A0A077Z640_TRITR Loading...

Telomere-associated protein Rif1 N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z640, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 712 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	38	Very low	33.3	Very low	251 Å²	251	136.2 Å²	136.2	100%	1.236	76%	0.758	S	S	*	*				0	89.3	0	-81.3	176.8	151.9	0	0	108.4
2	Q	27.1	Very low	34.4	Very low	201 Å²	201	133.6 Å²	133.6	94%	0.939	75%	0.748	S	S	*	*			trans	-97.6	125.5	170.9	-76.3	166.7	-23.5	0	0	106.3
3	S	33.3	Very low	34.8	Very low	112 Å²	112	127.8 Å²	127.8	78%	0.783	72%	0.718	S	S	*	*			trans	-152.1	98.2	177.1	169.4	0	0	0	0	110.2
4	A	29	Very low	35.7	Very low	88 Å²	88	128.6 Å²	128.6	73%	0.727	71%	0.71	S	S	*	*			trans	47.6	92.4	136.5	0	0	0	0	0	119.1
5	Y	33.2	Very low	36.7	Very low	239 Å²	239	123.9 Å²	123.9	94%	0.937	69%	0.694	S	S	*	*			trans	-128.2	89.9	143	-94.1	-86.6	0	0	0	107.9
6	S	28.5	Very low	37.4	Very low	88 Å²	88	118.6 Å²	118.6	62%	0.615	67%	0.671	S	S	*	*			trans	-86.7	126.4	166	-172.4	0	0	0	0	108	H8	S6-H8 PolarHBondContact O-N 2.98Å
7	P	33.1	Very low	37.9	Very low	123 Å²	123	119 Å²	119	80%	0.799	66%	0.659	S	S	*	*			trans	-82	83.7	-173.7	33	-32.2	0	0	0	110.4	S9	P7-S9 PolarHBondContact O-N 3.42Å; P7-S9 VanDerWaalsContact O-N 3.09Å
8	H	35.1	Very low	39.1	Very low	177 Å²	177	121.3 Å²	121.3	82%	0.819	66%	0.661	S	S	*	*			trans	-72.1	96.9	160.2	-71.9	-61.6	0	0	0	108.6	S6 S10	S6-H8 PolarHBondContact O-N 2.98Å; H8-S10 PolarHBondContact O-N 3.07Å
9	S	37.5	Very low	40.1	Very low	56 Å²	56	119.5 Å²	119.5	39%	0.392	65%	0.649	S	S	.	*			trans	-53.3	124.6	174.2	43.7	0	0	0	0	111.2	P7	P7-S9 PolarHBondContact O-N 3.42Å; P7-S9 VanDerWaalsContact O-N 3.09Å
10	S	35.5	Very low	40.7	Very low	53 Å²	53	114 Å²	114	37%	0.371	62%	0.62	S	S	.	*			trans	-60.4	151.9	178	91.1	0	0	0	0	110.7	H8 T12 V13 K14	H8-S10 PolarHBondContact O-N 3.07Å; S10-T12 PolarHBondContact O-N 3.33Å; S10-T12 PolarHBondContact OG-N 2.99Å; S10-T12 PolarHBondContact OG-OG1 3.44Å; S10-V13 PolarHBondContact O-N 3.31Å; S10-K14 PolarHBondContact O-N 2.72Å
11	P	36.3	Very low	41.4	Very low	110 Å²	110	116.7 Å²	116.7	71%	0.714	62%	0.621	S	S	*	*	H	α-helix	trans	-53.4	-29	178.1	13.9	-25.7	0	0	0	113.4	K14 A15	P11-K14 PolarHBondContact O-N 3.39Å; P11-A15 WeakPolarHBondContact O-CB 3.47Å; P11-A15 PolarHBondContact O-N 3.22Å
12	T	46.5	Very low	42.5	Very low	105 Å²	105	109.4 Å²	109.4	64%	0.644	58%	0.584	S	S	*	*	H	α-helix	trans	-63.7	-40.2	175.5	-10	0	0	0	0	112.6	S10 A15 A16	S10-T12 PolarHBondContact O-N 3.33Å; S10-T12 PolarHBondContact OG-N 2.99Å; S10-T12 PolarHBondContact OG-OG1 3.44Å; T12-A15 PolarHBondContact O-N 2.79Å; T12-A16 WeakPolarHBondContact O-CB 3.41Å; T12-A16 PolarHBondContact O-N 3.47Å
