A0A087YII6_POEFO Loading...

Choline/ethanolaminephosphotransferase 1

Catalyzes both phosphatidylcholine and phosphatidylethanolamine biosynthesis from CDP-choline and CDP-ethanolamine, respectively. Involved in protein-dependent process of phospholipid transport to distribute phosphatidyl choline to the lumenal surface. Has a higher cholinephosphotransferase activity than ethanolaminephosphotransferase activity.

AlphaFold DB , UniProt , Accession A0A087YII6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 423 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	34.5	Very low	30	Very low	245 Å²	245	133.4 Å²	133.4	100%	1.207	88%	0.882	S	S	*	*				0	115.1	0	-127.3	169.5	159.1	0	0	107.6
2	S	34.5	Very low	30	Very low	125 Å²	125	141.3 Å²	141.3	87%	0.874	88%	0.88	S	S	*	*			trans	53.5	129	171.1	-139.6	0	0	0	0	121.1
3	T	33.3	Very low	30.2	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	87%	0.874	S	S	*	*			trans	-72.7	145.6	-170.8	37.9	0	0	0	0	115.5
4	A	31.7	Very low	30.1	Very low	107 Å²	107	146.5 Å²	146.5	88%	0.884	87%	0.872	S	S	*	*			trans	-81.5	162.2	171.2	0	0	0	0	0	112.9
5	G	29	Very low	29.9	Very low	80 Å²	80	151.9 Å²	151.9	83%	0.825	87%	0.871	S	S	*	*			trans	144.5	70.5	152.1	0	0	0	0	0	116.7
6	Q	29.2	Very low	30	Very low	186 Å²	186	149.3 Å²	149.3	87%	0.869	87%	0.865	S	S	*	*			trans	-75.1	140.1	155.5	-87.9	-179.2	-23.5	0	0	109.9
7	Q	29.8	Very low	30.2	Very low	189 Å²	189	150.8 Å²	150.8	88%	0.883	87%	0.868	S	S	*	*				163.8	145	112.2	-90.1	-170.4	2.7	0	0	113.6
8	G	27	Very low	30.1	Very low	85 Å²	85	148.5 Å²	148.5	88%	0.876	87%	0.87	S	S	*	*			trans	94	127.8	154.3	0	0	0	0	0	114.6
9	G	26.1	Very low	30.1	Very low	83 Å²	83	153.2 Å²	153.2	86%	0.856	87%	0.871	S	S	*	*			cis	152.4	146.7	11.7	0	0	0	0	0	107.3
10	G	27.2	Very low	30.3	Very low	75 Å²	75	152.7 Å²	152.7	77%	0.773	87%	0.866	S	S	*	*			trans	129.2	96.7	162.9	0	0	0	0	0	117.3
11	L	27.7	Very low	30.2	Very low	156 Å²	156	155.2 Å²	155.2	82%	0.817	87%	0.868	S	S	*	*			trans	-17	151.4	150.7	-68.1	103.6	0	0	0	116.4
12	R	29.6	Very low	29.9	Very low	229 Å²	229	151 Å²	151	86%	0.864	85%	0.85	S	S	*	*			cis	-176.8	143	45.7	-141.8	164.5	-173	-176.6	1.4	110.6
13	T	32.4	Very low	29.6	Very low	131 Å²	131	153.7 Å²	153.7	80%	0.804	85%	0.848	S	S	*	*			trans	-77.7	139.6	172.7	-36.8	0	0	0	0	112.2
14	R	28.8	Very low	29.4	Very low	224 Å²	224	159.4 Å²	159.4	85%	0.845	86%	0.855	S	S	*	*				167.7	120.9	125	-102.4	-177.5	170.5	-178	-2.4	114
15	R	28.2	Very low	29.3	Very low	227 Å²	227	159.9 Å²	159.9	86%	0.857	85%	0.851	S	S	*	*				32.2	122.2	125.5	-78.2	-177.9	175	175.7	-1.4	119.3
16	S	31.4	Very low	29.3	Very low	110 Å²	110	158.8 Å²	158.8	77%	0.769	84%	0.841	S	S	*	*				51.7	102	126.5	160.3	0	0	0	0	117
17	L	32.8	Very low	29.4	Very low	175 Å²	175	159 Å²	159	92%	0.916	84%	0.844	S	S	*	*			trans	-175.8	103.5	144.8	-99.2	154	0	0	0	108.7
18	A	28	Very low	29.3	Very low	110 Å²	110	153.3 Å²	153.3	91%	0.909	84%	0.836	S	S	*	*			trans	-167.1	77.9	155.2	0	0	0	0	0	109.3
19	R	30	Very low	29.8	Very low	237 Å²	237	155.5 Å²	155.5	89%	0.894	83%	0.825	S	S	*	*			trans	-97.5	143.2	157.4	-150.3	-178.6	-159.1	-177.6	4.2	106
20	D	34.6	Very low	30.1	Very low	143 Å²	143	159.6 Å²	159.6	77%	0.765	82%	0.822	S	S	*	*			trans	65.9	100	172	-81.5	-30.2	0	0	0	118.8
21	K	29.3	Very low	30.5	Very low	206 Å²	206	159.4 Å²	159.4	90%	0.896	81%	0.813	S	S	*	*			trans	-169	81.6	133.8	-106.5	175.3	-175.3	-178.7	0	109.5
22	D	27.7	Very low	31.1	Very low	157 Å²	157	154.1 Å²	154.1	84%	0.84	79%	0.792	S	S	*	*			trans	-147.5	33.1	162.6	-109.1	-13.3	0	0	0	112.6
23	H	28.8	Very low	31.7	Very low	181 Å²	181	146 Å²	146	84%	0.838	77%	0.77	S	S	*	*			trans	-106.9	76.9	166.7	-95.1	-33.9	0	0	0	109.5
24	R	27.5	Very low	32.1	Very low	256 Å²	256	149.9 Å²	149.9	97%	0.966	77%	0.77	S	S	*	*	S	Bend	trans	-169.2	30.2	160.6	-109.3	167.6	-155.6	-138.4	7.2	116.9
25	S	31.2	Very low	32.6	Very low	117 Å²	117	144.9 Å²	144.9	82%	0.818	76%	0.759	S	S	*	*	S	Bend	trans	-128.3	9.2	167.2	76.5	0	0	0	0	115.5
26	G	28.7	Very low	33.2	Very low	58 Å²	58	137 Å²	137	60%	0.598	74%	0.739	S	S	*	*	S	Bend	trans	-90.6	-12.4	-175	0	0	0	0	0	116.8
27	M	29.9	Very low	33.9	Very low	189 Å²	189	136.7 Å²	136.7	93%	0.931	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	1.8	-166.8	-85.9	172.7	70	0	0	115.8
28	G	29	Very low	34.7	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-13.7	-178.4	0	0	0	0	0	115.7
29	M	37.3	Very low	35.7	Very low	131 Å²	131	131 Å²	131	65%	0.645	71%	0.705	S	S	*	*	S	Bend	trans	-128.3	8.1	-165.2	-151.8	146.7	67.3	0	0	114.5	A32	M29-A32 HydrophobicContact CG-CB 4.43Å
30	E	32.7	Very low	36.6	Very low	168 Å²	168	123.4 Å²	123.4	79%	0.785	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-75	-17.3	163.7	-73.1	-168.4	147.9	0	0	112.1	A32	E30-A32 VanDerWaalsContact C-N 3.28Å; E30-A32 PolarHBondContact O-N 2.82Å
31	A	35.2	Very low	37.7	Very low	71 Å²	71	122.9 Å²	122.9	59%	0.587	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-80.6	-1.4	179.8	0	0	0	0	0	114.3	C33 W34	A31-C33 VanDerWaalsContact C-N 3.27Å; A31-C33 PolarHBondContact O-N 3.11Å; A31-W34 VanDerWaalsContact O-CD1 3.3Å; A31-W34 PolarHBondContact O-NE1 3.42Å
32	A	39.8	Very low	39.1	Very low	46 Å²	46	123.1 Å²	123.1	38%	0.38	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-81	-4.7	-172.3	0	0	0	0	0	114.9	M29 E30 F410	M29-A32 HydrophobicContact CG-CB 4.43Å; E30-A32 VanDerWaalsContact C-N 3.28Å; E30-A32 PolarHBondContact O-N 2.82Å; A32-F410 HydrophobicContact CB-CD1 4.43Å; A32-F410 HydrophobicContact CB-CE1 3.69Å; A32-F410 HydrophobicContact CB-CZ 4.43Å
33	C	43.4	Very low	40.5	Very low	59 Å²	59	120.2 Å²	120.2	40%	0.399	65%	0.649	S	S	.	*			trans	-117.5	83.8	-165.2	-147.7	0	0	0	0	110	A31	A31-C33 VanDerWaalsContact C-N 3.27Å; A31-C33 PolarHBondContact O-N 3.11Å
34	W	40.3	Very low	42.2	Very low	211 Å²	211	113.3 Å²	113.3	80%	0.799	62%	0.618	S	S	*	*			trans	-115	89.4	177.4	-79	92.4	0	0	0	111.6	A31	A31-W34 VanDerWaalsContact O-CD1 3.3Å; A31-W34 PolarHBondContact O-NE1 3.42Å
35	L	39.1	Very low	43.9	Very low	119 Å²	119	105.7 Å²	105.7	62%	0.623	59%	0.593	S	S	*	*	S	Bend	trans	-140.8	107.8	140.2	-78.8	177.7	0	0	0	108.1	F412	L35-F412 HydrophobicContact CD1-CE2 3.86Å
36	S	41	Very low	45.5	Very low	61 Å²	61	102 Å²	102	43%	0.427	56%	0.564	S	S	.	*	S	Bend	trans	81.4	148.3	164.8	-81.8	0	0	0	0	122.5	L40	S36-L40 WeakPolarHBondContact OG-CD2 3.19Å
37	P	45.2	Very low	47.2	Very low	105 Å²	105	105.3 Å²	105.3	68%	0.682	58%	0.575	S	S	*	*			trans	-59.9	152.8	178.8	20.9	-29.5	0	0	0	112.7	V39 L40	P37-V39 PolarHBondContact O-N 3.04Å; P37-L40 PolarHBondContact O-N 2.91Å
38	G	51	Low	49.1	Very low	51 Å²	51	100.1 Å²	100.1	53%	0.526	56%	0.558	S	S	.	*	H	α-helix	trans	-54.2	-14.8	-161.3	0	0	0	0	0	118.6
39	V	48.9	Very low	51.5	Low	113 Å²	113	100.9 Å²	100.9	69%	0.685	55%	0.55	S	S	*	.	H	α-helix	trans	-78.4	-43.3	174.3	179.9	0	0	0	0	111.7	P37 R41 R42 L43	P37-V39 PolarHBondContact O-N 3.04Å; V39-R41 VanDerWaalsContact C-N 3.25Å; V39-R41 PolarHBondContact O-N 3.44Å; V39-R42 PolarHBondContact O-N 3.17Å; V39-L43 HydrophobicContact CG1-CD1 4.39Å; V39-L43 PolarHBondContact O-N 2.82Å
40	L	49	Very low	53.8	Low	78 Å²	78	96.3 Å²	96.3	41%	0.408	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-34.1	178.1	-153.9	80	0	0	0	110.9	S36 P37 L43 I44	S36-L40 WeakPolarHBondContact OG-CD2 3.19Å; P37-L40 PolarHBondContact O-N 2.91Å; L40-L43 PolarHBondContact O-N 3.43Å; L40-I44 HydrophobicContact CD2-CD1 4.04Å; L40-I44 HydrophobicContact CG-CD1 3.88Å; L40-I44 VanDerWaalsContact O-CG1 3.3Å; L40-I44 WeakPolarHBondContact O-CG1 3.32Å; L40-I44 PolarHBondContact O-N 3.35Å; L40-I44 VanDerWaalsContact O-N 3.13Å
41	R	57.4	Low	56.7	Low	132 Å²	132	88.6 Å²	88.6	50%	0.498	49%	0.494	S	S	.	.	H	α-helix	trans	-58.8	-48.4	174.3	-176.7	177.3	171.7	-174.9	-2.2	112.1	V39 L43 I44 E45	V39-R41 VanDerWaalsContact C-N 3.25Å; V39-R41 PolarHBondContact O-N 3.44Å; R41-L43 VanDerWaalsContact C-N 3.29Å; R41-L43 PolarHBondContact O-N 3.13Å; R41-I44 PolarHBondContact O-N 3.2Å; R41-E45 HydrophobicContact CG-CG 4.38Å; R41-E45 WeakPolarHBondContact CG-OE1 3.25Å; R41-E45 IonicContact CZ-OE1 2.62Å; R41-E45 IonicContact NE-OE1 2.79Å; R41-E45 PolarHBondContact NE-OE1 3.24Å; R41-E45 IonicContact NH2-OE1 3.5Å; R41-E45 PolarHBondContact NH2-OE1 2.9Å; R41-E45 WeakPolarHBondContact O-CG 3.47Å; R41-E45 PolarHBondContact O-N 3.02Å
42	R	58.1	Low	59.4	Low	211 Å²	211	87.8 Å²	87.8	80%	0.796	48%	0.484	S	S	*	.	H	α-helix	trans	-66	-30.4	177.9	-72.8	-173.7	-171.1	-175.5	3.5	113.2	V39 I44	V39-R42 PolarHBondContact O-N 3.17Å; R42-I44 VanDerWaalsContact C-N 3.34Å
43	L	57.8	Low	61.9	Low	96 Å²	96	96.1 Å²	96.1	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-72.4	-28.9	176.9	-71.7	169.2	0	0	0	112.4	V39 L40 R41 F390 R394	V39-L43 HydrophobicContact CG1-CD1 4.39Å; V39-L43 PolarHBondContact O-N 2.82Å; L40-L43 PolarHBondContact O-N 3.43Å; R41-L43 VanDerWaalsContact C-N 3.29Å; R41-L43 PolarHBondContact O-N 3.13Å; L43-F390 WeakPolarHBondContact O-CZ 3.46Å; L43-R394 PolarHBondContact O-NH1 2.61Å; L43-R394 VanDerWaalsContact O-NH1 3.09Å
44	I	63.9	Low	64.3	Low	36 Å²	36	98.4 Å²	98.4	19%	0.185	51%	0.51	C	S	.	.	H	α-helix	trans	-95.7	-24.7	-176	-63.2	168.6	0	0	0	112.6	L40 R41 R42 L46 R394 V397	L40-I44 HydrophobicContact CD2-CD1 4.04Å; L40-I44 HydrophobicContact CG-CD1 3.88Å; L40-I44 VanDerWaalsContact O-CG1 3.3Å; L40-I44 WeakPolarHBondContact O-CG1 3.32Å; L40-I44 PolarHBondContact O-N 3.35Å; L40-I44 VanDerWaalsContact O-N 3.13Å; R41-I44 PolarHBondContact O-N 3.2Å; R42-I44 VanDerWaalsContact C-N 3.34Å; I44-L46 PolarHBondContact O-N 3.46Å; I44-R394 HydrophobicContact CG2-CG 4.47Å; I44-R394 WeakPolarHBondContact O-CG 3.45Å; I44-R394 PolarHBondContact O-NE 3Å; I44-V397 HydrophobicContact CG2-CB 3.71Å; I44-V397 HydrophobicContact CG2-CG1 3.57Å; I44-V397 HydrophobicContact CG2-CG2 4.35Å
45	E	63.7	Low	66.9	Low	96 Å²	96	90 Å²	90	45%	0.449	48%	0.48	S	S	.	.	S	Bend	trans	-69.7	114.9	178.6	-80.9	176.8	178	0	0	111.8	R41 R394	R41-E45 HydrophobicContact CG-CG 4.38Å; R41-E45 WeakPolarHBondContact CG-OE1 3.25Å; R41-E45 IonicContact CZ-OE1 2.62Å; R41-E45 IonicContact NE-OE1 2.79Å; R41-E45 PolarHBondContact NE-OE1 3.24Å; R41-E45 IonicContact NH2-OE1 3.5Å; R41-E45 PolarHBondContact NH2-OE1 2.9Å; R41-E45 WeakPolarHBondContact O-CG 3.47Å; R41-E45 PolarHBondContact O-N 3.02Å; E45-R394 PolarHBondContact O-NH2 3.15Å
46	L	63.9	Low	69.5	Low	39 Å²	39	85.4 Å²	85.4	20%	0.204	46%	0.456	C	S	.	.			trans	-59.6	145	176.8	-78.5	162.9	0	0	0	112.1	I44 S48 P50 R394	I44-L46 PolarHBondContact O-N 3.46Å; L46-S48 VanDerWaalsContact CB-O 3.22Å; L46-S48 WeakPolarHBondContact CB-O 3.2Å; L46-S48 PolarHBondContact O-N 3.38Å; L46-P50 HydrophobicContact CD1-CB 4.22Å; L46-P50 HydrophobicContact CD1-CG 4.04Å; L46-R394 HydrophobicContact CD2-CG 4.19Å; L46-R394 HydrophobicContact CG-CG 4.09Å
47	P	64.6	Low	72	Confident	128 Å²	128	89 Å²	89	83%	0.831	46%	0.464	S	S	*	.	S	Bend	trans	-60.1	-30.6	179.5	-20	31.3	0	0	0	113.1
48	S	69.9	Low	74.3	Confident	81 Å²	81	88.1 Å²	88.1	57%	0.566	45%	0.446	S	S	*	.	S	Bend	trans	-123.9	147	172.3	54.7	0	0	0	0	109.7	L46 P50	L46-S48 VanDerWaalsContact CB-O 3.22Å; L46-S48 WeakPolarHBondContact CB-O 3.2Å; L46-S48 PolarHBondContact O-N 3.38Å; S48-P50 WeakPolarHBondContact O-CD 3.48Å
49	P	79.6	Confident	76.4	Confident	87 Å²	87	85.8 Å²	85.8	57%	0.565	42%	0.422	S	S	*	.			trans	-65.4	130	178.3	26.4	-33.3	0	0	0	110.4	L51 Q402	P49-L51 PolarHBondContact O-N 2.88Å; P49-Q402 VanDerWaalsContact CA-NE2 3.3Å
50	P	86.4	Confident	78.4	Confident	35 Å²	35	85 Å²	85	23%	0.227	41%	0.411	C	S	.	.	S	Bend	trans	-60.2	-28.1	176.7	19.4	-35.9	0	0	0	114.1	L46 S48 Y395 S398 V399 Q402	L46-P50 HydrophobicContact CD1-CB 4.22Å; L46-P50 HydrophobicContact CD1-CG 4.04Å; S48-P50 WeakPolarHBondContact O-CD 3.48Å; P50-Y395 HydrophobicContact CB-CD2 4.48Å; P50-Y395 HydrophobicContact CB-CE2 4.24Å; P50-S398 VanDerWaalsContact CD-OG 3.25Å; P50-S398 WeakPolarHBondContact CD-OG 3.45Å; P50-S398 WeakPolarHBondContact CG-OG 3.33Å; P50-V399 HydrophobicContact CB-CG2 3.74Å; P50-V399 HydrophobicContact CG-CG2 3.7Å; P50-Q402 VanDerWaalsContact CD-NE2 3.28Å
51	L	91.8	Very high	80.4	Confident	5 Å²	5	87.1 Å²	87.1	3%	0.026	42%	0.419	C	S	.	.	S	Bend	trans	-112.8	132.1	178.2	-57	-178.3	0	0	0	111.5	P49 L56 V344 V399 I403	P49-L51 PolarHBondContact O-N 2.88Å; L51-L56 HydrophobicContact CB-CD2 4.16Å; L51-L56 HydrophobicContact CB-CG 4.09Å; L51-L56 HydrophobicContact CD1-CD2 3.75Å; L51-V344 HydrophobicContact CD2-CG1 3.46Å; L51-V344 VanDerWaalsContact CD2-CG1 3.46Å; L51-V399 HydrophobicContact CD1-CG1 4.23Å; L51-I403 HydrophobicContact CD1-CD1 3.93Å; L51-I403 HydrophobicContact CD1-CG1 3.64Å
52	S	93.3	Very high	82.1	Confident	54 Å²	54	81.4 Å²	81.4	38%	0.378	40%	0.398	S	S	.	.			trans	-72.3	157.9	168.9	68.3	0	0	0	0	111.5	H54 Q55 L56	S52-H54 PolarHBondContact O-N 3.42Å; S52-H54 VanDerWaalsContact O-N 3.17Å; S52-Q55 PolarHBondContact O-N 3.35Å; S52-Q55 VanDerWaalsContact O-N 3.11Å; S52-Q55 WeakPolarHBondContact OG-CG 3.34Å; S52-Q55 PolarHBondContact OG-N 3.13Å; S52-Q55 PolarHBondContact OG-OE1 3.22Å; S52-L56 PolarHBondContact O-N 3.38Å
53	R	92.3	Very high	83.7	Confident	222 Å²	222	80.1 Å²	80.1	84%	0.838	39%	0.393	S	S	*	.	H	α-helix	trans	-56.5	-32.4	174	-68.1	-176.3	-179.4	176.7	-0.2	113	K57	R53-K57 WeakPolarHBondContact O-CG 3.22Å; R53-K57 PolarHBondContact O-N 2.82Å; R53-K57 VanDerWaalsContact O-N 3.14Å
54	H	93.1	Very high	85.3	Confident	106 Å²	106	80.7 Å²	80.7	49%	0.491	39%	0.389	S	S	.	.	H	α-helix	trans	-72.5	-40.1	178.4	173.4	-102.1	0	0	0	112	S52 K57 R58	S52-H54 PolarHBondContact O-N 3.42Å; S52-H54 VanDerWaalsContact O-N 3.17Å; H54-K57 PolarHBondContact O-N 3.04Å; H54-R58 PolarHBondContact CE1-NE 3.25Å; H54-R58 PolarHBondContact CE1-NH2 3.32Å; H54-R58 PolarHBondContact NE2-NE 2.62Å; H54-R58 PolarHBondContact NE2-NH2 3.17Å; H54-R58 PolarHBondContact O-N 3.14Å; H54-R58 VanDerWaalsContact O-N 3.08Å
55	Q	94.6	Very high	86.6	Confident	35 Å²	35	81.4 Å²	81.4	16%	0.164	40%	0.397	C	S	.	.	H	α-helix	trans	-62.7	-42.5	172.7	-77.6	167.8	-59	0	0	111.9	S52 K57 R58 L59 T348 S350	S52-Q55 PolarHBondContact O-N 3.35Å; S52-Q55 VanDerWaalsContact O-N 3.11Å; S52-Q55 WeakPolarHBondContact OG-CG 3.34Å; S52-Q55 PolarHBondContact OG-N 3.13Å; S52-Q55 PolarHBondContact OG-OE1 3.22Å; Q55-K57 PolarHBondContact O-N 3.04Å; Q55-R58 PolarHBondContact O-N 2.88Å; Q55-L59 PolarHBondContact O-N 3.22Å; Q55-T348 HydrophobicContact CB-CG2 3.97Å; Q55-T348 WeakPolarHBondContact O-CG2 3.37Å; Q55-S350 PolarHBondContact NE2-OG 3.26Å
56	L	94.6	Very high	88	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.12	39%	0.394	C	S	.	.	H	α-helix	trans	-58.3	-46.6	175.7	-75	175	0	0	0	111.8	L51 S52 R58 L59 E60 I403 H406	L51-L56 HydrophobicContact CB-CD2 4.16Å; L51-L56 HydrophobicContact CB-CG 4.09Å; L51-L56 HydrophobicContact CD1-CD2 3.75Å; S52-L56 PolarHBondContact O-N 3.38Å; L56-R58 PolarHBondContact O-N 3.34Å; L56-L59 WeakPolarHBondContact O-CB 3.31Å; L56-L59 PolarHBondContact O-N 3.47Å; L56-L59 VanDerWaalsContact O-N 3.12Å; L56-E60 PolarHBondContact O-N 2.95Å; L56-I403 HydrophobicContact CD2-CG1 4.29Å; L56-H406 VanDerWaalsContact C-NE2 3.29Å; L56-H406 HydrophobicContact CD1-CB 4.42Å; L56-H406 HydrophobicContact CD2-CB 4.03Å; L56-H406 PolarHBondContact O-NE2 3.03Å; L56-H406 VanDerWaalsContact O-NE2 3.15Å
57	K	93.8	Very high	89.3	Confident	137 Å²	137	79.7 Å²	79.7	60%	0.596	40%	0.402	S	S	*	.	H	α-helix	trans	-60.1	-43.3	174.5	-73.8	-176.5	176.9	-168.5	0	113.2	R53 H54 Q55 L59 E60	R53-K57 WeakPolarHBondContact O-CG 3.22Å; R53-K57 PolarHBondContact O-N 2.82Å; R53-K57 VanDerWaalsContact O-N 3.14Å; H54-K57 PolarHBondContact O-N 3.04Å; Q55-K57 PolarHBondContact O-N 3.04Å; K57-L59 PolarHBondContact O-N 2.71Å; K57-E60 WeakPolarHBondContact O-CB 3.46Å; K57-E60 PolarHBondContact O-N 3.03Å
58	R	93.5	Very high	90.4	Very high	85 Å²	85	76 Å²	76	32%	0.321	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-29.7	176.8	-74	-174.5	173.4	-169.2	-0.2	112.6	H54 Q55 L56 E60 E61 H62 T348 K349	H54-R58 PolarHBondContact CE1-NE 3.25Å; H54-R58 PolarHBondContact CE1-NH2 3.32Å; H54-R58 PolarHBondContact NE2-NE 2.62Å; H54-R58 PolarHBondContact NE2-NH2 3.17Å; H54-R58 PolarHBondContact O-N 3.14Å; H54-R58 VanDerWaalsContact O-N 3.08Å; Q55-R58 PolarHBondContact O-N 2.88Å; L56-R58 PolarHBondContact O-N 3.34Å; R58-E60 VanDerWaalsContact C-N 3.32Å; R58-E60 PolarHBondContact O-N 3.18Å; R58-E61 WeakPolarHBondContact O-CB 3.49Å; R58-E61 PolarHBondContact O-N 2.87Å; R58-H62 PolarHBondContact O-N 3.31Å; R58-T348 WeakPolarHBondContact CB-O 3.2Å; R58-T348 WeakPolarHBondContact CD-O 3.45Å; R58-K349 PolarHBondContact NH1-O 3.44Å
59	L	93.8	Very high	91.2	Very high	2 Å²	2	78.2 Å²	78.2	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-65	-34.1	175.6	-165	77.5	0	0	0	112.4	Q55 L56 K57 E61 H62 P156 M347 T348 I403	Q55-L59 PolarHBondContact O-N 3.22Å; L56-L59 WeakPolarHBondContact O-CB 3.31Å; L56-L59 PolarHBondContact O-N 3.47Å; L56-L59 VanDerWaalsContact O-N 3.12Å; K57-L59 PolarHBondContact O-N 2.71Å; L59-E61 PolarHBondContact O-N 2.99Å; L59-H62 WeakPolarHBondContact O-CB 3.47Å; L59-H62 PolarHBondContact O-N 2.87Å; L59-H62 VanDerWaalsContact O-N 3.07Å; L59-P156 HydrophobicContact CD1-CB 4.06Å; L59-P156 HydrophobicContact CD2-CB 4.33Å; L59-P156 HydrophobicContact CG-CB 3.87Å; L59-M347 HydrophobicContact CD1-CB 3.64Å; L59-M347 HydrophobicContact CD1-CE 4.44Å; L59-T348 HydrophobicContact CB-CG2 4.27Å; L59-T348 HydrophobicContact CD1-CG2 3.89Å; L59-I403 HydrophobicContact CD2-CB 4.15Å; L59-I403 HydrophobicContact CD2-CD1 3.74Å; L59-I403 HydrophobicContact CD2-CG1 3.63Å; L59-I403 HydrophobicContact CD2-CG2 3.49Å; L59-I403 VanDerWaalsContact CD2-CG2 3.49Å
60	E	91.5	Very high	91.8	Very high	97 Å²	97	74.1 Å²	74.1	45%	0.453	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-30.7	176.4	-61.8	179.8	159.8	0	0	112	L56 K57 R58 H62 R63 H406 L407	L56-E60 PolarHBondContact O-N 2.95Å; K57-E60 WeakPolarHBondContact O-CB 3.46Å; K57-E60 PolarHBondContact O-N 3.03Å; R58-E60 VanDerWaalsContact C-N 3.32Å; R58-E60 PolarHBondContact O-N 3.18Å; E60-H62 VanDerWaalsContact C-N 3.3Å; E60-R63 PolarHBondContact O-NH1 3.26Å; E60-H406 IonicContact OE1-CD2 2.63Å; E60-H406 IonicContact OE1-CE1 3.77Å; E60-H406 PolarHBondContact OE1-CE1 3.07Å; E60-H406 IonicContact OE1-NE2 2.64Å; E60-H406 PolarHBondContact OE1-NE2 2.89Å; E60-H406 VanDerWaalsContact OE1-NE2 3.07Å; E60-L407 HydrophobicContact CG-CD2 4.14Å
61	E	90.6	Very high	92.2	Very high	122 Å²	122	78.1 Å²	78.1	57%	0.57	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.2	176.7	-58.2	173.3	-176.9	0	0	112.8	R58 L59	R58-E61 WeakPolarHBondContact O-CB 3.49Å; R58-E61 PolarHBondContact O-N 2.87Å; L59-E61 PolarHBondContact O-N 2.99Å
62	H	93.9	Very high	92.3	Very high	13 Å²	13	80.7 Å²	80.7	6%	0.06	39%	0.394	C	S	.	.			trans	-64.1	138.5	-178.8	-176.4	60.6	0	0	0	111.2	R58 L59 E60 P156 E159 H346	R58-H62 PolarHBondContact O-N 3.31Å; L59-H62 WeakPolarHBondContact O-CB 3.47Å; L59-H62 PolarHBondContact O-N 2.87Å; L59-H62 VanDerWaalsContact O-N 3.07Å; E60-H62 VanDerWaalsContact C-N 3.3Å; H62-P156 HydrophobicContact CB-CG 4.41Å; H62-E159 IonicContact CD2-OE1 3.82Å; H62-E159 IonicContact CD2-OE2 3.94Å; H62-E159 PolarHBondContact CD2-OE2 2.87Å; H62-E159 IonicContact CE1-OE1 2.76Å; H62-E159 IonicContact NE2-OE1 2.59Å; H62-E159 PolarHBondContact NE2-OE1 3.49Å; H62-E159 IonicContact NE2-OE2 3.16Å; H62-E159 PolarHBondContact NE2-OE2 3.38Å; H62-H346 AromaticContact CE1-CE1 3.68Å
63	R	91.4	Very high	92.3	Very high	183 Å²	183	79.9 Å²	79.9	69%	0.691	38%	0.384	S	S	*	.			trans	-134.6	124.3	174.4	-65.1	-64.4	-179.6	-89.6	0.4	107.8	E60 S65	E60-R63 PolarHBondContact O-NH1 3.26Å; R63-S65 PolarHBondContact O-N 2.88Å
64	Y	91.2	Very high	92.3	Very high	108 Å²	108	72.6 Å²	72.6	42%	0.424	37%	0.366	S	S	.	.			trans	-57.4	133.5	175.2	-178	-108.9	0	0	0	110.3	S66 E159	Y64-S66 WeakPolarHBondContact CE1-OG 3.42Å; Y64-E159 HydrophobicContact CD2-CG 3.94Å; Y64-E159 WeakPolarHBondContact CD2-OE2 3.36Å; Y64-E159 HydrophobicContact CE2-CG 4.32Å
65	S	92.3	Very high	92.4	Very high	51 Å²	51	73 Å²	73	36%	0.357	37%	0.371	S	S	.	.			trans	-140	122	176.8	-176.2	0	0	0	0	109	R63 T213 L214	R63-S65 PolarHBondContact O-N 2.88Å; S65-T213 WeakPolarHBondContact O-CA 3.49Å; S65-T213 WeakPolarHBondContact OG-CG2 3.25Å; S65-T213 PolarHBondContact OG-OG1 3.35Å; S65-L214 PolarHBondContact O-N 2.87Å
66	S	91.9	Very high	92.5	Very high	56 Å²	56	72.4 Å²	72.4	39%	0.392	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153.3	174.4	67.5	0	0	0	0	111	Y64 L214	Y64-S66 WeakPolarHBondContact CE1-OG 3.42Å; S66-L214 CarbonylContact C-O 3.52Å; S66-L214 WeakPolarHBondContact CA-O 3.18Å
67	A	90.6	Very high	92.5	Very high	43 Å²	43	73.4 Å²	73.4	36%	0.355	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	151.3	179.5	0	0	0	0	0	111.8	T213 L214 R215 F216	A67-T213 HydrophobicContact CB-CG2 3.95Å; A67-L214 PolarHBondContact N-O 3.33Å; A67-R215 CarbonylContact O-C 3.57Å; A67-R215 WeakPolarHBondContact O-CA 3.42Å; A67-F216 PolarHBondContact O-N 3.45Å
68	G	88	Confident	92.6	Very high	52 Å²	52	76.2 Å²	76.2	54%	0.536	38%	0.38	S	S	.	.			trans	90.1	171	-174.9	0	0	0	0	0	112.4
69	H	87.3	Confident	92.8	Very high	126 Å²	126	75.4 Å²	75.4	58%	0.583	38%	0.377	S	S	*	.			trans	-147.6	143.9	171.8	56	-86.6	0	0	0	107.9
70	S	91.9	Very high	93	Very high	2 Å²	2	75.7 Å²	75.7	1%	0.014	38%	0.378	C	S	.	.			trans	-83.3	166.5	176.3	57.1	0	0	0	0	111.9	E73 P74 G217 E223	S70-E73 PolarHBondContact N-OE2 3.22Å; S70-E73 VanDerWaalsContact N-OE2 3.1Å; S70-E73 WeakPolarHBondContact OG-CB 3.43Å; S70-E73 PolarHBondContact OG-OE2 3.4Å; S70-E73 VanDerWaalsContact OG-OE2 3.04Å; S70-P74 WeakPolarHBondContact O-CD 3.42Å; S70-G217 WeakPolarHBondContact CA-O 3.11Å; S70-E223 WeakPolarHBondContact CB-OE1 3.43Å; S70-E223 WeakPolarHBondContact CB-OE2 3.08Å
71	L	94.6	Very high	93.3	Very high	119 Å²	119	76.7 Å²	76.7	62%	0.623	38%	0.383	S	S	*	.	S	Bend	trans	-62.3	-47	-169.9	177.9	66	0	0	0	113.9	I218 E223	L71-I218 HydrophobicContact CB-CG2 4.3Å; L71-I218 WeakPolarHBondContact CB-O 3.47Å; L71-I218 PolarHBondContact N-O 3.3Å; L71-E223 HydrophobicContact CB-CG 4.32Å; L71-E223 PolarHBondContact N-OE1 2.85Å
72	L	94.8	Very high	93.7	Very high	58 Å²	58	78 Å²	78	30%	0.304	38%	0.382	S	S	.	.	S	Bend	trans	-90.5	-15.9	-176.4	-65.7	179.7	0	0	0	112.3	L75 M76 T222 E223 I226	L72-L75 WeakPolarHBondContact O-CB 3.49Å; L72-L75 PolarHBondContact O-N 3.32Å; L72-M76 WeakPolarHBondContact O-CG 3.38Å; L72-M76 PolarHBondContact O-N 3.38Å; L72-T222 HydrophobicContact CB-CG2 4.33Å; L72-E223 HydrophobicContact CB-CG 4.36Å; L72-E223 WeakPolarHBondContact CB-OE1 3.44Å; L72-E223 HydrophobicContact CD1-CG 3.98Å; L72-E223 HydrophobicContact CG-CG 3.98Å; L72-E223 PolarHBondContact N-OE1 2.65Å; L72-I226 HydrophobicContact CB-CD1 4.39Å; L72-I226 HydrophobicContact CD1-CD1 3.61Å; L72-I226 HydrophobicContact CD1-CG2 4.41Å
73	E	91.9	Very high	93.9	Very high	37 Å²	37	78.8 Å²	78.8	17%	0.173	39%	0.387	C	S	.	.	H	α-helix	trans	-54.7	-49.6	-178.4	179.6	-169.9	150.3	0	0	112.9	S70 L75 M76 Q77 W80	S70-E73 PolarHBondContact N-OE2 3.22Å; S70-E73 VanDerWaalsContact N-OE2 3.1Å; S70-E73 WeakPolarHBondContact OG-CB 3.43Å; S70-E73 PolarHBondContact OG-OE2 3.4Å; S70-E73 VanDerWaalsContact OG-OE2 3.04Å; E73-L75 PolarHBondContact O-N 3Å; E73-L75 VanDerWaalsContact O-N 3.08Å; E73-M76 CarbonylContact O-C 3.6Å; E73-M76 PolarHBondContact O-N 2.77Å; E73-Q77 HydrophobicContact CG-CG 4.33Å; E73-Q77 VanDerWaalsContact O-CG 3.28Å; E73-Q77 WeakPolarHBondContact O-CG 3.24Å; E73-Q77 PolarHBondContact O-N 3.25Å; E73-Q77 PolarHBondContact OE1-NE2 3.48Å; E73-W80 HydrophobicContact CG-CH2 4.43Å; E73-W80 HydrophobicContact CG-CZ3 3.93Å
74	P	93.6	Very high	94.2	Very high	69 Å²	69	70.9 Å²	70.9	45%	0.448	36%	0.359	S	S	.	.	H	α-helix	trans	-55.6	-31	176.9	-27.1	34.6	0	0	0	114.6	S70	S70-P74 WeakPolarHBondContact O-CD 3.42Å
75	L	94.4	Very high	94.5	Very high	115 Å²	115	67.4 Å²	67.4	60%	0.602	36%	0.356	S	S	*	.	H	α-helix	trans	-75.6	-44.7	177	-166.8	148	0	0	0	110.5	L72 E73 Q77	L72-L75 WeakPolarHBondContact O-CB 3.49Å; L72-L75 PolarHBondContact O-N 3.32Å; E73-L75 PolarHBondContact O-N 3Å; E73-L75 VanDerWaalsContact O-N 3.08Å; L75-Q77 VanDerWaalsContact C-N 3.3Å; L75-Q77 PolarHBondContact O-N 2.94Å
76	M	96.1	Very high	94.7	Very high	23 Å²	23	70.6 Å²	70.6	11%	0.113	37%	0.365	C	S	.	.	H	α-helix	trans	-67.5	-27.4	177	-65.4	-60.2	-72.4	0	0	112.9	L72 E73 R78 Y79 W80 F135 T222 I226	L72-M76 WeakPolarHBondContact O-CG 3.38Å; L72-M76 PolarHBondContact O-N 3.38Å; E73-M76 CarbonylContact O-C 3.6Å; E73-M76 PolarHBondContact O-N 2.77Å; M76-R78 PolarHBondContact O-N 3.25Å; M76-Y79 HydrophobicContact CE-CD1 3.95Å; M76-Y79 HydrophobicContact CE-CE1 4.38Å; M76-Y79 WeakPolarHBondContact O-CA 3.41Å; M76-Y79 WeakPolarHBondContact O-CB 3.42Å; M76-Y79 PolarHBondContact O-N 3.12Å; M76-W80 HydrophobicContact CB-CD2 3.98Å; M76-W80 HydrophobicContact CB-CE3 4.05Å; M76-W80 HydrophobicContact CB-CH2 3.6Å; M76-W80 HydrophobicContact CB-CZ2 3.5Å; M76-W80 VanDerWaalsContact CB-CZ2 3.5Å; M76-W80 HydrophobicContact CB-CZ3 3.87Å; M76-W80 HydrophobicContact CE-CZ2 4.17Å; M76-W80 HydrophobicContact CG-CH2 4.39Å; M76-W80 HydrophobicContact CG-CZ2 4.14Å; M76-W80 PolarHBondContact O-N 2.98Å; M76-F135 HydrophobicContact CE-CE2 4.35Å; M76-T222 HydrophobicContact CG-CG2 4.17Å; M76-I226 HydrophobicContact CG-CD1 4.43Å; M76-I226 HydrophobicContact SD-CD1 4.38Å
77	Q	95.4	Very high	95	Very high	44 Å²	44	68.9 Å²	68.9	21%	0.206	35%	0.352	C	S	.	.	H	α-helix	trans	-54.4	-40.3	178.1	-74.1	-53.2	-15.5	0	0	112	E73 L75 Y79 W80 E81	E73-Q77 HydrophobicContact CG-CG 4.33Å; E73-Q77 VanDerWaalsContact O-CG 3.28Å; E73-Q77 WeakPolarHBondContact O-CG 3.24Å; E73-Q77 PolarHBondContact O-N 3.25Å; E73-Q77 PolarHBondContact OE1-NE2 3.48Å; L75-Q77 VanDerWaalsContact C-N 3.3Å; L75-Q77 PolarHBondContact O-N 2.94Å; Q77-Y79 VanDerWaalsContact C-N 3.31Å; Q77-Y79 PolarHBondContact O-N 3.15Å; Q77-W80 PolarHBondContact O-N 3.29Å; Q77-E81 WeakPolarHBondContact O-CB 3.44Å; Q77-E81 VanDerWaalsContact O-CG 3.26Å; Q77-E81 WeakPolarHBondContact O-CG 3.31Å; Q77-E81 PolarHBondContact O-N 3.03Å
78	R	96	Very high	95.2	Very high	196 Å²	196	69.5 Å²	69.5	74%	0.74	35%	0.353	S	S	*	.	H	α-helix	trans	-60.8	-42.4	177.7	-62.2	179.4	-173.4	165	2.6	112	M76 W82	M76-R78 PolarHBondContact O-N 3.25Å; R78-W82 PolarHBondContact O-N 3.49Å
79	Y	97.4	Very high	95.5	Very high	67 Å²	67	70.9 Å²	70.9	26%	0.263	35%	0.354	S	S	.	.	H	α-helix	trans	-68	-45.1	177.3	163.2	-111.1	0	0	0	111.2	M76 Q77 E81 W82 L83 F135 S139	M76-Y79 HydrophobicContact CE-CD1 3.95Å; M76-Y79 HydrophobicContact CE-CE1 4.38Å; M76-Y79 WeakPolarHBondContact O-CA 3.41Å; M76-Y79 WeakPolarHBondContact O-CB 3.42Å; M76-Y79 PolarHBondContact O-N 3.12Å; Q77-Y79 VanDerWaalsContact C-N 3.31Å; Q77-Y79 PolarHBondContact O-N 3.15Å; Y79-E81 PolarHBondContact O-N 2.91Å; Y79-W82 HydrophobicContact CD2-CE3 4.07Å; Y79-W82 HydrophobicContact CD2-CZ3 4.34Å; Y79-W82 HydrophobicContact CE2-CE3 4.14Å; Y79-W82 AromaticContact CE2-CZ3 3.98Å; Y79-W82 HydrophobicContact CE2-CZ3 3.98Å; Y79-W82 PolarHBondContact O-N 2.78Å; Y79-L83 HydrophobicContact CE1-CD2 4.3Å; Y79-L83 WeakPolarHBondContact O-CB 3.48Å; Y79-L83 PolarHBondContact O-N 3.25Å; Y79-F135 HydrophobicContact CE1-CE2 4.38Å; Y79-F135 AromaticContact CE1-CZ 3.81Å; Y79-F135 HydrophobicContact CE1-CZ 3.81Å; Y79-F135 AromaticContact CZ-CZ 3.69Å; Y79-F135 WeakPolarHBondContact OH-CE1 3.34Å; Y79-F135 WeakPolarHBondContact OH-CZ 3.43Å; Y79-S139 WeakPolarHBondContact CE1-OG 3.39Å; Y79-S139 PolarHBondContact OH-OG 3.07Å
80	W	98.1	Very high	95.8	Very high	9 Å²	9	73.6 Å²	73.6	3%	0.034	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-34.2	179.7	-61.4	-34.6	0	0	0	113.5	E73 M76 Q77 L83 V84 Q138 A142 I143 K146 T222	E73-W80 HydrophobicContact CG-CH2 4.43Å; E73-W80 HydrophobicContact CG-CZ3 3.93Å; M76-W80 HydrophobicContact CB-CD2 3.98Å; M76-W80 HydrophobicContact CB-CE3 4.05Å; M76-W80 HydrophobicContact CB-CH2 3.6Å; M76-W80 HydrophobicContact CB-CZ2 3.5Å; M76-W80 VanDerWaalsContact CB-CZ2 3.5Å; M76-W80 HydrophobicContact CB-CZ3 3.87Å; M76-W80 HydrophobicContact CE-CZ2 4.17Å; M76-W80 HydrophobicContact CG-CH2 4.39Å; M76-W80 HydrophobicContact CG-CZ2 4.14Å; M76-W80 PolarHBondContact O-N 2.98Å; Q77-W80 PolarHBondContact O-N 3.29Å; W80-L83 PolarHBondContact O-N 3.02Å; W80-V84 WeakPolarHBondContact O-CB 3.41Å; W80-V84 WeakPolarHBondContact O-CG1 3.34Å; W80-V84 PolarHBondContact O-N 3.44Å; W80-Q138 HydrophobicContact CZ2-CG 4.42Å; W80-A142 HydrophobicContact CD2-CB 3.46Å; W80-A142 VanDerWaalsContact CD2-CB 3.46Å; W80-A142 HydrophobicContact CE3-CB 3.86Å; W80-A142 HydrophobicContact CG-CB 3.89Å; W80-A142 HydrophobicContact CH2-CB 3.99Å; W80-A142 HydrophobicContact CZ2-CB 3.61Å; W80-A142 HydrophobicContact CZ3-CB 4.1Å; W80-I143 HydrophobicContact CB-CG2 3.9Å; W80-I143 HydrophobicContact CG-CG2 4.37Å; W80-I143 WeakPolarHBondContact O-CG2 3.48Å; W80-K146 HydrophobicContact CB-CD 4.15Å; W80-T222 HydrophobicContact CH2-CG2 4.1Å; W80-T222 HydrophobicContact CZ2-CG2 4.36Å
81	E	97.8	Very high	96	Very high	117 Å²	117	75.1 Å²	75.1	55%	0.547	37%	0.367	S	S	.	.	H	α-helix	trans	-65.9	-40.7	173	-76.6	173.7	-177	0	0	112.1	Q77 Y79 V84 G85	Q77-E81 WeakPolarHBondContact O-CB 3.44Å; Q77-E81 VanDerWaalsContact O-CG 3.26Å; Q77-E81 WeakPolarHBondContact O-CG 3.31Å; Q77-E81 PolarHBondContact O-N 3.03Å; Y79-E81 PolarHBondContact O-N 2.91Å; E81-V84 WeakPolarHBondContact O-CG1 3.45Å; E81-G85 PolarHBondContact O-N 3.43Å
82	W	98.1	Very high	96.1	Very high	150 Å²	150	69.6 Å²	69.6	57%	0.568	34%	0.339	S	S	*	.	H	α-helix	trans	-63.9	-46.2	171	168.7	82.4	0	0	0	111.4	R78 Y79 G85 Q86	R78-W82 PolarHBondContact O-N 3.49Å; Y79-W82 HydrophobicContact CD2-CE3 4.07Å; Y79-W82 HydrophobicContact CD2-CZ3 4.34Å; Y79-W82 HydrophobicContact CE2-CE3 4.14Å; Y79-W82 AromaticContact CE2-CZ3 3.98Å; Y79-W82 HydrophobicContact CE2-CZ3 3.98Å; Y79-W82 PolarHBondContact O-N 2.78Å; W82-G85 WeakPolarHBondContact O-CA 3.46Å; W82-G85 PolarHBondContact O-N 2.9Å; W82-G85 VanDerWaalsContact O-N 3.14Å; W82-Q86 HydrophobicContact CD2-CG 4.42Å; W82-Q86 HydrophobicContact CH2-CG 4.31Å; W82-Q86 HydrophobicContact CZ2-CG 3.96Å; W82-Q86 PolarHBondContact O-N 3.36Å
83	L	98.3	Very high	96.2	Very high	29 Å²	29	67.5 Å²	67.5	15%	0.152	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-47	-175.1	-179.1	63	0	0	0	112	Y79 W80 G85 Q86 V87 I143	Y79-L83 HydrophobicContact CE1-CD2 4.3Å; Y79-L83 WeakPolarHBondContact O-CB 3.48Å; Y79-L83 PolarHBondContact O-N 3.25Å; W80-L83 PolarHBondContact O-N 3.02Å; L83-G85 PolarHBondContact O-N 3.37Å; L83-Q86 WeakPolarHBondContact O-CB 3.29Å; L83-Q86 PolarHBondContact O-N 3.38Å; L83-V87 PolarHBondContact O-N 2.93Å; L83-I143 HydrophobicContact CB-CG2 4.28Å; L83-I143 HydrophobicContact CD2-CD1 3.88Å; L83-I143 HydrophobicContact CD2-CG2 4.03Å; L83-I143 HydrophobicContact CG-CD1 3.88Å; L83-I143 HydrophobicContact CG-CG2 4.27Å
84	V	98.3	Very high	96.5	Very high	17 Å²	17	66.3 Å²	66.3	10%	0.103	32%	0.323	C	S	.	.	H	α-helix	trans	-59.6	-32.4	175.8	72.2	0	0	0	0	110.8	W80 E81 Q86 V87 I143 K146 Q147 R150	W80-V84 WeakPolarHBondContact O-CB 3.41Å; W80-V84 WeakPolarHBondContact O-CG1 3.34Å; W80-V84 PolarHBondContact O-N 3.44Å; E81-V84 WeakPolarHBondContact O-CG1 3.45Å; V84-Q86 PolarHBondContact O-N 3.16Å; V84-V87 WeakPolarHBondContact O-CB 3.49Å; V84-V87 PolarHBondContact O-N 3.23Å; V84-V87 VanDerWaalsContact O-N 3.14Å; V84-I143 HydrophobicContact CB-CB 4.1Å; V84-I143 HydrophobicContact CB-CG2 4.2Å; V84-I143 HydrophobicContact CG2-CB 4.41Å; V84-K146 HydrophobicContact CB-CB 4.22Å; V84-K146 HydrophobicContact CG1-CB 4.26Å; V84-K146 HydrophobicContact CG2-CB 3.91Å; V84-Q147 HydrophobicContact CG2-CB 4Å; V84-R150 PolarHBondContact O-NH1 2.95Å
85	G	97.4	Very high	96.6	Very high	35 Å²	35	65.6 Å²	65.6	36%	0.361	32%	0.315	S	S	.	.	H	α-helix	trans	-58.3	-33.8	173.4	0	0	0	0	0	113.7	E81 W82 L83 R150	E81-G85 PolarHBondContact O-N 3.43Å; W82-G85 WeakPolarHBondContact O-CA 3.46Å; W82-G85 PolarHBondContact O-N 2.9Å; W82-G85 VanDerWaalsContact O-N 3.14Å; L83-G85 PolarHBondContact O-N 3.37Å; G85-R150 PolarHBondContact O-NH1 3.13Å; G85-R150 VanDerWaalsContact O-NH1 3.16Å
86	Q	97.6	Very high	96.8	Very high	119 Å²	119	60.5 Å²	60.5	56%	0.556	29%	0.289	S	S	*	.	H	α-helix	trans	-78.2	-18.3	178.5	-52.1	-49.7	-57.2	0	0	113.3	W82 L83 V84 P88	W82-Q86 HydrophobicContact CD2-CG 4.42Å; W82-Q86 HydrophobicContact CH2-CG 4.31Å; W82-Q86 HydrophobicContact CZ2-CG 3.96Å; W82-Q86 PolarHBondContact O-N 3.36Å; L83-Q86 WeakPolarHBondContact O-CB 3.29Å; L83-Q86 PolarHBondContact O-N 3.38Å; V84-Q86 PolarHBondContact O-N 3.16Å; Q86-P88 WeakPolarHBondContact O-CD 3.32Å
87	V	96.8	Very high	96.9	Very high	19 Å²	19	59.6 Å²	59.6	12%	0.115	28%	0.284	C	S	.	.	S	Bend	trans	-74.9	124.6	179.7	-177.2	0	0	0	0	109.9	L83 V84 I91 I96 I143 R150	L83-V87 PolarHBondContact O-N 2.93Å; V84-V87 WeakPolarHBondContact O-CB 3.49Å; V84-V87 PolarHBondContact O-N 3.23Å; V84-V87 VanDerWaalsContact O-N 3.14Å; V87-I91 HydrophobicContact CG1-CB 3.91Å; V87-I91 HydrophobicContact CG1-CD1 4.15Å; V87-I91 HydrophobicContact CG1-CG1 4.45Å; V87-I91 HydrophobicContact CG1-CG2 4.13Å; V87-I96 HydrophobicContact CG1-CD1 3.92Å; V87-I143 HydrophobicContact CG2-CD1 3.81Å; V87-R150 PolarHBondContact O-NH1 3.05Å
88	P	96.1	Very high	97	Very high	56 Å²	56	60.2 Å²	60.2	36%	0.364	29%	0.289	S	S	.	.			trans	-58.1	142.4	173.7	-24.5	32.8	0	0	0	112.7	Q86 W90 I91 Q147	Q86-P88 WeakPolarHBondContact O-CD 3.32Å; P88-W90 HydrophobicContact CB-CD2 4.41Å; P88-W90 HydrophobicContact CB-CG 4.32Å; P88-W90 HydrophobicContact CB-CZ2 4.35Å; P88-W90 HydrophobicContact CG-CZ2 4.44Å; P88-W90 PolarHBondContact O-N 3.49Å; P88-W90 VanDerWaalsContact O-N 3.11Å; P88-I91 HydrophobicContact CB-CD1 4.47Å; P88-I91 HydrophobicContact CB-CG1 4.3Å; P88-I91 HydrophobicContact CG-CD1 4.16Å; P88-I91 PolarHBondContact O-N 3.15Å; P88-I91 VanDerWaalsContact O-N 3.1Å; P88-Q147 PolarHBondContact O-NE2 3.33Å; P88-Q147 VanDerWaalsContact O-NE2 3.15Å
89	S	94.1	Very high	97.1	Very high	81 Å²	81	54.8 Å²	54.8	57%	0.566	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.3	-175.6	55.8	0	0	0	0	115.1	I414	S89-I414 VanDerWaalsContact O-CD1 3.3Å; S89-I414 WeakPolarHBondContact O-CD1 3.37Å
90	W	93.6	Very high	97.2	Very high	184 Å²	184	51.7 Å²	51.7	70%	0.697	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-12.1	177.1	59.3	-98.5	0	0	0	113.3	P88 A92	P88-W90 HydrophobicContact CB-CD2 4.41Å; P88-W90 HydrophobicContact CB-CG 4.32Å; P88-W90 HydrophobicContact CB-CZ2 4.35Å; P88-W90 HydrophobicContact CG-CZ2 4.44Å; P88-W90 PolarHBondContact O-N 3.49Å; P88-W90 VanDerWaalsContact O-N 3.11Å; W90-A92 PolarHBondContact O-N 3.22Å
91	I	95.7	Very high	97.2	Very high	33 Å²	33	51.9 Å²	51.9	17%	0.169	26%	0.263	C	S	.	.	S	Bend	trans	-76.1	120.3	177.1	-63.2	-170.7	0	0	0	109.1	V87 P88 L95 I96 Q147 I414	V87-I91 HydrophobicContact CG1-CB 3.91Å; V87-I91 HydrophobicContact CG1-CD1 4.15Å; V87-I91 HydrophobicContact CG1-CG1 4.45Å; V87-I91 HydrophobicContact CG1-CG2 4.13Å; P88-I91 HydrophobicContact CB-CD1 4.47Å; P88-I91 HydrophobicContact CB-CG1 4.3Å; P88-I91 HydrophobicContact CG-CD1 4.16Å; P88-I91 PolarHBondContact O-N 3.15Å; P88-I91 VanDerWaalsContact O-N 3.1Å; I91-L95 HydrophobicContact CG2-CD2 4.34Å; I91-I96 HydrophobicContact CG2-CD1 4.14Å; I91-I96 HydrophobicContact CG2-CG1 3.67Å; I91-Q147 PolarHBondContact O-NE2 2.86Å; I91-I414 VanDerWaalsContact O-CD1 3.25Å; I91-I414 WeakPolarHBondContact O-CD1 3.29Å
