G4V827_SCHMA Loading...

Tetraspanin-33

AlphaFold DB , UniProt , Accession G4V827, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 344 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	37.7	Very low	245 Å²	245	155.5 Å²	155.5	100%	1.207	88%	0.879	S	S	*	*				0	98.2	0	-66.9	176.4	-171.9	0	0	107.6
2	P	41.1	Very low	38.5	Very low	131 Å²	131	148.8 Å²	148.8	85%	0.851	85%	0.849	S	S	*	*			trans	-110.8	137.6	177.2	25	-6.8	0	0	0	112.2
3	S	35.7	Very low	38.7	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-78.6	139.8	177.7	48.5	0	0	0	0	112.7
4	E	37.4	Very low	38.9	Very low	196 Å²	196	143.1 Å²	143.1	92%	0.916	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-97.8	118.5	171.8	-161.3	178.3	167.9	0	0	108.9
5	T	38.8	Very low	39	Very low	135 Å²	135	136.9 Å²	136.9	83%	0.828	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-103.8	117	172.6	41.8	0	0	0	0	110.4
6	R	32	Very low	39.6	Very low	248 Å²	248	135.1 Å²	135.1	94%	0.936	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-67.9	132.4	163.4	-101.7	176.8	179	169.7	1.3	110.6
7	E	39.8	Very low	40.4	Very low	200 Å²	200	133.9 Å²	133.9	94%	0.935	76%	0.763	S	S	*	*			trans	-141.2	119.9	145.7	-90.3	-173.6	148.8	0	0	109.4
8	G	35	Very low	40.8	Very low	79 Å²	79	130.1 Å²	130.1	81%	0.814	74%	0.736	S	S	*	*			trans	-96.5	147.8	-176.7	0	0	0	0	0	112.5	S10	G8-S10 PolarHBondContact O-N 3.09Å
9	A	38.6	Very low	41.3	Very low	108 Å²	108	125.3 Å²	125.3	89%	0.893	71%	0.714	S	S	*	*			trans	-76.3	115.6	171.7	0	0	0	0	0	110.8	M11	A9-M11 PolarHBondContact O-N 3.33Å
10	S	40.9	Very low	42.6	Very low	118 Å²	118	127.6 Å²	127.6	83%	0.825	71%	0.711	S	S	*	*			trans	-72.5	103.6	169.4	161.5	0	0	0	0	110.3	G8 S12	G8-S10 PolarHBondContact O-N 3.09Å; S10-S12 PolarHBondContact O-N 3.29Å
11	M	39.2	Very low	43.4	Very low	138 Å²	138	125.4 Å²	125.4	68%	0.68	70%	0.698	S	S	*	*			trans	-69.7	121.6	166.6	-164.5	163.7	69.1	0	0	109	A9	A9-M11 PolarHBondContact O-N 3.33Å
12	S	47.8	Very low	44.4	Very low	74 Å²	74	114.9 Å²	114.9	52%	0.517	65%	0.646	S	S	.	*			trans	-60	140.9	-169	105.6	0	0	0	0	112.5	S10 G14 C15	S10-S12 PolarHBondContact O-N 3.29Å; S12-G14 PolarHBondContact O-N 3.46Å; S12-G14 PolarHBondContact OG-N 3.25Å; S12-C15 PolarHBondContact O-N 3.13Å
13	Q	41	Very low	45.1	Very low	174 Å²	174	111.9 Å²	111.9	81%	0.813	63%	0.626	S	S	*	*	H	α-helix	trans	-54.3	-21.8	179.7	-70.3	173.1	-19.5	0	0	113.3	L16 L17	Q13-L16 PolarHBondContact O-N 2.68Å; Q13-L17 PolarHBondContact O-N 3.29Å; Q13-L17 VanDerWaalsContact O-N 3.1Å
14	G	41.4	Very low	46.4	Very low	44 Å²	44	109.2 Å²	109.2	45%	0.454	60%	0.604	S	S	.	*	H	α-helix	trans	-66.4	-36.6	175.4	0	0	0	0	0	113.9	S12 L17 F18	S12-G14 PolarHBondContact O-N 3.46Å; S12-G14 PolarHBondContact OG-N 3.25Å; G14-L17 PolarHBondContact O-N 3.15Å; G14-F18 WeakPolarHBondContact O-CB 3.41Å; G14-F18 PolarHBondContact O-N 3.31Å
15	C	41.2	Very low	47.2	Very low	51 Å²	51	105.4 Å²	105.4	35%	0.345	59%	0.59	S	S	.	*	H	α-helix	trans	-66.8	-37.7	176.5	-81.3	0	0	0	0	111.9	S12 A19	S12-C15 PolarHBondContact O-N 3.13Å; C15-A19 WeakPolarHBondContact O-CB 3.27Å; C15-A19 PolarHBondContact O-N 3.42Å
16	L	47.6	Very low	47.8	Very low	107 Å²	107	101 Å²	101	56%	0.56	56%	0.559	S	S	*	*	H	α-helix	trans	-69.5	-39.5	176.5	-69.5	172.7	0	0	0	111.6	Q13 W20	Q13-L16 PolarHBondContact O-N 2.68Å; L16-W20 VanDerWaalsContact O-CB 3.23Å; L16-W20 WeakPolarHBondContact O-CB 3.48Å; L16-W20 PolarHBondContact O-N 3.28Å
17	L	52.9	Low	48.6	Very low	115 Å²	115	96 Å²	96	60%	0.602	55%	0.546	S	S	*	.	H	α-helix	trans	-67.5	-42.8	179.4	-152.2	97.6	0	0	0	112	Q13 G14 W20 L21	Q13-L17 PolarHBondContact O-N 3.29Å; Q13-L17 VanDerWaalsContact O-N 3.1Å; G14-L17 PolarHBondContact O-N 3.15Å; L17-W20 PolarHBondContact O-N 3.23Å; L17-L21 HydrophobicContact CD2-CD1 4.35Å; L17-L21 WeakPolarHBondContact O-CB 3.45Å; L17-L21 PolarHBondContact O-N 3.06Å
18	F	48.7	Very low	49.1	Very low	66 Å²	66	97 Å²	97	29%	0.289	54%	0.541	S	S	.	.	H	α-helix	trans	-69.1	-40.6	177	-169.2	-105.2	0	0	0	111.7	G14 W20 L21 L22 F87 L90	G14-F18 WeakPolarHBondContact O-CB 3.41Å; G14-F18 PolarHBondContact O-N 3.31Å; F18-W20 VanDerWaalsContact C-N 3.3Å; F18-W20 PolarHBondContact O-N 3.4Å; F18-L21 PolarHBondContact O-N 3.2Å; F18-L22 HydrophobicContact CD1-CD1 3.67Å; F18-L22 HydrophobicContact CD1-CG 4.37Å; F18-L22 HydrophobicContact CE1-CD1 3.35Å; F18-L22 HydrophobicContact CE1-CG 4.14Å; F18-L22 HydrophobicContact CZ-CD1 3.97Å; F18-L22 HydrophobicContact CZ-CG 4.36Å; F18-L22 WeakPolarHBondContact O-CB 3.23Å; F18-L22 WeakPolarHBondContact O-CG 3.35Å; F18-L22 PolarHBondContact O-N 3.08Å; F18-F87 AromaticContact CD1-CE2 3.61Å; F18-F87 HydrophobicContact CD1-CE2 3.61Å; F18-F87 AromaticContact CD1-CZ 3.76Å; F18-F87 HydrophobicContact CD1-CZ 3.76Å; F18-F87 HydrophobicContact CE1-CE2 4.02Å; F18-F87 HydrophobicContact CE1-CZ 4.42Å; F18-L90 HydrophobicContact CE1-CD2 4.24Å
19	A	50.7	Low	49.5	Very low	38 Å²	38	97.7 Å²	97.7	31%	0.314	53%	0.526	S	S	.	.	H	α-helix	trans	-61.1	-38.7	171.4	0	0	0	0	0	111.9	C15 T23	C15-A19 WeakPolarHBondContact O-CB 3.27Å; C15-A19 PolarHBondContact O-N 3.42Å; A19-T23 VanDerWaalsContact O-CB 3.32Å; A19-T23 WeakPolarHBondContact O-CB 3.29Å; A19-T23 PolarHBondContact O-N 3.04Å; A19-T23 PolarHBondContact O-OG1 3.44Å
20	W	66.6	Low	49.5	Very low	172 Å²	172	97.7 Å²	97.7	65%	0.652	52%	0.516	S	S	*	.	H	α-helix	trans	-68.7	-46	177	-166.6	84.3	0	0	0	112.1	L16 L17 F18 L22 T23 V24	L16-W20 VanDerWaalsContact O-CB 3.23Å; L16-W20 WeakPolarHBondContact O-CB 3.48Å; L16-W20 PolarHBondContact O-N 3.28Å; L17-W20 PolarHBondContact O-N 3.23Å; F18-W20 VanDerWaalsContact C-N 3.3Å; F18-W20 PolarHBondContact O-N 3.4Å; W20-L22 PolarHBondContact O-N 3.07Å; W20-T23 PolarHBondContact O-N 3.07Å; W20-T23 VanDerWaalsContact O-N 3.14Å; W20-V24 HydrophobicContact CD2-CG2 4.02Å; W20-V24 HydrophobicContact CE3-CG2 4.02Å; W20-V24 HydrophobicContact CH2-CG2 4.08Å; W20-V24 HydrophobicContact CZ2-CG2 4.06Å; W20-V24 HydrophobicContact CZ3-CG2 4.05Å; W20-V24 WeakPolarHBondContact O-CG2 3.4Å; W20-V24 PolarHBondContact O-N 3.07Å
21	L	59.7	Low	49.6	Very low	82 Å²	82	100.3 Å²	100.3	43%	0.429	52%	0.515	S	S	.	.	H	α-helix	trans	-60.4	-44.9	175.6	-82.5	164.1	0	0	0	112.1	L17 F18 V24 L25	L17-L21 HydrophobicContact CD2-CD1 4.35Å; L17-L21 WeakPolarHBondContact O-CB 3.45Å; L17-L21 PolarHBondContact O-N 3.06Å; F18-L21 PolarHBondContact O-N 3.2Å; L21-V24 PolarHBondContact O-N 3.18Å; L21-L25 WeakPolarHBondContact O-CB 3.34Å; L21-L25 VanDerWaalsContact O-CG 3.28Å; L21-L25 WeakPolarHBondContact O-CG 3.26Å; L21-L25 PolarHBondContact O-N 2.85Å
22	L	56.4	Low	49.8	Very low	23 Å²	23	98.2 Å²	98.2	12%	0.12	51%	0.514	C	S	.	.	H	α-helix	trans	-62.3	-43.4	173.1	-74.8	172.6	0	0	0	110.9	F18 W20 V24 L25 F26 L90	F18-L22 HydrophobicContact CD1-CD1 3.67Å; F18-L22 HydrophobicContact CD1-CG 4.37Å; F18-L22 HydrophobicContact CE1-CD1 3.35Å; F18-L22 HydrophobicContact CE1-CG 4.14Å; F18-L22 HydrophobicContact CZ-CD1 3.97Å; F18-L22 HydrophobicContact CZ-CG 4.36Å; F18-L22 WeakPolarHBondContact O-CB 3.23Å; F18-L22 WeakPolarHBondContact O-CG 3.35Å; F18-L22 PolarHBondContact O-N 3.08Å; W20-L22 PolarHBondContact O-N 3.07Å; L22-V24 VanDerWaalsContact C-N 3.33Å; L22-V24 PolarHBondContact O-N 3.07Å; L22-L25 PolarHBondContact O-N 3.36Å; L22-F26 HydrophobicContact CB-CD2 4.27Å; L22-F26 HydrophobicContact CD2-CD2 4.46Å; L22-F26 HydrophobicContact CD2-CE2 4.06Å; L22-F26 VanDerWaalsContact O-CB 3.26Å; L22-F26 WeakPolarHBondContact O-CB 3.49Å; L22-F26 WeakPolarHBondContact O-CD2 3.38Å; L22-F26 PolarHBondContact O-N 3.39Å; L22-L90 HydrophobicContact CD1-CD2 3.9Å
23	T	55.6	Low	49.6	Very low	69 Å²	69	99.4 Å²	99.4	42%	0.423	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-41.1	178.1	-56.8	0	0	0	0	111.9	A19 W20 F26 Q27	A19-T23 VanDerWaalsContact O-CB 3.32Å; A19-T23 WeakPolarHBondContact O-CB 3.29Å; A19-T23 PolarHBondContact O-N 3.04Å; A19-T23 PolarHBondContact O-OG1 3.44Å; W20-T23 PolarHBondContact O-N 3.07Å; W20-T23 VanDerWaalsContact O-N 3.14Å; T23-F26 PolarHBondContact O-N 2.99Å; T23-Q27 WeakPolarHBondContact O-CB 3.5Å; T23-Q27 WeakPolarHBondContact O-CG 3.07Å; T23-Q27 PolarHBondContact O-N 3.42Å
24	V	62.5	Low	49.4	Very low	56 Å²	56	95.4 Å²	95.4	34%	0.339	50%	0.504	S	S	.	.	H	α-helix	trans	-67.5	-41.8	176.5	172.2	0	0	0	0	111.7	W20 L21 L22	W20-V24 HydrophobicContact CD2-CG2 4.02Å; W20-V24 HydrophobicContact CE3-CG2 4.02Å; W20-V24 HydrophobicContact CH2-CG2 4.08Å; W20-V24 HydrophobicContact CZ2-CG2 4.06Å; W20-V24 HydrophobicContact CZ3-CG2 4.05Å; W20-V24 WeakPolarHBondContact O-CG2 3.4Å; W20-V24 PolarHBondContact O-N 3.07Å; L21-V24 PolarHBondContact O-N 3.18Å; L22-V24 VanDerWaalsContact C-N 3.33Å; L22-V24 PolarHBondContact O-N 3.07Å
25	L	54.3	Low	49	Very low	117 Å²	117	100.9 Å²	100.9	61%	0.613	52%	0.523	S	S	*	.	H	α-helix	trans	-66.8	-38.5	175.5	-71.5	170.5	0	0	0	111.7	L21 L22 R28	L21-L25 WeakPolarHBondContact O-CB 3.34Å; L21-L25 VanDerWaalsContact O-CG 3.28Å; L21-L25 WeakPolarHBondContact O-CG 3.26Å; L21-L25 PolarHBondContact O-N 2.85Å; L22-L25 PolarHBondContact O-N 3.36Å; L25-R28 PolarHBondContact O-N 3.48Å
26	F	51.9	Low	49	Very low	41 Å²	41	108.1 Å²	108.1	18%	0.18	54%	0.543	C	S	.	.	H	α-helix	trans	-76.4	-28	178.3	-85.4	-72.3	0	0	0	113.7	L22 T23 R28 I29 L141 V145	L22-F26 HydrophobicContact CB-CD2 4.27Å; L22-F26 HydrophobicContact CD2-CD2 4.46Å; L22-F26 HydrophobicContact CD2-CE2 4.06Å; L22-F26 VanDerWaalsContact O-CB 3.26Å; L22-F26 WeakPolarHBondContact O-CB 3.49Å; L22-F26 WeakPolarHBondContact O-CD2 3.38Å; L22-F26 PolarHBondContact O-N 3.39Å; T23-F26 PolarHBondContact O-N 2.99Å; F26-R28 PolarHBondContact O-N 3.06Å; F26-I29 HydrophobicContact CD1-CD1 3.38Å; F26-I29 HydrophobicContact CD1-CG1 4.32Å; F26-I29 HydrophobicContact CE1-CD1 3.53Å; F26-I29 HydrophobicContact CG-CD1 4.34Å; F26-I29 PolarHBondContact O-N 2.95Å; F26-L141 HydrophobicContact CE2-CD1 3.82Å; F26-L141 HydrophobicContact CZ-CD1 3.56Å; F26-L141 HydrophobicContact CZ-CD2 4.23Å; F26-L141 HydrophobicContact CZ-CG 4.04Å; F26-V145 HydrophobicContact CD1-CG2 4.3Å; F26-V145 HydrophobicContact CE1-CG1 4.33Å; F26-V145 HydrophobicContact CE1-CG2 3.49Å; F26-V145 VanDerWaalsContact CE1-CG2 3.49Å; F26-V145 HydrophobicContact CE2-CG2 3.97Å; F26-V145 HydrophobicContact CZ-CG2 3.31Å
27	Q	49.8	Very low	48.6	Very low	143 Å²	143	105 Å²	105	67%	0.668	53%	0.53	S	S	*	.	H	α-helix	trans	-68.8	-17.5	173	-87.9	179.4	-52.8	0	0	113.2	T23	T23-Q27 WeakPolarHBondContact O-CB 3.5Å; T23-Q27 WeakPolarHBondContact O-CG 3.07Å; T23-Q27 PolarHBondContact O-N 3.42Å
28	R	50.2	Low	47.7	Very low	222 Å²	222	106.3 Å²	106.3	84%	0.838	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.1	172.6	-85.4	-174.2	-178.9	-168.8	1.4	114.3	L25 F26 P30	L25-R28 PolarHBondContact O-N 3.48Å; F26-R28 PolarHBondContact O-N 3.06Å; R28-P30 WeakPolarHBondContact O-CD 3.26Å
29	I	41.6	Very low	47	Very low	94 Å²	94	107 Å²	107	48%	0.482	54%	0.537	S	S	.	.	S	Bend	trans	-76.8	116.5	172.2	-56.1	-173.8	0	0	0	107.2	F26 H31	F26-I29 HydrophobicContact CD1-CD1 3.38Å; F26-I29 HydrophobicContact CD1-CG1 4.32Å; F26-I29 HydrophobicContact CE1-CD1 3.53Å; F26-I29 HydrophobicContact CG-CD1 4.34Å; F26-I29 PolarHBondContact O-N 2.95Å; I29-H31 PolarHBondContact O-N 3.26Å
30	P	39.4	Very low	46.4	Very low	107 Å²	107	111.3 Å²	111.3	70%	0.695	56%	0.559	S	S	*	*			trans	-56.1	129.6	178.4	22.2	-31.1	0	0	0	109	R28 S32	R28-P30 WeakPolarHBondContact O-CD 3.26Å; P30-S32 PolarHBondContact O-N 3.26Å
31	H	43.1	Very low	44.8	Very low	173 Å²	173	107.7 Å²	107.7	80%	0.801	55%	0.549	S	S	*	.			trans	-57.6	87.2	171	-80.3	-88.4	0	0	0	109	I29 P33	I29-H31 PolarHBondContact O-N 3.26Å; H31-P33 WeakPolarHBondContact O-CD 3.31Å
32	S	42.4	Very low	43.5	Very low	95 Å²	95	108.4 Å²	108.4	66%	0.664	55%	0.55	S	S	*	*			trans	-76.3	118.3	168.9	59.9	0	0	0	0	107.4	P30 L34	P30-S32 PolarHBondContact O-N 3.26Å; S32-L34 PolarHBondContact O-N 2.99Å
33	P	44.1	Very low	42.5	Very low	99 Å²	99	117.7 Å²	117.7	64%	0.643	59%	0.585	S	S	*	*			trans	-63.8	125.1	175.8	25.3	-30.2	0	0	0	108.8	H31 N35	H31-P33 WeakPolarHBondContact O-CD 3.31Å; P33-N35 PolarHBondContact O-N 2.93Å
34	L	36.8	Very low	41.6	Very low	89 Å²	89	124.9 Å²	124.9	47%	0.466	61%	0.605	S	S	.	*	S	Bend	trans	-51.1	108.1	167.9	-85.6	86.3	0	0	0	108.8	S32 C153	S32-L34 PolarHBondContact O-N 2.99Å; L34-C153 HydrophobicContact CD2-CB 4.38Å
35	N	34.5	Very low	40.2	Very low	159 Å²	159	129.8 Å²	129.8	85%	0.85	62%	0.622	S	S	*	*			trans	-152.9	18.6	154.8	-97.3	-11.5	0	0	0	112.3	P33	P33-N35 PolarHBondContact O-N 2.93Å
36	R	40.2	Very low	39.1	Very low	204 Å²	204	129.3 Å²	129.3	77%	0.77	63%	0.626	S	S	*	*			trans	-113.2	3.6	-179.7	-90.8	-164.3	-101.2	-116.6	-4.8	116.3	F38 L39	R36-F38 PolarHBondContact O-N 3.02Å; R36-L39 HydrophobicContact CB-CD1 4.26Å; R36-L39 HydrophobicContact CG-CD1 3.53Å; R36-L39 HydrophobicContact CG-CG 4.29Å; R36-L39 PolarHBondContact O-N 3.45Å
37	C	38.3	Very low	38.3	Very low	42 Å²	42	134.4 Å²	134.4	28%	0.284	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-71.7	-13.9	175	-132.9	0	0	0	0	113.1	C153	C37-C153 HydrophobicContact CB-CB 3.72Å; C37-C153 WeakPolarHBondContact CB-SG 3.11Å; C37-C153 WeakPolarHBondContact SG-CA 3.31Å; C37-C153 WeakPolarHBondContact SG-CB 3.46Å; C37-C153 CovalentContact SG-SG 2.03Å; C37-C153 PolarHBondContact SG-SG 2.94Å
38	F	35.7	Very low	37.9	Very low	141 Å²	141	135.3 Å²	135.3	62%	0.618	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-78.2	-13.2	172.6	-108.3	-88.5	0	0	0	114.1	R36 V40 E41 Q42	R36-F38 PolarHBondContact O-N 3.02Å; F38-V40 VanDerWaalsContact C-N 3.34Å; F38-V40 PolarHBondContact O-N 3.45Å; F38-E41 PolarHBondContact O-N 2.87Å; F38-Q42 WeakPolarHBondContact O-CG 3.27Å; F38-Q42 PolarHBondContact O-N 3.3Å
39	L	33.3	Very low	37.4	Very low	82 Å²	82	127.8 Å²	127.8	43%	0.429	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-75.6	-17.9	-176.6	-75.7	178.7	0	0	0	114.3	R36	R36-L39 HydrophobicContact CB-CD1 4.26Å; R36-L39 HydrophobicContact CG-CD1 3.53Å; R36-L39 HydrophobicContact CG-CG 4.29Å; R36-L39 PolarHBondContact O-N 3.45Å
40	V	37.1	Very low	37.2	Very low	128 Å²	128	129.3 Å²	129.3	78%	0.776	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-23.3	172.8	-177.8	0	0	0	0	111.1	F38	F38-V40 VanDerWaalsContact C-N 3.34Å; F38-V40 PolarHBondContact O-N 3.45Å
41	E	33.4	Very low	37.2	Very low	95 Å²	95	132.9 Å²	132.9	44%	0.444	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	-17.9	176.6	-139.4	158.9	166.3	0	0	112.3	F38 R156	F38-E41 PolarHBondContact O-N 2.87Å; E41-R156 IonicContact OE1-NH2 3.96Å; E41-R156 IonicContact OE2-CZ 3.68Å; E41-R156 IonicContact OE2-NH1 2.98Å; E41-R156 PolarHBondContact OE2-NH1 2.85Å; E41-R156 IonicContact OE2-NH2 2.67Å; E41-R156 PolarHBondContact OE2-NH2 3.48Å
42	Q	32	Very low	37	Very low	97 Å²	97	130.8 Å²	130.8	45%	0.453	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-92.3	-9.4	-176.8	-79.4	-176	-25.6	0	0	115.6	F38 W44 F45	F38-Q42 WeakPolarHBondContact O-CG 3.27Å; F38-Q42 PolarHBondContact O-N 3.3Å; Q42-W44 PolarHBondContact O-N 3.44Å; Q42-F45 PolarHBondContact O-N 2.67Å
43	Y	35.5	Very low	36.8	Very low	219 Å²	219	132.5 Å²	132.5	86%	0.859	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-68.8	-11	168.8	-91.5	-83.6	0	0	0	113.1
44	W	37.1	Very low	36.6	Very low	219 Å²	219	137.5 Å²	137.5	83%	0.83	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-107.3	-6.9	176.7	-91.5	84.8	0	0	0	114.7	Q42	Q42-W44 PolarHBondContact O-N 3.44Å
45	F	34.6	Very low	36.9	Very low	160 Å²	160	137.1 Å²	137.1	70%	0.702	69%	0.691	S	S	*	*			trans	-150	107	179	-78.7	-83	0	0	0	111.5	Q42	Q42-F45 PolarHBondContact O-N 2.67Å
46	P	29.3	Very low	37.4	Very low	107 Å²	107	134 Å²	134	70%	0.695	68%	0.677	S	S	*	*			trans	-88.3	128.3	175.9	33.4	-27.1	0	0	0	109.6
47	N	35.5	Very low	37.5	Very low	147 Å²	147	132.7 Å²	132.7	79%	0.786	68%	0.679	S	S	*	*			trans	157.6	134.1	138.4	-80.8	-38.9	0	0	0	112.3
48	I	41.9	Very low	37.8	Very low	163 Å²	163	137.5 Å²	137.5	84%	0.836	70%	0.698	S	S	*	*			trans	92.4	89.3	161.7	-51.2	157.1	0	0	0	117.2
49	G	39.7	Very low	38.2	Very low	63 Å²	63	136.1 Å²	136.1	65%	0.649	70%	0.695	S	S	*	*				78.7	103.6	90.9	0	0	0	0	0	121.6
50	V	37.2	Very low	38.6	Very low	126 Å²	126	134.6 Å²	134.6	76%	0.764	70%	0.698	S	S	*	*			trans	58.9	118.9	132.5	-158.9	0	0	0	0	120.4
51	F	39.9	Very low	38.8	Very low	183 Å²	183	136.6 Å²	136.6	80%	0.803	70%	0.699	S	S	*	*				177.5	140.7	115.1	-110.7	-88.3	0	0	0	115.7
52	D	38.5	Very low	39.4	Very low	128 Å²	128	140.8 Å²	140.8	68%	0.684	71%	0.711	S	S	*	*			trans	-4.7	140.9	174.5	-68.6	-39.5	0	0	0	126.4
53	T	38.2	Very low	39.9	Very low	131 Å²	131	141.5 Å²	141.5	80%	0.804	71%	0.71	S	S	*	*	S	Bend	trans	-100.1	8.4	-171	4.7	0	0	0	0	115.9
54	F	39.4	Very low	40.5	Very low	204 Å²	204	139.5 Å²	139.5	90%	0.895	71%	0.708	S	S	*	*	S	Bend	trans	-94.9	-14.2	-166.8	-146.1	-102.7	0	0	0	115.9
55	S	43	Very low	40.8	Very low	82 Å²	82	140.4 Å²	140.4	57%	0.573	71%	0.711	S	S	*	*	S	Bend	trans	-89	-8.8	-177.1	-89.5	0	0	0	0	115.9
56	V	46.1	Very low	41.3	Very low	94 Å²	94	143 Å²	143	57%	0.57	72%	0.716	S	S	*	*	H	α-helix	trans	-78.1	-28.1	-165.6	-173.3	0	0	0	0	112.9	Q58	V56-Q58 PolarHBondContact O-N 2.89Å
57	H	42.6	Very low	42.4	Very low	175 Å²	175	140.8 Å²	140.8	81%	0.81	70%	0.696	S	S	*	*	H	α-helix	trans	-76.7	-21	-176	-151.4	-70.3	0	0	0	113.6
58	Q	45	Very low	42.8	Very low	144 Å²	144	137 Å²	137	67%	0.673	69%	0.692	S	S	*	*	H	α-helix	trans	-91.4	-19.1	-179.3	-132.7	178.4	8.9	0	0	113.2	V56	V56-Q58 PolarHBondContact O-N 2.89Å
59	M	42.4	Very low	43	Very low	112 Å²	112	137 Å²	137	55%	0.552	69%	0.693	S	S	*	*	H	α-helix	trans	-78.9	-34.2	176.9	-68.8	-173.5	-169.7	0	0	112.5	H61 R62 Y63	M59-H61 VanDerWaalsContact C-N 3.32Å; M59-H61 PolarHBondContact O-N 3.07Å; M59-R62 PolarHBondContact O-N 3.06Å; M59-Y63 PolarHBondContact O-N 3.5Å; M59-Y63 VanDerWaalsContact O-N 3.15Å
60	G	43	Very low	43.5	Very low	49 Å²	49	139.1 Å²	139.1	51%	0.505	68%	0.682	S	S	.	*	H	α-helix	trans	-61.4	-34.5	-178.8	0	0	0	0	0	114.5
61	H	41.4	Very low	44.3	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.787	68%	0.68	S	S	*	*	H	α-helix	trans	-81.3	-23.1	-178.4	-119.4	-76.3	0	0	0	114	M59	M59-H61 VanDerWaalsContact C-N 3.32Å; M59-H61 PolarHBondContact O-N 3.07Å
62	R	45.6	Very low	45.5	Very low	184 Å²	184	133.9 Å²	133.9	69%	0.694	66%	0.661	S	S	*	*	H	α-helix	trans	-84.7	-26.1	173.7	-98.2	-174	-89.2	-165.7	-4.7	112.5	M59	M59-R62 PolarHBondContact O-N 3.06Å
63	Y	42.6	Very low	47.2	Very low	112 Å²	112	135.6 Å²	135.6	44%	0.439	66%	0.659	S	S	.	*	H	α-helix	trans	-67.7	-38	-177.4	-146.8	-100.5	0	0	0	113.3	M59 R65 F67 L337	M59-Y63 PolarHBondContact O-N 3.5Å; M59-Y63 VanDerWaalsContact O-N 3.15Å; Y63-R65 VanDerWaalsContact C-N 3.28Å; Y63-R65 PolarHBondContact O-N 3.5Å; Y63-F67 HydrophobicContact CD1-CD2 4.2Å; Y63-F67 AromaticContact CE1-CD2 3.73Å; Y63-F67 HydrophobicContact CE1-CD2 3.73Å; Y63-F67 AromaticContact CE1-CE2 3.69Å; Y63-F67 HydrophobicContact CE1-CE2 3.69Å; Y63-F67 AromaticContact CZ-CE2 3.79Å; Y63-L337 WeakPolarHBondContact OH-CD1 3.37Å
64	H	46.8	Very low	49.3	Very low	176 Å²	176	129.8 Å²	129.8	82%	0.815	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-18.1	-177.3	-123.5	-64.9	0	0	0	114.4
65	R	44	Very low	51.6	Low	238 Å²	238	123.3 Å²	123.3	90%	0.898	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-10.2	-174.2	-125.8	-178.7	-160.1	173.4	5.6	114.5	Y63	Y63-R65 VanDerWaalsContact C-N 3.28Å; Y63-R65 PolarHBondContact O-N 3.5Å
66	R	45.5	Very low	53.8	Low	214 Å²	214	123.4 Å²	123.4	81%	0.808	59%	0.589	S	S	*	*	S	Bend	trans	-114.2	-0.9	-176.2	-152.4	-178.9	-109.5	-176.4	-5	113.7
67	F	52.1	Low	55.9	Low	61 Å²	61	129.1 Å²	129.1	27%	0.268	60%	0.601	S	S	.	*			trans	-109	18.8	-169.6	-132.8	-78.1	0	0	0	114	Y63 D69 R70 L337	Y63-F67 HydrophobicContact CD1-CD2 4.2Å; Y63-F67 AromaticContact CE1-CD2 3.73Å; Y63-F67 HydrophobicContact CE1-CD2 3.73Å; Y63-F67 AromaticContact CE1-CE2 3.69Å; Y63-F67 HydrophobicContact CE1-CE2 3.69Å; Y63-F67 AromaticContact CZ-CE2 3.79Å; F67-D69 PolarHBondContact O-N 3.09Å; F67-D69 VanDerWaalsContact O-N 3.09Å; F67-R70 HydrophobicContact CD1-CB 3.57Å; F67-R70 HydrophobicContact CD1-CG 4.32Å; F67-R70 HydrophobicContact CE1-CB 3.31Å; F67-R70 HydrophobicContact CE1-CG 4.11Å; F67-R70 HydrophobicContact CZ-CB 4.12Å; F67-L337 HydrophobicContact CE2-CD2 3.73Å; F67-L337 HydrophobicContact CZ-CD1 4.46Å; F67-L337 HydrophobicContact CZ-CD2 3.61Å
68	G	43.5	Very low	58.3	Low	69 Å²	69	121.4 Å²	121.4	71%	0.711	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-22	-170.7	0	0	0	0	0	116.2
69	D	46.2	Very low	60.5	Low	161 Å²	161	116 Å²	116	86%	0.861	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	14.8	-171	-64.1	-46	0	0	0	114.9	F67 I71	F67-D69 PolarHBondContact O-N 3.09Å; F67-D69 VanDerWaalsContact O-N 3.09Å; D69-I71 PolarHBondContact O-N 2.99Å
70	R	49.9	Very low	62.8	Low	108 Å²	108	117.3 Å²	117.3	41%	0.408	54%	0.54	S	S	.	.			trans	-85.3	109.4	-180	-81.5	-163.2	-80.1	-146.3	2.3	111.3	F67 S72 E340	F67-R70 HydrophobicContact CD1-CB 3.57Å; F67-R70 HydrophobicContact CD1-CG 4.32Å; F67-R70 HydrophobicContact CE1-CB 3.31Å; F67-R70 HydrophobicContact CE1-CG 4.11Å; F67-R70 HydrophobicContact CZ-CB 4.12Å; R70-S72 PolarHBondContact O-N 3.37Å; R70-S72 VanDerWaalsContact O-N 3.13Å; R70-E340 IonicContact CZ-OE2 2.83Å; R70-E340 IonicContact NH1-OE1 3.65Å; R70-E340 IonicContact NH1-OE2 3.64Å; R70-E340 PolarHBondContact NH1-OE2 3.18Å
71	I	55.4	Low	65.2	Low	142 Å²	142	117 Å²	117	73%	0.728	53%	0.53	S	S	*	.			trans	-44.4	114.1	169.8	-59.8	168.3	0	0	0	109	D69 Y73	D69-I71 PolarHBondContact O-N 2.99Å; I71-Y73 PolarHBondContact O-N 3.46Å
72	S	64.6	Low	67.6	Low	57 Å²	57	109 Å²	109	40%	0.399	49%	0.493	S	S	.	.			trans	-68.8	126.9	168.9	176.8	0	0	0	0	108.4	R70 I74 Q333	R70-S72 PolarHBondContact O-N 3.37Å; R70-S72 VanDerWaalsContact O-N 3.13Å; S72-I74 PolarHBondContact O-N 3.34Å; S72-I74 WeakPolarHBondContact OG-CB 3.46Å; S72-I74 PolarHBondContact OG-N 3.33Å; S72-Q333 PolarHBondContact OG-OE1 2.98Å
73	Y	74.2	Confident	69.9	Low	164 Å²	164	101.2 Å²	101.2	64%	0.643	47%	0.466	S	S	*	.			trans	-73.5	-0.3	175.6	-62.6	-68.9	0	0	0	112.7	I71 Q333 L336	I71-Y73 PolarHBondContact O-N 3.46Å; Y73-Q333 HydrophobicContact CD2-CG 4.26Å; Y73-Q333 VanDerWaalsContact N-NE2 3.15Å; Y73-L336 HydrophobicContact CD2-CD1 4.11Å; Y73-L336 HydrophobicContact CE2-CD1 3.93Å
74	I	82.8	Confident	72.4	Confident	10 Å²	10	100.9 Å²	100.9	5%	0.051	47%	0.472	C	S	.	.	S	Bend	trans	-77.3	130.9	-178.9	-63.6	165.6	0	0	0	109.5	S72 Q76 E150 L326 Q329 I330 Q333	S72-I74 PolarHBondContact O-N 3.34Å; S72-I74 WeakPolarHBondContact OG-CB 3.46Å; S72-I74 PolarHBondContact OG-N 3.33Å; I74-Q76 PolarHBondContact O-N 3.36Å; I74-Q76 VanDerWaalsContact O-N 3.07Å; I74-E150 HydrophobicContact CD1-CG 4.41Å; I74-L326 HydrophobicContact CG2-CD1 3.55Å; I74-Q329 HydrophobicContact CG1-CB 4.32Å; I74-I330 HydrophobicContact CD1-CG1 3.82Å; I74-I330 HydrophobicContact CG1-CG1 4.38Å; I74-Q333 HydrophobicContact CG1-CG 4.24Å
75	N	87.8	Confident	74.6	Confident	68 Å²	68	95.3 Å²	95.3	36%	0.364	45%	0.45	S	S	.	.			trans	-72	108.4	176	-174.8	-13.5	0	0	0	109.7	W77 V78 K79	N75-W77 PolarHBondContact O-N 3.19Å; N75-W77 WeakPolarHBondContact OD1-CB 3.28Å; N75-W77 PolarHBondContact OD1-N 3.05Å; N75-V78 HydrophobicContact CB-CB 4.32Å; N75-V78 HydrophobicContact CB-CG2 3.93Å; N75-V78 WeakPolarHBondContact O-CB 3.31Å; N75-V78 PolarHBondContact O-N 2.91Å; N75-V78 VanDerWaalsContact O-N 3.07Å; N75-K79 PolarHBondContact O-N 3.46Å
76	Q	88.7	Confident	77.1	Confident	83 Å²	83	84 Å²	84	39%	0.388	41%	0.408	S	S	.	.	H	α-helix	trans	-59.3	-31.9	-176.4	-155.1	75.2	-15.1	0	0	113	I74 K79 Y80	I74-Q76 PolarHBondContact O-N 3.36Å; I74-Q76 VanDerWaalsContact O-N 3.07Å; Q76-K79 PolarHBondContact O-N 2.98Å; Q76-Y80 HydrophobicContact CG-CD2 3.6Å; Q76-Y80 HydrophobicContact CG-CE2 3.22Å; Q76-Y80 PolarHBondContact NE2-OH 3.41Å; Q76-Y80 VanDerWaalsContact NE2-OH 3.08Å; Q76-Y80 VanDerWaalsContact O-CD2 3.27Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.37Å; Q76-Y80 PolarHBondContact O-N 2.94Å
77	W	90.5	Very high	79.4	Confident	214 Å²	214	75.7 Å²	75.7	81%	0.811	38%	0.378	S	S	*	.	H	α-helix	trans	-63.1	-45	175.5	-67.5	103.7	0	0	0	111.9	N75 K79 Y80 S81	N75-W77 PolarHBondContact O-N 3.19Å; N75-W77 WeakPolarHBondContact OD1-CB 3.28Å; N75-W77 PolarHBondContact OD1-N 3.05Å; W77-K79 VanDerWaalsContact C-N 3.35Å; W77-K79 PolarHBondContact O-N 3.46Å; W77-Y80 PolarHBondContact O-N 3.34Å; W77-S81 VanDerWaalsContact O-CB 3.26Å; W77-S81 WeakPolarHBondContact O-CB 3.32Å; W77-S81 PolarHBondContact O-N 3.31Å; W77-S81 PolarHBondContact O-OG 3Å; W77-S81 VanDerWaalsContact O-OG 3.06Å
