-F514 HydrophobicContact CB-CE2 4.24Å; V405-F514 HydrophobicContact CG2-CD2 4.14Å; V405-F514 HydrophobicContact CG2-CE2 4.08Å; H408-F514 HydrophobicContact CB-CE2 4.06Å; H408-F514 HydrophobicContact CB-CZ 3.7Å; A512-F514 HydrophobicContact CB-CE2 3.69Å; A512-F514 HydrophobicContact CB-CZ 3.79Å; F514-H516 PolarHBondContact O-N 3.44Å; F514-H527 CarbonylContact O-C 3.48Å; F514-H527 WeakPolarHBondContact O-CA 3.44Å; F514-H527 WeakPolarHBondContact O-CB 3.21Å; F514-V528 HydrophobicContact CB-CB 4.39Å; F514-V528 PolarHBondContact N-O 2.78Å; F514-V528 PolarHBondContact O-N 3.15Å; F514-V530 HydrophobicContact CD2-CG2 4.31Å; F514-V530 HydrophobicContact CE2-CG2 3.79Å
515	F	98	Very high	95.1	Very high	66 Å²	66	62.5 Å²	62.5	29%	0.289	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	132	173.5	176.3	-94	0	0	0	110.4	V397 G401 T517 H518 H527	V397-F515 HydrophobicContact CG1-CE1 3.69Å; V397-F515 HydrophobicContact CG1-CZ 4.42Å; G401-F515 WeakPolarHBondContact CA-O 3.4Å; G401-F515 PolarHBondContact N-O 3.4Å; F515-T517 VanDerWaalsContact CZ-C 3.42Å; F515-H518 AromaticContact CE2-CD2 3.86Å; F515-H518 AromaticContact CE2-NE2 3.85Å; F515-H518 AromaticContact CZ-CD2 3.57Å; F515-H518 AromaticContact CZ-CE1 3.45Å; F515-H518 VanDerWaalsContact CZ-CE1 3.45Å; F515-H518 WeakPolarHBondContact CZ-CE1 3.41Å; F515-H518 AromaticContact CZ-CG 3.71Å; F515-H518 AromaticContact CZ-ND1 3.63Å; F515-H518 AromaticContact CZ-NE2 3.42Å; F515-H518 WeakPolarHBondContact CZ-NE2 3.37Å; F515-H527 AromaticContact CD2-NE2 3.75Å
516	H	97.4	Very high	95.3	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.019	32%	0.323	C	S	.	.			trans	-109.5	-58.1	179.4	-173.7	63.2	0	0	0	112.5	Q399 R400 T402 F492 F514 G525 S526 V528	Q399-H516 WeakPolarHBondContact CA-CE1 3.45Å; Q399-H516 WeakPolarHBondContact CA-O 3.27Å; Q399-H516 PolarHBondContact N-O 2.65Å; R400-H516 PolarHBondContact N-O 2.71Å; T402-H516 VanDerWaalsContact CG2-CE1 3.43Å; T402-H516 WeakPolarHBondContact CG2-CE1 3.47Å; F492-H516 HydrophobicContact CE1-CB 4.23Å; F492-H516 AromaticContact CE1-CD2 3.41Å; F492-H516 VanDerWaalsContact CE1-CD2 3.41Å; F492-H516 WeakPolarHBondContact CE1-CD2 3.39Å; F492-H516 AromaticContact CE1-CG 3.66Å; F492-H516 AromaticContact CE1-NE2 3.73Å; F492-H516 AromaticContact CZ-CD2 3.86Å; F492-H516 AromaticContact CZ-NE2 3.7Å; F514-H516 PolarHBondContact O-N 3.44Å; H516-G525 PolarHBondContact CD2-O 3.46Å; H516-S526 WeakPolarHBondContact CA-O 3.47Å; H516-S526 WeakPolarHBondContact CB-O 3.37Å; H516-S526 PolarHBondContact N-O 2.86Å; H516-V528 HydrophobicContact CB-CG2 4.29Å