92	A	96.1	Very high	97.2	Very high	4 Å²	4	49 Å²	49	3%	0.033	26%	0.259	C	S	.	.			trans	-69.5	141.3	176.9	0	0	0	0	0	111.6	W90 N94 L95 I96 F412 I414	W90-A92 PolarHBondContact O-N 3.22Å; A92-N94 PolarHBondContact O-N 3.25Å; A92-L95 HydrophobicContact CB-CB 4.37Å; A92-L95 VanDerWaalsContact O-CB 3.31Å; A92-L95 WeakPolarHBondContact O-CB 3.21Å; A92-L95 PolarHBondContact O-N 3.27Å; A92-I96 PolarHBondContact O-N 2.73Å; A92-F412 VanDerWaalsContact CB-C 3.44Å; A92-I414 HydrophobicContact CB-CG1 4.14Å
93	P	97.3	Very high	97.3	Very high	13 Å²	13	43.5 Å²	43.5	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-51.2	-50.4	176.3	-30.3	37.2	0	0	0	113.4	L95 I96 T97 D144 Q147 A148	P93-L95 PolarHBondContact O-N 2.89Å; P93-L95 VanDerWaalsContact O-N 3.07Å; P93-I96 WeakPolarHBondContact O-CA 3.27Å; P93-I96 WeakPolarHBondContact O-CB 3.41Å; P93-I96 PolarHBondContact O-N 2.87Å; P93-T97 PolarHBondContact O-N 3.09Å; P93-T97 VanDerWaalsContact O-N 3.1Å; P93-T97 PolarHBondContact O-OG1 3.46Å; P93-D144 HydrophobicContact CB-CB 4.46Å; P93-D144 WeakPolarHBondContact CB-O 3.46Å; P93-Q147 HydrophobicContact CG-CB 4.49Å; P93-Q147 HydrophobicContact CG-CG 4.27Å; P93-A148 HydrophobicContact CB-CB 4.07Å; P93-A148 HydrophobicContact CG-CB 3.56Å
94	N	97.5	Very high	97.3	Very high	12 Å²	12	42.2 Å²	42.2	6%	0.064	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-22.7	-179.7	-56.8	-11.3	0	0	0	113.5	A92 I98 G158 F161 V411 F412	A92-N94 PolarHBondContact O-N 3.25Å; N94-I98 WeakPolarHBondContact O-CG2 3.46Å; N94-I98 PolarHBondContact O-N 3.13Å; N94-I98 VanDerWaalsContact O-N 3.09Å; N94-G158 WeakPolarHBondContact OD1-CA 3.22Å; N94-F161 HydrophobicContact CB-CD1 3.79Å; N94-F161 HydrophobicContact CB-CD2 4.41Å; N94-F161 HydrophobicContact CB-CE1 3.95Å; N94-F161 HydrophobicContact CB-CG 4.05Å; N94-F161 HydrophobicContact CB-CZ 4.33Å; N94-F161 VanDerWaalsContact O-CE1 3.29Å; N94-F161 WeakPolarHBondContact O-CE1 3.18Å; N94-V411 WeakPolarHBondContact CB-O 3.43Å; N94-V411 PolarHBondContact ND2-O 3.41Å; N94-F412 HydrophobicContact CB-CD1 4.12Å; N94-F412 HydrophobicContact CB-CE1 4.13Å
95	L	97.4	Very high	97.3	Very high	54 Å²	54	42.8 Å²	42.8	28%	0.283	24%	0.239	S	C	.	.	H	α-helix	trans	-72.3	-36.1	172.8	-179.8	60.7	0	0	0	110.8	I91 A92 P93 I98 I99 F412	I91-L95 HydrophobicContact CG2-CD2 4.34Å; A92-L95 HydrophobicContact CB-CB 4.37Å; A92-L95 VanDerWaalsContact O-CB 3.31Å; A92-L95 WeakPolarHBondContact O-CB 3.21Å; A92-L95 PolarHBondContact O-N 3.27Å; P93-L95 PolarHBondContact O-N 2.89Å; P93-L95 VanDerWaalsContact O-N 3.07Å; L95-I98 HydrophobicContact CD1-CG2 4.07Å; L95-I98 WeakPolarHBondContact O-CG2 3.19Å; L95-I99 HydrophobicContact CD1-CD1 3.93Å; L95-I99 HydrophobicContact CD1-CG1 4.22Å; L95-I99 HydrophobicContact CG-CD1 3.88Å; L95-I99 WeakPolarHBondContact O-CB 3.4Å; L95-I99 WeakPolarHBondContact O-CD1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.36Å; L95-I99 PolarHBondContact O-N 2.98Å; L95-I99 VanDerWaalsContact O-N 3.13Å; L95-F412 HydrophobicContact CB-CD1 4.46Å
96	I	98.1	Very high	97.3	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.046	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-50	173.8	-58.5	174	0	0	0	109.4	V87 I91 A92 P93 I98 I99 G100 L140 I143 D144 Q147	V87-I96 HydrophobicContact CG1-CD1 3.92Å; I91-I96 HydrophobicContact CG2-CD1 4.14Å; I91-I96 HydrophobicContact CG2-CG1 3.67Å; A92-I96 PolarHBondContact O-N 2.73Å; P93-I96 WeakPolarHBondContact O-CA 3.27Å; P93-I96 WeakPolarHBondContact O-CB 3.41Å; P93-I96 PolarHBondContact O-N 2.87Å; I96-I98 PolarHBondContact O-N 2.91Å; I96-I99 PolarHBondContact O-N 3.16Å; I96-G100 PolarHBondContact O-N 3.39Å; I96-L140 HydrophobicContact CG2-CB 3.71Å; I96-L140 HydrophobicContact CG2-CD2 3.99Å; I96-L140 HydrophobicContact CG2-CG 4.3Å; I96-L140 VanDerWaalsContact CG2-O 3.25Å; I96-L140 WeakPolarHBondContact CG2-O 3.35Å; I96-I143 HydrophobicContact CG2-CD1 4.25Å; I96-I143 HydrophobicContact CG2-CG1 4Å; I96-D144 HydrophobicContact CB-CB 4.3Å; I96-D144 HydrophobicContact CG2-CB 4.34Å; I96-Q147 HydrophobicContact CD1-CB 3.88Å; I96-Q147 HydrophobicContact CD1-CG 3.84Å
97	T	97.8	Very high	97.4	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-55.5	-50.3	178.4	-36.3	0	0	0	0	111.7	P93 I99 G100 L101 D144 F161 C165	P93-T97 PolarHBondContact O-N 3.09Å; P93-T97 VanDerWaalsContact O-N 3.1Å; P93-T97 PolarHBondContact O-OG1 3.46Å; T97-I99 PolarHBondContact O-N 3.3Å; T97-G100 PolarHBondContact O-N 3.36Å; T97-L101 PolarHBondContact O-N 2.98Å; T97-D144 PolarHBondContact OG1-OD2 3.23Å; T97-F161 HydrophobicContact CG2-CD1 3.97Å; T97-F161 HydrophobicContact CG2-CE1 4.22Å; T97-C165 HydrophobicContact CG2-CB 3.72Å
98	I	97.9	Very high	97.5	Very high	58 Å²	58	40.9 Å²	40.9	30%	0.297	22%	0.218	S	C	.	.	H	α-helix	trans	-69.3	-32.3	-176.8	-161.5	66.7	0	0	0	112.6	N94 L95 I96 L101 A102 F161 F412	N94-I98 WeakPolarHBondContact O-CG2 3.46Å; N94-I98 PolarHBondContact O-N 3.13Å; N94-I98 VanDerWaalsContact O-N 3.09Å; L95-I98 HydrophobicContact CD1-CG2 4.07Å; L95-I98 WeakPolarHBondContact O-CG2 3.19Å; I96-I98 PolarHBondContact O-N 2.91Å; I98-L101 HydrophobicContact CD1-CD2 4.12Å; I98-A102 WeakPolarHBondContact O-CB 3.14Å; I98-A102 PolarHBondContact O-N 3.47Å; I98-F161 HydrophobicContact CB-CE1 4.1Å; I98-F161 HydrophobicContact CB-CZ 4.12Å; I98-F161 HydrophobicContact CD1-CZ 4.16Å; I98-F161 HydrophobicContact CG1-CZ 4.5Å; I98-F412 HydrophobicContact CG2-CE1 4.17Å
99	I	98.4	Very high	97.6	Very high	82 Å²	82	42 Å²	42	42%	0.421	22%	0.22	S	C	.	.	H	α-helix	trans	-67.6	-42.2	173.7	-70.9	168.7	0	0	0	110.2	L95 I96 T97 A102 T103 L140	L95-I99 HydrophobicContact CD1-CD1 3.93Å; L95-I99 HydrophobicContact CD1-CG1 4.22Å; L95-I99 HydrophobicContact CG-CD1 3.88Å; L95-I99 WeakPolarHBondContact O-CB 3.4Å; L95-I99 WeakPolarHBondContact O-CD1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.36Å; L95-I99 PolarHBondContact O-N 2.98Å; L95-I99 VanDerWaalsContact O-N 3.13Å; I96-I99 PolarHBondContact O-N 3.16Å; T97-I99 PolarHBondContact O-N 3.3Å; I99-A102 PolarHBondContact O-N 3.11Å; I99-T103 WeakPolarHBondContact O-CB 3.17Å; I99-T103 PolarHBondContact O-N 3.19Å; I99-T103 PolarHBondContact O-OG1 3.33Å; I99-L140 HydrophobicContact CB-CD1 4.43Å; I99-L140 HydrophobicContact CG2-CD1 3.89Å
100	G	98.4	Very high	97.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-55.1	-58.3	171.9	0	0	0	0	0	110.7	I96 T97 A102 T103 N104 Y137	I96-G100 PolarHBondContact O-N 3.39Å; T97-G100 PolarHBondContact O-N 3.36Å; G100-A102 VanDerWaalsContact C-N 3.34Å; G100-A102 PolarHBondContact O-N 2.98Å; G100-T103 WeakPolarHBondContact O-CB 3.35Å; G100-T103 PolarHBondContact O-N 3.3Å; G100-N104 PolarHBondContact O-N 2.99Å; G100-Y137 VanDerWaalsContact C-CD2 3.46Å; G100-Y137 WeakPolarHBondContact O-CD2 3.35Å
101	L	98.4	Very high	98	Very high	13 Å²	13	30.4 Å²	30.4	7%	0.068	17%	0.167	C	C	.	.	H	α-helix	trans	-54.6	-48.8	179	177.6	64.7	0	0	0	111.8	T97 I98 T103 N104 V105 Y137 C165 L168	T97-L101 PolarHBondContact O-N 2.98Å; I98-L101 HydrophobicContact CD1-CD2 4.12Å; L101-T103 PolarHBondContact O-N 2.98Å; L101-N104 PolarHBondContact O-N 3.49Å; L101-N104 VanDerWaalsContact O-N 3.15Å; L101-V105 HydrophobicContact CD1-CG2 3.91Å; L101-V105 HydrophobicContact CG-CG2 4.13Å; L101-V105 WeakPolarHBondContact O-CB 3.33Å; L101-V105 VanDerWaalsContact O-CG2 3.23Å; L101-V105 WeakPolarHBondContact O-CG2 3.43Å; L101-V105 PolarHBondContact O-N 3.37Å; L101-Y137 HydrophobicContact CB-CE2 4.46Å; L101-C165 HydrophobicContact CB-CB 4.37Å; L101-C165 HydrophobicContact CD2-CB 3.98Å; L101-L168 HydrophobicContact CD1-CB 4.32Å; L101-L168 HydrophobicContact CD1-CG 4.29Å; L101-L168 HydrophobicContact CD2-CD2 4.02Å
102	A	98.7	Very high	98.2	Very high	56 Å²	56	30 Å²	30	46%	0.463	17%	0.165	S	C	.	.	H	α-helix	trans	-58.9	-37.3	179.4	0	0	0	0	0	112.2	I98 I99 G100 F106	I98-A102 WeakPolarHBondContact O-CB 3.14Å; I98-A102 PolarHBondContact O-N 3.47Å; I99-A102 PolarHBondContact O-N 3.11Å; G100-A102 VanDerWaalsContact C-N 3.34Å; G100-A102 PolarHBondContact O-N 2.98Å; A102-F106 WeakPolarHBondContact O-CB 3.36Å; A102-F106 PolarHBondContact O-N 3.38Å
103	T	98.6	Very high	98.3	Very high	36 Å²	36	38.3 Å²	38.3	22%	0.221	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-48.2	175.3	-56.5	0	0	0	0	111	I99 G100 L101 F106 T107 I136	I99-T103 WeakPolarHBondContact O-CB 3.17Å; I99-T103 PolarHBondContact O-N 3.19Å; I99-T103 PolarHBondContact O-OG1 3.33Å; G100-T103 WeakPolarHBondContact O-CB 3.35Å; G100-T103 PolarHBondContact O-N 3.3Å; L101-T103 PolarHBondContact O-N 2.98Å; T103-F106 PolarHBondContact O-N 2.82Å; T103-T107 WeakPolarHBondContact O-CB 3.5Å; T103-T107 VanDerWaalsContact O-CG2 3.29Å; T103-T107 WeakPolarHBondContact O-CG2 3.31Å; T103-T107 PolarHBondContact O-N 3.47Å; T103-T107 PolarHBondContact O-OG1 3.03Å; T103-I136 HydrophobicContact CG2-CB 4.3Å; T103-I136 HydrophobicContact CG2-CG2 4.12Å
104	N	98.5	Very high	98.4	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-43.7	178.7	-171.5	35	0	0	0	112.3	G100 L101 T107 T108 Y137 S169 V173	G100-N104 PolarHBondContact O-N 2.99Å; L101-N104 PolarHBondContact O-N 3.49Å; L101-N104 VanDerWaalsContact O-N 3.15Å; N104-T107 PolarHBondContact O-OG1 3.03Å; N104-T107 VanDerWaalsContact O-OG1 3.13Å; N104-T108 WeakPolarHBondContact O-CB 3.3Å; N104-T108 PolarHBondContact O-N 3.29Å; N104-T108 PolarHBondContact O-OG1 3.09Å; N104-Y137 HydrophobicContact CB-CD2 3.78Å; N104-Y137 HydrophobicContact CB-CG 4.03Å; N104-S169 PolarHBondContact ND2-O 3.22Å; N104-S169 PolarHBondContact ND2-OG 3.15Å; N104-V173 WeakPolarHBondContact ND2-CG2 3.27Å
105	V	98.7	Very high	98.4	Very high	30 Å²	30	41.5 Å²	41.5	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-52.8	176.7	171.3	0	0	0	0	110.5	L101 T107 T108 L109 F172	L101-V105 HydrophobicContact CD1-CG2 3.91Å; L101-V105 HydrophobicContact CG-CG2 4.13Å; L101-V105 WeakPolarHBondContact O-CB 3.33Å; L101-V105 VanDerWaalsContact O-CG2 3.23Å; L101-V105 WeakPolarHBondContact O-CG2 3.43Å; L101-V105 PolarHBondContact O-N 3.37Å; V105-T107 PolarHBondContact O-N 3.48Å; V105-T108 PolarHBondContact O-N 3.36Å; V105-L109 HydrophobicContact CG1-CD1 3.75Å; V105-L109 HydrophobicContact CG1-CG 4.23Å; V105-L109 WeakPolarHBondContact O-CB 3.5Å; V105-L109 VanDerWaalsContact O-CG 3.27Å; V105-L109 WeakPolarHBondContact O-CG 3.49Å; V105-L109 PolarHBondContact O-N 2.9Å; V105-F172 HydrophobicContact CB-CE1 4.49Å; V105-F172 HydrophobicContact CB-CE2 4.45Å; V105-F172 HydrophobicContact CB-CZ 4.41Å; V105-F172 HydrophobicContact CG1-CE1 3.95Å; V105-F172 HydrophobicContact CG1-CE2 4.3Å; V105-F172 HydrophobicContact CG1-CZ 3.83Å; V105-F172 HydrophobicContact CG2-CD2 3.69Å; V105-F172 HydrophobicContact CG2-CE1 4.46Å; V105-F172 HydrophobicContact CG2-CE2 3.61Å; V105-F172 HydrophobicContact CG2-CG 4.18Å; V105-F172 HydrophobicContact CG2-CZ 4.01Å
106	F	98.8	Very high	98.4	Very high	128 Å²	128	42 Å²	42	56%	0.561	21%	0.214	S	C	*	.	H	α-helix	trans	-58.5	-49.3	-178.1	172.5	-103.6	0	0	0	111.4	A102 T103 T108 L109 V110 M129	A102-F106 WeakPolarHBondContact O-CB 3.36Å; A102-F106 PolarHBondContact O-N 3.38Å; T103-F106 PolarHBondContact O-N 2.82Å; F106-T108 PolarHBondContact O-N 2.86Å; F106-L109 PolarHBondContact O-N 3.05Å; F106-V110 HydrophobicContact CE1-CG2 4.42Å; F106-V110 HydrophobicContact CE2-CG2 4.33Å; F106-V110 HydrophobicContact CZ-CG2 4.14Å; F106-V110 PolarHBondContact O-N 3.46Å; F106-V110 VanDerWaalsContact O-N 3.13Å; F106-M129 HydrophobicContact CE1-SD 4.06Å
107	T	98.6	Very high	98.4	Very high	5 Å²	5	43 Å²	43	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-41.6	-177.6	55.2	0	0	0	0	112	T103 N104 V105 V110 L111 M129 C130	T103-T107 WeakPolarHBondContact O-CB 3.5Å; T103-T107 VanDerWaalsContact O-CG2 3.29Å; T103-T107 WeakPolarHBondContact O-CG2 3.31Å; T103-T107 PolarHBondContact O-N 3.47Å; T103-T107 PolarHBondContact O-OG1 3.03Å; N104-T107 PolarHBondContact O-OG1 3.03Å; N104-T107 VanDerWaalsContact O-OG1 3.13Å; V105-T107 PolarHBondContact O-N 3.48Å; T107-V110 PolarHBondContact O-N 3.29Å; T107-L111 PolarHBondContact O-N 3.21Å; T107-M129 HydrophobicContact CG2-CE 3.94Å; T107-M129 HydrophobicContact CG2-CG 3.67Å; T107-M129 HydrophobicContact CG2-SD 4.08Å; T107-C130 PolarHBondContact O-SG 2.91Å
108	T	98.7	Very high	98.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-39.1	174.9	-57.6	0	0	0	0	112.5	N104 V105 F106 V110 L111 V112 F172	N104-T108 WeakPolarHBondContact O-CB 3.3Å; N104-T108 PolarHBondContact O-N 3.29Å; N104-T108 PolarHBondContact O-OG1 3.09Å; V105-T108 PolarHBondContact O-N 3.36Å; F106-T108 PolarHBondContact O-N 2.86Å; T108-V110 VanDerWaalsContact C-N 3.26Å; T108-V110 PolarHBondContact O-N 2.93Å; T108-L111 WeakPolarHBondContact O-CA 3.38Å; T108-L111 WeakPolarHBondContact O-CB 3.31Å; T108-L111 PolarHBondContact O-N 3Å; T108-V112 HydrophobicContact CG2-CG2 4.45Å; T108-V112 WeakPolarHBondContact O-CG2 3.31Å; T108-V112 PolarHBondContact O-N 3.42Å; T108-F172 HydrophobicContact CG2-CB 4Å; T108-F172 HydrophobicContact CG2-CD1 3.83Å; T108-F172 HydrophobicContact CG2-CG 4.43Å; T108-F172 WeakPolarHBondContact CG2-O 3.4Å
109	L	98.7	Very high	98.4	Very high	78 Å²	78	43 Å²	43	41%	0.408	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-31.4	177.9	-75	177.6	0	0	0	112.5	V105 F106 V112 Y113 F172	V105-L109 HydrophobicContact CG1-CD1 3.75Å; V105-L109 HydrophobicContact CG1-CG 4.23Å; V105-L109 WeakPolarHBondContact O-CB 3.5Å; V105-L109 VanDerWaalsContact O-CG 3.27Å; V105-L109 WeakPolarHBondContact O-CG 3.49Å; V105-L109 PolarHBondContact O-N 2.9Å; F106-L109 PolarHBondContact O-N 3.05Å; L109-V112 PolarHBondContact O-N 2.94Å; L109-Y113 WeakPolarHBondContact O-CB 3.37Å; L109-Y113 PolarHBondContact O-N 3.07Å; L109-F172 HydrophobicContact CD2-CE1 3.99Å; L109-F172 HydrophobicContact CG-CE1 4.1Å
110	V	98.7	Very high	98.4	Very high	23 Å²	23	41.7 Å²	41.7	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-41.4	170.5	172.4	0	0	0	0	111	F106 T107 T108 Y113 Y114 W125 A126 M129	F106-V110 HydrophobicContact CE1-CG2 4.42Å; F106-V110 HydrophobicContact CE2-CG2 4.33Å; F106-V110 HydrophobicContact CZ-CG2 4.14Å; F106-V110 PolarHBondContact O-N 3.46Å; F106-V110 VanDerWaalsContact O-N 3.13Å; T107-V110 PolarHBondContact O-N 3.29Å; T108-V110 VanDerWaalsContact C-N 3.26Å; T108-V110 PolarHBondContact O-N 2.93Å; V110-Y113 WeakPolarHBondContact O-CB 3.4Å; V110-Y113 PolarHBondContact O-N 3.12Å; V110-Y114 HydrophobicContact CG1-CD2 4Å; V110-Y114 HydrophobicContact CG1-CE2 3.88Å; V110-Y114 VanDerWaalsContact O-CD2 3.25Å; V110-Y114 WeakPolarHBondContact O-CD2 3.31Å; V110-Y114 PolarHBondContact O-N 2.94Å; V110-W125 HydrophobicContact CG1-CH2 3.6Å; V110-W125 HydrophobicContact CG1-CZ3 3.87Å; V110-A126 HydrophobicContact CG1-CB 4.27Å; V110-M129 HydrophobicContact CB-CE 3.46Å; V110-M129 VanDerWaalsContact CB-CE 3.46Å; V110-M129 HydrophobicContact CG1-CE 3.64Å; V110-M129 HydrophobicContact CG2-CE 3.67Å
111	L	98	Very high	98.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-43.3	172.1	-78	-176	0	0	0	112.1	T107 T108 Y113 Y114 C115 A122 A126 Y127 C130 I179 Y232	T107-L111 PolarHBondContact O-N 3.21Å; T108-L111 WeakPolarHBondContact O-CA 3.38Å; T108-L111 WeakPolarHBondContact O-CB 3.31Å; T108-L111 PolarHBondContact O-N 3Å; L111-Y113 VanDerWaalsContact C-N 3.27Å; L111-Y113 PolarHBondContact O-N 3.44Å; L111-Y114 PolarHBondContact O-N 3.09Å; L111-C115 WeakPolarHBondContact O-CB 3.38Å; L111-C115 PolarHBondContact O-N 2.74Å; L111-A122 HydrophobicContact CD2-CB 3.64Å; L111-A126 HydrophobicContact CD2-CB 3.91Å; L111-Y127 HydrophobicContact CD1-CD1 4.46Å; L111-Y127 HydrophobicContact CD2-CD1 3.76Å; L111-Y127 HydrophobicContact CD2-CE1 3.79Å; L111-C130 HydrophobicContact CD1-CB 4.12Å; L111-C130 WeakPolarHBondContact CD1-SG 3.47Å; L111-C130 VanDerWaalsContact CG-SG 3.56Å; L111-I179 HydrophobicContact CB-CD1 4.24Å; L111-I179 HydrophobicContact CB-CG2 4.15Å; L111-I179 HydrophobicContact CD1-CG2 4.45Å; L111-Y232 HydrophobicContact CD1-CD1 4.5Å; L111-Y232 HydrophobicContact CD1-CE1 3.81Å
112	V	98.6	Very high	98.3	Very high	23 Å²	23	46.3 Å²	46.3	14%	0.139	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-37.9	176.9	172.6	0	0	0	0	111.4	T108 L109 C115 P116 L175 I179 C325	T108-V112 HydrophobicContact CG2-CG2 4.45Å; T108-V112 WeakPolarHBondContact O-CG2 3.31Å; T108-V112 PolarHBondContact O-N 3.42Å; L109-V112 PolarHBondContact O-N 2.94Å; V112-C115 CarbonylContact O-C 3.48Å; V112-C115 PolarHBondContact O-N 2.95Å; V112-P116 WeakPolarHBondContact O-CA 3.44Å; V112-P116 VanDerWaalsContact O-N 3.17Å; V112-L175 HydrophobicContact CG2-CD2 3.73Å; V112-L175 HydrophobicContact CG2-CG 4.25Å; V112-I179 HydrophobicContact CG2-CD1 3.74Å; V112-C325 HydrophobicContact CG1-CB 3.85Å; V112-C325 HydrophobicContact CG2-CB 4.35Å
113	Y	98.6	Very high	98.2	Very high	179 Å²	179	45.6 Å²	45.6	70%	0.702	23%	0.228	S	C	*	.	H	α-helix	trans	-62.1	-43.1	176.2	172.1	-98.4	0	0	0	112.3	L109 V110 L111	L109-Y113 WeakPolarHBondContact O-CB 3.37Å; L109-Y113 PolarHBondContact O-N 3.07Å; V110-Y113 WeakPolarHBondContact O-CB 3.4Å; V110-Y113 PolarHBondContact O-N 3.12Å; L111-Y113 VanDerWaalsContact C-N 3.27Å; L111-Y113 PolarHBondContact O-N 3.44Å
114	Y	98.4	Very high	98.2	Very high	93 Å²	93	48.6 Å²	48.6	37%	0.365	24%	0.242	S	C	.	.	H	α-helix	trans	-78.8	-29.1	178.1	-76.6	-66.6	0	0	0	113.8	V110 L111 P123 W125 A126	V110-Y114 HydrophobicContact CG1-CD2 4Å; V110-Y114 HydrophobicContact CG1-CE2 3.88Å; V110-Y114 VanDerWaalsContact O-CD2 3.25Å; V110-Y114 WeakPolarHBondContact O-CD2 3.31Å; V110-Y114 PolarHBondContact O-N 2.94Å; L111-Y114 PolarHBondContact O-N 3.09Å; Y114-P123 HydrophobicContact CD1-CG 4.37Å; Y114-P123 HydrophobicContact CD2-CG 4.1Å; Y114-P123 HydrophobicContact CE1-CG 4.13Å; Y114-P123 HydrophobicContact CE2-CG 3.84Å; Y114-P123 HydrophobicContact CG-CG 4.37Å; Y114-W125 AromaticContact CE2-CH2 3.94Å; Y114-W125 HydrophobicContact CE2-CH2 3.94Å; Y114-W125 AromaticContact CE2-CZ2 3.65Å; Y114-W125 HydrophobicContact CE2-CZ2 3.65Å; Y114-W125 AromaticContact CZ-CZ2 3.94Å; Y114-W125 WeakPolarHBondContact OH-CZ2 3.31Å; Y114-A126 HydrophobicContact CD2-CB 4.43Å
115	C	98.4	Very high	98.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.263	C	S	.	.			trans	-134.7	62.9	-171.4	-54.3	0	0	0	0	112.1	L111 V112 T117 A118 E120 A122 I179 C325	L111-C115 WeakPolarHBondContact O-CB 3.38Å; L111-C115 PolarHBondContact O-N 2.74Å; V112-C115 CarbonylContact O-C 3.48Å; V112-C115 PolarHBondContact O-N 2.95Å; C115-T117 PolarHBondContact O-N 3.19Å; C115-A118 PolarHBondContact O-N 3.41Å; C115-A118 VanDerWaalsContact O-N 3.09Å; C115-E120 VanDerWaalsContact C-OE2 3.23Å; C115-E120 WeakPolarHBondContact CA-OE2 3.47Å; C115-E120 HydrophobicContact CB-CB 4.07Å; C115-A122 PolarHBondContact SG-N 2.86Å; C115-A122 VanDerWaalsContact SG-N 3.38Å; C115-I179 HydrophobicContact CB-CG2 3.51Å; C115-C325 PolarHBondContact O-SG 3.02Å
116	P	98.1	Very high	98.2	Very high	63 Å²	63	52.9 Å²	52.9	41%	0.409	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.4	-174.8	27.6	-36.5	0	0	0	113.5	V112 E120 C325	V112-P116 WeakPolarHBondContact O-CA 3.44Å; V112-P116 VanDerWaalsContact O-N 3.17Å; P116-E120 WeakPolarHBondContact CD-OE1 3.49Å; P116-C325 WeakPolarHBondContact O-CB 3.2Å; P116-C325 PolarHBondContact O-SG 2.76Å
117	T	98.1	Very high	98.2	Very high	32 Å²	32	47 Å²	47	20%	0.196	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-1.2	175.7	70.4	0	0	0	0	113.6	C115 T119 E120 P324	C115-T117 PolarHBondContact O-N 3.19Å; T117-T119 PolarHBondContact O-N 3.44Å; T117-T119 VanDerWaalsContact O-N 3.13Å; T117-T119 PolarHBondContact OG1-OG1 2.92Å; T117-E120 WeakPolarHBondContact CB-OE1 3.41Å; T117-E120 PolarHBondContact N-OE1 2.96Å; T117-E120 PolarHBondContact N-OE2 3.18Å; T117-E120 PolarHBondContact OG1-OE1 2.9Å; T117-E120 PolarHBondContact OG1-OE2 3.47Å; T117-E120 VanDerWaalsContact OG1-OE2 3.04Å; T117-P324 VanDerWaalsContact O-CG 3.29Å; T117-P324 WeakPolarHBondContact O-CG 3.26Å
118	A	98.1	Very high	98.1	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	53.8	24.9	-172.5	0	0	0	0	0	113.4	C115 E120 I179 Q182 G184 M190	C115-A118 PolarHBondContact O-N 3.41Å; C115-A118 VanDerWaalsContact O-N 3.09Å; A118-E120 PolarHBondContact N-OE2 3.36Å; A118-E120 VanDerWaalsContact N-OE2 3.14Å; A118-I179 HydrophobicContact CB-CB 4.48Å; A118-I179 HydrophobicContact CB-CG1 3.85Å; A118-Q182 CarbonylContact O-C 3.41Å; A118-Q182 WeakPolarHBondContact O-CA 3.44Å; A118-G184 WeakPolarHBondContact O-CA 3.45Å; A118-G184 PolarHBondContact O-N 3.23Å; A118-M190 HydrophobicContact CB-CE 3.77Å; A118-M190 HydrophobicContact CB-SD 3.87Å
119	T	97.6	Very high	98.1	Very high	60 Å²	60	52.1 Å²	52.1	37%	0.368	26%	0.255	S	S	.	.			trans	-107.5	-22.3	172.3	67.7	0	0	0	0	111.6	T117 Q182 T185	T117-T119 PolarHBondContact O-N 3.44Å; T117-T119 VanDerWaalsContact O-N 3.13Å; T117-T119 PolarHBondContact OG1-OG1 2.92Å; T119-Q182 PolarHBondContact O-NE2 3.25Å; T119-T185 HydrophobicContact CG2-CG2 4.25Å
120	E	97.5	Very high	98.1	Very high	54 Å²	54	48.4 Å²	48.4	25%	0.252	24%	0.235	S	C	.	.	S	Bend	trans	-76.1	169.6	-176.3	-49.5	85.7	165.7	0	0	111.5	C115 P116 T117 A118 Q182	C115-E120 VanDerWaalsContact C-OE2 3.23Å; C115-E120 WeakPolarHBondContact CA-OE2 3.47Å; C115-E120 HydrophobicContact CB-CB 4.07Å; P116-E120 WeakPolarHBondContact CD-OE1 3.49Å; T117-E120 WeakPolarHBondContact CB-OE1 3.41Å; T117-E120 PolarHBondContact N-OE1 2.96Å; T117-E120 PolarHBondContact N-OE2 3.18Å; T117-E120 PolarHBondContact OG1-OE1 2.9Å; T117-E120 PolarHBondContact OG1-OE2 3.47Å; T117-E120 VanDerWaalsContact OG1-OE2 3.04Å; A118-E120 PolarHBondContact N-OE2 3.36Å; A118-E120 VanDerWaalsContact N-OE2 3.14Å; E120-Q182 PolarHBondContact O-NE2 2.87Å
121	Q	97.2	Very high	98.1	Very high	108 Å²	108	47.5 Å²	47.5	51%	0.505	23%	0.23	S	C	.	.			trans	-111	123.6	170.7	-179	175.3	-42.7	0	0	109.3	S240	Q121-S240 PolarHBondContact OE1-OG 3.19Å
122	A	97.6	Very high	98.2	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.025	26%	0.255	C	S	.	.			trans	-77.2	158.7	174.1	0	0	0	0	0	110.6	L111 C115 A126 Y127	L111-A122 HydrophobicContact CD2-CB 3.64Å; C115-A122 PolarHBondContact SG-N 2.86Å; C115-A122 VanDerWaalsContact SG-N 3.38Å; A122-A126 HydrophobicContact CB-CB 4.18Å; A122-Y127 HydrophobicContact CB-CE1 3.97Å; A122-Y127 HydrophobicContact CB-CE2 3.94Å; A122-Y127 PolarHBondContact N-OH 2.92Å; A122-Y127 VanDerWaalsContact O-CE2 3.31Å; A122-Y127 WeakPolarHBondContact O-CE2 3.48Å
123	P	97.6	Very high	98.2	Very high	42 Å²	42	50.6 Å²	50.6	27%	0.273	25%	0.25	S	C	.	.			trans	-62.4	147	169.7	27.7	-35.3	0	0	0	111	Y114 W125 A126	Y114-P123 HydrophobicContact CD1-CG 4.37Å; Y114-P123 HydrophobicContact CD2-CG 4.1Å; Y114-P123 HydrophobicContact CE1-CG 4.13Å; Y114-P123 HydrophobicContact CE2-CG 3.84Å; Y114-P123 HydrophobicContact CG-CG 4.37Å; P123-W125 HydrophobicContact CG-CZ2 4.1Å; P123-W125 PolarHBondContact O-N 3.37Å; P123-W125 VanDerWaalsContact O-N 3.11Å; P123-A126 HydrophobicContact CG-CB 4.12Å; P123-A126 WeakPolarHBondContact O-CB 3.35Å; P123-A126 PolarHBondContact O-N 3.28Å
124	L	97.6	Very high	98.2	Very high	98 Å²	98	42.1 Å²	42.1	51%	0.513	22%	0.216	S	C	.	.	H	α-helix	trans	-48.4	-43.9	-176.5	177.3	157.8	0	0	0	113.2	A126 Y127 L128 A236	L124-A126 PolarHBondContact O-N 2.9Å; L124-Y127 PolarHBondContact O-N 2.85Å; L124-L128 HydrophobicContact CD2-CD1 3.43Å; L124-L128 VanDerWaalsContact CD2-CD1 3.43Å; L124-L128 HydrophobicContact CD2-CG 3.86Å; L124-L128 PolarHBondContact O-N 2.87Å; L124-L128 VanDerWaalsContact O-N 3.13Å; L124-A236 WeakPolarHBondContact CD1-O 3.3Å; L124-A236 HydrophobicContact CG-CB 4.21Å; L124-A236 WeakPolarHBondContact CG-O 3.37Å
125	W	98.2	Very high	98.2	Very high	122 Å²	122	41.5 Å²	41.5	46%	0.462	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-28	-177.7	69	-101.6	0	0	0	112.5	V110 Y114 P123 L128 M129	V110-W125 HydrophobicContact CG1-CH2 3.6Å; V110-W125 HydrophobicContact CG1-CZ3 3.87Å; Y114-W125 AromaticContact CE2-CH2 3.94Å; Y114-W125 HydrophobicContact CE2-CH2 3.94Å; Y114-W125 AromaticContact CE2-CZ2 3.65Å; Y114-W125 HydrophobicContact CE2-CZ2 3.65Å; Y114-W125 AromaticContact CZ-CZ2 3.94Å; Y114-W125 WeakPolarHBondContact OH-CZ2 3.31Å; P123-W125 HydrophobicContact CG-CZ2 4.1Å; P123-W125 PolarHBondContact O-N 3.37Å; P123-W125 VanDerWaalsContact O-N 3.11Å; W125-L128 PolarHBondContact O-N 2.87Å; W125-M129 HydrophobicContact CE3-CB 4.44Å; W125-M129 HydrophobicContact CE3-SD 4.48Å; W125-M129 HydrophobicContact CZ3-CE 4.09Å; W125-M129 HydrophobicContact CZ3-SD 3.92Å; W125-M129 WeakPolarHBondContact O-CB 3.43Å; W125-M129 PolarHBondContact O-N 3.14Å
126	A	98.4	Very high	98.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70.1	-39.7	178.8	0	0	0	0	0	111	V110 L111 Y114 A122 P123 L124 M129 C130	V110-A126 HydrophobicContact CG1-CB 4.27Å; L111-A126 HydrophobicContact CD2-CB 3.91Å; Y114-A126 HydrophobicContact CD2-CB 4.43Å; A122-A126 HydrophobicContact CB-CB 4.18Å; P123-A126 HydrophobicContact CG-CB 4.12Å; P123-A126 WeakPolarHBondContact O-CB 3.35Å; P123-A126 PolarHBondContact O-N 3.28Å; L124-A126 PolarHBondContact O-N 2.9Å; A126-M129 PolarHBondContact O-N 2.96Å; A126-C130 PolarHBondContact O-N 3.5Å
127	Y	98.4	Very high	98.2	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-43.6	172.5	-61.2	-56.6	0	0	0	111.8	L111 A122 L124 M129 C130 A131 A180 A235	L111-Y127 HydrophobicContact CD1-CD1 4.46Å; L111-Y127 HydrophobicContact CD2-CD1 3.76Å; L111-Y127 HydrophobicContact CD2-CE1 3.79Å; A122-Y127 HydrophobicContact CB-CE1 3.97Å; A122-Y127 HydrophobicContact CB-CE2 3.94Å; A122-Y127 PolarHBondContact N-OH 2.92Å; A122-Y127 VanDerWaalsContact O-CE2 3.31Å; A122-Y127 WeakPolarHBondContact O-CE2 3.48Å; L124-Y127 PolarHBondContact O-N 2.85Å; Y127-M129 VanDerWaalsContact C-N 3.3Å; Y127-M129 PolarHBondContact O-N 3.05Å; Y127-C130 PolarHBondContact O-N 3.12Å; Y127-A131 PolarHBondContact O-N 3.13Å; Y127-A180 HydrophobicContact CD1-CB 4.38Å; Y127-A180 HydrophobicContact CE1-CB 4.33Å; Y127-A235 HydrophobicContact CD1-CB 3.9Å; Y127-A235 HydrophobicContact CD2-CB 4.22Å; Y127-A235 HydrophobicContact CE1-CB 4.16Å; Y127-A235 HydrophobicContact CE2-CB 4.46Å; Y127-A235 HydrophobicContact CG-CB 3.93Å
128	L	98.6	Very high	98.2	Very high	70 Å²	70	40.2 Å²	40.2	37%	0.366	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-40	174.3	-68.3	-174.8	0	0	0	112.1	L124 W125 C130 A131 V132 L233 A236	L124-L128 HydrophobicContact CD2-CD1 3.43Å; L124-L128 VanDerWaalsContact CD2-CD1 3.43Å; L124-L128 HydrophobicContact CD2-CG 3.86Å; L124-L128 PolarHBondContact O-N 2.87Å; L124-L128 VanDerWaalsContact O-N 3.13Å; W125-L128 PolarHBondContact O-N 2.87Å; L128-C130 VanDerWaalsContact C-N 3.33Å; L128-C130 PolarHBondContact O-N 3.39Å; L128-A131 WeakPolarHBondContact O-CB 3.49Å; L128-A131 PolarHBondContact O-N 3.28Å; L128-V132 WeakPolarHBondContact O-CG2 3.3Å; L128-V132 PolarHBondContact O-N 2.9Å; L128-L233 HydrophobicContact CD2-CD2 3.81Å; L128-A236 HydrophobicContact CD2-CB 3.55Å; L128-A236 HydrophobicContact CG-CB 3.86Å
129	M	98.4	Very high	98.3	Very high	44 Å²	44	40.4 Å²	40.4	22%	0.217	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-40	177.2	-170.7	-170.1	62.4	0	0	111.3	F106 T107 V110 W125 A126 Y127 G133	F106-M129 HydrophobicContact CE1-SD 4.06Å; T107-M129 HydrophobicContact CG2-CE 3.94Å; T107-M129 HydrophobicContact CG2-CG 3.67Å; T107-M129 HydrophobicContact CG2-SD 4.08Å; V110-M129 HydrophobicContact CB-CE 3.46Å; V110-M129 VanDerWaalsContact CB-CE 3.46Å; V110-M129 HydrophobicContact CG1-CE 3.64Å; V110-M129 HydrophobicContact CG2-CE 3.67Å; W125-M129 HydrophobicContact CE3-CB 4.44Å; W125-M129 HydrophobicContact CE3-SD 4.48Å; W125-M129 HydrophobicContact CZ3-CE 4.09Å; W125-M129 HydrophobicContact CZ3-SD 3.92Å; W125-M129 WeakPolarHBondContact O-CB 3.43Å; W125-M129 PolarHBondContact O-N 3.14Å; A126-M129 PolarHBondContact O-N 2.96Å; Y127-M129 VanDerWaalsContact C-N 3.3Å; Y127-M129 PolarHBondContact O-N 3.05Å; M129-G133 WeakPolarHBondContact O-CA 3.38Å; M129-G133 PolarHBondContact O-N 3.35Å
130	C	98.6	Very high	98.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.6	-39	172.3	-78.4	0	0	0	0	113.2	T107 L111 A126 Y127 L128 G133 L134 Y232	T107-C130 PolarHBondContact O-SG 2.91Å; L111-C130 HydrophobicContact CD1-CB 4.12Å; L111-C130 WeakPolarHBondContact CD1-SG 3.47Å; L111-C130 VanDerWaalsContact CG-SG 3.56Å; A126-C130 PolarHBondContact O-N 3.5Å; Y127-C130 PolarHBondContact O-N 3.12Å; L128-C130 VanDerWaalsContact C-N 3.33Å; L128-C130 PolarHBondContact O-N 3.39Å; C130-G133 PolarHBondContact O-N 3.05Å; C130-L134 VanDerWaalsContact O-CB 3.3Å; C130-L134 WeakPolarHBondContact O-CB 3.35Å; C130-L134 PolarHBondContact O-N 3.23Å; C130-Y232 HydrophobicContact CB-CD1 3.85Å; C130-Y232 HydrophobicContact CB-CD2 3.96Å; C130-Y232 HydrophobicContact CB-CE1 3.73Å; C130-Y232 HydrophobicContact CB-CE2 3.84Å; C130-Y232 HydrophobicContact CB-CG 3.97Å
131	A	98.8	Very high	98.3	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.033	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-49.4	175.1	0	0	0	0	0	111.3	Y127 L128 F135 I229 L233	Y127-A131 PolarHBondContact O-N 3.13Å; L128-A131 WeakPolarHBondContact O-CB 3.49Å; L128-A131 PolarHBondContact O-N 3.28Å; A131-F135 WeakPolarHBondContact O-CB 3.5Å; A131-F135 PolarHBondContact O-N 3.42Å; A131-F135 VanDerWaalsContact O-N 3.12Å; A131-I229 HydrophobicContact CB-CG2 4.27Å; A131-L233 HydrophobicContact CB-CD2 3.82Å; A131-L233 HydrophobicContact CB-CG 4.1Å
132	V	98.8	Very high	98.3	Very high	86 Å²	86	33.9 Å²	33.9	52%	0.521	18%	0.176	S	C	.	.	H	α-helix	trans	-67.3	-42.7	177.1	173.9	0	0	0	0	111	L128 L134 F135 I136	L128-V132 WeakPolarHBondContact O-CG2 3.3Å; L128-V132 PolarHBondContact O-N 2.9Å; V132-L134 PolarHBondContact O-N 2.94Å; V132-F135 PolarHBondContact O-N 3.15Å; V132-I136 HydrophobicContact CG1-CD1 3.79Å; V132-I136 HydrophobicContact CG1-CG1 4.37Å; V132-I136 VanDerWaalsContact O-CG1 3.31Å; V132-I136 WeakPolarHBondContact O-CG1 3.17Å; V132-I136 PolarHBondContact O-N 2.83Å
133	G	98.7	Very high	98.3	Very high	2 Å²	2	33.7 Å²	33.7	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-43.5	-179.9	0	0	0	0	0	112.9	M129 C130 I136 Y137	M129-G133 WeakPolarHBondContact O-CA 3.38Å; M129-G133 PolarHBondContact O-N 3.35Å; C130-G133 PolarHBondContact O-N 3.05Å; G133-I136 PolarHBondContact O-N 3.41Å; G133-Y137 WeakPolarHBondContact O-CB 3.38Å; G133-Y137 PolarHBondContact O-N 2.67Å
134	L	98.8	Very high	98.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-69.6	-36.1	176.1	-176	57.3	0	0	0	111.9	C130 V132 Y137 Q138 V173 Q225 I228 I229 Y232	C130-L134 VanDerWaalsContact O-CB 3.3Å; C130-L134 WeakPolarHBondContact O-CB 3.35Å; C130-L134 PolarHBondContact O-N 3.23Å; V132-L134 PolarHBondContact O-N 2.94Å; L134-Y137 HydrophobicContact CD1-CD1 4.2Å; L134-Y137 WeakPolarHBondContact O-CB 3.38Å; L134-Y137 PolarHBondContact O-N 3.45Å; L134-Q138 WeakPolarHBondContact O-CB 3.27Å; L134-Q138 PolarHBondContact O-N 3.46Å; L134-V173 HydrophobicContact CD1-CG2 3.75Å; L134-Q225 HydrophobicContact CD1-CG 4.3Å; L134-I228 HydrophobicContact CD2-CB 3.89Å; L134-I228 HydrophobicContact CD2-CG2 3.45Å; L134-I228 VanDerWaalsContact CD2-CG2 3.45Å; L134-I229 HydrophobicContact CB-CG1 4.06Å; L134-I229 HydrophobicContact CD2-CG1 3.98Å; L134-I229 HydrophobicContact CG-CD1 4.37Å; L134-I229 HydrophobicContact CG-CG1 3.99Å; L134-Y232 HydrophobicContact CB-CE2 4.47Å; L134-Y232 HydrophobicContact CD2-CD2 4.48Å; L134-Y232 HydrophobicContact CD2-CE2 3.96Å
135	F	98.6	Very high	98.2	Very high	80 Å²	80	28.5 Å²	28.5	35%	0.351	15%	0.15	S	C	.	.	H	α-helix	trans	-63.8	-41.6	172.5	179.4	-103.4	0	0	0	112.1	M76 Y79 A131 V132 S139 I229	M76-F135 HydrophobicContact CE-CE2 4.35Å; Y79-F135 HydrophobicContact CE1-CE2 4.38Å; Y79-F135 AromaticContact CE1-CZ 3.81Å; Y79-F135 HydrophobicContact CE1-CZ 3.81Å; Y79-F135 AromaticContact CZ-CZ 3.69Å; Y79-F135 WeakPolarHBondContact OH-CE1 3.34Å; Y79-F135 WeakPolarHBondContact OH-CZ 3.43Å; A131-F135 WeakPolarHBondContact O-CB 3.5Å; A131-F135 PolarHBondContact O-N 3.42Å; A131-F135 VanDerWaalsContact O-N 3.12Å; V132-F135 PolarHBondContact O-N 3.15Å; F135-S139 VanDerWaalsContact O-CB 3.31Å; F135-S139 WeakPolarHBondContact O-CB 3.31Å; F135-S139 PolarHBondContact O-N 2.9Å; F135-S139 PolarHBondContact O-OG 3.44Å; F135-I229 HydrophobicContact CB-CD1 3.86Å; F135-I229 HydrophobicContact CD2-CD1 4.27Å
136	I	98.7	Very high	98.2	Very high	63 Å²	63	24.3 Å²	24.3	32%	0.323	14%	0.135	S	C	.	.	H	α-helix	trans	-62.7	-48.1	173.6	-70.2	168.1	0	0	0	109.7	T103 V132 G133 Q138 S139 L140	T103-I136 HydrophobicContact CG2-CB 4.3Å; T103-I136 HydrophobicContact CG2-CG2 4.12Å; V132-I136 HydrophobicContact CG1-CD1 3.79Å; V132-I136 HydrophobicContact CG1-CG1 4.37Å; V132-I136 VanDerWaalsContact O-CG1 3.31Å; V132-I136 WeakPolarHBondContact O-CG1 3.17Å; V132-I136 PolarHBondContact O-N 2.83Å; G133-I136 PolarHBondContact O-N 3.41Å; I136-Q138 PolarHBondContact O-N 2.93Å; I136-S139 PolarHBondContact O-N 3.39Å; I136-L140 HydrophobicContact CG2-CD1 3.79Å; I136-L140 HydrophobicContact CG2-CG 4.09Å; I136-L140 WeakPolarHBondContact O-CB 3.38Å; I136-L140 VanDerWaalsContact O-CG 3.3Å; I136-L140 WeakPolarHBondContact O-CG 3.35Å; I136-L140 PolarHBondContact O-N 3.38Å
137	Y	98.7	Very high	98.1	Very high	3 Å²	3	24.3 Å²	24.3	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-51.2	-58.3	175.4	174.4	-90.4	0	0	0	111	G100 L101 N104 G133 L134 S139 L140 D141 D166 S169	G100-Y137 VanDerWaalsContact C-CD2 3.46Å; G100-Y137 WeakPolarHBondContact O-CD2 3.35Å; L101-Y137 HydrophobicContact CB-CE2 4.46Å; N104-Y137 HydrophobicContact CB-CD2 3.78Å; N104-Y137 HydrophobicContact CB-CG 4.03Å; G133-Y137 WeakPolarHBondContact O-CB 3.38Å; G133-Y137 PolarHBondContact O-N 2.67Å; L134-Y137 HydrophobicContact CD1-CD1 4.2Å; L134-Y137 WeakPolarHBondContact O-CB 3.38Å; L134-Y137 PolarHBondContact O-N 3.45Å; Y137-S139 PolarHBondContact O-N 2.93Å; Y137-L140 PolarHBondContact O-N 3.15Å; Y137-L140 VanDerWaalsContact O-N 3.11Å; Y137-D141 HydrophobicContact CE1-CB 4.27Å; Y137-D141 WeakPolarHBondContact O-CB 3.37Å; Y137-D141 PolarHBondContact O-N 2.81Å; Y137-D141 PolarHBondContact OH-OD1 3.22Å; Y137-D166 WeakPolarHBondContact OH-CA 3.43Å; Y137-D166 PolarHBondContact OH-OD1 3.41Å; Y137-S169 WeakPolarHBondContact CE1-OG 3.32Å; Y137-S169 WeakPolarHBondContact CE2-OG 3.34Å; Y137-S169 WeakPolarHBondContact OH-CB 3.41Å; Y137-S169 PolarHBondContact OH-OG 3.13Å
138	Q	98.3	Very high	98	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-54.5	-42.1	179.3	177.6	176.4	91.9	0	0	112.1	W80 L134 I136 A142 T222 Q225	W80-Q138 HydrophobicContact CZ2-CG 4.42Å; L134-Q138 WeakPolarHBondContact O-CB 3.27Å; L134-Q138 PolarHBondContact O-N 3.46Å; I136-Q138 PolarHBondContact O-N 2.93Å; Q138-A142 WeakPolarHBondContact O-CB 3.43Å; Q138-A142 PolarHBondContact O-N 2.95Å; Q138-T222 PolarHBondContact NE2-O 2.88Å; Q138-T222 VanDerWaalsContact NE2-O 3.17Å; Q138-Q225 VanDerWaalsContact CB-OE1 3.23Å