78	V	92	Very high	81.5	Confident	14 Å²	14	76.8 Å²	76.8	9%	0.085	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-43.5	178.5	176.4	0	0	0	0	110.5	N75 S81 L82 L322 L326	N75-V78 HydrophobicContact CB-CB 4.32Å; N75-V78 HydrophobicContact CB-CG2 3.93Å; N75-V78 WeakPolarHBondContact O-CB 3.31Å; N75-V78 PolarHBondContact O-N 2.91Å; N75-V78 VanDerWaalsContact O-N 3.07Å; V78-S81 PolarHBondContact O-OG 3.19Å; V78-S81 VanDerWaalsContact O-OG 3.07Å; V78-L82 VanDerWaalsContact O-CB 3.31Å; V78-L82 WeakPolarHBondContact O-CB 3.49Å; V78-L82 PolarHBondContact O-N 3.48Å; V78-L82 VanDerWaalsContact O-N 3.09Å; V78-L322 HydrophobicContact CB-CD2 4.45Å; V78-L322 HydrophobicContact CG1-CB 4.22Å; V78-L322 HydrophobicContact CG1-CD2 4.01Å; V78-L322 WeakPolarHBondContact CG1-O 3.44Å; V78-L322 HydrophobicContact CG2-CD2 4.09Å; V78-L326 HydrophobicContact CG1-CB 4.07Å
79	K	91.1	Very high	83.9	Confident	29 Å²	29	78.3 Å²	78.3	13%	0.126	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-52.4	178.7	-178.9	177.3	179.4	173.7	0	111.5	N75 Q76 W77 C83 S147 E150 L326	N75-K79 PolarHBondContact O-N 3.46Å; Q76-K79 PolarHBondContact O-N 2.98Å; W77-K79 VanDerWaalsContact C-N 3.35Å; W77-K79 PolarHBondContact O-N 3.46Å; K79-C83 VanDerWaalsContact O-CB 3.24Å; K79-C83 WeakPolarHBondContact O-CB 3.32Å; K79-C83 PolarHBondContact O-N 3.34Å; K79-S147 WeakPolarHBondContact CE-O 3.43Å; K79-E150 IonicContact NZ-OE1 2.68Å; K79-E150 PolarHBondContact NZ-OE1 3.24Å; K79-L326 HydrophobicContact CB-CD1 4.34Å
80	Y	90.6	Very high	86.3	Confident	140 Å²	140	70.9 Å²	70.9	55%	0.549	33%	0.333	S	S	.	.	H	α-helix	trans	-71.7	-34.8	-177.2	-71.3	-52.1	0	0	0	113	Q76 W77 C83 L84	Q76-Y80 HydrophobicContact CG-CD2 3.6Å; Q76-Y80 HydrophobicContact CG-CE2 3.22Å; Q76-Y80 PolarHBondContact NE2-OH 3.41Å; Q76-Y80 VanDerWaalsContact NE2-OH 3.08Å; Q76-Y80 VanDerWaalsContact O-CD2 3.27Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.37Å; Q76-Y80 PolarHBondContact O-N 2.94Å; W77-Y80 PolarHBondContact O-N 3.34Å; Y80-C83 PolarHBondContact O-N 3.04Å; Y80-L84 VanDerWaalsContact O-CB 3.26Å; Y80-L84 WeakPolarHBondContact O-CB 3.23Å; Y80-L84 PolarHBondContact O-N 3.21Å
81	S	92.8	Very high	88.5	Confident	43 Å²	43	67.6 Å²	67.6	30%	0.301	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-44.5	175.3	67.4	0	0	0	0	111.3	W77 V78 L84 T85	W77-S81 VanDerWaalsContact O-CB 3.26Å; W77-S81 WeakPolarHBondContact O-CB 3.32Å; W77-S81 PolarHBondContact O-N 3.31Å; W77-S81 PolarHBondContact O-OG 3Å; W77-S81 VanDerWaalsContact O-OG 3.06Å; V78-S81 PolarHBondContact O-OG 3.19Å; V78-S81 VanDerWaalsContact O-OG 3.07Å; S81-L84 PolarHBondContact O-N 2.91Å; S81-T85 WeakPolarHBondContact O-CB 3.47Å; S81-T85 PolarHBondContact O-N 3.39Å; S81-T85 PolarHBondContact O-OG1 3.44Å; S81-T85 VanDerWaalsContact O-OG1 3.05Å
82	L	93.8	Very high	90.3	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-66.2	-41.7	178.4	-169.4	66.5	0	0	0	111.3	V78 N86 L155 Y158 A323 L326	V78-L82 VanDerWaalsContact O-CB 3.31Å; V78-L82 WeakPolarHBondContact O-CB 3.49Å; V78-L82 PolarHBondContact O-N 3.48Å; V78-L82 VanDerWaalsContact O-N 3.09Å; L82-N86 WeakPolarHBondContact CD1-ND2 3.49Å; L82-N86 WeakPolarHBondContact O-CB 3.4Å; L82-N86 PolarHBondContact O-N 2.87Å; L82-N86 PolarHBondContact O-ND2 2.92Å; L82-L155 HydrophobicContact CD2-CD2 3.93Å; L82-Y158 HydrophobicContact CD1-CE1 3.91Å; L82-A323 HydrophobicContact CD1-CB 4.46Å; L82-A323 HydrophobicContact CD2-CB 4.08Å; L82-L326 HydrophobicContact CD2-CD2 3.84Å
83	C	93.2	Very high	91.8	Very high	19 Å²	19	61.5 Å²	61.5	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-48.9	176.1	-175	0	0	0	0	111.5	K79 Y80 N86 F87 F144	K79-C83 VanDerWaalsContact O-CB 3.24Å; K79-C83 WeakPolarHBondContact O-CB 3.32Å; K79-C83 PolarHBondContact O-N 3.34Å; Y80-C83 PolarHBondContact O-N 3.04Å; C83-N86 PolarHBondContact O-N 2.98Å; C83-F87 WeakPolarHBondContact O-CB 3.34Å; C83-F87 PolarHBondContact O-N 3.43Å; C83-F144 WeakPolarHBondContact SG-CE2 3.43Å
84	L	93.9	Very high	92.7	Very high	105 Å²	105	55.6 Å²	55.6	55%	0.55	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-49.7	179.7	178.8	63.8	0	0	0	112	Y80 S81 N86 F87 I88	Y80-L84 VanDerWaalsContact O-CB 3.26Å; Y80-L84 WeakPolarHBondContact O-CB 3.23Å; Y80-L84 PolarHBondContact O-N 3.21Å; S81-L84 PolarHBondContact O-N 2.91Å; L84-N86 VanDerWaalsContact C-N 3.34Å; L84-N86 PolarHBondContact O-N 3.03Å; L84-F87 WeakPolarHBondContact O-CB 3.32Å; L84-F87 PolarHBondContact O-N 3.31Å; L84-F87 VanDerWaalsContact O-N 3.17Å; L84-I88 HydrophobicContact CD1-CD1 4.41Å; L84-I88 HydrophobicContact CG-CD1 4.26Å; L84-I88 WeakPolarHBondContact O-CG1 3.18Å; L84-I88 PolarHBondContact O-N 3.1Å
85	T	94	Very high	93.2	Very high	59 Å²	59	58.7 Å²	58.7	36%	0.362	29%	0.293	S	S	.	.	H	α-helix	trans	-61	-43.5	-179.9	-62.7	0	0	0	0	111.3	S81 F87 I88 F89	S81-T85 WeakPolarHBondContact O-CB 3.47Å; S81-T85 PolarHBondContact O-N 3.39Å; S81-T85 PolarHBondContact O-OG1 3.44Å; S81-T85 VanDerWaalsContact O-OG1 3.05Å; T85-F87 VanDerWaalsContact C-N 3.35Å; T85-F87 PolarHBondContact O-N 2.86Å; T85-I88 PolarHBondContact O-N 2.87Å; T85-F89 HydrophobicContact CG2-CD2 3.77Å; T85-F89 HydrophobicContact CG2-CE2 3.49Å; T85-F89 VanDerWaalsContact CG2-CE2 3.49Å; T85-F89 WeakPolarHBondContact O-CD2 3.48Å; T85-F89 PolarHBondContact O-N 2.84Å
86	N	96	Very high	93.4	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.011	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-32	176.8	-78.3	-73.4	0	0	0	112.8	L82 C83 L84 F89 L90 F144 Y158	L82-N86 WeakPolarHBondContact CD1-ND2 3.49Å; L82-N86 WeakPolarHBondContact O-CB 3.4Å; L82-N86 PolarHBondContact O-N 2.87Å; L82-N86 PolarHBondContact O-ND2 2.92Å; C83-N86 PolarHBondContact O-N 2.98Å; L84-N86 VanDerWaalsContact C-N 3.34Å; L84-N86 PolarHBondContact O-N 3.03Å; N86-F89 PolarHBondContact O-N 3.44Å; N86-L90 VanDerWaalsContact O-CB 3.27Å; N86-L90 WeakPolarHBondContact O-CB 3.42Å; N86-L90 PolarHBondContact O-N 3.14Å; N86-F144 HydrophobicContact CB-CB 4.02Å; N86-Y158 PolarHBondContact ND2-OH 3.28Å; N86-Y158 VanDerWaalsContact ND2-OH 3.12Å; N86-Y158 WeakPolarHBondContact OD1-CE2 3.07Å; N86-Y158 PolarHBondContact OD1-OH 2.95Å
87	F	94.3	Very high	93.6	Very high	39 Å²	39	58.7 Å²	58.7	17%	0.171	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-41.3	172.9	-178	-97.8	0	0	0	112	F18 C83 L84 T85 L90 A91 F144	F18-F87 AromaticContact CD1-CE2 3.61Å; F18-F87 HydrophobicContact CD1-CE2 3.61Å; F18-F87 AromaticContact CD1-CZ 3.76Å; F18-F87 HydrophobicContact CD1-CZ 3.76Å; F18-F87 HydrophobicContact CE1-CE2 4.02Å; F18-F87 HydrophobicContact CE1-CZ 4.42Å; C83-F87 WeakPolarHBondContact O-CB 3.34Å; C83-F87 PolarHBondContact O-N 3.43Å; L84-F87 WeakPolarHBondContact O-CB 3.32Å; L84-F87 PolarHBondContact O-N 3.31Å; L84-F87 VanDerWaalsContact O-N 3.17Å; T85-F87 VanDerWaalsContact C-N 3.35Å; T85-F87 PolarHBondContact O-N 2.86Å; F87-L90 WeakPolarHBondContact O-CB 3.35Å; F87-L90 PolarHBondContact O-N 3.43Å; F87-A91 PolarHBondContact O-N 3.44Å; F87-F144 HydrophobicContact CB-CD2 4.01Å; F87-F144 HydrophobicContact CB-CE2 4.02Å; F87-F144 HydrophobicContact CD2-CD2 4.45Å; F87-F144 AromaticContact CD2-CE2 3.92Å; F87-F144 HydrophobicContact CD2-CE2 3.92Å; F87-F144 HydrophobicContact CD2-CZ 4.2Å; F87-F144 HydrophobicContact CG-CE2 4.41Å
88	I	95.3	Very high	93.8	Very high	84 Å²	84	52 Å²	52	43%	0.431	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-48	175.1	-65.5	166.3	0	0	0	110.3	L84 T85 L90 A91 I92	L84-I88 HydrophobicContact CD1-CD1 4.41Å; L84-I88 HydrophobicContact CG-CD1 4.26Å; L84-I88 WeakPolarHBondContact O-CG1 3.18Å; L84-I88 PolarHBondContact O-N 3.1Å; T85-I88 PolarHBondContact O-N 2.87Å; I88-L90 VanDerWaalsContact C-N 3.28Å; I88-L90 PolarHBondContact O-N 3.38Å; I88-A91 PolarHBondContact O-N 3.02Å; I88-I92 HydrophobicContact CG2-CD1 3.81Å; I88-I92 HydrophobicContact CG2-CG1 4.47Å; I88-I92 WeakPolarHBondContact O-CG1 3.28Å; I88-I92 PolarHBondContact O-N 3.39Å
89	F	95.7	Very high	93.7	Very high	101 Å²	101	57.7 Å²	57.7	44%	0.443	30%	0.297	S	S	.	.	H	α-helix	trans	-63.6	-33.2	176.7	-76.5	-62.1	0	0	0	113.2	T85 N86 I92 G93	T85-F89 HydrophobicContact CG2-CD2 3.77Å; T85-F89 HydrophobicContact CG2-CE2 3.49Å; T85-F89 VanDerWaalsContact CG2-CE2 3.49Å; T85-F89 WeakPolarHBondContact O-CD2 3.48Å; T85-F89 PolarHBondContact O-N 2.84Å; N86-F89 PolarHBondContact O-N 3.44Å; F89-I92 HydrophobicContact CD1-CD1 4.47Å; F89-I92 PolarHBondContact O-N 3Å; F89-G93 PolarHBondContact O-N 2.65Å
90	L	96.1	Very high	93.5	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-43.4	174.5	-176.2	68.6	0	0	0	111.2	F18 L22 N86 F87 I88 T94 L137 S140 L141	F18-L90 HydrophobicContact CE1-CD2 4.24Å; L22-L90 HydrophobicContact CD1-CD2 3.9Å; N86-L90 VanDerWaalsContact O-CB 3.27Å; N86-L90 WeakPolarHBondContact O-CB 3.42Å; N86-L90 PolarHBondContact O-N 3.14Å; F87-L90 WeakPolarHBondContact O-CB 3.35Å; F87-L90 PolarHBondContact O-N 3.43Å; I88-L90 VanDerWaalsContact C-N 3.28Å; I88-L90 PolarHBondContact O-N 3.38Å; L90-T94 WeakPolarHBondContact O-CB 3.43Å; L90-T94 PolarHBondContact O-N 2.9Å; L90-T94 PolarHBondContact O-OG1 3.17Å; L90-L137 HydrophobicContact CD1-CD2 4.4Å; L90-L137 HydrophobicContact CD1-CG 3.95Å; L90-S140 VanDerWaalsContact CA-OG 3.27Å; L90-S140 WeakPolarHBondContact CA-OG 3.42Å; L90-S140 PolarHBondContact N-OG 3.48Å; L90-L141 HydrophobicContact CD1-CB 4.14Å; L90-L141 HydrophobicContact CD1-CD1 4.14Å; L90-L141 HydrophobicContact CD2-CD1 4.15Å
91	A	95	Very high	93.5	Very high	39 Å²	39	52.6 Å²	52.6	32%	0.322	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-46.9	174.8	0	0	0	0	0	111.1	F87 I88 T94 V95	F87-A91 PolarHBondContact O-N 3.44Å; I88-A91 PolarHBondContact O-N 3.02Å; A91-T94 PolarHBondContact O-N 2.93Å; A91-V95 VanDerWaalsContact O-CG2 3.31Å; A91-V95 WeakPolarHBondContact O-CG2 3.37Å; A91-V95 PolarHBondContact O-N 3.17Å
92	I	94.5	Very high	93.3	Very high	70 Å²	70	54 Å²	54	36%	0.359	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-51.8	176.9	-67.5	168.6	0	0	0	110.7	I88 F89 T94 V95 F96	I88-I92 HydrophobicContact CG2-CD1 3.81Å; I88-I92 HydrophobicContact CG2-CG1 4.47Å; I88-I92 WeakPolarHBondContact O-CG1 3.28Å; I88-I92 PolarHBondContact O-N 3.39Å; F89-I92 HydrophobicContact CD1-CD1 4.47Å; F89-I92 PolarHBondContact O-N 3Å; I92-T94 VanDerWaalsContact C-N 3.29Å; I92-T94 PolarHBondContact O-N 2.88Å; I92-V95 WeakPolarHBondContact O-CB 3.43Å; I92-V95 PolarHBondContact O-N 2.91Å; I92-V95 VanDerWaalsContact O-N 3.1Å; I92-F96 HydrophobicContact CG2-CD2 3.57Å; I92-F96 HydrophobicContact CG2-CE2 3.54Å; I92-F96 VanDerWaalsContact O-CD2 3.32Å; I92-F96 WeakPolarHBondContact O-CD2 3.22Å; I92-F96 PolarHBondContact O-N 3.02Å
93	G	95.1	Very high	92.8	Very high	1 Å²	1	55 Å²	55	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-37.8	179.3	0	0	0	0	0	112.9	F89 F96 L97	F89-G93 PolarHBondContact O-N 2.65Å; G93-F96 PolarHBondContact O-N 3.47Å; G93-L97 WeakPolarHBondContact O-CB 3.24Å; G93-L97 PolarHBondContact O-N 2.84Å
94	T	94.5	Very high	92.3	Very high	41 Å²	41	56.5 Å²	56.5	25%	0.252	30%	0.3	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174	-55.9	0	0	0	0	111.3	L90 A91 I92 L97 V98	L90-T94 WeakPolarHBondContact O-CB 3.43Å; L90-T94 PolarHBondContact O-N 2.9Å; L90-T94 PolarHBondContact O-OG1 3.17Å; A91-T94 PolarHBondContact O-N 2.93Å; I92-T94 VanDerWaalsContact C-N 3.29Å; I92-T94 PolarHBondContact O-N 2.88Å; T94-L97 PolarHBondContact O-N 2.91Å; T94-V98 HydrophobicContact CG2-CG2 4.46Å; T94-V98 VanDerWaalsContact O-CG2 3.31Å; T94-V98 WeakPolarHBondContact O-CG2 3.34Å; T94-V98 PolarHBondContact O-N 3.44Å
95	V	93.3	Very high	91.8	Very high	75 Å²	75	56 Å²	56	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-48.6	177.5	169.5	0	0	0	0	111	A91 I92 L97 V98 F99	A91-V95 VanDerWaalsContact O-CG2 3.31Å; A91-V95 WeakPolarHBondContact O-CG2 3.37Å; A91-V95 PolarHBondContact O-N 3.17Å; I92-V95 WeakPolarHBondContact O-CB 3.43Å; I92-V95 PolarHBondContact O-N 2.91Å; I92-V95 VanDerWaalsContact O-N 3.1Å; V95-L97 VanDerWaalsContact C-N 3.31Å; V95-L97 PolarHBondContact O-N 3.49Å; V95-V98 PolarHBondContact O-N 3.42Å; V95-F99 HydrophobicContact CG1-CD2 3.46Å; V95-F99 VanDerWaalsContact CG1-CD2 3.46Å; V95-F99 HydrophobicContact CG1-CE2 3.38Å; V95-F99 WeakPolarHBondContact O-CD2 3.32Å; V95-F99 PolarHBondContact O-N 3.48Å
96	F	90.8	Very high	91.1	Very high	103 Å²	103	60.3 Å²	60.3	45%	0.452	32%	0.317	S	S	.	.	H	α-helix	trans	-59.4	-39.7	175.9	-86.6	-79.7	0	0	0	112.6	I92 G93 G100 C129	I92-F96 HydrophobicContact CG2-CD2 3.57Å; I92-F96 HydrophobicContact CG2-CE2 3.54Å; I92-F96 VanDerWaalsContact O-CD2 3.32Å; I92-F96 WeakPolarHBondContact O-CD2 3.22Å; I92-F96 PolarHBondContact O-N 3.02Å; G93-F96 PolarHBondContact O-N 3.47Å; F96-G100 PolarHBondContact O-N 3.47Å; F96-C129 PolarHBondContact O-SG 2.99Å; F96-C129 VanDerWaalsContact O-SG 3.41Å
97	L	93.9	Very high	89.9	Confident	47 Å²	47	60.8 Å²	60.8	25%	0.246	32%	0.32	C	S	.	.	H	α-helix	trans	-67.3	-44.3	177.6	-172.9	148.6	0	0	0	111.7	G93 T94 V95 G100 V101 V134 L137	G93-L97 WeakPolarHBondContact O-CB 3.24Å; G93-L97 PolarHBondContact O-N 2.84Å; T94-L97 PolarHBondContact O-N 2.91Å; V95-L97 VanDerWaalsContact C-N 3.31Å; V95-L97 PolarHBondContact O-N 3.49Å; L97-G100 PolarHBondContact O-N 3Å; L97-V101 HydrophobicContact CD2-CG2 4.19Å; L97-V101 WeakPolarHBondContact O-CB 3.38Å; L97-V101 VanDerWaalsContact O-CG2 3.26Å; L97-V101 WeakPolarHBondContact O-CG2 3.26Å; L97-V101 PolarHBondContact O-N 3.14Å; L97-V134 HydrophobicContact CD1-CB 4.43Å; L97-V134 HydrophobicContact CD1-CG2 3.48Å; L97-V134 VanDerWaalsContact CD1-CG2 3.48Å; L97-V134 HydrophobicContact CG-CG2 4.49Å; L97-L137 HydrophobicContact CD1-CD1 4.26Å
98	V	93.1	Very high	88.5	Confident	73 Å²	73	62.2 Å²	62.2	44%	0.442	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-47.9	177.2	170.1	0	0	0	0	110.8	T94 V95 G100 V101 I102	T94-V98 HydrophobicContact CG2-CG2 4.46Å; T94-V98 VanDerWaalsContact O-CG2 3.31Å; T94-V98 WeakPolarHBondContact O-CG2 3.34Å; T94-V98 PolarHBondContact O-N 3.44Å; V95-V98 PolarHBondContact O-N 3.42Å; V98-G100 PolarHBondContact O-N 3Å; V98-V101 PolarHBondContact O-N 3.44Å; V98-I102 HydrophobicContact CG1-CD1 3.77Å; V98-I102 HydrophobicContact CG1-CG1 4.49Å; V98-I102 WeakPolarHBondContact O-CG1 3.45Å; V98-I102 PolarHBondContact O-N 2.8Å
99	F	90.3	Very high	86.8	Confident	134 Å²	134	59.6 Å²	59.6	59%	0.588	34%	0.34	S	S	*	.	H	α-helix	trans	-61.1	-44.2	176.2	-81.7	-62.5	0	0	0	112.1	V95 V101 I102 A103	V95-F99 HydrophobicContact CG1-CD2 3.46Å; V95-F99 VanDerWaalsContact CG1-CD2 3.46Å; V95-F99 HydrophobicContact CG1-CE2 3.38Å; V95-F99 WeakPolarHBondContact O-CD2 3.32Å; V95-F99 PolarHBondContact O-N 3.48Å; F99-V101 VanDerWaalsContact C-N 3.34Å; F99-V101 PolarHBondContact O-N 3.3Å; F99-I102 PolarHBondContact O-N 2.98Å; F99-A103 WeakPolarHBondContact O-CB 3.31Å; F99-A103 PolarHBondContact O-N 3.25Å
100	G	88.5	Confident	85.2	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-41.7	176.3	0	0	0	0	0	112.6	F96 L97 V98 F104 T126	F96-G100 PolarHBondContact O-N 3.47Å; L97-G100 PolarHBondContact O-N 3Å; V98-G100 PolarHBondContact O-N 3Å; G100-F104 VanDerWaalsContact O-CB 3.25Å; G100-F104 WeakPolarHBondContact O-CB 3.4Å; G100-F104 PolarHBondContact O-N 3.02Å; G100-T126 WeakPolarHBondContact O-CG2 3.46Å
101	V	89.7	Confident	83.5	Confident	61 Å²	61	59.5 Å²	59.5	37%	0.37	35%	0.349	S	S	.	.	H	α-helix	trans	-66.1	-45	176.8	170.7	0	0	0	0	111.5	L97 V98 F99 F104 T105 M130	L97-V101 HydrophobicContact CD2-CG2 4.19Å; L97-V101 WeakPolarHBondContact O-CB 3.38Å; L97-V101 VanDerWaalsContact O-CG2 3.26Å; L97-V101 WeakPolarHBondContact O-CG2 3.26Å; L97-V101 PolarHBondContact O-N 3.14Å; V98-V101 PolarHBondContact O-N 3.44Å; F99-V101 VanDerWaalsContact C-N 3.34Å; F99-V101 PolarHBondContact O-N 3.3Å; V101-F104 PolarHBondContact O-N 3.05Å; V101-T105 WeakPolarHBondContact O-CG2 3.45Å; V101-T105 PolarHBondContact O-N 3.05Å; V101-T105 PolarHBondContact O-OG1 2.98Å; V101-M130 HydrophobicContact CG2-CE 3.96Å
102	I	88.6	Confident	81.8	Confident	73 Å²	73	68.2 Å²	68.2	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-60.4	-53.3	178.7	-68.4	167.5	0	0	0	110.2	V98 F99 F104 T105 E106	V98-I102 HydrophobicContact CG1-CD1 3.77Å; V98-I102 HydrophobicContact CG1-CG1 4.49Å; V98-I102 WeakPolarHBondContact O-CG1 3.45Å; V98-I102 PolarHBondContact O-N 2.8Å; F99-I102 PolarHBondContact O-N 2.98Å; I102-F104 PolarHBondContact O-N 3.46Å; I102-T105 PolarHBondContact O-N 3.48Å; I102-T105 VanDerWaalsContact O-N 3.08Å; I102-T105 PolarHBondContact O-OG1 3.49Å; I102-E106 HydrophobicContact CG2-CG 4.46Å; I102-E106 PolarHBondContact O-N 3.43Å
103	A	83.2	Confident	79.8	Confident	24 Å²	24	74.7 Å²	74.7	20%	0.198	40%	0.399	C	S	.	.	H	α-helix	trans	-58.3	-35.3	178.4	0	0	0	0	0	111.9	F99 E106 S107 T126	F99-A103 WeakPolarHBondContact O-CB 3.31Å; F99-A103 PolarHBondContact O-N 3.25Å; A103-E106 PolarHBondContact O-N 2.83Å; A103-S107 VanDerWaalsContact O-CB 3.28Å; A103-S107 WeakPolarHBondContact O-CB 3.49Å; A103-S107 PolarHBondContact O-N 2.87Å; A103-S107 PolarHBondContact O-OG 2.87Å; A103-S107 VanDerWaalsContact O-OG 3.14Å; A103-T126 HydrophobicContact CB-CG2 3.7Å
104	F	82.8	Confident	77.7	Confident	51 Å²	51	77.6 Å²	77.6	22%	0.224	42%	0.419	C	S	.	.	H	α-helix	trans	-69.2	-39.9	178.9	-174.2	-99.2	0	0	0	111.7	G100 V101 I102 I110 W121 T126 V127 M130	G100-F104 VanDerWaalsContact O-CB 3.25Å; G100-F104 WeakPolarHBondContact O-CB 3.4Å; G100-F104 PolarHBondContact O-N 3.02Å; V101-F104 PolarHBondContact O-N 3.05Å; I102-F104 PolarHBondContact O-N 3.46Å; F104-I110 HydrophobicContact CE2-CD1 4.11Å; F104-I110 HydrophobicContact CE2-CG1 4.32Å; F104-W121 HydrophobicContact CE2-CH2 4.42Å; F104-W121 AromaticContact CE2-CZ3 3.83Å; F104-W121 HydrophobicContact CE2-CZ3 3.83Å; F104-W121 HydrophobicContact CZ-CH2 4.05Å; F104-W121 AromaticContact CZ-CZ3 3.82Å; F104-W121 HydrophobicContact CZ-CZ3 3.82Å; F104-T126 HydrophobicContact CB-CG2 3.65Å; F104-T126 HydrophobicContact CD2-CG2 4.42Å; F104-T126 VanDerWaalsContact N-CG2 3.3Å; F104-V127 HydrophobicContact CD2-CG2 4.41Å; F104-V127 HydrophobicContact CE2-CG2 4.24Å; F104-M130 HydrophobicContact CB-SD 3.97Å; F104-M130 HydrophobicContact CD2-SD 4.49Å; F104-M130 HydrophobicContact CG-SD 4.2Å
105	T	83	Confident	75.7	Confident	94 Å²	94	85.8 Å²	85.8	58%	0.577	45%	0.452	S	S	*	.	H	α-helix	trans	-69.3	-37	177.2	55.3	0	0	0	0	112.4	V101 I102 G108	V101-T105 WeakPolarHBondContact O-CG2 3.45Å; V101-T105 PolarHBondContact O-N 3.05Å; V101-T105 PolarHBondContact O-OG1 2.98Å; I102-T105 PolarHBondContact O-N 3.48Å; I102-T105 VanDerWaalsContact O-N 3.08Å; I102-T105 PolarHBondContact O-OG1 3.49Å; T105-G108 PolarHBondContact O-N 2.92Å
106	E	79.7	Confident	73.9	Confident	149 Å²	149	86.5 Å²	86.5	70%	0.696	46%	0.456	S	S	*	.	H	α-helix	trans	-72.7	-35.7	177.9	-71.3	-177.1	169.7	0	0	112.2	I102 A103 G108	I102-E106 HydrophobicContact CG2-CG 4.46Å; I102-E106 PolarHBondContact O-N 3.43Å; A103-E106 PolarHBondContact O-N 2.83Å; E106-G108 PolarHBondContact O-N 2.9Å
107	S	69.9	Low	72.4	Confident	12 Å²	12	82.6 Å²	82.6	8%	0.084	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	3	173.3	-77.4	0	0	0	0	114.3	A103 G109 G203 D206	A103-S107 VanDerWaalsContact O-CB 3.28Å; A103-S107 WeakPolarHBondContact O-CB 3.49Å; A103-S107 PolarHBondContact O-N 2.87Å; A103-S107 PolarHBondContact O-OG 2.87Å; A103-S107 VanDerWaalsContact O-OG 3.14Å; S107-G109 PolarHBondContact O-N 3.33Å; S107-G203 WeakPolarHBondContact O-CA 3.28Å; S107-D206 PolarHBondContact OG-OD2 3.25Å
108	G	64.9	Low	71	Confident	69 Å²	69	83.5 Å²	83.5	71%	0.711	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	6.4	174.2	0	0	0	0	0	115	T105 E106	T105-G108 PolarHBondContact O-N 2.92Å; E106-G108 PolarHBondContact O-N 2.9Å
109	G	61.4	Low	69.5	Low	30 Å²	30	84.3 Å²	84.3	31%	0.309	46%	0.457	S	S	.	.			trans	69.9	149.1	-177.1	0	0	0	0	0	113.7	S107	S107-G109 PolarHBondContact O-N 3.33Å
110	I	61.5	Low	68.3	Low	12 Å²	12	80.5 Å²	80.5	6%	0.062	44%	0.44	C	S	.	.			trans	-78.1	130	-179.4	-64.5	165.1	0	0	0	109.6	F104 W112 V117 W121 N124 V127	F104-I110 HydrophobicContact CE2-CD1 4.11Å; F104-I110 HydrophobicContact CE2-CG1 4.32Å; I110-W112 PolarHBondContact O-N 3.4Å; I110-W112 VanDerWaalsContact O-N 3.13Å; I110-V117 HydrophobicContact CG2-CG1 4.38Å; I110-W121 HydrophobicContact CB-CD2 4.43Å; I110-W121 HydrophobicContact CB-CH2 3.62Å; I110-W121 HydrophobicContact CB-CZ2 3.51Å; I110-W121 HydrophobicContact CB-CZ3 4.14Å; I110-W121 HydrophobicContact CD1-CD2 3.62Å; I110-W121 HydrophobicContact CD1-CE3 3.32Å; I110-W121 HydrophobicContact CD1-CG 4.38Å; I110-W121 HydrophobicContact CD1-CH2 3.93Å; I110-W121 HydrophobicContact CD1-CZ2 4.2Å; I110-W121 HydrophobicContact CD1-CZ3 3.5Å; I110-W121 HydrophobicContact CG1-CE3 4.44Å; I110-W121 HydrophobicContact CG1-CH2 4.22Å; I110-W121 HydrophobicContact CG1-CZ2 4.42Å; I110-W121 HydrophobicContact CG1-CZ3 4.25Å; I110-W121 HydrophobicContact CG2-CD2 4.26Å; I110-W121 HydrophobicContact CG2-CH2 4.24Å; I110-W121 HydrophobicContact CG2-CZ2 3.61Å; I110-N124 HydrophobicContact CD1-CB 4.39Å; I110-V127 HydrophobicContact CD1-CG2 4.15Å
111	P	60.7	Low	67.2	Low	91 Å²	91	83.4 Å²	83.4	59%	0.591	45%	0.451	S	S	*	.			trans	-64.5	115.4	177.1	23.1	-31.1	0	0	0	111.1	K113	P111-K113 PolarHBondContact O-N 3.48Å
112	W	59.6	Low	66.1	Low	221 Å²	221	86 Å²	86	84%	0.837	46%	0.462	S	S	*	.	S	Bend	trans	-64.8	6.7	-173.4	-56.1	77.8	0	0	0	116.1	I110	I110-W112 PolarHBondContact O-N 3.4Å; I110-W112 VanDerWaalsContact O-N 3.13Å
113	K	51.2	Low	65.1	Low	206 Å²	206	85.9 Å²	85.9	90%	0.896	46%	0.459	S	S	*	.			trans	-112.9	24.3	-160.8	-85.9	-163.2	178.1	-176.1	0	117.5	P111	P111-K113 PolarHBondContact O-N 3.48Å
114	S	52	Low	64.7	Low	62 Å²	62	85 Å²	85	43%	0.434	45%	0.451	S	S	.	.			trans	-133.3	153.3	171.8	168.1	0	0	0	0	112.7	T116 V117	S114-T116 PolarHBondContact OG-N 2.96Å; S114-T116 PolarHBondContact OG-OG1 2.89Å; S114-V117 VanDerWaalsContact CB-CG2 3.44Å; S114-V117 WeakPolarHBondContact O-CB 3.29Å; S114-V117 WeakPolarHBondContact O-CG2 3.28Å
115	K	52.2	Low	64.5	Low	214 Å²	214	85.4 Å²	85.4	93%	0.93	46%	0.455	S	S	*	.	S	Bend	trans	-79.9	-20.5	174.8	-78.1	-174.9	175.9	-178	0	113	V117	K115-V117 PolarHBondContact O-N 3.02Å
116	T	54.7	Low	64.4	Low	90 Å²	90	81.2 Å²	81.2	55%	0.552	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-9.3	173.8	53.9	0	0	0	0	112.4	S114 A118 H120	S114-T116 PolarHBondContact OG-N 2.96Å; S114-T116 PolarHBondContact OG-OG1 2.89Å; T116-A118 PolarHBondContact O-N 3.08Å; T116-H120 PolarHBondContact O-CD2 3.33Å
117	V	60	Low	64.6	Low	21 Å²	21	75.3 Å²	75.3	13%	0.127	40%	0.404	C	S	.	.	H	α-helix	trans	-69.9	-28	-166.8	166.3	0	0	0	0	113.2	I110 S114 K115 L119 H120 W121	I110-V117 HydrophobicContact CG2-CG1 4.38Å; S114-V117 VanDerWaalsContact CB-CG2 3.44Å; S114-V117 WeakPolarHBondContact O-CB 3.29Å; S114-V117 WeakPolarHBondContact O-CG2 3.28Å; K115-V117 PolarHBondContact O-N 3.02Å; V117-L119 PolarHBondContact O-N 3.32Å; V117-H120 CarbonylContact O-C 3.33Å; V117-H120 PolarHBondContact O-N 3.09Å; V117-W121 HydrophobicContact CG1-CG 4.25Å; V117-W121 PolarHBondContact O-N 3.23Å
118	A	63.8	Low	65.3	Low	66 Å²	66	78.1 Å²	78.1	55%	0.545	42%	0.417	S	S	.	.	H	α-helix	trans	-61.2	-44.7	-177.9	0	0	0	0	0	113.2	T116 W121 L122	T116-A118 PolarHBondContact O-N 3.08Å; A118-W121 PolarHBondContact O-N 2.9Å; A118-L122 WeakPolarHBondContact O-CG 3.16Å; A118-L122 PolarHBondContact O-N 3.45Å
119	L	62.5	Low	66.4	Low	90 Å²	90	76.3 Å²	76.3	47%	0.471	39%	0.393	S	S	.	.	H	α-helix	trans	-68	-40.4	176.8	-165.8	72.1	0	0	0	110.7	V117 W121 L122 F123	V117-L119 PolarHBondContact O-N 3.32Å; L119-W121 VanDerWaalsContact C-N 3.32Å; L119-W121 PolarHBondContact O-N 2.92Å; L119-L122 PolarHBondContact O-N 3.36Å; L119-F123 HydrophobicContact CD1-CD2 3.78Å; L119-F123 HydrophobicContact CD1-CE2 3.59Å; L119-F123 HydrophobicContact CG-CD2 4.01Å; L119-F123 HydrophobicContact CG-CE2 4.31Å; L119-F123 WeakPolarHBondContact O-CD2 3.42Å; L119-F123 PolarHBondContact O-N 2.78Å
120	H	63.6	Low	67.8	Low	53 Å²	53	77.5 Å²	77.5	25%	0.245	39%	0.391	C	S	.	.	H	α-helix	trans	-62.6	-35.2	175.1	-70.9	-66.6	0	0	0	112.9	T116 V117 N124 Q198	T116-H120 PolarHBondContact O-CD2 3.33Å; V117-H120 CarbonylContact O-C 3.33Å; V117-H120 PolarHBondContact O-N 3.09Å; H120-N124 WeakPolarHBondContact O-CB 3.26Å; H120-N124 PolarHBondContact O-N 2.97Å; H120-N124 VanDerWaalsContact O-N 3.12Å; H120-Q198 PolarHBondContact ND1-NE2 2.99Å