517	T	96.8	Very high	95.6	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.012	33%	0.329	C	S	.	.			trans	-158.5	149	-173.5	-177.5	0	0	0	0	112	H398 F515 L519 I524 S526	H398-T517 PolarHBondContact CE1-OG1 2.82Å; H398-T517 PolarHBondContact ND1-OG1 2.78Å; F515-T517 VanDerWaalsContact CZ-C 3.42Å; T517-L519 VanDerWaalsContact C-N 3.27Å; T517-L519 WeakPolarHBondContact CG2-O 3.26Å; T517-L519 PolarHBondContact OG1-N 2.79Å; T517-L519 PolarHBondContact OG1-O 3.2Å; T517-I524 HydrophobicContact CG2-CG2 4.42Å; T517-S526 PolarHBondContact N-O 3.4Å; T517-S526 VanDerWaalsContact N-O 3.09Å; T517-S526 WeakPolarHBondContact O-CA 3.49Å; T517-S526 WeakPolarHBondContact O-CB 3.42Å
518	H	97.1	Very high	95.8	Very high	114 Å²	114	60.1 Å²	60.1	53%	0.528	32%	0.315	S	S	.	.	S	Bend	trans	-79.1	-13.8	168.2	-58.5	106.5	0	0	0	112.8	Y393 F515 P520	Y393-H518 AromaticContact CE2-CE1 3.93Å; Y393-H518 AromaticContact CE2-ND1 3.49Å; Y393-H518 WeakPolarHBondContact CE2-ND1 3.24Å; Y393-H518 AromaticContact CZ-ND1 3.68Å; Y393-H518 PolarHBondContact OH-ND1 3.34Å; F515-H518 AromaticContact CE2-CD2 3.86Å; F515-H518 AromaticContact CE2-NE2 3.85Å; F515-H518 AromaticContact CZ-CD2 3.57Å; F515-H518 AromaticContact CZ-CE1 3.45Å; F515-H518 VanDerWaalsContact CZ-CE1 3.45Å; F515-H518 WeakPolarHBondContact CZ-CE1 3.41Å; F515-H518 AromaticContact CZ-CG 3.71Å; F515-H518 AromaticContact CZ-ND1 3.63Å; F515-H518 AromaticContact CZ-NE2 3.42Å; F515-H518 WeakPolarHBondContact CZ-NE2 3.37Å; H518-P520 VanDerWaalsContact C-CD 3.42Å; H518-P520 VanDerWaalsContact O-CD 3.29Å; H518-P520 WeakPolarHBondContact O-CD 3.42Å
519	L	94.8	Very high	95.9	Very high	121 Å²	121	61.3 Å²	61.3	63%	0.634	32%	0.32	S	S	*	.	S	Bend	trans	-120	75.5	-175.8	-57.7	173.9	0	0	0	108.5	T517	T517-L519 VanDerWaalsContact C-N 3.27Å; T517-L519 WeakPolarHBondContact CG2-O 3.26Å; T517-L519 PolarHBondContact OG1-N 2.79Å; T517-L519 PolarHBondContact OG1-O 3.2Å
520	P	94.1	Very high	96	Very high	70 Å²	70	57.9 Å²	57.9	46%	0.455	30%	0.302	S	S	.	.			trans	-71	145.7	172.1	30.7	-34	0	0	0	110.3	H518 I524	H518-P520 VanDerWaalsContact C-CD 3.42Å; H518-P520 VanDerWaalsContact O-CD 3.29Å; H518-P520 WeakPolarHBondContact O-CD 3.42Å; P520-I524 WeakPolarHBondContact CA-O 3.47Å; P520-I524 WeakPolarHBondContact CB-O 3.41Å
521	E	91.4	Very high	96	Very high	163 Å²	163	52.2 Å²	52.2	76%	0.762	28%	0.281	S	S	*	.	B	Isolated β-bridge	trans	-148.9	134.1	-179.9	-173.1	176.4	-173.3	0	0	110.6	R523 I524	E521-R523 PolarHBondContact O-N 2.96Å; E521-R523 VanDerWaalsContact O-N 3.13Å; E521-I524 PolarHBondContact N-O 2.88Å; E521-I524 WeakPolarHBondContact O-CB 3.29Å; E521-I524 PolarHBondContact O-N 2.96Å
522	G	91.4	Very high	96	Very high	62 Å²	62	53.3 Å²	53.3	64%	0.639	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	-116.9	177.8	0	0	0	0	0	112.3	I494 I524	I494-G522 WeakPolarHBondContact CD1-O 3.43Å; G522-I524 VanDerWaalsContact C-N 3.32Å