13	V	40	Very low	44.2	Very low	58 Å²	58	100.1 Å²	100.1	35%	0.352	54%	0.541	S	S	.	.	H	α-helix	trans	-70.6	-38.5	179.6	179.9	0	0	0	0	111.4	S10 R17	S10-V13 PolarHBondContact O-N 3.31Å; V13-R17 WeakPolarHBondContact O-CG 3.47Å; V13-R17 PolarHBondContact O-N 3.05Å
14	K	46.5	Very low	45.1	Very low	140 Å²	140	95.8 Å²	95.8	61%	0.609	51%	0.509	S	S	*	.	H	α-helix	trans	-66.7	-40.2	174.8	-77.4	-175.4	179.5	177.5	0	112	S10 P11 R17 K18	S10-K14 PolarHBondContact O-N 2.72Å; P11-K14 PolarHBondContact O-N 3.39Å; K14-R17 PolarHBondContact O-N 3.35Å; K14-K18 PolarHBondContact O-N 3.26Å
15	A	51.1	Low	46.6	Very low	57 Å²	57	95.1 Å²	95.1	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-46	176.3	0	0	0	0	0	111.5	P11 T12 R17 K18 M19	P11-A15 WeakPolarHBondContact O-CB 3.47Å; P11-A15 PolarHBondContact O-N 3.22Å; T12-A15 PolarHBondContact O-N 2.79Å; A15-R17 PolarHBondContact O-N 2.87Å; A15-K18 PolarHBondContact O-N 3.48Å; A15-M19 WeakPolarHBondContact O-CB 3.34Å; A15-M19 PolarHBondContact O-N 3.03Å
16	A	47.7	Very low	48	Very low	39 Å²	39	85.5 Å²	85.5	32%	0.322	46%	0.464	S	S	.	.	H	α-helix	trans	-58.7	-44.5	175.7	0	0	0	0	0	111.9	T12 K18 M19 A20	T12-A16 WeakPolarHBondContact O-CB 3.41Å; T12-A16 PolarHBondContact O-N 3.47Å; A16-K18 PolarHBondContact O-N 3.12Å; A16-M19 PolarHBondContact O-N 2.97Å; A16-A20 VanDerWaalsContact O-CB 3.29Å; A16-A20 WeakPolarHBondContact O-CB 3.46Å; A16-A20 PolarHBondContact O-N 3.06Å
17	R	46.5	Very low	49.3	Very low	126 Å²	126	81.4 Å²	81.4	48%	0.475	44%	0.435	S	S	.	.	H	α-helix	trans	-63.8	-37.3	175.4	-78	-177.8	177.6	171.3	1.6	113.7	V13 K14 A15 R21 D58	V13-R17 WeakPolarHBondContact O-CG 3.47Å; V13-R17 PolarHBondContact O-N 3.05Å; K14-R17 PolarHBondContact O-N 3.35Å; A15-R17 PolarHBondContact O-N 2.87Å; R17-R21 VanDerWaalsContact O-CG 3.31Å; R17-R21 WeakPolarHBondContact O-CG 3.4Å; R17-R21 PolarHBondContact O-N 3.47Å; R17-D58 IonicContact NE-OD2 3.82Å
18	K	58.5	Low	50.2	Low	161 Å²	161	77.8 Å²	77.8	70%	0.7	42%	0.416	S	S	*	.	H	α-helix	trans	-68.7	-42.7	176.2	-172.4	-179.9	176.9	-175	0	110.8	K14 A15 A16 R21 Q22	K14-K18 PolarHBondContact O-N 3.26Å; A15-K18 PolarHBondContact O-N 3.48Å; A16-K18 PolarHBondContact O-N 3.12Å; K18-R21 PolarHBondContact O-N 2.95Å; K18-Q22 PolarHBondContact O-N 3.03Å