121	W	66.2	Low	69.2	Low	62 Å²	62	80.7 Å²	80.7	24%	0.235	41%	0.411	C	S	.	.	H	α-helix	trans	-66.6	-45.9	172.4	-79.2	108.6	0	0	0	111.4	F104 I110 V117 A118 L119 F123 N124 V127	F104-W121 HydrophobicContact CE2-CH2 4.42Å; F104-W121 AromaticContact CE2-CZ3 3.83Å; F104-W121 HydrophobicContact CE2-CZ3 3.83Å; F104-W121 HydrophobicContact CZ-CH2 4.05Å; F104-W121 AromaticContact CZ-CZ3 3.82Å; F104-W121 HydrophobicContact CZ-CZ3 3.82Å; I110-W121 HydrophobicContact CB-CD2 4.43Å; I110-W121 HydrophobicContact CB-CH2 3.62Å; I110-W121 HydrophobicContact CB-CZ2 3.51Å; I110-W121 HydrophobicContact CB-CZ3 4.14Å; I110-W121 HydrophobicContact CD1-CD2 3.62Å; I110-W121 HydrophobicContact CD1-CE3 3.32Å; I110-W121 HydrophobicContact CD1-CG 4.38Å; I110-W121 HydrophobicContact CD1-CH2 3.93Å; I110-W121 HydrophobicContact CD1-CZ2 4.2Å; I110-W121 HydrophobicContact CD1-CZ3 3.5Å; I110-W121 HydrophobicContact CG1-CE3 4.44Å; I110-W121 HydrophobicContact CG1-CH2 4.22Å; I110-W121 HydrophobicContact CG1-CZ2 4.42Å; I110-W121 HydrophobicContact CG1-CZ3 4.25Å; I110-W121 HydrophobicContact CG2-CD2 4.26Å; I110-W121 HydrophobicContact CG2-CH2 4.24Å; I110-W121 HydrophobicContact CG2-CZ2 3.61Å; V117-W121 HydrophobicContact CG1-CG 4.25Å; V117-W121 PolarHBondContact O-N 3.23Å; A118-W121 PolarHBondContact O-N 2.9Å; L119-W121 VanDerWaalsContact C-N 3.32Å; L119-W121 PolarHBondContact O-N 2.92Å; W121-F123 VanDerWaalsContact C-N 3.28Å; W121-F123 PolarHBondContact O-N 3.26Å; W121-N124 PolarHBondContact O-N 3.22Å; W121-V127 HydrophobicContact CE3-CG2 3.93Å; W121-V127 HydrophobicContact CZ3-CG2 4.4Å; W121-V127 WeakPolarHBondContact O-CB 3.48Å; W121-V127 WeakPolarHBondContact O-CG1 3.34Å
122	L	66	Low	70.7	Confident	116 Å²	116	79.9 Å²	79.9	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-64.6	-34.2	-175.5	-75.8	171.6	0	0	0	112.6	A118 L119 I128	A118-L122 WeakPolarHBondContact O-CG 3.16Å; A118-L122 PolarHBondContact O-N 3.45Å; L119-L122 PolarHBondContact O-N 3.36Å; L122-I128 WeakPolarHBondContact O-CD1 3.29Å; L122-I128 VanDerWaalsContact O-CG1 3.25Å; L122-I128 WeakPolarHBondContact O-CG1 3.36Å
123	F	67.5	Low	72.4	Confident	70 Å²	70	69.3 Å²	69.3	31%	0.307	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	6.2	-177.9	-71	-78.4	0	0	0	114.2	L119 W121 L125 L190 T194	L119-F123 HydrophobicContact CD1-CD2 3.78Å; L119-F123 HydrophobicContact CD1-CE2 3.59Å; L119-F123 HydrophobicContact CG-CD2 4.01Å; L119-F123 HydrophobicContact CG-CE2 4.31Å; L119-F123 WeakPolarHBondContact O-CD2 3.42Å; L119-F123 PolarHBondContact O-N 2.78Å; W121-F123 VanDerWaalsContact C-N 3.28Å; W121-F123 PolarHBondContact O-N 3.26Å; F123-L125 PolarHBondContact O-N 2.73Å; F123-L190 HydrophobicContact CD2-CD2 4.37Å; F123-L190 HydrophobicContact CE1-CD1 4.27Å; F123-L190 HydrophobicContact CE1-CD2 4.16Å; F123-L190 HydrophobicContact CE2-CD2 3.8Å; F123-L190 HydrophobicContact CZ-CD1 4.19Å; F123-L190 HydrophobicContact CZ-CD2 3.68Å; F123-T194 HydrophobicContact CB-CG2 3.76Å; F123-T194 WeakPolarHBondContact O-CG2 3.25Å
124	N	75.4	Confident	74.5	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.027	34%	0.337	C	S	.	.			trans	-68.4	122.5	169.7	-176.8	-80.3	0	0	0	109.2	I110 H120 W121 T126 V127 I128	I110-N124 HydrophobicContact CD1-CB 4.39Å; H120-N124 WeakPolarHBondContact O-CB 3.26Å; H120-N124 PolarHBondContact O-N 2.97Å; H120-N124 VanDerWaalsContact O-N 3.12Å; W121-N124 PolarHBondContact O-N 3.22Å; N124-T126 PolarHBondContact O-N 2.99Å; N124-T126 VanDerWaalsContact OD1-CB 3.3Å; N124-T126 WeakPolarHBondContact OD1-CB 3.27Å; N124-T126 PolarHBondContact OD1-N 3.22Å; N124-T126 VanDerWaalsContact OD1-N 3.1Å; N124-V127 HydrophobicContact CB-CB 4.12Å; N124-V127 HydrophobicContact CB-CG2 3.85Å; N124-V127 PolarHBondContact O-N 3.02Å; N124-V127 VanDerWaalsContact O-N 3.1Å; N124-V127 PolarHBondContact OD1-N 3.06Å; N124-I128 WeakPolarHBondContact O-CG1 3.37Å; N124-I128 PolarHBondContact O-N 3.22Å
125	L	78.2	Confident	76.5	Confident	60 Å²	60	63.2 Å²	63.2	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-52.6	-41.8	-175.5	-180	61.5	0	0	0	112.2	F123 I128 C129 F210	F123-L125 PolarHBondContact O-N 2.73Å; L125-I128 PolarHBondContact O-N 3.21Å; L125-C129 WeakPolarHBondContact O-CB 3.31Å; L125-C129 PolarHBondContact O-N 3.42Å; L125-F210 HydrophobicContact CD2-CB 3.94Å; L125-F210 HydrophobicContact CD2-CD2 3.88Å; L125-F210 HydrophobicContact CD2-CG 3.91Å
126	T	82.3	Confident	78.5	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.037	31%	0.306	C	S	.	.	H	α-helix	trans	-71.2	-39.1	-177.3	-56.2	0	0	0	0	112	G100 A103 F104 N124 C129 M130 D206	G100-T126 WeakPolarHBondContact O-CG2 3.46Å; A103-T126 HydrophobicContact CB-CG2 3.7Å; F104-T126 HydrophobicContact CB-CG2 3.65Å; F104-T126 HydrophobicContact CD2-CG2 4.42Å; F104-T126 VanDerWaalsContact N-CG2 3.3Å; N124-T126 PolarHBondContact O-N 2.99Å; N124-T126 VanDerWaalsContact OD1-CB 3.3Å; N124-T126 WeakPolarHBondContact OD1-CB 3.27Å; N124-T126 PolarHBondContact OD1-N 3.22Å; N124-T126 VanDerWaalsContact OD1-N 3.1Å; T126-C129 WeakPolarHBondContact O-CB 3.31Å; T126-C129 PolarHBondContact O-N 2.95Å; T126-M130 WeakPolarHBondContact O-CG 3.16Å; T126-M130 PolarHBondContact O-N 3.31Å; T126-D206 PolarHBondContact OG1-OD2 2.99Å
127	V	83.7	Confident	80.5	Confident	26 Å²	26	52.7 Å²	52.7	16%	0.158	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-43.7	173.7	178.5	0	0	0	0	110.9	F104 I110 W121 N124 C129 M130 V131	F104-V127 HydrophobicContact CD2-CG2 4.41Å; F104-V127 HydrophobicContact CE2-CG2 4.24Å; I110-V127 HydrophobicContact CD1-CG2 4.15Å; W121-V127 HydrophobicContact CE3-CG2 3.93Å; W121-V127 HydrophobicContact CZ3-CG2 4.4Å; W121-V127 WeakPolarHBondContact O-CB 3.48Å; W121-V127 WeakPolarHBondContact O-CG1 3.34Å; N124-V127 HydrophobicContact CB-CB 4.12Å; N124-V127 HydrophobicContact CB-CG2 3.85Å; N124-V127 PolarHBondContact O-N 3.02Å; N124-V127 VanDerWaalsContact O-N 3.1Å; N124-V127 PolarHBondContact OD1-N 3.06Å; V127-C129 VanDerWaalsContact C-N 3.33Å; V127-C129 PolarHBondContact O-N 3.37Å; V127-M130 PolarHBondContact O-N 3.31Å; V127-V131 HydrophobicContact CG1-CG2 4.39Å; V127-V131 WeakPolarHBondContact O-CG2 3.26Å; V127-V131 PolarHBondContact O-N 3.44Å
128	I	85	Confident	82.2	Confident	70 Å²	70	57.9 Å²	57.9	36%	0.359	31%	0.311	S	S	.	.	H	α-helix	trans	-58.4	-47.5	175.2	-67.1	169.6	0	0	0	110.2	L122 N124 L125 M130 V131 V132	L122-I128 WeakPolarHBondContact O-CD1 3.29Å; L122-I128 VanDerWaalsContact O-CG1 3.25Å; L122-I128 WeakPolarHBondContact O-CG1 3.36Å; N124-I128 WeakPolarHBondContact O-CG1 3.37Å; N124-I128 PolarHBondContact O-N 3.22Å; L125-I128 PolarHBondContact O-N 3.21Å; I128-M130 VanDerWaalsContact C-N 3.32Å; I128-M130 PolarHBondContact O-N 2.85Å; I128-V131 PolarHBondContact O-N 2.86Å; I128-V132 HydrophobicContact CG2-CG2 4.25Å; I128-V132 WeakPolarHBondContact O-CB 3.33Å; I128-V132 WeakPolarHBondContact O-CG2 3.27Å; I128-V132 PolarHBondContact O-N 3.42Å
129	C	87.5	Confident	83.7	Confident	32 Å²	32	55.7 Å²	55.7	22%	0.216	29%	0.29	C	S	.	.	H	α-helix	trans	-56.3	-45	177.4	-175.1	0	0	0	0	111.9	F96 L125 T126 V127 G133	F96-C129 PolarHBondContact O-SG 2.99Å; F96-C129 VanDerWaalsContact O-SG 3.41Å; L125-C129 WeakPolarHBondContact O-CB 3.31Å; L125-C129 PolarHBondContact O-N 3.42Å; T126-C129 WeakPolarHBondContact O-CB 3.31Å; T126-C129 PolarHBondContact O-N 2.95Å; V127-C129 VanDerWaalsContact C-N 3.33Å; V127-C129 PolarHBondContact O-N 3.37Å; C129-G133 PolarHBondContact O-N 3.31Å
130	M	90.2	Very high	85.3	Confident	55 Å²	55	51.5 Å²	51.5	27%	0.271	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-47.7	176.2	-71.4	176.3	64.7	0	0	112.2	V101 F104 T126 V127 I128 V132 G133 V134	V101-M130 HydrophobicContact CG2-CE 3.96Å; F104-M130 HydrophobicContact CB-SD 3.97Å; F104-M130 HydrophobicContact CD2-SD 4.49Å; F104-M130 HydrophobicContact CG-SD 4.2Å; T126-M130 WeakPolarHBondContact O-CG 3.16Å; T126-M130 PolarHBondContact O-N 3.31Å; V127-M130 PolarHBondContact O-N 3.31Å; I128-M130 VanDerWaalsContact C-N 3.32Å; I128-M130 PolarHBondContact O-N 2.85Å; M130-V132 PolarHBondContact O-N 2.81Å; M130-G133 PolarHBondContact O-N 3Å; M130-V134 WeakPolarHBondContact O-CB 2.97Å; M130-V134 VanDerWaalsContact O-CG2 3.25Å; M130-V134 WeakPolarHBondContact O-CG2 3.08Å; M130-V134 PolarHBondContact O-N 2.82Å
131	V	91.4	Very high	86.8	Confident	78 Å²	78	51 Å²	51	47%	0.473	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-46.5	-179.3	171.5	0	0	0	0	110.8	V127 I128 V134 I135	V127-V131 HydrophobicContact CG1-CG2 4.39Å; V127-V131 WeakPolarHBondContact O-CG2 3.26Å; V127-V131 PolarHBondContact O-N 3.44Å; I128-V131 PolarHBondContact O-N 2.86Å; V131-V134 PolarHBondContact O-N 3.27Å; V131-I135 HydrophobicContact CG1-CD1 3.85Å; V131-I135 VanDerWaalsContact O-CG1 3.32Å; V131-I135 WeakPolarHBondContact O-CG1 3.13Å; V131-I135 PolarHBondContact O-N 3.03Å
132	V	92.1	Very high	88.2	Confident	74 Å²	74	48.5 Å²	48.5	45%	0.448	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-47.8	176	173.1	0	0	0	0	110.4	I128 M130 V134 I135 T136	I128-V132 HydrophobicContact CG2-CG2 4.25Å; I128-V132 WeakPolarHBondContact O-CB 3.33Å; I128-V132 WeakPolarHBondContact O-CG2 3.27Å; I128-V132 PolarHBondContact O-N 3.42Å; M130-V132 PolarHBondContact O-N 2.81Å; V132-V134 VanDerWaalsContact C-N 3.34Å; V132-V134 PolarHBondContact O-N 3.23Å; V132-I135 PolarHBondContact O-N 3.25Å; V132-T136 WeakPolarHBondContact O-CB 3.32Å; V132-T136 PolarHBondContact O-N 3.12Å; V132-T136 PolarHBondContact O-OG1 3.49Å; V132-T136 VanDerWaalsContact O-OG1 3.08Å
133	G	94.8	Very high	89.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.1	-43.7	177.6	0	0	0	0	0	113	C129 M130 L137	C129-G133 PolarHBondContact O-N 3.31Å; M130-G133 PolarHBondContact O-N 3Å; G133-L137 VanDerWaalsContact O-CB 3.24Å; G133-L137 WeakPolarHBondContact O-CB 3.29Å; G133-L137 PolarHBondContact O-N 3.02Å
134	V	95.3	Very high	91	Very high	54 Å²	54	40.8 Å²	40.8	33%	0.327	22%	0.222	S	C	.	.	H	α-helix	trans	-62.6	-48.7	176.3	170.6	0	0	0	0	111.3	L97 M130 V131 V132 L137 F138	L97-V134 HydrophobicContact CD1-CB 4.43Å; L97-V134 HydrophobicContact CD1-CG2 3.48Å; L97-V134 VanDerWaalsContact CD1-CG2 3.48Å; L97-V134 HydrophobicContact CG-CG2 4.49Å; M130-V134 WeakPolarHBondContact O-CB 2.97Å; M130-V134 VanDerWaalsContact O-CG2 3.25Å; M130-V134 WeakPolarHBondContact O-CG2 3.08Å; M130-V134 PolarHBondContact O-N 2.82Å; V131-V134 PolarHBondContact O-N 3.27Å; V132-V134 VanDerWaalsContact C-N 3.34Å; V132-V134 PolarHBondContact O-N 3.23Å; V134-L137 PolarHBondContact O-N 2.86Å; V134-F138 HydrophobicContact CG1-CD2 3.55Å; V134-F138 HydrophobicContact CG1-CE2 3.48Å; V134-F138 VanDerWaalsContact CG1-CE2 3.48Å; V134-F138 WeakPolarHBondContact O-CD2 3.29Å; V134-F138 PolarHBondContact O-N 3.03Å
135	I	94.6	Very high	91.8	Very high	86 Å²	86	41.4 Å²	41.4	44%	0.441	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-48.6	179.8	-68.2	168.3	0	0	0	110.2	V131 V132 L137 F138 V139	V131-I135 HydrophobicContact CG1-CD1 3.85Å; V131-I135 VanDerWaalsContact O-CG1 3.32Å; V131-I135 WeakPolarHBondContact O-CG1 3.13Å; V131-I135 PolarHBondContact O-N 3.03Å; V132-I135 PolarHBondContact O-N 3.25Å; I135-L137 VanDerWaalsContact C-N 3.31Å; I135-L137 PolarHBondContact O-N 3.42Å; I135-F138 PolarHBondContact O-N 3.03Å; I135-V139 HydrophobicContact CG2-CG2 4.31Å; I135-V139 WeakPolarHBondContact O-CB 3.29Å; I135-V139 WeakPolarHBondContact O-CG2 3.33Å; I135-V139 PolarHBondContact O-N 3.42Å
136	T	94.7	Very high	92.5	Very high	43 Å²	43	38.5 Å²	38.5	26%	0.264	21%	0.21	S	C	.	.	H	α-helix	trans	-59.5	-42	177.7	-60.3	0	0	0	0	111.2	V132 S140	V132-T136 WeakPolarHBondContact O-CB 3.32Å; V132-T136 PolarHBondContact O-N 3.12Å; V132-T136 PolarHBondContact O-OG1 3.49Å; V132-T136 VanDerWaalsContact O-OG1 3.08Å; T136-S140 WeakPolarHBondContact O-CB 3.25Å; T136-S140 PolarHBondContact O-N 3.27Å; T136-S140 PolarHBondContact O-OG 3.37Å
137	L	95.5	Very high	93	Very high	39 Å²	39	38.2 Å²	38.2	20%	0.204	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-50.7	176.4	-171.6	159.7	0	0	0	111.2	L90 L97 G133 V134 I135 V139 S140 L141	L90-L137 HydrophobicContact CD1-CD2 4.4Å; L90-L137 HydrophobicContact CD1-CG 3.95Å; L97-L137 HydrophobicContact CD1-CD1 4.26Å; G133-L137 VanDerWaalsContact O-CB 3.24Å; G133-L137 WeakPolarHBondContact O-CB 3.29Å; G133-L137 PolarHBondContact O-N 3.02Å; V134-L137 PolarHBondContact O-N 2.86Å; I135-L137 VanDerWaalsContact C-N 3.31Å; I135-L137 PolarHBondContact O-N 3.42Å; L137-V139 PolarHBondContact O-N 2.86Å; L137-S140 PolarHBondContact O-OG 3.5Å; L137-S140 VanDerWaalsContact O-OG 3.07Å; L137-L141 HydrophobicContact CD2-CD2 4.48Å; L137-L141 WeakPolarHBondContact O-CB 3.08Å; L137-L141 PolarHBondContact O-N 3.43Å
138	F	95	Very high	93.4	Very high	131 Å²	131	41.1 Å²	41.1	58%	0.575	22%	0.223	S	C	*	.	H	α-helix	trans	-62.9	-44.6	-179.5	-83	-66.3	0	0	0	113	V134 I135 A142	V134-F138 HydrophobicContact CG1-CD2 3.55Å; V134-F138 HydrophobicContact CG1-CE2 3.48Å; V134-F138 VanDerWaalsContact CG1-CE2 3.48Å; V134-F138 WeakPolarHBondContact O-CD2 3.29Å; V134-F138 PolarHBondContact O-N 3.03Å; I135-F138 PolarHBondContact O-N 3.03Å; F138-A142 WeakPolarHBondContact O-CB 3.5Å; F138-A142 PolarHBondContact O-N 2.95Å
139	V	96.1	Very high	93.6	Very high	19 Å²	19	44 Å²	44	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-46.8	-179.9	174.8	0	0	0	0	110.8	I135 L137 L141 A142 G143 Y158 I161 L162	I135-V139 HydrophobicContact CG2-CG2 4.31Å; I135-V139 WeakPolarHBondContact O-CB 3.29Å; I135-V139 WeakPolarHBondContact O-CG2 3.33Å; I135-V139 PolarHBondContact O-N 3.42Å; L137-V139 PolarHBondContact O-N 2.86Å; V139-L141 PolarHBondContact O-N 3.27Å; V139-A142 PolarHBondContact O-N 3.42Å; V139-G143 PolarHBondContact O-N 2.69Å; V139-Y158 HydrophobicContact CG1-CD2 3.91Å; V139-Y158 HydrophobicContact CG1-CE2 3.92Å; V139-Y158 VanDerWaalsContact O-CD2 3.29Å; V139-Y158 WeakPolarHBondContact O-CD2 3.48Å; V139-I161 HydrophobicContact CG2-CG2 3.74Å; V139-L162 HydrophobicContact CG1-CD2 4.13Å
140	S	96.2	Very high	93.7	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-36.4	178.3	60.7	0	0	0	0	112.6	L90 T136 L137 G143 F144	L90-S140 VanDerWaalsContact CA-OG 3.27Å; L90-S140 WeakPolarHBondContact CA-OG 3.42Å; L90-S140 PolarHBondContact N-OG 3.48Å; T136-S140 WeakPolarHBondContact O-CB 3.25Å; T136-S140 PolarHBondContact O-N 3.27Å; T136-S140 PolarHBondContact O-OG 3.37Å; L137-S140 PolarHBondContact O-OG 3.5Å; L137-S140 VanDerWaalsContact O-OG 3.07Å; S140-G143 PolarHBondContact O-N 3.27Å; S140-F144 VanDerWaalsContact O-CB 3.29Å; S140-F144 WeakPolarHBondContact O-CB 3.5Å; S140-F144 PolarHBondContact O-N 3.39Å
141	L	95.6	Very high	93.8	Very high	42 Å²	42	44.7 Å²	44.7	22%	0.22	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-44	174.1	-168.4	65.5	0	0	0	111.2	F26 L90 L137 V139 G143 F144 V145	F26-L141 HydrophobicContact CE2-CD1 3.82Å; F26-L141 HydrophobicContact CZ-CD1 3.56Å; F26-L141 HydrophobicContact CZ-CD2 4.23Å; F26-L141 HydrophobicContact CZ-CG 4.04Å; L90-L141 HydrophobicContact CD1-CB 4.14Å; L90-L141 HydrophobicContact CD1-CD1 4.14Å; L90-L141 HydrophobicContact CD2-CD1 4.15Å; L137-L141 HydrophobicContact CD2-CD2 4.48Å; L137-L141 WeakPolarHBondContact O-CB 3.08Å; L137-L141 PolarHBondContact O-N 3.43Å; V139-L141 PolarHBondContact O-N 3.27Å; L141-G143 VanDerWaalsContact C-N 3.35Å; L141-G143 PolarHBondContact O-N 2.88Å; L141-F144 PolarHBondContact O-N 3.28Å; L141-V145 HydrophobicContact CD1-CG2 4.13Å; L141-V145 HydrophobicContact CG-CG2 4.26Å; L141-V145 WeakPolarHBondContact O-CB 3.38Å; L141-V145 VanDerWaalsContact O-CG2 3.26Å; L141-V145 WeakPolarHBondContact O-CG2 3.31Å; L141-V145 PolarHBondContact O-N 3.32Å
142	A	95.1	Very high	93.7	Very high	10 Å²	10	42 Å²	42	8%	0.083	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-41.8	175.4	0	0	0	0	0	111.8	F138 V139 G146 L154 F157	F138-A142 WeakPolarHBondContact O-CB 3.5Å; F138-A142 PolarHBondContact O-N 2.95Å; V139-A142 PolarHBondContact O-N 3.42Å; A142-G146 VanDerWaalsContact O-CA 3.31Å; A142-G146 WeakPolarHBondContact O-CA 3.49Å; A142-G146 PolarHBondContact O-N 3.08Å; A142-L154 HydrophobicContact CB-CD2 4.47Å; A142-F157 HydrophobicContact CB-CD1 3.94Å; A142-F157 HydrophobicContact CB-CE1 4.31Å
143	G	95.8	Very high	93.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-43.4	175.6	0	0	0	0	0	113.4	V139 S140 L141 S147	V139-G143 PolarHBondContact O-N 2.69Å; S140-G143 PolarHBondContact O-N 3.27Å; L141-G143 VanDerWaalsContact C-N 3.35Å; L141-G143 PolarHBondContact O-N 2.88Å; G143-S147 WeakPolarHBondContact O-CB 3.42Å; G143-S147 PolarHBondContact O-N 3.5Å; G143-S147 PolarHBondContact O-OG 2.93Å
144	F	95.5	Very high	93.7	Very high	24 Å²	24	42.7 Å²	42.7	11%	0.105	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-53.4	177.9	-179.5	-104.9	0	0	0	111.6	C83 N86 F87 S140 L141 S147 L148	C83-F144 WeakPolarHBondContact SG-CE2 3.43Å; N86-F144 HydrophobicContact CB-CB 4.02Å; F87-F144 HydrophobicContact CB-CD2 4.01Å; F87-F144 HydrophobicContact CB-CE2 4.02Å; F87-F144 HydrophobicContact CD2-CD2 4.45Å; F87-F144 AromaticContact CD2-CE2 3.92Å; F87-F144 HydrophobicContact CD2-CE2 3.92Å; F87-F144 HydrophobicContact CD2-CZ 4.2Å; F87-F144 HydrophobicContact CG-CE2 4.41Å; S140-F144 VanDerWaalsContact O-CB 3.29Å; S140-F144 WeakPolarHBondContact O-CB 3.5Å; S140-F144 PolarHBondContact O-N 3.39Å; L141-F144 PolarHBondContact O-N 3.28Å; F144-S147 PolarHBondContact O-N 2.91Å; F144-S147 PolarHBondContact O-OG 3.43Å; F144-L148 HydrophobicContact CE1-CD2 4.08Å; F144-L148 HydrophobicContact CZ-CD2 4.15Å; F144-L148 WeakPolarHBondContact O-CB 3.45Å; F144-L148 PolarHBondContact O-N 2.92Å
145	V	93.2	Very high	93.7	Very high	17 Å²	17	40.1 Å²	40.1	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-39.8	179.4	179.4	0	0	0	0	111	F26 L141 S147 L148 R149 L154	F26-V145 HydrophobicContact CD1-CG2 4.3Å; F26-V145 HydrophobicContact CE1-CG1 4.33Å; F26-V145 HydrophobicContact CE1-CG2 3.49Å; F26-V145 VanDerWaalsContact CE1-CG2 3.49Å; F26-V145 HydrophobicContact CE2-CG2 3.97Å; F26-V145 HydrophobicContact CZ-CG2 3.31Å; L141-V145 HydrophobicContact CD1-CG2 4.13Å; L141-V145 HydrophobicContact CG-CG2 4.26Å; L141-V145 WeakPolarHBondContact O-CB 3.38Å; L141-V145 VanDerWaalsContact O-CG2 3.26Å; L141-V145 WeakPolarHBondContact O-CG2 3.31Å; L141-V145 PolarHBondContact O-N 3.32Å; V145-S147 PolarHBondContact O-N 3.27Å; V145-L148 PolarHBondContact O-N 3.5Å; V145-R149 HydrophobicContact CG1-CG 4.03Å; V145-R149 VanDerWaalsContact O-CB 3.28Å; V145-R149 WeakPolarHBondContact O-CB 3.36Å; V145-R149 PolarHBondContact O-N 2.9Å; V145-L154 HydrophobicContact CB-CD1 4Å; V145-L154 HydrophobicContact CG1-CD1 3.56Å
146	G	93.3	Very high	93.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.1	-44.6	177.1	0	0	0	0	0	112.5	A142 E150 N151	A142-G146 VanDerWaalsContact O-CA 3.31Å; A142-G146 WeakPolarHBondContact O-CA 3.49Å; A142-G146 PolarHBondContact O-N 3.08Å; G146-E150 CarbonylContact O-C 3.57Å; G146-E150 WeakPolarHBondContact O-CA 3.24Å; G146-E150 PolarHBondContact O-N 3.48Å; G146-E150 VanDerWaalsContact O-N 3.14Å; G146-N151 PolarHBondContact O-N 2.9Å
147	S	92.8	Very high	93.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-73.6	-41.2	176.8	60.2	0	0	0	0	113.3	K79 G143 F144 V145	K79-S147 WeakPolarHBondContact CE-O 3.43Å; G143-S147 WeakPolarHBondContact O-CB 3.42Å; G143-S147 PolarHBondContact O-N 3.5Å; G143-S147 PolarHBondContact O-OG 2.93Å; F144-S147 PolarHBondContact O-N 2.91Å; F144-S147 PolarHBondContact O-OG 3.43Å; V145-S147 PolarHBondContact O-N 3.27Å
148	L	90.7	Very high	93.7	Very high	87 Å²	87	41.7 Å²	41.7	46%	0.455	20%	0.197	S	C	.	.	H	α-helix	trans	-70.2	-42.7	-177.6	-174.5	67.3	0	0	0	112.7	F144 V145	F144-L148 HydrophobicContact CE1-CD2 4.08Å; F144-L148 HydrophobicContact CZ-CD2 4.15Å; F144-L148 WeakPolarHBondContact O-CB 3.45Å; F144-L148 PolarHBondContact O-N 2.92Å; V145-L148 PolarHBondContact O-N 3.5Å
149	R	90.3	Very high	93.8	Very high	130 Å²	130	37.9 Å²	37.9	49%	0.491	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	1.4	-179.1	-63	-65.8	-168.9	169.1	2.3	113.6	V145 N151	V145-R149 HydrophobicContact CG1-CG 4.03Å; V145-R149 VanDerWaalsContact O-CB 3.28Å; V145-R149 WeakPolarHBondContact O-CB 3.36Å; V145-R149 PolarHBondContact O-N 2.9Å; R149-N151 HydrophobicContact CB-CB 4.44Å; R149-N151 PolarHBondContact O-N 3.4Å
150	E	90.5	Very high	93.8	Very high	68 Å²	68	42.4 Å²	42.4	32%	0.318	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	37.1	-175.4	-63.8	173.6	-170.2	0	0	112.1	I74 K79 G146 T152 I330	I74-E150 HydrophobicContact CD1-CG 4.41Å; K79-E150 IonicContact NZ-OE1 2.68Å; K79-E150 PolarHBondContact NZ-OE1 3.24Å; G146-E150 CarbonylContact O-C 3.57Å; G146-E150 WeakPolarHBondContact O-CA 3.24Å; G146-E150 PolarHBondContact O-N 3.48Å; G146-E150 VanDerWaalsContact O-N 3.14Å; E150-T152 PolarHBondContact O-N 3.33Å; E150-I330 HydrophobicContact CB-CD1 3.84Å; E150-I330 HydrophobicContact CB-CG1 4.25Å; E150-I330 HydrophobicContact CG-CD1 4.13Å; E150-I330 HydrophobicContact CG-CG1 4.45Å
151	N	90.4	Very high	93.8	Very high	34 Å²	34	44.1 Å²	44.1	18%	0.182	21%	0.206	C	C	.	.			trans	-85.3	104.5	-177.3	-176.1	-29.7	0	0	0	109.6	G146 R149 C153 L154 L155	G146-N151 PolarHBondContact O-N 2.9Å; R149-N151 HydrophobicContact CB-CB 4.44Å; R149-N151 PolarHBondContact O-N 3.4Å; N151-C153 PolarHBondContact O-N 2.98Å; N151-C153 VanDerWaalsContact OD1-CB 3.31Å; N151-C153 WeakPolarHBondContact OD1-CB 3.36Å; N151-C153 PolarHBondContact OD1-N 2.71Å; N151-L154 HydrophobicContact CB-CB 4.26Å; N151-L154 HydrophobicContact CB-CD1 4.12Å; N151-L154 HydrophobicContact CB-CG 4.36Å; N151-L154 PolarHBondContact O-N 3.33Å; N151-L154 PolarHBondContact OD1-N 2.81Å; N151-L155 PolarHBondContact O-N 3.1Å
152	T	90.9	Very high	93.8	Very high	21 Å²	21	43 Å²	43	13%	0.129	20%	0.201	C	C	.	.	H	α-helix	trans	-58.6	-34.5	-178.1	54.7	0	0	0	0	112.9	E150 L155 R156 H327 I330 N331 L334	E150-T152 PolarHBondContact O-N 3.33Å; T152-L155 PolarHBondContact O-N 3.07Å; T152-R156 VanDerWaalsContact O-CB 3.29Å; T152-R156 WeakPolarHBondContact O-CB 3.17Å; T152-R156 PolarHBondContact O-N 3.01Å; T152-H327 PolarHBondContact O-CD2 2.77Å; T152-I330 HydrophobicContact CG2-CB 4.12Å; T152-I330 HydrophobicContact CG2-CG2 3.44Å; T152-I330 VanDerWaalsContact CG2-CG2 3.44Å; T152-N331 WeakPolarHBondContact CG2-OD1 3.32Å; T152-L334 HydrophobicContact CG2-CD1 4.11Å
153	C	92.9	Very high	93.9	Very high	40 Å²	40	44.9 Å²	44.9	27%	0.27	21%	0.211	S	C	.	.	H	α-helix	trans	-67.1	-45.3	179.7	-166.5	0	0	0	0	112	L34 C37 N151 R156 F157	L34-C153 HydrophobicContact CD2-CB 4.38Å; C37-C153 HydrophobicContact CB-CB 3.72Å; C37-C153 WeakPolarHBondContact CB-SG 3.11Å; C37-C153 WeakPolarHBondContact SG-CA 3.31Å; C37-C153 WeakPolarHBondContact SG-CB 3.46Å; C37-C153 CovalentContact SG-SG 2.03Å; C37-C153 PolarHBondContact SG-SG 2.94Å; N151-C153 PolarHBondContact O-N 2.98Å; N151-C153 VanDerWaalsContact OD1-CB 3.31Å; N151-C153 WeakPolarHBondContact OD1-CB 3.36Å; N151-C153 PolarHBondContact OD1-N 2.71Å; C153-R156 PolarHBondContact O-N 3.48Å; C153-F157 PolarHBondContact O-N 2.96Å
154	L	93.8	Very high	94	Very high	49 Å²	49	48.5 Å²	48.5	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-39.4	176.9	-72	176	0	0	0	111.9	A142 V145 N151 F157 Y158	A142-L154 HydrophobicContact CB-CD2 4.47Å; V145-L154 HydrophobicContact CB-CD1 4Å; V145-L154 HydrophobicContact CG1-CD1 3.56Å; N151-L154 HydrophobicContact CB-CB 4.26Å; N151-L154 HydrophobicContact CB-CD1 4.12Å; N151-L154 HydrophobicContact CB-CG 4.36Å; N151-L154 PolarHBondContact O-N 3.33Å; N151-L154 PolarHBondContact OD1-N 2.81Å; L154-F157 PolarHBondContact O-N 3.44Å; L154-Y158 VanDerWaalsContact O-CB 3.29Å; L154-Y158 WeakPolarHBondContact O-CB 3.46Å; L154-Y158 PolarHBondContact O-N 2.64Å
155	L	94.3	Very high	94	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-41.9	173.7	-74.8	169.8	0	0	0	111.8	L82 N151 T152 Y158 Y159 L326 H327 I330	L82-L155 HydrophobicContact CD2-CD2 3.93Å; N151-L155 PolarHBondContact O-N 3.1Å; T152-L155 PolarHBondContact O-N 3.07Å; L155-Y158 PolarHBondContact O-N 2.91Å; L155-Y159 WeakPolarHBondContact O-CD1 3.32Å; L155-Y159 PolarHBondContact O-N 3.3Å; L155-L326 HydrophobicContact CD1-CD2 4.03Å; L155-L326 HydrophobicContact CD1-CG 4.02Å; L155-L326 HydrophobicContact CD2-CD2 4.1Å; L155-H327 HydrophobicContact CB-CB 4.34Å; L155-I330 HydrophobicContact CD1-CD1 3.47Å; L155-I330 VanDerWaalsContact CD1-CD1 3.47Å