139	S	98.4	Very high	97.9	Very high	3 Å²	3	28 Å²	28	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-66.8	-41.5	-179.1	-61.9	0	0	0	0	112.2	Y79 F135 I136 Y137 I143	Y79-S139 WeakPolarHBondContact CE1-OG 3.39Å; Y79-S139 PolarHBondContact OH-OG 3.07Å; F135-S139 VanDerWaalsContact O-CB 3.31Å; F135-S139 WeakPolarHBondContact O-CB 3.31Å; F135-S139 PolarHBondContact O-N 2.9Å; F135-S139 PolarHBondContact O-OG 3.44Å; I136-S139 PolarHBondContact O-N 3.39Å; Y137-S139 PolarHBondContact O-N 2.93Å; S139-I143 WeakPolarHBondContact O-CG1 3.29Å; S139-I143 WeakPolarHBondContact O-CG2 3.23Å; S139-I143 PolarHBondContact O-N 3.07Å
140	L	98.5	Very high	97.8	Very high	34 Å²	34	32 Å²	32	18%	0.178	16%	0.159	C	C	.	.	H	α-helix	trans	-74.6	-40.5	-178.5	-66.5	-172.3	0	0	0	111.6	I96 I99 I136 Y137 I143 D144	I96-L140 HydrophobicContact CG2-CB 3.71Å; I96-L140 HydrophobicContact CG2-CD2 3.99Å; I96-L140 HydrophobicContact CG2-CG 4.3Å; I96-L140 VanDerWaalsContact CG2-O 3.25Å; I96-L140 WeakPolarHBondContact CG2-O 3.35Å; I99-L140 HydrophobicContact CB-CD1 4.43Å; I99-L140 HydrophobicContact CG2-CD1 3.89Å; I136-L140 HydrophobicContact CG2-CD1 3.79Å; I136-L140 HydrophobicContact CG2-CG 4.09Å; I136-L140 WeakPolarHBondContact O-CB 3.38Å; I136-L140 VanDerWaalsContact O-CG 3.3Å; I136-L140 WeakPolarHBondContact O-CG 3.35Å; I136-L140 PolarHBondContact O-N 3.38Å; Y137-L140 PolarHBondContact O-N 3.15Å; Y137-L140 VanDerWaalsContact O-N 3.11Å; L140-I143 HydrophobicContact CD2-CD1 4.02Å; L140-I143 VanDerWaalsContact O-CG1 3.3Å; L140-I143 WeakPolarHBondContact O-CG1 3.41Å; L140-I143 PolarHBondContact O-N 2.87Å; L140-D144 PolarHBondContact O-N 2.88Å
141	D	97.7	Very high	97.6	Very high	25 Å²	25	33.3 Å²	33.3	13%	0.134	17%	0.167	C	C	.	.	H	α-helix	trans	-55.4	-54.5	172.6	-168.1	78.2	0	0	0	111	Y137 I143 D144 D166	Y137-D141 HydrophobicContact CE1-CB 4.27Å; Y137-D141 WeakPolarHBondContact O-CB 3.37Å; Y137-D141 PolarHBondContact O-N 2.81Å; Y137-D141 PolarHBondContact OH-OD1 3.22Å; D141-I143 PolarHBondContact O-N 3.4Å; D141-D144 VanDerWaalsContact O-CG 3.28Å; D141-D144 PolarHBondContact O-N 3.15Å; D141-D166 VanDerWaalsContact OD1-OD1 3.07Å
142	A	96.9	Very high	97.4	Very high	26 Å²	26	40.5 Å²	40.5	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-21.2	-178	0	0	0	0	0	115.3	W80 Q138	W80-A142 HydrophobicContact CD2-CB 3.46Å; W80-A142 VanDerWaalsContact CD2-CB 3.46Å; W80-A142 HydrophobicContact CE3-CB 3.86Å; W80-A142 HydrophobicContact CG-CB 3.89Å; W80-A142 HydrophobicContact CH2-CB 3.99Å; W80-A142 HydrophobicContact CZ2-CB 3.61Å; W80-A142 HydrophobicContact CZ3-CB 4.1Å; Q138-A142 WeakPolarHBondContact O-CB 3.43Å; Q138-A142 PolarHBondContact O-N 2.95Å
143	I	98.1	Very high	97.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-98.2	-11	-178.7	69.7	177.1	0	0	0	113.9	W80 L83 V84 V87 I96 S139 L140 D141 G145 K146 Q147	W80-I143 HydrophobicContact CB-CG2 3.9Å; W80-I143 HydrophobicContact CG-CG2 4.37Å; W80-I143 WeakPolarHBondContact O-CG2 3.48Å; L83-I143 HydrophobicContact CB-CG2 4.28Å; L83-I143 HydrophobicContact CD2-CD1 3.88Å; L83-I143 HydrophobicContact CD2-CG2 4.03Å; L83-I143 HydrophobicContact CG-CD1 3.88Å; L83-I143 HydrophobicContact CG-CG2 4.27Å; V84-I143 HydrophobicContact CB-CB 4.1Å; V84-I143 HydrophobicContact CB-CG2 4.2Å; V84-I143 HydrophobicContact CG2-CB 4.41Å; V87-I143 HydrophobicContact CG2-CD1 3.81Å; I96-I143 HydrophobicContact CG2-CD1 4.25Å; I96-I143 HydrophobicContact CG2-CG1 4Å; S139-I143 WeakPolarHBondContact O-CG1 3.29Å; S139-I143 WeakPolarHBondContact O-CG2 3.23Å; S139-I143 PolarHBondContact O-N 3.07Å; L140-I143 HydrophobicContact CD2-CD1 4.02Å; L140-I143 VanDerWaalsContact O-CG1 3.3Å; L140-I143 WeakPolarHBondContact O-CG1 3.41Å; L140-I143 PolarHBondContact O-N 2.87Å; D141-I143 PolarHBondContact O-N 3.4Å; I143-G145 PolarHBondContact O-N 3.38Å; I143-K146 HydrophobicContact CG2-CD 4.49Å; I143-K146 CarbonylContact O-C 3.47Å; I143-K146 WeakPolarHBondContact O-CB 3.32Å; I143-K146 PolarHBondContact O-N 2.93Å; I143-Q147 WeakPolarHBondContact O-CB 3.25Å; I143-Q147 PolarHBondContact O-N 3.42Å
144	D	97.4	Very high	97	Very high	10 Å²	10	41.7 Å²	41.7	5%	0.053	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-44.3	-174.5	71.4	2.3	0	0	0	111.9	P93 I96 T97 L140 D141 K146 Q147 A148	P93-D144 HydrophobicContact CB-CB 4.46Å; P93-D144 WeakPolarHBondContact CB-O 3.46Å; I96-D144 HydrophobicContact CB-CB 4.3Å; I96-D144 HydrophobicContact CG2-CB 4.34Å; T97-D144 PolarHBondContact OG1-OD2 3.23Å; L140-D144 PolarHBondContact O-N 2.88Å; D141-D144 VanDerWaalsContact O-CG 3.28Å; D141-D144 PolarHBondContact O-N 3.15Å; D144-K146 VanDerWaalsContact C-N 3.31Å; D144-K146 PolarHBondContact O-N 3.14Å; D144-Q147 WeakPolarHBondContact O-CB 3.49Å; D144-Q147 PolarHBondContact O-N 3.45Å; D144-A148 PolarHBondContact O-N 3.3Å
145	G	95.6	Very high	96.8	Very high	21 Å²	21	43.2 Å²	43.2	22%	0.216	23%	0.227	C	C	.	.	H	α-helix	trans	-70.6	-30.5	175.7	0	0	0	0	0	111.4	I143 A148 R149	I143-G145 PolarHBondContact O-N 3.38Å; G145-A148 PolarHBondContact O-N 3.46Å; G145-R149 WeakPolarHBondContact O-CG 3.43Å; G145-R149 VanDerWaalsContact O-CZ 3.26Å; G145-R149 PolarHBondContact O-N 3.45Å; G145-R149 PolarHBondContact O-NE 2.85Å; G145-R149 PolarHBondContact O-NH1 2.84Å
146	K	96.9	Very high	96.7	Very high	33 Å²	33	40.5 Å²	40.5	14%	0.143	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-43.6	171.9	-66.7	177.7	178.3	-72.8	0	110.6	W80 V84 I143 D144 A148 R149 R150	W80-K146 HydrophobicContact CB-CD 4.15Å; V84-K146 HydrophobicContact CB-CB 4.22Å; V84-K146 HydrophobicContact CG1-CB 4.26Å; V84-K146 HydrophobicContact CG2-CB 3.91Å; I143-K146 HydrophobicContact CG2-CD 4.49Å; I143-K146 CarbonylContact O-C 3.47Å; I143-K146 WeakPolarHBondContact O-CB 3.32Å; I143-K146 PolarHBondContact O-N 2.93Å; D144-K146 VanDerWaalsContact C-N 3.31Å; D144-K146 PolarHBondContact O-N 3.14Å; K146-A148 VanDerWaalsContact C-N 3.34Å; K146-R149 VanDerWaalsContact CG-NH2 3.32Å; K146-R149 PolarHBondContact O-N 3.03Å; K146-R150 WeakPolarHBondContact O-CB 3.48Å; K146-R150 PolarHBondContact O-N 2.99Å
147	Q	97.6	Very high	96.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-45.8	174.6	-179.6	69.9	-11	0	0	109.7	V84 P88 I91 P93 I96 I143 D144 R149 R150 T151	V84-Q147 HydrophobicContact CG2-CB 4Å; P88-Q147 PolarHBondContact O-NE2 3.33Å; P88-Q147 VanDerWaalsContact O-NE2 3.15Å; I91-Q147 PolarHBondContact O-NE2 2.86Å; P93-Q147 HydrophobicContact CG-CB 4.49Å; P93-Q147 HydrophobicContact CG-CG 4.27Å; I96-Q147 HydrophobicContact CD1-CB 3.88Å; I96-Q147 HydrophobicContact CD1-CG 3.84Å; I143-Q147 WeakPolarHBondContact O-CB 3.25Å; I143-Q147 PolarHBondContact O-N 3.42Å; D144-Q147 WeakPolarHBondContact O-CB 3.49Å; D144-Q147 PolarHBondContact O-N 3.45Å; Q147-R149 VanDerWaalsContact C-N 3.28Å; Q147-R149 PolarHBondContact O-N 3.43Å; Q147-R150 WeakPolarHBondContact O-CB 3.39Å; Q147-R150 PolarHBondContact O-N 3.42Å; Q147-T151 HydrophobicContact CG-CG2 4.35Å; Q147-T151 PolarHBondContact O-N 2.95Å; Q147-T151 PolarHBondContact O-OG1 3Å
148	A	96.6	Very high	96.4	Very high	9 Å²	9	38.1 Å²	38.1	7%	0.074	21%	0.209	C	C	.	.	H	α-helix	trans	-56.9	-41	178.5	0	0	0	0	0	112.5	P93 D144 G145 K146 N152 S153 S154	P93-A148 HydrophobicContact CB-CB 4.07Å; P93-A148 HydrophobicContact CG-CB 3.56Å; D144-A148 PolarHBondContact O-N 3.3Å; G145-A148 PolarHBondContact O-N 3.46Å; K146-A148 VanDerWaalsContact C-N 3.34Å; A148-N152 PolarHBondContact O-N 2.79Å; A148-N152 VanDerWaalsContact O-N 3.16Å; A148-S153 PolarHBondContact O-N 3.36Å; A148-S154 PolarHBondContact O-N 3.35Å
149	R	96.1	Very high	96.3	Very high	143 Å²	143	39.1 Å²	39.1	54%	0.54	21%	0.214	S	C	.	.	H	α-helix	trans	-68.1	-44.4	173.7	-71.4	-178.6	-68.5	-91.5	2.1	111.8	G145 K146 Q147 T151 N152	G145-R149 WeakPolarHBondContact O-CG 3.43Å; G145-R149 VanDerWaalsContact O-CZ 3.26Å; G145-R149 PolarHBondContact O-N 3.45Å; G145-R149 PolarHBondContact O-NE 2.85Å; G145-R149 PolarHBondContact O-NH1 2.84Å; K146-R149 VanDerWaalsContact CG-NH2 3.32Å; K146-R149 PolarHBondContact O-N 3.03Å; Q147-R149 VanDerWaalsContact C-N 3.28Å; Q147-R149 PolarHBondContact O-N 3.43Å; R149-T151 VanDerWaalsContact C-N 3.3Å; R149-T151 PolarHBondContact O-N 3.36Å; R149-N152 PolarHBondContact O-N 3.39Å
150	R	95.8	Very high	96.2	Very high	128 Å²	128	39.5 Å²	39.5	48%	0.483	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-37.4	178.6	-176.4	-176.7	177.8	-164.9	0.7	112.4	V84 G85 V87 K146 Q147	V84-R150 PolarHBondContact O-NH1 2.95Å; G85-R150 PolarHBondContact O-NH1 3.13Å; G85-R150 VanDerWaalsContact O-NH1 3.16Å; V87-R150 PolarHBondContact O-NH1 3.05Å; K146-R150 WeakPolarHBondContact O-CB 3.48Å; K146-R150 PolarHBondContact O-N 2.99Å; Q147-R150 WeakPolarHBondContact O-CB 3.39Å; Q147-R150 PolarHBondContact O-N 3.42Å
151	T	95.3	Very high	96.1	Very high	27 Å²	27	38.9 Å²	38.9	17%	0.166	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	6.8	-177.4	57	0	0	0	0	113.6	Q147 R149 S153 I414	Q147-T151 HydrophobicContact CG-CG2 4.35Å; Q147-T151 PolarHBondContact O-N 2.95Å; Q147-T151 PolarHBondContact O-OG1 3Å; R149-T151 VanDerWaalsContact C-N 3.3Å; R149-T151 PolarHBondContact O-N 3.36Å; T151-S153 PolarHBondContact O-N 3.26Å; T151-S153 PolarHBondContact OG1-OG 3.08Å; T151-I414 HydrophobicContact CG2-CD1 3.92Å
152	N	94.6	Very high	96.1	Very high	155 Å²	155	38.9 Å²	38.9	83%	0.829	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	39.5	-175.4	-64.8	-56.8	0	0	0	113.3	A148 R149	A148-N152 PolarHBondContact O-N 2.79Å; A148-N152 VanDerWaalsContact O-N 3.16Å; R149-N152 PolarHBondContact O-N 3.39Å
153	S	94.1	Very high	96	Very high	36 Å²	36	38.3 Å²	38.3	25%	0.252	20%	0.204	S	C	.	.			trans	-119	19.5	-178.5	67.5	0	0	0	0	113.3	A148 T151	A148-S153 PolarHBondContact O-N 3.36Å; T151-S153 PolarHBondContact O-N 3.26Å; T151-S153 PolarHBondContact OG1-OG 3.08Å
154	S	94.5	Very high	96	Very high	77 Å²	77	38.9 Å²	38.9	54%	0.538	21%	0.21	S	C	.	.			trans	-60.2	132.9	172.1	-62	0	0	0	0	111.2	A148	A148-S154 PolarHBondContact O-N 3.35Å
155	S	95	Very high	96	Very high	32 Å²	32	38.8 Å²	38.8	22%	0.224	21%	0.21	C	C	.	.			trans	-154.7	158.1	-179.7	64.6	0	0	0	0	111.3	L157 G158 E159	S155-L157 PolarHBondContact O-N 3.13Å; S155-G158 PolarHBondContact O-N 3.38Å; S155-G158 PolarHBondContact OG-N 2.93Å; S155-E159 PolarHBondContact O-N 3.27Å
156	P	95.3	Very high	96.1	Very high	22 Å²	22	38.7 Å²	38.7	14%	0.143	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-29.5	170	-24.9	34.4	0	0	0	112.9	L59 H62 G158 L160 M347	L59-P156 HydrophobicContact CD1-CB 4.06Å; L59-P156 HydrophobicContact CD2-CB 4.33Å; L59-P156 HydrophobicContact CG-CB 3.87Å; H62-P156 HydrophobicContact CB-CG 4.41Å; P156-G158 VanDerWaalsContact C-N 3.35Å; P156-L160 WeakPolarHBondContact O-CB 3.29Å; P156-L160 PolarHBondContact O-N 2.89Å; P156-L160 VanDerWaalsContact O-N 3.08Å; P156-M347 HydrophobicContact CB-CE 3.83Å; P156-M347 WeakPolarHBondContact O-CE 3.49Å
157	L	95.8	Very high	96.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-42.5	173.9	178.4	59.5	0	0	0	111.8	S155 L160 F161 C400 I403 A404 I409 V411	S155-L157 PolarHBondContact O-N 3.13Å; L157-L160 PolarHBondContact O-N 2.86Å; L157-F161 VanDerWaalsContact O-CB 3.27Å; L157-F161 WeakPolarHBondContact O-CB 3.31Å; L157-F161 PolarHBondContact O-N 3.43Å; L157-C400 HydrophobicContact CD1-CB 4.04Å; L157-I403 HydrophobicContact CB-CG2 3.76Å; L157-I403 HydrophobicContact CD1-CB 4.13Å; L157-I403 HydrophobicContact CD1-CG2 4.07Å; L157-I403 HydrophobicContact CG-CG2 4.37Å; L157-A404 HydrophobicContact CD2-CB 3.84Å; L157-I409 HydrophobicContact CB-CD1 3.93Å; L157-I409 HydrophobicContact CD2-CD1 3.74Å; L157-I409 HydrophobicContact CD2-CG1 4.15Å; L157-I409 HydrophobicContact CG-CD1 4.49Å; L157-V411 HydrophobicContact CD2-CG2 4.26Å
158	G	96.2	Very high	96.2	Very high	16 Å²	16	38.8 Å²	38.8	17%	0.165	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-47.2	-179.1	0	0	0	0	0	112	N94 S155 P156 L160 F161 D162	N94-G158 WeakPolarHBondContact OD1-CA 3.22Å; S155-G158 PolarHBondContact O-N 3.38Å; S155-G158 PolarHBondContact OG-N 2.93Å; P156-G158 VanDerWaalsContact C-N 3.35Å; G158-L160 PolarHBondContact O-N 3.49Å; G158-F161 WeakPolarHBondContact O-CB 3.49Å; G158-F161 PolarHBondContact O-N 2.95Å; G158-F161 VanDerWaalsContact O-N 3.16Å; G158-D162 WeakPolarHBondContact O-CB 3.5Å; G158-D162 PolarHBondContact O-N 2.88Å
159	E	95.3	Very high	96.3	Very high	24 Å²	24	38.4 Å²	38.4	11%	0.112	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-43.5	174.9	174.1	-171.8	161.5	0	0	112.3	H62 Y64 S155 F161 H163 M347	H62-E159 IonicContact CD2-OE1 3.82Å; H62-E159 IonicContact CD2-OE2 3.94Å; H62-E159 PolarHBondContact CD2-OE2 2.87Å; H62-E159 IonicContact CE1-OE1 2.76Å; H62-E159 IonicContact NE2-OE1 2.59Å; H62-E159 PolarHBondContact NE2-OE1 3.49Å; H62-E159 IonicContact NE2-OE2 3.16Å; H62-E159 PolarHBondContact NE2-OE2 3.38Å; Y64-E159 HydrophobicContact CD2-CG 3.94Å; Y64-E159 WeakPolarHBondContact CD2-OE2 3.36Å; Y64-E159 HydrophobicContact CE2-CG 4.32Å; S155-E159 PolarHBondContact O-N 3.27Å; E159-F161 VanDerWaalsContact C-N 3.31Å; E159-F161 PolarHBondContact O-N 3.45Å; E159-H163 PolarHBondContact O-N 3.5Å; E159-H163 VanDerWaalsContact O-N 3.12Å; E159-M347 HydrophobicContact CB-CE 3.93Å; E159-M347 HydrophobicContact CG-CE 3.87Å
160	L	95.9	Very high	96.4	Very high	11 Å²	11	32.9 Å²	32.9	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-38.9	176	178.3	64.9	0	0	0	112.1	P156 L157 G158 G164 V343 V344 M347 V399 I403	P156-L160 WeakPolarHBondContact O-CB 3.29Å; P156-L160 PolarHBondContact O-N 2.89Å; P156-L160 VanDerWaalsContact O-N 3.08Å; L157-L160 PolarHBondContact O-N 2.86Å; G158-L160 PolarHBondContact O-N 3.49Å; L160-G164 WeakPolarHBondContact O-CA 3.11Å; L160-G164 PolarHBondContact O-N 2.88Å; L160-V343 HydrophobicContact CD1-CB 4.02Å; L160-V343 HydrophobicContact CD1-CG1 3.7Å; L160-V344 HydrophobicContact CD1-CG2 3.55Å; L160-V344 HydrophobicContact CD2-CG2 3.94Å; L160-V344 HydrophobicContact CG-CG2 4.41Å; L160-M347 HydrophobicContact CB-CE 4.23Å; L160-M347 HydrophobicContact CB-SD 3.81Å; L160-M347 HydrophobicContact CD1-SD 4.16Å; L160-V399 HydrophobicContact CD2-CG1 3.51Å; L160-I403 HydrophobicContact CD2-CD1 3.38Å
161	F	97	Very high	96.5	Very high	21 Å²	21	26.8 Å²	26.8	9%	0.092	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-44.5	-178.3	-165.7	-83.6	0	0	0	111.1	N94 T97 I98 L157 G158 E159 G164 C165 V411 F412	N94-F161 HydrophobicContact CB-CD1 3.79Å; N94-F161 HydrophobicContact CB-CD2 4.41Å; N94-F161 HydrophobicContact CB-CE1 3.95Å; N94-F161 HydrophobicContact CB-CG 4.05Å; N94-F161 HydrophobicContact CB-CZ 4.33Å; N94-F161 VanDerWaalsContact O-CE1 3.29Å; N94-F161 WeakPolarHBondContact O-CE1 3.18Å; T97-F161 HydrophobicContact CG2-CD1 3.97Å; T97-F161 HydrophobicContact CG2-CE1 4.22Å; I98-F161 HydrophobicContact CB-CE1 4.1Å; I98-F161 HydrophobicContact CB-CZ 4.12Å; I98-F161 HydrophobicContact CD1-CZ 4.16Å; I98-F161 HydrophobicContact CG1-CZ 4.5Å; L157-F161 VanDerWaalsContact O-CB 3.27Å; L157-F161 WeakPolarHBondContact O-CB 3.31Å; L157-F161 PolarHBondContact O-N 3.43Å; G158-F161 WeakPolarHBondContact O-CB 3.49Å; G158-F161 PolarHBondContact O-N 2.95Å; G158-F161 VanDerWaalsContact O-N 3.16Å; E159-F161 VanDerWaalsContact C-N 3.31Å; E159-F161 PolarHBondContact O-N 3.45Å; F161-G164 PolarHBondContact O-N 3Å; F161-C165 WeakPolarHBondContact O-CB 3.32Å; F161-C165 PolarHBondContact O-N 3Å; F161-C165 PolarHBondContact O-SG 3.4Å; F161-V411 HydrophobicContact CD2-CG1 4.37Å; F161-V411 HydrophobicContact CE2-CG1 4.16Å; F161-F412 HydrophobicContact CE1-CE1 4.38Å; F161-F412 HydrophobicContact CE2-CE1 4.01Å; F161-F412 AromaticContact CE2-CZ 3.88Å; F161-F412 HydrophobicContact CE2-CZ 3.88Å; F161-F412 AromaticContact CZ-CE1 3.62Å; F161-F412 HydrophobicContact CZ-CE1 3.62Å; F161-F412 AromaticContact CZ-CZ 3.8Å; F161-F412 HydrophobicContact CZ-CZ 3.8Å
162	D	97.1	Very high	96.7	Very high	25 Å²	25	25.8 Å²	25.8	13%	0.134	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-65.9	174.8	177.7	30.9	0	0	0	111.6	G158 G164 C165 D166	G158-D162 WeakPolarHBondContact O-CB 3.5Å; G158-D162 PolarHBondContact O-N 2.88Å; D162-G164 PolarHBondContact O-N 3.29Å; D162-G164 VanDerWaalsContact O-N 3.08Å; D162-C165 WeakPolarHBondContact O-CA 3.34Å; D162-C165 WeakPolarHBondContact O-CB 3.39Å; D162-C165 PolarHBondContact O-N 2.62Å; D162-D166 PolarHBondContact O-N 3.32Å
163	H	96.4	Very high	96.9	Very high	15 Å²	15	19 Å²	19	7%	0.069	12%	0.12	C	C	.	.	H	α-helix	trans	-61.3	-28.4	179.6	-63.8	-19.4	0	0	0	113.4	E159 D166 S167 H205 V343	E159-H163 PolarHBondContact O-N 3.5Å; E159-H163 VanDerWaalsContact O-N 3.12Å; H163-D166 IonicContact ND1-OD2 3.07Å; H163-S167 PolarHBondContact O-N 2.88Å; H163-S167 VanDerWaalsContact O-N 3.15Å; H163-H205 AromaticContact CD2-NE2 3.84Å; H163-H205 AromaticContact CG-NE2 3.63Å; H163-V343 HydrophobicContact CB-CG1 4.18Å; H163-V343 HydrophobicContact CB-CG2 4.26Å
164	G	96.8	Very high	97.1	Very high	11 Å²	11	18.2 Å²	18.2	11%	0.113	11%	0.114	C	C	.	.	H	α-helix	trans	-68.8	-34.2	173.5	0	0	0	0	0	113.6	L160 F161 D162 S167 N340	L160-G164 WeakPolarHBondContact O-CA 3.11Å; L160-G164 PolarHBondContact O-N 2.88Å; F161-G164 PolarHBondContact O-N 3Å; D162-G164 PolarHBondContact O-N 3.29Å; D162-G164 VanDerWaalsContact O-N 3.08Å; G164-S167 PolarHBondContact O-OG 2.7Å; G164-S167 VanDerWaalsContact O-OG 3.06Å; G164-N340 WeakPolarHBondContact CA-OD1 3.33Å; G164-N340 PolarHBondContact O-ND2 3.46Å
165	C	98.3	Very high	97.3	Very high	9 Å²	9	14.6 Å²	14.6	6%	0.061	9%	0.088	C	C	.	.	H	α-helix	trans	-76.2	-39.4	172.8	-70.7	0	0	0	0	111.3	T97 L101 F161 D162 S167 L168 S169	T97-C165 HydrophobicContact CG2-CB 3.72Å; L101-C165 HydrophobicContact CB-CB 4.37Å; L101-C165 HydrophobicContact CD2-CB 3.98Å; F161-C165 WeakPolarHBondContact O-CB 3.32Å; F161-C165 PolarHBondContact O-N 3Å; F161-C165 PolarHBondContact O-SG 3.4Å; D162-C165 WeakPolarHBondContact O-CA 3.34Å; D162-C165 WeakPolarHBondContact O-CB 3.39Å; D162-C165 PolarHBondContact O-N 2.62Å; C165-S167 VanDerWaalsContact C-N 3.3Å; C165-S167 PolarHBondContact O-N 2.99Å; C165-L168 PolarHBondContact O-N 3.24Å; C165-L168 VanDerWaalsContact O-N 3.17Å; C165-S169 WeakPolarHBondContact O-CB 3.49Å; C165-S169 PolarHBondContact O-N 3.24Å
166	D	98.3	Very high	97.5	Very high	18 Å²	18	13 Å²	13	10%	0.096	8%	0.078	C	C	.	.	H	α-helix	trans	-57.5	-40.9	175.4	-84.2	-30.7	0	0	0	113.2	Y137 D141 D162 H163 L168 S169 T170 F201	Y137-D166 WeakPolarHBondContact OH-CA 3.43Å; Y137-D166 PolarHBondContact OH-OD1 3.41Å; D141-D166 VanDerWaalsContact OD1-OD1 3.07Å; D162-D166 PolarHBondContact O-N 3.32Å; H163-D166 IonicContact ND1-OD2 3.07Å; D166-L168 VanDerWaalsContact C-N 3.28Å; D166-L168 PolarHBondContact O-N 3.09Å; D166-S169 PolarHBondContact O-N 3.25Å; D166-T170 WeakPolarHBondContact O-CB 3.23Å; D166-T170 PolarHBondContact O-N 2.82Å; D166-T170 PolarHBondContact O-OG1 2.82Å; D166-F201 HydrophobicContact CB-CE1 4.33Å; D166-F201 HydrophobicContact CB-CE2 3.67Å; D166-F201 HydrophobicContact CB-CZ 3.32Å
167	S	97.8	Very high	97.6	Very high	3 Å²	3	13 Å²	13	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-62.2	-38.6	178.6	80.5	0	0	0	0	111.8	H163 G164 C165 F201 A336 N340	H163-S167 PolarHBondContact O-N 2.88Å; H163-S167 VanDerWaalsContact O-N 3.15Å; G164-S167 PolarHBondContact O-OG 2.7Å; G164-S167 VanDerWaalsContact O-OG 3.06Å; C165-S167 VanDerWaalsContact C-N 3.3Å; C165-S167 PolarHBondContact O-N 2.99Å; S167-F201 VanDerWaalsContact CA-CE1 3.43Å; S167-A336 PolarHBondContact OG-O 3.49Å; S167-N340 WeakPolarHBondContact CB-OD1 3.16Å; S167-N340 PolarHBondContact OG-OD1 3.21Å
168	L	98.2	Very high	97.8	Very high	32 Å²	32	13.1 Å²	13.1	17%	0.168	8%	0.078	C	C	.	.	H	α-helix	trans	-74.8	-43.3	176.3	-176.7	54.5	0	0	0	111.1	L101 C165 D166 T170 V171 F172 F333 A336 L392	L101-L168 HydrophobicContact CD1-CB 4.32Å; L101-L168 HydrophobicContact CD1-CG 4.29Å; L101-L168 HydrophobicContact CD2-CD2 4.02Å; C165-L168 PolarHBondContact O-N 3.24Å; C165-L168 VanDerWaalsContact O-N 3.17Å; D166-L168 VanDerWaalsContact C-N 3.28Å; D166-L168 PolarHBondContact O-N 3.09Å; L168-T170 VanDerWaalsContact C-N 3.26Å; L168-T170 PolarHBondContact O-N 3.47Å; L168-V171 WeakPolarHBondContact O-CB 3.47Å; L168-V171 PolarHBondContact O-N 3.41Å; L168-V171 VanDerWaalsContact O-N 3.12Å; L168-F172 HydrophobicContact CD1-CD2 4.39Å; L168-F172 HydrophobicContact CD1-CE2 3.78Å; L168-F172 HydrophobicContact CG-CD2 4.47Å; L168-F172 HydrophobicContact CG-CE2 4.07Å; L168-F172 WeakPolarHBondContact O-CD2 3.15Å; L168-F333 HydrophobicContact CD1-CD1 3.55Å; L168-F333 HydrophobicContact CD1-CE1 3.57Å; L168-A336 HydrophobicContact CB-CB 4.49Å; L168-A336 HydrophobicContact CD1-CB 4.5Å; L168-L392 HydrophobicContact CD1-CD2 3.95Å; L168-L392 HydrophobicContact CD2-CD2 4.33Å
169	S	98.4	Very high	97.9	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.014	7%	0.07	C	C	.	.	H	α-helix	trans	-56.5	-41.9	176.1	-171.6	0	0	0	0	111.6	N104 Y137 C165 D166 V171 F172 V173	N104-S169 PolarHBondContact ND2-O 3.22Å; N104-S169 PolarHBondContact ND2-OG 3.15Å; Y137-S169 WeakPolarHBondContact CE1-OG 3.32Å; Y137-S169 WeakPolarHBondContact CE2-OG 3.34Å; Y137-S169 WeakPolarHBondContact OH-CB 3.41Å; Y137-S169 PolarHBondContact OH-OG 3.13Å; C165-S169 WeakPolarHBondContact O-CB 3.49Å; C165-S169 PolarHBondContact O-N 3.24Å; D166-S169 PolarHBondContact O-N 3.25Å; S169-V171 PolarHBondContact O-N 3.16Å; S169-F172 PolarHBondContact O-N 3.1Å; S169-V173 WeakPolarHBondContact O-CG2 3.23Å; S169-V173 PolarHBondContact O-N 3.33Å
170	T	98.6	Very high	98	Very high	26 Å²	26	11.2 Å²	11.2	16%	0.16	7%	0.065	C	C	.	.	H	α-helix	trans	-53	-41.1	176.6	-63.1	0	0	0	0	112	D166 L168 F172 V173 V174 F201	D166-T170 WeakPolarHBondContact O-CB 3.23Å; D166-T170 PolarHBondContact O-N 2.82Å; D166-T170 PolarHBondContact O-OG1 2.82Å; L168-T170 VanDerWaalsContact C-N 3.26Å; L168-T170 PolarHBondContact O-N 3.47Å; T170-F172 PolarHBondContact O-N 3.35Å; T170-V173 PolarHBondContact O-N 2.95Å; T170-V174 HydrophobicContact CG2-CG1 4.37Å; T170-V174 WeakPolarHBondContact O-CG1 3.45Å; T170-V174 WeakPolarHBondContact O-CG2 3.3Å; T170-V174 PolarHBondContact O-N 3.44Å; T170-F201 HydrophobicContact CG2-CB 4.13Å
171	V	98.8	Very high	98.1	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-59.1	-46.5	176.7	-179.7	0	0	0	0	111.2	L168 S169 V174 L175 M198 L329 G332 A336	L168-V171 WeakPolarHBondContact O-CB 3.47Å; L168-V171 PolarHBondContact O-N 3.41Å; L168-V171 VanDerWaalsContact O-N 3.12Å; S169-V171 PolarHBondContact O-N 3.16Å; V171-V174 WeakPolarHBondContact O-CG2 3.14Å; V171-L175 VanDerWaalsContact O-CB 3.25Å; V171-L175 WeakPolarHBondContact O-CB 3.29Å; V171-L175 PolarHBondContact O-N 3.37Å; V171-L175 VanDerWaalsContact O-N 3.15Å; V171-M198 HydrophobicContact CG2-SD 4.14Å; V171-L329 HydrophobicContact CG1-CD2 4.34Å; V171-G332 WeakPolarHBondContact CG2-O 3.35Å; V171-A336 HydrophobicContact CG2-CB 4.48Å
172	F	98.8	Very high	98.1	Very high	7 Å²	7	9.9 Å²	9.9	3%	0.031	6%	0.059	C	C	.	.	H	α-helix	trans	-71.8	-39.4	-179.6	-70.8	-83.2	0	0	0	111.8	V105 T108 L109 L168 S169 T170 L175 G176 L329 F333	V105-F172 HydrophobicContact CB-CE1 4.49Å; V105-F172 HydrophobicContact CB-CE2 4.45Å; V105-F172 HydrophobicContact CB-CZ 4.41Å; V105-F172 HydrophobicContact CG1-CE1 3.95Å; V105-F172 HydrophobicContact CG1-CE2 4.3Å; V105-F172 HydrophobicContact CG1-CZ 3.83Å; V105-F172 HydrophobicContact CG2-CD2 3.69Å; V105-F172 HydrophobicContact CG2-CE1 4.46Å; V105-F172 HydrophobicContact CG2-CE2 3.61Å; V105-F172 HydrophobicContact CG2-CG 4.18Å; V105-F172 HydrophobicContact CG2-CZ 4.01Å; T108-F172 HydrophobicContact CG2-CB 4Å; T108-F172 HydrophobicContact CG2-CD1 3.83Å; T108-F172 HydrophobicContact CG2-CG 4.43Å; T108-F172 WeakPolarHBondContact CG2-O 3.4Å; L109-F172 HydrophobicContact CD2-CE1 3.99Å; L109-F172 HydrophobicContact CG-CE1 4.1Å; L168-F172 HydrophobicContact CD1-CD2 4.39Å; L168-F172 HydrophobicContact CD1-CE2 3.78Å; L168-F172 HydrophobicContact CG-CD2 4.47Å; L168-F172 HydrophobicContact CG-CE2 4.07Å; L168-F172 WeakPolarHBondContact O-CD2 3.15Å; S169-F172 PolarHBondContact O-N 3.1Å; T170-F172 PolarHBondContact O-N 3.35Å; F172-L175 PolarHBondContact O-N 2.86Å; F172-G176 PolarHBondContact O-N 3.14Å; F172-L329 HydrophobicContact CD1-CD2 4.21Å; F172-L329 HydrophobicContact CE1-CD2 3.62Å; F172-L329 HydrophobicContact CZ-CD2 3.86Å; F172-F333 AromaticContact CE2-CE1 3.98Å; F172-F333 HydrophobicContact CE2-CE1 3.98Å; F172-F333 AromaticContact CZ-CE1 3.96Å; F172-F333 HydrophobicContact CZ-CE1 3.96Å; F172-F333 HydrophobicContact CZ-CZ 4.15Å
173	V	98.7	Very high	98.1	Very high	12 Å²	12	9 Å²	9	7%	0.073	5%	0.053	C	C	.	.	H	α-helix	trans	-60.3	-50	176.5	172.7	0	0	0	0	111.2	N104 L134 S169 T170 L175 T177 I228	N104-V173 WeakPolarHBondContact ND2-CG2 3.27Å; L134-V173 HydrophobicContact CD1-CG2 3.75Å; S169-V173 WeakPolarHBondContact O-CG2 3.23Å; S169-V173 PolarHBondContact O-N 3.33Å; T170-V173 PolarHBondContact O-N 2.95Å; V173-L175 VanDerWaalsContact C-N 3.33Å; V173-L175 PolarHBondContact O-N 3.38Å; V173-T177 VanDerWaalsContact O-CB 3.29Å; V173-T177 WeakPolarHBondContact O-CB 3.49Å; V173-T177 PolarHBondContact O-N 3.49Å; V173-T177 PolarHBondContact O-OG1 3.16Å; V173-I228 HydrophobicContact CG1-CD1 3.42Å; V173-I228 VanDerWaalsContact CG1-CD1 3.42Å
174	V	98.6	Very high	98.2	Very high	20 Å²	20	8.7 Å²	8.7	12%	0.121	6%	0.055	C	C	.	.	H	α-helix	trans	-67.4	-35.6	-178.9	-59.1	0	0	0	0	112.2	T170 V171 S178 C194	T170-V174 HydrophobicContact CG2-CG1 4.37Å; T170-V174 WeakPolarHBondContact O-CG1 3.45Å; T170-V174 WeakPolarHBondContact O-CG2 3.3Å; T170-V174 PolarHBondContact O-N 3.44Å; V171-V174 WeakPolarHBondContact O-CG2 3.14Å; V174-S178 WeakPolarHBondContact O-CB 3.18Å; V174-S178 PolarHBondContact O-N 3.06Å; V174-S178 VanDerWaalsContact O-N 3.07Å; V174-S178 PolarHBondContact O-OG 3.45Å; V174-C194 HydrophobicContact CG2-CB 4.02Å
175	L	98.8	Very high	98.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-67.9	-51.3	176.8	178.7	56.7	0	0	0	111.4	V112 V171 F172 V173 T177 S178 I179 M190 C325 I328 L329	V112-L175 HydrophobicContact CG2-CD2 3.73Å; V112-L175 HydrophobicContact CG2-CG 4.25Å; V171-L175 VanDerWaalsContact O-CB 3.25Å; V171-L175 WeakPolarHBondContact O-CB 3.29Å; V171-L175 PolarHBondContact O-N 3.37Å; V171-L175 VanDerWaalsContact O-N 3.15Å; F172-L175 PolarHBondContact O-N 2.86Å; V173-L175 VanDerWaalsContact C-N 3.33Å; V173-L175 PolarHBondContact O-N 3.38Å; L175-T177 VanDerWaalsContact C-N 3.29Å; L175-T177 PolarHBondContact O-N 2.9Å; L175-S178 WeakPolarHBondContact O-CB 3.38Å; L175-S178 PolarHBondContact O-N 2.68Å; L175-S178 VanDerWaalsContact O-N 3.15Å; L175-I179 HydrophobicContact CD1-CD1 4.23Å; L175-I179 HydrophobicContact CD1-CG1 4.47Å; L175-I179 HydrophobicContact CG-CD1 4.12Å; L175-I179 WeakPolarHBondContact O-CG1 3.25Å; L175-I179 PolarHBondContact O-N 2.88Å; L175-M190 HydrophobicContact CD1-CE 3.94Å; L175-C325 HydrophobicContact CD1-CB 4.15Å; L175-C325 HydrophobicContact CD2-CB 4.37Å; L175-I328 HydrophobicContact CB-CG2 4.15Å; L175-I328 HydrophobicContact CD1-CB 4.2Å; L175-I328 HydrophobicContact CD1-CG2 4.23Å; L175-L329 HydrophobicContact CD2-CD1 4.35Å; L175-L329 HydrophobicContact CD2-CD2 3.91Å; L175-L329 HydrophobicContact CD2-CG 3.82Å
176	G	98.6	Very high	98.1	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.3	-39.1	179	0	0	0	0	0	112.1	F172 I179 A180 Y232	F172-G176 PolarHBondContact O-N 3.14Å; G176-I179 PolarHBondContact O-N 3.31Å; G176-A180 WeakPolarHBondContact O-CB 3.43Å; G176-A180 PolarHBondContact O-N 3.33Å; G176-Y232 WeakPolarHBondContact CA-OH 3.35Å
177	T	98.3	Very high	98.1	Very high	21 Å²	21	13.6 Å²	13.6	13%	0.129	8%	0.082	C	C	.	.	H	α-helix	trans	-61.5	-46.6	174.1	-56.7	0	0	0	0	110.8	V173 L175 I179 A180 V181 I228 M231 Y232	V173-T177 VanDerWaalsContact O-CB 3.29Å; V173-T177 WeakPolarHBondContact O-CB 3.49Å; V173-T177 PolarHBondContact O-N 3.49Å; V173-T177 PolarHBondContact O-OG1 3.16Å; L175-T177 VanDerWaalsContact C-N 3.29Å; L175-T177 PolarHBondContact O-N 2.9Å; T177-I179 VanDerWaalsContact C-N 3.32Å; T177-I179 PolarHBondContact O-N 3.05Å; T177-A180 PolarHBondContact O-N 3.48Å; T177-A180 VanDerWaalsContact O-N 3.16Å; T177-V181 WeakPolarHBondContact O-CG2 3.4Å; T177-V181 PolarHBondContact O-N 3.28Å; T177-I228 HydrophobicContact CG2-CG1 4.24Å; T177-I228 HydrophobicContact CG2-CG2 4.48Å; T177-I228 WeakPolarHBondContact OG1-CG2 3.34Å; T177-M231 HydrophobicContact CG2-CE 3.34Å; T177-M231 HydrophobicContact CG2-SD 3.94Å; T177-Y232 PolarHBondContact N-OH 3.26Å
178	S	98.5	Very high	98.1	Very high	3 Å²	3	17.7 Å²	17.7	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-62.8	-37.3	178.9	-62.1	0	0	0	0	112.8	V174 L175 Q182 L183 C194	V174-S178 WeakPolarHBondContact O-CB 3.18Å; V174-S178 PolarHBondContact O-N 3.06Å; V174-S178 VanDerWaalsContact O-N 3.07Å; V174-S178 PolarHBondContact O-OG 3.45Å; L175-S178 WeakPolarHBondContact O-CB 3.38Å; L175-S178 PolarHBondContact O-N 2.68Å; L175-S178 VanDerWaalsContact O-N 3.15Å; S178-Q182 PolarHBondContact O-N 2.99Å; S178-L183 PolarHBondContact O-N 3.14Å; S178-C194 PolarHBondContact OG-SG 3.22Å; S178-C194 VanDerWaalsContact OG-SG 3.38Å
179	I	98.6	Very high	98.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.4	-46.9	172.3	-68	165.5	0	0	0	110.7	L111 V112 C115 A118 L175 G176 T177 V181 Q182	L111-I179 HydrophobicContact CB-CD1 4.24Å; L111-I179 HydrophobicContact CB-CG2 4.15Å; L111-I179 HydrophobicContact CD1-CG2 4.45Å; V112-I179 HydrophobicContact CG2-CD1 3.74Å; C115-I179 HydrophobicContact CB-CG2 3.51Å; A118-I179 HydrophobicContact CB-CB 4.48Å; A118-I179 HydrophobicContact CB-CG1 3.85Å; L175-I179 HydrophobicContact CD1-CD1 4.23Å; L175-I179 HydrophobicContact CD1-CG1 4.47Å; L175-I179 HydrophobicContact CG-CD1 4.12Å; L175-I179 WeakPolarHBondContact O-CG1 3.25Å; L175-I179 PolarHBondContact O-N 2.88Å; G176-I179 PolarHBondContact O-N 3.31Å; T177-I179 VanDerWaalsContact C-N 3.32Å; T177-I179 PolarHBondContact O-N 3.05Å; I179-V181 PolarHBondContact O-N 3.34Å; I179-Q182 PolarHBondContact O-N 2.88Å
180	A	98	Very high	98.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.1	-35.3	-176.2	0	0	0	0	0	113.4	Y127 G176 T177 Y232 A235 W243	Y127-A180 HydrophobicContact CD1-CB 4.38Å; Y127-A180 HydrophobicContact CE1-CB 4.33Å; G176-A180 WeakPolarHBondContact O-CB 3.43Å; G176-A180 PolarHBondContact O-N 3.33Å; T177-A180 PolarHBondContact O-N 3.48Å; T177-A180 VanDerWaalsContact O-N 3.16Å; A180-Y232 HydrophobicContact CB-CD1 3.64Å; A180-Y232 HydrophobicContact CB-CE1 3.71Å; A180-A235 HydrophobicContact CB-CB 4.2Å; A180-W243 VanDerWaalsContact O-CD1 3.24Å; A180-W243 PolarHBondContact O-NE1 3.46Å; A180-W243 VanDerWaalsContact O-NE1 3.12Å
181	V	97.9	Very high	98.1	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	1.9	178.9	-58.4	0	0	0	0	114.2	T177 I179 L183 M231 W243 K255 P258	T177-V181 WeakPolarHBondContact O-CG2 3.4Å; T177-V181 PolarHBondContact O-N 3.28Å; I179-V181 PolarHBondContact O-N 3.34Å; V181-L183 HydrophobicContact CG2-CB 4.12Å; V181-L183 HydrophobicContact CG2-CD1 3.69Å; V181-L183 HydrophobicContact CG2-CG 3.48Å; V181-L183 VanDerWaalsContact CG2-CG 3.48Å; V181-M231 HydrophobicContact CG1-CE 3.23Å; V181-W243 HydrophobicContact CB-CD2 4.06Å; V181-W243 HydrophobicContact CB-CE3 4.2Å; V181-W243 HydrophobicContact CB-CG 4.39Å; V181-W243 HydrophobicContact CG1-CD2 3.89Å; V181-W243 HydrophobicContact CG1-CE3 3.92Å; V181-W243 HydrophobicContact CG1-CH2 3.78Å; V181-W243 HydrophobicContact CG1-CZ2 3.75Å; V181-W243 HydrophobicContact CG1-CZ3 3.87Å; V181-K255 HydrophobicContact CB-CB 4.37Å; V181-K255 WeakPolarHBondContact O-CB 3.37Å; V181-P258 HydrophobicContact CG1-CG 4.2Å
182	Q	97.4	Very high	98.1	Very high	3 Å²	3	22.7 Å²	22.7	1%	0.014	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	49.6	-174.3	-59.2	-172.2	-20.1	0	0	114.1	A118 T119 E120 S178 I179 G184 T185 K255	A118-Q182 CarbonylContact O-C 3.41Å; A118-Q182 WeakPolarHBondContact O-CA 3.44Å; T119-Q182 PolarHBondContact O-NE2 3.25Å; E120-Q182 PolarHBondContact O-NE2 2.87Å; S178-Q182 PolarHBondContact O-N 2.99Å; I179-Q182 PolarHBondContact O-N 2.88Å; Q182-G184 PolarHBondContact O-N 3.13Å; Q182-T185 PolarHBondContact O-N 3.1Å; Q182-T185 PolarHBondContact O-OG1 3.11Å; Q182-K255 PolarHBondContact O-NZ 3.15Å
183	L	97.4	Very high	98.1	Very high	5 Å²	5	22.8 Å²	22.8	3%	0.026	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-71.4	-10.9	177	-90.5	172.8	0	0	0	113.2	S178 V181 T185 N186 W189 M190 C193 A259	S178-L183 PolarHBondContact O-N 3.14Å; V181-L183 HydrophobicContact CG2-CB 4.12Å; V181-L183 HydrophobicContact CG2-CD1 3.69Å; V181-L183 HydrophobicContact CG2-CG 3.48Å; V181-L183 VanDerWaalsContact CG2-CG 3.48Å; L183-T185 PolarHBondContact O-N 3.11Å; L183-T185 VanDerWaalsContact O-N 3.16Å; L183-N186 HydrophobicContact CD2-CB 4.48Å; L183-N186 CarbonylContact O-C 3.41Å; L183-N186 WeakPolarHBondContact O-CA 3.3Å; L183-N186 PolarHBondContact O-N 3.36Å; L183-N186 VanDerWaalsContact O-O 3.08Å; L183-W189 HydrophobicContact CD2-CB 3.84Å; L183-M190 HydrophobicContact CB-CB 3.97Å; L183-M190 HydrophobicContact CB-CG 4.31Å; L183-C193 HydrophobicContact CD1-CB 4.36Å; L183-A259 HydrophobicContact CD2-CB 4.47Å
184	G	97.5	Very high	98.1	Very high	9 Å²	9	22.2 Å²	22.2	9%	0.093	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-59.7	-23.3	173.2	0	0	0	0	0	113.4	A118 Q182 N186	A118-G184 WeakPolarHBondContact O-CA 3.45Å; A118-G184 PolarHBondContact O-N 3.23Å; Q182-G184 PolarHBondContact O-N 3.13Å; G184-N186 PolarHBondContact O-N 3.24Å
185	T	96.8	Very high	98.1	Very high	63 Å²	63	21.8 Å²	21.8	39%	0.387	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-71.7	-12	172.2	66.8	0	0	0	0	113.1	T119 Q182 L183 K255	T119-T185 HydrophobicContact CG2-CG2 4.25Å; Q182-T185 PolarHBondContact O-N 3.1Å; Q182-T185 PolarHBondContact O-OG1 3.11Å; L183-T185 PolarHBondContact O-N 3.11Å; L183-T185 VanDerWaalsContact O-N 3.16Å; T185-K255 PolarHBondContact OG1-NZ 2.84Å
186	N	97.6	Very high	98.1	Very high	48 Å²	48	22.2 Å²	22.2	26%	0.257	12%	0.118	S	C	.	.	S	Bend	trans	-132.7	71.1	178.1	-61.9	91.8	0	0	0	109.2	L183 G184 D188 W189 M190	L183-N186 HydrophobicContact CD2-CB 4.48Å; L183-N186 CarbonylContact O-C 3.41Å; L183-N186 WeakPolarHBondContact O-CA 3.3Å; L183-N186 PolarHBondContact O-N 3.36Å; L183-N186 VanDerWaalsContact O-O 3.08Å; G184-N186 PolarHBondContact O-N 3.24Å; N186-D188 VanDerWaalsContact C-N 3.28Å; N186-D188 PolarHBondContact O-N 3.47Å; N186-D188 VanDerWaalsContact O-N 3.14Å; N186-W189 HydrophobicContact CB-CB 4.18Å; N186-W189 PolarHBondContact O-N 3.22Å; N186-M190 PolarHBondContact O-N 3.07Å
187	P	97.5	Very high	98	Very high	30 Å²	30	22.8 Å²	22.8	20%	0.195	12%	0.123	C	C	.	.	H	α-helix	trans	-54.1	-39.6	-170.6	-27.5	35.2	0	0	0	113.9	W189 M190 F191 F320 E321	P187-W189 VanDerWaalsContact C-N 3.3Å; P187-W189 PolarHBondContact O-N 2.95Å; P187-M190 WeakPolarHBondContact O-CB 3.15Å; P187-M190 PolarHBondContact O-N 3.18Å; P187-F191 WeakPolarHBondContact O-CB 3.32Å; P187-F191 PolarHBondContact O-N 3.01Å; P187-F320 HydrophobicContact CB-CD1 4.16Å; P187-F320 HydrophobicContact CB-CE1 3.99Å; P187-F320 WeakPolarHBondContact O-CE1 3.49Å; P187-E321 HydrophobicContact CB-CG 3.86Å; P187-E321 HydrophobicContact CG-CB 4.36Å; P187-E321 HydrophobicContact CG-CG 3.78Å