19	M	58.5	Low	51.5	Low	86 Å²	86	71 Å²	71	42%	0.424	39%	0.388	S	S	.	.	H	α-helix	trans	-64.5	-45.2	176.9	-172.5	-178.5	-73.4	0	0	111.2	A15 A16 R21 Q22 I23 L41 V45	A15-M19 WeakPolarHBondContact O-CB 3.34Å; A15-M19 PolarHBondContact O-N 3.03Å; A16-M19 PolarHBondContact O-N 2.97Å; M19-R21 PolarHBondContact O-N 3.41Å; M19-Q22 WeakPolarHBondContact O-CB 3.25Å; M19-Q22 PolarHBondContact O-N 3.44Å; M19-Q22 VanDerWaalsContact O-N 3.13Å; M19-I23 HydrophobicContact CG-CD1 4.16Å; M19-I23 VanDerWaalsContact O-CG1 3.29Å; M19-I23 WeakPolarHBondContact O-CG1 3.25Å; M19-I23 PolarHBondContact O-N 3.45Å; M19-L41 HydrophobicContact CG-CD2 3.77Å; M19-L41 HydrophobicContact SD-CD2 4.14Å; M19-V45 HydrophobicContact SD-CG2 3.37Å; M19-V45 WeakPolarHBondContact SD-CG2 3.35Å
20	A	52.3	Low	52.5	Low	9 Å²	9	74.2 Å²	74.2	7%	0.074	41%	0.411	C	S	.	.	H	α-helix	trans	-51.5	-55.8	171.1	0	0	0	0	0	110.5	A16 Q22 I23 I24 T61	A16-A20 VanDerWaalsContact O-CB 3.29Å; A16-A20 WeakPolarHBondContact O-CB 3.46Å; A16-A20 PolarHBondContact O-N 3.06Å; A20-Q22 PolarHBondContact O-N 3.03Å; A20-I23 WeakPolarHBondContact O-CB 3.2Å; A20-I23 PolarHBondContact O-N 2.85Å; A20-I23 VanDerWaalsContact O-N 3.09Å; A20-I24 HydrophobicContact CB-CD1 4.46Å; A20-I24 WeakPolarHBondContact O-CD1 3.43Å; A20-I24 VanDerWaalsContact O-CG1 3.22Å; A20-I24 WeakPolarHBondContact O-CG1 3.19Å; A20-I24 PolarHBondContact O-N 3.48Å; A20-T61 HydrophobicContact CB-CG2 3.53Å
21	R	54.8	Low	54.2	Low	171 Å²	171	75.2 Å²	75.2	65%	0.645	41%	0.412	S	S	*	.	H	α-helix	trans	-56.7	-36.7	178.5	-74.2	176.8	-171.9	177.7	0.7	113.3	R17 K18 M19 I24 S25	R17-R21 VanDerWaalsContact O-CG 3.31Å; R17-R21 WeakPolarHBondContact O-CG 3.4Å; R17-R21 PolarHBondContact O-N 3.47Å; K18-R21 PolarHBondContact O-N 2.95Å; M19-R21 PolarHBondContact O-N 3.41Å; R21-I24 PolarHBondContact O-N 3.09Å; R21-S25 WeakPolarHBondContact O-CB 3.4Å; R21-S25 PolarHBondContact O-N 3.45Å
22	Q	62.7	Low	55.4	Low	98 Å²	98	74.3 Å²	74.3	46%	0.458	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-48.8	175.7	-172.2	61.5	41.7	0	0	110.9	K18 M19 A20 I24 S25 D26	K18-Q22 PolarHBondContact O-N 3.03Å; M19-Q22 WeakPolarHBondContact O-CB 3.25Å; M19-Q22 PolarHBondContact O-N 3.44Å; M19-Q22 VanDerWaalsContact O-N 3.13Å; A20-Q22 PolarHBondContact O-N 3.03Å; Q22-I24 PolarHBondContact O-N 3.09Å; Q22-S25 WeakPolarHBondContact O-CB 3.44Å; Q22-S25 PolarHBondContact O-N 3.37Å; Q22-S25 VanDerWaalsContact O-N 3.12Å; Q22-D26 WeakPolarHBondContact CG-OD2 3.37Å; Q22-D26 VanDerWaalsContact NE2-CG 3.29Å; Q22-D26 PolarHBondContact NE2-OD1 3.35Å; Q22-D26 PolarHBondContact NE2-OD2 3.1Å; Q22-D26 VanDerWaalsContact NE2-OD2 3.11Å; Q22-D26 VanDerWaalsContact O-CB 3.32Å; Q22-D26 WeakPolarHBondContact O-CB 3.29Å; Q22-D26 PolarHBondContact O-N 2.86Å