156	R	94.6	Very high	94.1	Very high	90 Å²	90	53 Å²	53	34%	0.34	25%	0.251	S	S	.	.	H	α-helix	trans	-59.1	-48.2	174.9	-175.7	174.4	-176.9	-179.1	4.9	111.6	E41 T152 C153 Y159 F160	E41-R156 IonicContact OE1-NH2 3.96Å; E41-R156 IonicContact OE2-CZ 3.68Å; E41-R156 IonicContact OE2-NH1 2.98Å; E41-R156 PolarHBondContact OE2-NH1 2.85Å; E41-R156 IonicContact OE2-NH2 2.67Å; E41-R156 PolarHBondContact OE2-NH2 3.48Å; T152-R156 VanDerWaalsContact O-CB 3.29Å; T152-R156 WeakPolarHBondContact O-CB 3.17Å; T152-R156 PolarHBondContact O-N 3.01Å; C153-R156 PolarHBondContact O-N 3.48Å; R156-Y159 VanDerWaalsContact CA-CE1 3.42Å; R156-Y159 HydrophobicContact CB-CE1 4.15Å; R156-Y159 HydrophobicContact CG-CE1 4.28Å; R156-F160 WeakPolarHBondContact O-CB 3.45Å; R156-F160 PolarHBondContact O-N 2.97Å; R156-F160 VanDerWaalsContact O-N 3.08Å
157	F	95	Very high	94.2	Very high	103 Å²	103	57.5 Å²	57.5	45%	0.452	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-47	174.6	177.2	-101.1	0	0	0	111.7	A142 C153 L154 F160 I161	A142-F157 HydrophobicContact CB-CD1 3.94Å; A142-F157 HydrophobicContact CB-CE1 4.31Å; C153-F157 PolarHBondContact O-N 2.96Å; L154-F157 PolarHBondContact O-N 3.44Å; F157-F160 PolarHBondContact O-N 2.03Å; F157-I161 HydrophobicContact CD1-CG1 4.39Å; F157-I161 HydrophobicContact CD2-CG1 4.13Å; F157-I161 HydrophobicContact CE1-CG1 4Å; F157-I161 HydrophobicContact CE2-CD1 3.94Å; F157-I161 HydrophobicContact CE2-CG1 3.72Å; F157-I161 HydrophobicContact CG-CG1 4.46Å; F157-I161 HydrophobicContact CZ-CD1 4.1Å; F157-I161 HydrophobicContact CZ-CG1 3.65Å; F157-I161 WeakPolarHBondContact O-CG1 3.29Å; F157-I161 PolarHBondContact O-N 3.23Å
158	Y	96.2	Very high	94.4	Very high	7 Å²	7	61.4 Å²	61.4	3%	0.027	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-56.8	-178.6	173.6	-103.3	0	0	0	112.7	L82 N86 V139 L154 L155 F160 I161 L162 A323	L82-Y158 HydrophobicContact CD1-CE1 3.91Å; N86-Y158 PolarHBondContact ND2-OH 3.28Å; N86-Y158 VanDerWaalsContact ND2-OH 3.12Å; N86-Y158 WeakPolarHBondContact OD1-CE2 3.07Å; N86-Y158 PolarHBondContact OD1-OH 2.95Å; V139-Y158 HydrophobicContact CG1-CD2 3.91Å; V139-Y158 HydrophobicContact CG1-CE2 3.92Å; V139-Y158 VanDerWaalsContact O-CD2 3.29Å; V139-Y158 WeakPolarHBondContact O-CD2 3.48Å; L154-Y158 VanDerWaalsContact O-CB 3.29Å; L154-Y158 WeakPolarHBondContact O-CB 3.46Å; L154-Y158 PolarHBondContact O-N 2.64Å; L155-Y158 PolarHBondContact O-N 2.91Å; Y158-F160 VanDerWaalsContact C-N 3.28Å; Y158-F160 PolarHBondContact O-N 3.34Å; Y158-I161 PolarHBondContact O-N 2.89Å; Y158-L162 HydrophobicContact CD1-CD1 4.19Å; Y158-L162 HydrophobicContact CE1-CD1 3.51Å; Y158-L162 HydrophobicContact CE1-CG 4.4Å; Y158-L162 HydrophobicContact CE2-CD1 3.98Å; Y158-L162 HydrophobicContact CE2-CG 4.27Å; Y158-L162 VanDerWaalsContact CZ-CD1 3.42Å; Y158-L162 WeakPolarHBondContact O-CG 3.12Å; Y158-L162 PolarHBondContact O-N 3.02Å; Y158-A323 HydrophobicContact CD1-CB 3.68Å; Y158-A323 HydrophobicContact CE1-CB 3.78Å
159	Y	96	Very high	94.5	Very high	51 Å²	51	59.8 Å²	59.8	20%	0.2	29%	0.289	C	S	.	.	H	α-helix	trans	-69.9	-28.3	-178.3	78.8	-109.2	0	0	0	112	L155 R156 T163 H327	L155-Y159 WeakPolarHBondContact O-CD1 3.32Å; L155-Y159 PolarHBondContact O-N 3.3Å; R156-Y159 VanDerWaalsContact CA-CE1 3.42Å; R156-Y159 HydrophobicContact CB-CE1 4.15Å; R156-Y159 HydrophobicContact CG-CE1 4.28Å; Y159-T163 WeakPolarHBondContact O-CB 3.36Å; Y159-T163 PolarHBondContact O-N 3.38Å; Y159-T163 PolarHBondContact O-OG1 3.34Å; Y159-H327 HydrophobicContact CE1-CB 4.34Å
160	F	96.6	Very high	94.7	Very high	115 Å²	115	56.8 Å²	56.8	50%	0.504	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-49.2	174.2	175.6	-102.1	0	0	0	111.2	R156 F157 Y158 L162 T163 L164	R156-F160 WeakPolarHBondContact O-CB 3.45Å; R156-F160 PolarHBondContact O-N 2.97Å; R156-F160 VanDerWaalsContact O-N 3.08Å; F157-F160 PolarHBondContact O-N 2.03Å; Y158-F160 VanDerWaalsContact C-N 3.28Å; Y158-F160 PolarHBondContact O-N 3.34Å; F160-L162 PolarHBondContact O-N 3.36Å; F160-T163 WeakPolarHBondContact O-CB 3.45Å; F160-T163 PolarHBondContact O-N 3.08Å; F160-T163 VanDerWaalsContact O-N 3.16Å; F160-L164 HydrophobicContact CD1-CD1 4.1Å; F160-L164 HydrophobicContact CE1-CD1 3.48Å; F160-L164 VanDerWaalsContact CE1-CD1 3.48Å; F160-L164 HydrophobicContact CE1-CG 4.21Å; F160-L164 HydrophobicContact CZ-CD1 3.73Å; F160-L164 HydrophobicContact CZ-CD2 4.39Å; F160-L164 HydrophobicContact CZ-CG 4.18Å; F160-L164 PolarHBondContact O-N 3.16Å
161	I	96.4	Very high	94.9	Very high	39 Å²	39	57.6 Å²	57.6	20%	0.2	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-43.7	176.2	-65.6	-62.4	0	0	0	111.1	V139 F157 Y158 T163 L164 L165	V139-I161 HydrophobicContact CG2-CG2 3.74Å; F157-I161 HydrophobicContact CD1-CG1 4.39Å; F157-I161 HydrophobicContact CD2-CG1 4.13Å; F157-I161 HydrophobicContact CE1-CG1 4Å; F157-I161 HydrophobicContact CE2-CD1 3.94Å; F157-I161 HydrophobicContact CE2-CG1 3.72Å; F157-I161 HydrophobicContact CG-CG1 4.46Å; F157-I161 HydrophobicContact CZ-CD1 4.1Å; F157-I161 HydrophobicContact CZ-CG1 3.65Å; F157-I161 WeakPolarHBondContact O-CG1 3.29Å; F157-I161 PolarHBondContact O-N 3.23Å; Y158-I161 PolarHBondContact O-N 2.89Å; I161-T163 VanDerWaalsContact C-N 3.26Å; I161-T163 PolarHBondContact O-N 2.69Å; I161-L164 HydrophobicContact CD1-CD1 4.47Å; I161-L164 PolarHBondContact O-N 3.49Å; I161-L165 HydrophobicContact CG2-CD1 4.17Å; I161-L165 HydrophobicContact CG2-CG 4.42Å; I161-L165 WeakPolarHBondContact O-CG 3.46Å; I161-L165 PolarHBondContact O-N 2.83Å
162	L	96.4	Very high	95	Very high	19 Å²	19	59.4 Å²	59.4	10%	0.099	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-35.7	174.9	-70.6	-171.2	0	0	0	112.8	V139 Y158 F160 L165 F166 Q316 A319 I320	V139-L162 HydrophobicContact CG1-CD2 4.13Å; Y158-L162 HydrophobicContact CD1-CD1 4.19Å; Y158-L162 HydrophobicContact CE1-CD1 3.51Å; Y158-L162 HydrophobicContact CE1-CG 4.4Å; Y158-L162 HydrophobicContact CE2-CD1 3.98Å; Y158-L162 HydrophobicContact CE2-CG 4.27Å; Y158-L162 VanDerWaalsContact CZ-CD1 3.42Å; Y158-L162 WeakPolarHBondContact O-CG 3.12Å; Y158-L162 PolarHBondContact O-N 3.02Å; F160-L162 PolarHBondContact O-N 3.36Å; L162-L165 HydrophobicContact CD2-CD1 4.35Å; L162-L165 PolarHBondContact O-N 3.49Å; L162-F166 WeakPolarHBondContact O-CB 3.44Å; L162-F166 PolarHBondContact O-N 2.96Å; L162-Q316 PolarHBondContact O-NE2 3.13Å; L162-A319 HydrophobicContact CD1-CB 4.02Å; L162-I320 HydrophobicContact CB-CD1 4.13Å; L162-I320 HydrophobicContact CB-CG1 3.64Å; L162-I320 HydrophobicContact CD1-CG1 4.22Å
163	T	96.6	Very high	95	Very high	48 Å²	48	61.5 Å²	61.5	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-67.5	-42.5	176.4	-57.9	0	0	0	0	110.7	Y159 F160 I161 F166 L167	Y159-T163 WeakPolarHBondContact O-CB 3.36Å; Y159-T163 PolarHBondContact O-N 3.38Å; Y159-T163 PolarHBondContact O-OG1 3.34Å; F160-T163 WeakPolarHBondContact O-CB 3.45Å; F160-T163 PolarHBondContact O-N 3.08Å; F160-T163 VanDerWaalsContact O-N 3.16Å; I161-T163 VanDerWaalsContact C-N 3.26Å; I161-T163 PolarHBondContact O-N 2.69Å; T163-F166 PolarHBondContact O-N 3.07Å; T163-L167 HydrophobicContact CG2-CD1 4.38Å; T163-L167 WeakPolarHBondContact O-CG 3.35Å; T163-L167 PolarHBondContact O-N 3.34Å
164	L	96.8	Very high	95	Very high	76 Å²	76	63.5 Å²	63.5	40%	0.398	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-45.8	174.4	-69.2	-179	0	0	0	111.6	F160 I161 F166 L167 T168	F160-L164 HydrophobicContact CD1-CD1 4.1Å; F160-L164 HydrophobicContact CE1-CD1 3.48Å; F160-L164 VanDerWaalsContact CE1-CD1 3.48Å; F160-L164 HydrophobicContact CE1-CG 4.21Å; F160-L164 HydrophobicContact CZ-CD1 3.73Å; F160-L164 HydrophobicContact CZ-CD2 4.39Å; F160-L164 HydrophobicContact CZ-CG 4.18Å; F160-L164 PolarHBondContact O-N 3.16Å; I161-L164 HydrophobicContact CD1-CD1 4.47Å; I161-L164 PolarHBondContact O-N 3.49Å; L164-F166 VanDerWaalsContact C-N 3.29Å; L164-F166 PolarHBondContact O-N 3.41Å; L164-L167 PolarHBondContact O-N 2.83Å; L164-T168 PolarHBondContact O-N 3.03Å; L164-T168 PolarHBondContact O-OG1 2.87Å; L164-T168 VanDerWaalsContact O-OG1 3.04Å
165	L	95.5	Very high	95	Very high	80 Å²	80	65.2 Å²	65.2	42%	0.419	34%	0.343	S	S	.	.	H	α-helix	trans	-59	-40.9	176.6	-70.8	174	0	0	0	111.9	I161 L162 T168 E169	I161-L165 HydrophobicContact CG2-CD1 4.17Å; I161-L165 HydrophobicContact CG2-CG 4.42Å; I161-L165 WeakPolarHBondContact O-CG 3.46Å; I161-L165 PolarHBondContact O-N 2.83Å; L162-L165 HydrophobicContact CD2-CD1 4.35Å; L162-L165 PolarHBondContact O-N 3.49Å; L165-T168 PolarHBondContact O-N 3.25Å; L165-E169 WeakPolarHBondContact O-CB 3.19Å; L165-E169 PolarHBondContact O-N 3.46Å
166	F	96.1	Very high	94.7	Very high	55 Å²	55	70.3 Å²	70.3	24%	0.241	37%	0.366	C	S	.	.	H	α-helix	trans	-65.3	-44.3	178.7	179.6	-99.5	0	0	0	111.3	L162 T163 L164 T168 E169 V170 A313 Q316 I320	L162-F166 WeakPolarHBondContact O-CB 3.44Å; L162-F166 PolarHBondContact O-N 2.96Å; T163-F166 PolarHBondContact O-N 3.07Å; L164-F166 VanDerWaalsContact C-N 3.29Å; L164-F166 PolarHBondContact O-N 3.41Å; F166-T168 VanDerWaalsContact C-N 3.35Å; F166-E169 PolarHBondContact O-N 3.05Å; F166-V170 HydrophobicContact CD1-CG2 4.48Å; F166-V170 HydrophobicContact CE1-CG2 4.11Å; F166-V170 HydrophobicContact CZ-CG2 4.15Å; F166-V170 WeakPolarHBondContact O-CG2 3.31Å; F166-V170 PolarHBondContact O-N 3.38Å; F166-A313 HydrophobicContact CE2-CB 4.16Å; F166-Q316 HydrophobicContact CB-CG 4.4Å; F166-Q316 HydrophobicContact CD2-CG 4.45Å; F166-I320 HydrophobicContact CB-CD1 4.29Å
167	L	96.4	Very high	94.4	Very high	95 Å²	95	73.4 Å²	73.4	50%	0.497	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-41.3	175.8	-67.1	175.1	0	0	0	111.5	T163 L164 V170 V171	T163-L167 HydrophobicContact CG2-CD1 4.38Å; T163-L167 WeakPolarHBondContact O-CG 3.35Å; T163-L167 PolarHBondContact O-N 3.34Å; L164-L167 PolarHBondContact O-N 2.83Å; L167-V170 PolarHBondContact O-N 3Å; L167-V171 WeakPolarHBondContact O-CB 3.45Å; L167-V171 VanDerWaalsContact O-CG2 3.27Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å; L167-V171 PolarHBondContact O-N 3Å
168	T	95.4	Very high	94.4	Very high	82 Å²	82	73.1 Å²	73.1	50%	0.503	39%	0.388	S	S	.	.	H	α-helix	trans	-61.9	-43.8	174.7	-59.9	0	0	0	0	111.4	L164 L165 F166 V170 V171 C172	L164-T168 PolarHBondContact O-N 3.03Å; L164-T168 PolarHBondContact O-OG1 2.87Å; L164-T168 VanDerWaalsContact O-OG1 3.04Å; L165-T168 PolarHBondContact O-N 3.25Å; F166-T168 VanDerWaalsContact C-N 3.35Å; T168-V170 PolarHBondContact O-N 3.27Å; T168-V171 PolarHBondContact O-N 2.96Å; T168-C172 VanDerWaalsContact O-CB 3.29Å; T168-C172 WeakPolarHBondContact O-CB 3.29Å; T168-C172 PolarHBondContact O-N 2.83Å; T168-C172 PolarHBondContact O-SG 3.41Å
169	E	93.6	Very high	94.3	Very high	54 Å²	54	79.4 Å²	79.4	25%	0.252	41%	0.413	S	S	.	.	H	α-helix	trans	-59.3	-47.9	176.7	-175.6	-178.2	-179.8	0	0	111.8	L165 F166 V171 C172 C173 Q316	L165-E169 WeakPolarHBondContact O-CB 3.19Å; L165-E169 PolarHBondContact O-N 3.46Å; F166-E169 PolarHBondContact O-N 3.05Å; E169-V171 PolarHBondContact O-N 3.38Å; E169-C172 PolarHBondContact O-N 3.49Å; E169-C173 WeakPolarHBondContact O-CB 3.24Å; E169-C173 PolarHBondContact O-N 3.01Å; E169-Q316 PolarHBondContact OE2-OE1 3.48Å
170	V	93.4	Very high	94.1	Very high	67 Å²	67	80.8 Å²	80.8	41%	0.406	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-45.9	177.9	173.4	0	0	0	0	111	F166 L167 T168 C173 V174	F166-V170 HydrophobicContact CD1-CG2 4.48Å; F166-V170 HydrophobicContact CE1-CG2 4.11Å; F166-V170 HydrophobicContact CZ-CG2 4.15Å; F166-V170 WeakPolarHBondContact O-CG2 3.31Å; F166-V170 PolarHBondContact O-N 3.38Å; L167-V170 PolarHBondContact O-N 3Å; T168-V170 PolarHBondContact O-N 3.27Å; V170-C173 PolarHBondContact O-N 3.42Å; V170-V174 VanDerWaalsContact O-CG2 3.31Å; V170-V174 WeakPolarHBondContact O-CG2 3.18Å; V170-V174 PolarHBondContact O-N 3.05Å
171	V	95.3	Very high	93.9	Very high	84 Å²	84	80.5 Å²	80.5	51%	0.509	42%	0.418	S	S	.	.	H	α-helix	trans	-62.8	-46.1	177.7	171.1	0	0	0	0	110.9	L167 T168 E169 C173 V174 L175	L167-V171 WeakPolarHBondContact O-CB 3.45Å; L167-V171 VanDerWaalsContact O-CG2 3.27Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å; L167-V171 PolarHBondContact O-N 3Å; T168-V171 PolarHBondContact O-N 2.96Å; E169-V171 PolarHBondContact O-N 3.38Å; V171-C173 VanDerWaalsContact C-N 3.35Å; V171-C173 PolarHBondContact O-N 2.94Å; V171-V174 PolarHBondContact O-N 3.4Å; V171-L175 HydrophobicContact CG1-CD1 3.81Å; V171-L175 HydrophobicContact CG1-CG 4.24Å; V171-L175 WeakPolarHBondContact O-CB 3.22Å; V171-L175 VanDerWaalsContact O-CG 3.25Å; V171-L175 WeakPolarHBondContact O-CG 3.32Å; V171-L175 PolarHBondContact O-N 2.95Å
172	C	92.2	Very high	93.8	Very high	72 Å²	72	81.2 Å²	81.2	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-60	-43.3	176.6	-74.9	0	0	0	0	111.9	T168 E169 L175 F176	T168-C172 VanDerWaalsContact O-CB 3.29Å; T168-C172 WeakPolarHBondContact O-CB 3.29Å; T168-C172 PolarHBondContact O-N 2.83Å; T168-C172 PolarHBondContact O-SG 3.41Å; E169-C172 PolarHBondContact O-N 3.49Å; C172-L175 PolarHBondContact O-N 2.93Å; C172-F176 WeakPolarHBondContact O-CB 3.21Å; C172-F176 PolarHBondContact O-N 2.88Å
173	C	90.9	Very high	93.5	Very high	65 Å²	65	82.4 Å²	82.4	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-62.3	-45.2	177.2	-174.7	0	0	0	0	111.8	E169 V170 V171 F176 F177	E169-C173 WeakPolarHBondContact O-CB 3.24Å; E169-C173 PolarHBondContact O-N 3.01Å; V170-C173 PolarHBondContact O-N 3.42Å; V171-C173 VanDerWaalsContact C-N 3.35Å; V171-C173 PolarHBondContact O-N 2.94Å; C173-F176 PolarHBondContact O-N 3.29Å; C173-F177 PolarHBondContact O-N 2.92Å; C173-F177 VanDerWaalsContact O-N 3.1Å
174	V	93.2	Very high	93.3	Very high	82 Å²	82	80.7 Å²	80.7	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-64	-45.6	177.2	172.2	0	0	0	0	110.8	V170 V171 F176 F177 V178	V170-V174 VanDerWaalsContact O-CG2 3.31Å; V170-V174 WeakPolarHBondContact O-CG2 3.18Å; V170-V174 PolarHBondContact O-N 3.05Å; V171-V174 PolarHBondContact O-N 3.4Å; V174-F176 PolarHBondContact O-N 3.38Å; V174-F177 PolarHBondContact O-N 3.34Å; V174-V178 HydrophobicContact CG1-CG2 4.14Å; V174-V178 WeakPolarHBondContact O-CB 3.45Å; V174-V178 VanDerWaalsContact O-CG2 3.3Å; V174-V178 WeakPolarHBondContact O-CG2 3.34Å; V174-V178 PolarHBondContact O-N 3.5Å
175	L	93.3	Very high	93.2	Very high	85 Å²	85	81.8 Å²	81.8	45%	0.445	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-41.2	178.6	-70.6	176.1	0	0	0	112.1	V171 C172 F177 V178 Y179	V171-L175 HydrophobicContact CG1-CD1 3.81Å; V171-L175 HydrophobicContact CG1-CG 4.24Å; V171-L175 WeakPolarHBondContact O-CB 3.22Å; V171-L175 VanDerWaalsContact O-CG 3.25Å; V171-L175 WeakPolarHBondContact O-CG 3.32Å; V171-L175 PolarHBondContact O-N 2.95Å; C172-L175 PolarHBondContact O-N 2.93Å; L175-F177 VanDerWaalsContact C-N 3.33Å; L175-F177 PolarHBondContact O-N 2.96Å; L175-V178 PolarHBondContact O-N 3.29Å; L175-Y179 HydrophobicContact CD2-CD2 3.99Å; L175-Y179 HydrophobicContact CD2-CE2 3.78Å; L175-Y179 WeakPolarHBondContact O-CB 3.49Å; L175-Y179 PolarHBondContact O-N 2.91Å
176	F	89.7	Confident	93	Very high	108 Å²	108	85.5 Å²	85.5	47%	0.474	44%	0.435	S	S	.	.	H	α-helix	trans	-60	-42.9	175.5	-177.1	-90.1	0	0	0	111.5	C172 C173 V174 R180 T183	C172-F176 WeakPolarHBondContact O-CB 3.21Å; C172-F176 PolarHBondContact O-N 2.88Å; C173-F176 PolarHBondContact O-N 3.29Å; V174-F176 PolarHBondContact O-N 3.38Å; F176-R180 WeakPolarHBondContact O-CA 3.49Å; F176-R180 PolarHBondContact O-N 3.39Å; F176-R180 VanDerWaalsContact O-N 3.13Å; F176-T183 HydrophobicContact CD2-CG2 3.61Å; F176-T183 HydrophobicContact CE2-CG2 3.83Å
177	F	88.6	Confident	92.7	Very high	154 Å²	154	85.9 Å²	85.9	68%	0.675	44%	0.439	S	S	*	.	H	α-helix	trans	-69.2	-46.7	177.9	-107.8	-82.2	0	0	0	113	C173 V174 L175	C173-F177 PolarHBondContact O-N 2.92Å; C173-F177 VanDerWaalsContact O-N 3.1Å; V174-F177 PolarHBondContact O-N 3.34Å; L175-F177 VanDerWaalsContact C-N 3.33Å; L175-F177 PolarHBondContact O-N 2.96Å
178	V	94.6	Very high	92.6	Very high	97 Å²	97	82.3 Å²	82.3	59%	0.588	42%	0.42	S	S	*	.	H	α-helix	trans	-67.9	-40.1	-177.6	172.2	0	0	0	0	111.4	V174 L175	V174-V178 HydrophobicContact CG1-CG2 4.14Å; V174-V178 WeakPolarHBondContact O-CB 3.45Å; V174-V178 VanDerWaalsContact O-CG2 3.3Å; V174-V178 WeakPolarHBondContact O-CG2 3.34Å; V174-V178 PolarHBondContact O-N 3.5Å; L175-V178 PolarHBondContact O-N 3.29Å
179	Y	94.3	Very high	92.4	Very high	140 Å²	140	84.3 Å²	84.3	55%	0.549	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	37.3	-176.6	-59.3	-72.4	0	0	0	112.1	L175 E181 S182 T183	L175-Y179 HydrophobicContact CD2-CD2 3.99Å; L175-Y179 HydrophobicContact CD2-CE2 3.78Å; L175-Y179 WeakPolarHBondContact O-CB 3.49Å; L175-Y179 PolarHBondContact O-N 2.91Å; Y179-E181 PolarHBondContact O-N 2.9Å; Y179-S182 PolarHBondContact O-N 3.29Å; Y179-T183 WeakPolarHBondContact O-CB 3.47Å; Y179-T183 PolarHBondContact O-N 3.24Å; Y179-T183 PolarHBondContact O-OG1 3.37Å
180	R	91.7	Very high	92.2	Very high	79 Å²	79	84.4 Å²	84.4	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-48.5	-56.8	-176.5	-178.8	-174	177.7	-81	3.9	112.5	F176 S182 T183 I184 E299	F176-R180 WeakPolarHBondContact O-CA 3.49Å; F176-R180 PolarHBondContact O-N 3.39Å; F176-R180 VanDerWaalsContact O-N 3.13Å; R180-S182 PolarHBondContact O-N 3.31Å; R180-T183 PolarHBondContact O-N 3Å; R180-T183 VanDerWaalsContact O-N 3.12Å; R180-I184 HydrophobicContact CG-CD1 3.87Å; R180-I184 WeakPolarHBondContact O-CG1 3.34Å; R180-I184 PolarHBondContact O-N 3.38Å; R180-E299 IonicContact CZ-OE1 3.75Å; R180-E299 IonicContact NE-OE1 3.89Å; R180-E299 IonicContact NH2-OE1 2.83Å; R180-E299 PolarHBondContact NH2-OE1 2.88Å
181	E	92.3	Very high	92	Very high	109 Å²	109	82.7 Å²	82.7	51%	0.509	41%	0.414	S	S	.	.	H	α-helix	trans	-60	-44	-178	-60.3	-51.4	128.1	0	0	112.5	Y179 T183 I184 H185	Y179-E181 PolarHBondContact O-N 2.9Å; E181-T183 VanDerWaalsContact C-N 3.31Å; E181-T183 PolarHBondContact O-N 2.94Å; E181-I184 PolarHBondContact O-N 2.87Å; E181-H185 PolarHBondContact O-CD2 2.88Å; E181-H185 VanDerWaalsContact O-CD2 3.23Å; E181-H185 PolarHBondContact O-N 3.42Å; E181-H185 VanDerWaalsContact O-N 3.08Å
182	S	94.4	Very high	91.8	Very high	55 Å²	55	82.1 Å²	82.1	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-66.8	-36.1	177.8	-174.2	0	0	0	0	111.8	Y179 R180 R186	Y179-S182 PolarHBondContact O-N 3.29Å; R180-S182 PolarHBondContact O-N 3.31Å; S182-R186 WeakPolarHBondContact O-CB 3.39Å; S182-R186 VanDerWaalsContact O-CG 3.3Å; S182-R186 WeakPolarHBondContact O-CG 3.39Å; S182-R186 PolarHBondContact O-N 3.26Å
183	T	89.8	Confident	91.5	Very high	43 Å²	43	81.1 Å²	81.1	26%	0.264	40%	0.396	S	S	.	.	H	α-helix	trans	-69.4	-40.8	178.9	-55.2	0	0	0	0	111.1	F176 Y179 R180 E181 R186 L187	F176-T183 HydrophobicContact CD2-CG2 3.61Å; F176-T183 HydrophobicContact CE2-CG2 3.83Å; Y179-T183 WeakPolarHBondContact O-CB 3.47Å; Y179-T183 PolarHBondContact O-N 3.24Å; Y179-T183 PolarHBondContact O-OG1 3.37Å; R180-T183 PolarHBondContact O-N 3Å; R180-T183 VanDerWaalsContact O-N 3.12Å; E181-T183 VanDerWaalsContact C-N 3.31Å; E181-T183 PolarHBondContact O-N 2.94Å; T183-R186 PolarHBondContact O-N 3.27Å; T183-L187 VanDerWaalsContact O-CB 3.31Å; T183-L187 WeakPolarHBondContact O-CB 3.33Å; T183-L187 PolarHBondContact O-N 3.2Å
184	I	92.9	Very high	91	Very high	13 Å²	13	78.2 Å²	78.2	7%	0.067	38%	0.376	C	S	.	.	H	α-helix	trans	-58.3	-51.3	173.3	-72.5	171.1	0	0	0	110.1	R180 E181 R186 L187 E188 V291 V295	R180-I184 HydrophobicContact CG-CD1 3.87Å; R180-I184 WeakPolarHBondContact O-CG1 3.34Å; R180-I184 PolarHBondContact O-N 3.38Å; E181-I184 PolarHBondContact O-N 2.87Å; I184-R186 PolarHBondContact O-N 3.08Å; I184-L187 WeakPolarHBondContact O-CB 3.38Å; I184-L187 PolarHBondContact O-N 2.87Å; I184-L187 VanDerWaalsContact O-N 3.11Å; I184-E188 WeakPolarHBondContact O-CG 3.31Å; I184-E188 PolarHBondContact O-N 2.88Å; I184-V291 HydrophobicContact CG2-CG1 3.81Å; I184-V295 HydrophobicContact CD1-CG2 4.12Å; I184-V295 HydrophobicContact CG1-CG2 4.37Å
185	H	94.2	Very high	90.7	Very high	98 Å²	98	75.7 Å²	75.7	45%	0.454	36%	0.359	S	S	.	.	H	α-helix	trans	-62.1	-39.4	178.4	-72.8	-43.7	0	0	0	113.7	E181 L187 E188 E189	E181-H185 PolarHBondContact O-CD2 2.88Å; E181-H185 VanDerWaalsContact O-CD2 3.23Å; E181-H185 PolarHBondContact O-N 3.42Å; E181-H185 VanDerWaalsContact O-N 3.08Å; H185-L187 VanDerWaalsContact C-N 3.32Å; H185-E188 IonicContact CE1-OE2 3.88Å; H185-E188 IonicContact CG-OE2 3.98Å; H185-E188 IonicContact ND1-OE2 2.97Å; H185-E188 PolarHBondContact ND1-OE2 3.01Å; H185-E188 PolarHBondContact O-N 3.26Å; H185-E189 PolarHBondContact O-N 3.37Å
186	R	91.5	Very high	90.6	Very high	158 Å²	158	71.7 Å²	71.7	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-65.2	-38.5	174.4	-74.5	179.4	-174.9	-79.8	1.5	111.6	S182 T183 I184 E189 L190	S182-R186 WeakPolarHBondContact O-CB 3.39Å; S182-R186 VanDerWaalsContact O-CG 3.3Å; S182-R186 WeakPolarHBondContact O-CG 3.39Å; S182-R186 PolarHBondContact O-N 3.26Å; T183-R186 PolarHBondContact O-N 3.27Å; I184-R186 PolarHBondContact O-N 3.08Å; R186-E189 PolarHBondContact O-N 2.93Å; R186-L190 WeakPolarHBondContact O-CB 3.14Å; R186-L190 WeakPolarHBondContact O-CG 3.33Å; R186-L190 PolarHBondContact O-N 3.48Å
187	L	90.1	Very high	90.4	Very high	64 Å²	64	69 Å²	69	34%	0.335	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-43.7	176.2	-177.8	62.2	0	0	0	111.1	T183 I184 H185 E189 L190 I191 V291	T183-L187 VanDerWaalsContact O-CB 3.31Å; T183-L187 WeakPolarHBondContact O-CB 3.33Å; T183-L187 PolarHBondContact O-N 3.2Å; I184-L187 WeakPolarHBondContact O-CB 3.38Å; I184-L187 PolarHBondContact O-N 2.87Å; I184-L187 VanDerWaalsContact O-N 3.11Å; H185-L187 VanDerWaalsContact C-N 3.32Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 3.32Å; L187-L190 PolarHBondContact O-N 3.34Å; L187-I191 HydrophobicContact CD1-CD1 3.94Å; L187-I191 HydrophobicContact CD1-CG1 4.11Å; L187-I191 HydrophobicContact CG-CD1 3.88Å; L187-I191 HydrophobicContact CG-CG1 4.42Å; L187-I191 WeakPolarHBondContact O-CB 3.38Å; L187-I191 VanDerWaalsContact O-CG1 3.26Å; L187-I191 WeakPolarHBondContact O-CG1 3.26Å; L187-I191 PolarHBondContact O-N 3.04Å; L187-V291 HydrophobicContact CD2-CG1 4.15Å; L187-V291 HydrophobicContact CD2-CG2 4.28Å; L187-V291 HydrophobicContact CG-CG2 4.15Å
188	E	93.8	Very high	90.2	Very high	20 Å²	20	62 Å²	62	9%	0.093	30%	0.3	C	S	.	.	H	α-helix	trans	-55.3	-47.2	173.1	-68.5	174.4	150.1	0	0	111.4	I184 H185 I191 K192 P223 K224 V291	I184-E188 WeakPolarHBondContact O-CG 3.31Å; I184-E188 PolarHBondContact O-N 2.88Å; H185-E188 IonicContact CE1-OE2 3.88Å; H185-E188 IonicContact CG-OE2 3.98Å; H185-E188 IonicContact ND1-OE2 2.97Å; H185-E188 PolarHBondContact ND1-OE2 3.01Å; H185-E188 PolarHBondContact O-N 3.26Å; E188-I191 PolarHBondContact O-N 3.09Å; E188-K192 VanDerWaalsContact O-CB 3.29Å; E188-K192 WeakPolarHBondContact O-CB 3.5Å; E188-K192 PolarHBondContact O-N 2.97Å; E188-P223 HydrophobicContact CB-CB 4.5Å; E188-P223 WeakPolarHBondContact O-CB 3.33Å; E188-K224 HydrophobicContact CG-CB 4.22Å; E188-K224 WeakPolarHBondContact OE1-CB 3.27Å; E188-K224 WeakPolarHBondContact OE1-CD 3.28Å; E188-K224 VanDerWaalsContact OE1-CG 3.3Å; E188-K224 WeakPolarHBondContact OE1-CG 3.47Å; E188-V291 HydrophobicContact CG-CB 4.04Å; E188-V291 HydrophobicContact CG-CG1 4.2Å; E188-V291 HydrophobicContact CG-CG2 3.85Å
189	E	91.7	Very high	89.9	Confident	124 Å²	124	57.6 Å²	57.6	58%	0.579	27%	0.273	S	S	*	.	H	α-helix	trans	-66.1	-43.2	179	-173.6	177.8	-163.2	0	0	112.5	H185 R186 L187 K192 T193	H185-E189 PolarHBondContact O-N 3.37Å; R186-E189 PolarHBondContact O-N 2.93Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 3.32Å; E189-K192 PolarHBondContact O-N 3.36Å; E189-T193 HydrophobicContact CG-CG2 4.45Å; E189-T193 WeakPolarHBondContact O-CB 3.36Å; E189-T193 WeakPolarHBondContact O-CG2 3.49Å; E189-T193 PolarHBondContact O-N 3.03Å; E189-T193 PolarHBondContact O-OG1 3.33Å