188	D	98	Very high	98	Very high	90 Å²	90	22 Å²	22	48%	0.481	12%	0.118	S	C	.	.	H	α-helix	trans	-57.5	-42.1	176.4	-72	-47.9	0	0	0	113	N186 F192 Y312 K313	N186-D188 VanDerWaalsContact C-N 3.28Å; N186-D188 PolarHBondContact O-N 3.47Å; N186-D188 VanDerWaalsContact O-N 3.14Å; D188-F192 WeakPolarHBondContact O-CB 3.44Å; D188-F192 PolarHBondContact O-N 3.15Å; D188-Y312 PolarHBondContact OD1-OH 3.25Å; D188-Y312 VanDerWaalsContact OD1-OH 3.07Å; D188-K313 IonicContact OD1-NZ 2.9Å; D188-K313 PolarHBondContact OD1-NZ 3.23Å
189	W	98.1	Very high	98	Very high	81 Å²	81	24.1 Å²	24.1	31%	0.307	13%	0.127	S	C	.	.	H	α-helix	trans	-73.4	-36.6	177.4	-78.8	105.8	0	0	0	112.1	L183 N186 P187 F192 C193 M256 A259 L263	L183-W189 HydrophobicContact CD2-CB 3.84Å; N186-W189 HydrophobicContact CB-CB 4.18Å; N186-W189 PolarHBondContact O-N 3.22Å; P187-W189 VanDerWaalsContact C-N 3.3Å; P187-W189 PolarHBondContact O-N 2.95Å; W189-F192 HydrophobicContact CE3-CD1 4.04Å; W189-F192 HydrophobicContact CZ3-CD1 4.08Å; W189-F192 HydrophobicContact CZ3-CE1 4.38Å; W189-F192 PolarHBondContact O-N 2.91Å; W189-C193 WeakPolarHBondContact O-CB 3.33Å; W189-C193 PolarHBondContact O-N 3.33Å; W189-C193 PolarHBondContact O-SG 3.43Å; W189-M256 VanDerWaalsContact CD1-CE 3.49Å; W189-M256 HydrophobicContact CD2-CE 3.73Å; W189-M256 VanDerWaalsContact CE2-CE 3.42Å; W189-M256 HydrophobicContact CG-CE 3.75Å; W189-M256 HydrophobicContact CZ2-CE 4.01Å; W189-M256 VanDerWaalsContact NE1-CE 3.27Å; W189-A259 HydrophobicContact CD2-CB 4.14Å; W189-A259 HydrophobicContact CE3-CB 3.65Å; W189-A259 HydrophobicContact CZ3-CB 4.12Å; W189-L263 HydrophobicContact CH2-CD2 4.26Å; W189-L263 HydrophobicContact CZ3-CB 4.5Å
190	M	98.4	Very high	98	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-48.7	172.2	-173.5	173.1	176.9	0	0	111.2	A118 L175 L183 N186 P187 F192 C193 C194 F320 P324 I328	A118-M190 HydrophobicContact CB-CE 3.77Å; A118-M190 HydrophobicContact CB-SD 3.87Å; L175-M190 HydrophobicContact CD1-CE 3.94Å; L183-M190 HydrophobicContact CB-CB 3.97Å; L183-M190 HydrophobicContact CB-CG 4.31Å; N186-M190 PolarHBondContact O-N 3.07Å; P187-M190 WeakPolarHBondContact O-CB 3.15Å; P187-M190 PolarHBondContact O-N 3.18Å; M190-F192 PolarHBondContact O-N 3.41Å; M190-C193 PolarHBondContact O-N 3.35Å; M190-C194 WeakPolarHBondContact O-CB 3.42Å; M190-C194 PolarHBondContact O-N 2.85Å; M190-C194 PolarHBondContact O-SG 3.45Å; M190-F320 HydrophobicContact CB-CZ 4.34Å; M190-F320 HydrophobicContact CG-CZ 4.21Å; M190-F320 HydrophobicContact SD-CZ 4.48Å; M190-P324 HydrophobicContact CE-CB 3.73Å; M190-P324 HydrophobicContact CE-CG 4.32Å; M190-P324 HydrophobicContact SD-CB 3.77Å; M190-P324 HydrophobicContact SD-CG 4.28Å; M190-I328 HydrophobicContact CE-CG1 4.49Å
191	F	98.7	Very high	97.9	Very high	14 Å²	14	27.2 Å²	27.2	6%	0.061	14%	0.142	C	C	.	.	H	α-helix	trans	-57.2	-52	176.5	-175.5	-83.6	0	0	0	110.1	P187 C193 C194 F195 A308 M309 Y312 F320 Y327	P187-F191 WeakPolarHBondContact O-CB 3.32Å; P187-F191 PolarHBondContact O-N 3.01Å; F191-C193 PolarHBondContact O-N 3.1Å; F191-C194 PolarHBondContact O-N 3.07Å; F191-F195 HydrophobicContact CD1-CD2 4.07Å; F191-F195 AromaticContact CD2-CD2 3.85Å; F191-F195 HydrophobicContact CD2-CD2 3.85Å; F191-F195 AromaticContact CD2-CE2 3.71Å; F191-F195 HydrophobicContact CD2-CE2 3.71Å; F191-F195 AromaticContact CE1-CD2 3.9Å; F191-F195 HydrophobicContact CE1-CD2 3.9Å; F191-F195 HydrophobicContact CE1-CE2 4.41Å; F191-F195 HydrophobicContact CE1-CG 4.25Å; F191-F195 AromaticContact CE2-CD2 3.69Å; F191-F195 HydrophobicContact CE2-CD2 3.69Å; F191-F195 AromaticContact CE2-CE2 3.37Å; F191-F195 HydrophobicContact CE2-CE2 3.37Å; F191-F195 HydrophobicContact CE2-CZ 4.06Å; F191-F195 HydrophobicContact CG-CD2 4.03Å; F191-F195 HydrophobicContact CG-CE2 4.35Å; F191-F195 AromaticContact CZ-CD2 3.7Å; F191-F195 HydrophobicContact CZ-CD2 3.7Å; F191-F195 AromaticContact CZ-CE2 3.75Å; F191-F195 HydrophobicContact CZ-CE2 3.75Å; F191-F195 HydrophobicContact CZ-CG 4.19Å; F191-F195 HydrophobicContact CZ-CZ 4.28Å; F191-F195 WeakPolarHBondContact O-CB 3.32Å; F191-F195 WeakPolarHBondContact O-CD2 3.36Å; F191-F195 PolarHBondContact O-N 3.36Å; F191-A308 HydrophobicContact CE2-CB 4.05Å; F191-A308 HydrophobicContact CZ-CB 3.95Å; F191-M309 HydrophobicContact CE1-CB 4.35Å; F191-M309 HydrophobicContact CE1-CE 4.33Å; F191-M309 HydrophobicContact CZ-CB 4Å; F191-Y312 HydrophobicContact CB-CD1 4.38Å; F191-Y312 HydrophobicContact CB-CE1 4.19Å; F191-Y312 AromaticContact CD2-CD1 3.61Å; F191-Y312 HydrophobicContact CD2-CD1 3.61Å; F191-Y312 HydrophobicContact CD2-CE1 4.26Å; F191-Y312 HydrophobicContact CD2-CG 4.22Å; F191-Y312 AromaticContact CE2-CD1 3.99Å; F191-Y312 HydrophobicContact CE2-CD1 3.99Å; F191-Y312 HydrophobicContact CE2-CG 4.42Å; F191-Y312 AromaticContact CG-CD1 3.93Å; F191-Y312 HydrophobicContact CG-CD1 3.93Å; F191-Y312 HydrophobicContact CG-CE1 4.2Å; F191-F320 HydrophobicContact CB-CE1 3.76Å; F191-F320 HydrophobicContact CB-CZ 3.83Å; F191-F320 HydrophobicContact CD2-CE1 4.33Å; F191-F320 HydrophobicContact CD2-CE2 4.31Å; F191-F320 HydrophobicContact CD2-CZ 4.2Å; F191-Y327 HydrophobicContact CE2-CE1 4.3Å
192	F	98.5	Very high	97.9	Very high	69 Å²	69	27.2 Å²	27.2	30%	0.303	14%	0.141	S	C	.	.	H	α-helix	trans	-56	-52.2	178.6	173.7	-98	0	0	0	112	D188 W189 M190 C194 F195 A196 T262 L263	D188-F192 WeakPolarHBondContact O-CB 3.44Å; D188-F192 PolarHBondContact O-N 3.15Å; W189-F192 HydrophobicContact CE3-CD1 4.04Å; W189-F192 HydrophobicContact CZ3-CD1 4.08Å; W189-F192 HydrophobicContact CZ3-CE1 4.38Å; W189-F192 PolarHBondContact O-N 2.91Å; M190-F192 PolarHBondContact O-N 3.41Å; F192-C194 PolarHBondContact O-N 3.25Å; F192-F195 PolarHBondContact O-N 2.59Å; F192-A196 HydrophobicContact CE1-CB 4.35Å; F192-A196 HydrophobicContact CE2-CB 4.35Å; F192-A196 HydrophobicContact CZ-CB 4.15Å; F192-A196 WeakPolarHBondContact O-CA 3.34Å; F192-A196 WeakPolarHBondContact O-CB 3.36Å; F192-A196 PolarHBondContact O-N 2.9Å; F192-T262 HydrophobicContact CE1-CG2 4.33Å; F192-L263 HydrophobicContact CE1-CB 3.81Å; F192-L263 HydrophobicContact CE1-CD1 4.12Å; F192-L263 HydrophobicContact CE2-CD1 4.14Å; F192-L263 HydrophobicContact CZ-CB 4.01Å; F192-L263 HydrophobicContact CZ-CD1 3.49Å; F192-L263 VanDerWaalsContact CZ-CD1 3.49Å; F192-L263 HydrophobicContact CZ-CG 4.36Å
193	C	98.5	Very high	98	Very high	10 Å²	10	27 Å²	27	7%	0.068	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-44.2	-175.1	-64.9	0	0	0	0	112.1	L183 W189 M190 F191 G197 T262	L183-C193 HydrophobicContact CD1-CB 4.36Å; W189-C193 WeakPolarHBondContact O-CB 3.33Å; W189-C193 PolarHBondContact O-N 3.33Å; W189-C193 PolarHBondContact O-SG 3.43Å; M190-C193 PolarHBondContact O-N 3.35Å; F191-C193 PolarHBondContact O-N 3.1Å; C193-G197 PolarHBondContact O-N 3.16Å; C193-T262 HydrophobicContact CB-CG2 4.27Å
194	C	98.6	Very high	97.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-50.5	178.5	-71.7	0	0	0	0	112	V174 S178 M190 F191 F192 G197 M198 I328	V174-C194 HydrophobicContact CG2-CB 4.02Å; S178-C194 PolarHBondContact OG-SG 3.22Å; S178-C194 VanDerWaalsContact OG-SG 3.38Å; M190-C194 WeakPolarHBondContact O-CB 3.42Å; M190-C194 PolarHBondContact O-N 2.85Å; M190-C194 PolarHBondContact O-SG 3.45Å; F191-C194 PolarHBondContact O-N 3.07Å; F192-C194 PolarHBondContact O-N 3.25Å; C194-G197 PolarHBondContact O-N 2.62Å; C194-M198 WeakPolarHBondContact O-CE 3.49Å; C194-M198 WeakPolarHBondContact O-CG 3.49Å; C194-M198 PolarHBondContact O-N 3.17Å; C194-I328 HydrophobicContact CB-CD1 3.59Å; C194-I328 HydrophobicContact CB-CG1 4.21Å; C194-I328 HydrophobicContact CB-CG2 4.28Å
195	F	98.6	Very high	98	Very high	10 Å²	10	27.4 Å²	27.4	4%	0.044	14%	0.142	C	C	.	.	H	α-helix	trans	-73	-30.4	-178.5	-78.3	-88.7	0	0	0	113	F191 F192 M198 F199 I305 A308 Y327 I328 F331	F191-F195 HydrophobicContact CD1-CD2 4.07Å; F191-F195 AromaticContact CD2-CD2 3.85Å; F191-F195 HydrophobicContact CD2-CD2 3.85Å; F191-F195 AromaticContact CD2-CE2 3.71Å; F191-F195 HydrophobicContact CD2-CE2 3.71Å; F191-F195 AromaticContact CE1-CD2 3.9Å; F191-F195 HydrophobicContact CE1-CD2 3.9Å; F191-F195 HydrophobicContact CE1-CE2 4.41Å; F191-F195 HydrophobicContact CE1-CG 4.25Å; F191-F195 AromaticContact CE2-CD2 3.69Å; F191-F195 HydrophobicContact CE2-CD2 3.69Å; F191-F195 AromaticContact CE2-CE2 3.37Å; F191-F195 HydrophobicContact CE2-CE2 3.37Å; F191-F195 HydrophobicContact CE2-CZ 4.06Å; F191-F195 HydrophobicContact CG-CD2 4.03Å; F191-F195 HydrophobicContact CG-CE2 4.35Å; F191-F195 AromaticContact CZ-CD2 3.7Å; F191-F195 HydrophobicContact CZ-CD2 3.7Å; F191-F195 AromaticContact CZ-CE2 3.75Å; F191-F195 HydrophobicContact CZ-CE2 3.75Å; F191-F195 HydrophobicContact CZ-CG 4.19Å; F191-F195 HydrophobicContact CZ-CZ 4.28Å; F191-F195 WeakPolarHBondContact O-CB 3.32Å; F191-F195 WeakPolarHBondContact O-CD2 3.36Å; F191-F195 PolarHBondContact O-N 3.36Å; F192-F195 PolarHBondContact O-N 2.59Å; F195-M198 HydrophobicContact CB-CE 4.32Å; F195-M198 HydrophobicContact CD1-CE 3.57Å; F195-M198 HydrophobicContact CD2-CE 4.11Å; F195-M198 HydrophobicContact CE1-CE 3.8Å; F195-M198 HydrophobicContact CE2-CE 4.31Å; F195-M198 HydrophobicContact CG-CE 3.75Å; F195-M198 HydrophobicContact CZ-CE 4.16Å; F195-F199 WeakPolarHBondContact O-CB 3.48Å; F195-F199 PolarHBondContact O-N 3.13Å; F195-I305 HydrophobicContact CD1-CG1 4.2Å; F195-A308 HydrophobicContact CD1-CB 4.45Å; F195-A308 HydrophobicContact CE1-CB 3.51Å; F195-A308 HydrophobicContact CE2-CB 4.18Å; F195-A308 HydrophobicContact CZ-CB 3.35Å; F195-Y327 HydrophobicContact CE2-CE1 4.35Å; F195-Y327 HydrophobicContact CZ-CE1 4.27Å; F195-I328 HydrophobicContact CD2-CD1 4.16Å; F195-I328 HydrophobicContact CE2-CD1 3.66Å; F195-F331 HydrophobicContact CE1-CB 4.04Å; F195-F331 HydrophobicContact CZ-CB 3.7Å; F195-F331 HydrophobicContact CZ-CG 4.13Å
196	A	98.4	Very high	98	Very high	10 Å²	10	24.4 Å²	24.4	8%	0.083	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-43.8	171.9	0	0	0	0	0	111.4	F192 F199 M200 T262	F192-A196 HydrophobicContact CE1-CB 4.35Å; F192-A196 HydrophobicContact CE2-CB 4.35Å; F192-A196 HydrophobicContact CZ-CB 4.15Å; F192-A196 WeakPolarHBondContact O-CA 3.34Å; F192-A196 WeakPolarHBondContact O-CB 3.36Å; F192-A196 PolarHBondContact O-N 2.9Å; A196-F199 PolarHBondContact O-N 3.09Å; A196-M200 WeakPolarHBondContact O-CB 3.35Å; A196-M200 VanDerWaalsContact O-CG 3.29Å; A196-M200 WeakPolarHBondContact O-CG 3.48Å; A196-M200 PolarHBondContact O-N 3.45Å; A196-T262 HydrophobicContact CB-CG2 4.25Å
197	G	97.6	Very high	98	Very high	11 Å²	11	22.4 Å²	22.4	11%	0.113	11%	0.113	C	C	.	.	H	α-helix	trans	-60.8	-48.4	176.5	0	0	0	0	0	112.6	C193 C194 F199 M200 F201	C193-G197 PolarHBondContact O-N 3.16Å; C194-G197 PolarHBondContact O-N 2.62Å; G197-F199 VanDerWaalsContact C-N 3.34Å; G197-F199 PolarHBondContact O-N 2.8Å; G197-M200 PolarHBondContact O-N 3.32Å; G197-F201 PolarHBondContact O-N 3.37Å; G197-F201 VanDerWaalsContact O-N 3.12Å
198	M	98.3	Very high	98	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.025	11%	0.106	C	C	.	.	H	α-helix	trans	-61	-41.4	175.2	-66.5	-176.6	-72.6	0	0	112.2	V171 C194 F195 Y202	V171-M198 HydrophobicContact CG2-SD 4.14Å; C194-M198 WeakPolarHBondContact O-CE 3.49Å; C194-M198 WeakPolarHBondContact O-CG 3.49Å; C194-M198 PolarHBondContact O-N 3.17Å; F195-M198 HydrophobicContact CB-CE 4.32Å; F195-M198 HydrophobicContact CD1-CE 3.57Å; F195-M198 HydrophobicContact CD2-CE 4.11Å; F195-M198 HydrophobicContact CE1-CE 3.8Å; F195-M198 HydrophobicContact CE2-CE 4.31Å; F195-M198 HydrophobicContact CG-CE 3.75Å; F195-M198 HydrophobicContact CZ-CE 4.16Å; M198-Y202 PolarHBondContact O-N 2.84Å
199	F	98.4	Very high	97.9	Very high	48 Å²	48	17.1 Å²	17.1	21%	0.211	8%	0.083	C	C	.	.	H	α-helix	trans	-65.9	-42.8	177.6	179.6	-107.1	0	0	0	112.7	F195 A196 G197 F201 Y202 C203 F274 I301 I305	F195-F199 WeakPolarHBondContact O-CB 3.48Å; F195-F199 PolarHBondContact O-N 3.13Å; A196-F199 PolarHBondContact O-N 3.09Å; G197-F199 VanDerWaalsContact C-N 3.34Å; G197-F199 PolarHBondContact O-N 2.8Å; F199-F201 VanDerWaalsContact C-N 3.35Å; F199-F201 PolarHBondContact O-N 3.12Å; F199-Y202 WeakPolarHBondContact O-CB 3.39Å; F199-Y202 PolarHBondContact O-N 3.43Å; F199-C203 VanDerWaalsContact CE1-SG 3.57Å; F199-C203 WeakPolarHBondContact CZ-SG 3.25Å; F199-C203 PolarHBondContact O-N 3.38Å; F199-C203 PolarHBondContact O-SG 2.85Å; F199-F274 HydrophobicContact CE1-CE2 4.43Å; F199-F274 HydrophobicContact CZ-CE2 4.21Å; F199-F274 HydrophobicContact CZ-CZ 4.22Å; F199-I301 HydrophobicContact CD2-CG1 3.84Å; F199-I301 HydrophobicContact CD2-CG2 4.23Å; F199-I301 HydrophobicContact CE2-CG1 4.47Å; F199-I301 HydrophobicContact CE2-CG2 4.02Å; F199-I305 HydrophobicContact CB-CD1 4.15Å; F199-I305 HydrophobicContact CD2-CD1 3.71Å; F199-I305 HydrophobicContact CE2-CD1 4.49Å; F199-I305 HydrophobicContact CG-CD1 4.19Å
200	M	97.1	Very high	97.9	Very high	38 Å²	38	13.2 Å²	13.2	19%	0.187	7%	0.069	C	C	.	.	H	α-helix	trans	-61.9	-43.3	177.4	-75.5	-174	-66.1	0	0	111.6	A196 G197 Y202 C203 A204 A266	A196-M200 WeakPolarHBondContact O-CB 3.35Å; A196-M200 VanDerWaalsContact O-CG 3.29Å; A196-M200 WeakPolarHBondContact O-CG 3.48Å; A196-M200 PolarHBondContact O-N 3.45Å; G197-M200 PolarHBondContact O-N 3.32Å; M200-Y202 VanDerWaalsContact C-N 3.34Å; M200-Y202 PolarHBondContact O-N 3.04Å; M200-C203 WeakPolarHBondContact O-CB 3.38Å; M200-C203 PolarHBondContact O-N 2.99Å; M200-A204 PolarHBondContact O-N 3.21Å; M200-A204 VanDerWaalsContact O-N 3.07Å; M200-A266 HydrophobicContact CG-CB 4.45Å; M200-A266 VanDerWaalsContact SD-CA 3.52Å; M200-A266 HydrophobicContact SD-CB 3.87Å
201	F	97.3	Very high	97.8	Very high	27 Å²	27	13.7 Å²	13.7	12%	0.118	7%	0.072	C	C	.	.	H	α-helix	trans	-63.2	-40.3	175.7	-172.7	-94.5	0	0	0	111.9	D166 S167 T170 G197 F199 A204 H205 T339	D166-F201 HydrophobicContact CB-CE1 4.33Å; D166-F201 HydrophobicContact CB-CE2 3.67Å; D166-F201 HydrophobicContact CB-CZ 3.32Å; S167-F201 VanDerWaalsContact CA-CE1 3.43Å; T170-F201 HydrophobicContact CG2-CB 4.13Å; G197-F201 PolarHBondContact O-N 3.37Å; G197-F201 VanDerWaalsContact O-N 3.12Å; F199-F201 VanDerWaalsContact C-N 3.35Å; F199-F201 PolarHBondContact O-N 3.12Å; F201-A204 PolarHBondContact O-N 2.99Å; F201-H205 AromaticContact CE1-CE1 3.46Å; F201-H205 VanDerWaalsContact CE1-CE1 3.46Å; F201-H205 WeakPolarHBondContact CE1-CE1 3.3Å; F201-H205 AromaticContact CE1-ND1 3.66Å; F201-H205 AromaticContact CE2-CE1 3.83Å; F201-H205 AromaticContact CZ-CE1 3.22Å; F201-H205 WeakPolarHBondContact CZ-CE1 3.3Å; F201-H205 AromaticContact CZ-ND1 3.85Å; F201-H205 PolarHBondContact O-N 3.34Å; F201-H205 PolarHBondContact O-ND1 2.79Å; F201-T339 HydrophobicContact CD1-CG2 3.84Å; F201-T339 HydrophobicContact CE1-CG2 3.72Å
202	Y	98.3	Very high	97.6	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.3	-42.6	171.7	-173.7	-90.8	0	0	0	112.2	M198 F199 M200 A204 H205 W206 P297 I301 I338 T339 L342	M198-Y202 PolarHBondContact O-N 2.84Å; F199-Y202 WeakPolarHBondContact O-CB 3.39Å; F199-Y202 PolarHBondContact O-N 3.43Å; M200-Y202 VanDerWaalsContact C-N 3.34Å; M200-Y202 PolarHBondContact O-N 3.04Å; Y202-A204 VanDerWaalsContact C-N 3.34Å; Y202-A204 PolarHBondContact O-N 3.5Å; Y202-H205 CarbonylContact O-C 3.58Å; Y202-H205 PolarHBondContact O-N 2.88Å; Y202-W206 HydrophobicContact CD1-CB 4.49Å; Y202-W206 HydrophobicContact CD1-CE3 4.29Å; Y202-W206 HydrophobicContact CE1-CB 4.42Å; Y202-W206 HydrophobicContact CE1-CE3 4.08Å; Y202-W206 WeakPolarHBondContact O-CB 3.32Å; Y202-W206 PolarHBondContact O-N 3.18Å; Y202-P297 HydrophobicContact CE1-CB 3.99Å; Y202-P297 VanDerWaalsContact OH-CB 3.31Å; Y202-P297 WeakPolarHBondContact OH-CB 3.46Å; Y202-P297 PolarHBondContact OH-O 3.46Å; Y202-P297 VanDerWaalsContact OH-O 3.08Å; Y202-I301 HydrophobicContact CD1-CB 3.68Å; Y202-I301 HydrophobicContact CD1-CG1 3.93Å; Y202-I301 HydrophobicContact CD1-CG2 3.65Å; Y202-I301 HydrophobicContact CD2-CB 4.28Å; Y202-I301 HydrophobicContact CD2-CD1 4.22Å; Y202-I301 HydrophobicContact CD2-CG1 4.38Å; Y202-I301 HydrophobicContact CE1-CB 3.59Å; Y202-I301 HydrophobicContact CE1-CG1 4.36Å; Y202-I301 HydrophobicContact CE1-CG2 3.47Å; Y202-I301 VanDerWaalsContact CE1-CG2 3.47Å; Y202-I301 HydrophobicContact CE2-CB 4.23Å; Y202-I301 HydrophobicContact CG-CB 4.02Å; Y202-I301 HydrophobicContact CG-CD1 4.12Å; Y202-I301 HydrophobicContact CG-CG1 3.93Å; Y202-I301 HydrophobicContact CG-CG2 4.46Å; Y202-I338 HydrophobicContact CE2-CG2 3.81Å; Y202-T339 HydrophobicContact CD2-CG2 4.44Å; Y202-L342 HydrophobicContact CD1-CD2 4.33Å; Y202-L342 HydrophobicContact CD2-CD2 4.02Å; Y202-L342 HydrophobicContact CE1-CD2 3.94Å; Y202-L342 HydrophobicContact CE2-CB 4.14Å; Y202-L342 HydrophobicContact CE2-CD2 3.58Å; Y202-L342 HydrophobicContact CG-CD2 4.37Å
203	C	97.9	Very high	97.4	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-62.8	-36.2	178.5	-79.7	0	0	0	0	113.2	F199 M200 H205 W206 Q207 Y273	F199-C203 VanDerWaalsContact CE1-SG 3.57Å; F199-C203 WeakPolarHBondContact CZ-SG 3.25Å; F199-C203 PolarHBondContact O-N 3.38Å; F199-C203 PolarHBondContact O-SG 2.85Å; M200-C203 WeakPolarHBondContact O-CB 3.38Å; M200-C203 PolarHBondContact O-N 2.99Å; C203-H205 VanDerWaalsContact C-N 3.29Å; C203-H205 PolarHBondContact O-N 3.44Å; C203-W206 PolarHBondContact O-N 3.49Å; C203-Q207 WeakPolarHBondContact O-CB 3.38Å; C203-Q207 PolarHBondContact O-N 3.4Å; C203-Y273 HydrophobicContact CB-CD2 3.42Å; C203-Y273 VanDerWaalsContact CB-CD2 3.42Å; C203-Y273 HydrophobicContact CB-CE2 4.02Å; C203-Y273 HydrophobicContact CB-CG 3.97Å
204	A	96.9	Very high	97.2	Very high	13 Å²	13	12.1 Å²	12.1	11%	0.107	7%	0.072	C	C	.	.	H	α-helix	trans	-59.3	-42.5	174.2	0	0	0	0	0	111.4	M200 F201 Y202 T208 L214 Y273	M200-A204 PolarHBondContact O-N 3.21Å; M200-A204 VanDerWaalsContact O-N 3.07Å; F201-A204 PolarHBondContact O-N 2.99Å; Y202-A204 VanDerWaalsContact C-N 3.34Å; Y202-A204 PolarHBondContact O-N 3.5Å; A204-T208 PolarHBondContact O-N 3.18Å; A204-T208 PolarHBondContact O-OG1 3.38Å; A204-L214 HydrophobicContact CB-CD1 4.46Å; A204-Y273 HydrophobicContact CB-CE1 4.18Å
205	H	97.8	Very high	96.9	Very high	9 Å²	9	18 Å²	18	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-74.2	-30.9	175.8	-70.4	83.5	0	0	0	112.8	H163 F201 Y202 C203 T208 Y209 L342 V343	H163-H205 AromaticContact CD2-NE2 3.84Å; H163-H205 AromaticContact CG-NE2 3.63Å; F201-H205 AromaticContact CE1-CE1 3.46Å; F201-H205 VanDerWaalsContact CE1-CE1 3.46Å; F201-H205 WeakPolarHBondContact CE1-CE1 3.3Å; F201-H205 AromaticContact CE1-ND1 3.66Å; F201-H205 AromaticContact CE2-CE1 3.83Å; F201-H205 AromaticContact CZ-CE1 3.22Å; F201-H205 WeakPolarHBondContact CZ-CE1 3.3Å; F201-H205 AromaticContact CZ-ND1 3.85Å; F201-H205 PolarHBondContact O-N 3.34Å; F201-H205 PolarHBondContact O-ND1 2.79Å; Y202-H205 CarbonylContact O-C 3.58Å; Y202-H205 PolarHBondContact O-N 2.88Å; C203-H205 VanDerWaalsContact C-N 3.29Å; C203-H205 PolarHBondContact O-N 3.44Å; H205-T208 WeakPolarHBondContact O-CB 3.2Å; H205-T208 PolarHBondContact O-N 3.02Å; H205-Y209 WeakPolarHBondContact O-CB 3.19Å; H205-Y209 PolarHBondContact O-N 3.32Å; H205-L342 HydrophobicContact CB-CD2 3.83Å; H205-L342 HydrophobicContact CB-CG 4.28Å; H205-V343 WeakPolarHBondContact CD2-CG2 3.33Å
206	W	98.1	Very high	96.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67	-47.7	174.7	-179	-0.5	0	0	0	110.6	Y202 C203 T208 Y209 V210 F274 I277 V294 L295 P297 V298 L342	Y202-W206 HydrophobicContact CD1-CB 4.49Å; Y202-W206 HydrophobicContact CD1-CE3 4.29Å; Y202-W206 HydrophobicContact CE1-CB 4.42Å; Y202-W206 HydrophobicContact CE1-CE3 4.08Å; Y202-W206 WeakPolarHBondContact O-CB 3.32Å; Y202-W206 PolarHBondContact O-N 3.18Å; C203-W206 PolarHBondContact O-N 3.49Å; W206-T208 PolarHBondContact O-N 2.96Å; W206-Y209 WeakPolarHBondContact O-CB 3.28Å; W206-Y209 PolarHBondContact O-N 3.29Å; W206-Y209 VanDerWaalsContact O-N 3.15Å; W206-V210 WeakPolarHBondContact O-CG2 3.25Å; W206-V210 PolarHBondContact O-N 3Å; W206-F274 AromaticContact CH2-CE1 3.83Å; W206-F274 HydrophobicContact CH2-CE1 3.83Å; W206-F274 HydrophobicContact CH2-CZ 4.17Å; W206-F274 HydrophobicContact CZ2-CE1 4.46Å; W206-F274 HydrophobicContact CZ3-CE1 4.1Å; W206-F274 AromaticContact CZ3-CZ 4Å; W206-F274 HydrophobicContact CZ3-CZ 4Å; W206-I277 HydrophobicContact CB-CD1 4.31Å; W206-I277 HydrophobicContact CD2-CD1 3.69Å; W206-I277 HydrophobicContact CD2-CG1 4.49Å; W206-I277 HydrophobicContact CE3-CD1 4.16Å; W206-I277 HydrophobicContact CG-CD1 3.79Å; W206-I277 HydrophobicContact CG-CG1 4.27Å; W206-I277 HydrophobicContact CZ2-CD1 4.43Å; W206-I277 HydrophobicContact CZ2-CG2 4.01Å; W206-V294 WeakPolarHBondContact CZ2-O 3.22Å; W206-V294 PolarHBondContact NE1-O 3.45Å; W206-L295 HydrophobicContact CH2-CD2 4.36Å; W206-L295 HydrophobicContact CZ2-CD2 3.97Å; W206-P297 HydrophobicContact CD2-CB 3.89Å; W206-P297 HydrophobicContact CD2-CG 4.31Å; W206-P297 HydrophobicContact CE3-CB 4.45Å; W206-P297 HydrophobicContact CG-CB 3.93Å; W206-P297 HydrophobicContact CG-CG 4.06Å; W206-V298 HydrophobicContact CH2-CB 3.59Å; W206-V298 HydrophobicContact CH2-CG2 3.82Å; W206-V298 HydrophobicContact CZ2-CB 4.27Å; W206-V298 HydrophobicContact CZ3-CB 4.18Å; W206-V298 HydrophobicContact CZ3-CG2 4.21Å; W206-L342 HydrophobicContact CB-CD2 4.07Å
207	Q	97.3	Very high	96	Very high	6 Å²	6	21.4 Å²	21.4	3%	0.028	12%	0.115	C	C	.	.	H	α-helix	trans	-49.6	-43.9	168.7	149.4	177.8	-96.3	0	0	111.3	C203 V210 S211 R215 Y273 V276 I277	C203-Q207 WeakPolarHBondContact O-CB 3.38Å; C203-Q207 PolarHBondContact O-N 3.4Å; Q207-V210 PolarHBondContact O-N 3.42Å; Q207-S211 WeakPolarHBondContact O-CB 3.34Å; Q207-S211 PolarHBondContact O-N 2.75Å; Q207-S211 PolarHBondContact O-OG 2.96Å; Q207-R215 PolarHBondContact NE2-O 3.46Å; Q207-R215 VanDerWaalsContact NE2-O 3.15Å; Q207-Y273 HydrophobicContact CB-CD1 4.49Å; Q207-V276 HydrophobicContact CG-CB 4.35Å; Q207-V276 HydrophobicContact CG-CG1 3.93Å; Q207-I277 HydrophobicContact CB-CG1 4.46Å
208	T	96.8	Very high	95.6	Very high	8 Å²	8	26.4 Å²	26.4	5%	0.049	14%	0.138	C	C	.	.	H	α-helix	trans	-68.6	-42.2	-178.2	-55.1	0	0	0	0	111.3	A204 H205 W206 V210 S211 G212 L214 H346	A204-T208 PolarHBondContact O-N 3.18Å; A204-T208 PolarHBondContact O-OG1 3.38Å; H205-T208 WeakPolarHBondContact O-CB 3.2Å; H205-T208 PolarHBondContact O-N 3.02Å; W206-T208 PolarHBondContact O-N 2.96Å; T208-V210 PolarHBondContact O-N 2.82Å; T208-S211 PolarHBondContact O-N 3.07Å; T208-G212 VanDerWaalsContact O-CA 3.24Å; T208-G212 WeakPolarHBondContact O-CA 3.47Å; T208-G212 PolarHBondContact O-N 3.5Å; T208-L214 HydrophobicContact CG2-CB 4.25Å; T208-L214 WeakPolarHBondContact OG1-CA 3.21Å; T208-L214 WeakPolarHBondContact OG1-CD1 3.39Å; T208-H346 VanDerWaalsContact CG2-CE1 3.47Å; T208-H346 WeakPolarHBondContact CG2-CE1 3.26Å; T208-H346 PolarHBondContact O-CD2 2.62Å
209	Y	97.2	Very high	95.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-32.1	173	-178.5	-114.9	0	0	0	113.3	H205 W206 T288 I289 A290 T292 P297 L342 A345 H346 S350	H205-Y209 WeakPolarHBondContact O-CB 3.19Å; H205-Y209 PolarHBondContact O-N 3.32Å; W206-Y209 WeakPolarHBondContact O-CB 3.28Å; W206-Y209 PolarHBondContact O-N 3.29Å; W206-Y209 VanDerWaalsContact O-N 3.15Å; Y209-T288 HydrophobicContact CD1-CG2 3.69Å; Y209-T288 HydrophobicContact CE1-CG2 3.47Å; Y209-T288 VanDerWaalsContact CE1-CG2 3.47Å; Y209-I289 HydrophobicContact CD2-CG2 4.03Å; Y209-I289 HydrophobicContact CE2-CG2 4.16Å; Y209-I289 WeakPolarHBondContact O-CG2 3.45Å; Y209-I289 PolarHBondContact O-N 3.47Å; Y209-A290 HydrophobicContact CE2-CB 4Å; Y209-A290 WeakPolarHBondContact OH-CB 3.49Å; Y209-T292 PolarHBondContact OH-OG1 3.39Å; Y209-P297 HydrophobicContact CD1-CG 3.84Å; Y209-P297 HydrophobicContact CE1-CG 4.09Å; Y209-L342 HydrophobicContact CD1-CD1 3.92Å; Y209-L342 HydrophobicContact CD2-CD1 4.21Å; Y209-L342 HydrophobicContact CG-CD1 3.69Å; Y209-A345 HydrophobicContact CD2-CB 4.33Å; Y209-A345 HydrophobicContact CE2-CB 3.87Å; Y209-H346 HydrophobicContact CD2-CB 3.92Å; Y209-S350 PolarHBondContact OH-O 3Å; Y209-S350 VanDerWaalsContact OH-O 3.14Å
210	V	97.3	Very high	95	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-79.8	-47.3	177.8	172.7	0	0	0	0	111.9	W206 Q207 T208 I277 G281 V282 T288 V294	W206-V210 WeakPolarHBondContact O-CG2 3.25Å; W206-V210 PolarHBondContact O-N 3Å; Q207-V210 PolarHBondContact O-N 3.42Å; T208-V210 PolarHBondContact O-N 2.82Å; V210-I277 HydrophobicContact CG2-CG1 4.41Å; V210-I277 HydrophobicContact CG2-CG2 4.32Å; V210-G281 WeakPolarHBondContact O-CA 3.42Å; V210-V282 PolarHBondContact O-N 3.34Å; V210-T288 HydrophobicContact CG2-CG2 4.07Å; V210-V294 HydrophobicContact CG1-CB 4.35Å; V210-V294 HydrophobicContact CG1-CG1 3.85Å; V210-V294 HydrophobicContact CG2-CB 4.05Å; V210-V294 HydrophobicContact CG2-CG1 4.25Å
211	S	95.9	Very high	94.8	Very high	10 Å²	10	30.3 Å²	30.3	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-99.6	-10.9	-169.2	66.9	0	0	0	0	115.1	Q207 T208 T213 G280 V282	Q207-S211 WeakPolarHBondContact O-CB 3.34Å; Q207-S211 PolarHBondContact O-N 2.75Å; Q207-S211 PolarHBondContact O-OG 2.96Å; T208-S211 PolarHBondContact O-N 3.07Å; S211-T213 PolarHBondContact O-N 2.94Å; S211-T213 PolarHBondContact OG-O 3.18Å; S211-G280 VanDerWaalsContact CA-O 3.31Å; S211-G280 WeakPolarHBondContact CA-O 3.43Å; S211-G280 WeakPolarHBondContact CB-O 3.4Å; S211-V282 WeakPolarHBondContact O-CG1 3.44Å
212	G	94.8	Very high	94.7	Very high	19 Å²	19	29.9 Å²	29.9	20%	0.196	16%	0.162	C	C	.	.	S	Bend	trans	69.3	13.3	-175.4	0	0	0	0	0	114.3	T208	T208-G212 VanDerWaalsContact O-CA 3.24Å; T208-G212 WeakPolarHBondContact O-CA 3.47Å; T208-G212 PolarHBondContact O-N 3.5Å
213	T	94.4	Very high	94.6	Very high	26 Å²	26	30.8 Å²	30.8	16%	0.16	17%	0.166	C	C	.	.	S	Bend	trans	-146.4	130	-178.8	-64.3	0	0	0	0	110.4	S65 A67 S211 R215	S65-T213 WeakPolarHBondContact O-CA 3.49Å; S65-T213 WeakPolarHBondContact OG-CG2 3.25Å; S65-T213 PolarHBondContact OG-OG1 3.35Å; A67-T213 HydrophobicContact CB-CG2 3.95Å; S211-T213 PolarHBondContact O-N 2.94Å; S211-T213 PolarHBondContact OG-O 3.18Å; T213-R215 HydrophobicContact CG2-CG 4.36Å; T213-R215 PolarHBondContact O-N 2.93Å
214	L	93.6	Very high	94.5	Very high	14 Å²	14	34.2 Å²	34.2	7%	0.073	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	118.6	173.9	-174.7	65.6	0	0	0	109.1	S65 S66 A67 A204 T208 F216	S65-L214 PolarHBondContact O-N 2.87Å; S66-L214 CarbonylContact C-O 3.52Å; S66-L214 WeakPolarHBondContact CA-O 3.18Å; A67-L214 PolarHBondContact N-O 3.33Å; A204-L214 HydrophobicContact CB-CD1 4.46Å; T208-L214 HydrophobicContact CG2-CB 4.25Å; T208-L214 WeakPolarHBondContact OG1-CA 3.21Å; T208-L214 WeakPolarHBondContact OG1-CD1 3.39Å; L214-F216 HydrophobicContact CD2-CE1 3.98Å; L214-F216 HydrophobicContact CD2-CE2 4.45Å; L214-F216 HydrophobicContact CD2-CZ 3.64Å; L214-F216 HydrophobicContact CG-CE1 4.29Å; L214-F216 HydrophobicContact CG-CZ 4.11Å
215	R	92.9	Very high	94.6	Very high	123 Å²	123	34.2 Å²	34.2	46%	0.464	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.2	-176.4	-62	175.8	175.8	-120	-1.7	110.5	A67 Q207 T213	A67-R215 CarbonylContact O-C 3.57Å; A67-R215 WeakPolarHBondContact O-CA 3.42Å; Q207-R215 PolarHBondContact NE2-O 3.46Å; Q207-R215 VanDerWaalsContact NE2-O 3.15Å; T213-R215 HydrophobicContact CG2-CG 4.36Å; T213-R215 PolarHBondContact O-N 2.93Å
216	F	89.9	Confident	94.6	Very high	65 Å²	65	35.8 Å²	35.8	29%	0.285	19%	0.193	S	C	.	.			trans	-87.6	138.4	177.4	-59.5	-71.2	0	0	0	111.6	A67 L214 D220	A67-F216 PolarHBondContact O-N 3.45Å; L214-F216 HydrophobicContact CD2-CE1 3.98Å; L214-F216 HydrophobicContact CD2-CE2 4.45Å; L214-F216 HydrophobicContact CD2-CZ 3.64Å; L214-F216 HydrophobicContact CG-CE1 4.29Å; L214-F216 HydrophobicContact CG-CZ 4.11Å; F216-D220 WeakPolarHBondContact CA-OD2 3.37Å
217	G	88.8	Confident	94.6	Very high	27 Å²	27	40.1 Å²	40.1	28%	0.278	21%	0.212	S	C	.	.			trans	-84.3	176.4	173.2	0	0	0	0	0	112.7	S70 I219 D220	S70-G217 WeakPolarHBondContact CA-O 3.11Å; G217-I219 VanDerWaalsContact C-N 3.32Å; G217-D220 PolarHBondContact N-OD2 3.44Å
218	I	89.6	Confident	94.6	Very high	116 Å²	116	40.4 Å²	40.4	60%	0.595	21%	0.214	S	C	*	.	S	Bend	trans	-66.8	-38.5	172.2	-60.9	173	0	0	0	110.6	L71	L71-I218 HydrophobicContact CB-CG2 4.3Å; L71-I218 WeakPolarHBondContact CB-O 3.47Å; L71-I218 PolarHBondContact N-O 3.3Å
219	I	91.3	Very high	94.7	Very high	99 Å²	99	41 Å²	41	51%	0.508	22%	0.217	S	C	.	.	S	Bend	trans	-110.2	118.5	170.5	-59.7	177.4	0	0	0	106	G217 E223 V224	G217-I219 VanDerWaalsContact C-N 3.32Å; I219-E223 HydrophobicContact CG2-CB 4.14Å; I219-V224 HydrophobicContact CG2-CG2 4.34Å
220	D	91.4	Very high	94.8	Very high	19 Å²	19	45 Å²	45	10%	0.102	24%	0.237	C	C	.	.			trans	-140.6	-164.9	-177.7	-142.5	-55.8	0	0	0	110.3	F216 G217 T222 E223 V224	F216-D220 WeakPolarHBondContact CA-OD2 3.37Å; G217-D220 PolarHBondContact N-OD2 3.44Å; D220-T222 PolarHBondContact O-N 3.04Å; D220-T222 VanDerWaalsContact O-N 3.12Å; D220-E223 PolarHBondContact N-OE2 3.27Å; D220-E223 PolarHBondContact O-N 3.35Å; D220-V224 WeakPolarHBondContact O-CG2 3.4Å; D220-V224 PolarHBondContact O-N 3.31Å; D220-V224 VanDerWaalsContact O-N 3.12Å
221	V	93.4	Very high	94.8	Very high	56 Å²	56	45.2 Å²	45.2	34%	0.339	24%	0.238	S	C	.	.	H	α-helix	trans	-50	-40.3	-174.7	178.5	0	0	0	0	112.6	V224 Q225	V221-V224 PolarHBondContact O-N 3.3Å; V221-Q225 HydrophobicContact CG1-CG 4.15Å; V221-Q225 WeakPolarHBondContact O-CB 3.34Å; V221-Q225 WeakPolarHBondContact O-CG 3.29Å; V221-Q225 PolarHBondContact O-N 3.23Å
222	T	95.3	Very high	95	Very high	18 Å²	18	44.8 Å²	44.8	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-53.7	-179.2	-55.3	0	0	0	0	112.3	L72 M76 W80 Q138 D220 Q225 I226	L72-T222 HydrophobicContact CB-CG2 4.33Å; M76-T222 HydrophobicContact CG-CG2 4.17Å; W80-T222 HydrophobicContact CH2-CG2 4.1Å; W80-T222 HydrophobicContact CZ2-CG2 4.36Å; Q138-T222 PolarHBondContact NE2-O 2.88Å; Q138-T222 VanDerWaalsContact NE2-O 3.17Å; D220-T222 PolarHBondContact O-N 3.04Å; D220-T222 VanDerWaalsContact O-N 3.12Å; T222-Q225 PolarHBondContact O-N 2.67Å; T222-I226 HydrophobicContact CG2-CD1 4.08Å; T222-I226 WeakPolarHBondContact O-CG1 3.41Å; T222-I226 PolarHBondContact O-N 2.9Å
223	E	96.2	Very high	95.1	Very high	19 Å²	19	47.6 Å²	47.6	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-41.4	-179	-66.4	68.5	-149.2	0	0	111.1	S70 L71 L72 I219 D220 I226 F227	S70-E223 WeakPolarHBondContact CB-OE1 3.43Å; S70-E223 WeakPolarHBondContact CB-OE2 3.08Å; L71-E223 HydrophobicContact CB-CG 4.32Å; L71-E223 PolarHBondContact N-OE1 2.85Å; L72-E223 HydrophobicContact CB-CG 4.36Å; L72-E223 WeakPolarHBondContact CB-OE1 3.44Å; L72-E223 HydrophobicContact CD1-CG 3.98Å; L72-E223 HydrophobicContact CG-CG 3.98Å; L72-E223 PolarHBondContact N-OE1 2.65Å; I219-E223 HydrophobicContact CG2-CB 4.14Å; D220-E223 PolarHBondContact N-OE2 3.27Å; D220-E223 PolarHBondContact O-N 3.35Å; E223-I226 PolarHBondContact O-N 2.97Å; E223-F227 WeakPolarHBondContact O-CB 3.46Å; E223-F227 PolarHBondContact O-N 2.76Å
224	V	96.4	Very high	95.3	Very high	71 Å²	71	49.7 Å²	49.7	43%	0.43	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-45.6	-179.7	173.3	0	0	0	0	110.4	I219 D220 V221 F227 I228	I219-V224 HydrophobicContact CG2-CG2 4.34Å; D220-V224 WeakPolarHBondContact O-CG2 3.4Å; D220-V224 PolarHBondContact O-N 3.31Å; D220-V224 VanDerWaalsContact O-N 3.12Å; V221-V224 PolarHBondContact O-N 3.3Å; V224-F227 WeakPolarHBondContact O-CB 3.43Å; V224-F227 PolarHBondContact O-N 3.46Å; V224-I228 HydrophobicContact CG1-CD1 3.9Å; V224-I228 VanDerWaalsContact O-CG1 3.26Å; V224-I228 WeakPolarHBondContact O-CG1 3.41Å; V224-I228 PolarHBondContact O-N 2.89Å
225	Q	97.9	Very high	95.5	Very high	14 Å²	14	49.1 Å²	49.1	7%	0.065	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-39.6	177.3	-76.4	175.6	-8.4	0	0	112.3	L134 Q138 V221 T222 F227 I228 I229	L134-Q225 HydrophobicContact CD1-CG 4.3Å; Q138-Q225 VanDerWaalsContact CB-OE1 3.23Å; V221-Q225 HydrophobicContact CG1-CG 4.15Å; V221-Q225 WeakPolarHBondContact O-CB 3.34Å; V221-Q225 WeakPolarHBondContact O-CG 3.29Å; V221-Q225 PolarHBondContact O-N 3.23Å; T222-Q225 PolarHBondContact O-N 2.67Å; Q225-F227 VanDerWaalsContact C-N 3.33Å; Q225-F227 PolarHBondContact O-N 3.49Å; Q225-I228 PolarHBondContact O-N 3.35Å; Q225-I229 VanDerWaalsContact O-CG1 3.26Å; Q225-I229 WeakPolarHBondContact O-CG1 3.44Å; Q225-I229 PolarHBondContact O-N 3.25Å
226	I	98	Very high	95.7	Very high	42 Å²	42	43.6 Å²	43.6	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-42.9	173.9	-71.6	169.2	0	0	0	110.8	L72 M76 T222 E223 I228 I229 I230	L72-I226 HydrophobicContact CB-CD1 4.39Å; L72-I226 HydrophobicContact CD1-CD1 3.61Å; L72-I226 HydrophobicContact CD1-CG2 4.41Å; M76-I226 HydrophobicContact CG-CD1 4.43Å; M76-I226 HydrophobicContact SD-CD1 4.38Å; T222-I226 HydrophobicContact CG2-CD1 4.08Å; T222-I226 WeakPolarHBondContact O-CG1 3.41Å; T222-I226 PolarHBondContact O-N 2.9Å; E223-I226 PolarHBondContact O-N 2.97Å; I226-I228 VanDerWaalsContact C-N 3.33Å; I226-I228 PolarHBondContact O-N 2.59Å; I226-I229 WeakPolarHBondContact O-CB 3.35Å; I226-I229 PolarHBondContact O-N 3.17Å; I226-I230 HydrophobicContact CG2-CD1 4.22Å; I226-I230 WeakPolarHBondContact O-CG1 3.37Å; I226-I230 PolarHBondContact O-N 2.89Å
227	F	97.8	Very high	96	Very high	90 Å²	90	46.9 Å²	46.9	40%	0.395	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-43.3	174.7	179	-104.3	0	0	0	111.7	E223 V224 Q225 I230 M231	E223-F227 WeakPolarHBondContact O-CB 3.46Å; E223-F227 PolarHBondContact O-N 2.76Å; V224-F227 WeakPolarHBondContact O-CB 3.43Å; V224-F227 PolarHBondContact O-N 3.46Å; Q225-F227 VanDerWaalsContact C-N 3.33Å; Q225-F227 PolarHBondContact O-N 3.49Å; F227-I230 WeakPolarHBondContact O-CB 3.41Å; F227-I230 PolarHBondContact O-N 3.3Å; F227-M231 HydrophobicContact CD1-CG 4.3Å; F227-M231 HydrophobicContact CD1-SD 3.63Å; F227-M231 HydrophobicContact CE1-CG 4.03Å; F227-M231 HydrophobicContact CE1-SD 3.28Å; F227-M231 WeakPolarHBondContact CE1-SD 3.4Å; F227-M231 HydrophobicContact CZ-CG 4.28Å; F227-M231 HydrophobicContact CZ-SD 4.04Å; F227-M231 WeakPolarHBondContact O-CG 3.39Å; F227-M231 PolarHBondContact O-N 2.65Å
228	I	98.5	Very high	96.3	Very high	13 Å²	13	47 Å²	47	7%	0.067	26%	0.258	C	S	.	.	H	α-helix	trans	-66	-38.5	176.9	-67.6	167.6	0	0	0	111.7	L134 V173 T177 V224 Q225 I226 I230 M231 Y232	L134-I228 HydrophobicContact CD2-CB 3.89Å; L134-I228 HydrophobicContact CD2-CG2 3.45Å; L134-I228 VanDerWaalsContact CD2-CG2 3.45Å; V173-I228 HydrophobicContact CG1-CD1 3.42Å; V173-I228 VanDerWaalsContact CG1-CD1 3.42Å; T177-I228 HydrophobicContact CG2-CG1 4.24Å; T177-I228 HydrophobicContact CG2-CG2 4.48Å; T177-I228 WeakPolarHBondContact OG1-CG2 3.34Å; V224-I228 HydrophobicContact CG1-CD1 3.9Å; V224-I228 VanDerWaalsContact O-CG1 3.26Å; V224-I228 WeakPolarHBondContact O-CG1 3.41Å; V224-I228 PolarHBondContact O-N 2.89Å; Q225-I228 PolarHBondContact O-N 3.35Å; I226-I228 VanDerWaalsContact C-N 3.33Å; I226-I228 PolarHBondContact O-N 2.59Å; I228-I230 VanDerWaalsContact C-N 3.29Å; I228-I230 PolarHBondContact O-N 3.39Å; I228-M231 HydrophobicContact CG1-SD 4.36Å; I228-M231 WeakPolarHBondContact O-CB 3.37Å; I228-M231 PolarHBondContact O-N 2.94Å; I228-M231 VanDerWaalsContact O-N 3.09Å; I228-Y232 HydrophobicContact CG2-CD2 3.99Å; I228-Y232 HydrophobicContact CG2-CE2 3.55Å; I228-Y232 WeakPolarHBondContact O-CD2 3.23Å; I228-Y232 PolarHBondContact O-N 3.18Å