23	I	61.1	Low	56.5	Low	7 Å²	7	74.1 Å²	74.1	4%	0.036	40%	0.399	C	S	.	.	H	α-helix	trans	-54.3	-43.5	174.1	-65.9	166.1	0	0	0	109.9	M19 A20 D26 L27 L41 L42 L65	M19-I23 HydrophobicContact CG-CD1 4.16Å; M19-I23 VanDerWaalsContact O-CG1 3.29Å; M19-I23 WeakPolarHBondContact O-CG1 3.25Å; M19-I23 PolarHBondContact O-N 3.45Å; A20-I23 WeakPolarHBondContact O-CB 3.2Å; A20-I23 PolarHBondContact O-N 2.85Å; A20-I23 VanDerWaalsContact O-N 3.09Å; I23-D26 PolarHBondContact O-N 3.38Å; I23-L27 HydrophobicContact CG2-CD1 3.58Å; I23-L27 HydrophobicContact CG2-CG 4.1Å; I23-L27 WeakPolarHBondContact O-CB 3.42Å; I23-L27 WeakPolarHBondContact O-CG 3.29Å; I23-L27 PolarHBondContact O-N 3.41Å; I23-L41 HydrophobicContact CD1-CD2 3.92Å; I23-L41 HydrophobicContact CG1-CB 4.47Å; I23-L41 HydrophobicContact CG1-CD2 3.63Å; I23-L42 HydrophobicContact CD1-CB 4.48Å; I23-L42 HydrophobicContact CD1-CD1 4.38Å; I23-L42 HydrophobicContact CG2-CB 4.48Å; I23-L65 HydrophobicContact CG2-CD2 3.91Å
24	I	53.4	Low	57.8	Low	21 Å²	21	73.2 Å²	73.2	11%	0.108	39%	0.393	C	S	.	.	H	α-helix	trans	-64.1	-46.5	178.3	-65.2	147.6	0	0	0	111.6	A20 R21 Q22 D26 L27 A28 L64 L65	A20-I24 HydrophobicContact CB-CD1 4.46Å; A20-I24 WeakPolarHBondContact O-CD1 3.43Å; A20-I24 VanDerWaalsContact O-CG1 3.22Å; A20-I24 WeakPolarHBondContact O-CG1 3.19Å; A20-I24 PolarHBondContact O-N 3.48Å; R21-I24 PolarHBondContact O-N 3.09Å; Q22-I24 PolarHBondContact O-N 3.09Å; I24-D26 VanDerWaalsContact C-N 3.27Å; I24-D26 PolarHBondContact O-N 2.96Å; I24-L27 PolarHBondContact O-N 3.12Å; I24-A28 WeakPolarHBondContact O-CB 3.02Å; I24-A28 PolarHBondContact O-N 2.82Å; I24-L64 HydrophobicContact CD1-CB 3.08Å; I24-L64 HydrophobicContact CD1-CD1 3.64Å; I24-L64 HydrophobicContact CD1-CD2 4.4Å; I24-L64 HydrophobicContact CD1-CG 3.87Å; I24-L64 HydrophobicContact CG1-CB 3.71Å; I24-L64 HydrophobicContact CG2-CB 4.2Å; I24-L64 VanDerWaalsContact CG2-O 3.31Å; I24-L64 WeakPolarHBondContact CG2-O 3.15Å; I24-L65 HydrophobicContact CG1-CD2 4.08Å; I24-L65 HydrophobicContact CG1-CG 4.37Å
25	S	59.1	Low	58.4	Low	74 Å²	74	66.9 Å²	66.9	52%	0.517	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-40.7	176.5	-175.1	0	0	0	0	111.6	R21 Q22 A28 S29	R21-S25 WeakPolarHBondContact O-CB 3.4Å; R21-S25 PolarHBondContact O-N 3.45Å; Q22-S25 WeakPolarHBondContact O-CB 3.44Å; Q22-S25 PolarHBondContact O-N 3.37Å; Q22-S25 VanDerWaalsContact O-N 3.12Å; S25-A28 PolarHBondContact O-N 2.93Å; S25-S29 PolarHBondContact O-N 3.18Å