190	L	87.8	Confident	89.6	Confident	56 Å²	56	56.2 Å²	56.2	29%	0.293	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-44.6	176.5	-75.5	171.7	0	0	0	111.3	F123 R186 L187 K192 T193 T194	F123-L190 HydrophobicContact CD2-CD2 4.37Å; F123-L190 HydrophobicContact CE1-CD1 4.27Å; F123-L190 HydrophobicContact CE1-CD2 4.16Å; F123-L190 HydrophobicContact CE2-CD2 3.8Å; F123-L190 HydrophobicContact CZ-CD1 4.19Å; F123-L190 HydrophobicContact CZ-CD2 3.68Å; R186-L190 WeakPolarHBondContact O-CB 3.14Å; R186-L190 WeakPolarHBondContact O-CG 3.33Å; R186-L190 PolarHBondContact O-N 3.48Å; L187-L190 PolarHBondContact O-N 3.34Å; L190-K192 VanDerWaalsContact C-N 3.34Å; L190-T193 PolarHBondContact O-N 3.3Å; L190-T193 PolarHBondContact O-OG1 3.04Å; L190-T194 VanDerWaalsContact O-CB 3.23Å; L190-T194 WeakPolarHBondContact O-CB 3.03Å; L190-T194 PolarHBondContact O-N 3.47Å; L190-T194 PolarHBondContact O-OG1 2.86Å
191	I	89.2	Confident	89.2	Confident	31 Å²	31	55.1 Å²	55.1	16%	0.159	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-41.1	178.1	-64.1	170.1	0	0	0	110	L187 E188 T193 T194 F195 V196 M211 P223 V291	L187-I191 HydrophobicContact CD1-CD1 3.94Å; L187-I191 HydrophobicContact CD1-CG1 4.11Å; L187-I191 HydrophobicContact CG-CD1 3.88Å; L187-I191 HydrophobicContact CG-CG1 4.42Å; L187-I191 WeakPolarHBondContact O-CB 3.38Å; L187-I191 VanDerWaalsContact O-CG1 3.26Å; L187-I191 WeakPolarHBondContact O-CG1 3.26Å; L187-I191 PolarHBondContact O-N 3.04Å; E188-I191 PolarHBondContact O-N 3.09Å; I191-T193 PolarHBondContact O-N 3.44Å; I191-T194 PolarHBondContact O-N 2.85Å; I191-F195 HydrophobicContact CB-CD2 4.28Å; I191-F195 HydrophobicContact CG1-CD2 4.41Å; I191-F195 HydrophobicContact CG2-CB 4.2Å; I191-F195 HydrophobicContact CG2-CD2 3.89Å; I191-F195 HydrophobicContact CG2-CG 4.42Å; I191-F195 WeakPolarHBondContact O-CA 3.36Å; I191-F195 WeakPolarHBondContact O-CB 3.25Å; I191-F195 PolarHBondContact O-N 3.34Å; I191-V196 PolarHBondContact O-N 3.27Å; I191-M211 HydrophobicContact CG2-SD 4.47Å; I191-P223 HydrophobicContact CB-CB 4.09Å; I191-P223 HydrophobicContact CB-CG 4.17Å; I191-P223 HydrophobicContact CG2-CB 4.04Å; I191-P223 HydrophobicContact CG2-CG 3.81Å; I191-V291 HydrophobicContact CD1-CG2 3.71Å
192	K	91.2	Very high	88.5	Confident	72 Å²	72	57.6 Å²	57.6	31%	0.313	28%	0.281	S	S	.	.	I	π-helix	trans	-59.8	-48.3	176.6	-169.5	169.4	-173.9	154.8	0	112.1	E188 E189 L190 T194 V196 T197 P223 D228 A231	E188-K192 VanDerWaalsContact O-CB 3.29Å; E188-K192 WeakPolarHBondContact O-CB 3.5Å; E188-K192 PolarHBondContact O-N 2.97Å; E189-K192 PolarHBondContact O-N 3.36Å; L190-K192 VanDerWaalsContact C-N 3.34Å; K192-T194 VanDerWaalsContact C-N 3.35Å; K192-V196 WeakPolarHBondContact O-CB 3.45Å; K192-V196 PolarHBondContact O-N 2.95Å; K192-T197 PolarHBondContact O-N 3.33Å; K192-P223 HydrophobicContact CB-CG 3.92Å; K192-D228 IonicContact NZ-OD1 2.82Å; K192-D228 PolarHBondContact NZ-OD1 3.05Å; K192-A231 HydrophobicContact CG-CB 4.42Å
193	T	85.6	Confident	87.5	Confident	50 Å²	50	55.8 Å²	55.8	31%	0.307	27%	0.27	S	S	.	.	I	π-helix	trans	-76.5	-19.4	-176.1	53.1	0	0	0	0	114.3	E189 L190 I191 T197	E189-T193 HydrophobicContact CG-CG2 4.45Å; E189-T193 WeakPolarHBondContact O-CB 3.36Å; E189-T193 WeakPolarHBondContact O-CG2 3.49Å; E189-T193 PolarHBondContact O-N 3.03Å; E189-T193 PolarHBondContact O-OG1 3.33Å; L190-T193 PolarHBondContact O-N 3.3Å; L190-T193 PolarHBondContact O-OG1 3.04Å; I191-T193 PolarHBondContact O-N 3.44Å; T193-T197 PolarHBondContact O-OG1 3.27Å
194	T	81.5	Confident	86.9	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.025	26%	0.263	C	S	.	.	I	π-helix	trans	-101.8	-52.6	179.5	-50.1	0	0	0	0	111.8	F123 L190 I191 K192 Q198	F123-T194 HydrophobicContact CB-CG2 3.76Å; F123-T194 WeakPolarHBondContact O-CG2 3.25Å; L190-T194 VanDerWaalsContact O-CB 3.23Å; L190-T194 WeakPolarHBondContact O-CB 3.03Å; L190-T194 PolarHBondContact O-N 3.47Å; L190-T194 PolarHBondContact O-OG1 2.86Å; I191-T194 PolarHBondContact O-N 2.85Å; K192-T194 VanDerWaalsContact C-N 3.35Å; T194-Q198 VanDerWaalsContact O-CB 3.24Å; T194-Q198 WeakPolarHBondContact O-CB 3.47Å; T194-Q198 WeakPolarHBondContact O-CG 3.49Å; T194-Q198 PolarHBondContact O-OE1 2.97Å
195	F	86.8	Confident	86.4	Confident	30 Å²	30	60.1 Å²	60.1	13%	0.132	29%	0.287	C	S	.	.	I	π-helix	trans	-92.4	-36.3	-171	-64.9	-83.2	0	0	0	113.6	I191 Y199 T207 F210 M211	I191-F195 HydrophobicContact CB-CD2 4.28Å; I191-F195 HydrophobicContact CG1-CD2 4.41Å; I191-F195 HydrophobicContact CG2-CB 4.2Å; I191-F195 HydrophobicContact CG2-CD2 3.89Å; I191-F195 HydrophobicContact CG2-CG 4.42Å; I191-F195 WeakPolarHBondContact O-CA 3.36Å; I191-F195 WeakPolarHBondContact O-CB 3.25Å; I191-F195 PolarHBondContact O-N 3.34Å; F195-Y199 WeakPolarHBondContact O-CB 3.32Å; F195-Y199 PolarHBondContact O-N 3.26Å; F195-T207 HydrophobicContact CB-CG2 4.28Å; F195-T207 HydrophobicContact CD1-CG2 3.33Å; F195-T207 HydrophobicContact CE1-CG2 3.85Å; F195-T207 HydrophobicContact CG-CG2 4.05Å; F195-F210 AromaticContact CD1-CD1 3.91Å; F195-F210 HydrophobicContact CD1-CD1 3.91Å; F195-F210 AromaticContact CE1-CD1 3.26Å; F195-F210 HydrophobicContact CE1-CD1 3.26Å; F195-F210 AromaticContact CE1-CE1 3.79Å; F195-F210 HydrophobicContact CE1-CE1 3.79Å; F195-F210 HydrophobicContact CE1-CG 4.23Å; F195-F210 AromaticContact CZ-CD1 3.77Å; F195-F210 HydrophobicContact CZ-CD1 3.77Å; F195-F210 AromaticContact CZ-CE1 3.79Å; F195-F210 HydrophobicContact CZ-CE1 3.79Å; F195-M211 HydrophobicContact CB-CB 4.41Å; F195-M211 HydrophobicContact CB-CG 4.36Å; F195-M211 HydrophobicContact CB-SD 3.8Å; F195-M211 HydrophobicContact CD1-CB 4.48Å; F195-M211 HydrophobicContact CG-SD 4.35Å
196	V	90.5	Very high	85.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-81.7	-46.3	-176	178.3	0	0	0	0	111.9	I191 K192 Q198 Y199 P223 W229 A231 S232	I191-V196 PolarHBondContact O-N 3.27Å; K192-V196 WeakPolarHBondContact O-CB 3.45Å; K192-V196 PolarHBondContact O-N 2.95Å; V196-Q198 VanDerWaalsContact C-N 3.34Å; V196-Q198 PolarHBondContact O-N 2.93Å; V196-Y199 WeakPolarHBondContact O-CB 3.32Å; V196-Y199 PolarHBondContact O-N 3.29Å; V196-P223 HydrophobicContact CG2-CG 3.79Å; V196-W229 HydrophobicContact CG1-CD2 4.34Å; V196-W229 HydrophobicContact CG1-CE3 3.79Å; V196-W229 HydrophobicContact CG1-CZ3 4.04Å; V196-A231 HydrophobicContact CG1-CB 4.27Å; V196-S232 WeakPolarHBondContact O-CB 3.42Å; V196-S232 PolarHBondContact O-OG 2.97Å
197	T	86.7	Confident	85.2	Confident	51 Å²	51	50 Å²	50	31%	0.313	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-32.1	-179.4	52.7	0	0	0	0	112.7	K192 T193	K192-T197 PolarHBondContact O-N 3.33Å; T193-T197 PolarHBondContact O-OG1 3.27Å
198	Q	83.2	Confident	85.2	Confident	9 Å²	9	47.5 Å²	47.5	4%	0.042	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1.7	-179.7	-48.7	-172	-79.6	0	0	113.1	H120 T194 V196 R200 E201 F204	H120-Q198 PolarHBondContact ND1-NE2 2.99Å; T194-Q198 VanDerWaalsContact O-CB 3.24Å; T194-Q198 WeakPolarHBondContact O-CB 3.47Å; T194-Q198 WeakPolarHBondContact O-CG 3.49Å; T194-Q198 PolarHBondContact O-OE1 2.97Å; V196-Q198 VanDerWaalsContact C-N 3.34Å; V196-Q198 PolarHBondContact O-N 2.93Å; Q198-R200 PolarHBondContact O-N 3.44Å; Q198-E201 WeakPolarHBondContact O-CB 3.34Å; Q198-E201 PolarHBondContact O-N 2.98Å; Q198-E201 VanDerWaalsContact O-N 3.11Å; Q198-F204 HydrophobicContact CB-CB 4.19Å; Q198-F204 HydrophobicContact CB-CD1 4.34Å; Q198-F204 HydrophobicContact CB-CD2 4.38Å; Q198-F204 HydrophobicContact CB-CG 4.04Å
199	Y	88.8	Confident	84.9	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.016	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	125.5	-178.8	-168.8	-95.6	0	0	0	111	F195 V196 E201 T208 M211 D212 W229 F235 P250	F195-Y199 WeakPolarHBondContact O-CB 3.32Å; F195-Y199 PolarHBondContact O-N 3.26Å; V196-Y199 WeakPolarHBondContact O-CB 3.32Å; V196-Y199 PolarHBondContact O-N 3.29Å; Y199-E201 PolarHBondContact O-N 3.41Å; Y199-T208 HydrophobicContact CD1-CG2 4.49Å; Y199-T208 HydrophobicContact CD2-CG2 3.85Å; Y199-T208 HydrophobicContact CE1-CG2 4.16Å; Y199-T208 HydrophobicContact CE2-CG2 3.46Å; Y199-T208 VanDerWaalsContact CE2-CG2 3.46Å; Y199-T208 HydrophobicContact CG-CG2 4.34Å; Y199-M211 HydrophobicContact CD2-CB 4.3Å; Y199-M211 HydrophobicContact CE2-CB 4.32Å; Y199-D212 WeakPolarHBondContact CE2-OD1 3.33Å; Y199-D212 PolarHBondContact OH-OD1 3.48Å; Y199-D212 PolarHBondContact OH-OD2 3.34Å; Y199-W229 HydrophobicContact CD1-CH2 4.13Å; Y199-W229 AromaticContact CD1-CZ3 3.81Å; Y199-W229 HydrophobicContact CD1-CZ3 3.81Å; Y199-W229 AromaticContact CD2-CH2 3.51Å; Y199-W229 HydrophobicContact CD2-CH2 3.51Å; Y199-W229 AromaticContact CD2-CZ3 3.93Å; Y199-W229 HydrophobicContact CD2-CZ3 3.93Å; Y199-W229 HydrophobicContact CE1-CH2 4.44Å; Y199-W229 HydrophobicContact CE1-CZ3 4.41Å; Y199-W229 AromaticContact CE2-CH2 3.88Å; Y199-W229 HydrophobicContact CE2-CH2 3.88Å; Y199-W229 AromaticContact CG-CH2 3.65Å; Y199-W229 HydrophobicContact CG-CH2 3.65Å; Y199-W229 AromaticContact CG-CZ3 3.53Å; Y199-W229 HydrophobicContact CG-CZ3 3.53Å; Y199-F235 AromaticContact CD1-CE2 3.71Å; Y199-F235 HydrophobicContact CD1-CE2 3.71Å; Y199-F235 AromaticContact CE1-CE2 3.73Å; Y199-F235 HydrophobicContact CE1-CE2 3.73Å; Y199-F235 HydrophobicContact CE1-CZ 4.16Å; Y199-P250 HydrophobicContact CD1-CG 4.34Å; Y199-P250 HydrophobicContact CE1-CB 4.17Å; Y199-P250 HydrophobicContact CE1-CG 3.67Å; Y199-P250 HydrophobicContact CE2-CG 4.25Å; Y199-P250 WeakPolarHBondContact OH-CB 3.5Å
200	R	87.4	Confident	84.7	Confident	111 Å²	111	49 Å²	49	42%	0.419	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	16.8	-175.7	-64.9	170.3	66.7	179.5	0.2	115.1	Q198 T208 F234 E245	Q198-R200 PolarHBondContact O-N 3.44Å; R200-T208 HydrophobicContact CG-CG2 3.82Å; R200-T208 PolarHBondContact N-OG1 3.24Å; R200-F234 HydrophobicContact CB-CD2 3.99Å; R200-F234 HydrophobicContact CB-CE2 3.62Å; R200-F234 HydrophobicContact CB-CZ 4.27Å; R200-E245 IonicContact CZ-OE1 3.66Å; R200-E245 IonicContact CZ-OE2 3.66Å; R200-E245 IonicContact NH1-OE1 2.88Å; R200-E245 PolarHBondContact NH1-OE1 3.24Å; R200-E245 IonicContact NH1-OE2 2.87Å; R200-E245 PolarHBondContact NH1-OE2 2.92Å; R200-E245 IonicContact NH2-OE2 3.34Å
201	E	83	Confident	84.9	Confident	56 Å²	56	46.5 Å²	46.5	26%	0.262	23%	0.232	S	C	.	.			trans	-76.2	147.8	169.7	-69.9	-66.4	164.9	0	0	110.4	Q198 Y199 G203 F204 R233	Q198-E201 WeakPolarHBondContact O-CB 3.34Å; Q198-E201 PolarHBondContact O-N 2.98Å; Q198-E201 VanDerWaalsContact O-N 3.11Å; Y199-E201 PolarHBondContact O-N 3.41Å; E201-G203 PolarHBondContact O-N 2.63Å; E201-F204 HydrophobicContact CB-CD2 3.83Å; E201-F204 PolarHBondContact O-N 3.49Å; E201-F204 VanDerWaalsContact O-N 3.08Å; E201-R233 WeakPolarHBondContact OE1-CD 3.26Å; E201-R233 IonicContact OE2-NH1 3.98Å
202	L	78.8	Confident	85.1	Confident	161 Å²	161	45.4 Å²	45.4	84%	0.843	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	125.7	-178	-166.8	75.1	0	0	0	110.1
203	G	72.5	Confident	85.1	Confident	16 Å²	16	47.5 Å²	47.5	17%	0.165	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	8.6	-177.4	0	0	0	0	0	115.7	S107 E201	S107-G203 WeakPolarHBondContact O-CA 3.28Å; E201-G203 PolarHBondContact O-N 2.63Å
204	F	77.8	Confident	85.5	Confident	25 Å²	25	47 Å²	47	11%	0.11	23%	0.231	C	C	.	.			trans	-123	34.9	175.8	-59.8	-79.1	0	0	0	112.1	Q198 E201 D206 T207 T208	Q198-F204 HydrophobicContact CB-CB 4.19Å; Q198-F204 HydrophobicContact CB-CD1 4.34Å; Q198-F204 HydrophobicContact CB-CD2 4.38Å; Q198-F204 HydrophobicContact CB-CG 4.04Å; E201-F204 HydrophobicContact CB-CD2 3.83Å; E201-F204 PolarHBondContact O-N 3.49Å; E201-F204 VanDerWaalsContact O-N 3.08Å; F204-D206 VanDerWaalsContact C-N 3.34Å; F204-D206 PolarHBondContact O-N 2.93Å; F204-T207 WeakPolarHBondContact O-CB 3.48Å; F204-T207 PolarHBondContact O-N 2.92Å; F204-T208 PolarHBondContact O-N 3.45Å; F204-T208 VanDerWaalsContact O-N 3.09Å; F204-T208 PolarHBondContact O-OG1 3.35Å
205	E	82.5	Confident	86.1	Confident	122 Å²	122	46.9 Å²	46.9	57%	0.57	23%	0.23	S	C	*	.	H	α-helix	trans	-62.6	-40.9	178.4	-63.5	-176.4	179.5	0	0	111.4	T207 T208 N209	E205-T207 VanDerWaalsContact C-N 3.33Å; E205-T207 PolarHBondContact O-N 3.24Å; E205-T208 WeakPolarHBondContact O-CB 3.29Å; E205-T208 PolarHBondContact O-N 3.36Å; E205-T208 VanDerWaalsContact O-N 3.1Å; E205-N209 PolarHBondContact O-N 2.87Å; E205-N209 PolarHBondContact O-ND2 2.91Å
206	D	79.4	Confident	86.4	Confident	41 Å²	41	50.1 Å²	50.1	22%	0.219	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-44.7	175	-67.8	-24	0	0	0	112.1	S107 T126 F204 T208 N209 F210	S107-D206 PolarHBondContact OG-OD2 3.25Å; T126-D206 PolarHBondContact OG1-OD2 2.99Å; F204-D206 VanDerWaalsContact C-N 3.34Å; F204-D206 PolarHBondContact O-N 2.93Å; D206-T208 VanDerWaalsContact C-N 3.31Å; D206-T208 PolarHBondContact O-N 3.38Å; D206-N209 PolarHBondContact O-N 2.8Å; D206-F210 VanDerWaalsContact O-CB 3.25Å; D206-F210 WeakPolarHBondContact O-CB 3.3Å; D206-F210 PolarHBondContact O-N 3.44Å
207	T	81.7	Confident	86.5	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-40.1	176.7	-55.8	0	0	0	0	111.3	F195 F204 E205 M211	F195-T207 HydrophobicContact CB-CG2 4.28Å; F195-T207 HydrophobicContact CD1-CG2 3.33Å; F195-T207 HydrophobicContact CE1-CG2 3.85Å; F195-T207 HydrophobicContact CG-CG2 4.05Å; F204-T207 WeakPolarHBondContact O-CB 3.48Å; F204-T207 PolarHBondContact O-N 2.92Å; E205-T207 VanDerWaalsContact C-N 3.33Å; E205-T207 PolarHBondContact O-N 3.24Å; T207-M211 WeakPolarHBondContact O-CB 3.36Å; T207-M211 PolarHBondContact O-N 3.4Å
208	T	88.4	Confident	86.8	Confident	13 Å²	13	55.3 Å²	55.3	8%	0.08	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-50	178.6	-56.3	0	0	0	0	110.8	Y199 R200 F204 E205 D206 F210 M211 D212	Y199-T208 HydrophobicContact CD1-CG2 4.49Å; Y199-T208 HydrophobicContact CD2-CG2 3.85Å; Y199-T208 HydrophobicContact CE1-CG2 4.16Å; Y199-T208 HydrophobicContact CE2-CG2 3.46Å; Y199-T208 VanDerWaalsContact CE2-CG2 3.46Å; Y199-T208 HydrophobicContact CG-CG2 4.34Å; R200-T208 HydrophobicContact CG-CG2 3.82Å; R200-T208 PolarHBondContact N-OG1 3.24Å; F204-T208 PolarHBondContact O-N 3.45Å; F204-T208 VanDerWaalsContact O-N 3.09Å; F204-T208 PolarHBondContact O-OG1 3.35Å; E205-T208 WeakPolarHBondContact O-CB 3.29Å; E205-T208 PolarHBondContact O-N 3.36Å; E205-T208 VanDerWaalsContact O-N 3.1Å; D206-T208 VanDerWaalsContact C-N 3.31Å; D206-T208 PolarHBondContact O-N 3.38Å; T208-F210 VanDerWaalsContact C-N 3.34Å; T208-F210 PolarHBondContact O-N 3.24Å; T208-M211 PolarHBondContact O-N 2.96Å; T208-D212 PolarHBondContact O-N 3.3Å
209	N	88.2	Confident	87.4	Confident	99 Å²	99	58.7 Å²	58.7	53%	0.529	28%	0.284	S	S	.	.	H	α-helix	trans	-63	-40.7	178.8	-71.4	-30.6	0	0	0	111.9	E205 D206 D212 F213	E205-N209 PolarHBondContact O-N 2.87Å; E205-N209 PolarHBondContact O-ND2 2.91Å; D206-N209 PolarHBondContact O-N 2.8Å; N209-D212 PolarHBondContact O-N 3.31Å; N209-F213 WeakPolarHBondContact O-CB 3.3Å; N209-F213 PolarHBondContact O-N 3.45Å
210	F	87.9	Confident	87.8	Confident	75 Å²	75	58.5 Å²	58.5	33%	0.329	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-44.8	176.3	-178.4	-100	0	0	0	111.8	L125 F195 D206 T208 D212 F213 I214	L125-F210 HydrophobicContact CD2-CB 3.94Å; L125-F210 HydrophobicContact CD2-CD2 3.88Å; L125-F210 HydrophobicContact CD2-CG 3.91Å; F195-F210 AromaticContact CD1-CD1 3.91Å; F195-F210 HydrophobicContact CD1-CD1 3.91Å; F195-F210 AromaticContact CE1-CD1 3.26Å; F195-F210 HydrophobicContact CE1-CD1 3.26Å; F195-F210 AromaticContact CE1-CE1 3.79Å; F195-F210 HydrophobicContact CE1-CE1 3.79Å; F195-F210 HydrophobicContact CE1-CG 4.23Å; F195-F210 AromaticContact CZ-CD1 3.77Å; F195-F210 HydrophobicContact CZ-CD1 3.77Å; F195-F210 AromaticContact CZ-CE1 3.79Å; F195-F210 HydrophobicContact CZ-CE1 3.79Å; D206-F210 VanDerWaalsContact O-CB 3.25Å; D206-F210 WeakPolarHBondContact O-CB 3.3Å; D206-F210 PolarHBondContact O-N 3.44Å; T208-F210 VanDerWaalsContact C-N 3.34Å; T208-F210 PolarHBondContact O-N 3.24Å; F210-D212 VanDerWaalsContact C-N 3.34Å; F210-D212 PolarHBondContact O-N 3.25Å; F210-F213 WeakPolarHBondContact O-CB 3.25Å; F210-F213 PolarHBondContact O-N 3.5Å; F210-I214 HydrophobicContact CD1-CG1 4.16Å; F210-I214 HydrophobicContact CE1-CD1 4.45Å; F210-I214 HydrophobicContact CE1-CG1 3.78Å; F210-I214 HydrophobicContact CE2-CD1 4.2Å; F210-I214 HydrophobicContact CE2-CG1 4.14Å; F210-I214 HydrophobicContact CZ-CD1 3.95Å; F210-I214 HydrophobicContact CZ-CG1 3.77Å; F210-I214 WeakPolarHBondContact O-CG1 3.36Å; F210-I214 PolarHBondContact O-N 2.96Å
211	M	91.5	Very high	88.2	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-43.5	176.5	-170	66.2	-167.1	0	0	111.4	I191 F195 Y199 T207 T208 F213 I214 Q215 W229	I191-M211 HydrophobicContact CG2-SD 4.47Å; F195-M211 HydrophobicContact CB-CB 4.41Å; F195-M211 HydrophobicContact CB-CG 4.36Å; F195-M211 HydrophobicContact CB-SD 3.8Å; F195-M211 HydrophobicContact CD1-CB 4.48Å; F195-M211 HydrophobicContact CG-SD 4.35Å; Y199-M211 HydrophobicContact CD2-CB 4.3Å; Y199-M211 HydrophobicContact CE2-CB 4.32Å; T207-M211 WeakPolarHBondContact O-CB 3.36Å; T207-M211 PolarHBondContact O-N 3.4Å; T208-M211 PolarHBondContact O-N 2.96Å; M211-F213 VanDerWaalsContact C-N 3.3Å; M211-F213 PolarHBondContact O-N 3.19Å; M211-I214 PolarHBondContact O-N 3.25Å; M211-Q215 HydrophobicContact CE-CG 3.85Å; M211-Q215 WeakPolarHBondContact O-CB 3.49Å; M211-Q215 WeakPolarHBondContact O-CG 3.37Å; M211-Q215 PolarHBondContact O-N 3.37Å; M211-W229 HydrophobicContact CE-CZ2 4.38Å; M211-W229 HydrophobicContact CG-CH2 4.22Å; M211-W229 HydrophobicContact CG-CZ2 4.25Å
212	D	93.2	Very high	88.8	Confident	8 Å²	8	50.6 Å²	50.6	4%	0.043	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-39.9	176.4	-80.9	-1.1	0	0	0	112.3	Y199 T208 N209 F210 K216 Y251 S252	Y199-D212 WeakPolarHBondContact CE2-OD1 3.33Å; Y199-D212 PolarHBondContact OH-OD1 3.48Å; Y199-D212 PolarHBondContact OH-OD2 3.34Å; T208-D212 PolarHBondContact O-N 3.3Å; N209-D212 PolarHBondContact O-N 3.31Å; F210-D212 VanDerWaalsContact C-N 3.34Å; F210-D212 PolarHBondContact O-N 3.25Å; D212-K216 WeakPolarHBondContact O-CD 3.25Å; D212-K216 VanDerWaalsContact O-CG 3.24Å; D212-K216 WeakPolarHBondContact O-CG 3.37Å; D212-K216 PolarHBondContact O-N 2.82Å; D212-Y251 WeakPolarHBondContact OD2-CE1 3.41Å; D212-Y251 VanDerWaalsContact OD2-CZ 3.3Å; D212-Y251 PolarHBondContact OD2-OH 3.26Å; D212-S252 WeakPolarHBondContact OD1-CB 3.35Å; D212-S252 PolarHBondContact OD1-OG 2.97Å
213	F	92.2	Very high	89.5	Confident	116 Å²	116	43 Å²	43	51%	0.509	21%	0.211	S	C	.	.	H	α-helix	trans	-63.9	-51.4	176.1	173.5	-99.5	0	0	0	111.2	N209 F210 M211 Q215 K216 E217	N209-F213 WeakPolarHBondContact O-CB 3.3Å; N209-F213 PolarHBondContact O-N 3.45Å; F210-F213 WeakPolarHBondContact O-CB 3.25Å; F210-F213 PolarHBondContact O-N 3.5Å; M211-F213 VanDerWaalsContact C-N 3.3Å; M211-F213 PolarHBondContact O-N 3.19Å; F213-Q215 VanDerWaalsContact C-N 3.3Å; F213-Q215 PolarHBondContact O-N 2.98Å; F213-K216 PolarHBondContact O-N 3.41Å; F213-E217 HydrophobicContact CZ-CB 4.42Å; F213-E217 HydrophobicContact CZ-CG 4.36Å; F213-E217 WeakPolarHBondContact O-CB 3.42Å; F213-E217 PolarHBondContact O-N 3.26Å
214	I	92.5	Very high	90.6	Very high	40 Å²	40	47.2 Å²	47.2	21%	0.205	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-42.3	179.7	-69.6	-58.4	0	0	0	111.5	F210 M211 E217 L218 C290	F210-I214 HydrophobicContact CD1-CG1 4.16Å; F210-I214 HydrophobicContact CE1-CD1 4.45Å; F210-I214 HydrophobicContact CE1-CG1 3.78Å; F210-I214 HydrophobicContact CE2-CD1 4.2Å; F210-I214 HydrophobicContact CE2-CG1 4.14Å; F210-I214 HydrophobicContact CZ-CD1 3.95Å; F210-I214 HydrophobicContact CZ-CG1 3.77Å; F210-I214 WeakPolarHBondContact O-CG1 3.36Å; F210-I214 PolarHBondContact O-N 2.96Å; M211-I214 PolarHBondContact O-N 3.25Å; I214-E217 PolarHBondContact O-N 2.86Å; I214-L218 HydrophobicContact CG2-CD1 3.75Å; I214-L218 HydrophobicContact CG2-CG 4.27Å; I214-L218 WeakPolarHBondContact O-CB 3.47Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.86Å; I214-C290 HydrophobicContact CG2-CB 4.47Å
215	Q	95.2	Very high	91.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-40.7	179.6	-74.6	-177	-28.3	0	0	113.1	M211 F213 N219 C220 G222 W229 S252 C253	M211-Q215 HydrophobicContact CE-CG 3.85Å; M211-Q215 WeakPolarHBondContact O-CB 3.49Å; M211-Q215 WeakPolarHBondContact O-CG 3.37Å; M211-Q215 PolarHBondContact O-N 3.37Å; F213-Q215 VanDerWaalsContact C-N 3.3Å; F213-Q215 PolarHBondContact O-N 2.98Å; Q215-N219 WeakPolarHBondContact O-CA 3.3Å; Q215-N219 PolarHBondContact O-N 3.47Å; Q215-C220 WeakPolarHBondContact CB-O 3.28Å; Q215-C220 PolarHBondContact O-N 3.36Å; Q215-C220 VanDerWaalsContact O-N 3.14Å; Q215-G222 VanDerWaalsContact NE2-N 3.11Å; Q215-W229 VanDerWaalsContact NE2-CZ2 3.33Å; Q215-S252 PolarHBondContact OE1-OG 3.35Å; Q215-C253 VanDerWaalsContact CD-SG 3.57Å; Q215-C253 PolarHBondContact NE2-SG 2.99Å; Q215-C253 VanDerWaalsContact NE2-SG 3.44Å; Q215-C253 PolarHBondContact OE1-SG 3.05Å
216	K	92.7	Very high	92.1	Very high	98 Å²	98	42 Å²	42	43%	0.426	20%	0.204	S	C	.	.	H	α-helix	trans	-69.1	-43.9	176.1	-70.3	169.3	-171.2	165.3	0	111.7	D212 F213 Y251	D212-K216 WeakPolarHBondContact O-CD 3.25Å; D212-K216 VanDerWaalsContact O-CG 3.24Å; D212-K216 WeakPolarHBondContact O-CG 3.37Å; D212-K216 PolarHBondContact O-N 2.82Å; F213-K216 PolarHBondContact O-N 3.41Å; K216-Y251 PolarHBondContact NZ-OH 3.18Å
217	E	93.4	Very high	92.9	Very high	126 Å²	126	44 Å²	44	59%	0.589	21%	0.214	S	C	*	.	H	α-helix	trans	-70	-42.1	-176.3	-170	62.4	-158.3	0	0	111.9	F213 I214	F213-E217 HydrophobicContact CZ-CB 4.42Å; F213-E217 HydrophobicContact CZ-CG 4.36Å; F213-E217 WeakPolarHBondContact O-CB 3.42Å; F213-E217 PolarHBondContact O-N 3.26Å; I214-E217 PolarHBondContact O-N 2.86Å
218	L	93.6	Very high	93.5	Very high	35 Å²	35	44.9 Å²	44.9	18%	0.183	22%	0.219	C	C	.	.	H	α-helix	trans	-92.3	-0.9	-178.1	-55	-175.9	0	0	0	113.6	I214 C220 A293 L294 I297	I214-L218 HydrophobicContact CG2-CD1 3.75Å; I214-L218 HydrophobicContact CG2-CG 4.27Å; I214-L218 WeakPolarHBondContact O-CB 3.47Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.86Å; L218-C220 VanDerWaalsContact C-N 3.31Å; L218-C220 HydrophobicContact CB-CB 4.35Å; L218-C220 PolarHBondContact O-N 3.36Å; L218-A293 HydrophobicContact CB-CB 4.38Å; L218-L294 HydrophobicContact CD1-CB 4.28Å; L218-I297 HydrophobicContact CD2-CD1 3.53Å
219	N	94.7	Very high	93.9	Very high	80 Å²	80	44.2 Å²	44.2	43%	0.428	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	50.5	-175.3	-69.2	-60.7	0	0	0	112.3	Q215 W286	Q215-N219 WeakPolarHBondContact O-CA 3.3Å; Q215-N219 PolarHBondContact O-N 3.47Å; N219-W286 VanDerWaalsContact C-CG 3.42Å; N219-W286 HydrophobicContact CB-CD2 3.84Å; N219-W286 VanDerWaalsContact CB-CE2 3.48Å; N219-W286 HydrophobicContact CB-CE3 4.3Å; N219-W286 HydrophobicContact CB-CG 4.32Å; N219-W286 HydrophobicContact CB-CH2 4.14Å; N219-W286 HydrophobicContact CB-CZ2 3.66Å; N219-W286 HydrophobicContact CB-CZ3 4.43Å; N219-W286 WeakPolarHBondContact O-CB 3.49Å; N219-W286 VanDerWaalsContact O-CD2 3.31Å; N219-W286 VanDerWaalsContact OD1-CZ2 3.26Å; N219-W286 WeakPolarHBondContact OD1-CZ2 3.4Å; N219-W286 PolarHBondContact OD1-NE1 2.92Å
220	C	96.3	Very high	94.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.			trans	-130.1	166.7	-173.8	66	0	0	0	0	111.6	Q215 L218 T288 C290 A293	Q215-C220 WeakPolarHBondContact CB-O 3.28Å; Q215-C220 PolarHBondContact O-N 3.36Å; Q215-C220 VanDerWaalsContact O-N 3.14Å; L218-C220 VanDerWaalsContact C-N 3.31Å; L218-C220 HydrophobicContact CB-CB 4.35Å; L218-C220 PolarHBondContact O-N 3.36Å; C220-T288 CarbonylContact C-O 3.32Å; C220-T288 WeakPolarHBondContact CA-O 3.36Å; C220-T288 WeakPolarHBondContact CB-O 3.41Å; C220-C290 HydrophobicContact CB-CB 3.87Å; C220-C290 WeakPolarHBondContact CB-SG 3.21Å; C220-C290 WeakPolarHBondContact SG-CA 3.43Å; C220-C290 WeakPolarHBondContact SG-CB 3.24Å; C220-C290 CovalentContact SG-SG 2.04Å; C220-C290 PolarHBondContact SG-SG 3.06Å; C220-A293 HydrophobicContact CB-CB 3.89Å
221	C	96.3	Very high	94.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.			trans	-143.6	128.4	173.2	-168.4	0	0	0	0	111.9	S225 Y226 W229 C253 W286 T288	C221-S225 CarbonylContact O-C 3.56Å; C221-Y226 PolarHBondContact O-N 3.45Å; C221-Y226 VanDerWaalsContact O-N 3.1Å; C221-W229 PolarHBondContact SG-NE1 2.89Å; C221-W229 VanDerWaalsContact SG-NE1 3.37Å; C221-C253 VanDerWaalsContact CA-SG 3.56Å; C221-C253 HydrophobicContact CB-CB 3.61Å; C221-C253 WeakPolarHBondContact CB-SG 3.43Å; C221-C253 WeakPolarHBondContact SG-CB 3.33Å; C221-C253 CovalentContact SG-SG 2.03Å; C221-C253 PolarHBondContact SG-SG 3.04Å; C221-W286 HydrophobicContact CB-CB 4.43Å; C221-W286 WeakPolarHBondContact CB-O 3.17Å; C221-T288 PolarHBondContact N-O 3.04Å