229	I	98.8	Very high	96.5	Very high	21 Å²	21	41.9 Å²	41.9	11%	0.108	24%	0.235	C	C	.	.	H	α-helix	trans	-57.7	-45.1	172.4	-68.9	160.6	0	0	0	110	A131 L134 F135 Q225 I226 M231 Y232 L233	A131-I229 HydrophobicContact CB-CG2 4.27Å; L134-I229 HydrophobicContact CB-CG1 4.06Å; L134-I229 HydrophobicContact CD2-CG1 3.98Å; L134-I229 HydrophobicContact CG-CD1 4.37Å; L134-I229 HydrophobicContact CG-CG1 3.99Å; F135-I229 HydrophobicContact CB-CD1 3.86Å; F135-I229 HydrophobicContact CD2-CD1 4.27Å; Q225-I229 VanDerWaalsContact O-CG1 3.26Å; Q225-I229 WeakPolarHBondContact O-CG1 3.44Å; Q225-I229 PolarHBondContact O-N 3.25Å; I226-I229 WeakPolarHBondContact O-CB 3.35Å; I226-I229 PolarHBondContact O-N 3.17Å; I229-M231 VanDerWaalsContact C-N 3.32Å; I229-M231 PolarHBondContact O-N 3.12Å; I229-Y232 PolarHBondContact O-N 2.89Å; I229-L233 HydrophobicContact CG2-CD1 4.42Å; I229-L233 WeakPolarHBondContact O-CG 3.49Å; I229-L233 PolarHBondContact O-N 2.82Å
230	I	98.4	Very high	96.5	Very high	83 Å²	83	38.3 Å²	38.3	43%	0.426	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-41.5	175.1	-65.6	164.1	0	0	0	110.8	I226 F227 I228 Y232 L233 L234	I226-I230 HydrophobicContact CG2-CD1 4.22Å; I226-I230 WeakPolarHBondContact O-CG1 3.37Å; I226-I230 PolarHBondContact O-N 2.89Å; F227-I230 WeakPolarHBondContact O-CB 3.41Å; F227-I230 PolarHBondContact O-N 3.3Å; I228-I230 VanDerWaalsContact C-N 3.29Å; I228-I230 PolarHBondContact O-N 3.39Å; I230-Y232 VanDerWaalsContact C-N 3.34Å; I230-Y232 PolarHBondContact O-N 2.9Å; I230-L233 PolarHBondContact O-N 3.18Å; I230-L234 HydrophobicContact CG2-CD1 4.1Å; I230-L234 HydrophobicContact CG2-CG 4.31Å; I230-L234 WeakPolarHBondContact O-CG 3.43Å; I230-L234 PolarHBondContact O-N 2.94Å
231	M	98.2	Very high	96.6	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-41.4	176	-65.8	171	62	0	0	112.3	T177 V181 F227 I228 I229 L233 L234 A235 W243 P258	T177-M231 HydrophobicContact CG2-CE 3.34Å; T177-M231 HydrophobicContact CG2-SD 3.94Å; V181-M231 HydrophobicContact CG1-CE 3.23Å; F227-M231 HydrophobicContact CD1-CG 4.3Å; F227-M231 HydrophobicContact CD1-SD 3.63Å; F227-M231 HydrophobicContact CE1-CG 4.03Å; F227-M231 HydrophobicContact CE1-SD 3.28Å; F227-M231 WeakPolarHBondContact CE1-SD 3.4Å; F227-M231 HydrophobicContact CZ-CG 4.28Å; F227-M231 HydrophobicContact CZ-SD 4.04Å; F227-M231 WeakPolarHBondContact O-CG 3.39Å; F227-M231 PolarHBondContact O-N 2.65Å; I228-M231 HydrophobicContact CG1-SD 4.36Å; I228-M231 WeakPolarHBondContact O-CB 3.37Å; I228-M231 PolarHBondContact O-N 2.94Å; I228-M231 VanDerWaalsContact O-N 3.09Å; I229-M231 VanDerWaalsContact C-N 3.32Å; I229-M231 PolarHBondContact O-N 3.12Å; M231-L233 VanDerWaalsContact C-N 3.35Å; M231-L234 PolarHBondContact O-N 3.41Å; M231-A235 WeakPolarHBondContact O-CB 3.36Å; M231-A235 PolarHBondContact O-N 3.46Å; M231-W243 HydrophobicContact CB-CH2 4.36Å; M231-W243 HydrophobicContact CB-CZ2 4.3Å; M231-W243 HydrophobicContact CE-CH2 4.46Å; M231-W243 HydrophobicContact CG-CH2 4.26Å; M231-P258 HydrophobicContact CE-CB 3.56Å; M231-P258 HydrophobicContact CE-CG 3.59Å; M231-P258 HydrophobicContact SD-CB 4.2Å; M231-P258 HydrophobicContact SD-CG 4.31Å
232	Y	98.6	Very high	96.8	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-41	173.9	-72.9	-51.1	0	0	0	112.1	L111 C130 L134 G176 T177 A180 I228 I229 I230 A235 A236	L111-Y232 HydrophobicContact CD1-CD1 4.5Å; L111-Y232 HydrophobicContact CD1-CE1 3.81Å; C130-Y232 HydrophobicContact CB-CD1 3.85Å; C130-Y232 HydrophobicContact CB-CD2 3.96Å; C130-Y232 HydrophobicContact CB-CE1 3.73Å; C130-Y232 HydrophobicContact CB-CE2 3.84Å; C130-Y232 HydrophobicContact CB-CG 3.97Å; L134-Y232 HydrophobicContact CB-CE2 4.47Å; L134-Y232 HydrophobicContact CD2-CD2 4.48Å; L134-Y232 HydrophobicContact CD2-CE2 3.96Å; G176-Y232 WeakPolarHBondContact CA-OH 3.35Å; T177-Y232 PolarHBondContact N-OH 3.26Å; A180-Y232 HydrophobicContact CB-CD1 3.64Å; A180-Y232 HydrophobicContact CB-CE1 3.71Å; I228-Y232 HydrophobicContact CG2-CD2 3.99Å; I228-Y232 HydrophobicContact CG2-CE2 3.55Å; I228-Y232 WeakPolarHBondContact O-CD2 3.23Å; I228-Y232 PolarHBondContact O-N 3.18Å; I229-Y232 PolarHBondContact O-N 2.89Å; I230-Y232 VanDerWaalsContact C-N 3.34Å; I230-Y232 PolarHBondContact O-N 2.9Å; Y232-A235 PolarHBondContact O-N 2.89Å; Y232-A236 WeakPolarHBondContact O-CB 3.31Å; Y232-A236 PolarHBondContact O-N 3.3Å
233	L	98.6	Very high	96.8	Very high	78 Å²	78	40.2 Å²	40.2	41%	0.408	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-40.4	175.6	-64.7	175.1	0	0	0	111.8	L128 A131 I229 I230 M231 A236 V237	L128-L233 HydrophobicContact CD2-CD2 3.81Å; A131-L233 HydrophobicContact CB-CD2 3.82Å; A131-L233 HydrophobicContact CB-CG 4.1Å; I229-L233 HydrophobicContact CG2-CD1 4.42Å; I229-L233 WeakPolarHBondContact O-CG 3.49Å; I229-L233 PolarHBondContact O-N 2.82Å; I230-L233 PolarHBondContact O-N 3.18Å; M231-L233 VanDerWaalsContact C-N 3.35Å; L233-A236 WeakPolarHBondContact O-CB 3.47Å; L233-A236 PolarHBondContact O-N 3.41Å; L233-V237 WeakPolarHBondContact O-CG2 3.28Å; L233-V237 PolarHBondContact O-N 3.36Å
234	L	97.9	Very high	96.7	Very high	70 Å²	70	43.5 Å²	43.5	37%	0.366	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-40.9	174.1	-69.7	173.7	0	0	0	111.8	I230 M231 A236 V237 G238 F242 W243	I230-L234 HydrophobicContact CG2-CD1 4.1Å; I230-L234 HydrophobicContact CG2-CG 4.31Å; I230-L234 WeakPolarHBondContact O-CG 3.43Å; I230-L234 PolarHBondContact O-N 2.94Å; M231-L234 PolarHBondContact O-N 3.41Å; L234-A236 VanDerWaalsContact C-N 3.32Å; L234-A236 PolarHBondContact O-N 2.89Å; L234-V237 PolarHBondContact O-N 2.92Å; L234-G238 WeakPolarHBondContact O-CA 3.46Å; L234-G238 PolarHBondContact O-N 3.41Å; L234-F242 HydrophobicContact CB-CD1 4.43Å; L234-F242 HydrophobicContact CB-CE1 4.02Å; L234-F242 HydrophobicContact CD1-CE1 4.16Å; L234-F242 HydrophobicContact CD1-CZ 4.21Å; L234-F242 HydrophobicContact CD2-CZ 4.38Å; L234-W243 HydrophobicContact CB-CZ2 4.02Å; L234-W243 HydrophobicContact CD1-CH2 4.42Å
235	A	97.7	Very high	96.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-37.4	173.6	0	0	0	0	0	112	Y127 A180 M231 Y232 G239	Y127-A235 HydrophobicContact CD1-CB 3.9Å; Y127-A235 HydrophobicContact CD2-CB 4.22Å; Y127-A235 HydrophobicContact CE1-CB 4.16Å; Y127-A235 HydrophobicContact CE2-CB 4.46Å; Y127-A235 HydrophobicContact CG-CB 3.93Å; A180-A235 HydrophobicContact CB-CB 4.2Å; M231-A235 WeakPolarHBondContact O-CB 3.36Å; M231-A235 PolarHBondContact O-N 3.46Å; Y232-A235 PolarHBondContact O-N 2.89Å; A235-G239 WeakPolarHBondContact O-CA 3.28Å; A235-G239 PolarHBondContact O-N 3.05Å
236	A	97.6	Very high	96.6	Very high	8 Å²	8	46.3 Å²	46.3	7%	0.066	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-44.1	176.3	0	0	0	0	0	112.3	L124 L128 Y232 L233 L234	L124-A236 WeakPolarHBondContact CD1-O 3.3Å; L124-A236 HydrophobicContact CG-CB 4.21Å; L124-A236 WeakPolarHBondContact CG-O 3.37Å; L128-A236 HydrophobicContact CD2-CB 3.55Å; L128-A236 HydrophobicContact CG-CB 3.86Å; Y232-A236 WeakPolarHBondContact O-CB 3.31Å; Y232-A236 PolarHBondContact O-N 3.3Å; L233-A236 WeakPolarHBondContact O-CB 3.47Å; L233-A236 PolarHBondContact O-N 3.41Å; L234-A236 VanDerWaalsContact C-N 3.32Å; L234-A236 PolarHBondContact O-N 2.89Å
237	V	96.7	Very high	96.4	Very high	134 Å²	134	46 Å²	46	81%	0.812	26%	0.262	S	S	*	.	H	α-helix	trans	-80.2	-44.1	-177.2	176.7	0	0	0	0	112.1	L233 L234	L233-V237 WeakPolarHBondContact O-CG2 3.28Å; L233-V237 PolarHBondContact O-N 3.36Å; L234-V237 PolarHBondContact O-N 2.92Å
238	G	93.6	Very high	95.8	Very high	28 Å²	28	48 Å²	48	29%	0.289	29%	0.285	S	S	.	.	H	α-helix	trans	-99	-15.6	-171	0	0	0	0	0	115.4	L234 F242	L234-G238 WeakPolarHBondContact O-CA 3.46Å; L234-G238 PolarHBondContact O-N 3.41Å; G238-F242 PolarHBondContact O-N 3.04Å
239	G	93.2	Very high	95.4	Very high	9 Å²	9	53.9 Å²	53.9	9%	0.093	32%	0.321	C	S	.	.	H	α-helix	trans	56.8	-154.6	-177.8	0	0	0	0	0	113.7	A235 A241	A235-G239 WeakPolarHBondContact O-CA 3.28Å; A235-G239 PolarHBondContact O-N 3.05Å; G239-A241 VanDerWaalsContact C-N 3.31Å; G239-A241 PolarHBondContact O-N 2.91Å
240	S	91.4	Very high	95	Very high	25 Å²	25	58.1 Å²	58.1	18%	0.175	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-36	176.1	63.2	0	0	0	0	112.9	Q121 F242 W243 Q244	Q121-S240 PolarHBondContact OE1-OG 3.19Å; S240-F242 VanDerWaalsContact C-N 3.29Å; S240-F242 PolarHBondContact O-N 3.21Å; S240-W243 PolarHBondContact O-N 3.29Å; S240-W243 VanDerWaalsContact O-N 3.15Å; S240-Q244 WeakPolarHBondContact O-CB 3.38Å; S240-Q244 VanDerWaalsContact O-CG 3.31Å; S240-Q244 WeakPolarHBondContact O-CG 3.29Å; S240-Q244 PolarHBondContact O-N 2.91Å
241	A	95	Very high	94.7	Very high	68 Å²	68	60.1 Å²	60.1	56%	0.562	36%	0.355	S	S	*	.	H	α-helix	trans	-58.9	-40.7	-177.2	0	0	0	0	0	111.9	G239 S245	G239-A241 VanDerWaalsContact C-N 3.31Å; G239-A241 PolarHBondContact O-N 2.91Å; A241-S245 WeakPolarHBondContact O-CB 3.22Å; A241-S245 PolarHBondContact O-N 3.47Å
242	F	96.3	Very high	94.5	Very high	57 Å²	57	62.5 Å²	62.5	25%	0.25	37%	0.367	C	S	.	.	H	α-helix	trans	-60.8	-50.9	174.8	173.7	-101.9	0	0	0	111.8	L234 G238 S240 Q244 S245 M254	L234-F242 HydrophobicContact CB-CD1 4.43Å; L234-F242 HydrophobicContact CB-CE1 4.02Å; L234-F242 HydrophobicContact CD1-CE1 4.16Å; L234-F242 HydrophobicContact CD1-CZ 4.21Å; L234-F242 HydrophobicContact CD2-CZ 4.38Å; G238-F242 PolarHBondContact O-N 3.04Å; S240-F242 VanDerWaalsContact C-N 3.29Å; S240-F242 PolarHBondContact O-N 3.21Å; F242-Q244 VanDerWaalsContact C-N 3.32Å; F242-Q244 PolarHBondContact O-N 3.38Å; F242-S245 WeakPolarHBondContact O-CB 3Å; F242-S245 PolarHBondContact O-N 2.84Å; F242-S245 PolarHBondContact O-OG 3Å; F242-M254 HydrophobicContact CE1-CE 4.27Å; F242-M254 HydrophobicContact CE2-CE 3.97Å; F242-M254 HydrophobicContact CZ-CE 3.54Å; F242-M254 WeakPolarHBondContact O-CB 3.5Å; F242-M254 WeakPolarHBondContact O-CG 3.25Å
243	W	96.3	Very high	94.4	Very high	7 Å²	7	65.7 Å²	65.7	3%	0.027	38%	0.382	C	S	.	.	H	α-helix	trans	-70.5	-26.5	-176.6	-66.4	117.5	0	0	0	114.1	A180 V181 M231 L234 S240 M254 K255 P258	A180-W243 VanDerWaalsContact O-CD1 3.24Å; A180-W243 PolarHBondContact O-NE1 3.46Å; A180-W243 VanDerWaalsContact O-NE1 3.12Å; V181-W243 HydrophobicContact CB-CD2 4.06Å; V181-W243 HydrophobicContact CB-CE3 4.2Å; V181-W243 HydrophobicContact CB-CG 4.39Å; V181-W243 HydrophobicContact CG1-CD2 3.89Å; V181-W243 HydrophobicContact CG1-CE3 3.92Å; V181-W243 HydrophobicContact CG1-CH2 3.78Å; V181-W243 HydrophobicContact CG1-CZ2 3.75Å; V181-W243 HydrophobicContact CG1-CZ3 3.87Å; M231-W243 HydrophobicContact CB-CH2 4.36Å; M231-W243 HydrophobicContact CB-CZ2 4.3Å; M231-W243 HydrophobicContact CE-CH2 4.46Å; M231-W243 HydrophobicContact CG-CH2 4.26Å; L234-W243 HydrophobicContact CB-CZ2 4.02Å; L234-W243 HydrophobicContact CD1-CH2 4.42Å; S240-W243 PolarHBondContact O-N 3.29Å; S240-W243 VanDerWaalsContact O-N 3.15Å; W243-M254 HydrophobicContact CE3-CB 4.31Å; W243-M254 PolarHBondContact O-N 3.23Å; W243-K255 HydrophobicContact CB-CB 4.25Å; W243-K255 PolarHBondContact O-N 3.03Å; W243-P258 HydrophobicContact CH2-CG 4.24Å; W243-P258 HydrophobicContact CZ3-CG 3.82Å
244	Q	94.2	Very high	94.3	Very high	88 Å²	88	63.9 Å²	63.9	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-86.3	-14.3	175.3	-65.7	-179.7	9.6	0	0	113.2	S240 F242	S240-Q244 WeakPolarHBondContact O-CB 3.38Å; S240-Q244 VanDerWaalsContact O-CG 3.31Å; S240-Q244 WeakPolarHBondContact O-CG 3.29Å; S240-Q244 PolarHBondContact O-N 2.91Å; F242-Q244 VanDerWaalsContact C-N 3.32Å; F242-Q244 PolarHBondContact O-N 3.38Å
245	S	95.7	Very high	94.1	Very high	49 Å²	49	60.6 Å²	60.6	34%	0.343	36%	0.355	S	S	.	.			trans	-61.6	142.5	179	71.4	0	0	0	0	111.7	A241 F242 Q253 M254	A241-S245 WeakPolarHBondContact O-CB 3.22Å; A241-S245 PolarHBondContact O-N 3.47Å; F242-S245 WeakPolarHBondContact O-CB 3Å; F242-S245 PolarHBondContact O-N 2.84Å; F242-S245 PolarHBondContact O-OG 3Å; S245-Q253 CarbonylContact O-C 3.57Å; S245-Q253 WeakPolarHBondContact O-CA 3.26Å; S245-M254 PolarHBondContact O-N 3.4Å; S245-M254 VanDerWaalsContact OG-CG 3.24Å; S245-M254 WeakPolarHBondContact OG-CG 3.44Å
246	L	96.2	Very high	94.1	Very high	96 Å²	96	61.7 Å²	61.7	50%	0.503	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-86.1	137.7	177.8	-67	172.8	0	0	0	110.3	P248 Q253	L246-P248 VanDerWaalsContact O-CD 3.31Å; L246-P248 WeakPolarHBondContact O-CD 3.19Å; L246-Q253 HydrophobicContact CD2-CG 3.97Å
247	I	93.4	Very high	94	Very high	34 Å²	34	64.4 Å²	64.4	17%	0.174	37%	0.373	C	S	.	.			trans	-75.6	116	170	-56.4	173	0	0	0	107.9	V249 L250 N251 I252 M254 I257	I247-V249 PolarHBondContact O-N 3.02Å; I247-L250 HydrophobicContact CB-CB 4.33Å; I247-L250 HydrophobicContact CD1-CD1 4.35Å; I247-L250 HydrophobicContact CG2-CB 4.3Å; I247-L250 HydrophobicContact CG2-CD1 4.31Å; I247-L250 HydrophobicContact CG2-CG 4.3Å; I247-L250 PolarHBondContact O-N 2.78Å; I247-L250 VanDerWaalsContact O-N 3.13Å; I247-N251 PolarHBondContact O-N 3.44Å; I247-I252 HydrophobicContact CD1-CD1 4.01Å; I247-I252 HydrophobicContact CD1-CG1 3.67Å; I247-I252 HydrophobicContact CG1-CG1 4.33Å; I247-I252 PolarHBondContact N-O 3.2Å; I247-M254 HydrophobicContact CD1-SD 3.87Å; I247-M254 HydrophobicContact CG1-CG 4.37Å; I247-M254 HydrophobicContact CG1-SD 3.53Å; I247-M254 VanDerWaalsContact CG1-SD 3.53Å; I247-I257 HydrophobicContact CD1-CD1 3.63Å; I247-I257 HydrophobicContact CD1-CG1 3.87Å
248	P	85.7	Confident	94	Very high	134 Å²	134	58.4 Å²	58.4	87%	0.87	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-17.5	-167.6	-29.2	36.4	0	0	0	116.7	L246	L246-P248 VanDerWaalsContact O-CD 3.31Å; L246-P248 WeakPolarHBondContact O-CD 3.19Å
249	V	90.3	Very high	94.1	Very high	135 Å²	135	57.1 Å²	57.1	82%	0.818	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-34.9	-179.7	-178.3	0	0	0	0	112.7	I247	I247-V249 PolarHBondContact O-N 3.02Å
250	L	89.9	Confident	94.3	Very high	111 Å²	111	59.7 Å²	59.7	58%	0.581	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-16.9	-172.4	-63.1	177.5	0	0	0	112.9	I247 I252	I247-L250 HydrophobicContact CB-CB 4.33Å; I247-L250 HydrophobicContact CD1-CD1 4.35Å; I247-L250 HydrophobicContact CG2-CB 4.3Å; I247-L250 HydrophobicContact CG2-CD1 4.31Å; I247-L250 HydrophobicContact CG2-CG 4.3Å; I247-L250 PolarHBondContact O-N 2.78Å; I247-L250 VanDerWaalsContact O-N 3.13Å; L250-I252 HydrophobicContact CB-CD1 4.19Å; L250-I252 HydrophobicContact CB-CG1 3.87Å; L250-I252 HydrophobicContact CD1-CD1 3.99Å; L250-I252 HydrophobicContact CD1-CG1 4.43Å; L250-I252 PolarHBondContact O-N 2.99Å
251	N	92.4	Very high	94.5	Very high	125 Å²	125	61.4 Å²	61.4	67%	0.668	35%	0.345	S	S	*	.			trans	52.9	32.3	-174.3	-160	37.7	0	0	0	113.6	I247	I247-N251 PolarHBondContact O-N 3.44Å
252	I	94.2	Very high	94.6	Very high	54 Å²	54	60 Å²	60	28%	0.277	33%	0.33	S	S	.	.			trans	-110	148.8	172.1	66.9	179.1	0	0	0	109.4	I247 L250 I260	I247-I252 HydrophobicContact CD1-CD1 4.01Å; I247-I252 HydrophobicContact CD1-CG1 3.67Å; I247-I252 HydrophobicContact CG1-CG1 4.33Å; I247-I252 PolarHBondContact N-O 3.2Å; L250-I252 HydrophobicContact CB-CD1 4.19Å; L250-I252 HydrophobicContact CB-CG1 3.87Å; L250-I252 HydrophobicContact CD1-CD1 3.99Å; L250-I252 HydrophobicContact CD1-CG1 4.43Å; L250-I252 PolarHBondContact O-N 2.99Å; I252-I260 HydrophobicContact CD1-CD1 4.27Å
253	Q	96	Very high	94.6	Very high	68 Å²	68	60.2 Å²	60.2	32%	0.318	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-70.6	145.1	174.3	-66.1	179.9	-14.4	0	0	110.7	S245 L246 K255 M256	S245-Q253 CarbonylContact O-C 3.57Å; S245-Q253 WeakPolarHBondContact O-CA 3.26Å; L246-Q253 HydrophobicContact CD2-CG 3.97Å; Q253-K255 HydrophobicContact CB-CG 3.93Å; Q253-K255 PolarHBondContact O-N 2.86Å; Q253-K255 VanDerWaalsContact O-N 3.14Å; Q253-M256 HydrophobicContact CB-CG 4.43Å; Q253-M256 VanDerWaalsContact O-CB 3.27Å; Q253-M256 WeakPolarHBondContact O-CB 3.34Å; Q253-M256 WeakPolarHBondContact O-CG 3.21Å; Q253-M256 PolarHBondContact O-N 2.99Å
254	M	95.9	Very high	94.7	Very high	41 Å²	41	65 Å²	65	20%	0.202	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-33.9	178.7	-77.1	-62.5	-69.7	0	0	113.4	F242 W243 S245 I247 M256 I257 P258	F242-M254 HydrophobicContact CE1-CE 4.27Å; F242-M254 HydrophobicContact CE2-CE 3.97Å; F242-M254 HydrophobicContact CZ-CE 3.54Å; F242-M254 WeakPolarHBondContact O-CB 3.5Å; F242-M254 WeakPolarHBondContact O-CG 3.25Å; W243-M254 HydrophobicContact CE3-CB 4.31Å; W243-M254 PolarHBondContact O-N 3.23Å; S245-M254 PolarHBondContact O-N 3.4Å; S245-M254 VanDerWaalsContact OG-CG 3.24Å; S245-M254 WeakPolarHBondContact OG-CG 3.44Å; I247-M254 HydrophobicContact CD1-SD 3.87Å; I247-M254 HydrophobicContact CG1-CG 4.37Å; I247-M254 HydrophobicContact CG1-SD 3.53Å; I247-M254 VanDerWaalsContact CG1-SD 3.53Å; M254-M256 PolarHBondContact O-N 3.49Å; M254-M256 VanDerWaalsContact O-N 3.12Å; M254-I257 HydrophobicContact CE-CD1 3.73Å; M254-I257 PolarHBondContact O-N 3.17Å; M254-I257 HydrophobicContact SD-CD1 3.67Å; M254-P258 WeakPolarHBondContact O-CD 3.18Å
255	K	95.1	Very high	94.8	Very high	1 Å²	1	62.1 Å²	62.1	0%	0.004	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.3	174.9	71.3	179.6	75.1	-171.1	0	114.4	V181 Q182 T185 W243 Q253 I257 P258	V181-K255 HydrophobicContact CB-CB 4.37Å; V181-K255 WeakPolarHBondContact O-CB 3.37Å; Q182-K255 PolarHBondContact O-NZ 3.15Å; T185-K255 PolarHBondContact OG1-NZ 2.84Å; W243-K255 HydrophobicContact CB-CB 4.25Å; W243-K255 PolarHBondContact O-N 3.03Å; Q253-K255 HydrophobicContact CB-CG 3.93Å; Q253-K255 PolarHBondContact O-N 2.86Å; Q253-K255 VanDerWaalsContact O-N 3.14Å; K255-I257 VanDerWaalsContact C-N 3.33Å; K255-P258 WeakPolarHBondContact O-CD 3.49Å
256	M	96.6	Very high	94.8	Very high	24 Å²	24	60.3 Å²	60.3	12%	0.118	34%	0.341	C	S	.	.	H	α-helix	trans	-76	-22.5	177.5	-60.5	-47.8	-54.9	0	0	112.3	W189 Q253 M254 A259 I260	W189-M256 VanDerWaalsContact CD1-CE 3.49Å; W189-M256 HydrophobicContact CD2-CE 3.73Å; W189-M256 VanDerWaalsContact CE2-CE 3.42Å; W189-M256 HydrophobicContact CG-CE 3.75Å; W189-M256 HydrophobicContact CZ2-CE 4.01Å; W189-M256 VanDerWaalsContact NE1-CE 3.27Å; Q253-M256 HydrophobicContact CB-CG 4.43Å; Q253-M256 VanDerWaalsContact O-CB 3.27Å; Q253-M256 WeakPolarHBondContact O-CB 3.34Å; Q253-M256 WeakPolarHBondContact O-CG 3.21Å; Q253-M256 PolarHBondContact O-N 2.99Å; M254-M256 PolarHBondContact O-N 3.49Å; M254-M256 VanDerWaalsContact O-N 3.12Å; M256-A259 HydrophobicContact CE-CB 4.32Å; M256-A259 PolarHBondContact O-N 2.88Å; M256-I260 HydrophobicContact CB-CD1 4.4Å; M256-I260 WeakPolarHBondContact O-CB 3.41Å; M256-I260 VanDerWaalsContact O-CG1 3.25Å; M256-I260 WeakPolarHBondContact O-CG1 3.23Å; M256-I260 PolarHBondContact O-N 3.26Å
257	I	95.8	Very high	94.8	Very high	64 Å²	64	60.4 Å²	60.4	33%	0.328	34%	0.341	S	S	.	.	H	α-helix	trans	-60.9	-55.3	178.8	-60.1	173.9	0	0	0	110.5	I247 M254 K255 A259 I260 C261	I247-I257 HydrophobicContact CD1-CD1 3.63Å; I247-I257 HydrophobicContact CD1-CG1 3.87Å; M254-I257 HydrophobicContact CE-CD1 3.73Å; M254-I257 PolarHBondContact O-N 3.17Å; M254-I257 HydrophobicContact SD-CD1 3.67Å; K255-I257 VanDerWaalsContact C-N 3.33Å; I257-A259 VanDerWaalsContact C-N 3.25Å; I257-A259 PolarHBondContact O-N 3.38Å; I257-I260 PolarHBondContact O-N 2.85Å; I257-C261 WeakPolarHBondContact O-CB 3.19Å; I257-C261 PolarHBondContact O-N 2.77Å; I257-C261 PolarHBondContact O-SG 3.44Å
258	P	96.1	Very high	94.9	Very high	9 Å²	9	63.7 Å²	63.7	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-58.5	-35	177.3	-25.7	35.6	0	0	0	113.9	V181 M231 W243 M254 K255 C261 T262	V181-P258 HydrophobicContact CG1-CG 4.2Å; M231-P258 HydrophobicContact CE-CB 3.56Å; M231-P258 HydrophobicContact CE-CG 3.59Å; M231-P258 HydrophobicContact SD-CB 4.2Å; M231-P258 HydrophobicContact SD-CG 4.31Å; W243-P258 HydrophobicContact CH2-CG 4.24Å; W243-P258 HydrophobicContact CZ3-CG 3.82Å; M254-P258 WeakPolarHBondContact O-CD 3.18Å; K255-P258 WeakPolarHBondContact O-CD 3.49Å; P258-C261 PolarHBondContact O-N 2.91Å; P258-T262 WeakPolarHBondContact O-CB 3.34Å; P258-T262 PolarHBondContact O-N 3.43Å; P258-T262 PolarHBondContact O-OG1 2.84Å
259	A	96.4	Very high	95.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-44	178.3	0	0	0	0	0	112.1	L183 W189 M256 I257 T262 L263	L183-A259 HydrophobicContact CD2-CB 4.47Å; W189-A259 HydrophobicContact CD2-CB 4.14Å; W189-A259 HydrophobicContact CE3-CB 3.65Å; W189-A259 HydrophobicContact CZ3-CB 4.12Å; M256-A259 HydrophobicContact CE-CB 4.32Å; M256-A259 PolarHBondContact O-N 2.88Å; I257-A259 VanDerWaalsContact C-N 3.25Å; I257-A259 PolarHBondContact O-N 3.38Å; A259-T262 WeakPolarHBondContact O-CB 3.44Å; A259-T262 PolarHBondContact O-N 3.22Å; A259-L263 PolarHBondContact O-N 3.5Å
260	I	96.8	Very high	95.5	Very high	64 Å²	64	53 Å²	53	33%	0.328	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-41.8	174	-66.8	164.8	0	0	0	110.5	I252 M256 I257 T262 L263 L264	I252-I260 HydrophobicContact CD1-CD1 4.27Å; M256-I260 HydrophobicContact CB-CD1 4.4Å; M256-I260 WeakPolarHBondContact O-CB 3.41Å; M256-I260 VanDerWaalsContact O-CG1 3.25Å; M256-I260 WeakPolarHBondContact O-CG1 3.23Å; M256-I260 PolarHBondContact O-N 3.26Å; I257-I260 PolarHBondContact O-N 2.85Å; I260-T262 VanDerWaalsContact C-N 3.29Å; I260-T262 PolarHBondContact O-N 3.04Å; I260-L263 WeakPolarHBondContact O-CB 3.29Å; I260-L263 PolarHBondContact O-N 3.27Å; I260-L263 VanDerWaalsContact O-N 3.17Å; I260-L264 HydrophobicContact CG2-CD1 4.05Å; I260-L264 HydrophobicContact CG2-CG 4.31Å; I260-L264 WeakPolarHBondContact O-CG 3.42Å; I260-L264 PolarHBondContact O-N 3.22Å
261	C	96.2	Very high	95.7	Very high	60 Å²	60	52 Å²	52	41%	0.405	29%	0.287	S	S	.	.	H	α-helix	trans	-59.1	-40.9	173.6	-70.9	0	0	0	0	111.6	I257 P258 L264 G265	I257-C261 WeakPolarHBondContact O-CB 3.19Å; I257-C261 PolarHBondContact O-N 2.77Å; I257-C261 PolarHBondContact O-SG 3.44Å; P258-C261 PolarHBondContact O-N 2.91Å; C261-L264 PolarHBondContact O-N 3.34Å; C261-G265 PolarHBondContact O-N 3.12Å
262	T	96.8	Very high	95.7	Very high	40 Å²	40	49 Å²	49	25%	0.245	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-42.4	175.2	-58.3	0	0	0	0	111.1	F192 C193 A196 P258 A259 I260 A266	F192-T262 HydrophobicContact CE1-CG2 4.33Å; C193-T262 HydrophobicContact CB-CG2 4.27Å; A196-T262 HydrophobicContact CB-CG2 4.25Å; P258-T262 WeakPolarHBondContact O-CB 3.34Å; P258-T262 PolarHBondContact O-N 3.43Å; P258-T262 PolarHBondContact O-OG1 2.84Å; A259-T262 WeakPolarHBondContact O-CB 3.44Å; A259-T262 PolarHBondContact O-N 3.22Å; I260-T262 VanDerWaalsContact C-N 3.29Å; I260-T262 PolarHBondContact O-N 3.04Å; T262-A266 WeakPolarHBondContact O-CB 3.27Å; T262-A266 PolarHBondContact O-N 3.44Å
263	L	97.6	Very high	95.8	Very high	60 Å²	60	47.8 Å²	47.8	31%	0.314	26%	0.263	S	S	.	.	H	α-helix	trans	-62.2	-50.8	175.9	175.2	63.7	0	0	0	112.2	W189 F192 A259 I260 A266 I267	W189-L263 HydrophobicContact CH2-CD2 4.26Å; W189-L263 HydrophobicContact CZ3-CB 4.5Å; F192-L263 HydrophobicContact CE1-CB 3.81Å; F192-L263 HydrophobicContact CE1-CD1 4.12Å; F192-L263 HydrophobicContact CE2-CD1 4.14Å; F192-L263 HydrophobicContact CZ-CB 4.01Å; F192-L263 HydrophobicContact CZ-CD1 3.49Å; F192-L263 VanDerWaalsContact CZ-CD1 3.49Å; F192-L263 HydrophobicContact CZ-CG 4.36Å; A259-L263 PolarHBondContact O-N 3.5Å; I260-L263 WeakPolarHBondContact O-CB 3.29Å; I260-L263 PolarHBondContact O-N 3.27Å; I260-L263 VanDerWaalsContact O-N 3.17Å; L263-A266 PolarHBondContact O-N 2.86Å; L263-I267 HydrophobicContact CD1-CD1 4.09Å; L263-I267 HydrophobicContact CD1-CG1 4.47Å; L263-I267 HydrophobicContact CG-CD1 4.15Å; L263-I267 WeakPolarHBondContact O-CG1 3.32Å; L263-I267 PolarHBondContact O-N 3.25Å
264	L	97.2	Very high	95.8	Very high	108 Å²	108	47 Å²	47	57%	0.565	26%	0.258	S	S	*	.	H	α-helix	trans	-64.3	-42.2	179.6	-65.8	177	0	0	0	111.5	I260 C261 A266 I267 F268	I260-L264 HydrophobicContact CG2-CD1 4.05Å; I260-L264 HydrophobicContact CG2-CG 4.31Å; I260-L264 WeakPolarHBondContact O-CG 3.42Å; I260-L264 PolarHBondContact O-N 3.22Å; C261-L264 PolarHBondContact O-N 3.34Å; L264-A266 VanDerWaalsContact C-N 3.34Å; L264-I267 PolarHBondContact O-N 3.07Å; L264-F268 WeakPolarHBondContact O-CB 3.46Å; L264-F268 PolarHBondContact O-N 2.93Å
265	G	95.6	Very high	95.8	Very high	27 Å²	27	53.7 Å²	53.7	28%	0.278	28%	0.281	S	S	.	.	H	α-helix	trans	-61.8	-40.6	174.7	0	0	0	0	0	112.3	C261 F268 S269	C261-G265 PolarHBondContact O-N 3.12Å; G265-F268 PolarHBondContact O-N 3.45Å; G265-S269 WeakPolarHBondContact O-CB 3.42Å; G265-S269 PolarHBondContact O-N 3.12Å; G265-S269 PolarHBondContact O-OG 3.29Å
266	A	96	Very high	95.8	Very high	12 Å²	12	54.7 Å²	54.7	10%	0.099	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-46.2	174.5	0	0	0	0	0	111.8	M200 T262 L263 L264 F268 S269 C270	M200-A266 HydrophobicContact CG-CB 4.45Å; M200-A266 VanDerWaalsContact SD-CA 3.52Å; M200-A266 HydrophobicContact SD-CB 3.87Å; T262-A266 WeakPolarHBondContact O-CB 3.27Å; T262-A266 PolarHBondContact O-N 3.44Å; L263-A266 PolarHBondContact O-N 2.86Å; L264-A266 VanDerWaalsContact C-N 3.34Å; A266-F268 VanDerWaalsContact C-N 3.35Å; A266-F268 PolarHBondContact O-N 2.85Å; A266-S269 PolarHBondContact O-N 3.25Å; A266-C270 WeakPolarHBondContact O-CB 3.39Å; A266-C270 PolarHBondContact O-N 3.28Å; A266-C270 PolarHBondContact O-SG 2.9Å
267	I	96.3	Very high	95.8	Very high	97 Å²	97	53.5 Å²	53.5	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-58.5	-48.4	176	-68	165.6	0	0	0	110.4	L263 L264 T271	L263-I267 HydrophobicContact CD1-CD1 4.09Å; L263-I267 HydrophobicContact CD1-CG1 4.47Å; L263-I267 HydrophobicContact CG-CD1 4.15Å; L263-I267 WeakPolarHBondContact O-CG1 3.32Å; L263-I267 PolarHBondContact O-N 3.25Å; L264-I267 PolarHBondContact O-N 3.07Å; I267-T271 WeakPolarHBondContact O-CB 3.42Å; I267-T271 PolarHBondContact O-N 3.17Å; I267-T271 PolarHBondContact O-OG1 3.41Å
268	F	95.1	Very high	95.8	Very high	104 Å²	104	56.6 Å²	56.6	46%	0.456	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-51.6	-179.9	178.6	-100.9	0	0	0	112.2	L264 G265 A266 T271 N272	L264-F268 WeakPolarHBondContact O-CB 3.46Å; L264-F268 PolarHBondContact O-N 2.93Å; G265-F268 PolarHBondContact O-N 3.45Å; A266-F268 VanDerWaalsContact C-N 3.35Å; A266-F268 PolarHBondContact O-N 2.85Å; F268-T271 PolarHBondContact O-N 2.8Å; F268-N272 WeakPolarHBondContact CE1-ND2 3.38Å; F268-N272 WeakPolarHBondContact CZ-ND2 3.17Å; F268-N272 PolarHBondContact O-N 3.23Å; F268-N272 PolarHBondContact O-ND2 2.93Å
269	S	94.3	Very high	95.7	Very high	23 Å²	23	61.6 Å²	61.6	16%	0.161	32%	0.323	C	S	.	.	H	α-helix	trans	-65.9	-46.1	-177.5	-54.8	0	0	0	0	111.5	G265 A266 T271 N272 Y273	G265-S269 WeakPolarHBondContact O-CB 3.42Å; G265-S269 PolarHBondContact O-N 3.12Å; G265-S269 PolarHBondContact O-OG 3.29Å; A266-S269 PolarHBondContact O-N 3.25Å; S269-T271 VanDerWaalsContact C-N 3.32Å; S269-T271 PolarHBondContact O-N 3.14Å; S269-N272 PolarHBondContact O-N 3.16Å; S269-N272 VanDerWaalsContact O-N 3.14Å; S269-Y273 WeakPolarHBondContact O-CD2 3.26Å; S269-Y273 VanDerWaalsContact O-CG 3.28Å; S269-Y273 PolarHBondContact O-N 2.99Å
270	C	94.6	Very high	95.5	Very high	22 Å²	22	62.6 Å²	62.6	15%	0.149	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-40	175.9	-71.2	0	0	0	0	111.6	A266 N272 Y273 F274	A266-C270 WeakPolarHBondContact O-CB 3.39Å; A266-C270 PolarHBondContact O-N 3.28Å; A266-C270 PolarHBondContact O-SG 2.9Å; C270-N272 VanDerWaalsContact C-N 3.27Å; C270-N272 PolarHBondContact O-N 2.89Å; C270-Y273 PolarHBondContact O-N 3.39Å; C270-F274 HydrophobicContact CB-CD2 4.07Å; C270-F274 HydrophobicContact CB-CE2 4.32Å; C270-F274 WeakPolarHBondContact O-CB 3.45Å; C270-F274 VanDerWaalsContact O-CD2 3.26Å; C270-F274 WeakPolarHBondContact O-CD2 3.45Å; C270-F274 PolarHBondContact O-N 3.49Å
271	T	94.4	Very high	95.3	Very high	89 Å²	89	60.5 Å²	60.5	55%	0.546	33%	0.328	S	S	.	.	H	α-helix	trans	-56.9	-44.1	175.1	-59.8	0	0	0	0	111.3	I267 F268 S269 R275	I267-T271 WeakPolarHBondContact O-CB 3.42Å; I267-T271 PolarHBondContact O-N 3.17Å; I267-T271 PolarHBondContact O-OG1 3.41Å; F268-T271 PolarHBondContact O-N 2.8Å; S269-T271 VanDerWaalsContact C-N 3.32Å; S269-T271 PolarHBondContact O-N 3.14Å; T271-R275 VanDerWaalsContact O-CB 3.29Å; T271-R275 WeakPolarHBondContact O-CB 3.35Å; T271-R275 PolarHBondContact O-N 3.16Å
272	N	93.8	Very high	95.2	Very high	63 Å²	63	62 Å²	62	34%	0.337	34%	0.335	S	S	.	.	H	α-helix	trans	-67	-47.3	177.2	-67.7	-36.2	0	0	0	112.2	F268 S269 C270 R275 V276	F268-N272 WeakPolarHBondContact CE1-ND2 3.38Å; F268-N272 WeakPolarHBondContact CZ-ND2 3.17Å; F268-N272 PolarHBondContact O-N 3.23Å; F268-N272 PolarHBondContact O-ND2 2.93Å; S269-N272 PolarHBondContact O-N 3.16Å; S269-N272 VanDerWaalsContact O-N 3.14Å; C270-N272 VanDerWaalsContact C-N 3.27Å; C270-N272 PolarHBondContact O-N 2.89Å; N272-R275 WeakPolarHBondContact O-CB 3.33Å; N272-R275 PolarHBondContact O-N 3.46Å; N272-V276 PolarHBondContact O-N 3.45Å
273	Y	95.8	Very high	95	Very high	28 Å²	28	61 Å²	61	11%	0.11	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-49	178.6	-62.6	-38.2	0	0	0	112	C203 A204 Q207 S269 C270 R275 V276 I277	C203-Y273 HydrophobicContact CB-CD2 3.42Å; C203-Y273 VanDerWaalsContact CB-CD2 3.42Å; C203-Y273 HydrophobicContact CB-CE2 4.02Å; C203-Y273 HydrophobicContact CB-CG 3.97Å; A204-Y273 HydrophobicContact CB-CE1 4.18Å; Q207-Y273 HydrophobicContact CB-CD1 4.49Å; S269-Y273 WeakPolarHBondContact O-CD2 3.26Å; S269-Y273 VanDerWaalsContact O-CG 3.28Å; S269-Y273 PolarHBondContact O-N 2.99Å; C270-Y273 PolarHBondContact O-N 3.39Å; Y273-R275 VanDerWaalsContact C-N 3.32Å; Y273-R275 PolarHBondContact O-N 2.87Å; Y273-V276 PolarHBondContact O-N 2.96Å; Y273-V276 VanDerWaalsContact O-N 3.1Å; Y273-I277 VanDerWaalsContact O-CG1 3.3Å; Y273-I277 WeakPolarHBondContact O-CG1 3.4Å; Y273-I277 PolarHBondContact O-N 3.08Å
274	F	96	Very high	94.5	Very high	51 Å²	51	66.2 Å²	66.2	22%	0.224	35%	0.353	C	S	.	.	H	α-helix	trans	-67	-33.7	-179	-83	-75.8	0	0	0	112.2	F199 W206 C270 V276 I277 F278	F199-F274 HydrophobicContact CE1-CE2 4.43Å; F199-F274 HydrophobicContact CZ-CE2 4.21Å; F199-F274 HydrophobicContact CZ-CZ 4.22Å; W206-F274 AromaticContact CH2-CE1 3.83Å; W206-F274 HydrophobicContact CH2-CE1 3.83Å; W206-F274 HydrophobicContact CH2-CZ 4.17Å; W206-F274 HydrophobicContact CZ2-CE1 4.46Å; W206-F274 HydrophobicContact CZ3-CE1 4.1Å; W206-F274 AromaticContact CZ3-CZ 4Å; W206-F274 HydrophobicContact CZ3-CZ 4Å; C270-F274 HydrophobicContact CB-CD2 4.07Å; C270-F274 HydrophobicContact CB-CE2 4.32Å; C270-F274 WeakPolarHBondContact O-CB 3.45Å; C270-F274 VanDerWaalsContact O-CD2 3.26Å; C270-F274 WeakPolarHBondContact O-CD2 3.45Å; C270-F274 PolarHBondContact O-N 3.49Å; F274-V276 VanDerWaalsContact C-N 3.29Å; F274-V276 PolarHBondContact O-N 3.12Å; F274-I277 HydrophobicContact CD1-CD1 4.27Å; F274-I277 HydrophobicContact CE1-CD1 4.45Å; F274-I277 PolarHBondContact O-N 3.38Å; F274-F278 HydrophobicContact CB-CD2 4.14Å; F274-F278 HydrophobicContact CB-CE2 3.96Å; F274-F278 HydrophobicContact CD1-CD2 4.36Å; F274-F278 AromaticContact CD1-CE2 3.61Å; F274-F278 HydrophobicContact CD1-CE2 3.61Å; F274-F278 AromaticContact CD1-CZ 3.95Å; F274-F278 HydrophobicContact CD1-CZ 3.95Å; F274-F278 HydrophobicContact CG-CE2 4.2Å; F274-F278 WeakPolarHBondContact O-CB 3.45Å; F274-F278 WeakPolarHBondContact O-CD2 3.45Å; F274-F278 WeakPolarHBondContact O-CG 3.4Å; F274-F278 PolarHBondContact O-N 2.8Å
275	R	95.8	Very high	94.2	Very high	181 Å²	181	68.6 Å²	68.6	68%	0.683	37%	0.366	S	S	*	.	H	α-helix	trans	-55.5	-47.2	170	-177.2	-177.3	178.3	-170.7	0.5	110.9	T271 N272 Y273 T279	T271-R275 VanDerWaalsContact O-CB 3.29Å; T271-R275 WeakPolarHBondContact O-CB 3.35Å; T271-R275 PolarHBondContact O-N 3.16Å; N272-R275 WeakPolarHBondContact O-CB 3.33Å; N272-R275 PolarHBondContact O-N 3.46Å; Y273-R275 VanDerWaalsContact C-N 3.32Å; Y273-R275 PolarHBondContact O-N 2.87Å; R275-T279 WeakPolarHBondContact O-CB 3.4Å; R275-T279 PolarHBondContact O-N 3.18Å; R275-T279 PolarHBondContact O-OG1 2.91Å
276	V	94.5	Very high	94	Very high	22 Å²	22	69.3 Å²	69.3	13%	0.133	37%	0.373	C	S	.	.	H	α-helix	trans	-70.2	-40.5	178.1	-179.7	0	0	0	0	111.7	Q207 N272 Y273 F274 F278 T279 G280	Q207-V276 HydrophobicContact CG-CB 4.35Å; Q207-V276 HydrophobicContact CG-CG1 3.93Å; N272-V276 PolarHBondContact O-N 3.45Å; Y273-V276 PolarHBondContact O-N 2.96Å; Y273-V276 VanDerWaalsContact O-N 3.1Å; F274-V276 VanDerWaalsContact C-N 3.29Å; F274-V276 PolarHBondContact O-N 3.12Å; V276-F278 VanDerWaalsContact C-N 3.31Å; V276-F278 PolarHBondContact O-N 2.91Å; V276-T279 PolarHBondContact O-N 3.15Å; V276-G280 VanDerWaalsContact O-CA 3.24Å; V276-G280 WeakPolarHBondContact O-CA 3.48Å; V276-G280 PolarHBondContact O-N 3.12Å
277	I	96.1	Very high	93.9	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-40.5	178.1	-70.7	161.6	0	0	0	111.5	W206 Q207 V210 Y273 F274 V294	W206-I277 HydrophobicContact CB-CD1 4.31Å; W206-I277 HydrophobicContact CD2-CD1 3.69Å; W206-I277 HydrophobicContact CD2-CG1 4.49Å; W206-I277 HydrophobicContact CE3-CD1 4.16Å; W206-I277 HydrophobicContact CG-CD1 3.79Å; W206-I277 HydrophobicContact CG-CG1 4.27Å; W206-I277 HydrophobicContact CZ2-CD1 4.43Å; W206-I277 HydrophobicContact CZ2-CG2 4.01Å; Q207-I277 HydrophobicContact CB-CG1 4.46Å; V210-I277 HydrophobicContact CG2-CG1 4.41Å; V210-I277 HydrophobicContact CG2-CG2 4.32Å; Y273-I277 VanDerWaalsContact O-CG1 3.3Å; Y273-I277 WeakPolarHBondContact O-CG1 3.4Å; Y273-I277 PolarHBondContact O-N 3.08Å; F274-I277 HydrophobicContact CD1-CD1 4.27Å; F274-I277 HydrophobicContact CE1-CD1 4.45Å; F274-I277 PolarHBondContact O-N 3.38Å; I277-V294 HydrophobicContact CG2-CB 4.33Å
278	F	95.8	Very high	93.9	Very high	129 Å²	129	64.9 Å²	64.9	57%	0.566	35%	0.35	S	S	*	.	H	α-helix	trans	-82.8	-21.8	-178.2	-69.4	-55	0	0	0	114.6	F274 V276 L295	F274-F278 HydrophobicContact CB-CD2 4.14Å; F274-F278 HydrophobicContact CB-CE2 3.96Å; F274-F278 HydrophobicContact CD1-CD2 4.36Å; F274-F278 AromaticContact CD1-CE2 3.61Å; F274-F278 HydrophobicContact CD1-CE2 3.61Å; F274-F278 AromaticContact CD1-CZ 3.95Å; F274-F278 HydrophobicContact CD1-CZ 3.95Å; F274-F278 HydrophobicContact CG-CE2 4.2Å; F274-F278 WeakPolarHBondContact O-CB 3.45Å; F274-F278 WeakPolarHBondContact O-CD2 3.45Å; F274-F278 WeakPolarHBondContact O-CG 3.4Å; F274-F278 PolarHBondContact O-N 2.8Å; V276-F278 VanDerWaalsContact C-N 3.31Å; V276-F278 PolarHBondContact O-N 2.91Å; F278-L295 HydrophobicContact CE1-CD1 4.41Å; F278-L295 HydrophobicContact CE1-CD2 3.65Å; F278-L295 HydrophobicContact CE1-CG 4.27Å; F278-L295 HydrophobicContact CZ-CD2 4.08Å
279	T	94.1	Very high	93.8	Very high	113 Å²	113	61.9 Å²	61.9	69%	0.693	34%	0.339	S	S	*	.	H	α-helix	trans	-121.6	-14	-172.3	65.1	0	0	0	0	114.8	R275 V276	R275-T279 WeakPolarHBondContact O-CB 3.4Å; R275-T279 PolarHBondContact O-N 3.18Å; R275-T279 PolarHBondContact O-OG1 2.91Å; V276-T279 PolarHBondContact O-N 3.15Å
280	G	92.1	Very high	93.7	Very high	22 Å²	22	62.1 Å²	62.1	23%	0.227	34%	0.342	C	S	.	.			trans	-107.3	15.6	-169.7	0	0	0	0	0	115.2	S211 V276 V282	S211-G280 VanDerWaalsContact CA-O 3.31Å; S211-G280 WeakPolarHBondContact CA-O 3.43Å; S211-G280 WeakPolarHBondContact CB-O 3.4Å; V276-G280 VanDerWaalsContact O-CA 3.24Å; V276-G280 WeakPolarHBondContact O-CA 3.48Å; V276-G280 PolarHBondContact O-N 3.12Å; G280-V282 PolarHBondContact O-N 3.36Å