523	R	92.9	Very high	95.8	Very high	98 Å²	98	54.5 Å²	54.5	37%	0.37	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-3.9	-179.4	-60	172.4	179.1	171.5	4.9	113.7	P429 D465 Y468 F492 E521	P429-R523 HydrophobicContact CG-CB 3.61Å; D465-R523 IonicContact OD1-CZ 3.2Å; D465-R523 IonicContact OD1-NH1 2.76Å; D465-R523 PolarHBondContact OD1-NH1 3.28Å; D465-R523 IonicContact OD1-NH2 2.71Å; D465-R523 PolarHBondContact OD1-NH2 3.45Å; Y468-R523 HydrophobicContact CD1-CG 4.07Å; Y468-R523 VanDerWaalsContact CD2-CD 3.46Å; Y468-R523 HydrophobicContact CD2-CG 4.3Å; Y468-R523 HydrophobicContact CE1-CB 4.22Å; Y468-R523 HydrophobicContact CE1-CG 4.2Å; Y468-R523 HydrophobicContact CE2-CG 4.44Å; Y468-R523 HydrophobicContact CG-CG 4.14Å; F492-R523 WeakPolarHBondContact CD2-O 3.49Å; E521-R523 PolarHBondContact O-N 2.96Å; E521-R523 VanDerWaalsContact O-N 3.13Å
524	I	94.1	Very high	95.3	Very high	62 Å²	62	56.7 Å²	56.7	32%	0.318	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-95.2	119	-177.3	-62	169.1	0	0	0	109.5	F492 T517 P520 E521 G522	F492-I524 HydrophobicContact CE1-CG2 4.2Å; F492-I524 HydrophobicContact CE2-CB 4.31Å; F492-I524 HydrophobicContact CE2-CG1 4.12Å; F492-I524 HydrophobicContact CE2-CG2 4.17Å; F492-I524 HydrophobicContact CZ-CG2 3.89Å; T517-I524 HydrophobicContact CG2-CG2 4.42Å; P520-I524 WeakPolarHBondContact CA-O 3.47Å; P520-I524 WeakPolarHBondContact CB-O 3.41Å; E521-I524 PolarHBondContact N-O 2.88Å; E521-I524 WeakPolarHBondContact O-CB 3.29Å; E521-I524 PolarHBondContact O-N 2.96Å; G522-I524 VanDerWaalsContact C-N 3.32Å
525	G	94.3	Very high	94.1	Very high	1 Å²	1	61 Å²	61	1%	0.01	31%	0.31	C	S	.	.			trans	-89.4	167.3	178.6	0	0	0	0	0	113.9	F492 H516 H527	F492-G525 VanDerWaalsContact CG-N 3.35Å; H516-G525 PolarHBondContact CD2-O 3.46Å; G525-H527 VanDerWaalsContact C-N 3.31Å
526	S	97.3	Very high	92.2	Very high	36 Å²	36	66 Å²	66	25%	0.252	33%	0.331	S	S	.	.	S	Bend	trans	-72.5	-26.3	178.4	60.1	0	0	0	0	112.9	S493 H516 T517	S493-S526 PolarHBondContact OG-N 3.42Å; S493-S526 PolarHBondContact OG-OG 3.02Å; H516-S526 WeakPolarHBondContact CA-O 3.47Å; H516-S526 WeakPolarHBondContact CB-O 3.37Å; H516-S526 PolarHBondContact N-O 2.86Å; T517-S526 PolarHBondContact N-O 3.4Å; T517-S526 VanDerWaalsContact N-O 3.09Å; T517-S526 WeakPolarHBondContact O-CA 3.49Å; T517-S526 WeakPolarHBondContact O-CB 3.42Å
527	H	98.3	Very high	89.7	Confident	57 Å²	57	68.7 Å²	68.7	26%	0.264	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	156.2	178.9	-61.8	73.7	0	0	0	111.1	F492 S493 V513 F514 F515 G525 Y529	F492-H527 CarbonylContact C-O 3.57Å; F492-H527 WeakPolarHBondContact CA-O 3.14Å; S493-H527 PolarHBondContact N-O 2.95Å; S493-H527 PolarHBondContact OG-N 3.35Å; V513-H527 HydrophobicContact CG1-CB 4.17Å; F514-H527 CarbonylContact O-C 3.48Å; F514-H527 WeakPolarHBondContact O-CA 3.44Å; F514-H527 WeakPolarHBondContact O-CB 3.21Å; F515-H527 AromaticContact CD2-NE2 3.75Å; G525-H527 VanDerWaalsContact C-N 3.31Å; H527-Y529 HydrophobicContact CB-CD1 4.12Å; H527-Y529 HydrophobicContact CB-CE1 3.53Å