222	G	95.4	Very high	94.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	67.4	168.4	-174.8	0	0	0	0	0	114	Q215 C290	Q215-G222 VanDerWaalsContact NE2-N 3.11Å; G222-C290 WeakPolarHBondContact O-CB 3.45Å; G222-C290 PolarHBondContact O-N 2.81Å; G222-C290 PolarHBondContact O-SG 2.99Å; G222-C290 VanDerWaalsContact O-SG 3.33Å
223	P	94.1	Very high	94.4	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	24%	0.236	C	C	.	.	S	Bend	trans	-59.6	-55.3	177.7	-21.1	30.8	0	0	0	112.5	E188 I191 K192 V196 D228 G289 C290 V291	E188-P223 HydrophobicContact CB-CB 4.5Å; E188-P223 WeakPolarHBondContact O-CB 3.33Å; I191-P223 HydrophobicContact CB-CB 4.09Å; I191-P223 HydrophobicContact CB-CG 4.17Å; I191-P223 HydrophobicContact CG2-CB 4.04Å; I191-P223 HydrophobicContact CG2-CG 3.81Å; K192-P223 HydrophobicContact CB-CG 3.92Å; V196-P223 HydrophobicContact CG2-CG 3.79Å; P223-D228 WeakPolarHBondContact CD-OD2 3.49Å; P223-D228 HydrophobicContact CG-CB 4.38Å; P223-G289 CarbonylContact O-C 3.55Å; P223-C290 PolarHBondContact O-N 3.07Å; P223-C290 VanDerWaalsContact O-N 3.16Å; P223-V291 WeakPolarHBondContact O-CG2 3.47Å; P223-V291 PolarHBondContact O-N 2.03Å
224	K	95.8	Very high	94.4	Very high	106 Å²	106	44.5 Å²	44.5	46%	0.461	22%	0.22	S	C	.	.	S	Bend	trans	-109	-36.8	180	179.8	175	-172.9	167.3	0	111.7	E188 D228 G289	E188-K224 HydrophobicContact CG-CB 4.22Å; E188-K224 WeakPolarHBondContact OE1-CB 3.27Å; E188-K224 WeakPolarHBondContact OE1-CD 3.28Å; E188-K224 VanDerWaalsContact OE1-CG 3.3Å; E188-K224 WeakPolarHBondContact OE1-CG 3.47Å; K224-D228 WeakPolarHBondContact CA-OD2 3.25Å; K224-D228 WeakPolarHBondContact CB-OD2 3.34Å; K224-D228 PolarHBondContact N-OD2 3.41Å; K224-G289 VanDerWaalsContact C-CA 3.43Å; K224-G289 WeakPolarHBondContact O-CA 3.44Å; K224-G289 PolarHBondContact O-N 2.64Å
225	S	95.4	Very high	94.5	Very high	31 Å²	31	42.8 Å²	42.8	22%	0.217	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-156	160	179.9	-178.7	0	0	0	0	111.1	C221 L227 D228	C221-S225 CarbonylContact O-C 3.56Å; S225-L227 PolarHBondContact O-N 2.9Å; S225-D228 PolarHBondContact N-OD2 3.45Å; S225-D228 VanDerWaalsContact O-CB 3.3Å; S225-D228 WeakPolarHBondContact O-CB 3.36Å; S225-D228 PolarHBondContact O-N 3.33Å
226	Y	95.5	Very high	94.5	Very high	7 Å²	7	44.1 Å²	44.1	3%	0.027	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-56	-22.9	172.4	75.2	-81.2	0	0	0	113.4	C221 D228 V273 A281 T287	C221-Y226 PolarHBondContact O-N 3.45Å; C221-Y226 VanDerWaalsContact O-N 3.1Å; Y226-D228 PolarHBondContact O-N 3.42Å; Y226-V273 HydrophobicContact CD2-CG2 4.45Å; Y226-A281 HydrophobicContact CE2-CB 4.08Å; Y226-T287 HydrophobicContact CD1-CG2 3.85Å; Y226-T287 HydrophobicContact CE1-CG2 3.88Å
227	L	96.5	Very high	94.6	Very high	81 Å²	81	41.8 Å²	41.8	42%	0.424	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-70.9	-16.7	176.3	-63.1	175.3	0	0	0	113.7	S225 W229 T230 Q274	S225-L227 PolarHBondContact O-N 2.9Å; L227-W229 PolarHBondContact O-N 2.67Å; L227-W229 VanDerWaalsContact O-N 3.16Å; L227-T230 WeakPolarHBondContact O-CB 3.43Å; L227-T230 PolarHBondContact O-N 3.1Å; L227-T230 VanDerWaalsContact O-N 3.12Å; L227-T230 PolarHBondContact O-OG1 2.9Å; L227-Q274 HydrophobicContact CD2-CB 4.16Å; L227-Q274 HydrophobicContact CD2-CG 4.33Å; L227-Q274 PolarHBondContact O-OE1 3.3Å
228	D	95.5	Very high	94.6	Very high	21 Å²	21	40.2 Å²	40.2	11%	0.112	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-63.7	-21.2	178.5	-75.2	-49.1	0	0	0	112.9	K192 P223 K224 S225 Y226 T230 A231	K192-D228 IonicContact NZ-OD1 2.82Å; K192-D228 PolarHBondContact NZ-OD1 3.05Å; P223-D228 WeakPolarHBondContact CD-OD2 3.49Å; P223-D228 HydrophobicContact CG-CB 4.38Å; K224-D228 WeakPolarHBondContact CA-OD2 3.25Å; K224-D228 WeakPolarHBondContact CB-OD2 3.34Å; K224-D228 PolarHBondContact N-OD2 3.41Å; S225-D228 PolarHBondContact N-OD2 3.45Å; S225-D228 VanDerWaalsContact O-CB 3.3Å; S225-D228 WeakPolarHBondContact O-CB 3.36Å; S225-D228 PolarHBondContact O-N 3.33Å; Y226-D228 PolarHBondContact O-N 3.42Å; D228-T230 PolarHBondContact O-N 3.47Å; D228-T230 VanDerWaalsContact O-N 3.12Å; D228-A231 WeakPolarHBondContact O-CB 3.33Å; D228-A231 PolarHBondContact O-N 2.94Å
229	W	95.8	Very high	94.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-60.6	-16.6	174.3	-75	111.6	0	0	0	113.7	V196 Y199 M211 Q215 C221 L227 A231 S232 F235 V249 P250	V196-W229 HydrophobicContact CG1-CD2 4.34Å; V196-W229 HydrophobicContact CG1-CE3 3.79Å; V196-W229 HydrophobicContact CG1-CZ3 4.04Å; Y199-W229 HydrophobicContact CD1-CH2 4.13Å; Y199-W229 AromaticContact CD1-CZ3 3.81Å; Y199-W229 HydrophobicContact CD1-CZ3 3.81Å; Y199-W229 AromaticContact CD2-CH2 3.51Å; Y199-W229 HydrophobicContact CD2-CH2 3.51Å; Y199-W229 AromaticContact CD2-CZ3 3.93Å; Y199-W229 HydrophobicContact CD2-CZ3 3.93Å; Y199-W229 HydrophobicContact CE1-CH2 4.44Å; Y199-W229 HydrophobicContact CE1-CZ3 4.41Å; Y199-W229 AromaticContact CE2-CH2 3.88Å; Y199-W229 HydrophobicContact CE2-CH2 3.88Å; Y199-W229 AromaticContact CG-CH2 3.65Å; Y199-W229 HydrophobicContact CG-CH2 3.65Å; Y199-W229 AromaticContact CG-CZ3 3.53Å; Y199-W229 HydrophobicContact CG-CZ3 3.53Å; M211-W229 HydrophobicContact CE-CZ2 4.38Å; M211-W229 HydrophobicContact CG-CH2 4.22Å; M211-W229 HydrophobicContact CG-CZ2 4.25Å; Q215-W229 VanDerWaalsContact NE2-CZ2 3.33Å; C221-W229 PolarHBondContact SG-NE1 2.89Å; C221-W229 VanDerWaalsContact SG-NE1 3.37Å; L227-W229 PolarHBondContact O-N 2.67Å; L227-W229 VanDerWaalsContact O-N 3.16Å; W229-A231 PolarHBondContact O-N 3.26Å; W229-A231 VanDerWaalsContact O-N 3.1Å; W229-S232 WeakPolarHBondContact O-CB 3.41Å; W229-S232 PolarHBondContact O-N 3.46Å; W229-F235 HydrophobicContact CB-CB 4.03Å; W229-F235 HydrophobicContact CD2-CD2 4.38Å; W229-F235 AromaticContact CE3-CD2 3.59Å; W229-F235 HydrophobicContact CE3-CD2 3.59Å; W229-F235 HydrophobicContact CE3-CE2 4.05Å; W229-F235 HydrophobicContact CE3-CG 4.38Å; W229-F235 HydrophobicContact CZ3-CD2 4.09Å; W229-F235 HydrophobicContact CZ3-CE2 4.16Å; W229-F235 WeakPolarHBondContact O-CB 3.4Å; W229-V249 HydrophobicContact CB-CG1 4.12Å; W229-V249 HydrophobicContact CG-CB 4.27Å; W229-V249 HydrophobicContact CG-CG1 4.01Å; W229-P250 HydrophobicContact CD2-CG 3.92Å; W229-P250 HydrophobicContact CE3-CG 3.95Å; W229-P250 HydrophobicContact CH2-CG 3.44Å; W229-P250 VanDerWaalsContact CH2-CG 3.44Å; W229-P250 HydrophobicContact CZ2-CB 4.46Å; W229-P250 HydrophobicContact CZ2-CG 3.36Å; W229-P250 HydrophobicContact CZ3-CG 3.72Å
230	T	94.7	Very high	94.3	Very high	60 Å²	60	49 Å²	49	37%	0.368	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-55.5	-25.8	168.6	-73.2	0	0	0	0	112.8	L227 D228 S232 S236 Q274	L227-T230 WeakPolarHBondContact O-CB 3.43Å; L227-T230 PolarHBondContact O-N 3.1Å; L227-T230 VanDerWaalsContact O-N 3.12Å; L227-T230 PolarHBondContact O-OG1 2.9Å; D228-T230 PolarHBondContact O-N 3.47Å; D228-T230 VanDerWaalsContact O-N 3.12Å; T230-S232 VanDerWaalsContact C-N 3.31Å; T230-S236 WeakPolarHBondContact O-CA 3.12Å; T230-S236 WeakPolarHBondContact O-CB 3.01Å; T230-S236 PolarHBondContact O-OG 3.34Å; T230-Q274 PolarHBondContact OG1-OE1 2.95Å
231	A	93.1	Very high	94	Very high	44 Å²	44	50.7 Å²	50.7	36%	0.364	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-76	-14.9	177.5	0	0	0	0	0	114	K192 V196 D228 W229	K192-A231 HydrophobicContact CG-CB 4.42Å; V196-A231 HydrophobicContact CG1-CB 4.27Å; D228-A231 WeakPolarHBondContact O-CB 3.33Å; D228-A231 PolarHBondContact O-N 2.94Å; W229-A231 PolarHBondContact O-N 3.26Å; W229-A231 VanDerWaalsContact O-N 3.1Å
232	S	92.3	Very high	93.8	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.014	31%	0.305	C	S	.	.	S	Bend	trans	-82.1	141.8	176.2	179.4	0	0	0	0	110.8	V196 W229 T230 F234 F235 S236	V196-S232 WeakPolarHBondContact O-CB 3.42Å; V196-S232 PolarHBondContact O-OG 2.97Å; W229-S232 WeakPolarHBondContact O-CB 3.41Å; W229-S232 PolarHBondContact O-N 3.46Å; T230-S232 VanDerWaalsContact C-N 3.31Å; S232-F234 VanDerWaalsContact C-N 3.27Å; S232-F234 PolarHBondContact O-N 2.72Å; S232-F235 PolarHBondContact O-N 3.41Å; S232-S236 WeakPolarHBondContact O-CB 3.36Å; S232-S236 PolarHBondContact O-N 2.95Å
233	R	91.6	Very high	93.7	Very high	163 Å²	163	59.6 Å²	59.6	62%	0.615	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-40	176.7	177.7	-176.8	150.4	-176.8	-5.7	112.8	E201 N241	E201-R233 WeakPolarHBondContact OE1-CD 3.26Å; E201-R233 IonicContact OE2-NH1 3.98Å; R233-N241 PolarHBondContact O-ND2 3.01Å
234	F	92.2	Very high	93.5	Very high	40 Å²	40	65 Å²	65	18%	0.175	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-28.9	-175.3	-60.3	-77.8	0	0	0	113.4	R200 S232 S243 E245	R200-F234 HydrophobicContact CB-CD2 3.99Å; R200-F234 HydrophobicContact CB-CE2 3.62Å; R200-F234 HydrophobicContact CB-CZ 4.27Å; S232-F234 VanDerWaalsContact C-N 3.27Å; S232-F234 PolarHBondContact O-N 2.72Å; F234-S243 WeakPolarHBondContact O-CB 3.45Å; F234-S243 PolarHBondContact O-OG 3.44Å; F234-E245 CarbonylContact O-C 3.51Å
235	F	95.2	Very high	93.4	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.018	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-0.8	-173.3	-58.6	-71.4	0	0	0	113.6	Y199 W229 S232 C237 E245 C247 G248 V249 P250 Q274	Y199-F235 AromaticContact CD1-CE2 3.71Å; Y199-F235 HydrophobicContact CD1-CE2 3.71Å; Y199-F235 AromaticContact CE1-CE2 3.73Å; Y199-F235 HydrophobicContact CE1-CE2 3.73Å; Y199-F235 HydrophobicContact CE1-CZ 4.16Å; W229-F235 HydrophobicContact CB-CB 4.03Å; W229-F235 HydrophobicContact CD2-CD2 4.38Å; W229-F235 AromaticContact CE3-CD2 3.59Å; W229-F235 HydrophobicContact CE3-CD2 3.59Å; W229-F235 HydrophobicContact CE3-CE2 4.05Å; W229-F235 HydrophobicContact CE3-CG 4.38Å; W229-F235 HydrophobicContact CZ3-CD2 4.09Å; W229-F235 HydrophobicContact CZ3-CE2 4.16Å; W229-F235 WeakPolarHBondContact O-CB 3.4Å; S232-F235 PolarHBondContact O-N 3.41Å; F235-C237 PolarHBondContact O-N 3.08Å; F235-E245 HydrophobicContact CD1-CB 4.01Å; F235-E245 HydrophobicContact CE1-CB 3.85Å; F235-E245 HydrophobicContact CE1-CG 4.5Å; F235-C247 PolarHBondContact O-N 3.1Å; F235-C247 VanDerWaalsContact O-N 3.16Å; F235-G248 WeakPolarHBondContact CB-O 3.37Å; F235-V249 VanDerWaalsContact CE1-C 3.48Å; F235-P250 HydrophobicContact CD2-CG 4.39Å; F235-P250 HydrophobicContact CE1-CG 4.49Å; F235-P250 HydrophobicContact CE2-CG 3.63Å; F235-P250 HydrophobicContact CZ-CB 4.28Å; F235-P250 HydrophobicContact CZ-CG 3.68Å; F235-Q274 PolarHBondContact O-NE2 2.91Å
236	S	94.9	Very high	93.3	Very high	27 Å²	27	61.7 Å²	61.7	19%	0.189	33%	0.334	C	S	.	.			trans	-54.2	134.7	178.5	-168.9	0	0	0	0	112	T230 S232 D238 N241	T230-S236 WeakPolarHBondContact O-CA 3.12Å; T230-S236 WeakPolarHBondContact O-CB 3.01Å; T230-S236 PolarHBondContact O-OG 3.34Å; S232-S236 WeakPolarHBondContact O-CB 3.36Å; S232-S236 PolarHBondContact O-N 2.95Å; S236-D238 PolarHBondContact O-N 3.21Å; S236-D238 PolarHBondContact OG-N 2.94Å; S236-N241 PolarHBondContact N-ND2 2.76Å; S236-N241 PolarHBondContact O-ND2 2.89Å
237	C	94.2	Very high	93.3	Very high	49 Å²	49	61.7 Å²	61.7	33%	0.331	34%	0.335	S	S	.	.			trans	-81.6	6.8	175	-90.7	0	0	0	0	114.2	F235 C247	F235-C237 PolarHBondContact O-N 3.08Å; C237-C247 WeakPolarHBondContact CA-SG 3.22Å; C237-C247 HydrophobicContact CB-CB 4.34Å; C237-C247 WeakPolarHBondContact CB-SG 3.41Å; C237-C247 WeakPolarHBondContact SG-CA 3.36Å; C237-C247 WeakPolarHBondContact SG-CB 3.36Å; C237-C247 CovalentContact SG-SG 2.04Å; C237-C247 PolarHBondContact SG-SG 3.42Å
238	D	93.6	Very high	93.3	Very high	93 Å²	93	57.9 Å²	57.9	50%	0.497	32%	0.316	S	S	.	.			trans	-62.2	140.7	176.6	-170.9	13.6	0	0	0	111	S236 S240 N241	S236-D238 PolarHBondContact O-N 3.21Å; S236-D238 PolarHBondContact OG-N 2.94Å; D238-S240 PolarHBondContact O-N 2.88Å; D238-S240 PolarHBondContact OD2-OG 3.49Å; D238-N241 VanDerWaalsContact O-CB 3.25Å; D238-N241 WeakPolarHBondContact O-CB 3.34Å; D238-N241 PolarHBondContact O-N 3.14Å
239	K	89.8	Confident	93.3	Very high	211 Å²	211	57.1 Å²	57.1	92%	0.917	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.1	179.1	-64.1	-178	-179.1	179	0	112.3	N241	K239-N241 VanDerWaalsContact C-N 3.28Å
240	S	92	Very high	93.2	Very high	90 Å²	90	57.3 Å²	57.3	63%	0.629	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.2	176	76.6	0	0	0	0	113.4	D238 I242	D238-S240 PolarHBondContact O-N 2.88Å; D238-S240 PolarHBondContact OD2-OG 3.49Å; S240-I242 PolarHBondContact O-N 3.46Å
241	N	91	Very high	93.1	Very high	35 Å²	35	58 Å²	58	19%	0.187	31%	0.309	C	S	.	.			trans	-74.5	114.5	-176.3	-166.3	-7.1	0	0	0	111.1	R233 S236 D238 K239 S243 A246	R233-N241 PolarHBondContact O-ND2 3.01Å; S236-N241 PolarHBondContact N-ND2 2.76Å; S236-N241 PolarHBondContact O-ND2 2.89Å; D238-N241 VanDerWaalsContact O-CB 3.25Å; D238-N241 WeakPolarHBondContact O-CB 3.34Å; D238-N241 PolarHBondContact O-N 3.14Å; K239-N241 VanDerWaalsContact C-N 3.28Å; N241-S243 VanDerWaalsContact C-N 3.29Å; N241-S243 WeakPolarHBondContact OD1-CB 3.37Å; N241-S243 PolarHBondContact OD1-N 2.92Å; N241-A246 HydrophobicContact CB-CB 4.21Å
242	I	92.1	Very high	93.1	Very high	167 Å²	167	56.1 Å²	56.1	86%	0.856	29%	0.293	S	S	*	.			trans	-84.7	-1.2	178.6	61.1	164.9	0	0	0	113.4	S240	S240-I242 PolarHBondContact O-N 3.46Å
243	S	91.7	Very high	93.2	Very high	19 Å²	19	56 Å²	56	13%	0.133	29%	0.292	C	S	.	.			trans	-63.1	131.8	-179.8	-179.3	0	0	0	0	111.1	F234 N241 E245 A246	F234-S243 WeakPolarHBondContact O-CB 3.45Å; F234-S243 PolarHBondContact O-OG 3.44Å; N241-S243 VanDerWaalsContact C-N 3.29Å; N241-S243 WeakPolarHBondContact OD1-CB 3.37Å; N241-S243 PolarHBondContact OD1-N 2.92Å; S243-E245 PolarHBondContact O-N 2.88Å; S243-E245 VanDerWaalsContact O-N 3.12Å; S243-E245 PolarHBondContact OG-N 3.44Å; S243-A246 VanDerWaalsContact O-CB 3.22Å; S243-A246 WeakPolarHBondContact O-CB 3.42Å; S243-A246 PolarHBondContact O-N 3.42Å
244	P	91.4	Very high	93.2	Very high	114 Å²	114	49.1 Å²	49.1	74%	0.74	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.4	170.4	-22.7	33.5	0	0	0	113.3
245	E	92.8	Very high	93	Very high	40 Å²	40	52.2 Å²	52.2	19%	0.187	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	7.8	-178.5	-61	162.2	134.6	0	0	112.2	R200 F234 F235 S243 G248 F271	R200-E245 IonicContact CZ-OE1 3.66Å; R200-E245 IonicContact CZ-OE2 3.66Å; R200-E245 IonicContact NH1-OE1 2.88Å; R200-E245 PolarHBondContact NH1-OE1 3.24Å; R200-E245 IonicContact NH1-OE2 2.87Å; R200-E245 PolarHBondContact NH1-OE2 2.92Å; R200-E245 IonicContact NH2-OE2 3.34Å; F234-E245 CarbonylContact O-C 3.51Å; F235-E245 HydrophobicContact CD1-CB 4.01Å; F235-E245 HydrophobicContact CE1-CB 3.85Å; F235-E245 HydrophobicContact CE1-CG 4.5Å; S243-E245 PolarHBondContact O-N 2.88Å; S243-E245 VanDerWaalsContact O-N 3.12Å; S243-E245 PolarHBondContact OG-N 3.44Å; E245-G248 WeakPolarHBondContact O-CA 3.29Å; E245-G248 PolarHBondContact O-N 3.1Å; E245-F271 HydrophobicContact CG-CE1 4.03Å; E245-F271 HydrophobicContact CG-CE2 4.15Å; E245-F271 HydrophobicContact CG-CZ 3.62Å
246	A	94.3	Very high	91.9	Very high	28 Å²	28	60.4 Å²	60.4	23%	0.231	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	140.2	179.3	0	0	0	0	0	111.5	N241 S243 G248	N241-A246 HydrophobicContact CB-CB 4.21Å; S243-A246 VanDerWaalsContact O-CB 3.22Å; S243-A246 WeakPolarHBondContact O-CB 3.42Å; S243-A246 PolarHBondContact O-N 3.42Å; A246-G248 PolarHBondContact O-N 3.17Å
247	C	95.8	Very high	90.1	Very high	8 Å²	8	64.7 Å²	64.7	5%	0.054	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	17.9	-168.9	-69.9	0	0	0	0	115.5	F235 C237 G272 V273 Q274 K275	F235-C247 PolarHBondContact O-N 3.1Å; F235-C247 VanDerWaalsContact O-N 3.16Å; C237-C247 WeakPolarHBondContact CA-SG 3.22Å; C237-C247 HydrophobicContact CB-CB 4.34Å; C237-C247 WeakPolarHBondContact CB-SG 3.41Å; C237-C247 WeakPolarHBondContact SG-CA 3.36Å; C237-C247 WeakPolarHBondContact SG-CB 3.36Å; C237-C247 CovalentContact SG-SG 2.04Å; C237-C247 PolarHBondContact SG-SG 3.42Å; C247-G272 CarbonylContact O-C 3.17Å; C247-G272 VanDerWaalsContact O-CA 3.25Å; C247-G272 WeakPolarHBondContact O-CA 3.23Å; C247-V273 PolarHBondContact O-N 3.42Å; C247-Q274 HydrophobicContact CB-CB 4.25Å; C247-Q274 VanDerWaalsContact O-CB 3.25Å; C247-Q274 WeakPolarHBondContact O-CB 2.85Å; C247-Q274 WeakPolarHBondContact O-CG 3.26Å; C247-Q274 PolarHBondContact O-N 2.97Å; C247-K275 HydrophobicContact CB-CD 4.26Å; C247-K275 HydrophobicContact CB-CG 3.93Å; C247-K275 WeakPolarHBondContact SG-CE 3.44Å
248	G	95.3	Very high	88.2	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.01	36%	0.359	C	S	.	.			trans	-98.5	-171.1	174.2	0	0	0	0	0	113.6	F235 E245 A246 G270 Q274	F235-G248 WeakPolarHBondContact CB-O 3.37Å; E245-G248 WeakPolarHBondContact O-CA 3.29Å; E245-G248 PolarHBondContact O-N 3.1Å; A246-G248 PolarHBondContact O-N 3.17Å; G248-G270 CarbonylContact C-O 3.58Å; G248-G270 WeakPolarHBondContact CA-O 3.43Å; G248-Q274 PolarHBondContact O-NE2 3.29Å
249	V	95.5	Very high	86.3	Confident	5 Å²	5	72.5 Å²	72.5	3%	0.03	38%	0.375	C	S	.	.			trans	-135.4	161.8	168.1	-60	0	0	0	0	108.6	W229 F235 C253 G270 V273 Q274 V285	W229-V249 HydrophobicContact CB-CG1 4.12Å; W229-V249 HydrophobicContact CG-CB 4.27Å; W229-V249 HydrophobicContact CG-CG1 4.01Å; F235-V249 VanDerWaalsContact CE1-C 3.48Å; V249-C253 HydrophobicContact CB-CB 4.28Å; V249-C253 HydrophobicContact CG2-CB 3.7Å; V249-G270 PolarHBondContact N-O 2.91Å; V249-V273 HydrophobicContact CB-CG2 4.24Å; V249-V273 HydrophobicContact CG1-CG2 3.7Å; V249-V273 HydrophobicContact CG2-CG2 3.69Å; V249-Q274 HydrophobicContact CG1-CG 4.33Å; V249-V285 HydrophobicContact CG2-CB 4.46Å; V249-V285 HydrophobicContact CG2-CG1 3.81Å
250	P	94.5	Very high	84.7	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.019	36%	0.363	C	S	.	.			trans	-56.4	153.2	172.9	-29.7	38.5	0	0	0	113.8	Y199 W229 F235 S252 C253	Y199-P250 HydrophobicContact CD1-CG 4.34Å; Y199-P250 HydrophobicContact CE1-CB 4.17Å; Y199-P250 HydrophobicContact CE1-CG 3.67Å; Y199-P250 HydrophobicContact CE2-CG 4.25Å; Y199-P250 WeakPolarHBondContact OH-CB 3.5Å; W229-P250 HydrophobicContact CD2-CG 3.92Å; W229-P250 HydrophobicContact CE3-CG 3.95Å; W229-P250 HydrophobicContact CH2-CG 3.44Å; W229-P250 VanDerWaalsContact CH2-CG 3.44Å; W229-P250 HydrophobicContact CZ2-CB 4.46Å; W229-P250 HydrophobicContact CZ2-CG 3.36Å; W229-P250 HydrophobicContact CZ3-CG 3.72Å; F235-P250 HydrophobicContact CD2-CG 4.39Å; F235-P250 HydrophobicContact CE1-CG 4.49Å; F235-P250 HydrophobicContact CE2-CG 3.63Å; F235-P250 HydrophobicContact CZ-CB 4.28Å; F235-P250 HydrophobicContact CZ-CG 3.68Å; P250-S252 WeakPolarHBondContact CB-OG 3.46Å; P250-S252 PolarHBondContact O-N 3.47Å; P250-S252 VanDerWaalsContact O-N 3.17Å; P250-C253 WeakPolarHBondContact O-CB 3.12Å; P250-C253 PolarHBondContact O-N 2.97Å
251	Y	91.8	Very high	82.9	Confident	76 Å²	76	68.3 Å²	68.3	30%	0.298	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-62.2	-22.2	176.4	76.9	-79.8	0	0	0	113.1	D212 K216 C253 C254 I265	D212-Y251 WeakPolarHBondContact OD2-CE1 3.41Å; D212-Y251 VanDerWaalsContact OD2-CZ 3.3Å; D212-Y251 PolarHBondContact OD2-OH 3.26Å; K216-Y251 PolarHBondContact NZ-OH 3.18Å; Y251-C253 PolarHBondContact O-N 3.36Å; Y251-C254 WeakPolarHBondContact O-CB 3.19Å; Y251-C254 PolarHBondContact O-N 3.41Å; Y251-C254 PolarHBondContact O-SG 3.14Å; Y251-I265 HydrophobicContact CD2-CG2 4.05Å
252	S	92.8	Very high	81.4	Confident	3 Å²	3	73.4 Å²	73.4	2%	0.021	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-66.6	-19.7	174.5	42.6	0	0	0	0	113.5	D212 Q215 P250 C254	D212-S252 WeakPolarHBondContact OD1-CB 3.35Å; D212-S252 PolarHBondContact OD1-OG 2.97Å; Q215-S252 PolarHBondContact OE1-OG 3.35Å; P250-S252 WeakPolarHBondContact CB-OG 3.46Å; P250-S252 PolarHBondContact O-N 3.47Å; P250-S252 VanDerWaalsContact O-N 3.17Å; S252-C254 VanDerWaalsContact C-N 3.31Å
253	C	94.9	Very high	79.8	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-79.6	-10.8	170.3	-67.6	0	0	0	0	113.9	Q215 C221 V249 P250 Y251 V285 W286	Q215-C253 VanDerWaalsContact CD-SG 3.57Å; Q215-C253 PolarHBondContact NE2-SG 2.99Å; Q215-C253 VanDerWaalsContact NE2-SG 3.44Å; Q215-C253 PolarHBondContact OE1-SG 3.05Å; C221-C253 VanDerWaalsContact CA-SG 3.56Å; C221-C253 HydrophobicContact CB-CB 3.61Å; C221-C253 WeakPolarHBondContact CB-SG 3.43Å; C221-C253 WeakPolarHBondContact SG-CB 3.33Å; C221-C253 CovalentContact SG-SG 2.03Å; C221-C253 PolarHBondContact SG-SG 3.04Å; V249-C253 HydrophobicContact CB-CB 4.28Å; V249-C253 HydrophobicContact CG2-CB 3.7Å; P250-C253 WeakPolarHBondContact O-CB 3.12Å; P250-C253 PolarHBondContact O-N 2.97Å; Y251-C253 PolarHBondContact O-N 3.36Å; C253-V285 HydrophobicContact CB-CB 4.42Å; C253-V285 WeakPolarHBondContact O-CA 3.46Å; C253-V285 WeakPolarHBondContact O-CB 2.96Å; C253-W286 PolarHBondContact O-N 2.93Å
254	C	92.4	Very high	78.5	Confident	19 Å²	19	77.8 Å²	77.8	13%	0.128	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-65.1	135.2	-176.4	-69	0	0	0	0	111.8	Y251 S252 N266 C269	Y251-C254 WeakPolarHBondContact O-CB 3.19Å; Y251-C254 PolarHBondContact O-N 3.41Å; Y251-C254 PolarHBondContact O-SG 3.14Å; S252-C254 VanDerWaalsContact C-N 3.31Å; C254-N266 PolarHBondContact SG-O 3.5Å; C254-C269 WeakPolarHBondContact CA-SG 3.39Å; C254-C269 HydrophobicContact CB-CB 3.99Å; C254-C269 WeakPolarHBondContact CB-SG 3.45Å; C254-C269 WeakPolarHBondContact SG-CB 3.06Å; C254-C269 CovalentContact SG-SG 2Å; C254-C269 PolarHBondContact SG-SG 3.05Å
255	R	88.3	Confident	77.3	Confident	105 Å²	105	77.8 Å²	77.8	40%	0.396	41%	0.408	S	S	.	.			trans	-73.1	131.1	166.9	-60.9	-176.7	69.2	-168.5	-4.7	107.9	M257 S282 L284 W286	R255-M257 PolarHBondContact O-N 3.33Å; R255-S282 WeakPolarHBondContact CD-O 3.11Å; R255-S282 PolarHBondContact NH1-O 2.04Å; R255-L284 PolarHBondContact N-O 2.77Å; R255-W286 HydrophobicContact CG-CD2 3.8Å; R255-W286 HydrophobicContact CG-CE3 4.21Å; R255-W286 HydrophobicContact CG-CG 4.15Å; R255-W286 HydrophobicContact CG-CZ2 4.17Å
256	Q	70.6	Confident	76.3	Confident	175 Å²	175	80.3 Å²	80.3	82%	0.818	42%	0.422	S	S	*	.			trans	-65.9	110.2	167.8	-68.4	-177.3	26.2	0	0	107.6	N258	Q256-N258 PolarHBondContact O-N 3Å; Q256-N258 PolarHBondContact O-OD1 3.47Å
257	M	58.1	Low	75.6	Confident	117 Å²	117	83.1 Å²	83.1	58%	0.576	44%	0.437	S	S	*	.			trans	-82.8	109.7	169.6	-67.7	179.3	170.2	0	0	106.5	R255 D259 R283 L284	R255-M257 PolarHBondContact O-N 3.33Å; M257-D259 PolarHBondContact O-N 2.99Å; M257-R283 WeakPolarHBondContact CE-O 3.37Å; M257-L284 HydrophobicContact CE-CD2 3.87Å
258	N	52.8	Low	75	Confident	153 Å²	153	86 Å²	86	82%	0.818	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	17.1	-171.9	-61.4	-10.5	0	0	0	114.9	Q256	Q256-N258 PolarHBondContact O-N 3Å; Q256-N258 PolarHBondContact O-OD1 3.47Å
259	D	54.5	Low	74.8	Confident	153 Å²	153	86.7 Å²	86.7	82%	0.818	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	2.1	-162.1	-116.3	-23.6	0	0	0	115.9	M257	M257-D259 PolarHBondContact O-N 2.99Å
260	I	56.1	Low	74.6	Confident	130 Å²	130	86.5 Å²	86.5	67%	0.667	46%	0.46	S	S	*	.	S	Bend	trans	-141.3	100	177.6	-53.1	178.2	0	0	0	110.4	V262	I260-V262 PolarHBondContact O-N 3.41Å
261	S	53.6	Low	74.5	Confident	83 Å²	83	90.9 Å²	90.9	58%	0.58	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.3	68.8	161.8	64.1	0	0	0	0	116.1	N263	S261-N263 PolarHBondContact O-N 2.92Å
262	V	59.7	Low	74.6	Confident	142 Å²	142	88.5 Å²	88.5	86%	0.861	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.4	-14.5	153.1	-169.7	0	0	0	0	121.1	I260	I260-V262 PolarHBondContact O-N 3.41Å
263	N	60.2	Low	74.6	Confident	150 Å²	150	88.3 Å²	88.3	80%	0.802	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.9	10.9	-171.8	-80.5	-29.4	0	0	0	115.6	S261	S261-N263 PolarHBondContact O-N 2.92Å
264	I	63.7	Low	74.7	Confident	129 Å²	129	89.2 Å²	89.2	66%	0.662	48%	0.481	S	S	*	.			trans	-103.4	102	176.8	-54.7	176.9	0	0	0	109.9	N266	I264-N266 PolarHBondContact O-N 3.49Å
265	I	64.8	Low	74.8	Confident	114 Å²	114	96 Å²	96	59%	0.585	51%	0.509	S	S	*	.			trans	-73.6	117.8	172.8	-61.1	167.9	0	0	0	108	Y251 T267	Y251-I265 HydrophobicContact CD2-CG2 4.05Å; I265-T267 VanDerWaalsContact C-N 3.35Å; I265-T267 HydrophobicContact CG2-CG2 4.36Å; I265-T267 PolarHBondContact O-N 3.3Å
266	N	72	Confident	75.1	Confident	92 Å²	92	94 Å²	94	49%	0.492	51%	0.505	S	S	.	.			trans	-73	90.3	171.9	-177.2	-0.9	0	0	0	109.7	C254 I264 S268 C269	C254-N266 PolarHBondContact SG-O 3.5Å; I264-N266 PolarHBondContact O-N 3.49Å; N266-S268 PolarHBondContact O-N 2.79Å; N266-S268 VanDerWaalsContact O-N 3.17Å; N266-S268 WeakPolarHBondContact OD1-CA 3.35Å; N266-S268 WeakPolarHBondContact OD1-CB 3.33Å; N266-S268 PolarHBondContact OD1-N 3.46Å; N266-C269 HydrophobicContact CB-CB 4.44Å; N266-C269 PolarHBondContact O-N 3.48Å; N266-C269 PolarHBondContact OD1-N 3.38Å