281	G	94.4	Very high	93.6	Very high	20 Å²	20	63.4 Å²	63.4	21%	0.206	36%	0.359	C	S	.	.			trans	-64.9	122	-180	0	0	0	0	0	112.8	V210 S287	V210-G281 WeakPolarHBondContact O-CA 3.42Å; G281-S287 CarbonylContact C-O 3.13Å; G281-S287 WeakPolarHBondContact CA-O 3.46Å
282	V	94	Very high	93.6	Very high	90 Å²	90	60.3 Å²	60.3	55%	0.545	34%	0.34	S	S	.	.			trans	-94.9	-7.2	-178.4	-62.2	0	0	0	0	113.9	V210 S211 G280 S287 I289	V210-V282 PolarHBondContact O-N 3.34Å; S211-V282 WeakPolarHBondContact O-CG1 3.44Å; G280-V282 PolarHBondContact O-N 3.36Å; V282-S287 PolarHBondContact N-O 3.45Å; V282-I289 HydrophobicContact CG2-CB 4.41Å; V282-I289 HydrophobicContact CG2-CG1 4.39Å
283	G	91.1	Very high	93.6	Very high	19 Å²	19	60.9 Å²	60.9	20%	0.196	35%	0.349	C	S	.	.	S	Bend	trans	-75.2	176.5	177.4	0	0	0	0	0	113.5	N285 G286 S287 T288	G283-N285 PolarHBondContact O-N 3.44Å; G283-G286 PolarHBondContact O-N 3.41Å; G283-S287 VanDerWaalsContact C-OG 3.24Å; G283-S287 WeakPolarHBondContact CA-O 3.44Å; G283-S287 WeakPolarHBondContact CA-OG 3.37Å; G283-S287 PolarHBondContact N-O 2.76Å; G283-T288 VanDerWaalsContact CA-O 3.29Å; G283-T288 WeakPolarHBondContact CA-O 3.46Å
284	K	88.7	Confident	93.6	Very high	170 Å²	170	60.7 Å²	60.7	74%	0.739	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-54.1	127.7	176	-175.1	177.5	179.2	-179.8	0	110.5	G286 S287	K284-G286 VanDerWaalsContact C-N 3.28Å; K284-G286 PolarHBondContact O-N 3.05Å; K284-S287 PolarHBondContact N-OG 3.02Å; K284-S287 VanDerWaalsContact N-OG 3.08Å; K284-S287 VanDerWaalsContact O-CB 3.24Å; K284-S287 WeakPolarHBondContact O-CB 3.4Å; K284-S287 PolarHBondContact O-N 2.79Å; K284-S287 PolarHBondContact O-OG 3.35Å
285	N	90.3	Very high	93.5	Very high	159 Å²	159	61.8 Å²	61.8	85%	0.85	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	60.2	30.6	-177.2	-50.4	-25.7	0	0	0	114.4	G283 S287	G283-N285 PolarHBondContact O-N 3.44Å; N285-S287 VanDerWaalsContact C-N 3.31Å; N285-S287 PolarHBondContact O-N 3.47Å
286	G	90.9	Very high	93.4	Very high	41 Å²	41	54.5 Å²	54.5	42%	0.423	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	74.4	21.5	-178.9	0	0	0	0	0	113.8	G283 K284 V294	G283-G286 PolarHBondContact O-N 3.41Å; K284-G286 VanDerWaalsContact C-N 3.28Å; K284-G286 PolarHBondContact O-N 3.05Å; G286-V294 VanDerWaalsContact O-CG1 3.26Å; G286-V294 WeakPolarHBondContact O-CG1 3.46Å
287	S	94.7	Very high	93.5	Very high	16 Å²	16	53.5 Å²	53.5	11%	0.112	33%	0.329	C	S	.	.			trans	-75.6	179.7	175	55.2	0	0	0	0	112.1	G281 V282 G283 K284 N285 G291 T292	G281-S287 CarbonylContact C-O 3.13Å; G281-S287 WeakPolarHBondContact CA-O 3.46Å; V282-S287 PolarHBondContact N-O 3.45Å; G283-S287 VanDerWaalsContact C-OG 3.24Å; G283-S287 WeakPolarHBondContact CA-O 3.44Å; G283-S287 WeakPolarHBondContact CA-OG 3.37Å; G283-S287 PolarHBondContact N-O 2.76Å; K284-S287 PolarHBondContact N-OG 3.02Å; K284-S287 VanDerWaalsContact N-OG 3.08Å; K284-S287 VanDerWaalsContact O-CB 3.24Å; K284-S287 WeakPolarHBondContact O-CB 3.4Å; K284-S287 PolarHBondContact O-N 2.79Å; K284-S287 PolarHBondContact O-OG 3.35Å; N285-S287 VanDerWaalsContact C-N 3.31Å; N285-S287 PolarHBondContact O-N 3.47Å; S287-G291 WeakPolarHBondContact OG-CA 3.45Å; S287-T292 WeakPolarHBondContact CB-O 3.49Å
288	T	95.5	Very high	93.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	35%	0.347	C	S	.	.			trans	-63.7	169.5	172	65.9	0	0	0	0	111.5	Y209 V210 G283 A290 G291 T292 S293 V294	Y209-T288 HydrophobicContact CD1-CG2 3.69Å; Y209-T288 HydrophobicContact CE1-CG2 3.47Å; Y209-T288 VanDerWaalsContact CE1-CG2 3.47Å; V210-T288 HydrophobicContact CG2-CG2 4.07Å; G283-T288 VanDerWaalsContact CA-O 3.29Å; G283-T288 WeakPolarHBondContact CA-O 3.46Å; T288-A290 PolarHBondContact O-N 3.1Å; T288-A290 PolarHBondContact OG1-N 2.64Å; T288-G291 PolarHBondContact O-N 3.38Å; T288-T292 WeakPolarHBondContact CG2-O 3.27Å; T288-T292 PolarHBondContact N-O 2.96Å; T288-T292 PolarHBondContact OG1-N 3.46Å; T288-T292 PolarHBondContact OG1-O 3.12Å; T288-T292 PolarHBondContact OG1-OG1 2.87Å; T288-S293 WeakPolarHBondContact CG2-O 3.38Å; T288-V294 HydrophobicContact CG2-CG1 4.43Å
289	I	93.1	Very high	93.4	Very high	42 Å²	42	55.2 Å²	55.2	22%	0.215	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.7	175.2	-158.7	169.9	0	0	0	113.4	Y209 V282 K349	Y209-I289 HydrophobicContact CD2-CG2 4.03Å; Y209-I289 HydrophobicContact CE2-CG2 4.16Å; Y209-I289 WeakPolarHBondContact O-CG2 3.45Å; Y209-I289 PolarHBondContact O-N 3.47Å; V282-I289 HydrophobicContact CG2-CB 4.41Å; V282-I289 HydrophobicContact CG2-CG1 4.39Å; I289-K349 HydrophobicContact CD1-CD 4.23Å; I289-K349 HydrophobicContact CD1-CG 3.97Å; I289-K349 HydrophobicContact CG1-CB 4.47Å; I289-K349 HydrophobicContact CG1-CD 4.15Å; I289-K349 HydrophobicContact CG1-CG 3.93Å; I289-K349 HydrophobicContact CG2-CB 4.47Å; I289-K349 HydrophobicContact CG2-CG 4.44Å
290	A	92.6	Very high	93.4	Very high	27 Å²	27	50.1 Å²	50.1	22%	0.223	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-2.5	175.7	0	0	0	0	0	114	Y209 T288 T292 S350	Y209-A290 HydrophobicContact CE2-CB 4Å; Y209-A290 WeakPolarHBondContact OH-CB 3.49Å; T288-A290 PolarHBondContact O-N 3.1Å; T288-A290 PolarHBondContact OG1-N 2.64Å; A290-T292 HydrophobicContact CB-CG2 4.39Å; A290-S350 VanDerWaalsContact CB-C 3.43Å
291	G	92.4	Very high	93.6	Very high	49 Å²	49	49.1 Å²	49.1	51%	0.505	30%	0.304	S	S	.	.	S	Bend	trans	80.3	13	-175.5	0	0	0	0	0	114.6	S287 T288	S287-G291 WeakPolarHBondContact OG-CA 3.45Å; T288-G291 PolarHBondContact O-N 3.38Å
292	T	93.3	Very high	93.7	Very high	24 Å²	24	49 Å²	49	15%	0.147	30%	0.303	C	S	.	.	S	Bend	trans	-92.4	166.4	176.5	66.8	0	0	0	0	111.6	Y209 S287 T288 A290 V294 S296 E351	Y209-T292 PolarHBondContact OH-OG1 3.39Å; S287-T292 WeakPolarHBondContact CB-O 3.49Å; T288-T292 WeakPolarHBondContact CG2-O 3.27Å; T288-T292 PolarHBondContact N-O 2.96Å; T288-T292 PolarHBondContact OG1-N 3.46Å; T288-T292 PolarHBondContact OG1-O 3.12Å; T288-T292 PolarHBondContact OG1-OG1 2.87Å; A290-T292 HydrophobicContact CB-CG2 4.39Å; T292-V294 PolarHBondContact O-N 3.06Å; T292-S296 PolarHBondContact OG1-OG 3.24Å; T292-S296 VanDerWaalsContact OG1-OG 3.06Å; T292-E351 HydrophobicContact CG2-CB 3.6Å
293	S	95	Very high	93.8	Very high	75 Å²	75	46.6 Å²	46.6	52%	0.524	29%	0.289	S	S	.	.			trans	-52.4	137.3	171.4	176.3	0	0	0	0	111.2	T288 L295 S296	T288-S293 WeakPolarHBondContact CG2-O 3.38Å; S293-L295 PolarHBondContact O-N 3.44Å; S293-L295 VanDerWaalsContact O-N 3.08Å; S293-L295 PolarHBondContact OG-N 2.89Å; S293-S296 WeakPolarHBondContact O-CB 3.4Å; S293-S296 PolarHBondContact O-N 3.22Å; S293-S296 PolarHBondContact O-OG 3.5Å; S293-S296 VanDerWaalsContact O-OG 3.1Å
294	V	95.4	Very high	94.1	Very high	24 Å²	24	45.7 Å²	45.7	15%	0.145	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.6	173.1	-59.6	0	0	0	0	112.3	W206 V210 I277 G286 T288 T292	W206-V294 WeakPolarHBondContact CZ2-O 3.22Å; W206-V294 PolarHBondContact NE1-O 3.45Å; V210-V294 HydrophobicContact CG1-CB 4.35Å; V210-V294 HydrophobicContact CG1-CG1 3.85Å; V210-V294 HydrophobicContact CG2-CB 4.05Å; V210-V294 HydrophobicContact CG2-CG1 4.25Å; I277-V294 HydrophobicContact CG2-CB 4.33Å; G286-V294 VanDerWaalsContact O-CG1 3.26Å; G286-V294 WeakPolarHBondContact O-CG1 3.46Å; T288-V294 HydrophobicContact CG2-CG1 4.43Å; T292-V294 PolarHBondContact O-N 3.06Å
295	L	94.5	Very high	94.5	Very high	74 Å²	74	39.4 Å²	39.4	39%	0.387	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-6.3	175.6	-68.1	-178.9	0	0	0	114.3	W206 F278 S293 P297 V298	W206-L295 HydrophobicContact CH2-CD2 4.36Å; W206-L295 HydrophobicContact CZ2-CD2 3.97Å; F278-L295 HydrophobicContact CE1-CD1 4.41Å; F278-L295 HydrophobicContact CE1-CD2 3.65Å; F278-L295 HydrophobicContact CE1-CG 4.27Å; F278-L295 HydrophobicContact CZ-CD2 4.08Å; S293-L295 PolarHBondContact O-N 3.44Å; S293-L295 VanDerWaalsContact O-N 3.08Å; S293-L295 PolarHBondContact OG-N 2.89Å; L295-P297 VanDerWaalsContact C-N 3.31Å; L295-V298 WeakPolarHBondContact O-CB 3.44Å; L295-V298 WeakPolarHBondContact O-CG1 3.04Å; L295-V298 PolarHBondContact O-N 3.47Å
296	S	93.3	Very high	94.8	Very high	29 Å²	29	37.3 Å²	37.3	20%	0.203	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-37.3	-175.7	70	0	0	0	0	114.6	T292 S293 V298 L299 H300	T292-S296 PolarHBondContact OG1-OG 3.24Å; T292-S296 VanDerWaalsContact OG1-OG 3.06Å; S293-S296 WeakPolarHBondContact O-CB 3.4Å; S293-S296 PolarHBondContact O-N 3.22Å; S293-S296 PolarHBondContact O-OG 3.5Å; S293-S296 VanDerWaalsContact O-OG 3.1Å; S296-V298 PolarHBondContact O-N 2.86Å; S296-L299 PolarHBondContact O-N 3.05Å; S296-H300 PolarHBondContact O-ND1 3.42Å
297	P	95.4	Very high	95.1	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18	178.9	-23.6	39	0	0	0	114.3	Y202 W206 Y209 L295 L299 H300 I301 L342	Y202-P297 HydrophobicContact CE1-CB 3.99Å; Y202-P297 VanDerWaalsContact OH-CB 3.31Å; Y202-P297 WeakPolarHBondContact OH-CB 3.46Å; Y202-P297 PolarHBondContact OH-O 3.46Å; Y202-P297 VanDerWaalsContact OH-O 3.08Å; W206-P297 HydrophobicContact CD2-CB 3.89Å; W206-P297 HydrophobicContact CD2-CG 4.31Å; W206-P297 HydrophobicContact CE3-CB 4.45Å; W206-P297 HydrophobicContact CG-CB 3.93Å; W206-P297 HydrophobicContact CG-CG 4.06Å; Y209-P297 HydrophobicContact CD1-CG 3.84Å; Y209-P297 HydrophobicContact CE1-CG 4.09Å; L295-P297 VanDerWaalsContact C-N 3.31Å; P297-L299 PolarHBondContact O-N 3.24Å; P297-H300 PolarHBondContact O-N 2.93Å; P297-I301 PolarHBondContact O-N 2.99Å; P297-L342 HydrophobicContact CB-CD1 4.34Å; P297-L342 HydrophobicContact CG-CD1 4.19Å
298	V	95.4	Very high	95.3	Very high	61 Å²	61	36.2 Å²	36.2	37%	0.37	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-33.8	-179.3	83.7	0	0	0	0	112.2	W206 L295 S296 H300 G302	W206-V298 HydrophobicContact CH2-CB 3.59Å; W206-V298 HydrophobicContact CH2-CG2 3.82Å; W206-V298 HydrophobicContact CZ2-CB 4.27Å; W206-V298 HydrophobicContact CZ3-CB 4.18Å; W206-V298 HydrophobicContact CZ3-CG2 4.21Å; L295-V298 WeakPolarHBondContact O-CB 3.44Å; L295-V298 WeakPolarHBondContact O-CG1 3.04Å; L295-V298 PolarHBondContact O-N 3.47Å; S296-V298 PolarHBondContact O-N 2.86Å; V298-H300 VanDerWaalsContact C-N 3.32Å; V298-H300 PolarHBondContact O-N 3.5Å; V298-G302 VanDerWaalsContact O-CA 3.25Å; V298-G302 WeakPolarHBondContact O-CA 3.44Å; V298-G302 PolarHBondContact O-N 2.95Å
299	L	94.4	Very high	95.4	Very high	104 Å²	104	40.8 Å²	40.8	55%	0.545	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-36.4	-177.2	-64.5	179	0	0	0	111.3	S296 P297 S303 L354	S296-L299 PolarHBondContact O-N 3.05Å; P297-L299 PolarHBondContact O-N 3.24Å; L299-S303 WeakPolarHBondContact O-CB 3.34Å; L299-S303 PolarHBondContact O-N 3.28Å; L299-S303 PolarHBondContact O-OG 3.33Å; L299-L354 HydrophobicContact CB-CD1 4.28Å
300	H	94.8	Very high	95.6	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-70.6	-58	-178.5	-60	75.9	0	0	0	111.5	S296 P297 V298 S303 V304 I338 M352 H353 L354	S296-H300 PolarHBondContact O-ND1 3.42Å; P297-H300 PolarHBondContact O-N 2.93Å; V298-H300 VanDerWaalsContact C-N 3.32Å; V298-H300 PolarHBondContact O-N 3.5Å; H300-S303 PolarHBondContact O-N 3.41Å; H300-V304 PolarHBondContact O-N 3.47Å; H300-I338 HydrophobicContact CB-CG2 3.76Å; H300-M352 HydrophobicContact CB-CE 4.36Å; H300-M352 PolarHBondContact CE1-O 2.84Å; H300-M352 PolarHBondContact NE2-O 3.35Å; H300-H353 VanDerWaalsContact NE2-C 3.29Å; H300-H353 PolarHBondContact NE2-O 2.9Å; H300-H353 VanDerWaalsContact NE2-O 3.16Å; H300-L354 WeakPolarHBondContact NE2-CA 3.5Å; H300-L354 PolarHBondContact NE2-N 2.94Å
301	I	95.8	Very high	95.8	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-69.9	-35.3	-179.9	-166.9	60.1	0	0	0	111.8	F199 Y202 P297 S303 V304 I305	F199-I301 HydrophobicContact CD2-CG1 3.84Å; F199-I301 HydrophobicContact CD2-CG2 4.23Å; F199-I301 HydrophobicContact CE2-CG1 4.47Å; F199-I301 HydrophobicContact CE2-CG2 4.02Å; Y202-I301 HydrophobicContact CD1-CB 3.68Å; Y202-I301 HydrophobicContact CD1-CG1 3.93Å; Y202-I301 HydrophobicContact CD1-CG2 3.65Å; Y202-I301 HydrophobicContact CD2-CB 4.28Å; Y202-I301 HydrophobicContact CD2-CD1 4.22Å; Y202-I301 HydrophobicContact CD2-CG1 4.38Å; Y202-I301 HydrophobicContact CE1-CB 3.59Å; Y202-I301 HydrophobicContact CE1-CG1 4.36Å; Y202-I301 HydrophobicContact CE1-CG2 3.47Å; Y202-I301 VanDerWaalsContact CE1-CG2 3.47Å; Y202-I301 HydrophobicContact CE2-CB 4.23Å; Y202-I301 HydrophobicContact CG-CB 4.02Å; Y202-I301 HydrophobicContact CG-CD1 4.12Å; Y202-I301 HydrophobicContact CG-CG1 3.93Å; Y202-I301 HydrophobicContact CG-CG2 4.46Å; P297-I301 PolarHBondContact O-N 2.99Å; I301-S303 VanDerWaalsContact C-N 3.32Å; I301-S303 PolarHBondContact O-N 3.44Å; I301-V304 PolarHBondContact O-N 2.92Å; I301-I305 HydrophobicContact CG1-CD1 4.06Å; I301-I305 WeakPolarHBondContact O-CG1 3.38Å; I301-I305 PolarHBondContact O-N 2.88Å
302	G	96.4	Very high	96.1	Very high	18 Å²	18	37.6 Å²	37.6	19%	0.186	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-41.4	175.8	0	0	0	0	0	111.8	V298 V304 I305 I306	V298-G302 VanDerWaalsContact O-CA 3.25Å; V298-G302 WeakPolarHBondContact O-CA 3.44Å; V298-G302 PolarHBondContact O-N 2.95Å; G302-V304 PolarHBondContact O-N 3.43Å; G302-I305 PolarHBondContact O-N 3.41Å; G302-I306 VanDerWaalsContact O-CB 3.25Å; G302-I306 WeakPolarHBondContact O-CB 3.18Å; G302-I306 WeakPolarHBondContact O-CD1 3.39Å; G302-I306 WeakPolarHBondContact O-CG1 3.32Å; G302-I306 PolarHBondContact O-N 3.03Å
303	S	96.1	Very high	96.2	Very high	38 Å²	38	42.1 Å²	42.1	27%	0.266	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-40.8	175.7	-66.1	0	0	0	0	112	L299 H300 I301 L307	L299-S303 WeakPolarHBondContact O-CB 3.34Å; L299-S303 PolarHBondContact O-N 3.28Å; L299-S303 PolarHBondContact O-OG 3.33Å; H300-S303 PolarHBondContact O-N 3.41Å; I301-S303 VanDerWaalsContact C-N 3.32Å; I301-S303 PolarHBondContact O-N 3.44Å; S303-L307 VanDerWaalsContact O-CB 3.25Å; S303-L307 WeakPolarHBondContact O-CB 3.47Å; S303-L307 WeakPolarHBondContact O-CD1 3.16Å; S303-L307 WeakPolarHBondContact O-CG 3.5Å; S303-L307 PolarHBondContact O-N 2.95Å
304	V	97.1	Very high	96.2	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-50.3	175.3	179.9	0	0	0	0	110.9	H300 I301 G302 A308 F331 V334 I338 F359	H300-V304 PolarHBondContact O-N 3.47Å; I301-V304 PolarHBondContact O-N 2.92Å; G302-V304 PolarHBondContact O-N 3.43Å; V304-A308 VanDerWaalsContact O-CB 3.32Å; V304-A308 WeakPolarHBondContact O-CB 3.3Å; V304-A308 PolarHBondContact O-N 2.97Å; V304-F331 HydrophobicContact CG1-CD1 4.4Å; V304-V334 HydrophobicContact CG1-CG1 4.38Å; V304-V334 HydrophobicContact CG2-CG1 3.82Å; V304-I338 HydrophobicContact CG2-CG1 4.22Å; V304-F359 HydrophobicContact CG2-CE1 3.53Å; V304-F359 HydrophobicContact CG2-CZ 3.89Å
305	I	97.7	Very high	96.1	Very high	38 Å²	38	44.9 Å²	44.9	20%	0.195	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-42.7	-176.8	-65.5	170.7	0	0	0	111.5	F195 F199 I301 G302 A308 M309	F195-I305 HydrophobicContact CD1-CG1 4.2Å; F199-I305 HydrophobicContact CB-CD1 4.15Å; F199-I305 HydrophobicContact CD2-CD1 3.71Å; F199-I305 HydrophobicContact CE2-CD1 4.49Å; F199-I305 HydrophobicContact CG-CD1 4.19Å; I301-I305 HydrophobicContact CG1-CD1 4.06Å; I301-I305 WeakPolarHBondContact O-CG1 3.38Å; I301-I305 PolarHBondContact O-N 2.88Å; G302-I305 PolarHBondContact O-N 3.41Å; I305-A308 PolarHBondContact O-N 2.83Å; I305-M309 WeakPolarHBondContact O-CB 3.43Å; I305-M309 PolarHBondContact O-N 3.36Å
306	I	97.6	Very high	95.9	Very high	114 Å²	114	45.5 Å²	45.5	59%	0.585	25%	0.25	S	C	*	.	H	α-helix	trans	-66.2	-45	179.8	-69.9	167.3	0	0	0	110.4	G302 M309 M310	G302-I306 VanDerWaalsContact O-CB 3.25Å; G302-I306 WeakPolarHBondContact O-CB 3.18Å; G302-I306 WeakPolarHBondContact O-CD1 3.39Å; G302-I306 WeakPolarHBondContact O-CG1 3.32Å; G302-I306 PolarHBondContact O-N 3.03Å; I306-M309 PolarHBondContact O-N 3.42Å; I306-M310 VanDerWaalsContact O-CB 3.24Å; I306-M310 WeakPolarHBondContact O-CB 3.34Å; I306-M310 PolarHBondContact O-N 3Å
307	L	97.2	Very high	95.8	Very high	34 Å²	34	46.6 Å²	46.6	18%	0.178	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-45.5	175.8	-73.3	172.5	0	0	0	110.8	S303 M310 I311 F331 F359 P362 F366	S303-L307 VanDerWaalsContact O-CB 3.25Å; S303-L307 WeakPolarHBondContact O-CB 3.47Å; S303-L307 WeakPolarHBondContact O-CD1 3.16Å; S303-L307 WeakPolarHBondContact O-CG 3.5Å; S303-L307 PolarHBondContact O-N 2.95Å; L307-M310 HydrophobicContact CD2-CE 3.63Å; L307-M310 PolarHBondContact O-N 3.39Å; L307-I311 WeakPolarHBondContact O-CB 3.28Å; L307-I311 WeakPolarHBondContact O-CD1 3.32Å; L307-I311 VanDerWaalsContact O-CG1 3.23Å; L307-I311 WeakPolarHBondContact O-CG1 3.32Å; L307-I311 PolarHBondContact O-N 3.2Å; L307-F331 HydrophobicContact CB-CE1 4.43Å; L307-F359 HydrophobicContact CD1-CD1 3.96Å; L307-F359 HydrophobicContact CD1-CE1 4.49Å; L307-P362 HydrophobicContact CB-CB 4.41Å; L307-P362 HydrophobicContact CD1-CB 4.04Å; L307-F366 HydrophobicContact CD2-CB 4.44Å
308	A	98.2	Very high	95.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-51.5	175.8	0	0	0	0	0	111.5	F191 F195 V304 I305 M310 I311 Y312 Y327 F331	F191-A308 HydrophobicContact CE2-CB 4.05Å; F191-A308 HydrophobicContact CZ-CB 3.95Å; F195-A308 HydrophobicContact CD1-CB 4.45Å; F195-A308 HydrophobicContact CE1-CB 3.51Å; F195-A308 HydrophobicContact CE2-CB 4.18Å; F195-A308 HydrophobicContact CZ-CB 3.35Å; V304-A308 VanDerWaalsContact O-CB 3.32Å; V304-A308 WeakPolarHBondContact O-CB 3.3Å; V304-A308 PolarHBondContact O-N 2.97Å; I305-A308 PolarHBondContact O-N 2.83Å; A308-M310 VanDerWaalsContact C-N 3.33Å; A308-M310 PolarHBondContact O-N 2.64Å; A308-I311 PolarHBondContact O-N 2.83Å; A308-Y312 VanDerWaalsContact O-CB 3.29Å; A308-Y312 WeakPolarHBondContact O-CB 3.25Å; A308-Y312 PolarHBondContact O-N 3.18Å; A308-Y327 VanDerWaalsContact C-OH 3.29Å; A308-Y327 VanDerWaalsContact CA-OH 3.25Å; A308-Y327 WeakPolarHBondContact CA-OH 3.34Å; A308-Y327 HydrophobicContact CB-CE1 4.37Å; A308-Y327 PolarHBondContact O-OH 3.04Å; A308-F331 HydrophobicContact CB-CD1 3.61Å; A308-F331 HydrophobicContact CB-CE1 3.7Å; A308-F331 HydrophobicContact CB-CG 4.08Å; A308-F331 HydrophobicContact CB-CZ 4.26Å
309	M	98.1	Very high	95.9	Very high	96 Å²	96	48.8 Å²	48.8	47%	0.473	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-41.8	-179	-175.5	180	-67.1	0	0	112.1	F191 I305 I306 Y312 K313	F191-M309 HydrophobicContact CE1-CB 4.35Å; F191-M309 HydrophobicContact CE1-CE 4.33Å; F191-M309 HydrophobicContact CZ-CB 4Å; I305-M309 WeakPolarHBondContact O-CB 3.43Å; I305-M309 PolarHBondContact O-N 3.36Å; I306-M309 PolarHBondContact O-N 3.42Å; M309-Y312 PolarHBondContact O-N 2.72Å; M309-K313 HydrophobicContact CG-CG 4.46Å; M309-K313 WeakPolarHBondContact O-CB 3.39Å; M309-K313 WeakPolarHBondContact O-CG 3.25Å; M309-K313 PolarHBondContact O-N 3.1Å
310	M	96.8	Very high	96.1	Very high	41 Å²	41	43.9 Å²	43.9	20%	0.202	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-46.5	177.5	178.6	-179.3	54.8	0	0	111.4	I306 L307 A308 Y312 K313 K314 F366	I306-M310 VanDerWaalsContact O-CB 3.24Å; I306-M310 WeakPolarHBondContact O-CB 3.34Å; I306-M310 PolarHBondContact O-N 3Å; L307-M310 HydrophobicContact CD2-CE 3.63Å; L307-M310 PolarHBondContact O-N 3.39Å; A308-M310 VanDerWaalsContact C-N 3.33Å; A308-M310 PolarHBondContact O-N 2.64Å; M310-Y312 VanDerWaalsContact C-N 3.3Å; M310-Y312 PolarHBondContact O-N 2.88Å; M310-K313 PolarHBondContact O-N 2.87Å; M310-K314 HydrophobicContact CG-CD 3.88Å; M310-K314 HydrophobicContact CG-CG 4.36Å; M310-K314 VanDerWaalsContact O-CB 3.29Å; M310-K314 WeakPolarHBondContact O-CB 3.35Å; M310-K314 WeakPolarHBondContact O-CG 3.46Å; M310-K314 PolarHBondContact O-N 3.22Å; M310-F366 HydrophobicContact CE-CB 4.23Å; M310-F366 HydrophobicContact CE-CD2 2.97Å; M310-F366 HydrophobicContact CE-CE2 3.32Å; M310-F366 HydrophobicContact CE-CG 3.73Å; M310-F366 HydrophobicContact CE-CZ 4.32Å; M310-F366 HydrophobicContact SD-CD2 3.62Å; M310-F366 HydrophobicContact SD-CE2 3.38Å; M310-F366 WeakPolarHBondContact SD-CE2 3.28Å; M310-F366 HydrophobicContact SD-CZ 4.44Å
311	I	97.5	Very high	96.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-40.1	179.9	-70.4	160.9	0	0	0	110.4	L307 A308 S315 L319 Y327 F331 P362 L365 F366 Q369	L307-I311 WeakPolarHBondContact O-CB 3.28Å; L307-I311 WeakPolarHBondContact O-CD1 3.32Å; L307-I311 VanDerWaalsContact O-CG1 3.23Å; L307-I311 WeakPolarHBondContact O-CG1 3.32Å; L307-I311 PolarHBondContact O-N 3.2Å; A308-I311 PolarHBondContact O-N 2.83Å; I311-S315 WeakPolarHBondContact O-CB 3.35Å; I311-S315 PolarHBondContact O-N 3.08Å; I311-L319 HydrophobicContact CG2-CD2 4.34Å; I311-Y327 HydrophobicContact CG2-CE2 3.88Å; I311-F331 HydrophobicContact CD1-CE1 4.38Å; I311-F331 HydrophobicContact CD1-CZ 3.67Å; I311-P362 WeakPolarHBondContact CD1-O 3.38Å; I311-L365 HydrophobicContact CD1-CB 3.66Å; I311-L365 HydrophobicContact CD1-CD1 4.47Å; I311-L365 HydrophobicContact CG1-CB 4.24Å; I311-L365 HydrophobicContact CG2-CB 4.22Å; I311-L365 HydrophobicContact CG2-CD1 4.41Å; I311-F366 HydrophobicContact CD1-CB 4.38Å; I311-Q369 VanDerWaalsContact CA-OE1 3.3Å; I311-Q369 PolarHBondContact O-NE2 3.05Å
312	Y	97.6	Very high	96.3	Very high	10 Å²	10	51.3 Å²	51.3	4%	0.039	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-57.4	171.9	171.6	-153	0	0	0	111	D188 F191 A308 M309 M310 K314 F320 E321	D188-Y312 PolarHBondContact OD1-OH 3.25Å; D188-Y312 VanDerWaalsContact OD1-OH 3.07Å; F191-Y312 HydrophobicContact CB-CD1 4.38Å; F191-Y312 HydrophobicContact CB-CE1 4.19Å; F191-Y312 AromaticContact CD2-CD1 3.61Å; F191-Y312 HydrophobicContact CD2-CD1 3.61Å; F191-Y312 HydrophobicContact CD2-CE1 4.26Å; F191-Y312 HydrophobicContact CD2-CG 4.22Å; F191-Y312 AromaticContact CE2-CD1 3.99Å; F191-Y312 HydrophobicContact CE2-CD1 3.99Å; F191-Y312 HydrophobicContact CE2-CG 4.42Å; F191-Y312 AromaticContact CG-CD1 3.93Å; F191-Y312 HydrophobicContact CG-CD1 3.93Å; F191-Y312 HydrophobicContact CG-CE1 4.2Å; A308-Y312 VanDerWaalsContact O-CB 3.29Å; A308-Y312 WeakPolarHBondContact O-CB 3.25Å; A308-Y312 PolarHBondContact O-N 3.18Å; M309-Y312 PolarHBondContact O-N 2.72Å; M310-Y312 VanDerWaalsContact C-N 3.3Å; M310-Y312 PolarHBondContact O-N 2.88Å; Y312-K314 PolarHBondContact O-N 3.04Å; Y312-F320 HydrophobicContact CD1-CD1 4.32Å; Y312-F320 HydrophobicContact CD2-CB 3.42Å; Y312-F320 VanDerWaalsContact CD2-CB 3.42Å; Y312-F320 AromaticContact CD2-CD1 3.79Å; Y312-F320 HydrophobicContact CD2-CD1 3.79Å; Y312-F320 AromaticContact CD2-CG 3.91Å; Y312-F320 HydrophobicContact CD2-CG 3.91Å; Y312-F320 HydrophobicContact CE1-CD1 4.15Å; Y312-F320 HydrophobicContact CE2-CB 3.94Å; Y312-F320 AromaticContact CE2-CD1 3.62Å; Y312-F320 HydrophobicContact CE2-CD1 3.62Å; Y312-F320 HydrophobicContact CE2-CG 4.19Å; Y312-F320 HydrophobicContact CG-CB 4.02Å; Y312-F320 HydrophobicContact CG-CD1 4.17Å; Y312-F320 HydrophobicContact CG-CG 4.22Å; Y312-F320 AromaticContact CZ-CD1 3.81Å; Y312-E321 HydrophobicContact CE2-CG 4.32Å; Y312-E321 WeakPolarHBondContact CE2-OE1 3.17Å
313	K	96.1	Very high	96.4	Very high	120 Å²	120	53.2 Å²	53.2	52%	0.522	27%	0.273	S	S	.	.	H	α-helix	trans	-75.6	-18.7	-171.2	-66	-58.3	-176.3	-172.2	0	115.2	D188 M309 M310	D188-K313 IonicContact OD1-NZ 2.9Å; D188-K313 PolarHBondContact OD1-NZ 3.23Å; M309-K313 HydrophobicContact CG-CG 4.46Å; M309-K313 WeakPolarHBondContact O-CB 3.39Å; M309-K313 WeakPolarHBondContact O-CG 3.25Å; M309-K313 PolarHBondContact O-N 3.1Å; M310-K313 PolarHBondContact O-N 2.87Å
314	K	94.4	Very high	96.5	Very high	141 Å²	141	51.6 Å²	51.6	61%	0.613	26%	0.261	S	S	*	.	H	α-helix	trans	-100.7	-6.9	178.6	-69.4	-169.6	173.1	-176.4	0	114.4	M310 Y312 A316	M310-K314 HydrophobicContact CG-CD 3.88Å; M310-K314 HydrophobicContact CG-CG 4.36Å; M310-K314 VanDerWaalsContact O-CB 3.29Å; M310-K314 WeakPolarHBondContact O-CB 3.35Å; M310-K314 WeakPolarHBondContact O-CG 3.46Å; M310-K314 PolarHBondContact O-N 3.22Å; Y312-K314 PolarHBondContact O-N 3.04Å; K314-A316 PolarHBondContact O-N 2.97Å
315	S	94	Very high	96.5	Very high	16 Å²	16	51.6 Å²	51.6	11%	0.112	26%	0.261	C	S	.	.			trans	-61.9	122.8	-178.4	-177.3	0	0	0	0	111.5	I311 V317 Q318 L319 Q369 E377	I311-S315 WeakPolarHBondContact O-CB 3.35Å; I311-S315 PolarHBondContact O-N 3.08Å; S315-V317 VanDerWaalsContact C-N 3.26Å; S315-V317 PolarHBondContact O-N 2.92Å; S315-V317 PolarHBondContact OG-N 3.31Å; S315-Q318 PolarHBondContact OG-N 3.16Å; S315-L319 WeakPolarHBondContact OG-CB 3.32Å; S315-L319 PolarHBondContact OG-N 2.82Å; S315-Q369 VanDerWaalsContact CA-NE2 3.33Å; S315-E377 VanDerWaalsContact CB-OE2 3.25Å; S315-E377 WeakPolarHBondContact CB-OE2 3.49Å; S315-E377 PolarHBondContact OG-OE2 2.87Å
316	A	89.3	Confident	96.6	Very high	86 Å²	86	50.7 Å²	50.7	71%	0.711	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-26.7	177.3	0	0	0	0	0	111.6	K314 E377	K314-A316 PolarHBondContact O-N 2.97Å; A316-E377 PolarHBondContact N-OE1 3.5Å
317	V	92.4	Very high	96.6	Very high	53 Å²	53	45.2 Å²	45.2	32%	0.321	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	2.9	-176.8	-59.9	0	0	0	0	113.8	S315 L319 K322 E377	S315-V317 VanDerWaalsContact C-N 3.26Å; S315-V317 PolarHBondContact O-N 2.92Å; S315-V317 PolarHBondContact OG-N 3.31Å; V317-L319 HydrophobicContact CG2-CB 4.19Å; V317-K322 WeakPolarHBondContact O-CD 3.24Å; V317-K322 VanDerWaalsContact O-CE 3.27Å; V317-K322 WeakPolarHBondContact O-CE 3.22Å; V317-K322 PolarHBondContact O-NZ 2.81Å; V317-E377 HydrophobicContact CG2-CB 3.92Å; V317-E377 HydrophobicContact CG2-CG 4.26Å
318	Q	95.5	Very high	96.7	Very high	106 Å²	106	43.6 Å²	43.6	50%	0.495	22%	0.22	S	C	.	.			trans	57.5	51.2	-173.5	-59.9	175.4	-41.9	0	0	111.4	S315 F320 E321 K322	S315-Q318 PolarHBondContact OG-N 3.16Å; Q318-F320 VanDerWaalsContact C-N 3.3Å; Q318-F320 PolarHBondContact O-N 3.05Å; Q318-E321 VanDerWaalsContact C-OE2 3.25Å; Q318-E321 WeakPolarHBondContact CA-OE2 3.25Å; Q318-E321 HydrophobicContact CB-CB 4.19Å; Q318-E321 HydrophobicContact CB-CG 4.47Å; Q318-E321 WeakPolarHBondContact CB-OE2 3.29Å; Q318-E321 PolarHBondContact O-N 3.34Å; Q318-K322 PolarHBondContact O-N 3.42Å
319	L	96.6	Very high	96.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-55	-43.6	-171.1	-177.3	69.7	0	0	0	112.7	I311 S315 V317 H323 Y327 L365 E377 L381	I311-L319 HydrophobicContact CG2-CD2 4.34Å; S315-L319 WeakPolarHBondContact OG-CB 3.32Å; S315-L319 PolarHBondContact OG-N 2.82Å; V317-L319 HydrophobicContact CG2-CB 4.19Å; L319-H323 WeakPolarHBondContact O-CB 3.38Å; L319-H323 PolarHBondContact O-N 2.93Å; L319-Y327 HydrophobicContact CD2-CD2 4.24Å; L319-Y327 HydrophobicContact CD2-CE2 4.3Å; L319-Y327 HydrophobicContact CG-CD2 4.39Å; L319-L365 HydrophobicContact CD2-CD2 3.96Å; L319-E377 HydrophobicContact CD1-CB 4.05Å; L319-E377 HydrophobicContact CD2-CB 4.19Å; L319-L381 HydrophobicContact CD1-CB 4.2Å; L319-L381 HydrophobicContact CD1-CD2 3.83Å; L319-L381 HydrophobicContact CD2-CB 4.24Å; L319-L381 HydrophobicContact CD2-CD2 4.13Å; L319-L381 HydrophobicContact CG-CD2 3.9Å
320	F	98.2	Very high	96.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.2	-42.7	179.5	178.7	-109	0	0	0	111.7	P187 M190 F191 Y312 Q318 K322 H323 P324 Y327 I328	P187-F320 HydrophobicContact CB-CD1 4.16Å; P187-F320 HydrophobicContact CB-CE1 3.99Å; P187-F320 WeakPolarHBondContact O-CE1 3.49Å; M190-F320 HydrophobicContact CB-CZ 4.34Å; M190-F320 HydrophobicContact CG-CZ 4.21Å; M190-F320 HydrophobicContact SD-CZ 4.48Å; F191-F320 HydrophobicContact CB-CE1 3.76Å; F191-F320 HydrophobicContact CB-CZ 3.83Å; F191-F320 HydrophobicContact CD2-CE1 4.33Å; F191-F320 HydrophobicContact CD2-CE2 4.31Å; F191-F320 HydrophobicContact CD2-CZ 4.2Å; Y312-F320 HydrophobicContact CD1-CD1 4.32Å; Y312-F320 HydrophobicContact CD2-CB 3.42Å; Y312-F320 VanDerWaalsContact CD2-CB 3.42Å; Y312-F320 AromaticContact CD2-CD1 3.79Å; Y312-F320 HydrophobicContact CD2-CD1 3.79Å; Y312-F320 AromaticContact CD2-CG 3.91Å; Y312-F320 HydrophobicContact CD2-CG 3.91Å; Y312-F320 HydrophobicContact CE1-CD1 4.15Å; Y312-F320 HydrophobicContact CE2-CB 3.94Å; Y312-F320 AromaticContact CE2-CD1 3.62Å; Y312-F320 HydrophobicContact CE2-CD1 3.62Å; Y312-F320 HydrophobicContact CE2-CG 4.19Å; Y312-F320 HydrophobicContact CG-CB 4.02Å; Y312-F320 HydrophobicContact CG-CD1 4.17Å; Y312-F320 HydrophobicContact CG-CG 4.22Å; Y312-F320 AromaticContact CZ-CD1 3.81Å; Q318-F320 VanDerWaalsContact C-N 3.3Å; Q318-F320 PolarHBondContact O-N 3.05Å; F320-K322 VanDerWaalsContact C-N 3.34Å; F320-K322 PolarHBondContact O-N 3.48Å; F320-H323 CarbonylContact O-C 3.53Å; F320-P324 HydrophobicContact CD2-CB 4.33Å; F320-P324 HydrophobicContact CE2-CB 4.01Å; F320-P324 HydrophobicContact CZ-CB 4.23Å; F320-P324 WeakPolarHBondContact O-CA 3.34Å; F320-P324 WeakPolarHBondContact O-CB 3.38Å; F320-P324 WeakPolarHBondContact O-CD 3.41Å; F320-Y327 HydrophobicContact CB-CD2 4.24Å; F320-Y327 HydrophobicContact CB-CE2 4.43Å; F320-Y327 HydrophobicContact CB-CG 4.41Å; F320-Y327 AromaticContact CD2-CD1 3.42Å; F320-Y327 HydrophobicContact CD2-CD1 3.42Å; F320-Y327 VanDerWaalsContact CD2-CD1 3.42Å; F320-Y327 HydrophobicContact CD2-CD2 4.21Å; F320-Y327 HydrophobicContact CD2-CE1 4.01Å; F320-Y327 AromaticContact CD2-CG 3.55Å; F320-Y327 HydrophobicContact CD2-CG 3.55Å; F320-Y327 AromaticContact CE2-CD1 3.92Å; F320-Y327 HydrophobicContact CE2-CD1 3.92Å; F320-Y327 HydrophobicContact CE2-CG 4.35Å; F320-Y327 HydrophobicContact CG-CD1 4.46Å; F320-Y327 HydrophobicContact CG-CG 4.46Å; F320-I328 HydrophobicContact CE2-CD1 3.75Å; F320-I328 HydrophobicContact CE2-CG1 4Å; F320-I328 HydrophobicContact CZ-CD1 4.33Å
321	E	97.3	Very high	96.9	Very high	60 Å²	60	37.9 Å²	37.9	28%	0.28	19%	0.193	S	C	.	.	H	α-helix	trans	-67.1	-36.1	-178.6	-61.2	92.7	148.5	0	0	112.3	P187 Y312 Q318	P187-E321 HydrophobicContact CB-CG 3.86Å; P187-E321 HydrophobicContact CG-CB 4.36Å; P187-E321 HydrophobicContact CG-CG 3.78Å; Y312-E321 HydrophobicContact CE2-CG 4.32Å; Y312-E321 WeakPolarHBondContact CE2-OE1 3.17Å; Q318-E321 VanDerWaalsContact C-OE2 3.25Å; Q318-E321 WeakPolarHBondContact CA-OE2 3.25Å; Q318-E321 HydrophobicContact CB-CB 4.19Å; Q318-E321 HydrophobicContact CB-CG 4.47Å; Q318-E321 WeakPolarHBondContact CB-OE2 3.29Å; Q318-E321 PolarHBondContact O-N 3.34Å
322	K	97.7	Very high	96.9	Very high	104 Å²	104	37.9 Å²	37.9	45%	0.452	19%	0.193	S	C	.	.	H	α-helix	trans	-83.8	-30.1	179.6	-68.3	-177.5	-175.3	158.6	0	113.5	V317 Q318 F320 P324	V317-K322 WeakPolarHBondContact O-CD 3.24Å; V317-K322 VanDerWaalsContact O-CE 3.27Å; V317-K322 WeakPolarHBondContact O-CE 3.22Å; V317-K322 PolarHBondContact O-NZ 2.81Å; Q318-K322 PolarHBondContact O-N 3.42Å; F320-K322 VanDerWaalsContact C-N 3.34Å; F320-K322 PolarHBondContact O-N 3.48Å; K322-P324 VanDerWaalsContact C-CD 3.45Å
323	H	98.1	Very high	97	Very high	59 Å²	59	38 Å²	38	27%	0.273	19%	0.193	S	C	.	.	S	Bend	trans	-133.2	51.5	-176	-54.6	-62.9	0	0	0	113.2	L319 F320 C325 L326 Y327 Y378 L381	L319-H323 WeakPolarHBondContact O-CB 3.38Å; L319-H323 PolarHBondContact O-N 2.93Å; F320-H323 CarbonylContact O-C 3.53Å; H323-C325 PolarHBondContact O-N 3.3Å; H323-L326 HydrophobicContact CB-CB 4.34Å; H323-L326 PolarHBondContact O-N 2.95Å; H323-Y327 WeakPolarHBondContact O-CB 3.28Å; H323-Y327 PolarHBondContact O-N 3.34Å; H323-Y378 HydrophobicContact CB-CD2 4.41Å; H323-Y378 HydrophobicContact CB-CE2 4.34Å; H323-Y378 AromaticContact CD2-CD2 3.3Å; H323-Y378 WeakPolarHBondContact CD2-CD2 3.15Å; H323-Y378 AromaticContact CD2-CE2 3.7Å; H323-Y378 AromaticContact CE1-CD2 3.8Å; H323-Y378 AromaticContact CE1-CE2 3.53Å; H323-Y378 AromaticContact CG-CD2 3.62Å; H323-Y378 AromaticContact CG-CE2 3.56Å; H323-Y378 AromaticContact ND1-CD2 3.93Å; H323-Y378 AromaticContact ND1-CE2 3.47Å; H323-Y378 WeakPolarHBondContact ND1-CE2 3.33Å; H323-Y378 AromaticContact NE2-CD2 3.44Å; H323-Y378 WeakPolarHBondContact NE2-CD2 3.14Å; H323-Y378 AromaticContact NE2-CE2 3.69Å; H323-Y378 AromaticContact NE2-CG 3.93Å; H323-L381 HydrophobicContact CB-CD2 4.32Å
324	P	98.5	Very high	97.1	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.019	17%	0.169	C	C	.	.	H	α-helix	trans	-65.7	-39.1	-170.3	24.8	-33.1	0	0	0	112.8	T117 M190 F320 K322 Y327 I328	T117-P324 VanDerWaalsContact O-CG 3.29Å; T117-P324 WeakPolarHBondContact O-CG 3.26Å; M190-P324 HydrophobicContact CE-CB 3.73Å; M190-P324 HydrophobicContact CE-CG 4.32Å; M190-P324 HydrophobicContact SD-CB 3.77Å; M190-P324 HydrophobicContact SD-CG 4.28Å; F320-P324 HydrophobicContact CD2-CB 4.33Å; F320-P324 HydrophobicContact CE2-CB 4.01Å; F320-P324 HydrophobicContact CZ-CB 4.23Å; F320-P324 WeakPolarHBondContact O-CA 3.34Å; F320-P324 WeakPolarHBondContact O-CB 3.38Å; F320-P324 WeakPolarHBondContact O-CD 3.41Å; K322-P324 VanDerWaalsContact C-CD 3.45Å; P324-Y327 WeakPolarHBondContact O-CB 3.41Å; P324-Y327 PolarHBondContact O-N 3.47Å; P324-I328 WeakPolarHBondContact O-CB 3.43Å; P324-I328 VanDerWaalsContact O-CG1 3.31Å; P324-I328 WeakPolarHBondContact O-CG1 3.35Å; P324-I328 PolarHBondContact O-N 2.83Å
325	C	98.7	Very high	97.3	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-46.2	179.2	-64.8	0	0	0	0	111.9	V112 C115 P116 L175 H323 Y327 I328 L329	V112-C325 HydrophobicContact CG1-CB 3.85Å; V112-C325 HydrophobicContact CG2-CB 4.35Å; C115-C325 PolarHBondContact O-SG 3.02Å; P116-C325 WeakPolarHBondContact O-CB 3.2Å; P116-C325 PolarHBondContact O-SG 2.76Å; L175-C325 HydrophobicContact CD1-CB 4.15Å; L175-C325 HydrophobicContact CD2-CB 4.37Å; H323-C325 PolarHBondContact O-N 3.3Å; C325-Y327 VanDerWaalsContact C-N 3.28Å; C325-Y327 PolarHBondContact O-N 2.84Å; C325-I328 PolarHBondContact O-N 3.46Å; C325-L329 WeakPolarHBondContact O-CB 3.29Å; C325-L329 VanDerWaalsContact O-CG 3.29Å; C325-L329 WeakPolarHBondContact O-CG 3.47Å; C325-L329 PolarHBondContact O-N 3.33Å
326	L	98.6	Very high	97.5	Very high	18 Å²	18	25.1 Å²	25.1	9%	0.094	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-42.5	176.4	177.7	60.5	0	0	0	110.9	H323 L329 A330 Y378 L381 W382 L385	H323-L326 HydrophobicContact CB-CB 4.34Å; H323-L326 PolarHBondContact O-N 2.95Å; L326-L329 PolarHBondContact O-N 3.08Å; L326-A330 WeakPolarHBondContact O-CB 3.44Å; L326-A330 PolarHBondContact O-N 3.25Å; L326-Y378 HydrophobicContact CD2-CD2 4.15Å; L326-Y378 HydrophobicContact CD2-CE2 3.67Å; L326-L381 HydrophobicContact CB-CD2 4.24Å; L326-L381 HydrophobicContact CD2-CB 4.49Å; L326-L381 HydrophobicContact CD2-CD2 3.72Å; L326-L381 HydrophobicContact CD2-CG 3.9Å; L326-L381 HydrophobicContact CG-CD2 3.72Å; L326-L381 HydrophobicContact CG-CG 3.84Å; L326-W382 HydrophobicContact CD1-CD2 3.96Å; L326-W382 HydrophobicContact CD1-CE3 3.82Å; L326-W382 HydrophobicContact CD1-CH2 4.06Å; L326-W382 HydrophobicContact CD1-CZ2 4.2Å; L326-W382 HydrophobicContact CD1-CZ3 3.87Å; L326-W382 HydrophobicContact CD2-CD2 3.87Å; L326-W382 HydrophobicContact CD2-CG 4.03Å; L326-W382 HydrophobicContact CD2-CZ2 4.09Å; L326-L385 HydrophobicContact CD1-CB 4.04Å; L326-L385 HydrophobicContact CD1-CD1 4.41Å; L326-L385 HydrophobicContact CD1-CD2 3.49Å; L326-L385 VanDerWaalsContact CD1-CD2 3.49Å; L326-L385 HydrophobicContact CD1-CG 4.15Å