528	V	98.4	Very high	86.9	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.6	166.9	-179	0	0	0	0	108.1	V405 M428 I490 T491 F492 F514 H516	V405-V528 HydrophobicContact CB-CG1 4.16Å; V405-V528 HydrophobicContact CG1-CG1 4.42Å; V405-V528 HydrophobicContact CG2-CG1 4.06Å; M428-V528 HydrophobicContact CE-CG1 4.39Å; M428-V528 HydrophobicContact CE-CG2 3.82Å; M428-V528 HydrophobicContact SD-CG1 4.18Å; I490-V528 HydrophobicContact CG2-CG1 3.61Å; T491-V528 CarbonylContact O-C 3.6Å; T491-V528 WeakPolarHBondContact O-CA 3.44Å; F492-V528 HydrophobicContact CD1-CG2 3.88Å; F492-V528 HydrophobicContact CE1-CG2 3.68Å; F514-V528 HydrophobicContact CB-CB 4.39Å; F514-V528 PolarHBondContact N-O 2.78Å; F514-V528 PolarHBondContact O-N 3.15Å; H516-V528 HydrophobicContact CB-CG2 4.29Å
529	Y	98.3	Very high	83.8	Confident	35 Å²	35	82.1 Å²	82.1	14%	0.137	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	140.7	177.1	-60.7	-23.4	0	0	0	110.5	I490 T491 S493 E496 V513 H527 Y531	I490-Y529 WeakPolarHBondContact CA-O 3.31Å; T491-Y529 PolarHBondContact N-O 2.57Å; T491-Y529 PolarHBondContact O-N 2.8Å; S493-Y529 VanDerWaalsContact CA-CE2 3.44Å; S493-Y529 VanDerWaalsContact CB-CE2 3.44Å; S493-Y529 WeakPolarHBondContact CB-OH 3.2Å; E496-Y529 HydrophobicContact CB-CD2 4.35Å; E496-Y529 HydrophobicContact CB-CE2 4.26Å; E496-Y529 WeakPolarHBondContact OE2-CE2 3.4Å; V513-Y529 HydrophobicContact CB-CD1 4.22Å; V513-Y529 HydrophobicContact CB-CE1 4.39Å; V513-Y529 HydrophobicContact CG1-CD1 3.84Å; V513-Y529 HydrophobicContact CG1-CE1 3.63Å; V513-Y529 HydrophobicContact CG2-CD1 3.78Å; V513-Y529 HydrophobicContact CG2-CE1 4Å; H527-Y529 HydrophobicContact CB-CD1 4.12Å; H527-Y529 HydrophobicContact CB-CE1 3.53Å; Y529-Y531 HydrophobicContact CD2-CE2 4.45Å; Y529-Y531 WeakPolarHBondContact CD2-OH 3.5Å
530	V	97.8	Very high	80.9	Confident	1 Å²	1	83.1 Å²	83.1	1%	0.006	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.7	171.2	-175	0	0	0	0	108.2	V405 L489 I490 R510 T511 A512 F514	V405-V530 HydrophobicContact CG2-CG2 3.72Å; L489-V530 WeakPolarHBondContact O-CA 3.25Å; I490-V530 HydrophobicContact CG1-CG1 4.48Å; I490-V530 HydrophobicContact CG1-CG2 4.36Å; R510-V530 WeakPolarHBondContact CA-O 3.45Å; T511-V530 PolarHBondContact N-O 3.26Å; T511-V530 PolarHBondContact OG1-O 3.42Å; A512-V530 HydrophobicContact CB-CB 4.06Å; A512-V530 HydrophobicContact CB-CG2 4.19Å; A512-V530 PolarHBondContact N-O 3.02Å; A512-V530 PolarHBondContact O-N 3.04Å; F514-V530 HydrophobicContact CD2-CG2 4.31Å; F514-V530 HydrophobicContact CE2-CG2 3.79Å