267	T	79.3	Confident	76.2	Confident	87 Å²	87	89.7 Å²	89.7	53%	0.534	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.4	176.6	52.4	0	0	0	0	113.3	I265	I265-T267 VanDerWaalsContact C-N 3.35Å; I265-T267 HydrophobicContact CG2-CG2 4.36Å; I265-T267 PolarHBondContact O-N 3.3Å
268	S	84.8	Confident	77.9	Confident	68 Å²	68	88.3 Å²	88.3	48%	0.476	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-2	-177.8	-59.6	0	0	0	0	114	N266 G270 F271	N266-S268 PolarHBondContact O-N 2.79Å; N266-S268 VanDerWaalsContact O-N 3.17Å; N266-S268 WeakPolarHBondContact OD1-CA 3.35Å; N266-S268 WeakPolarHBondContact OD1-CB 3.33Å; N266-S268 PolarHBondContact OD1-N 3.46Å; S268-G270 PolarHBondContact O-N 3.13Å; S268-G270 VanDerWaalsContact O-N 3.13Å; S268-F271 WeakPolarHBondContact O-CD2 3.41Å; S268-F271 PolarHBondContact O-N 2.89Å; S268-F271 VanDerWaalsContact O-N 3.17Å
269	C	89.7	Confident	79.9	Confident	16 Å²	16	84.2 Å²	84.2	11%	0.108	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-29.4	-175.8	104.2	0	0	0	0	112.8	C254 N266 F271 V273	C254-C269 WeakPolarHBondContact CA-SG 3.39Å; C254-C269 HydrophobicContact CB-CB 3.99Å; C254-C269 WeakPolarHBondContact CB-SG 3.45Å; C254-C269 WeakPolarHBondContact SG-CB 3.06Å; C254-C269 CovalentContact SG-SG 2Å; C254-C269 PolarHBondContact SG-SG 3.05Å; N266-C269 HydrophobicContact CB-CB 4.44Å; N266-C269 PolarHBondContact O-N 3.48Å; N266-C269 PolarHBondContact OD1-N 3.38Å; C269-F271 VanDerWaalsContact C-N 3.3Å; C269-F271 PolarHBondContact O-N 3.23Å; C269-V273 VanDerWaalsContact O-CG1 3.26Å; C269-V273 WeakPolarHBondContact O-CG1 3.08Å
270	G	91.2	Very high	81.8	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.01	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5	-176.1	0	0	0	0	0	113.9	G248 V249 S268 G272 V273	G248-G270 CarbonylContact C-O 3.58Å; G248-G270 WeakPolarHBondContact CA-O 3.43Å; V249-G270 PolarHBondContact N-O 2.91Å; S268-G270 PolarHBondContact O-N 3.13Å; S268-G270 VanDerWaalsContact O-N 3.13Å; G270-G272 PolarHBondContact O-N 3.49Å; G270-V273 WeakPolarHBondContact O-CG2 3.47Å
271	F	93.1	Very high	83.6	Confident	95 Å²	95	75.1 Å²	75.1	42%	0.417	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	125.9	-172.8	-79.9	-122.1	0	0	0	111.4	E245 S268 C269 V273	E245-F271 HydrophobicContact CG-CE1 4.03Å; E245-F271 HydrophobicContact CG-CE2 4.15Å; E245-F271 HydrophobicContact CG-CZ 3.62Å; S268-F271 WeakPolarHBondContact O-CD2 3.41Å; S268-F271 PolarHBondContact O-N 2.89Å; S268-F271 VanDerWaalsContact O-N 3.17Å; C269-F271 VanDerWaalsContact C-N 3.3Å; C269-F271 PolarHBondContact O-N 3.23Å; F271-V273 PolarHBondContact O-N 2.63Å; F271-V273 VanDerWaalsContact O-N 3.12Å
272	G	93.3	Very high	85.5	Confident	26 Å²	26	73 Å²	73	27%	0.268	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	5.5	175.9	0	0	0	0	0	115.8	C247 G270 Q274 K275	C247-G272 CarbonylContact O-C 3.17Å; C247-G272 VanDerWaalsContact O-CA 3.25Å; C247-G272 WeakPolarHBondContact O-CA 3.23Å; G270-G272 PolarHBondContact O-N 3.49Å; G272-Q274 PolarHBondContact O-N 3.08Å; G272-Q274 VanDerWaalsContact O-N 3.16Å; G272-K275 WeakPolarHBondContact O-CB 3.36Å; G272-K275 PolarHBondContact O-N 2.95Å
273	V	94.5	Very high	87	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-62.9	-25	-174.4	-59.5	0	0	0	0	113.5	Y226 C247 V249 C269 G270 F271 K275 L276 L284 V285	Y226-V273 HydrophobicContact CD2-CG2 4.45Å; C247-V273 PolarHBondContact O-N 3.42Å; V249-V273 HydrophobicContact CB-CG2 4.24Å; V249-V273 HydrophobicContact CG1-CG2 3.7Å; V249-V273 HydrophobicContact CG2-CG2 3.69Å; C269-V273 VanDerWaalsContact O-CG1 3.26Å; C269-V273 WeakPolarHBondContact O-CG1 3.08Å; G270-V273 WeakPolarHBondContact O-CG2 3.47Å; F271-V273 PolarHBondContact O-N 2.63Å; F271-V273 VanDerWaalsContact O-N 3.12Å; V273-K275 PolarHBondContact O-N 3.1Å; V273-L276 HydrophobicContact CG1-CD1 4.46Å; V273-L276 WeakPolarHBondContact O-CB 3.32Å; V273-L276 PolarHBondContact O-N 3.09Å; V273-L276 VanDerWaalsContact O-N 3.16Å; V273-L284 HydrophobicContact CG1-CD1 4.27Å; V273-V285 HydrophobicContact CB-CG2 4.46Å; V273-V285 HydrophobicContact CG1-CG1 4.18Å; V273-V285 HydrophobicContact CG2-CG1 4.49Å; V273-V285 HydrophobicContact CG2-CG2 4.32Å
274	Q	95.6	Very high	88.4	Confident	18 Å²	18	70.6 Å²	70.6	8%	0.084	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-68.5	-15.2	176.5	-61.1	-172.5	64	0	0	112.8	L227 T230 F235 C247 G248 V249 G272	L227-Q274 HydrophobicContact CD2-CB 4.16Å; L227-Q274 HydrophobicContact CD2-CG 4.33Å; L227-Q274 PolarHBondContact O-OE1 3.3Å; T230-Q274 PolarHBondContact OG1-OE1 2.95Å; F235-Q274 PolarHBondContact O-NE2 2.91Å; C247-Q274 HydrophobicContact CB-CB 4.25Å; C247-Q274 VanDerWaalsContact O-CB 3.25Å; C247-Q274 WeakPolarHBondContact O-CB 2.85Å; C247-Q274 WeakPolarHBondContact O-CG 3.26Å; C247-Q274 PolarHBondContact O-N 2.97Å; G248-Q274 PolarHBondContact O-NE2 3.29Å; V249-Q274 HydrophobicContact CG1-CG 4.33Å; G272-Q274 PolarHBondContact O-N 3.08Å; G272-Q274 VanDerWaalsContact O-N 3.16Å
275	K	94.5	Very high	89.9	Confident	163 Å²	163	64.5 Å²	64.5	71%	0.709	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-89	-15.5	174.6	-62.4	178.4	-178.3	172.7	0	113.3	C247 G272 V273	C247-K275 HydrophobicContact CB-CD 4.26Å; C247-K275 HydrophobicContact CB-CG 3.93Å; C247-K275 WeakPolarHBondContact SG-CE 3.44Å; G272-K275 WeakPolarHBondContact O-CB 3.36Å; G272-K275 PolarHBondContact O-N 2.95Å; V273-K275 PolarHBondContact O-N 3.1Å
276	L	94.6	Very high	91.3	Very high	63 Å²	63	62.2 Å²	62.2	33%	0.33	33%	0.333	S	S	.	.	S	Bend	trans	-78.8	158.2	-177.9	-61	179.1	0	0	0	110.9	V273 E280 A281 L284	V273-L276 HydrophobicContact CG1-CD1 4.46Å; V273-L276 WeakPolarHBondContact O-CB 3.32Å; V273-L276 PolarHBondContact O-N 3.09Å; V273-L276 VanDerWaalsContact O-N 3.16Å; L276-E280 HydrophobicContact CB-CB 4.06Å; L276-E280 HydrophobicContact CD1-CB 4.4Å; L276-A281 HydrophobicContact CB-CB 4.4Å; L276-L284 HydrophobicContact CD1-CD1 3.66Å
277	T	95.2	Very high	92.4	Very high	83 Å²	83	59.7 Å²	59.7	51%	0.509	32%	0.321	S	S	.	.			trans	-65.8	152.3	168	65.6	0	0	0	0	109.9	A279 E280 A281	T277-A279 PolarHBondContact O-N 3.39Å; T277-A279 VanDerWaalsContact O-N 3.11Å; T277-E280 WeakPolarHBondContact CB-OE2 3.02Å; T277-E280 WeakPolarHBondContact CG2-OE2 3.26Å; T277-E280 PolarHBondContact N-OE2 3.42Å; T277-E280 PolarHBondContact O-N 3.31Å; T277-E280 VanDerWaalsContact OG1-CD 3.25Å; T277-E280 VanDerWaalsContact OG1-CG 3.32Å; T277-E280 WeakPolarHBondContact OG1-CG 2.97Å; T277-E280 PolarHBondContact OG1-N 3.12Å; T277-E280 PolarHBondContact OG1-OE2 3.22Å; T277-A281 PolarHBondContact O-N 2.97Å
278	T	93.6	Very high	93.2	Very high	89 Å²	89	58.9 Å²	58.9	55%	0.546	32%	0.316	S	S	.	.	H	α-helix	trans	-55.3	-33.8	179	-45.7	0	0	0	0	112.4	S282 T287	T278-S282 VanDerWaalsContact O-CB 3.28Å; T278-S282 WeakPolarHBondContact O-CB 3.36Å; T278-S282 PolarHBondContact O-N 3.49Å; T278-S282 PolarHBondContact O-OG 3.35Å; T278-S282 VanDerWaalsContact O-OG 3.08Å; T278-T287 HydrophobicContact CG2-CG2 4.39Å
279	A	94.2	Very high	93.7	Very high	67 Å²	67	55.7 Å²	55.7	55%	0.554	29%	0.294	S	S	*	.	H	α-helix	trans	-65.9	-36.8	176.8	0	0	0	0	0	112.8	T277 S282	T277-A279 PolarHBondContact O-N 3.39Å; T277-A279 VanDerWaalsContact O-N 3.11Å; A279-S282 PolarHBondContact O-OG 3.17Å
280	E	94.1	Very high	94.1	Very high	92 Å²	92	55.2 Å²	55.2	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-78.2	-44.3	175.2	-68	163.3	139.2	0	0	111.2	L276 T277 S282 R283	L276-E280 HydrophobicContact CB-CB 4.06Å; L276-E280 HydrophobicContact CD1-CB 4.4Å; T277-E280 WeakPolarHBondContact CB-OE2 3.02Å; T277-E280 WeakPolarHBondContact CG2-OE2 3.26Å; T277-E280 PolarHBondContact N-OE2 3.42Å; T277-E280 PolarHBondContact O-N 3.31Å; T277-E280 VanDerWaalsContact OG1-CD 3.25Å; T277-E280 VanDerWaalsContact OG1-CG 3.32Å; T277-E280 WeakPolarHBondContact OG1-CG 2.97Å; T277-E280 PolarHBondContact OG1-N 3.12Å; T277-E280 PolarHBondContact OG1-OE2 3.22Å; E280-S282 VanDerWaalsContact C-N 3.33Å; E280-S282 PolarHBondContact O-N 3.38Å; E280-R283 WeakPolarHBondContact O-CB 3.43Å; E280-R283 PolarHBondContact O-N 2Å; E280-R283 VanDerWaalsContact O-N 3.13Å
281	A	94	Very high	94.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-58.9	-42.7	179	0	0	0	0	0	111.9	Y226 L276 T277 R283 L284 V285 T287	Y226-A281 HydrophobicContact CE2-CB 4.08Å; L276-A281 HydrophobicContact CB-CB 4.4Å; T277-A281 PolarHBondContact O-N 2.97Å; A281-R283 PolarHBondContact O-N 3.27Å; A281-R283 VanDerWaalsContact O-N 3.09Å; A281-L284 PolarHBondContact O-N 3.17Å; A281-V285 HydrophobicContact CB-CG2 4.49Å; A281-V285 WeakPolarHBondContact O-CG2 3.49Å; A281-V285 PolarHBondContact O-N 3.06Å; A281-T287 HydrophobicContact CB-CG2 4.26Å
282	S	92.9	Very high	94.4	Very high	39 Å²	39	54.3 Å²	54.3	27%	0.273	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-18.3	178.5	63	0	0	0	0	114.7	R255 T278 A279 E280	R255-S282 WeakPolarHBondContact CD-O 3.11Å; R255-S282 PolarHBondContact NH1-O 2.04Å; T278-S282 VanDerWaalsContact O-CB 3.28Å; T278-S282 WeakPolarHBondContact O-CB 3.36Å; T278-S282 PolarHBondContact O-N 3.49Å; T278-S282 PolarHBondContact O-OG 3.35Å; T278-S282 VanDerWaalsContact O-OG 3.08Å; A279-S282 PolarHBondContact O-OG 3.17Å; E280-S282 VanDerWaalsContact C-N 3.33Å; E280-S282 PolarHBondContact O-N 3.38Å
283	R	90.8	Very high	94.5	Very high	184 Å²	184	53.6 Å²	53.6	69%	0.694	28%	0.281	S	S	*	.	H	α-helix	trans	-78.1	-25.9	173.2	-64.7	179.9	176.4	172.6	-1	112.5	M257 E280 A281	M257-R283 WeakPolarHBondContact CE-O 3.37Å; E280-R283 WeakPolarHBondContact O-CB 3.43Å; E280-R283 PolarHBondContact O-N 2Å; E280-R283 VanDerWaalsContact O-N 3.13Å; A281-R283 PolarHBondContact O-N 3.27Å; A281-R283 VanDerWaalsContact O-N 3.09Å
284	L	91.1	Very high	94.4	Very high	57 Å²	57	57.2 Å²	57.2	30%	0.298	30%	0.3	S	S	.	.	H	α-helix	trans	-102.3	-43.4	-173.8	-62.1	170.2	0	0	0	112.3	R255 M257 V273 L276 A281	R255-L284 PolarHBondContact N-O 2.77Å; M257-L284 HydrophobicContact CE-CD2 3.87Å; V273-L284 HydrophobicContact CG1-CD1 4.27Å; L276-L284 HydrophobicContact CD1-CD1 3.66Å; A281-L284 PolarHBondContact O-N 3.17Å
285	V	94.3	Very high	94.3	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-130.6	158.4	-172.8	-61.6	0	0	0	0	111.1	V249 C253 V273 A281 T287	V249-V285 HydrophobicContact CG2-CB 4.46Å; V249-V285 HydrophobicContact CG2-CG1 3.81Å; C253-V285 HydrophobicContact CB-CB 4.42Å; C253-V285 WeakPolarHBondContact O-CA 3.46Å; C253-V285 WeakPolarHBondContact O-CB 2.96Å; V273-V285 HydrophobicContact CB-CG2 4.46Å; V273-V285 HydrophobicContact CG1-CG1 4.18Å; V273-V285 HydrophobicContact CG2-CG1 4.49Å; V273-V285 HydrophobicContact CG2-CG2 4.32Å; A281-V285 HydrophobicContact CB-CG2 4.49Å; A281-V285 WeakPolarHBondContact O-CG2 3.49Å; A281-V285 PolarHBondContact O-N 3.06Å; V285-T287 PolarHBondContact O-N 3.35Å
286	W	95.2	Very high	94.3	Very high	66 Å²	66	52.5 Å²	52.5	25%	0.25	29%	0.288	C	S	.	.			trans	-66.7	125.7	167.6	-62.3	116.6	0	0	0	109.5	N219 C221 C253 R255	N219-W286 VanDerWaalsContact C-CG 3.42Å; N219-W286 HydrophobicContact CB-CD2 3.84Å; N219-W286 VanDerWaalsContact CB-CE2 3.48Å; N219-W286 HydrophobicContact CB-CE3 4.3Å; N219-W286 HydrophobicContact CB-CG 4.32Å; N219-W286 HydrophobicContact CB-CH2 4.14Å; N219-W286 HydrophobicContact CB-CZ2 3.66Å; N219-W286 HydrophobicContact CB-CZ3 4.43Å; N219-W286 WeakPolarHBondContact O-CB 3.49Å; N219-W286 VanDerWaalsContact O-CD2 3.31Å; N219-W286 VanDerWaalsContact OD1-CZ2 3.26Å; N219-W286 WeakPolarHBondContact OD1-CZ2 3.4Å; N219-W286 PolarHBondContact OD1-NE1 2.92Å; C221-W286 HydrophobicContact CB-CB 4.43Å; C221-W286 WeakPolarHBondContact CB-O 3.17Å; C253-W286 PolarHBondContact O-N 2.93Å; R255-W286 HydrophobicContact CG-CD2 3.8Å; R255-W286 HydrophobicContact CG-CE3 4.21Å; R255-W286 HydrophobicContact CG-CG 4.15Å; R255-W286 HydrophobicContact CG-CZ2 4.17Å
287	T	95.3	Very high	94.2	Very high	39 Å²	39	52.4 Å²	52.4	24%	0.239	29%	0.287	C	S	.	.			trans	-96.8	-14.3	179.4	51.9	0	0	0	0	113.2	Y226 T278 A281 V285	Y226-T287 HydrophobicContact CD1-CG2 3.85Å; Y226-T287 HydrophobicContact CE1-CG2 3.88Å; T278-T287 HydrophobicContact CG2-CG2 4.39Å; A281-T287 HydrophobicContact CB-CG2 4.26Å; V285-T287 PolarHBondContact O-N 3.35Å
288	T	95.3	Very high	94.1	Very high	70 Å²	70	50.8 Å²	50.8	43%	0.429	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-72.1	132.4	178.3	-49.9	0	0	0	0	110.3	C220 C221 D292 A293	C220-T288 CarbonylContact C-O 3.32Å; C220-T288 WeakPolarHBondContact CA-O 3.36Å; C220-T288 WeakPolarHBondContact CB-O 3.41Å; C221-T288 PolarHBondContact N-O 3.04Å; T288-D292 HydrophobicContact CG2-CB 4.37Å; T288-A293 HydrophobicContact CG2-CB 4.28Å
289	G	96.2	Very high	94	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	27%	0.274	C	S	.	.			trans	-65.3	149.8	172.5	0	0	0	0	0	112.4	P223 K224 V291 D292 A293	P223-G289 CarbonylContact O-C 3.55Å; K224-G289 VanDerWaalsContact C-CA 3.43Å; K224-G289 WeakPolarHBondContact O-CA 3.44Å; K224-G289 PolarHBondContact O-N 2.64Å; G289-V291 VanDerWaalsContact C-N 3.32Å; G289-V291 PolarHBondContact O-N 3.44Å; G289-D292 PolarHBondContact O-N 2.89Å; G289-A293 WeakPolarHBondContact O-CB 3.42Å; G289-A293 PolarHBondContact O-N 2.78Å
290	C	96.5	Very high	94	Very high	6 Å²	6	54.1 Å²	54.1	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-69.1	-29.9	-179.7	-65	0	0	0	0	113.2	I214 C220 G222 P223 L294	I214-C290 HydrophobicContact CG2-CB 4.47Å; C220-C290 HydrophobicContact CB-CB 3.87Å; C220-C290 WeakPolarHBondContact CB-SG 3.21Å; C220-C290 WeakPolarHBondContact SG-CA 3.43Å; C220-C290 WeakPolarHBondContact SG-CB 3.24Å; C220-C290 CovalentContact SG-SG 2.04Å; C220-C290 PolarHBondContact SG-SG 3.06Å; G222-C290 WeakPolarHBondContact O-CB 3.45Å; G222-C290 PolarHBondContact O-N 2.81Å; G222-C290 PolarHBondContact O-SG 2.99Å; G222-C290 VanDerWaalsContact O-SG 3.33Å; P223-C290 PolarHBondContact O-N 3.07Å; P223-C290 VanDerWaalsContact O-N 3.16Å; C290-L294 VanDerWaalsContact O-CB 3.3Å; C290-L294 WeakPolarHBondContact O-CB 3.28Å; C290-L294 PolarHBondContact O-N 3.22Å
291	V	95.4	Very high	94.1	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-67.4	-47.2	174.4	178.9	0	0	0	0	110.4	I184 L187 E188 I191 P223 G289 A293 L294 V295	I184-V291 HydrophobicContact CG2-CG1 3.81Å; L187-V291 HydrophobicContact CD2-CG1 4.15Å; L187-V291 HydrophobicContact CD2-CG2 4.28Å; L187-V291 HydrophobicContact CG-CG2 4.15Å; E188-V291 HydrophobicContact CG-CB 4.04Å; E188-V291 HydrophobicContact CG-CG1 4.2Å; E188-V291 HydrophobicContact CG-CG2 3.85Å; I191-V291 HydrophobicContact CD1-CG2 3.71Å; P223-V291 WeakPolarHBondContact O-CG2 3.47Å; P223-V291 PolarHBondContact O-N 2.03Å; G289-V291 VanDerWaalsContact C-N 3.32Å; G289-V291 PolarHBondContact O-N 3.44Å; V291-A293 PolarHBondContact O-N 3.44Å; V291-L294 PolarHBondContact O-N 3.37Å; V291-V295 VanDerWaalsContact O-CG2 3.29Å; V291-V295 WeakPolarHBondContact O-CG2 3.31Å; V291-V295 PolarHBondContact O-N 2.88Å
292	D	95.2	Very high	94	Very high	74 Å²	74	57.5 Å²	57.5	40%	0.396	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-40.6	177.1	-71.7	-26	0	0	0	112.3	T288 G289 L294 V295 S296	T288-D292 HydrophobicContact CG2-CB 4.37Å; G289-D292 PolarHBondContact O-N 2.89Å; D292-L294 PolarHBondContact O-N 3.49Å; D292-V295 PolarHBondContact O-N 3.19Å; D292-S296 WeakPolarHBondContact O-CB 3.39Å; D292-S296 PolarHBondContact O-N 3.41Å
293	A	95.7	Very high	94.1	Very high	11 Å²	11	61 Å²	61	9%	0.091	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-45.3	175.1	0	0	0	0	0	111.4	L218 C220 T288 G289 V291 S296 I297	L218-A293 HydrophobicContact CB-CB 4.38Å; C220-A293 HydrophobicContact CB-CB 3.89Å; T288-A293 HydrophobicContact CG2-CB 4.28Å; G289-A293 WeakPolarHBondContact O-CB 3.42Å; G289-A293 PolarHBondContact O-N 2.78Å; V291-A293 PolarHBondContact O-N 3.44Å; A293-S296 PolarHBondContact O-N 2.91Å; A293-I297 WeakPolarHBondContact O-CD1 3.3Å; A293-I297 VanDerWaalsContact O-CG1 3.3Å; A293-I297 WeakPolarHBondContact O-CG1 3.48Å; A293-I297 PolarHBondContact O-N 3.09Å
294	L	93.7	Very high	94.2	Very high	76 Å²	76	60.5 Å²	60.5	40%	0.398	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-46.3	176.6	-180	62.6	0	0	0	111.7	L218 C290 V291 D292 S296 I297 V298	L218-L294 HydrophobicContact CD1-CB 4.28Å; C290-L294 VanDerWaalsContact O-CB 3.3Å; C290-L294 WeakPolarHBondContact O-CB 3.28Å; C290-L294 PolarHBondContact O-N 3.22Å; V291-L294 PolarHBondContact O-N 3.37Å; D292-L294 PolarHBondContact O-N 3.49Å; L294-S296 VanDerWaalsContact C-N 3.34Å; L294-S296 PolarHBondContact O-N 2.92Å; L294-I297 PolarHBondContact O-N 3.13Å; L294-V298 WeakPolarHBondContact O-CG2 3.49Å; L294-V298 PolarHBondContact O-N 3.16Å
295	V	93.2	Very high	94.2	Very high	28 Å²	28	61.6 Å²	61.6	17%	0.17	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-45.9	176.8	167.4	0	0	0	0	110.7	I184 V291 D292 I297 V298 E299	I184-V295 HydrophobicContact CD1-CG2 4.12Å; I184-V295 HydrophobicContact CG1-CG2 4.37Å; V291-V295 VanDerWaalsContact O-CG2 3.29Å; V291-V295 WeakPolarHBondContact O-CG2 3.31Å; V291-V295 PolarHBondContact O-N 2.88Å; D292-V295 PolarHBondContact O-N 3.19Å; V295-I297 VanDerWaalsContact C-N 3.33Å; V295-I297 PolarHBondContact O-N 2.87Å; V295-V298 PolarHBondContact O-N 2.83Å; V295-E299 HydrophobicContact CG1-CG 4.35Å; V295-E299 WeakPolarHBondContact O-CB 3.3Å; V295-E299 WeakPolarHBondContact O-CG 3.46Å; V295-E299 PolarHBondContact O-N 3.43Å
296	S	94.4	Very high	94	Very high	54 Å²	54	63.9 Å²	63.9	38%	0.378	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-39.5	177.8	-174.5	0	0	0	0	112.2	D292 A293 L294 E299 N300	D292-S296 WeakPolarHBondContact O-CB 3.39Å; D292-S296 PolarHBondContact O-N 3.41Å; A293-S296 PolarHBondContact O-N 2.91Å; L294-S296 VanDerWaalsContact C-N 3.34Å; L294-S296 PolarHBondContact O-N 2.92Å; S296-E299 PolarHBondContact O-N 2.9Å; S296-N300 VanDerWaalsContact O-CB 3.28Å; S296-N300 WeakPolarHBondContact O-CB 3.24Å; S296-N300 PolarHBondContact O-N 3.4Å; S296-N300 PolarHBondContact O-ND2 3.42Å; S296-N300 PolarHBondContact OG-ND2 3.33Å
297	I	92.9	Very high	94	Very high	61 Å²	61	68.9 Å²	68.9	31%	0.313	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-45.1	175	-73.1	162.2	0	0	0	111	L218 A293 L294 V295 N301 F305	L218-I297 HydrophobicContact CD2-CD1 3.53Å; A293-I297 WeakPolarHBondContact O-CD1 3.3Å; A293-I297 VanDerWaalsContact O-CG1 3.3Å; A293-I297 WeakPolarHBondContact O-CG1 3.48Å; A293-I297 PolarHBondContact O-N 3.09Å; L294-I297 PolarHBondContact O-N 3.13Å; V295-I297 VanDerWaalsContact C-N 3.33Å; V295-I297 PolarHBondContact O-N 2.87Å; I297-N301 WeakPolarHBondContact O-CB 3.36Å; I297-N301 PolarHBondContact O-N 3.1Å; I297-N301 VanDerWaalsContact O-N 3.09Å; I297-N301 PolarHBondContact O-ND2 3Å; I297-F305 HydrophobicContact CG2-CE2 4.21Å; I297-F305 HydrophobicContact CG2-CZ 4.35Å
298	V	91.5	Very high	93.8	Very high	49 Å²	49	68.6 Å²	68.6	30%	0.297	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-44.6	178.5	172.1	0	0	0	0	110.9	L294 V295 N301 I302 F305	L294-V298 WeakPolarHBondContact O-CG2 3.49Å; L294-V298 PolarHBondContact O-N 3.16Å; V295-V298 PolarHBondContact O-N 2.83Å; V298-N301 CarbonylContact O-C 3.1Å; V298-N301 PolarHBondContact O-N 2.85Å; V298-I302 WeakPolarHBondContact O-CA 3.45Å; V298-I302 WeakPolarHBondContact O-CB 3.14Å; V298-I302 PolarHBondContact O-N 3.31Å; V298-F305 HydrophobicContact CB-CD2 4.36Å; V298-F305 HydrophobicContact CB-CE2 4.39Å; V298-F305 HydrophobicContact CG1-CD2 4.35Å; V298-F305 HydrophobicContact CG1-CG 4.43Å; V298-F305 HydrophobicContact CG2-CD1 4.42Å; V298-F305 HydrophobicContact CG2-CD2 4.21Å; V298-F305 HydrophobicContact CG2-CE1 4.18Å; V298-F305 HydrophobicContact CG2-CE2 3.97Å; V298-F305 HydrophobicContact CG2-CG 4.43Å; V298-F305 HydrophobicContact CG2-CZ 3.95Å
299	E	92.4	Very high	93.6	Very high	101 Å²	101	71.5 Å²	71.5	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-42.8	179.7	-73.7	177.1	168.9	0	0	112.1	R180 V295 S296 N301	R180-E299 IonicContact CZ-OE1 3.75Å; R180-E299 IonicContact NE-OE1 3.89Å; R180-E299 IonicContact NH2-OE1 2.83Å; R180-E299 PolarHBondContact NH2-OE1 2.88Å; V295-E299 HydrophobicContact CG1-CG 4.35Å; V295-E299 WeakPolarHBondContact O-CB 3.3Å; V295-E299 WeakPolarHBondContact O-CG 3.46Å; V295-E299 PolarHBondContact O-N 3.43Å; S296-E299 PolarHBondContact O-N 2.9Å; E299-N301 PolarHBondContact O-N 3.11Å
300	N	95.1	Very high	93.5	Very high	125 Å²	125	75.9 Å²	75.9	67%	0.668	40%	0.397	S	S	*	.	H	α-helix	trans	-67.6	-25.6	177.5	-71.1	-29.5	0	0	0	112.9	S296	S296-N300 VanDerWaalsContact O-CB 3.28Å; S296-N300 WeakPolarHBondContact O-CB 3.24Å; S296-N300 PolarHBondContact O-N 3.4Å; S296-N300 PolarHBondContact O-ND2 3.42Å; S296-N300 PolarHBondContact OG-ND2 3.33Å
301	N	94.2	Very high	93.4	Very high	67 Å²	67	76.9 Å²	76.9	36%	0.358	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	27.2	-176.1	-64.8	-79	0	0	0	112.8	I297 V298 E299 V303 Y304 F305	I297-N301 WeakPolarHBondContact O-CB 3.36Å; I297-N301 PolarHBondContact O-N 3.1Å; I297-N301 VanDerWaalsContact O-N 3.09Å; I297-N301 PolarHBondContact O-ND2 3Å; V298-N301 CarbonylContact O-C 3.1Å; V298-N301 PolarHBondContact O-N 2.85Å; E299-N301 PolarHBondContact O-N 3.11Å; N301-V303 PolarHBondContact O-N 2.86Å; N301-Y304 HydrophobicContact CB-CD2 4.14Å; N301-Y304 PolarHBondContact O-N 3.38Å; N301-F305 HydrophobicContact CB-CD2 4.09Å; N301-F305 HydrophobicContact CB-CE2 4.07Å; N301-F305 WeakPolarHBondContact O-CD2 3.37Å; N301-F305 PolarHBondContact O-N 3.08Å
302	I	92.5	Very high	93.3	Very high	97 Å²	97	80.6 Å²	80.6	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-56.4	-32.6	-168.6	-167.3	168.7	0	0	0	113.1	V298 Y304 F305 A306	V298-I302 WeakPolarHBondContact O-CA 3.45Å; V298-I302 WeakPolarHBondContact O-CB 3.14Å; V298-I302 PolarHBondContact O-N 3.31Å; I302-Y304 PolarHBondContact O-N 3.35Å; I302-F305 PolarHBondContact O-N 3.43Å; I302-A306 WeakPolarHBondContact O-CB 3.39Å; I302-A306 PolarHBondContact O-N 2.88Å
303	V	94.7	Very high	93.3	Very high	111 Å²	111	78.4 Å²	78.4	67%	0.673	42%	0.419	S	S	*	.	H	α-helix	trans	-62.4	-43.4	178.1	179.8	0	0	0	0	111.7	N301 Y307	N301-V303 PolarHBondContact O-N 2.86Å; V303-Y307 WeakPolarHBondContact O-CB 3.26Å; V303-Y307 PolarHBondContact O-N 3.38Å
304	Y	93.8	Very high	93.3	Very high	175 Å²	175	81.3 Å²	81.3	69%	0.686	44%	0.435	S	S	*	.	H	α-helix	trans	-70.3	-42.1	179.9	-64.5	-66.9	0	0	0	111.6	N301 I302 Y307 G308	N301-Y304 HydrophobicContact CB-CD2 4.14Å; N301-Y304 PolarHBondContact O-N 3.38Å; I302-Y304 PolarHBondContact O-N 3.35Å; Y304-Y307 PolarHBondContact O-N 2.98Å; Y304-G308 PolarHBondContact O-N 3.08Å
305	F	90.7	Very high	93.3	Very high	80 Å²	80	84.9 Å²	84.9	35%	0.351	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-44.9	175.4	-78.5	-79.4	0	0	0	111.6	I297 V298 N301 I302 Y307 G308 F309	I297-F305 HydrophobicContact CG2-CE2 4.21Å; I297-F305 HydrophobicContact CG2-CZ 4.35Å; V298-F305 HydrophobicContact CB-CD2 4.36Å; V298-F305 HydrophobicContact CB-CE2 4.39Å; V298-F305 HydrophobicContact CG1-CD2 4.35Å; V298-F305 HydrophobicContact CG1-CG 4.43Å; V298-F305 HydrophobicContact CG2-CD1 4.42Å; V298-F305 HydrophobicContact CG2-CD2 4.21Å; V298-F305 HydrophobicContact CG2-CE1 4.18Å; V298-F305 HydrophobicContact CG2-CE2 3.97Å; V298-F305 HydrophobicContact CG2-CG 4.43Å; V298-F305 HydrophobicContact CG2-CZ 3.95Å; N301-F305 HydrophobicContact CB-CD2 4.09Å; N301-F305 HydrophobicContact CB-CE2 4.07Å; N301-F305 WeakPolarHBondContact O-CD2 3.37Å; N301-F305 PolarHBondContact O-N 3.08Å; I302-F305 PolarHBondContact O-N 3.43Å; F305-Y307 VanDerWaalsContact C-N 3.32Å; F305-Y307 PolarHBondContact O-N 3.12Å; F305-G308 WeakPolarHBondContact O-CA 2.88Å; F305-G308 PolarHBondContact O-N 3.2Å; F305-F309 WeakPolarHBondContact O-CD2 3.35Å; F305-F309 PolarHBondContact O-N 3.26Å
306	A	91.1	Very high	93.5	Very high	48 Å²	48	85 Å²	85	40%	0.397	45%	0.447	S	S	.	.	H	α-helix	trans	-59.5	-42.2	176.5	0	0	0	0	0	111.8	I302 G308 F309 V310	I302-A306 WeakPolarHBondContact O-CB 3.39Å; I302-A306 PolarHBondContact O-N 2.88Å; A306-G308 VanDerWaalsContact C-N 3.3Å; A306-G308 PolarHBondContact O-N 3.23Å; A306-F309 PolarHBondContact O-N 2.83Å; A306-V310 WeakPolarHBondContact O-CB 3.38Å; A306-V310 VanDerWaalsContact O-CG2 3.29Å; A306-V310 WeakPolarHBondContact O-CG2 3.5Å; A306-V310 PolarHBondContact O-N 3.44Å