26	D	63.9	Low	58.8	Low	37 Å²	37	69.6 Å²	69.6	20%	0.198	37%	0.368	C	S	.	.	H	α-helix	trans	-78.2	-30.7	-177	-67.6	-16.9	0	0	0	111.8	Q22 I23 I24 S29 V34 S38	Q22-D26 WeakPolarHBondContact CG-OD2 3.37Å; Q22-D26 VanDerWaalsContact NE2-CG 3.29Å; Q22-D26 PolarHBondContact NE2-OD1 3.35Å; Q22-D26 PolarHBondContact NE2-OD2 3.1Å; Q22-D26 VanDerWaalsContact NE2-OD2 3.11Å; Q22-D26 VanDerWaalsContact O-CB 3.32Å; Q22-D26 WeakPolarHBondContact O-CB 3.29Å; Q22-D26 PolarHBondContact O-N 2.86Å; I23-D26 PolarHBondContact O-N 3.38Å; I24-D26 VanDerWaalsContact C-N 3.27Å; I24-D26 PolarHBondContact O-N 2.96Å; D26-S29 WeakPolarHBondContact O-CB 3.31Å; D26-S29 PolarHBondContact O-N 3.4Å; D26-V34 HydrophobicContact CB-CG1 3.53Å; D26-S38 WeakPolarHBondContact CB-OG 3.44Å
27	L	55.6	Low	59.8	Low	2 Å²	2	74.9 Å²	74.9	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-71.4	-33.3	170.8	-77.1	174.3	0	0	0	112	I23 I24 S29 T35 V39 L65 L72	I23-L27 HydrophobicContact CG2-CD1 3.58Å; I23-L27 HydrophobicContact CG2-CG 4.1Å; I23-L27 WeakPolarHBondContact O-CB 3.42Å; I23-L27 WeakPolarHBondContact O-CG 3.29Å; I23-L27 PolarHBondContact O-N 3.41Å; I24-L27 PolarHBondContact O-N 3.12Å; L27-S29 PolarHBondContact O-N 3.39Å; L27-T35 HydrophobicContact CD2-CG2 3.78Å; L27-V39 HydrophobicContact CD2-CG2 3.91Å; L27-L65 HydrophobicContact CD1-CD2 3.1Å; L27-L72 HydrophobicContact CB-CD1 4.18Å; L27-L72 VanDerWaalsContact O-CD2 3.3Å; L27-L72 WeakPolarHBondContact O-CD2 3.43Å; L27-L72 WeakPolarHBondContact O-CG 3.47Å
28	A	51.7	Low	60.7	Low	47 Å²	47	69 Å²	69	39%	0.388	36%	0.362	S	S	.	.	S	Bend	trans	-75	-8.2	172	0	0	0	0	0	113.3	I24 S25 S71	I24-A28 WeakPolarHBondContact O-CB 3.02Å; I24-A28 PolarHBondContact O-N 2.82Å; S25-A28 PolarHBondContact O-N 2.93Å; A28-S71 PolarHBondContact O-OG 3.27Å
29	S	62.8	Low	60.8	Low	34 Å²	34	62 Å²	62	24%	0.238	33%	0.332	C	S	.	.	S	Bend	trans	-62.3	141.5	177.3	-171.9	0	0	0	0	111.3	S25 D26 L27 D31	S25-S29 PolarHBondContact O-N 3.18Å; D26-S29 WeakPolarHBondContact O-CB 3.31Å; D26-S29 PolarHBondContact O-N 3.4Å; L27-S29 PolarHBondContact O-N 3.39Å; S29-D31 PolarHBondContact O-N 2.91Å; S29-D31 WeakPolarHBondContact OG-CB 3.26Å; S29-D31 PolarHBondContact OG-N 2.89Å; S29-D31 VanDerWaalsContact OG-N 3.13Å
30	S	58	Low	60.9	Low	124 Å²	124	61.6 Å²	61.6	87%	0.867	33%	0.332	S	S	*	.	S	Bend	trans	-73	-8.4	168.3	54.1	0	0	0	0	112.9	V32	S30-V32 PolarHBondContact O-N 2.8Å
31	D	70.6	Confident	61.5	Low	74 Å²	74	63.9 Å²	63.9	40%	0.396	34%	0.343	S	S	.	.			trans	-85.1	109.6	177.9	-174.1	-24.9	0	0	0	111.2	S29 D33 V34 T35	S29-D31 PolarHBondContact O-N 2.91Å; S29-D31 WeakPolarHBondContact OG-CB 3.26Å; S29-D31 PolarHBondContact OG-N 2.89Å; S29-D31 VanDerWaalsContact OG-N 3.13Å; D31-D33 PolarHBondContact O-N 3.18Å; D31-D33 WeakPolarHBondContact OD1-CB 3.38Å; D31-D33 PolarHBondContact OD1-N 3.43Å; D31-V34 HydrophobicContact CB-CB 3.97Å; D31-V34 HydrophobicContact CB-CG2 3.78Å; D31-V34 WeakPolarHBondContact O-CB 3.5Å; D31-V34 PolarHBondContact O-N 3.31Å; D31-V34 VanDerWaalsContact O-N 3.07Å; D31-V34 PolarHBondContact OD1-N 3.06Å; D31-T35 PolarHBondContact O-N 3.02Å; D31-T35 PolarHBondContact O-OG1 3.32Å; D31-T35 VanDerWaalsContact O-OG1 3.06Å