531	Y	96.8	Very high	78	Confident	7 Å²	7	86 Å²	86	3%	0.027	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.4	172.4	-58.2	-102.1	0	0	0	110.1	H488 L489 T491 E496 L503 N509 R510 Y529	H488-Y531 CarbonylContact C-O 3.57Å; H488-Y531 VanDerWaalsContact CA-O 3.25Å; H488-Y531 WeakPolarHBondContact CA-O 3.34Å; L489-Y531 PolarHBondContact N-O 2.88Å; L489-Y531 PolarHBondContact O-N 3.29Å; T491-Y531 HydrophobicContact CG2-CD2 4.21Å; T491-Y531 HydrophobicContact CG2-CE2 3.67Å; E496-Y531 WeakPolarHBondContact CG-OH 3.4Å; E496-Y531 PolarHBondContact OE1-OH 3.05Å; L503-Y531 HydrophobicContact CD1-CD1 4.11Å; L503-Y531 HydrophobicContact CD1-CE1 3.66Å; L503-Y531 HydrophobicContact CD1-CE2 4.22Å; L503-Y531 HydrophobicContact CD2-CD1 4.19Å; L503-Y531 HydrophobicContact CD2-CD2 4.43Å; L503-Y531 HydrophobicContact CD2-CG 4.15Å; N509-Y531 CarbonylContact O-C 3.55Å; N509-Y531 VanDerWaalsContact O-CA 3.25Å; N509-Y531 WeakPolarHBondContact O-CA 3.36Å; R510-Y531 HydrophobicContact CB-CD1 3.86Å; R510-Y531 HydrophobicContact CB-CE1 3.66Å; R510-Y531 HydrophobicContact CG-CE1 4.17Å; Y529-Y531 HydrophobicContact CD2-CE2 4.45Å; Y529-Y531 WeakPolarHBondContact CD2-OH 3.5Å
532	E	94.9	Very high	75.3	Confident	90 Å²	90	86 Å²	86	42%	0.421	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	134.3	175.5	-173.7	179.1	-177.7	0	0	109.4	N509 T511	N509-E532 PolarHBondContact N-O 3.2Å; N509-E532 PolarHBondContact O-N 3.16Å; T511-E532 HydrophobicContact CG2-CB 3.58Å
533	R	92.4	Very high	72.6	Confident	41 Å²	41	90.3 Å²	90.3	16%	0.155	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	123.6	177.1	-163.9	171.5	69.8	158.8	-8.6	110.2	D482 L485 T487 S506 Y508 L535	D482-R533 PolarHBondContact O-NH1 3.32Å; D482-R533 PolarHBondContact O-NH2 2.94Å; L485-R533 VanDerWaalsContact CD1-NH1 3.31Å; T487-R533 PolarHBondContact O-N 2.78Å; S506-R533 WeakPolarHBondContact O-CG 3.42Å; Y508-R533 HydrophobicContact CD1-CB 3.82Å; Y508-R533 HydrophobicContact CD1-CG 4.42Å; Y508-R533 HydrophobicContact CE1-CB 3.5Å; Y508-R533 HydrophobicContact CE1-CG 4.13Å; Y508-R533 HydrophobicContact CE2-CG 4.49Å; R533-L535 PolarHBondContact O-N 3.32Å
534	K	85.8	Confident	69.7	Low	120 Å²	120	92.2 Å²	92.2	52%	0.522	46%	0.46	S	S	.	.			trans	-79.8	112	165.6	-71.8	-173.3	179.5	-177	0	108.7	N507 N509 K536	N507-K534 WeakPolarHBondContact ND2-CB 3.39Å; N507-K534 PolarHBondContact ND2-O 3.13Å; N507-K534 PolarHBondContact O-N 2.9Å; N509-K534 PolarHBondContact ND2-NZ 2.59Å; K534-K536 PolarHBondContact O-N 2.78Å
535	L	74.3	Confident	67	Low	131 Å²	131	92.7 Å²	92.7	69%	0.686	47%	0.469	S	S	*	.			trans	-59.3	125	167.8	-67.3	173.5	0	0	0	107.8	R533 G537	R533-L535 PolarHBondContact O-N 3.32Å; L535-G537 PolarHBondContact O-N 2.77Å
536	K	58.4	Low	64.3	Low	170 Å²	170	100.1 Å²	100.1	74%	0.739	50%	0.503	S	S	*	.			trans	-57.1	107.8	168.7	-75.5	177	-179.5	168.1	0	106	K534 K538	K534-K536 PolarHBondContact O-N 2.78Å; K536-K538 PolarHBondContact O-N 3.46Å