327	Y	98.8	Very high	97.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-50.7	177.9	-167.9	-77.9	0	0	0	112.8	F191 F195 A308 I311 L319 F320 H323 P324 C325 L329 A330 F331 L381	F191-Y327 HydrophobicContact CE2-CE1 4.3Å; F195-Y327 HydrophobicContact CE2-CE1 4.35Å; F195-Y327 HydrophobicContact CZ-CE1 4.27Å; A308-Y327 VanDerWaalsContact C-OH 3.29Å; A308-Y327 VanDerWaalsContact CA-OH 3.25Å; A308-Y327 WeakPolarHBondContact CA-OH 3.34Å; A308-Y327 HydrophobicContact CB-CE1 4.37Å; A308-Y327 PolarHBondContact O-OH 3.04Å; I311-Y327 HydrophobicContact CG2-CE2 3.88Å; L319-Y327 HydrophobicContact CD2-CD2 4.24Å; L319-Y327 HydrophobicContact CD2-CE2 4.3Å; L319-Y327 HydrophobicContact CG-CD2 4.39Å; F320-Y327 HydrophobicContact CB-CD2 4.24Å; F320-Y327 HydrophobicContact CB-CE2 4.43Å; F320-Y327 HydrophobicContact CB-CG 4.41Å; F320-Y327 AromaticContact CD2-CD1 3.42Å; F320-Y327 HydrophobicContact CD2-CD1 3.42Å; F320-Y327 VanDerWaalsContact CD2-CD1 3.42Å; F320-Y327 HydrophobicContact CD2-CD2 4.21Å; F320-Y327 HydrophobicContact CD2-CE1 4.01Å; F320-Y327 AromaticContact CD2-CG 3.55Å; F320-Y327 HydrophobicContact CD2-CG 3.55Å; F320-Y327 AromaticContact CE2-CD1 3.92Å; F320-Y327 HydrophobicContact CE2-CD1 3.92Å; F320-Y327 HydrophobicContact CE2-CG 4.35Å; F320-Y327 HydrophobicContact CG-CD1 4.46Å; F320-Y327 HydrophobicContact CG-CG 4.46Å; H323-Y327 WeakPolarHBondContact O-CB 3.28Å; H323-Y327 PolarHBondContact O-N 3.34Å; P324-Y327 WeakPolarHBondContact O-CB 3.41Å; P324-Y327 PolarHBondContact O-N 3.47Å; C325-Y327 VanDerWaalsContact C-N 3.28Å; C325-Y327 PolarHBondContact O-N 2.84Å; Y327-L329 VanDerWaalsContact C-N 3.31Å; Y327-L329 PolarHBondContact O-N 3.03Å; Y327-A330 PolarHBondContact O-N 3.47Å; Y327-F331 AromaticContact CD1-CD2 3.77Å; Y327-F331 HydrophobicContact CD1-CD2 3.77Å; Y327-F331 HydrophobicContact CD1-CE2 4.22Å; Y327-F331 HydrophobicContact CD2-CE2 4.27Å; Y327-F331 AromaticContact CE1-CD2 3.41Å; Y327-F331 HydrophobicContact CE1-CD2 3.41Å; Y327-F331 VanDerWaalsContact CE1-CD2 3.41Å; Y327-F331 AromaticContact CE1-CE2 3.61Å; Y327-F331 HydrophobicContact CE1-CE2 3.61Å; Y327-F331 HydrophobicContact CE1-CG 4.18Å; Y327-F331 HydrophobicContact CE2-CD2 4.22Å; Y327-F331 AromaticContact CE2-CE2 3.68Å; Y327-F331 HydrophobicContact CE2-CE2 3.68Å; Y327-F331 HydrophobicContact CG-CD2 4.29Å; Y327-F331 AromaticContact CZ-CD2 3.64Å; Y327-F331 AromaticContact CZ-CE2 3.29Å; Y327-F331 WeakPolarHBondContact O-CD2 3.22Å; Y327-F331 PolarHBondContact O-N 3.24Å; Y327-F331 VanDerWaalsContact O-N 3.08Å; Y327-F331 WeakPolarHBondContact OH-CE2 2.99Å; Y327-L381 HydrophobicContact CD2-CD1 4.21Å; Y327-L381 HydrophobicContact CD2-CD2 4.31Å
328	I	98.8	Very high	98.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.3	-38.7	178.5	-66.8	-55.5	0	0	0	111	L175 M190 C194 F195 F320 P324 C325 G332	L175-I328 HydrophobicContact CB-CG2 4.15Å; L175-I328 HydrophobicContact CD1-CB 4.2Å; L175-I328 HydrophobicContact CD1-CG2 4.23Å; M190-I328 HydrophobicContact CE-CG1 4.49Å; C194-I328 HydrophobicContact CB-CD1 3.59Å; C194-I328 HydrophobicContact CB-CG1 4.21Å; C194-I328 HydrophobicContact CB-CG2 4.28Å; F195-I328 HydrophobicContact CD2-CD1 4.16Å; F195-I328 HydrophobicContact CE2-CD1 3.66Å; F320-I328 HydrophobicContact CE2-CD1 3.75Å; F320-I328 HydrophobicContact CE2-CG1 4Å; F320-I328 HydrophobicContact CZ-CD1 4.33Å; P324-I328 WeakPolarHBondContact O-CB 3.43Å; P324-I328 VanDerWaalsContact O-CG1 3.31Å; P324-I328 WeakPolarHBondContact O-CG1 3.35Å; P324-I328 PolarHBondContact O-N 2.83Å; C325-I328 PolarHBondContact O-N 3.46Å; I328-G332 VanDerWaalsContact O-CA 3.23Å; I328-G332 WeakPolarHBondContact O-CA 3.44Å; I328-G332 PolarHBondContact O-N 3.24Å
329	L	98.8	Very high	98.3	Very high	13 Å²	13	14.1 Å²	14.1	7%	0.068	7%	0.066	C	C	.	.	H	α-helix	trans	-64.3	-45.3	175.3	-71.2	170.6	0	0	0	111.9	V171 F172 L175 C325 L326 Y327 G332 F333 L385	V171-L329 HydrophobicContact CG1-CD2 4.34Å; F172-L329 HydrophobicContact CD1-CD2 4.21Å; F172-L329 HydrophobicContact CE1-CD2 3.62Å; F172-L329 HydrophobicContact CZ-CD2 3.86Å; L175-L329 HydrophobicContact CD2-CD1 4.35Å; L175-L329 HydrophobicContact CD2-CD2 3.91Å; L175-L329 HydrophobicContact CD2-CG 3.82Å; C325-L329 WeakPolarHBondContact O-CB 3.29Å; C325-L329 VanDerWaalsContact O-CG 3.29Å; C325-L329 WeakPolarHBondContact O-CG 3.47Å; C325-L329 PolarHBondContact O-N 3.33Å; L326-L329 PolarHBondContact O-N 3.08Å; Y327-L329 VanDerWaalsContact C-N 3.31Å; Y327-L329 PolarHBondContact O-N 3.03Å; L329-G332 PolarHBondContact O-N 3.04Å; L329-F333 HydrophobicContact CB-CE2 4.47Å; L329-F333 HydrophobicContact CB-CZ 4.4Å; L329-F333 HydrophobicContact CD2-CE1 4.28Å; L329-F333 HydrophobicContact CD2-CZ 4.11Å; L329-F333 WeakPolarHBondContact O-CD2 3.41Å; L329-F333 VanDerWaalsContact O-CG 3.23Å; L329-F333 WeakPolarHBondContact O-CG 3.3Å; L329-F333 PolarHBondContact O-N 3.49Å; L329-L385 HydrophobicContact CB-CD1 3.57Å
330	A	98.6	Very high	98.3	Very high	2 Å²	2	14.4 Å²	14.4	2%	0.017	7%	0.068	C	C	.	.	H	α-helix	trans	-60.5	-52.4	-179.4	0	0	0	0	0	111.9	L326 Y327 V334 L381 L385	L326-A330 WeakPolarHBondContact O-CB 3.44Å; L326-A330 PolarHBondContact O-N 3.25Å; Y327-A330 PolarHBondContact O-N 3.47Å; A330-V334 WeakPolarHBondContact O-CG2 3.42Å; A330-L381 HydrophobicContact CB-CD1 3.92Å; A330-L385 HydrophobicContact CB-CB 4.13Å; A330-L385 HydrophobicContact CB-CD1 4.19Å
331	F	98.6	Very high	98.3	Very high	2 Å²	2	16 Å²	16	1%	0.009	8%	0.075	C	C	.	.	H	α-helix	trans	-72.9	-29.5	177.6	-78.2	-89.2	0	0	0	113	F195 V304 L307 A308 I311 Y327 V334 S335 P362 L365	F195-F331 HydrophobicContact CE1-CB 4.04Å; F195-F331 HydrophobicContact CZ-CB 3.7Å; F195-F331 HydrophobicContact CZ-CG 4.13Å; V304-F331 HydrophobicContact CG1-CD1 4.4Å; L307-F331 HydrophobicContact CB-CE1 4.43Å; A308-F331 HydrophobicContact CB-CD1 3.61Å; A308-F331 HydrophobicContact CB-CE1 3.7Å; A308-F331 HydrophobicContact CB-CG 4.08Å; A308-F331 HydrophobicContact CB-CZ 4.26Å; I311-F331 HydrophobicContact CD1-CE1 4.38Å; I311-F331 HydrophobicContact CD1-CZ 3.67Å; Y327-F331 AromaticContact CD1-CD2 3.77Å; Y327-F331 HydrophobicContact CD1-CD2 3.77Å; Y327-F331 HydrophobicContact CD1-CE2 4.22Å; Y327-F331 HydrophobicContact CD2-CE2 4.27Å; Y327-F331 AromaticContact CE1-CD2 3.41Å; Y327-F331 HydrophobicContact CE1-CD2 3.41Å; Y327-F331 VanDerWaalsContact CE1-CD2 3.41Å; Y327-F331 AromaticContact CE1-CE2 3.61Å; Y327-F331 HydrophobicContact CE1-CE2 3.61Å; Y327-F331 HydrophobicContact CE1-CG 4.18Å; Y327-F331 HydrophobicContact CE2-CD2 4.22Å; Y327-F331 AromaticContact CE2-CE2 3.68Å; Y327-F331 HydrophobicContact CE2-CE2 3.68Å; Y327-F331 HydrophobicContact CG-CD2 4.29Å; Y327-F331 AromaticContact CZ-CD2 3.64Å; Y327-F331 AromaticContact CZ-CE2 3.29Å; Y327-F331 WeakPolarHBondContact O-CD2 3.22Å; Y327-F331 PolarHBondContact O-N 3.24Å; Y327-F331 VanDerWaalsContact O-N 3.08Å; Y327-F331 WeakPolarHBondContact OH-CE2 2.99Å; F331-V334 WeakPolarHBondContact O-CB 3.42Å; F331-V334 PolarHBondContact O-N 3.47Å; F331-S335 WeakPolarHBondContact O-CB 3.36Å; F331-S335 PolarHBondContact O-N 3.4Å; F331-P362 HydrophobicContact CD1-CG 4.21Å; F331-P362 HydrophobicContact CE1-CB 3.78Å; F331-P362 HydrophobicContact CE1-CG 3.78Å; F331-P362 HydrophobicContact CZ-CB 4.13Å; F331-P362 HydrophobicContact CZ-CG 4.27Å; F331-L365 HydrophobicContact CE2-CD1 4.18Å; F331-L365 HydrophobicContact CZ-CD1 4.37Å
332	G	98.6	Very high	98.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-64	-42.4	176	0	0	0	0	0	112.2	V171 I328 L329 V334 S335 A336	V171-G332 WeakPolarHBondContact CG2-O 3.35Å; I328-G332 VanDerWaalsContact O-CA 3.23Å; I328-G332 WeakPolarHBondContact O-CA 3.44Å; I328-G332 PolarHBondContact O-N 3.24Å; L329-G332 PolarHBondContact O-N 3.04Å; G332-V334 VanDerWaalsContact C-N 3.31Å; G332-V334 PolarHBondContact O-N 3.48Å; G332-S335 PolarHBondContact O-N 3.07Å; G332-A336 WeakPolarHBondContact O-CB 3.45Å; G332-A336 PolarHBondContact O-N 3.18Å
333	F	98.8	Very high	98.3	Very high	13 Å²	13	8.2 Å²	8.2	6%	0.057	4%	0.04	C	C	.	.	H	α-helix	trans	-64.7	-35.5	174.9	-63	-21.9	0	0	0	112.6	L168 F172 L329 K337 L385 L389 L392	L168-F333 HydrophobicContact CD1-CD1 3.55Å; L168-F333 HydrophobicContact CD1-CE1 3.57Å; F172-F333 AromaticContact CE2-CE1 3.98Å; F172-F333 HydrophobicContact CE2-CE1 3.98Å; F172-F333 AromaticContact CZ-CE1 3.96Å; F172-F333 HydrophobicContact CZ-CE1 3.96Å; F172-F333 HydrophobicContact CZ-CZ 4.15Å; L329-F333 HydrophobicContact CB-CE2 4.47Å; L329-F333 HydrophobicContact CB-CZ 4.4Å; L329-F333 HydrophobicContact CD2-CE1 4.28Å; L329-F333 HydrophobicContact CD2-CZ 4.11Å; L329-F333 WeakPolarHBondContact O-CD2 3.41Å; L329-F333 VanDerWaalsContact O-CG 3.23Å; L329-F333 WeakPolarHBondContact O-CG 3.3Å; L329-F333 PolarHBondContact O-N 3.49Å; F333-K337 PolarHBondContact O-N 2.83Å; F333-L385 HydrophobicContact CD2-CD1 3.85Å; F333-L385 HydrophobicContact CE2-CD1 3.54Å; F333-L385 HydrophobicContact CE2-CG 4.41Å; F333-L389 HydrophobicContact CD2-CB 3.66Å; F333-L389 HydrophobicContact CD2-CD1 4.1Å; F333-L389 HydrophobicContact CD2-CG 4.42Å; F333-L389 HydrophobicContact CE2-CB 3.76Å; F333-L389 HydrophobicContact CE2-CD1 3.78Å; F333-L389 HydrophobicContact CE2-CD2 4.31Å; F333-L389 HydrophobicContact CE2-CG 4.15Å; F333-L389 HydrophobicContact CZ-CD1 4.06Å; F333-L392 HydrophobicContact CB-CD2 4.17Å; F333-L392 HydrophobicContact CD1-CD2 4.24Å; F333-L392 HydrophobicContact CG-CD2 4.41Å
334	V	98.5	Very high	98.2	Very high	1 Å²	1	5.8 Å²	5.8	1%	0.006	3%	0.029	C	C	.	.	H	α-helix	trans	-63	-49.3	171	179.5	0	0	0	0	110.2	V304 A330 F331 G332 A336 K337 I338 A358 P362 S388	V304-V334 HydrophobicContact CG1-CG1 4.38Å; V304-V334 HydrophobicContact CG2-CG1 3.82Å; A330-V334 WeakPolarHBondContact O-CG2 3.42Å; F331-V334 WeakPolarHBondContact O-CB 3.42Å; F331-V334 PolarHBondContact O-N 3.47Å; G332-V334 VanDerWaalsContact C-N 3.31Å; G332-V334 PolarHBondContact O-N 3.48Å; V334-A336 PolarHBondContact O-N 3.31Å; V334-K337 PolarHBondContact O-N 3.3Å; V334-I338 HydrophobicContact CG1-CG1 4.41Å; V334-I338 VanDerWaalsContact O-CG1 3.28Å; V334-I338 WeakPolarHBondContact O-CG1 3.47Å; V334-I338 PolarHBondContact O-N 3.28Å; V334-A358 HydrophobicContact CG1-CB 4.04Å; V334-A358 WeakPolarHBondContact CG2-O 3.1Å; V334-P362 HydrophobicContact CG2-CG 4.03Å; V334-S388 WeakPolarHBondContact CG2-OG 3.26Å
335	S	98.4	Very high	98.1	Very high	4 Å²	4	5.7 Å²	5.7	3%	0.028	3%	0.029	C	C	.	.	H	α-helix	trans	-60.6	-43.2	179	-170.9	0	0	0	0	112.5	F331 G332 I338 T339	F331-S335 WeakPolarHBondContact O-CB 3.36Å; F331-S335 PolarHBondContact O-N 3.4Å; G332-S335 PolarHBondContact O-N 3.07Å; S335-I338 PolarHBondContact O-N 2.81Å; S335-T339 WeakPolarHBondContact O-CB 3.4Å; S335-T339 PolarHBondContact O-N 2.84Å; S335-T339 PolarHBondContact O-OG1 2.96Å
336	A	98.5	Very high	98	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.008	3%	0.032	C	C	.	.	H	α-helix	trans	-60.3	-46.9	175.6	0	0	0	0	0	111.3	S167 L168 V171 G332 V334 I338 T339 N340 L392	S167-A336 PolarHBondContact OG-O 3.49Å; L168-A336 HydrophobicContact CB-CB 4.49Å; L168-A336 HydrophobicContact CD1-CB 4.5Å; V171-A336 HydrophobicContact CG2-CB 4.48Å; G332-A336 WeakPolarHBondContact O-CB 3.45Å; G332-A336 PolarHBondContact O-N 3.18Å; V334-A336 PolarHBondContact O-N 3.31Å; A336-I338 PolarHBondContact O-N 3.45Å; A336-T339 WeakPolarHBondContact O-CB 3.47Å; A336-T339 PolarHBondContact O-N 2.95Å; A336-N340 VanDerWaalsContact O-CG 3.24Å; A336-N340 PolarHBondContact O-N 2.96Å; A336-N340 PolarHBondContact O-OD1 3.44Å; A336-N340 VanDerWaalsContact O-OD1 3.1Å; A336-L392 HydrophobicContact CB-CD2 4.15Å
337	K	97.8	Very high	97.9	Very high	9 Å²	9	5.4 Å²	5.4	4%	0.039	3%	0.027	C	C	.	.	H	α-helix	trans	-61.9	-44.7	176.8	-175.1	175.5	165	-166	0	112	F333 V334 T339 N340 K341 D356 A358 D391 L392 Y395	F333-K337 PolarHBondContact O-N 2.83Å; V334-K337 PolarHBondContact O-N 3.3Å; K337-T339 VanDerWaalsContact C-N 3.28Å; K337-T339 PolarHBondContact O-N 3.2Å; K337-N340 PolarHBondContact O-N 3.45Å; K337-K341 PolarHBondContact O-N 2.93Å; K337-D356 VanDerWaalsContact CE-OD1 3.29Å; K337-D356 WeakPolarHBondContact CE-OD1 3.19Å; K337-D356 IonicContact NZ-OD1 3.09Å; K337-D356 PolarHBondContact NZ-OD1 3.19Å; K337-D356 IonicContact NZ-OD2 3.31Å; K337-A358 HydrophobicContact CD-CB 4Å; K337-D391 WeakPolarHBondContact CD-OD2 3.48Å; K337-D391 WeakPolarHBondContact CE-OD2 3.45Å; K337-D391 IonicContact NZ-OD1 3.99Å; K337-D391 PolarHBondContact NZ-OD1 3.1Å; K337-D391 IonicContact NZ-OD2 3.63Å; K337-D391 PolarHBondContact NZ-OD2 3.42Å; K337-L392 HydrophobicContact CB-CB 4.44Å; K337-L392 HydrophobicContact CB-CD1 3.74Å; K337-L392 HydrophobicContact CG-CD1 4.37Å; K337-Y395 HydrophobicContact CD-CG 4.42Å; K337-Y395 HydrophobicContact CG-CD1 4.14Å; K337-Y395 HydrophobicContact CG-CG 4.33Å
338	I	97.9	Very high	97.8	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.005	3%	0.027	C	C	.	.	H	α-helix	trans	-63.2	-37.2	178.7	-67.2	-60.9	0	0	0	111.2	Y202 H300 V304 V334 S335 A336 K341 L342 A358 F359	Y202-I338 HydrophobicContact CE2-CG2 3.81Å; H300-I338 HydrophobicContact CB-CG2 3.76Å; V304-I338 HydrophobicContact CG2-CG1 4.22Å; V334-I338 HydrophobicContact CG1-CG1 4.41Å; V334-I338 VanDerWaalsContact O-CG1 3.28Å; V334-I338 WeakPolarHBondContact O-CG1 3.47Å; V334-I338 PolarHBondContact O-N 3.28Å; S335-I338 PolarHBondContact O-N 2.81Å; A336-I338 PolarHBondContact O-N 3.45Å; I338-K341 PolarHBondContact O-N 3.44Å; I338-L342 PolarHBondContact O-N 3.41Å; I338-L342 VanDerWaalsContact O-N 3.17Å; I338-A358 HydrophobicContact CD1-CB 4.33Å; I338-F359 HydrophobicContact CD1-CE2 3.81Å; I338-F359 HydrophobicContact CD1-CZ 4.01Å; I338-F359 HydrophobicContact CG1-CZ 4.3Å
339	T	98.2	Very high	97.6	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.018	4%	0.039	C	C	.	.	H	α-helix	trans	-64.4	-46.2	172.2	-53.5	0	0	0	0	111.2	F201 Y202 S335 A336 K337 K341 L342 V343	F201-T339 HydrophobicContact CD1-CG2 3.84Å; F201-T339 HydrophobicContact CE1-CG2 3.72Å; Y202-T339 HydrophobicContact CD2-CG2 4.44Å; S335-T339 WeakPolarHBondContact O-CB 3.4Å; S335-T339 PolarHBondContact O-N 2.84Å; S335-T339 PolarHBondContact O-OG1 2.96Å; A336-T339 WeakPolarHBondContact O-CB 3.47Å; A336-T339 PolarHBondContact O-N 2.95Å; K337-T339 VanDerWaalsContact C-N 3.28Å; K337-T339 PolarHBondContact O-N 3.2Å; T339-K341 VanDerWaalsContact C-N 3.27Å; T339-K341 PolarHBondContact O-N 2.85Å; T339-L342 WeakPolarHBondContact O-CA 3.47Å; T339-L342 VanDerWaalsContact O-CB 3.3Å; T339-L342 WeakPolarHBondContact O-CB 3.46Å; T339-L342 PolarHBondContact O-N 3.15Å; T339-V343 WeakPolarHBondContact O-CG2 3.25Å; T339-V343 PolarHBondContact O-N 3.47Å
340	N	97.7	Very high	97.4	Very high	7 Å²	7	8.4 Å²	8.4	4%	0.037	4%	0.042	C	C	.	.	H	α-helix	trans	-60.3	-38	178.3	-66.6	5.3	0	0	0	111.6	G164 S167 A336 K337 L342 V343 V344 Y395 C396	G164-N340 WeakPolarHBondContact CA-OD1 3.33Å; G164-N340 PolarHBondContact O-ND2 3.46Å; S167-N340 WeakPolarHBondContact CB-OD1 3.16Å; S167-N340 PolarHBondContact OG-OD1 3.21Å; A336-N340 VanDerWaalsContact O-CG 3.24Å; A336-N340 PolarHBondContact O-N 2.96Å; A336-N340 PolarHBondContact O-OD1 3.44Å; A336-N340 VanDerWaalsContact O-OD1 3.1Å; K337-N340 PolarHBondContact O-N 3.45Å; N340-L342 VanDerWaalsContact C-N 3.32Å; N340-L342 PolarHBondContact O-N 3.17Å; N340-V343 PolarHBondContact O-N 3.27Å; N340-V344 WeakPolarHBondContact O-CG2 3.33Å; N340-V344 PolarHBondContact O-N 3.4Å; N340-Y395 HydrophobicContact CB-CD1 4.49Å; N340-Y395 HydrophobicContact CB-CE1 3.93Å; N340-C396 PolarHBondContact ND2-SG 2.84Å
341	K	97.1	Very high	97.1	Very high	33 Å²	33	13.5 Å²	13.5	14%	0.143	7%	0.065	C	C	.	.	H	α-helix	trans	-62.9	-36.3	172.5	-72.5	-173.3	73.9	-180	0	112.9	K337 I338 T339 A345 M352 H353 D356 Y395	K337-K341 PolarHBondContact O-N 2.93Å; I338-K341 PolarHBondContact O-N 3.44Å; T339-K341 VanDerWaalsContact C-N 3.27Å; T339-K341 PolarHBondContact O-N 2.85Å; K341-A345 WeakPolarHBondContact O-CB 3.15Å; K341-A345 PolarHBondContact O-N 2.65Å; K341-M352 HydrophobicContact CB-CE 4.07Å; K341-H353 PolarHBondContact NZ-O 3.36Å; K341-D356 WeakPolarHBondContact CD-OD2 3.2Å; K341-D356 WeakPolarHBondContact CE-OD2 3.35Å; K341-D356 IonicContact NZ-OD2 3.95Å; K341-D356 PolarHBondContact NZ-OD2 3.43Å; K341-Y395 HydrophobicContact CG-CE1 4.1Å; K341-Y395 HydrophobicContact CG-CE2 4.08Å; K341-Y395 WeakPolarHBondContact CG-OH 3.1Å
342	L	97.8	Very high	96.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-67.9	-40.9	175.2	178	63.9	0	0	0	111.4	Y202 H205 W206 Y209 P297 I338 T339 N340 A345 H346 M352	Y202-L342 HydrophobicContact CD1-CD2 4.33Å; Y202-L342 HydrophobicContact CD2-CD2 4.02Å; Y202-L342 HydrophobicContact CE1-CD2 3.94Å; Y202-L342 HydrophobicContact CE2-CB 4.14Å; Y202-L342 HydrophobicContact CE2-CD2 3.58Å; Y202-L342 HydrophobicContact CG-CD2 4.37Å; H205-L342 HydrophobicContact CB-CD2 3.83Å; H205-L342 HydrophobicContact CB-CG 4.28Å; W206-L342 HydrophobicContact CB-CD2 4.07Å; Y209-L342 HydrophobicContact CD1-CD1 3.92Å; Y209-L342 HydrophobicContact CD2-CD1 4.21Å; Y209-L342 HydrophobicContact CG-CD1 3.69Å; P297-L342 HydrophobicContact CB-CD1 4.34Å; P297-L342 HydrophobicContact CG-CD1 4.19Å; I338-L342 PolarHBondContact O-N 3.41Å; I338-L342 VanDerWaalsContact O-N 3.17Å; T339-L342 WeakPolarHBondContact O-CA 3.47Å; T339-L342 VanDerWaalsContact O-CB 3.3Å; T339-L342 WeakPolarHBondContact O-CB 3.46Å; T339-L342 PolarHBondContact O-N 3.15Å; N340-L342 VanDerWaalsContact C-N 3.32Å; N340-L342 PolarHBondContact O-N 3.17Å; L342-A345 PolarHBondContact O-N 2.83Å; L342-H346 PolarHBondContact O-N 3.05Å; L342-M352 HydrophobicContact CB-CE 3.97Å; L342-M352 HydrophobicContact CB-SD 3.7Å; L342-M352 HydrophobicContact CD1-SD 3.4Å; L342-M352 WeakPolarHBondContact CD1-SD 3.25Å; L342-M352 HydrophobicContact CG-SD 4.12Å
343	V	97.3	Very high	96.3	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.012	10%	0.095	C	C	.	.	H	α-helix	trans	-59.9	-50.1	173.7	-173.7	0	0	0	0	110.4	L160 H163 H205 T339 N340 A345 H346 M347	L160-V343 HydrophobicContact CD1-CB 4.02Å; L160-V343 HydrophobicContact CD1-CG1 3.7Å; H163-V343 HydrophobicContact CB-CG1 4.18Å; H163-V343 HydrophobicContact CB-CG2 4.26Å; H205-V343 WeakPolarHBondContact CD2-CG2 3.33Å; T339-V343 WeakPolarHBondContact O-CG2 3.25Å; T339-V343 PolarHBondContact O-N 3.47Å; N340-V343 PolarHBondContact O-N 3.27Å; V343-A345 VanDerWaalsContact C-N 3.34Å; V343-A345 PolarHBondContact O-N 2.63Å; V343-H346 WeakPolarHBondContact O-CB 3.38Å; V343-H346 PolarHBondContact O-N 3.13Å; V343-M347 HydrophobicContact CG1-CG 4.46Å; V343-M347 HydrophobicContact CG1-SD 3.85Å; V343-M347 VanDerWaalsContact O-CG 3.28Å; V343-M347 WeakPolarHBondContact O-CG 3.49Å; V343-M347 PolarHBondContact O-N 2.86Å
344	V	97	Very high	95.6	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-56.5	-48.8	174.8	169.1	0	0	0	0	111	L51 L160 N340 H346 M347 T348 Y395 V399	L51-V344 HydrophobicContact CD2-CG1 3.46Å; L51-V344 VanDerWaalsContact CD2-CG1 3.46Å; L160-V344 HydrophobicContact CD1-CG2 3.55Å; L160-V344 HydrophobicContact CD2-CG2 3.94Å; L160-V344 HydrophobicContact CG-CG2 4.41Å; N340-V344 WeakPolarHBondContact O-CG2 3.33Å; N340-V344 PolarHBondContact O-N 3.4Å; V344-H346 VanDerWaalsContact C-N 3.27Å; V344-H346 PolarHBondContact O-N 2.86Å; V344-M347 PolarHBondContact O-N 3.14Å; V344-M347 VanDerWaalsContact O-N 3.17Å; V344-T348 HydrophobicContact CG1-CG2 4.26Å; V344-T348 PolarHBondContact O-N 3.4Å; V344-T348 PolarHBondContact O-OG1 3.48Å; V344-Y395 WeakPolarHBondContact CG2-OH 3.36Å; V344-V399 HydrophobicContact CG2-CG1 4.14Å
345	A	96.5	Very high	95	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-40	-179.6	0	0	0	0	0	112.4	Y209 K341 L342 V343 K349 S350 M352	Y209-A345 HydrophobicContact CD2-CB 4.33Å; Y209-A345 HydrophobicContact CE2-CB 3.87Å; K341-A345 WeakPolarHBondContact O-CB 3.15Å; K341-A345 PolarHBondContact O-N 2.65Å; L342-A345 PolarHBondContact O-N 2.83Å; V343-A345 VanDerWaalsContact C-N 3.34Å; V343-A345 PolarHBondContact O-N 2.63Å; A345-K349 CarbonylContact O-C 3.45Å; A345-K349 VanDerWaalsContact O-CA 3.29Å; A345-K349 WeakPolarHBondContact O-CA 3.47Å; A345-K349 PolarHBondContact O-N 3.19Å; A345-S350 VanDerWaalsContact CB-O 3.3Å; A345-S350 WeakPolarHBondContact CB-O 3.19Å; A345-S350 PolarHBondContact O-N 2.69Å; A345-M352 HydrophobicContact CB-CG 3.57Å; A345-M352 HydrophobicContact CB-SD 4.45Å
346	H	96.1	Very high	94.6	Very high	13 Å²	13	32.6 Å²	32.6	6%	0.06	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-55.8	172.2	165.2	-112.9	0	0	0	111.8	H62 T208 Y209 L342 V343 V344 T348 K349	H62-H346 AromaticContact CE1-CE1 3.68Å; T208-H346 VanDerWaalsContact CG2-CE1 3.47Å; T208-H346 WeakPolarHBondContact CG2-CE1 3.26Å; T208-H346 PolarHBondContact O-CD2 2.62Å; Y209-H346 HydrophobicContact CD2-CB 3.92Å; L342-H346 PolarHBondContact O-N 3.05Å; V343-H346 WeakPolarHBondContact O-CB 3.38Å; V343-H346 PolarHBondContact O-N 3.13Å; V344-H346 VanDerWaalsContact C-N 3.27Å; V344-H346 PolarHBondContact O-N 2.86Å; H346-T348 VanDerWaalsContact C-N 3.3Å; H346-T348 PolarHBondContact O-N 2.86Å; H346-K349 PolarHBondContact O-N 3.15Å
347	M	95.9	Very high	94.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67	-32.2	-173.8	-58.6	173.8	82.6	0	0	112.6	L59 P156 E159 L160 V343 V344	L59-M347 HydrophobicContact CD1-CB 3.64Å; L59-M347 HydrophobicContact CD1-CE 4.44Å; P156-M347 HydrophobicContact CB-CE 3.83Å; P156-M347 WeakPolarHBondContact O-CE 3.49Å; E159-M347 HydrophobicContact CB-CE 3.93Å; E159-M347 HydrophobicContact CG-CE 3.87Å; L160-M347 HydrophobicContact CB-CE 4.23Å; L160-M347 HydrophobicContact CB-SD 3.81Å; L160-M347 HydrophobicContact CD1-SD 4.16Å; V343-M347 HydrophobicContact CG1-CG 4.46Å; V343-M347 HydrophobicContact CG1-SD 3.85Å; V343-M347 VanDerWaalsContact O-CG 3.28Å; V343-M347 WeakPolarHBondContact O-CG 3.49Å; V343-M347 PolarHBondContact O-N 2.86Å; V344-M347 PolarHBondContact O-N 3.14Å; V344-M347 VanDerWaalsContact O-N 3.17Å
348	T	96.1	Very high	94	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	2.4	176.6	65.3	0	0	0	0	113.2	Q55 R58 L59 V344 H346 S350	Q55-T348 HydrophobicContact CB-CG2 3.97Å; Q55-T348 WeakPolarHBondContact O-CG2 3.37Å; R58-T348 WeakPolarHBondContact CB-O 3.2Å; R58-T348 WeakPolarHBondContact CD-O 3.45Å; L59-T348 HydrophobicContact CB-CG2 4.27Å; L59-T348 HydrophobicContact CD1-CG2 3.89Å; V344-T348 HydrophobicContact CG1-CG2 4.26Å; V344-T348 PolarHBondContact O-N 3.4Å; V344-T348 PolarHBondContact O-OG1 3.48Å; H346-T348 VanDerWaalsContact C-N 3.3Å; H346-T348 PolarHBondContact O-N 2.86Å; T348-S350 PolarHBondContact O-N 2.83Å; T348-S350 PolarHBondContact OG1-OG 3.32Å
349	K	95.3	Very high	93.8	Very high	59 Å²	59	38.8 Å²	38.8	26%	0.257	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	46.3	-175.6	-49.3	176.8	-176.4	164.2	0	112.2	R58 I289 A345 H346	R58-K349 PolarHBondContact NH1-O 3.44Å; I289-K349 HydrophobicContact CD1-CD 4.23Å; I289-K349 HydrophobicContact CD1-CG 3.97Å; I289-K349 HydrophobicContact CG1-CB 4.47Å; I289-K349 HydrophobicContact CG1-CD 4.15Å; I289-K349 HydrophobicContact CG1-CG 3.93Å; I289-K349 HydrophobicContact CG2-CB 4.47Å; I289-K349 HydrophobicContact CG2-CG 4.44Å; A345-K349 CarbonylContact O-C 3.45Å; A345-K349 VanDerWaalsContact O-CA 3.29Å; A345-K349 WeakPolarHBondContact O-CA 3.47Å; A345-K349 PolarHBondContact O-N 3.19Å; H346-K349 PolarHBondContact O-N 3.15Å
350	S	94.6	Very high	93.7	Very high	17 Å²	17	42.6 Å²	42.6	12%	0.119	21%	0.208	C	C	.	.			trans	-121.1	155.8	-175.5	64	0	0	0	0	111.6	Q55 Y209 A290 A345 T348	Q55-S350 PolarHBondContact NE2-OG 3.26Å; Y209-S350 PolarHBondContact OH-O 3Å; Y209-S350 VanDerWaalsContact OH-O 3.14Å; A290-S350 VanDerWaalsContact CB-C 3.43Å; A345-S350 VanDerWaalsContact CB-O 3.3Å; A345-S350 WeakPolarHBondContact CB-O 3.19Å; A345-S350 PolarHBondContact O-N 2.69Å; T348-S350 PolarHBondContact O-N 2.83Å; T348-S350 PolarHBondContact OG1-OG 3.32Å
351	E	93.3	Very high	93.6	Very high	110 Å²	110	42.2 Å²	42.2	51%	0.514	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-67.4	158.4	175.6	65.7	-178	-178.3	0	0	113	T292 H353	T292-E351 HydrophobicContact CG2-CB 3.6Å; E351-H353 IonicContact OE1-CE1 2.84Å; E351-H353 PolarHBondContact OE1-CE1 2.79Å; E351-H353 IonicContact OE1-ND1 3.35Å
352	M	92.2	Very high	93.5	Very high	20 Å²	20	40.9 Å²	40.9	10%	0.099	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-98.8	121.9	173.1	-68.2	-175.2	67.3	0	0	110.8	H300 K341 L342 A345	H300-M352 HydrophobicContact CB-CE 4.36Å; H300-M352 PolarHBondContact CE1-O 2.84Å; H300-M352 PolarHBondContact NE2-O 3.35Å; K341-M352 HydrophobicContact CB-CE 4.07Å; L342-M352 HydrophobicContact CB-CE 3.97Å; L342-M352 HydrophobicContact CB-SD 3.7Å; L342-M352 HydrophobicContact CD1-SD 3.4Å; L342-M352 WeakPolarHBondContact CD1-SD 3.25Å; L342-M352 HydrophobicContact CG-SD 4.12Å; A345-M352 HydrophobicContact CB-CG 3.57Å; A345-M352 HydrophobicContact CB-SD 4.45Å
353	H	88	Confident	93.5	Very high	116 Å²	116	41.9 Å²	41.9	54%	0.537	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-82.7	135.2	171.5	-58.2	-63	0	0	0	111.4	H300 K341 E351	H300-H353 VanDerWaalsContact NE2-C 3.29Å; H300-H353 PolarHBondContact NE2-O 2.9Å; H300-H353 VanDerWaalsContact NE2-O 3.16Å; K341-H353 PolarHBondContact NZ-O 3.36Å; E351-H353 IonicContact OE1-CE1 2.84Å; E351-H353 PolarHBondContact OE1-CE1 2.79Å; E351-H353 IonicContact OE1-ND1 3.35Å
354	L	83.5	Confident	93.4	Very high	71 Å²	71	44.8 Å²	44.8	37%	0.372	23%	0.227	S	C	.	.	S	Bend	trans	-73.6	-38.5	-178.4	-173.2	66.7	0	0	0	112.5	L299 H300 D356	L299-L354 HydrophobicContact CB-CD1 4.28Å; H300-L354 WeakPolarHBondContact NE2-CA 3.5Å; H300-L354 PolarHBondContact NE2-N 2.94Å; L354-D356 PolarHBondContact O-N 3.43Å; L354-D356 VanDerWaalsContact O-N 3.13Å
355	H	86.2	Confident	93.4	Very high	179 Å²	179	44.5 Å²	44.5	83%	0.829	23%	0.225	S	C	*	.			trans	-64.3	114.8	178	-61.9	-67.4	0	0	0	110.2
356	D	90.3	Very high	93.4	Very high	35 Å²	35	47.6 Å²	47.6	19%	0.187	24%	0.238	C	C	.	.			trans	-150.6	142.8	-179.6	-158.3	-68.2	0	0	0	111.3	K337 K341 L354 A358 F359	K337-D356 VanDerWaalsContact CE-OD1 3.29Å; K337-D356 WeakPolarHBondContact CE-OD1 3.19Å; K337-D356 IonicContact NZ-OD1 3.09Å; K337-D356 PolarHBondContact NZ-OD1 3.19Å; K337-D356 IonicContact NZ-OD2 3.31Å; K341-D356 WeakPolarHBondContact CD-OD2 3.2Å; K341-D356 WeakPolarHBondContact CE-OD2 3.35Å; K341-D356 IonicContact NZ-OD2 3.95Å; K341-D356 PolarHBondContact NZ-OD2 3.43Å; L354-D356 PolarHBondContact O-N 3.43Å; L354-D356 VanDerWaalsContact O-N 3.13Å; D356-A358 HydrophobicContact CB-CB 4.33Å; D356-A358 PolarHBondContact O-N 3.21Å; D356-A358 VanDerWaalsContact OD1-CB 3.32Å; D356-A358 WeakPolarHBondContact OD1-CB 3.36Å; D356-A358 PolarHBondContact OD1-N 3.17Å; D356-F359 HydrophobicContact CB-CD2 4.2Å; D356-F359 HydrophobicContact CB-CE2 4.47Å; D356-F359 PolarHBondContact O-N 3.5Å
357	L	90.8	Very high	93.3	Very high	108 Å²	108	51 Å²	51	57%	0.565	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-60.3	-20.4	173.7	-68	173.9	0	0	0	112.9	F359 L360	L357-F359 PolarHBondContact O-N 2.86Å; L357-F359 VanDerWaalsContact O-N 3.12Å; L357-L360 WeakPolarHBondContact O-CB 3.47Å; L357-L360 PolarHBondContact O-N 3.17Å
358	A	91.3	Very high	93.3	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.008	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-54.9	-31.3	175.2	0	0	0	0	0	112.1	V334 K337 I338 D356 L360 D391	V334-A358 HydrophobicContact CG1-CB 4.04Å; V334-A358 WeakPolarHBondContact CG2-O 3.1Å; K337-A358 HydrophobicContact CD-CB 4Å; I338-A358 HydrophobicContact CD1-CB 4.33Å; D356-A358 HydrophobicContact CB-CB 4.33Å; D356-A358 PolarHBondContact O-N 3.21Å; D356-A358 VanDerWaalsContact OD1-CB 3.32Å; D356-A358 WeakPolarHBondContact OD1-CB 3.36Å; D356-A358 PolarHBondContact OD1-N 3.17Å; A358-L360 VanDerWaalsContact C-N 3.34Å; A358-D391 WeakPolarHBondContact CA-OD2 3.41Å; A358-D391 PolarHBondContact N-OD2 3.4Å
359	F	95	Very high	93.2	Very high	32 Å²	32	52.1 Å²	52.1	14%	0.14	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-84.8	-2.4	179.8	-65.9	-73.2	0	0	0	114	V304 L307 I338 D356 L357 G363	V304-F359 HydrophobicContact CG2-CE1 3.53Å; V304-F359 HydrophobicContact CG2-CZ 3.89Å; L307-F359 HydrophobicContact CD1-CD1 3.96Å; L307-F359 HydrophobicContact CD1-CE1 4.49Å; I338-F359 HydrophobicContact CD1-CE2 3.81Å; I338-F359 HydrophobicContact CD1-CZ 4.01Å; I338-F359 HydrophobicContact CG1-CZ 4.3Å; D356-F359 HydrophobicContact CB-CD2 4.2Å; D356-F359 HydrophobicContact CB-CE2 4.47Å; D356-F359 PolarHBondContact O-N 3.5Å; L357-F359 PolarHBondContact O-N 2.86Å; L357-F359 VanDerWaalsContact O-N 3.12Å; F359-G363 WeakPolarHBondContact O-CA 3.43Å; F359-G363 PolarHBondContact O-N 3.07Å
360	L	95.8	Very high	93.1	Very high	82 Å²	82	57 Å²	57	43%	0.429	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-48.2	-179.7	-178.3	61.1	0	0	0	111.6	L357 A358 G363 L364 I387	L357-L360 WeakPolarHBondContact O-CB 3.47Å; L357-L360 PolarHBondContact O-N 3.17Å; A358-L360 VanDerWaalsContact C-N 3.34Å; L360-G363 PolarHBondContact O-N 3.34Å; L360-L364 HydrophobicContact CD1-CG 4.41Å; L360-L364 HydrophobicContact CG-CD1 4.42Å; L360-L364 WeakPolarHBondContact O-CG 3.43Å; L360-L364 PolarHBondContact O-N 3.17Å; L360-I387 HydrophobicContact CB-CG2 4.33Å; L360-I387 HydrophobicContact CD2-CD1 4.27Å; L360-I387 HydrophobicContact CD2-CG2 4.15Å; L360-I387 HydrophobicContact CG-CG2 4.47Å
361	G	95.8	Very high	93.1	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-57.4	177.8	0	0	0	0	0	113	G363 L364 L365	G361-G363 VanDerWaalsContact C-N 3.25Å; G361-G363 PolarHBondContact O-N 3.02Å; G361-L364 PolarHBondContact O-N 3.23Å; G361-L365 PolarHBondContact O-N 3.41Å
362	P	95.9	Very high	93	Very high	4 Å²	4	64 Å²	64	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-56.3	-36.7	172.9	-28.7	36.6	0	0	0	113.8	L307 I311 F331 V334 L365 F366	L307-P362 HydrophobicContact CB-CB 4.41Å; L307-P362 HydrophobicContact CD1-CB 4.04Å; I311-P362 WeakPolarHBondContact CD1-O 3.38Å; F331-P362 HydrophobicContact CD1-CG 4.21Å; F331-P362 HydrophobicContact CE1-CB 3.78Å; F331-P362 HydrophobicContact CE1-CG 3.78Å; F331-P362 HydrophobicContact CZ-CB 4.13Å; F331-P362 HydrophobicContact CZ-CG 4.27Å; V334-P362 HydrophobicContact CG2-CG 4.03Å; P362-L365 PolarHBondContact O-N 3.31Å; P362-F366 WeakPolarHBondContact O-CB 3.19Å; P362-F366 PolarHBondContact O-N 3.3Å
363	G	96	Very high	92.9	Very high	22 Å²	22	64.7 Å²	64.7	23%	0.227	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-40.3	176.9	0	0	0	0	0	112.9	F359 L360 G361 F366 L367	F359-G363 WeakPolarHBondContact O-CA 3.43Å; F359-G363 PolarHBondContact O-N 3.07Å; L360-G363 PolarHBondContact O-N 3.34Å; G361-G363 VanDerWaalsContact C-N 3.25Å; G361-G363 PolarHBondContact O-N 3.02Å; G363-F366 PolarHBondContact O-N 2.83Å; G363-L367 WeakPolarHBondContact O-CB 3.42Å; G363-L367 VanDerWaalsContact O-CG 3.27Å; G363-L367 WeakPolarHBondContact O-CG 3.49Å; G363-L367 PolarHBondContact O-N 2.83Å
364	L	96.1	Very high	93	Very high	63 Å²	63	66 Å²	66	33%	0.33	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-44.9	174.5	-70.7	172.3	0	0	0	111.5	L360 G361 L367 D368 V380 I383 I387	L360-L364 HydrophobicContact CD1-CG 4.41Å; L360-L364 HydrophobicContact CG-CD1 4.42Å; L360-L364 WeakPolarHBondContact O-CG 3.43Å; L360-L364 PolarHBondContact O-N 3.17Å; G361-L364 PolarHBondContact O-N 3.23Å; L364-L367 PolarHBondContact O-N 3.07Å; L364-D368 VanDerWaalsContact O-CB 3.32Å; L364-D368 WeakPolarHBondContact O-CB 3.46Å; L364-D368 PolarHBondContact O-N 3.15Å; L364-V380 HydrophobicContact CB-CG1 3.98Å; L364-I383 HydrophobicContact CD1-CG2 4.28Å; L364-I387 HydrophobicContact CD1-CD1 4.1Å
365	L	96.4	Very high	93.5	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.8	-44.5	175.2	-78	166.7	0	0	0	112.1	I311 L319 F331 G361 P362 D368 Q369 V380 L381 A384	I311-L365 HydrophobicContact CD1-CB 3.66Å; I311-L365 HydrophobicContact CD1-CD1 4.47Å; I311-L365 HydrophobicContact CG1-CB 4.24Å; I311-L365 HydrophobicContact CG2-CB 4.22Å; I311-L365 HydrophobicContact CG2-CD1 4.41Å; L319-L365 HydrophobicContact CD2-CD2 3.96Å; F331-L365 HydrophobicContact CE2-CD1 4.18Å; F331-L365 HydrophobicContact CZ-CD1 4.37Å; G361-L365 PolarHBondContact O-N 3.41Å; P362-L365 PolarHBondContact O-N 3.31Å; L365-D368 PolarHBondContact O-N 2.94Å; L365-Q369 WeakPolarHBondContact O-CG 3.5Å; L365-Q369 PolarHBondContact O-N 3.4Å; L365-V380 HydrophobicContact CD2-CB 3.84Å; L365-V380 HydrophobicContact CD2-CG1 3.73Å; L365-V380 HydrophobicContact CG-CG1 3.89Å; L365-L381 HydrophobicContact CD1-CD1 3.88Å; L365-L381 HydrophobicContact CD2-CB 4.3Å; L365-A384 HydrophobicContact CD1-CB 4.07Å
366	F	96.2	Very high	93.9	Very high	68 Å²	68	61.7 Å²	61.7	30%	0.298	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.9	169.6	-113.9	0	0	0	112.2	L307 M310 I311 P362 G363 Q369 Y370	L307-F366 HydrophobicContact CD2-CB 4.44Å; M310-F366 HydrophobicContact CE-CB 4.23Å; M310-F366 HydrophobicContact CE-CD2 2.97Å; M310-F366 HydrophobicContact CE-CE2 3.32Å; M310-F366 HydrophobicContact CE-CG 3.73Å; M310-F366 HydrophobicContact CE-CZ 4.32Å; M310-F366 HydrophobicContact SD-CD2 3.62Å; M310-F366 HydrophobicContact SD-CE2 3.38Å; M310-F366 WeakPolarHBondContact SD-CE2 3.28Å; M310-F366 HydrophobicContact SD-CZ 4.44Å; I311-F366 HydrophobicContact CD1-CB 4.38Å; P362-F366 WeakPolarHBondContact O-CB 3.19Å; P362-F366 PolarHBondContact O-N 3.3Å; G363-F366 PolarHBondContact O-N 2.83Å; F366-Q369 PolarHBondContact O-N 3.49Å; F366-Y370 WeakPolarHBondContact O-CB 3.46Å; F366-Y370 PolarHBondContact O-N 3.12Å
367	L	95.4	Very high	94.1	Very high	84 Å²	84	60 Å²	60	44%	0.44	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-42.8	178.9	-75.4	170.9	0	0	0	111.4	G363 L364 Y370 F371	G363-L367 WeakPolarHBondContact O-CB 3.42Å; G363-L367 VanDerWaalsContact O-CG 3.27Å; G363-L367 WeakPolarHBondContact O-CG 3.49Å; G363-L367 PolarHBondContact O-N 2.83Å; L364-L367 PolarHBondContact O-N 3.07Å; L367-Y370 WeakPolarHBondContact O-CB 3.2Å; L367-Y370 PolarHBondContact O-N 3.43Å; L367-F371 HydrophobicContact CD2-CE2 4.44Å; L367-F371 WeakPolarHBondContact O-CD2 3.4Å; L367-F371 PolarHBondContact O-N 3.01Å
368	D	94.8	Very high	94.4	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-49.9	176.9	-175.5	45.3	0	0	0	111.2	L364 L365 Y370 F371 N372 S373 F374 I375 V380	L364-D368 VanDerWaalsContact O-CB 3.32Å; L364-D368 WeakPolarHBondContact O-CB 3.46Å; L364-D368 PolarHBondContact O-N 3.15Å; L365-D368 PolarHBondContact O-N 2.94Å; D368-Y370 VanDerWaalsContact C-N 3.31Å; D368-Y370 PolarHBondContact O-N 3.09Å; D368-F371 CarbonylContact O-C 3.59Å; D368-F371 PolarHBondContact O-N 3.4Å; D368-F371 VanDerWaalsContact O-N 3.1Å; D368-N372 PolarHBondContact O-N 2.93Å; D368-S373 VanDerWaalsContact O-CA 3.32Å; D368-S373 WeakPolarHBondContact O-CA 3.3Å; D368-S373 PolarHBondContact O-N 3.24Å; D368-F374 WeakPolarHBondContact OD1-CD1 3.18Å; D368-F374 PolarHBondContact OD1-N 3.14Å; D368-F374 VanDerWaalsContact OD1-N 3.13Å; D368-I375 PolarHBondContact OD1-N 2.87Å; D368-I375 VanDerWaalsContact OD2-O 3.05Å; D368-V380 HydrophobicContact CB-CG2 4.41Å