32	V	62.4	Low	62	Low	90 Å²	90	56.1 Å²	56.1	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-53.3	-34.2	179.3	172.5	0	0	0	0	112.9	S30 K36 R76	S30-V32 PolarHBondContact O-N 2.8Å; V32-K36 WeakPolarHBondContact O-CB 3.37Å; V32-K36 PolarHBondContact O-N 3.32Å; V32-R76 PolarHBondContact O-NH1 2.87Å; V32-R76 PolarHBondContact O-NH2 3.44Å
33	D	69	Low	61.9	Low	101 Å²	101	54.9 Å²	54.9	54%	0.54	31%	0.306	S	S	.	.	H	α-helix	trans	-78.2	-35.9	-179.6	-75.8	-29	0	0	0	111.6	D31 K36 K37	D31-D33 PolarHBondContact O-N 3.18Å; D31-D33 WeakPolarHBondContact OD1-CB 3.38Å; D31-D33 PolarHBondContact OD1-N 3.43Å; D33-K36 WeakPolarHBondContact O-CB 3.41Å; D33-K36 PolarHBondContact O-N 2.97Å; D33-K37 WeakPolarHBondContact O-CG 3.43Å; D33-K37 PolarHBondContact O-N 3.36Å
34	V	67.9	Low	61.9	Low	39 Å²	39	59.3 Å²	59.3	24%	0.236	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-43.7	174.3	174.7	0	0	0	0	110.2	D26 D31 K36 K37 S38	D26-V34 HydrophobicContact CB-CG1 3.53Å; D31-V34 HydrophobicContact CB-CB 3.97Å; D31-V34 HydrophobicContact CB-CG2 3.78Å; D31-V34 WeakPolarHBondContact O-CB 3.5Å; D31-V34 PolarHBondContact O-N 3.31Å; D31-V34 VanDerWaalsContact O-N 3.07Å; D31-V34 PolarHBondContact OD1-N 3.06Å; V34-K36 VanDerWaalsContact C-N 3.33Å; V34-K36 PolarHBondContact O-N 2.79Å; V34-K37 PolarHBondContact O-N 3.01Å; V34-S38 WeakPolarHBondContact O-CB 3.46Å; V34-S38 PolarHBondContact O-N 3.44Å; V34-S38 VanDerWaalsContact O-N 3.12Å; V34-S38 PolarHBondContact O-OG 3.48Å
35	T	58.5	Low	62.3	Low	8 Å²	8	59.7 Å²	59.7	5%	0.049	33%	0.331	C	S	.	.	H	α-helix	trans	-57.9	-45.6	171.5	-49	0	0	0	0	111.4	L27 D31 K37 S38 V39 L72	L27-T35 HydrophobicContact CD2-CG2 3.78Å; D31-T35 PolarHBondContact O-N 3.02Å; D31-T35 PolarHBondContact O-OG1 3.32Å; D31-T35 VanDerWaalsContact O-OG1 3.06Å; T35-K37 PolarHBondContact O-N 3.4Å; T35-S38 PolarHBondContact O-N 3.23Å; T35-V39 PolarHBondContact O-N 2.99Å; T35-L72 HydrophobicContact CG2-CD2 3.27Å
36	K	60.3	Low	62.4	Low	113 Å²	113	56.4 Å²	56.4	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-58.4	-50.7	179.6	-159.6	177.8	172.4	-179.3	0	111.7	V32 D33 V34 S38 V39 D40	V32-K36 WeakPolarHBondContact O-CB 3.37Å; V32-K36 PolarHBondContact O-N 3.32Å; D33-K36 WeakPolarHBondContact O-CB 3.41Å; D33-K36 PolarHBondContact O-N 2.97Å; V34-K36 VanDerWaalsContact C-N 3.33Å; V34-K36 PolarHBondContact O-N 2.79Å; K36-S38 PolarHBondContact O-N 3.2Å; K36-V39 WeakPolarHBondContact O-CB 3.38Å; K36-V39 PolarHBondContact O-N 3Å; K36-D40 VanDerWaalsContact O-CG 3.31Å; K36-D40 PolarHBondContact O-N 2.88Å