537	G	44.2	Very low	61.6	Low	61 Å²	61	105.4 Å²	105.4	63%	0.629	53%	0.528	S	S	*	.			trans	-53.6	135.8	178.4	0	0	0	0	0	108.8	L535 F539	L535-G537 PolarHBondContact O-N 2.77Å; G537-F539 PolarHBondContact O-N 3Å
538	K	37.1	Very low	58.7	Low	204 Å²	204	107 Å²	107	89%	0.887	55%	0.546	S	S	*	.			trans	-37.7	119.2	145	-80.4	176.4	172.7	177.8	0	105.8	K536 N540	K536-K538 PolarHBondContact O-N 3.46Å; K538-N540 PolarHBondContact O-N 3.03Å
539	F	32.5	Very low	56	Low	195 Å²	195	115.5 Å²	115.5	86%	0.855	59%	0.585	S	S	*	*			trans	-38.6	120.3	170.5	-101.2	-96.2	0	0	0	107.3	G537 T541	G537-F539 PolarHBondContact O-N 3Å; F539-T541 PolarHBondContact O-N 2.89Å
540	N	33.5	Very low	53.6	Low	141 Å²	141	120.5 Å²	120.5	75%	0.754	61%	0.613	S	S	*	*			trans	-57.8	97.9	168.6	-104.6	-17	0	0	0	105.8	K538 K542	K538-N540 PolarHBondContact O-N 3.03Å; N540-K542 HydrophobicContact CB-CB 4.44Å; N540-K542 PolarHBondContact O-N 2.78Å
541	T	33.6	Very low	50.7	Low	132 Å²	132	131.7 Å²	131.7	81%	0.81	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	55.5	159.1	29.5	0	0	0	0	108.7	F539	F539-T541 PolarHBondContact O-N 2.89Å
542	K	35.6	Very low	48.4	Very low	162 Å²	162	137.9 Å²	137.9	70%	0.704	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	15	175.3	-119.5	-173.7	-179.3	-172	0	111.7	N540	N540-K542 HydrophobicContact CB-CB 4.44Å; N540-K542 PolarHBondContact O-N 2.78Å
543	M	34.4	Very low	45.9	Very low	153 Å²	153	140.4 Å²	140.4	75%	0.754	72%	0.72	S	S	*	*	S	Bend	trans	-127	14.2	172.5	-127.6	179.2	92.8	0	0	113.2
544	N	32.8	Very low	43.4	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	75%	0.751	S	S	*	*	S	Bend	trans	-118.6	3.9	170.5	-83.4	1.3	0	0	0	113.1
545	S	35.8	Very low	40.9	Very low	71 Å²	71	147.5 Å²	147.5	50%	0.497	77%	0.765	S	S	.	*	S	Bend	trans	-98.2	-4.9	173.5	58.8	0	0	0	0	113.7
546	E	38.4	Very low	38.8	Very low	157 Å²	157	148.5 Å²	148.5	73%	0.734	77%	0.77	S	S	*	*	S	Bend	trans	-102.8	4.1	175.5	-75.4	-178.4	169.1	0	0	113
547	L	40.1	Very low	37.5	Very low	148 Å²	148	147.1 Å²	147.1	78%	0.775	77%	0.772	S	S	*	*	S	Bend	trans	-112.9	8.5	173.4	-96.6	133.3	0	0	0	113.4
548	S	38.1	Very low	37	Very low	91 Å²	91	153.2 Å²	153.2	64%	0.636	78%	0.782	S	S	*	*	S	Bend	trans	-112	6.5	174.1	60.9	0	0	0	0	114.1
549	E	42.2	Very low	37	Very low	177 Å²	177	149.3 Å²	149.3	83%	0.827	77%	0.774	S	S	*	*	S	Bend	trans	-109.6	11.6	171.3	-83.7	-172.1	170.8	0	0	113.2
550	I	47.9	Very low	37.3	Very low	141 Å²	141	145.5 Å²	145.5	72%	0.723	77%	0.767	S	S	*	*			trans	-128.4	78	166.1	-51.9	176.4	0	0	0	107.9
551	N	35.7	Very low	37.7	Very low	235 Å²	235	145.9 Å²	145.9	100%	1.257	77%	0.769	S	S	*	*			trans	-168.2	0	148.8	-96.4	-20.3	0	0	0	110.3

Retrieved 551 of 551 residues in 293.7 ms (Link to these results)

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