369	Q	94.7	Very high	94.7	Very high	21 Å²	21	63.2 Å²	63.2	10%	0.098	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-36.1	174.8	-71.7	-176.9	-14.5	0	0	113.4	I311 S315 L365 F366 F371 N372 E377	I311-Q369 VanDerWaalsContact CA-OE1 3.3Å; I311-Q369 PolarHBondContact O-NE2 3.05Å; S315-Q369 VanDerWaalsContact CA-NE2 3.33Å; L365-Q369 WeakPolarHBondContact O-CG 3.5Å; L365-Q369 PolarHBondContact O-N 3.4Å; F366-Q369 PolarHBondContact O-N 3.49Å; Q369-F371 VanDerWaalsContact C-N 3.26Å; Q369-F371 PolarHBondContact O-N 2.83Å; Q369-N372 PolarHBondContact O-N 2.86Å; Q369-N372 VanDerWaalsContact O-N 3.16Å; Q369-E377 HydrophobicContact CG-CG 4.48Å; Q369-E377 PolarHBondContact NE2-OE2 3.01Å
370	Y	93.6	Very high	94.8	Very high	160 Å²	160	62 Å²	62	63%	0.627	31%	0.305	S	S	*	.	H	α-helix	trans	-62.6	-35	175.7	-179.3	-95.5	0	0	0	112	F366 L367 D368 N372	F366-Y370 WeakPolarHBondContact O-CB 3.46Å; F366-Y370 PolarHBondContact O-N 3.12Å; L367-Y370 WeakPolarHBondContact O-CB 3.2Å; L367-Y370 PolarHBondContact O-N 3.43Å; D368-Y370 VanDerWaalsContact C-N 3.31Å; D368-Y370 PolarHBondContact O-N 3.09Å; Y370-N372 VanDerWaalsContact C-N 3.26Å; Y370-N372 PolarHBondContact O-N 2.99Å
371	F	93.3	Very high	94.9	Very high	124 Å²	124	58.1 Å²	58.1	54%	0.544	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	29.6	175.1	-67.7	-69.1	0	0	0	113.1	L367 D368 Q369 S373 F374	L367-F371 HydrophobicContact CD2-CE2 4.44Å; L367-F371 WeakPolarHBondContact O-CD2 3.4Å; L367-F371 PolarHBondContact O-N 3.01Å; D368-F371 CarbonylContact O-C 3.59Å; D368-F371 PolarHBondContact O-N 3.4Å; D368-F371 VanDerWaalsContact O-N 3.1Å; Q369-F371 VanDerWaalsContact C-N 3.26Å; Q369-F371 PolarHBondContact O-N 2.83Å; F371-S373 VanDerWaalsContact C-N 3.35Å; F371-S373 PolarHBondContact O-N 2.99Å; F371-F374 HydrophobicContact CB-CD1 4.13Å
372	N	91	Very high	95	Very high	152 Å²	152	63.2 Å²	63.2	81%	0.813	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	38.9	178.6	-59.9	-53.3	0	0	0	114	D368 Q369 Y370	D368-N372 PolarHBondContact O-N 2.93Å; Q369-N372 PolarHBondContact O-N 2.86Å; Q369-N372 VanDerWaalsContact O-N 3.16Å; Y370-N372 VanDerWaalsContact C-N 3.26Å; Y370-N372 PolarHBondContact O-N 2.99Å
373	S	91.3	Very high	95.1	Very high	33 Å²	33	66.4 Å²	66.4	23%	0.231	32%	0.32	C	S	.	.			trans	53.4	59.5	176.2	-53.2	0	0	0	0	111.7	D368 F371 I375 E377	D368-S373 VanDerWaalsContact O-CA 3.32Å; D368-S373 WeakPolarHBondContact O-CA 3.3Å; D368-S373 PolarHBondContact O-N 3.24Å; F371-S373 VanDerWaalsContact C-N 3.35Å; F371-S373 PolarHBondContact O-N 2.99Å; S373-I375 VanDerWaalsContact C-N 3.26Å; S373-I375 CarbonylContact C-O 3.33Å; S373-I375 PolarHBondContact O-N 3.08Å; S373-E377 PolarHBondContact OG-OE1 3.46Å
374	F	90.3	Very high	95.2	Very high	143 Å²	143	65.4 Å²	65.4	63%	0.627	31%	0.31	S	S	*	.	S	Bend	trans	-69	-26.7	-178.2	83.1	-82.9	0	0	0	112.2	D368 F371	D368-F374 WeakPolarHBondContact OD1-CD1 3.18Å; D368-F374 PolarHBondContact OD1-N 3.14Å; D368-F374 VanDerWaalsContact OD1-N 3.13Å; F371-F374 HydrophobicContact CB-CD1 4.13Å
375	I	93.2	Very high	95.3	Very high	65 Å²	65	63.3 Å²	63.3	33%	0.333	30%	0.299	S	S	.	.	S	Bend	trans	-102.2	153	165.8	-57.5	175.4	0	0	0	107.7	D368 S373 E377 L379 V380	D368-I375 PolarHBondContact OD1-N 2.87Å; D368-I375 VanDerWaalsContact OD2-O 3.05Å; S373-I375 VanDerWaalsContact C-N 3.26Å; S373-I375 CarbonylContact C-O 3.33Å; S373-I375 PolarHBondContact O-N 3.08Å; I375-E377 PolarHBondContact O-N 3.24Å; I375-E377 VanDerWaalsContact O-N 3.07Å; I375-L379 HydrophobicContact CG2-CD2 4.12Å; I375-V380 HydrophobicContact CB-CG2 3.8Å; I375-V380 HydrophobicContact CG2-CG2 3.57Å
376	D	94.6	Very high	95.4	Very high	95 Å²	95	68.4 Å²	68.4	51%	0.508	33%	0.325	S	S	.	.			trans	-58.6	114.4	169.1	-175.7	-8.8	0	0	0	110.4	Y378 L379 V380	D376-Y378 PolarHBondContact O-N 3.23Å; D376-Y378 VanDerWaalsContact OD1-CB 3.31Å; D376-Y378 WeakPolarHBondContact OD1-CB 3.31Å; D376-Y378 PolarHBondContact OD1-N 3.22Å; D376-L379 HydrophobicContact CB-CB 4.28Å; D376-L379 WeakPolarHBondContact O-CA 3.45Å; D376-L379 WeakPolarHBondContact O-CB 3.38Å; D376-L379 PolarHBondContact O-N 3.11Å; D376-V380 PolarHBondContact O-N 3.19Å; D376-V380 VanDerWaalsContact O-N 3.09Å
377	E	95.6	Very high	95.4	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-52.8	-30.7	179	-65.1	-176.8	-135	0	0	112	S315 A316 V317 L319 Q369 S373 I375 V380 L381	S315-E377 VanDerWaalsContact CB-OE2 3.25Å; S315-E377 WeakPolarHBondContact CB-OE2 3.49Å; S315-E377 PolarHBondContact OG-OE2 2.87Å; A316-E377 PolarHBondContact N-OE1 3.5Å; V317-E377 HydrophobicContact CG2-CB 3.92Å; V317-E377 HydrophobicContact CG2-CG 4.26Å; L319-E377 HydrophobicContact CD1-CB 4.05Å; L319-E377 HydrophobicContact CD2-CB 4.19Å; Q369-E377 HydrophobicContact CG-CG 4.48Å; Q369-E377 PolarHBondContact NE2-OE2 3.01Å; S373-E377 PolarHBondContact OG-OE1 3.46Å; I375-E377 PolarHBondContact O-N 3.24Å; I375-E377 VanDerWaalsContact O-N 3.07Å; E377-V380 PolarHBondContact O-N 3.16Å; E377-L381 VanDerWaalsContact O-CB 3.31Å; E377-L381 WeakPolarHBondContact O-CB 3.46Å; E377-L381 PolarHBondContact O-N 3.35Å
378	Y	96.7	Very high	95.5	Very high	82 Å²	82	63.4 Å²	63.4	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-41.2	176.2	179	-121.9	0	0	0	112.3	H323 L326 D376 L381 W382	H323-Y378 HydrophobicContact CB-CD2 4.41Å; H323-Y378 HydrophobicContact CB-CE2 4.34Å; H323-Y378 AromaticContact CD2-CD2 3.3Å; H323-Y378 WeakPolarHBondContact CD2-CD2 3.15Å; H323-Y378 AromaticContact CD2-CE2 3.7Å; H323-Y378 AromaticContact CE1-CD2 3.8Å; H323-Y378 AromaticContact CE1-CE2 3.53Å; H323-Y378 AromaticContact CG-CD2 3.62Å; H323-Y378 AromaticContact CG-CE2 3.56Å; H323-Y378 AromaticContact ND1-CD2 3.93Å; H323-Y378 AromaticContact ND1-CE2 3.47Å; H323-Y378 WeakPolarHBondContact ND1-CE2 3.33Å; H323-Y378 AromaticContact NE2-CD2 3.44Å; H323-Y378 WeakPolarHBondContact NE2-CD2 3.14Å; H323-Y378 AromaticContact NE2-CE2 3.69Å; H323-Y378 AromaticContact NE2-CG 3.93Å; L326-Y378 HydrophobicContact CD2-CD2 4.15Å; L326-Y378 HydrophobicContact CD2-CE2 3.67Å; D376-Y378 PolarHBondContact O-N 3.23Å; D376-Y378 VanDerWaalsContact OD1-CB 3.31Å; D376-Y378 WeakPolarHBondContact OD1-CB 3.31Å; D376-Y378 PolarHBondContact OD1-N 3.22Å; Y378-L381 PolarHBondContact O-N 3.17Å; Y378-W382 AromaticContact CE1-CD1 3.95Å; Y378-W382 AromaticContact CE1-NE1 3.67Å; Y378-W382 AromaticContact CE2-CD1 3.83Å; Y378-W382 AromaticContact CE2-NE1 3.41Å; Y378-W382 AromaticContact CZ-CD1 3.7Å; Y378-W382 AromaticContact CZ-NE1 3.08Å; Y378-W382 PolarHBondContact O-N 3.42Å; Y378-W382 VanDerWaalsContact O-N 3.15Å; Y378-W382 PolarHBondContact OH-NE1 2.83Å
379	L	97.1	Very high	95.6	Very high	93 Å²	93	66.7 Å²	66.7	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-66.2	-44.3	174.7	179.7	64.8	0	0	0	110.7	I375 D376 L381 W382 I383	I375-L379 HydrophobicContact CG2-CD2 4.12Å; D376-L379 HydrophobicContact CB-CB 4.28Å; D376-L379 WeakPolarHBondContact O-CA 3.45Å; D376-L379 WeakPolarHBondContact O-CB 3.38Å; D376-L379 PolarHBondContact O-N 3.11Å; L379-L381 PolarHBondContact O-N 2.92Å; L379-W382 PolarHBondContact O-N 3.16Å; L379-I383 HydrophobicContact CG-CD1 4.22Å; L379-I383 WeakPolarHBondContact O-CG1 3.47Å; L379-I383 PolarHBondContact O-N 2.98Å
380	V	97.4	Very high	95.7	Very high	8 Å²	8	70.4 Å²	70.4	5%	0.048	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-35.8	177.2	-173.1	0	0	0	0	110.7	L364 L365 D368 I375 D376 E377 I383 A384	L364-V380 HydrophobicContact CB-CG1 3.98Å; L365-V380 HydrophobicContact CD2-CB 3.84Å; L365-V380 HydrophobicContact CD2-CG1 3.73Å; L365-V380 HydrophobicContact CG-CG1 3.89Å; D368-V380 HydrophobicContact CB-CG2 4.41Å; I375-V380 HydrophobicContact CB-CG2 3.8Å; I375-V380 HydrophobicContact CG2-CG2 3.57Å; D376-V380 PolarHBondContact O-N 3.19Å; D376-V380 VanDerWaalsContact O-N 3.09Å; E377-V380 PolarHBondContact O-N 3.16Å; V380-I383 WeakPolarHBondContact O-CB 3.33Å; V380-I383 PolarHBondContact O-N 3.44Å; V380-A384 WeakPolarHBondContact O-CB 3.17Å; V380-A384 PolarHBondContact O-N 3.17Å
381	L	98.1	Very high	95.8	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-41.2	176.1	-177.5	61.3	0	0	0	112.6	L319 H323 L326 Y327 A330 L365 E377 Y378 L379 A384 L385	L319-L381 HydrophobicContact CD1-CB 4.2Å; L319-L381 HydrophobicContact CD1-CD2 3.83Å; L319-L381 HydrophobicContact CD2-CB 4.24Å; L319-L381 HydrophobicContact CD2-CD2 4.13Å; L319-L381 HydrophobicContact CG-CD2 3.9Å; H323-L381 HydrophobicContact CB-CD2 4.32Å; L326-L381 HydrophobicContact CB-CD2 4.24Å; L326-L381 HydrophobicContact CD2-CB 4.49Å; L326-L381 HydrophobicContact CD2-CD2 3.72Å; L326-L381 HydrophobicContact CD2-CG 3.9Å; L326-L381 HydrophobicContact CG-CD2 3.72Å; L326-L381 HydrophobicContact CG-CG 3.84Å; Y327-L381 HydrophobicContact CD2-CD1 4.21Å; Y327-L381 HydrophobicContact CD2-CD2 4.31Å; A330-L381 HydrophobicContact CB-CD1 3.92Å; L365-L381 HydrophobicContact CD1-CD1 3.88Å; L365-L381 HydrophobicContact CD2-CB 4.3Å; E377-L381 VanDerWaalsContact O-CB 3.31Å; E377-L381 WeakPolarHBondContact O-CB 3.46Å; E377-L381 PolarHBondContact O-N 3.35Å; Y378-L381 PolarHBondContact O-N 3.17Å; L379-L381 PolarHBondContact O-N 2.92Å; L381-A384 WeakPolarHBondContact O-CB 3.43Å; L381-A384 PolarHBondContact O-N 3.37Å; L381-L385 PolarHBondContact O-N 3.25Å
382	W	98.3	Very high	95.9	Very high	107 Å²	107	57.6 Å²	57.6	41%	0.405	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-42.4	172.4	-86.7	111.2	0	0	0	112.4	L326 Y378 L379 A384 L385 I386	L326-W382 HydrophobicContact CD1-CD2 3.96Å; L326-W382 HydrophobicContact CD1-CE3 3.82Å; L326-W382 HydrophobicContact CD1-CH2 4.06Å; L326-W382 HydrophobicContact CD1-CZ2 4.2Å; L326-W382 HydrophobicContact CD1-CZ3 3.87Å; L326-W382 HydrophobicContact CD2-CD2 3.87Å; L326-W382 HydrophobicContact CD2-CG 4.03Å; L326-W382 HydrophobicContact CD2-CZ2 4.09Å; Y378-W382 AromaticContact CE1-CD1 3.95Å; Y378-W382 AromaticContact CE1-NE1 3.67Å; Y378-W382 AromaticContact CE2-CD1 3.83Å; Y378-W382 AromaticContact CE2-NE1 3.41Å; Y378-W382 AromaticContact CZ-CD1 3.7Å; Y378-W382 AromaticContact CZ-NE1 3.08Å; Y378-W382 PolarHBondContact O-N 3.42Å; Y378-W382 VanDerWaalsContact O-N 3.15Å; Y378-W382 PolarHBondContact OH-NE1 2.83Å; L379-W382 PolarHBondContact O-N 3.16Å; W382-A384 VanDerWaalsContact C-N 3.32Å; W382-A384 PolarHBondContact O-N 2.86Å; W382-L385 HydrophobicContact CE3-CD2 3.83Å; W382-L385 HydrophobicContact CZ3-CD2 3.62Å; W382-L385 PolarHBondContact O-N 3.27Å; W382-I386 WeakPolarHBondContact O-CG1 3.29Å; W382-I386 PolarHBondContact O-N 3.41Å
383	I	97.9	Very high	96.1	Very high	71 Å²	71	53.6 Å²	53.6	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-60.5	-45.2	174.7	-67	167.2	0	0	0	109.9	L364 L379 V380 L385 I386 I387	L364-I383 HydrophobicContact CD1-CG2 4.28Å; L379-I383 HydrophobicContact CG-CD1 4.22Å; L379-I383 WeakPolarHBondContact O-CG1 3.47Å; L379-I383 PolarHBondContact O-N 2.98Å; V380-I383 WeakPolarHBondContact O-CB 3.33Å; V380-I383 PolarHBondContact O-N 3.44Å; I383-L385 PolarHBondContact O-N 3.42Å; I383-I386 PolarHBondContact O-N 3.34Å; I383-I387 HydrophobicContact CG2-CD1 3.62Å; I383-I387 HydrophobicContact CG2-CG1 4.32Å; I383-I387 WeakPolarHBondContact O-CB 3.24Å; I383-I387 VanDerWaalsContact O-CG1 3.3Å; I383-I387 WeakPolarHBondContact O-CG1 3.3Å; I383-I387 PolarHBondContact O-N 2.93Å
384	A	98	Very high	96.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-46.1	176.9	0	0	0	0	0	111.6	L365 V380 L381 W382 I386 I387 S388	L365-A384 HydrophobicContact CD1-CB 4.07Å; V380-A384 WeakPolarHBondContact O-CB 3.17Å; V380-A384 PolarHBondContact O-N 3.17Å; L381-A384 WeakPolarHBondContact O-CB 3.43Å; L381-A384 PolarHBondContact O-N 3.37Å; W382-A384 VanDerWaalsContact C-N 3.32Å; W382-A384 PolarHBondContact O-N 2.86Å; A384-I386 PolarHBondContact O-N 3.05Å; A384-I387 PolarHBondContact O-N 3.36Å; A384-S388 VanDerWaalsContact O-CB 3.29Å; A384-S388 WeakPolarHBondContact O-CB 3.5Å; A384-S388 PolarHBondContact O-N 2.77Å; A384-S388 PolarHBondContact O-OG 3.29Å
385	L	98.3	Very high	96.4	Very high	19 Å²	19	48.4 Å²	48.4	10%	0.099	24%	0.235	C	C	.	.	H	α-helix	trans	-55.4	-51.7	175.3	178.7	77	0	0	0	111.3	L326 L329 A330 F333 L381 W382 I383 S388 L389	L326-L385 HydrophobicContact CD1-CB 4.04Å; L326-L385 HydrophobicContact CD1-CD1 4.41Å; L326-L385 HydrophobicContact CD1-CD2 3.49Å; L326-L385 VanDerWaalsContact CD1-CD2 3.49Å; L326-L385 HydrophobicContact CD1-CG 4.15Å; L329-L385 HydrophobicContact CB-CD1 3.57Å; A330-L385 HydrophobicContact CB-CB 4.13Å; A330-L385 HydrophobicContact CB-CD1 4.19Å; F333-L385 HydrophobicContact CD2-CD1 3.85Å; F333-L385 HydrophobicContact CE2-CD1 3.54Å; F333-L385 HydrophobicContact CE2-CG 4.41Å; L381-L385 PolarHBondContact O-N 3.25Å; W382-L385 HydrophobicContact CE3-CD2 3.83Å; W382-L385 HydrophobicContact CZ3-CD2 3.62Å; W382-L385 PolarHBondContact O-N 3.27Å; I383-L385 PolarHBondContact O-N 3.42Å; L385-S388 PolarHBondContact O-N 3.43Å; L385-L389 WeakPolarHBondContact O-CB 3.33Å; L385-L389 PolarHBondContact O-N 3.29Å
386	I	97.9	Very high	96.5	Very high	106 Å²	106	47 Å²	47	54%	0.544	23%	0.231	S	C	.	.	H	α-helix	trans	-63.6	-45.2	-175.9	-67.8	168.3	0	0	0	110.5	W382 I383 A384 F390	W382-I386 WeakPolarHBondContact O-CG1 3.29Å; W382-I386 PolarHBondContact O-N 3.41Å; I383-I386 PolarHBondContact O-N 3.34Å; A384-I386 PolarHBondContact O-N 3.05Å; I386-F390 VanDerWaalsContact O-CB 3.23Å; I386-F390 WeakPolarHBondContact O-CB 3.45Å; I386-F390 PolarHBondContact O-N 3.29Å
387	I	96.9	Very high	96.4	Very high	45 Å²	45	44.5 Å²	44.5	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-49.9	177.5	-70.8	173.1	0	0	0	110.2	L360 L364 I383 A384 L389 F390 D391	L360-I387 HydrophobicContact CB-CG2 4.33Å; L360-I387 HydrophobicContact CD2-CD1 4.27Å; L360-I387 HydrophobicContact CD2-CG2 4.15Å; L360-I387 HydrophobicContact CG-CG2 4.47Å; L364-I387 HydrophobicContact CD1-CD1 4.1Å; I383-I387 HydrophobicContact CG2-CD1 3.62Å; I383-I387 HydrophobicContact CG2-CG1 4.32Å; I383-I387 WeakPolarHBondContact O-CB 3.24Å; I383-I387 VanDerWaalsContact O-CG1 3.3Å; I383-I387 WeakPolarHBondContact O-CG1 3.3Å; I383-I387 PolarHBondContact O-N 2.93Å; A384-I387 PolarHBondContact O-N 3.36Å; I387-L389 PolarHBondContact O-N 3.35Å; I387-F390 PolarHBondContact O-N 2.79Å; I387-D391 WeakPolarHBondContact O-CB 3.42Å; I387-D391 PolarHBondContact O-N 2.76Å
388	S	97.4	Very high	96.2	Very high	3 Å²	3	45 Å²	45	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-40.3	-177.9	-64	0	0	0	0	112.4	V334 A384 L385 L392	V334-S388 WeakPolarHBondContact CG2-OG 3.26Å; A384-S388 VanDerWaalsContact O-CB 3.29Å; A384-S388 WeakPolarHBondContact O-CB 3.5Å; A384-S388 PolarHBondContact O-N 2.77Å; A384-S388 PolarHBondContact O-OG 3.29Å; L385-S388 PolarHBondContact O-N 3.43Å; S388-L392 VanDerWaalsContact O-CB 3.28Å; S388-L392 WeakPolarHBondContact O-CB 3.06Å; S388-L392 PolarHBondContact O-N 3.27Å
389	L	96.9	Very high	96.1	Very high	72 Å²	72	41.1 Å²	41.1	38%	0.377	21%	0.207	S	C	.	.	H	α-helix	trans	-64	-50.3	174.8	177.4	58.9	0	0	0	111.3	F333 L385 I387 D391 L392 V393	F333-L389 HydrophobicContact CD2-CB 3.66Å; F333-L389 HydrophobicContact CD2-CD1 4.1Å; F333-L389 HydrophobicContact CD2-CG 4.42Å; F333-L389 HydrophobicContact CE2-CB 3.76Å; F333-L389 HydrophobicContact CE2-CD1 3.78Å; F333-L389 HydrophobicContact CE2-CD2 4.31Å; F333-L389 HydrophobicContact CE2-CG 4.15Å; F333-L389 HydrophobicContact CZ-CD1 4.06Å; L385-L389 WeakPolarHBondContact O-CB 3.33Å; L385-L389 PolarHBondContact O-N 3.29Å; I387-L389 PolarHBondContact O-N 3.35Å; L389-D391 VanDerWaalsContact C-N 3.33Å; L389-D391 PolarHBondContact O-N 3.2Å; L389-L392 PolarHBondContact O-N 3.21Å; L389-V393 HydrophobicContact CD1-CG2 4.04Å; L389-V393 WeakPolarHBondContact O-CG2 3.34Å; L389-V393 PolarHBondContact O-N 2.87Å
390	F	95.7	Very high	96	Very high	98 Å²	98	37.3 Å²	37.3	43%	0.43	19%	0.188	S	C	.	.	H	α-helix	trans	-61	-44.9	-179	178.7	-103.6	0	0	0	111.2	L43 I386 I387 V393 R394	L43-F390 WeakPolarHBondContact O-CZ 3.46Å; I386-F390 VanDerWaalsContact O-CB 3.23Å; I386-F390 WeakPolarHBondContact O-CB 3.45Å; I386-F390 PolarHBondContact O-N 3.29Å; I387-F390 PolarHBondContact O-N 2.79Å; F390-V393 PolarHBondContact O-N 2.99Å; F390-R394 WeakPolarHBondContact O-CB 3.48Å; F390-R394 PolarHBondContact O-N 2.83Å
391	D	95.2	Very high	95.7	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.059	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-41.6	178.4	178.6	49.6	0	0	0	112.4	K337 A358 I387 L389 Y395	K337-D391 WeakPolarHBondContact CD-OD2 3.48Å; K337-D391 WeakPolarHBondContact CE-OD2 3.45Å; K337-D391 IonicContact NZ-OD1 3.99Å; K337-D391 PolarHBondContact NZ-OD1 3.1Å; K337-D391 IonicContact NZ-OD2 3.63Å; K337-D391 PolarHBondContact NZ-OD2 3.42Å; A358-D391 WeakPolarHBondContact CA-OD2 3.41Å; A358-D391 PolarHBondContact N-OD2 3.4Å; I387-D391 WeakPolarHBondContact O-CB 3.42Å; I387-D391 PolarHBondContact O-N 2.76Å; L389-D391 VanDerWaalsContact C-N 3.33Å; L389-D391 PolarHBondContact O-N 3.2Å; D391-Y395 VanDerWaalsContact O-CB 3.26Å; D391-Y395 WeakPolarHBondContact O-CB 3.34Å; D391-Y395 PolarHBondContact O-N 2.72Å
392	L	96	Very high	95.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-51.3	173.2	172.9	62.7	0	0	0	111.8	L168 F333 A336 K337 S388 L389 R394 Y395 C396	L168-L392 HydrophobicContact CD1-CD2 3.95Å; L168-L392 HydrophobicContact CD2-CD2 4.33Å; F333-L392 HydrophobicContact CB-CD2 4.17Å; F333-L392 HydrophobicContact CD1-CD2 4.24Å; F333-L392 HydrophobicContact CG-CD2 4.41Å; A336-L392 HydrophobicContact CB-CD2 4.15Å; K337-L392 HydrophobicContact CB-CB 4.44Å; K337-L392 HydrophobicContact CB-CD1 3.74Å; K337-L392 HydrophobicContact CG-CD1 4.37Å; S388-L392 VanDerWaalsContact O-CB 3.28Å; S388-L392 WeakPolarHBondContact O-CB 3.06Å; S388-L392 PolarHBondContact O-N 3.27Å; L389-L392 PolarHBondContact O-N 3.21Å; L392-R394 VanDerWaalsContact C-N 3.32Å; L392-R394 PolarHBondContact O-N 3.07Å; L392-Y395 PolarHBondContact O-N 3.34Å; L392-C396 PolarHBondContact O-N 3.32Å; L392-C396 PolarHBondContact O-SG 3.23Å
393	V	94.8	Very high	95.3	Very high	68 Å²	68	36.8 Å²	36.8	41%	0.412	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-45.6	179.7	170.5	0	0	0	0	110.2	L389 F390 Y395 C396 V397	L389-V393 HydrophobicContact CD1-CG2 4.04Å; L389-V393 WeakPolarHBondContact O-CG2 3.34Å; L389-V393 PolarHBondContact O-N 2.87Å; F390-V393 PolarHBondContact O-N 2.99Å; V393-Y395 PolarHBondContact O-N 3.05Å; V393-C396 PolarHBondContact O-N 3.08Å; V393-V397 HydrophobicContact CG1-CG2 4.27Å; V393-V397 WeakPolarHBondContact O-CB 3.11Å; V393-V397 VanDerWaalsContact O-CG2 3.31Å; V393-V397 WeakPolarHBondContact O-CG2 3.33Å; V393-V397 PolarHBondContact O-N 3.14Å
394	R	93.6	Very high	95.1	Very high	45 Å²	45	33.7 Å²	33.7	17%	0.17	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-46.7	178.2	-165.6	-171.9	-174.8	136.8	-8.6	111.8	L43 I44 E45 L46 F390 L392 S398	L43-R394 PolarHBondContact O-NH1 2.61Å; L43-R394 VanDerWaalsContact O-NH1 3.09Å; I44-R394 HydrophobicContact CG2-CG 4.47Å; I44-R394 WeakPolarHBondContact O-CG 3.45Å; I44-R394 PolarHBondContact O-NE 3Å; E45-R394 PolarHBondContact O-NH2 3.15Å; L46-R394 HydrophobicContact CD2-CG 4.19Å; L46-R394 HydrophobicContact CG-CG 4.09Å; F390-R394 WeakPolarHBondContact O-CB 3.48Å; F390-R394 PolarHBondContact O-N 2.83Å; L392-R394 VanDerWaalsContact C-N 3.32Å; L392-R394 PolarHBondContact O-N 3.07Å; R394-S398 WeakPolarHBondContact O-CB 3.29Å; R394-S398 PolarHBondContact O-N 2.99Å
395	Y	95	Very high	94.8	Very high	22 Å²	22	37.6 Å²	37.6	9%	0.086	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-51.4	176.9	177.2	-102.1	0	0	0	111.4	P50 K337 N340 K341 V344 D391 L392 V393 V397 S398 V399	P50-Y395 HydrophobicContact CB-CD2 4.48Å; P50-Y395 HydrophobicContact CB-CE2 4.24Å; K337-Y395 HydrophobicContact CD-CG 4.42Å; K337-Y395 HydrophobicContact CG-CD1 4.14Å; K337-Y395 HydrophobicContact CG-CG 4.33Å; N340-Y395 HydrophobicContact CB-CD1 4.49Å; N340-Y395 HydrophobicContact CB-CE1 3.93Å; K341-Y395 HydrophobicContact CG-CE1 4.1Å; K341-Y395 HydrophobicContact CG-CE2 4.08Å; K341-Y395 WeakPolarHBondContact CG-OH 3.1Å; V344-Y395 WeakPolarHBondContact CG2-OH 3.36Å; D391-Y395 VanDerWaalsContact O-CB 3.26Å; D391-Y395 WeakPolarHBondContact O-CB 3.34Å; D391-Y395 PolarHBondContact O-N 2.72Å; L392-Y395 PolarHBondContact O-N 3.34Å; V393-Y395 PolarHBondContact O-N 3.05Å; Y395-V397 PolarHBondContact O-N 2.88Å; Y395-S398 PolarHBondContact O-N 3.31Å; Y395-V399 HydrophobicContact CD2-CG2 4.08Å; Y395-V399 HydrophobicContact CE1-CG2 4.19Å; Y395-V399 HydrophobicContact CE2-CG2 3.67Å; Y395-V399 HydrophobicContact CG-CG2 4.49Å; Y395-V399 WeakPolarHBondContact O-CB 3.31Å; Y395-V399 WeakPolarHBondContact O-CG2 3.46Å; Y395-V399 PolarHBondContact O-N 3.06Å
396	C	94.4	Very high	94.6	Very high	37 Å²	37	39 Å²	39	25%	0.25	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-47.8	-177.3	-63.9	0	0	0	0	111.9	N340 L392 V393 S398 V399 C400	N340-C396 PolarHBondContact ND2-SG 2.84Å; L392-C396 PolarHBondContact O-N 3.32Å; L392-C396 PolarHBondContact O-SG 3.23Å; V393-C396 PolarHBondContact O-N 3.08Å; C396-S398 PolarHBondContact O-N 2.8Å; C396-V399 PolarHBondContact O-N 3.1Å; C396-C400 VanDerWaalsContact O-CB 3.32Å; C396-C400 WeakPolarHBondContact O-CB 3.46Å; C396-C400 PolarHBondContact O-N 2.93Å; C396-C400 PolarHBondContact O-SG 3.36Å
397	V	92.4	Very high	94.3	Very high	41 Å²	41	35.8 Å²	35.8	25%	0.248	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-44.6	178.5	174.8	0	0	0	0	110.9	I44 V393 Y395 N401	I44-V397 HydrophobicContact CG2-CB 3.71Å; I44-V397 HydrophobicContact CG2-CG1 3.57Å; I44-V397 HydrophobicContact CG2-CG2 4.35Å; V393-V397 HydrophobicContact CG1-CG2 4.27Å; V393-V397 WeakPolarHBondContact O-CB 3.11Å; V393-V397 VanDerWaalsContact O-CG2 3.31Å; V393-V397 WeakPolarHBondContact O-CG2 3.33Å; V393-V397 PolarHBondContact O-N 3.14Å; Y395-V397 PolarHBondContact O-N 2.88Å; V397-N401 WeakPolarHBondContact CG1-ND2 3.04Å; V397-N401 VanDerWaalsContact O-CB 3.28Å; V397-N401 WeakPolarHBondContact O-CB 3.48Å; V397-N401 VanDerWaalsContact O-CG 3.22Å; V397-N401 PolarHBondContact O-N 2.69Å; V397-N401 PolarHBondContact O-ND2 3.37Å
398	S	92.6	Very high	94.1	Very high	11 Å²	11	39.1 Å²	39.1	8%	0.077	21%	0.207	C	C	.	.	H	α-helix	trans	-65	-42.7	-179.5	-173	0	0	0	0	112.3	P50 R394 Y395 C396 Q402	P50-S398 VanDerWaalsContact CD-OG 3.25Å; P50-S398 WeakPolarHBondContact CD-OG 3.45Å; P50-S398 WeakPolarHBondContact CG-OG 3.33Å; R394-S398 WeakPolarHBondContact O-CB 3.29Å; R394-S398 PolarHBondContact O-N 2.99Å; Y395-S398 PolarHBondContact O-N 3.31Å; C396-S398 PolarHBondContact O-N 2.8Å; S398-Q402 WeakPolarHBondContact O-CB 3.35Å; S398-Q402 VanDerWaalsContact O-CG 3.25Å; S398-Q402 WeakPolarHBondContact O-CG 3.4Å; S398-Q402 PolarHBondContact O-N 3.36Å
399	V	94.2	Very high	93.8	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-47.4	178.5	171.1	0	0	0	0	110.7	P50 L51 L160 V344 Y395 C396 N401 Q402 I403	P50-V399 HydrophobicContact CB-CG2 3.74Å; P50-V399 HydrophobicContact CG-CG2 3.7Å; L51-V399 HydrophobicContact CD1-CG1 4.23Å; L160-V399 HydrophobicContact CD2-CG1 3.51Å; V344-V399 HydrophobicContact CG2-CG1 4.14Å; Y395-V399 HydrophobicContact CD2-CG2 4.08Å; Y395-V399 HydrophobicContact CE1-CG2 4.19Å; Y395-V399 HydrophobicContact CE2-CG2 3.67Å; Y395-V399 HydrophobicContact CG-CG2 4.49Å; Y395-V399 WeakPolarHBondContact O-CB 3.31Å; Y395-V399 WeakPolarHBondContact O-CG2 3.46Å; Y395-V399 PolarHBondContact O-N 3.06Å; C396-V399 PolarHBondContact O-N 3.1Å; V399-N401 VanDerWaalsContact C-N 3.35Å; V399-N401 PolarHBondContact O-N 2.75Å; V399-Q402 PolarHBondContact O-N 3.19Å; V399-I403 HydrophobicContact CG1-CD1 3.67Å; V399-I403 HydrophobicContact CG1-CG1 4.41Å; V399-I403 WeakPolarHBondContact O-CG1 3.24Å; V399-I403 PolarHBondContact O-N 3.48Å
400	C	94.4	Very high	93.6	Very high	13 Å²	13	42 Å²	42	9%	0.088	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-45.9	179.2	-68.2	0	0	0	0	111.6	L157 C396 Q402 I403 A404	L157-C400 HydrophobicContact CD1-CB 4.04Å; C396-C400 VanDerWaalsContact O-CB 3.32Å; C396-C400 WeakPolarHBondContact O-CB 3.46Å; C396-C400 PolarHBondContact O-N 2.93Å; C396-C400 PolarHBondContact O-SG 3.36Å; C400-Q402 PolarHBondContact O-N 2.93Å; C400-I403 PolarHBondContact O-N 3.25Å; C400-A404 WeakPolarHBondContact O-CB 3.5Å; C400-A404 PolarHBondContact O-N 3.3Å
401	N	91.9	Very high	93.4	Very high	56 Å²	56	38.2 Å²	38.2	30%	0.299	20%	0.203	S	C	.	.	H	α-helix	trans	-65.2	-40.1	178.7	-73.7	-20.5	0	0	0	112.1	V397 V399 A404 C405	V397-N401 WeakPolarHBondContact CG1-ND2 3.04Å; V397-N401 VanDerWaalsContact O-CB 3.28Å; V397-N401 WeakPolarHBondContact O-CB 3.48Å; V397-N401 VanDerWaalsContact O-CG 3.22Å; V397-N401 PolarHBondContact O-N 2.69Å; V397-N401 PolarHBondContact O-ND2 3.37Å; V399-N401 VanDerWaalsContact C-N 3.35Å; V399-N401 PolarHBondContact O-N 2.75Å; N401-A404 PolarHBondContact O-N 3.4Å; N401-C405 VanDerWaalsContact O-CB 3.3Å; N401-C405 WeakPolarHBondContact O-CB 3.46Å; N401-C405 PolarHBondContact O-N 2.86Å; N401-C405 PolarHBondContact O-SG 3.25Å
402	Q	93.5	Very high	93.4	Very high	46 Å²	46	40.9 Å²	40.9	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-44.9	178	-79	-178.4	9.7	0	0	112.5	P49 P50 S398 V399 C400 C405 H406	P49-Q402 VanDerWaalsContact CA-NE2 3.3Å; P50-Q402 VanDerWaalsContact CD-NE2 3.28Å; S398-Q402 WeakPolarHBondContact O-CB 3.35Å; S398-Q402 VanDerWaalsContact O-CG 3.25Å; S398-Q402 WeakPolarHBondContact O-CG 3.4Å; S398-Q402 PolarHBondContact O-N 3.36Å; V399-Q402 PolarHBondContact O-N 3.19Å; C400-Q402 PolarHBondContact O-N 2.93Å; Q402-C405 PolarHBondContact O-N 3.37Å; Q402-H406 WeakPolarHBondContact O-CB 3.34Å; Q402-H406 PolarHBondContact O-N 3.02Å
403	I	94.3	Very high	93.1	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-44.7	177.4	-65.2	172	0	0	0	110.3	L51 L56 L59 L157 L160 V399 C400 C405 H406 L407	L51-I403 HydrophobicContact CD1-CD1 3.93Å; L51-I403 HydrophobicContact CD1-CG1 3.64Å; L56-I403 HydrophobicContact CD2-CG1 4.29Å; L59-I403 HydrophobicContact CD2-CB 4.15Å; L59-I403 HydrophobicContact CD2-CD1 3.74Å; L59-I403 HydrophobicContact CD2-CG1 3.63Å; L59-I403 HydrophobicContact CD2-CG2 3.49Å; L59-I403 VanDerWaalsContact CD2-CG2 3.49Å; L157-I403 HydrophobicContact CB-CG2 3.76Å; L157-I403 HydrophobicContact CD1-CB 4.13Å; L157-I403 HydrophobicContact CD1-CG2 4.07Å; L157-I403 HydrophobicContact CG-CG2 4.37Å; L160-I403 HydrophobicContact CD2-CD1 3.38Å; V399-I403 HydrophobicContact CG1-CD1 3.67Å; V399-I403 HydrophobicContact CG1-CG1 4.41Å; V399-I403 WeakPolarHBondContact O-CG1 3.24Å; V399-I403 PolarHBondContact O-N 3.48Å; C400-I403 PolarHBondContact O-N 3.25Å; I403-C405 VanDerWaalsContact C-N 3.33Å; I403-C405 PolarHBondContact O-N 3.17Å; I403-H406 PolarHBondContact O-N 3.39Å; I403-H406 VanDerWaalsContact O-N 3.15Å; I403-L407 HydrophobicContact CG2-CD1 3.61Å; I403-L407 HydrophobicContact CG2-CG 4.11Å; I403-L407 WeakPolarHBondContact O-CB 3.41Å; I403-L407 WeakPolarHBondContact O-CG 3.18Å; I403-L407 PolarHBondContact O-N 3.22Å
404	A	93.1	Very high	92.8	Very high	6 Å²	6	46.4 Å²	46.4	5%	0.05	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-44.9	177.9	0	0	0	0	0	112	L157 C400 N401 H408 I409 V411	L157-A404 HydrophobicContact CD2-CB 3.84Å; C400-A404 WeakPolarHBondContact O-CB 3.5Å; C400-A404 PolarHBondContact O-N 3.3Å; N401-A404 PolarHBondContact O-N 3.4Å; A404-H408 WeakPolarHBondContact O-CA 3.26Å; A404-H408 PolarHBondContact O-N 2.63Å; A404-I409 HydrophobicContact CB-CG1 4.39Å; A404-I409 PolarHBondContact O-N 3.08Å; A404-V411 HydrophobicContact CB-CG2 3.73Å
405	C	92.4	Very high	91.9	Very high	83 Å²	83	49.9 Å²	49.9	56%	0.561	25%	0.25	S	S	*	.	H	α-helix	trans	-62.3	-42.3	174.5	-74.8	0	0	0	0	112.2	N401 Q402 I403 H408	N401-C405 VanDerWaalsContact O-CB 3.3Å; N401-C405 WeakPolarHBondContact O-CB 3.46Å; N401-C405 PolarHBondContact O-N 2.86Å; N401-C405 PolarHBondContact O-SG 3.25Å; Q402-C405 PolarHBondContact O-N 3.37Å; I403-C405 VanDerWaalsContact C-N 3.33Å; I403-C405 PolarHBondContact O-N 3.17Å; C405-H408 PolarHBondContact O-N 2.95Å
406	H	93.8	Very high	90.4	Very high	48 Å²	48	54.6 Å²	54.6	22%	0.222	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-43	179.9	-177.8	46.6	0	0	0	112.6	L56 E60 Q402 I403 H408	L56-H406 VanDerWaalsContact C-NE2 3.29Å; L56-H406 HydrophobicContact CD1-CB 4.42Å; L56-H406 HydrophobicContact CD2-CB 4.03Å; L56-H406 PolarHBondContact O-NE2 3.03Å; L56-H406 VanDerWaalsContact O-NE2 3.15Å; E60-H406 IonicContact OE1-CD2 2.63Å; E60-H406 IonicContact OE1-CE1 3.77Å; E60-H406 PolarHBondContact OE1-CE1 3.07Å; E60-H406 IonicContact OE1-NE2 2.64Å; E60-H406 PolarHBondContact OE1-NE2 2.89Å; E60-H406 VanDerWaalsContact OE1-NE2 3.07Å; Q402-H406 WeakPolarHBondContact O-CB 3.34Å; Q402-H406 PolarHBondContact O-N 3.02Å; I403-H406 PolarHBondContact O-N 3.39Å; I403-H406 VanDerWaalsContact O-N 3.15Å; H406-H408 VanDerWaalsContact C-N 3.29Å; H406-H408 PolarHBondContact O-N 3.39Å
407	L	92.2	Very high	88.5	Confident	40 Å²	40	58.2 Å²	58.2	21%	0.209	31%	0.309	C	S	.	.	H	α-helix	trans	-83.6	-2.5	179.3	-61.7	-179.5	0	0	0	113.3	E60 I403 I409	E60-L407 HydrophobicContact CG-CD2 4.14Å; I403-L407 HydrophobicContact CG2-CD1 3.61Å; I403-L407 HydrophobicContact CG2-CG 4.11Å; I403-L407 WeakPolarHBondContact O-CB 3.41Å; I403-L407 WeakPolarHBondContact O-CG 3.18Å; I403-L407 PolarHBondContact O-N 3.22Å; L407-I409 VanDerWaalsContact C-N 3.3Å; L407-I409 HydrophobicContact CB-CD1 4.11Å; L407-I409 HydrophobicContact CB-CG1 4.04Å; L407-I409 HydrophobicContact CB-CG2 4.49Å; L407-I409 HydrophobicContact CD1-CD1 4.1Å; L407-I409 PolarHBondContact O-N 3.18Å
408	H	92.4	Very high	86.4	Confident	114 Å²	114	64.3 Å²	64.3	53%	0.528	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	38.8	-176.6	-58.3	-72.6	0	0	0	114.5	A404 C405 H406 K415	A404-H408 WeakPolarHBondContact O-CA 3.26Å; A404-H408 PolarHBondContact O-N 2.63Å; C405-H408 PolarHBondContact O-N 2.95Å; H406-H408 VanDerWaalsContact C-N 3.29Å; H406-H408 PolarHBondContact O-N 3.39Å; H408-K415 WeakPolarHBondContact O-CE 3.24Å; H408-K415 PolarHBondContact O-NZ 3.29Å
409	I	92.1	Very high	84.1	Confident	57 Å²	57	68.2 Å²	68.2	29%	0.292	37%	0.367	S	S	.	.			trans	-116	163	178.4	61.7	-179.9	0	0	0	111.3	L157 A404 L407	L157-I409 HydrophobicContact CB-CD1 3.93Å; L157-I409 HydrophobicContact CD2-CD1 3.74Å; L157-I409 HydrophobicContact CD2-CG1 4.15Å; L157-I409 HydrophobicContact CG-CD1 4.49Å; A404-I409 HydrophobicContact CB-CG1 4.39Å; A404-I409 PolarHBondContact O-N 3.08Å; L407-I409 VanDerWaalsContact C-N 3.3Å; L407-I409 HydrophobicContact CB-CD1 4.11Å; L407-I409 HydrophobicContact CB-CG1 4.04Å; L407-I409 HydrophobicContact CB-CG2 4.49Å; L407-I409 HydrophobicContact CD1-CD1 4.1Å; L407-I409 PolarHBondContact O-N 3.18Å
410	F	91.6	Very high	81.7	Confident	80 Å²	80	74 Å²	74	35%	0.351	40%	0.404	S	S	.	.			trans	-98.1	140.3	171.8	-60.9	-79.7	0	0	0	109.7	A32 K413 K415	A32-F410 HydrophobicContact CB-CD1 4.43Å; A32-F410 HydrophobicContact CB-CE1 3.69Å; A32-F410 HydrophobicContact CB-CZ 4.43Å; F410-K413 HydrophobicContact CB-CB 3.9Å; F410-K413 HydrophobicContact CG-CB 4.35Å; F410-K415 HydrophobicContact CD2-CG 4.02Å; F410-K415 HydrophobicContact CE2-CD 4.48Å; F410-K415 HydrophobicContact CE2-CG 3.94Å
411	V	91.7	Very high	79.1	Confident	17 Å²	17	82.2 Å²	82.2	10%	0.103	44%	0.441	C	S	.	.	S	Bend	trans	-65	-42.9	-178.6	-174.3	0	0	0	0	111.5	N94 L157 F161 A404	N94-V411 WeakPolarHBondContact CB-O 3.43Å; N94-V411 PolarHBondContact ND2-O 3.41Å; L157-V411 HydrophobicContact CD2-CG2 4.26Å; F161-V411 HydrophobicContact CD2-CG1 4.37Å; F161-V411 HydrophobicContact CE2-CG1 4.16Å; A404-V411 HydrophobicContact CB-CG2 3.73Å
412	F	95.1	Very high	76.7	Confident	67 Å²	67	85.3 Å²	85.3	29%	0.294	47%	0.468	S	S	.	.	S	Bend	trans	-120.8	17.6	-171.9	-58.8	-66.5	0	0	0	114.2	L35 A92 N94 L95 I98 F161	L35-F412 HydrophobicContact CD1-CE2 3.86Å; A92-F412 VanDerWaalsContact CB-C 3.44Å; N94-F412 HydrophobicContact CB-CD1 4.12Å; N94-F412 HydrophobicContact CB-CE1 4.13Å; L95-F412 HydrophobicContact CB-CD1 4.46Å; I98-F412 HydrophobicContact CG2-CE1 4.17Å; F161-F412 HydrophobicContact CE1-CE1 4.38Å; F161-F412 HydrophobicContact CE2-CE1 4.01Å; F161-F412 AromaticContact CE2-CZ 3.88Å; F161-F412 HydrophobicContact CE2-CZ 3.88Å; F161-F412 AromaticContact CZ-CE1 3.62Å; F161-F412 HydrophobicContact CZ-CE1 3.62Å; F161-F412 AromaticContact CZ-CZ 3.8Å; F161-F412 HydrophobicContact CZ-CZ 3.8Å
413	K	90.4	Very high	74.2	Confident	147 Å²	147	91.9 Å²	91.9	64%	0.639	52%	0.519	S	S	*	.			trans	-137.6	137.9	178.6	-66.1	-176	-179	179.4	0	110.7	F410	F410-K413 HydrophobicContact CB-CB 3.9Å; F410-K413 HydrophobicContact CG-CB 4.35Å
414	I	87.7	Confident	73.2	Confident	42 Å²	42	96.5 Å²	96.5	22%	0.215	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-86.6	131.8	169.1	-60.6	169.2	0	0	0	107.5	S89 I91 A92 T151	S89-I414 VanDerWaalsContact O-CD1 3.3Å; S89-I414 WeakPolarHBondContact O-CD1 3.37Å; I91-I414 VanDerWaalsContact O-CD1 3.25Å; I91-I414 WeakPolarHBondContact O-CD1 3.29Å; A92-I414 HydrophobicContact CB-CG1 4.14Å; T151-I414 HydrophobicContact CG2-CD1 3.92Å
415	K	75.2	Confident	72.1	Confident	118 Å²	118	101.2 Å²	101.2	51%	0.513	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-65.8	129.8	169.9	-78.4	-177.2	-176.8	169.5	0	108	H408 F410 S417	H408-K415 WeakPolarHBondContact O-CE 3.24Å; H408-K415 PolarHBondContact O-NZ 3.29Å; F410-K415 HydrophobicContact CD2-CG 4.02Å; F410-K415 HydrophobicContact CE2-CD 4.48Å; F410-K415 HydrophobicContact CE2-CG 3.94Å; K415-S417 PolarHBondContact O-N 3.49Å; K415-S417 VanDerWaalsContact O-N 3.16Å
416	P	62.6	Low	71	Confident	121 Å²	121	102.2 Å²	102.2	79%	0.786	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-54.6	126	172.6	-19.8	29.8	0	0	0	108.8	L418	P416-L418 PolarHBondContact O-N 3Å; P416-L418 VanDerWaalsContact O-N 3.14Å
417	S	55.8	Low	69.6	Low	112 Å²	112	105.4 Å²	105.4	78%	0.783	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-62	117.1	166.2	39.3	0	0	0	0	106.9	K415 S419	K415-S417 PolarHBondContact O-N 3.49Å; K415-S417 VanDerWaalsContact O-N 3.16Å; S417-S419 VanDerWaalsContact C-N 3.25Å; S417-S419 PolarHBondContact O-N 3.39Å
418	L	48.4	Very low	68.2	Low	170 Å²	170	109.5 Å²	109.5	89%	0.89	62%	0.615	S	S	*	*			trans	-61.7	98	163.8	-80.3	154.7	0	0	0	105.7	P416	P416-L418 PolarHBondContact O-N 3Å; P416-L418 VanDerWaalsContact O-N 3.14Å
419	S	42.7	Very low	66.6	Low	92 Å²	92	109.2 Å²	109.2	64%	0.643	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-53	126.8	166.2	43.4	0	0	0	0	107	S417 Q421	S417-S419 VanDerWaalsContact C-N 3.25Å; S417-S419 PolarHBondContact O-N 3.39Å; S419-Q421 PolarHBondContact O-N 3.26Å
420	P	44.6	Very low	64.8	Low	124 Å²	124	112.9 Å²	112.9	81%	0.805	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-56.7	121.3	172.4	19.4	-23.6	0	0	0	106.3	S422	P420-S422 PolarHBondContact O-N 2.58Å
421	Q	39.5	Very low	62.7	Low	185 Å²	185	115.5 Å²	115.5	86%	0.864	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.5	116.3	170.9	-74.1	-177.6	-11.1	0	0	106	S419 S423	S419-Q421 PolarHBondContact O-N 3.26Å; Q421-S423 VanDerWaalsContact C-N 3.27Å; Q421-S423 PolarHBondContact O-N 3.08Å
422	S	41.3	Very low	60.3	Low	122 Å²	122	123.7 Å²	123.7	85%	0.853	71%	0.714	S	S	*	*			trans	-60.8	97.8	167.8	51.7	0	0	0	0	106.7	P420	P420-S422 PolarHBondContact O-N 2.58Å
423	S	40.8	Very low	57.2	Low	184 Å²	184	128.8 Å²	128.8	100%	1.287	75%	0.753	S	S	*	*			trans	-70.6	0	167.1	54.3	0	0	0	0	110.5	Q421	Q421-S423 VanDerWaalsContact C-N 3.27Å; Q421-S423 PolarHBondContact O-N 3.08Å

Retrieved 423 of 423 residues in 779.6 ms (Link to these results)

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