37	K	68.5	Low	62.1	Low	150 Å²	150	60 Å²	60	65%	0.652	32%	0.321	S	S	*	.	H	α-helix	trans	-60.3	-32.8	-179.8	-75.9	174.8	-178.7	172.9	0	111.8	D33 V34 T35 D40 L41	D33-K37 WeakPolarHBondContact O-CG 3.43Å; D33-K37 PolarHBondContact O-N 3.36Å; V34-K37 PolarHBondContact O-N 3.01Å; T35-K37 PolarHBondContact O-N 3.4Å; K37-D40 PolarHBondContact O-N 2.91Å; K37-L41 WeakPolarHBondContact O-CB 2.84Å; K37-L41 PolarHBondContact O-N 3.23Å
38	S	64	Low	62.3	Low	4 Å²	4	66.2 Å²	66.2	3%	0.028	35%	0.35	C	S	.	.	H	α-helix	trans	-80.2	-36.2	-176.3	-57.9	0	0	0	0	112.7	D26 V34 T35 K36 D40 L41 L42	D26-S38 WeakPolarHBondContact CB-OG 3.44Å; V34-S38 WeakPolarHBondContact O-CB 3.46Å; V34-S38 PolarHBondContact O-N 3.44Å; V34-S38 VanDerWaalsContact O-N 3.12Å; V34-S38 PolarHBondContact O-OG 3.48Å; T35-S38 PolarHBondContact O-N 3.23Å; K36-S38 PolarHBondContact O-N 3.2Å; S38-D40 VanDerWaalsContact C-N 3.34Å; S38-L41 PolarHBondContact O-N 2.88Å; S38-L42 WeakPolarHBondContact O-CB 3.39Å; S38-L42 PolarHBondContact O-N 2.93Å
39	V	60.5	Low	62.7	Low	12 Å²	12	66.4 Å²	66.4	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-55.3	-50.2	161.8	149.7	0	0	0	0	110.8	L27 T35 K36 L41 L42 Y43 S80	L27-V39 HydrophobicContact CD2-CG2 3.91Å; T35-V39 PolarHBondContact O-N 2.99Å; K36-V39 WeakPolarHBondContact O-CB 3.38Å; K36-V39 PolarHBondContact O-N 3Å; V39-L41 VanDerWaalsContact C-N 3.26Å; V39-L41 PolarHBondContact O-N 3.37Å; V39-L42 WeakPolarHBondContact O-CB 3.37Å; V39-L42 PolarHBondContact O-N 3.42Å; V39-Y43 PolarHBondContact O-N 2.88Å; V39-S80 WeakPolarHBondContact CG1-OG 3.46Å
40	D	61.2	Low	62.1	Low	79 Å²	79	65.9 Å²	65.9	42%	0.422	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-34.6	-178.3	-68.7	-27.5	0	0	0	110.5	K36 K37 S38 Y43 M44	K36-D40 VanDerWaalsContact O-CG 3.31Å; K36-D40 PolarHBondContact O-N 2.88Å; K37-D40 PolarHBondContact O-N 2.91Å; S38-D40 VanDerWaalsContact C-N 3.34Å; D40-Y43 WeakPolarHBondContact O-CB 3.41Å; D40-Y43 PolarHBondContact O-N 3.41Å; D40-M44 WeakPolarHBondContact O-CG 3.34Å; D40-M44 PolarHBondContact O-N 3.35Å