307	Y	93.8	Very high	93.5	Very high	172 Å²	172	86.3 Å²	86.3	68%	0.675	45%	0.449	S	S	*	.	H	α-helix	trans	-59.3	-41.4	173.4	-179.2	-96.1	0	0	0	112	V303 Y304 F305 S311	V303-Y307 WeakPolarHBondContact O-CB 3.26Å; V303-Y307 PolarHBondContact O-N 3.38Å; Y304-Y307 PolarHBondContact O-N 2.98Å; F305-Y307 VanDerWaalsContact C-N 3.32Å; F305-Y307 PolarHBondContact O-N 3.12Å; Y307-S311 WeakPolarHBondContact CE1-OG 3.34Å; Y307-S311 VanDerWaalsContact O-CB 3.25Å; Y307-S311 WeakPolarHBondContact O-CB 3.29Å; Y307-S311 PolarHBondContact O-N 2.82Å; Y307-S311 PolarHBondContact O-OG 3.11Å
308	G	92.1	Very high	93.7	Very high	33 Å²	33	87.1 Å²	87.1	34%	0.34	45%	0.453	S	S	.	.	H	α-helix	trans	-58.4	-53.7	174.9	0	0	0	0	0	112.8	Y304 F305 A306 V310 S311 V312	Y304-G308 PolarHBondContact O-N 3.08Å; F305-G308 WeakPolarHBondContact O-CA 2.88Å; F305-G308 PolarHBondContact O-N 3.2Å; A306-G308 VanDerWaalsContact C-N 3.3Å; A306-G308 PolarHBondContact O-N 3.23Å; G308-V310 PolarHBondContact O-N 3.35Å; G308-S311 WeakPolarHBondContact O-CB 3.43Å; G308-S311 PolarHBondContact O-N 3.13Å; G308-V312 WeakPolarHBondContact O-CG2 3.4Å; G308-V312 PolarHBondContact O-N 3.28Å; G308-V312 VanDerWaalsContact O-N 3.08Å
309	F	90.8	Very high	93.9	Very high	131 Å²	131	85.6 Å²	85.6	58%	0.575	45%	0.446	S	S	*	.	H	α-helix	trans	-60.5	-46.5	178.9	-75.7	-71	0	0	0	112.5	F305 A306 S311 V312 A313	F305-F309 WeakPolarHBondContact O-CD2 3.35Å; F305-F309 PolarHBondContact O-N 3.26Å; A306-F309 PolarHBondContact O-N 2.83Å; F309-S311 VanDerWaalsContact C-N 3.3Å; F309-S311 PolarHBondContact O-N 2.88Å; F309-V312 PolarHBondContact O-N 3.42Å; F309-A313 PolarHBondContact O-N 2.87Å
310	V	93.5	Very high	94.1	Very high	92 Å²	92	81.7 Å²	81.7	56%	0.558	43%	0.428	S	S	*	.	H	α-helix	trans	-63.1	-38.9	178.2	173.2	0	0	0	0	111	A306 G308 A313 V314	A306-V310 WeakPolarHBondContact O-CB 3.38Å; A306-V310 VanDerWaalsContact O-CG2 3.29Å; A306-V310 WeakPolarHBondContact O-CG2 3.5Å; A306-V310 PolarHBondContact O-N 3.44Å; G308-V310 PolarHBondContact O-N 3.35Å; V310-A313 PolarHBondContact O-N 3.12Å; V310-V314 HydrophobicContact CG1-CG2 4.19Å; V310-V314 WeakPolarHBondContact O-CB 3.3Å; V310-V314 VanDerWaalsContact O-CG2 3.24Å; V310-V314 WeakPolarHBondContact O-CG2 3.5Å; V310-V314 PolarHBondContact O-N 2.77Å
311	S	94.8	Very high	94.2	Very high	28 Å²	28	80.2 Å²	80.2	20%	0.196	42%	0.42	C	S	.	.	H	α-helix	trans	-61.3	-47.6	177.4	-63.1	0	0	0	0	111.4	Y307 G308 F309 A313 V314 F315	Y307-S311 WeakPolarHBondContact CE1-OG 3.34Å; Y307-S311 VanDerWaalsContact O-CB 3.25Å; Y307-S311 WeakPolarHBondContact O-CB 3.29Å; Y307-S311 PolarHBondContact O-N 2.82Å; Y307-S311 PolarHBondContact O-OG 3.11Å; G308-S311 WeakPolarHBondContact O-CB 3.43Å; G308-S311 PolarHBondContact O-N 3.13Å; F309-S311 VanDerWaalsContact C-N 3.3Å; F309-S311 PolarHBondContact O-N 2.88Å; S311-A313 PolarHBondContact O-N 3.2Å; S311-V314 PolarHBondContact O-N 3.42Å; S311-F315 WeakPolarHBondContact O-CB 3.37Å; S311-F315 WeakPolarHBondContact O-CD2 3.45Å; S311-F315 PolarHBondContact O-N 3.38Å
312	V	93.4	Very high	94.3	Very high	80 Å²	80	79.4 Å²	79.4	49%	0.485	42%	0.415	S	S	.	.	H	α-helix	trans	-59	-48.6	177.8	174	0	0	0	0	110.9	G308 F309 V314 F315 Q316	G308-V312 WeakPolarHBondContact O-CG2 3.4Å; G308-V312 PolarHBondContact O-N 3.28Å; G308-V312 VanDerWaalsContact O-N 3.08Å; F309-V312 PolarHBondContact O-N 3.42Å; V312-V314 VanDerWaalsContact C-N 3.34Å; V312-V314 PolarHBondContact O-N 3.36Å; V312-F315 PolarHBondContact O-N 3.2Å; V312-Q316 WeakPolarHBondContact O-CB 3.43Å; V312-Q316 PolarHBondContact O-N 3.36Å
313	A	94.6	Very high	94.4	Very high	27 Å²	27	74.8 Å²	74.8	22%	0.223	39%	0.391	C	S	.	.	H	α-helix	trans	-59.1	-42.6	177.6	0	0	0	0	0	112.6	F166 F309 V310 S311 Q316 L317	F166-A313 HydrophobicContact CE2-CB 4.16Å; F309-A313 PolarHBondContact O-N 2.87Å; V310-A313 PolarHBondContact O-N 3.12Å; S311-A313 PolarHBondContact O-N 3.2Å; A313-Q316 PolarHBondContact O-N 3.17Å; A313-L317 WeakPolarHBondContact O-CB 3.46Å; A313-L317 PolarHBondContact O-N 3.5Å
314	V	95.7	Very high	94.5	Very high	72 Å²	72	75.2 Å²	75.2	44%	0.436	38%	0.384	S	S	.	.	H	α-helix	trans	-66.6	-45.3	177.3	169.3	0	0	0	0	111.2	V310 S311 V312 Q316 L317 I318	V310-V314 HydrophobicContact CG1-CG2 4.19Å; V310-V314 WeakPolarHBondContact O-CB 3.3Å; V310-V314 VanDerWaalsContact O-CG2 3.24Å; V310-V314 WeakPolarHBondContact O-CG2 3.5Å; V310-V314 PolarHBondContact O-N 2.77Å; S311-V314 PolarHBondContact O-N 3.42Å; V312-V314 VanDerWaalsContact C-N 3.34Å; V312-V314 PolarHBondContact O-N 3.36Å; V314-Q316 VanDerWaalsContact C-N 3.32Å; V314-Q316 PolarHBondContact O-N 3.46Å; V314-L317 PolarHBondContact O-N 3.37Å; V314-I318 HydrophobicContact CG1-CD1 3.78Å; V314-I318 HydrophobicContact CG1-CG1 4.41Å; V314-I318 VanDerWaalsContact O-CG1 3.28Å; V314-I318 WeakPolarHBondContact O-CG1 3.03Å; V314-I318 PolarHBondContact O-N 3.42Å
315	F	95	Very high	94.5	Very high	152 Å²	152	69.9 Å²	69.9	67%	0.667	37%	0.37	S	S	*	.	H	α-helix	trans	-60.4	-42.4	176.9	-83.5	-64.7	0	0	0	111.8	S311 V312 I318 A319	S311-F315 WeakPolarHBondContact O-CB 3.37Å; S311-F315 WeakPolarHBondContact O-CD2 3.45Å; S311-F315 PolarHBondContact O-N 3.38Å; V312-F315 PolarHBondContact O-N 3.2Å; F315-I318 PolarHBondContact O-N 3.41Å; F315-A319 PolarHBondContact O-N 3.23Å
316	Q	95.8	Very high	94.7	Very high	30 Å²	30	66 Å²	66	14%	0.14	35%	0.353	C	S	.	.	H	α-helix	trans	-65.3	-42.6	176.3	-175.3	165.9	-6.4	0	0	112	L162 F166 E169 V312 A313 V314 I318 A319 I320	L162-Q316 PolarHBondContact O-NE2 3.13Å; F166-Q316 HydrophobicContact CB-CG 4.4Å; F166-Q316 HydrophobicContact CD2-CG 4.45Å; E169-Q316 PolarHBondContact OE2-OE1 3.48Å; V312-Q316 WeakPolarHBondContact O-CB 3.43Å; V312-Q316 PolarHBondContact O-N 3.36Å; A313-Q316 PolarHBondContact O-N 3.17Å; V314-Q316 VanDerWaalsContact C-N 3.32Å; V314-Q316 PolarHBondContact O-N 3.46Å; Q316-I318 PolarHBondContact O-N 2.68Å; Q316-A319 PolarHBondContact O-N 2.89Å; Q316-I320 HydrophobicContact CG-CD1 4.16Å; Q316-I320 VanDerWaalsContact O-CG1 3.31Å; Q316-I320 WeakPolarHBondContact O-CG1 3.38Å; Q316-I320 PolarHBondContact O-N 2.97Å
317	L	96.3	Very high	94.8	Very high	81 Å²	81	65 Å²	65	42%	0.424	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-44.3	175.6	-178	62.9	0	0	0	111.6	A313 V314 A319 I320 L321	A313-L317 WeakPolarHBondContact O-CB 3.46Å; A313-L317 PolarHBondContact O-N 3.5Å; V314-L317 PolarHBondContact O-N 3.37Å; L317-A319 VanDerWaalsContact C-N 3.34Å; L317-A319 PolarHBondContact O-N 3.48Å; L317-I320 PolarHBondContact O-N 3.38Å; L317-L321 HydrophobicContact CD1-CG 4.45Å; L317-L321 HydrophobicContact CG-CD1 4.22Å; L317-L321 HydrophobicContact CG-CG 4.49Å; L317-L321 VanDerWaalsContact O-CG 3.29Å; L317-L321 WeakPolarHBondContact O-CG 3.48Å; L317-L321 PolarHBondContact O-N 3.5Å
318	I	96.1	Very high	94.8	Very high	79 Å²	79	59.8 Å²	59.8	41%	0.405	33%	0.326	S	S	.	.	H	α-helix	trans	-59.3	-46	175.2	-69	166.4	0	0	0	110.3	V314 F315 Q316 I320 L321 L322	V314-I318 HydrophobicContact CG1-CD1 3.78Å; V314-I318 HydrophobicContact CG1-CG1 4.41Å; V314-I318 VanDerWaalsContact O-CG1 3.28Å; V314-I318 WeakPolarHBondContact O-CG1 3.03Å; V314-I318 PolarHBondContact O-N 3.42Å; F315-I318 PolarHBondContact O-N 3.41Å; Q316-I318 PolarHBondContact O-N 2.68Å; I318-I320 VanDerWaalsContact C-N 3.34Å; I318-I320 PolarHBondContact O-N 2.93Å; I318-L321 PolarHBondContact O-N 2.89Å; I318-L322 HydrophobicContact CG2-CD1 3.78Å; I318-L322 HydrophobicContact CG2-CG 4.16Å; I318-L322 WeakPolarHBondContact O-CB 3.35Å; I318-L322 VanDerWaalsContact O-CG 3.26Å; I318-L322 WeakPolarHBondContact O-CG 3.42Å; I318-L322 PolarHBondContact O-N 2.93Å
319	A	95.9	Very high	94.9	Very high	17 Å²	17	60.4 Å²	60.4	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-42.4	177.8	0	0	0	0	0	112.3	L162 F315 Q316 L317 A323	L162-A319 HydrophobicContact CD1-CB 4.02Å; F315-A319 PolarHBondContact O-N 3.23Å; Q316-A319 PolarHBondContact O-N 2.89Å; L317-A319 VanDerWaalsContact C-N 3.34Å; L317-A319 PolarHBondContact O-N 3.48Å; A319-A323 VanDerWaalsContact O-CB 3.32Å; A319-A323 WeakPolarHBondContact O-CB 3.05Å; A319-A323 PolarHBondContact O-N 3.33Å
320	I	96.8	Very high	94.9	Very high	18 Å²	18	54.5 Å²	54.5	9%	0.092	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-47.1	175.1	-67.6	164.1	0	0	0	110.8	L162 F166 Q316 L317 I318 A323 K324	L162-I320 HydrophobicContact CB-CD1 4.13Å; L162-I320 HydrophobicContact CB-CG1 3.64Å; L162-I320 HydrophobicContact CD1-CG1 4.22Å; F166-I320 HydrophobicContact CB-CD1 4.29Å; Q316-I320 HydrophobicContact CG-CD1 4.16Å; Q316-I320 VanDerWaalsContact O-CG1 3.31Å; Q316-I320 WeakPolarHBondContact O-CG1 3.38Å; Q316-I320 PolarHBondContact O-N 2.97Å; L317-I320 PolarHBondContact O-N 3.38Å; I318-I320 VanDerWaalsContact C-N 3.34Å; I318-I320 PolarHBondContact O-N 2.93Å; I320-A323 PolarHBondContact O-N 2.81Å; I320-K324 VanDerWaalsContact O-CB 3.29Å; I320-K324 WeakPolarHBondContact O-CB 3.33Å; I320-K324 PolarHBondContact O-N 3.39Å
321	L	96.3	Very high	94.8	Very high	95 Å²	95	52 Å²	52	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-47	179.5	-70	174.6	0	0	0	111.3	L317 I318 A323 K324 T325	L317-L321 HydrophobicContact CD1-CG 4.45Å; L317-L321 HydrophobicContact CG-CD1 4.22Å; L317-L321 HydrophobicContact CG-CG 4.49Å; L317-L321 VanDerWaalsContact O-CG 3.29Å; L317-L321 WeakPolarHBondContact O-CG 3.48Å; L317-L321 PolarHBondContact O-N 3.5Å; I318-L321 PolarHBondContact O-N 2.89Å; L321-A323 PolarHBondContact O-N 3.38Å; L321-K324 PolarHBondContact O-N 2.96Å; L321-T325 WeakPolarHBondContact O-CB 3.25Å; L321-T325 PolarHBondContact O-N 2.9Å; L321-T325 PolarHBondContact O-OG1 2.94Å
322	L	95.9	Very high	94.7	Very high	49 Å²	49	53.9 Å²	53.9	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-60.7	-45.6	177.6	-68.9	174.3	0	0	0	111.7	V78 I318 T325 L326	V78-L322 HydrophobicContact CB-CD2 4.45Å; V78-L322 HydrophobicContact CG1-CB 4.22Å; V78-L322 HydrophobicContact CG1-CD2 4.01Å; V78-L322 WeakPolarHBondContact CG1-O 3.44Å; V78-L322 HydrophobicContact CG2-CD2 4.09Å; I318-L322 HydrophobicContact CG2-CD1 3.78Å; I318-L322 HydrophobicContact CG2-CG 4.16Å; I318-L322 WeakPolarHBondContact O-CB 3.35Å; I318-L322 VanDerWaalsContact O-CG 3.26Å; I318-L322 WeakPolarHBondContact O-CG 3.42Å; I318-L322 PolarHBondContact O-N 2.93Å; L322-T325 PolarHBondContact O-N 2.82Å; L322-L326 WeakPolarHBondContact O-CB 3.43Å; L322-L326 PolarHBondContact O-N 3.43Å
323	A	96.1	Very high	94.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-40.8	178	0	0	0	0	0	112.6	L82 Y158 A319 I320 L321 L326 H327	L82-A323 HydrophobicContact CD1-CB 4.46Å; L82-A323 HydrophobicContact CD2-CB 4.08Å; Y158-A323 HydrophobicContact CD1-CB 3.68Å; Y158-A323 HydrophobicContact CE1-CB 3.78Å; A319-A323 VanDerWaalsContact O-CB 3.32Å; A319-A323 WeakPolarHBondContact O-CB 3.05Å; A319-A323 PolarHBondContact O-N 3.33Å; I320-A323 PolarHBondContact O-N 2.81Å; L321-A323 PolarHBondContact O-N 3.38Å; A323-L326 PolarHBondContact O-N 2.96Å; A323-H327 VanDerWaalsContact O-CB 3.31Å; A323-H327 WeakPolarHBondContact O-CB 3.44Å; A323-H327 PolarHBondContact O-N 2.85Å
324	K	96	Very high	94.2	Very high	120 Å²	120	54 Å²	54	52%	0.522	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-45.2	175.6	-174.4	-178.2	178.4	-177.7	0	111.3	I320 L321 L326 H327 T328	I320-K324 VanDerWaalsContact O-CB 3.29Å; I320-K324 WeakPolarHBondContact O-CB 3.33Å; I320-K324 PolarHBondContact O-N 3.39Å; L321-K324 PolarHBondContact O-N 2.96Å; K324-L326 VanDerWaalsContact C-N 3.35Å; K324-L326 PolarHBondContact O-N 3.11Å; K324-H327 PolarHBondContact O-N 3.21Å; K324-T328 PolarHBondContact O-N 3.28Å; K324-T328 PolarHBondContact O-OG1 3.05Å; K324-T328 VanDerWaalsContact O-OG1 3.09Å
325	T	94.6	Very high	93.9	Very high	63 Å²	63	58.1 Å²	58.1	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-59.5	-46.1	176	-65.8	0	0	0	0	111	L321 L322 T328 Q329	L321-T325 WeakPolarHBondContact O-CB 3.25Å; L321-T325 PolarHBondContact O-N 2.9Å; L321-T325 PolarHBondContact O-OG1 2.94Å; L322-T325 PolarHBondContact O-N 2.82Å; T325-T328 PolarHBondContact O-N 3.05Å; T325-Q329 HydrophobicContact CG2-CG 4.48Å; T325-Q329 WeakPolarHBondContact O-CB 3.48Å; T325-Q329 WeakPolarHBondContact O-CG 3.36Å; T325-Q329 PolarHBondContact O-N 3.2Å
326	L	94.3	Very high	93.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-45	177	-175.6	60.7	0	0	0	111.7	I74 V78 K79 L82 L155 L322 A323 K324 T328 Q329 I330	I74-L326 HydrophobicContact CG2-CD1 3.55Å; V78-L326 HydrophobicContact CG1-CB 4.07Å; K79-L326 HydrophobicContact CB-CD1 4.34Å; L82-L326 HydrophobicContact CD2-CD2 3.84Å; L155-L326 HydrophobicContact CD1-CD2 4.03Å; L155-L326 HydrophobicContact CD1-CG 4.02Å; L155-L326 HydrophobicContact CD2-CD2 4.1Å; L322-L326 WeakPolarHBondContact O-CB 3.43Å; L322-L326 PolarHBondContact O-N 3.43Å; A323-L326 PolarHBondContact O-N 2.96Å; K324-L326 VanDerWaalsContact C-N 3.35Å; K324-L326 PolarHBondContact O-N 3.11Å; L326-T328 PolarHBondContact O-N 2.97Å; L326-Q329 PolarHBondContact O-N 2.88Å; L326-I330 HydrophobicContact CD1-CD1 4.07Å; L326-I330 HydrophobicContact CD1-CG1 4.37Å; L326-I330 HydrophobicContact CG-CD1 3.87Å; L326-I330 WeakPolarHBondContact O-CD1 3.25Å; L326-I330 VanDerWaalsContact O-CG1 3.27Å; L326-I330 WeakPolarHBondContact O-CG1 3.49Å; L326-I330 PolarHBondContact O-N 3.22Å
327	H	94.3	Very high	93.2	Very high	27 Å²	27	54.9 Å²	54.9	13%	0.125	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-43.9	176	174.9	-102.2	0	0	0	112.2	T152 L155 Y159 A323 K324 N331	T152-H327 PolarHBondContact O-CD2 2.77Å; L155-H327 HydrophobicContact CB-CB 4.34Å; Y159-H327 HydrophobicContact CE1-CB 4.34Å; A323-H327 VanDerWaalsContact O-CB 3.31Å; A323-H327 WeakPolarHBondContact O-CB 3.44Å; A323-H327 PolarHBondContact O-N 2.85Å; K324-H327 PolarHBondContact O-N 3.21Å; H327-N331 PolarHBondContact CE1-ND2 3Å; H327-N331 PolarHBondContact ND1-ND2 3.25Å; H327-N331 PolarHBondContact NE2-ND2 3.16Å; H327-N331 WeakPolarHBondContact O-CB 3.27Å; H327-N331 PolarHBondContact O-N 2.91Å; H327-N331 PolarHBondContact O-ND2 3.12Å
328	T	93.7	Very high	92.8	Very high	62 Å²	62	57 Å²	57	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-47	176.2	-61.2	0	0	0	0	111.4	K324 T325 L326 I330 N331 D332	K324-T328 PolarHBondContact O-N 3.28Å; K324-T328 PolarHBondContact O-OG1 3.05Å; K324-T328 VanDerWaalsContact O-OG1 3.09Å; T325-T328 PolarHBondContact O-N 3.05Å; L326-T328 PolarHBondContact O-N 2.97Å; T328-I330 VanDerWaalsContact C-N 3.33Å; T328-I330 PolarHBondContact O-N 2.85Å; T328-N331 PolarHBondContact O-N 2.97Å; T328-D332 PolarHBondContact O-N 2.97Å
329	Q	93	Very high	92.5	Very high	46 Å²	46	58.4 Å²	58.4	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-58.1	-43.9	178.2	-75.2	179.6	-20.4	0	0	112.3	I74 T325 L326 D332 Q333	I74-Q329 HydrophobicContact CG1-CB 4.32Å; T325-Q329 HydrophobicContact CG2-CG 4.48Å; T325-Q329 WeakPolarHBondContact O-CB 3.48Å; T325-Q329 WeakPolarHBondContact O-CG 3.36Å; T325-Q329 PolarHBondContact O-N 3.2Å; L326-Q329 PolarHBondContact O-N 2.88Å; Q329-D332 PolarHBondContact O-N 2.75Å; Q329-Q333 VanDerWaalsContact O-CG 3.29Å; Q329-Q333 WeakPolarHBondContact O-CG 3.22Å; Q329-Q333 PolarHBondContact O-N 2.62Å
330	I	91.6	Very high	92.1	Very high	6 Å²	6	61.7 Å²	61.7	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-44	177.7	-65.1	161.9	0	0	0	110.8	I74 E150 T152 L155 L326 T328 D332 Q333 L334	I74-I330 HydrophobicContact CD1-CG1 3.82Å; I74-I330 HydrophobicContact CG1-CG1 4.38Å; E150-I330 HydrophobicContact CB-CD1 3.84Å; E150-I330 HydrophobicContact CB-CG1 4.25Å; E150-I330 HydrophobicContact CG-CD1 4.13Å; E150-I330 HydrophobicContact CG-CG1 4.45Å; T152-I330 HydrophobicContact CG2-CB 4.12Å; T152-I330 HydrophobicContact CG2-CG2 3.44Å; T152-I330 VanDerWaalsContact CG2-CG2 3.44Å; L155-I330 HydrophobicContact CD1-CD1 3.47Å; L155-I330 VanDerWaalsContact CD1-CD1 3.47Å; L326-I330 HydrophobicContact CD1-CD1 4.07Å; L326-I330 HydrophobicContact CD1-CG1 4.37Å; L326-I330 HydrophobicContact CG-CD1 3.87Å; L326-I330 WeakPolarHBondContact O-CD1 3.25Å; L326-I330 VanDerWaalsContact O-CG1 3.27Å; L326-I330 WeakPolarHBondContact O-CG1 3.49Å; L326-I330 PolarHBondContact O-N 3.22Å; T328-I330 VanDerWaalsContact C-N 3.33Å; T328-I330 PolarHBondContact O-N 2.85Å; I330-D332 PolarHBondContact O-N 3.34Å; I330-Q333 PolarHBondContact O-N 3.42Å; I330-L334 HydrophobicContact CG2-CD1 3.96Å; I330-L334 HydrophobicContact CG2-CG 4.41Å; I330-L334 WeakPolarHBondContact O-CB 3.49Å; I330-L334 VanDerWaalsContact O-CG 3.31Å; I330-L334 WeakPolarHBondContact O-CG 3.11Å; I330-L334 PolarHBondContact O-N 3.39Å
331	N	91.6	Very high	91.4	Very high	41 Å²	41	65.7 Å²	65.7	22%	0.219	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-39.4	178.7	-76.4	-41	0	0	0	112.6	T152 H327 T328 L334 R335	T152-N331 WeakPolarHBondContact CG2-OD1 3.32Å; H327-N331 PolarHBondContact CE1-ND2 3Å; H327-N331 PolarHBondContact ND1-ND2 3.25Å; H327-N331 PolarHBondContact NE2-ND2 3.16Å; H327-N331 WeakPolarHBondContact O-CB 3.27Å; H327-N331 PolarHBondContact O-N 2.91Å; H327-N331 PolarHBondContact O-ND2 3.12Å; T328-N331 PolarHBondContact O-N 2.97Å; N331-L334 PolarHBondContact O-N 3.12Å; N331-R335 VanDerWaalsContact O-CG 3.28Å; N331-R335 WeakPolarHBondContact O-CG 3.43Å; N331-R335 PolarHBondContact O-N 3.12Å
332	D	91.4	Very high	90.7	Very high	67 Å²	67	67.3 Å²	67.3	36%	0.358	33%	0.332	S	S	.	.	H	α-helix	trans	-68.6	-40.2	176.9	-68.9	-24.6	0	0	0	111.3	T328 Q329 I330 L334 R335 L336	T328-D332 PolarHBondContact O-N 2.97Å; Q329-D332 PolarHBondContact O-N 2.75Å; I330-D332 PolarHBondContact O-N 3.34Å; D332-L334 PolarHBondContact O-N 3.12Å; D332-R335 PolarHBondContact O-N 3.16Å; D332-R335 IonicContact OD1-CZ 2.67Å; D332-R335 IonicContact OD1-NH1 3.96Å; D332-R335 PolarHBondContact OD1-NH1 2.72Å; D332-L336 WeakPolarHBondContact O-CG 3.36Å; D332-L336 PolarHBondContact O-N 3.24Å
333	Q	89.9	Confident	89.8	Confident	31 Å²	31	74.6 Å²	74.6	15%	0.145	36%	0.357	C	S	.	.	H	α-helix	trans	-57.2	-47.5	169.7	-71.1	-125.8	-94.4	0	0	111.5	S72 Y73 I74 Q329 I330 R335 L336 L337	S72-Q333 PolarHBondContact OG-OE1 2.98Å; Y73-Q333 HydrophobicContact CD2-CG 4.26Å; Y73-Q333 VanDerWaalsContact N-NE2 3.15Å; I74-Q333 HydrophobicContact CG1-CG 4.24Å; Q329-Q333 VanDerWaalsContact O-CG 3.29Å; Q329-Q333 WeakPolarHBondContact O-CG 3.22Å; Q329-Q333 PolarHBondContact O-N 2.62Å; I330-Q333 PolarHBondContact O-N 3.42Å; Q333-R335 VanDerWaalsContact C-N 3.33Å; Q333-R335 PolarHBondContact O-N 3Å; Q333-L336 PolarHBondContact O-N 2.69Å; Q333-L337 VanDerWaalsContact O-CG 3.23Å; Q333-L337 WeakPolarHBondContact O-CG 3.37Å; Q333-L337 PolarHBondContact O-N 2.96Å
334	L	89	Confident	88	Confident	77 Å²	77	85.3 Å²	85.3	40%	0.403	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-36.6	179.2	-74	169.3	0	0	0	113.1	T152 I330 N331 D332 L337 H338	T152-L334 HydrophobicContact CG2-CD1 4.11Å; I330-L334 HydrophobicContact CG2-CD1 3.96Å; I330-L334 HydrophobicContact CG2-CG 4.41Å; I330-L334 WeakPolarHBondContact O-CB 3.49Å; I330-L334 VanDerWaalsContact O-CG 3.31Å; I330-L334 WeakPolarHBondContact O-CG 3.11Å; I330-L334 PolarHBondContact O-N 3.39Å; N331-L334 PolarHBondContact O-N 3.12Å; D332-L334 PolarHBondContact O-N 3.12Å; L334-L337 PolarHBondContact O-N 3.16Å; L334-H338 PolarHBondContact O-N 3.1Å; L334-H338 PolarHBondContact O-ND1 3.38Å
335	R	89.2	Confident	87.6	Confident	160 Å²	160	83.6 Å²	83.6	60%	0.604	40%	0.398	S	S	*	.	H	α-helix	trans	-66	-46	175.8	-75.4	170.3	-177.8	167.8	-6.2	111.9	N331 D332 Q333 L337 H338 Q339	N331-R335 VanDerWaalsContact O-CG 3.28Å; N331-R335 WeakPolarHBondContact O-CG 3.43Å; N331-R335 PolarHBondContact O-N 3.12Å; D332-R335 PolarHBondContact O-N 3.16Å; D332-R335 IonicContact OD1-CZ 2.67Å; D332-R335 IonicContact OD1-NH1 3.96Å; D332-R335 PolarHBondContact OD1-NH1 2.72Å; Q333-R335 VanDerWaalsContact C-N 3.33Å; Q333-R335 PolarHBondContact O-N 3Å; R335-L337 VanDerWaalsContact C-N 3.26Å; R335-L337 PolarHBondContact O-N 3.18Å; R335-H338 PolarHBondContact O-N 3.16Å; R335-Q339 WeakPolarHBondContact O-CG 3.14Å; R335-Q339 PolarHBondContact O-N 3.01Å
336	L	89.3	Confident	87.2	Confident	77 Å²	77	84.7 Å²	84.7	40%	0.403	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-39.9	176.7	-68.9	170.9	0	0	0	111.1	Y73 D332 Q333 Q339 E340	Y73-L336 HydrophobicContact CD2-CD1 4.11Å; Y73-L336 HydrophobicContact CE2-CD1 3.93Å; D332-L336 WeakPolarHBondContact O-CG 3.36Å; D332-L336 PolarHBondContact O-N 3.24Å; Q333-L336 PolarHBondContact O-N 2.69Å; L336-Q339 WeakPolarHBondContact O-CB 3.25Å; L336-Q339 PolarHBondContact O-N 3.04Å; L336-E340 PolarHBondContact O-N 3.05Å
337	L	87.1	Confident	86.8	Confident	36 Å²	36	89.4 Å²	89.4	19%	0.188	42%	0.421	C	S	.	.	H	α-helix	trans	-68.1	-37.3	176.9	-65.5	169.5	0	0	0	113	Y63 F67 Q333 L334 R335 Q339 N341	Y63-L337 WeakPolarHBondContact OH-CD1 3.37Å; F67-L337 HydrophobicContact CE2-CD2 3.73Å; F67-L337 HydrophobicContact CZ-CD1 4.46Å; F67-L337 HydrophobicContact CZ-CD2 3.61Å; Q333-L337 VanDerWaalsContact O-CG 3.23Å; Q333-L337 WeakPolarHBondContact O-CG 3.37Å; Q333-L337 PolarHBondContact O-N 2.96Å; L334-L337 PolarHBondContact O-N 3.16Å; R335-L337 VanDerWaalsContact C-N 3.26Å; R335-L337 PolarHBondContact O-N 3.18Å; L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-N341 WeakPolarHBondContact O-CB 3.27Å; L337-N341 PolarHBondContact O-N 3.49Å
338	H	88.1	Confident	86.4	Confident	126 Å²	126	93.1 Å²	93.1	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-64.4	-39.2	171.5	-93.2	75.3	0	0	0	111.9	L334 R335 N341 N342	L334-H338 PolarHBondContact O-N 3.1Å; L334-H338 PolarHBondContact O-ND1 3.38Å; R335-H338 PolarHBondContact O-N 3.16Å; H338-N341 PolarHBondContact O-N 3.26Å; H338-N342 PolarHBondContact O-N 2.62Å; H338-N342 VanDerWaalsContact O-N 3.07Å; H338-N342 PolarHBondContact O-ND2 2.88Å
339	Q	88.8	Confident	86	Confident	109 Å²	109	95 Å²	95	51%	0.509	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-51.6	175.9	-73.3	177.6	-33.3	0	0	110.9	R335 L336 L337 N341 N342 Y343	R335-Q339 WeakPolarHBondContact O-CG 3.14Å; R335-Q339 PolarHBondContact O-N 3.01Å; L336-Q339 WeakPolarHBondContact O-CB 3.25Å; L336-Q339 PolarHBondContact O-N 3.04Å; L337-Q339 VanDerWaalsContact C-N 3.34Å; Q339-N341 VanDerWaalsContact C-N 3.27Å; Q339-N341 PolarHBondContact O-N 2.98Å; Q339-N342 PolarHBondContact O-N 3.18Å; Q339-N342 VanDerWaalsContact O-N 3.07Å; Q339-Y343 WeakPolarHBondContact O-CD2 2.98Å; Q339-Y343 PolarHBondContact O-N 3.41Å
340	E	86.5	Confident	85.5	Confident	86 Å²	86	98.3 Å²	98.3	40%	0.402	46%	0.457	S	S	.	.	H	α-helix	trans	-54.9	-42.6	176.4	-74.2	-173	163.5	0	0	112.3	R70 L336 N342 Y343 F344	R70-E340 IonicContact CZ-OE2 2.83Å; R70-E340 IonicContact NH1-OE1 3.65Å; R70-E340 IonicContact NH1-OE2 3.64Å; R70-E340 PolarHBondContact NH1-OE2 3.18Å; L336-E340 PolarHBondContact O-N 3.05Å; E340-N342 VanDerWaalsContact C-N 3.28Å; E340-N342 PolarHBondContact O-N 2.04Å; E340-Y343 PolarHBondContact O-N 3.43Å; E340-F344 WeakPolarHBondContact O-CD2 2.96Å
341	N	83.6	Confident	85.1	Confident	101 Å²	101	104.9 Å²	104.9	54%	0.54	49%	0.488	S	S	.	.	H	α-helix	trans	-74.3	-16.3	-178.6	-160.7	55.8	0	0	0	113.9	L337 H338 Q339	L337-N341 WeakPolarHBondContact O-CB 3.27Å; L337-N341 PolarHBondContact O-N 3.49Å; H338-N341 PolarHBondContact O-N 3.26Å; Q339-N341 VanDerWaalsContact C-N 3.27Å; Q339-N341 PolarHBondContact O-N 2.98Å
342	N	82	Confident	84.6	Confident	130 Å²	130	109.8 Å²	109.8	70%	0.695	51%	0.509	S	S	*	.	H	α-helix	trans	-86.8	-15.9	172.3	-71.9	-25.4	0	0	0	112.4	H338 Q339 E340	H338-N342 PolarHBondContact O-N 2.62Å; H338-N342 VanDerWaalsContact O-N 3.07Å; H338-N342 PolarHBondContact O-ND2 2.88Å; Q339-N342 PolarHBondContact O-N 3.18Å; Q339-N342 VanDerWaalsContact O-N 3.07Å; E340-N342 VanDerWaalsContact C-N 3.28Å; E340-N342 PolarHBondContact O-N 2.04Å
343	Y	75.1	Confident	84	Confident	202 Å²	202	113.3 Å²	113.3	79%	0.792	52%	0.521	S	S	*	.	H	α-helix	trans	-87.1	-16.8	176	-79.8	-71.2	0	0	0	113.6	Q339 E340	Q339-Y343 WeakPolarHBondContact O-CD2 2.98Å; Q339-Y343 PolarHBondContact O-N 3.41Å; E340-Y343 PolarHBondContact O-N 3.43Å
344	F	59.2	Low	83.4	Confident	225 Å²	225	120.8 Å²	120.8	99%	0.987	56%	0.555	S	S	*	*			trans	-105.6	0	174.3	-76.9	-76	0	0	0	110.7	E340	E340-F344 WeakPolarHBondContact O-CD2 2.96Å

Retrieved 344 of 344 residues in 830.1 ms (Link to these results)

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