41	L	65.6	Low	61.8	Low	57 Å²	57	64.5 Å²	64.5	30%	0.298	33%	0.33	S	S	.	.	H	α-helix	trans	-66.1	-45.2	173.7	-155	92.9	0	0	0	111.3	M19 I23 K37 S38 V39 Y43 M44 V45	M19-L41 HydrophobicContact CG-CD2 3.77Å; M19-L41 HydrophobicContact SD-CD2 4.14Å; I23-L41 HydrophobicContact CD1-CD2 3.92Å; I23-L41 HydrophobicContact CG1-CB 4.47Å; I23-L41 HydrophobicContact CG1-CD2 3.63Å; K37-L41 WeakPolarHBondContact O-CB 2.84Å; K37-L41 PolarHBondContact O-N 3.23Å; S38-L41 PolarHBondContact O-N 2.88Å; V39-L41 VanDerWaalsContact C-N 3.26Å; V39-L41 PolarHBondContact O-N 3.37Å; L41-Y43 VanDerWaalsContact C-N 3.26Å; L41-Y43 PolarHBondContact O-N 3.38Å; L41-M44 HydrophobicContact CD1-CE 3.84Å; L41-M44 HydrophobicContact CG-CE 4.49Å; L41-M44 PolarHBondContact O-N 2.94Å; L41-V45 VanDerWaalsContact O-CG2 3.29Å; L41-V45 WeakPolarHBondContact O-CG2 3.37Å; L41-V45 PolarHBondContact O-N 2.81Å
42	L	65.2	Low	60.9	Low	8 Å²	8	67 Å²	67	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-42.3	174.3	-175.7	69.5	0	0	0	110.3	I23 S38 V39 V45 V46 L57 L65 F81	I23-L42 HydrophobicContact CD1-CB 4.48Å; I23-L42 HydrophobicContact CD1-CD1 4.38Å; I23-L42 HydrophobicContact CG2-CB 4.48Å; S38-L42 WeakPolarHBondContact O-CB 3.39Å; S38-L42 PolarHBondContact O-N 2.93Å; V39-L42 WeakPolarHBondContact O-CB 3.37Å; V39-L42 PolarHBondContact O-N 3.42Å; L42-V45 PolarHBondContact O-N 2.85Å; L42-V46 HydrophobicContact CG-CG2 4.46Å; L42-V46 WeakPolarHBondContact O-CB 3.42Å; L42-V46 WeakPolarHBondContact O-CG2 3.48Å; L42-V46 PolarHBondContact O-N 3.25Å; L42-L57 HydrophobicContact CD1-CD2 4.45Å; L42-L65 HydrophobicContact CD1-CD1 4.43Å; L42-L65 HydrophobicContact CD2-CD1 4.21Å; L42-F81 HydrophobicContact CD2-CD2 4Å; L42-F81 HydrophobicContact CD2-CE2 4.19Å
43	Y	60.3	Low	60	Low	72 Å²	72	65.3 Å²	65.3	28%	0.282	34%	0.344	S	S	.	.	H	α-helix	trans	-58.6	-49.4	173.4	171.9	-127.6	0	0	0	112.1	V39 D40 L41 V45 V46 K47 A84 P87	V39-Y43 PolarHBondContact O-N 2.88Å; D40-Y43 WeakPolarHBondContact O-CB 3.41Å; D40-Y43 PolarHBondContact O-N 3.41Å; L41-Y43 VanDerWaalsContact C-N 3.26Å; L41-Y43 PolarHBondContact O-N 3.38Å; Y43-V45 VanDerWaalsContact C-N 3.31Å; Y43-V45 PolarHBondContact O-N 3.38Å; Y43-V46 PolarHBondContact O-N 2.81Å; Y43-K47 HydrophobicContact CE1-CD 4.35Å; Y43-K47 HydrophobicContact CE2-CB 4.42Å; Y43-K47 HydrophobicContact CE2-CD 4.4Å; Y43-K47 WeakPolarHBondContact O-CB 3.22Å; Y43-K47 PolarHBondContact O-N 3.21Å; Y43-A84 HydrophobicContact CD2-CB 3.58Å; Y43-A84 HydrophobicContact CE2-CB 4.48Å; Y43-A84 HydrophobicContact CG-CB 4.16Å; Y43-P87 HydrophobicContact CE2-CG 4.36Å
44	M	61.6	Low	58.8	Low	99 Å²	99	64.3 Å²	64.3	49%	0.488	34%	0.341	S	S	.	.	H	α-helix	trans	-59.6	-42.9	177.8	-71.7	-164.5	-55.8	0	0	111.6	D40 L41 K47 E48	D40-M44 WeakPolarHBondContact O-CG 3.34Å; D40-M44 PolarHBondContact O-N 3.35Å; L41-M44 HydrophobicContact CD1-CE 3.84Å; L41-M44 HydrophobicContact CG-CE 4.49Å; L41-M44 PolarHBondContact O-N 2.94Å; M44-K47 PolarHBondContact O-N 3.12Å; M44-E48 WeakPolarHBondContact O-CB 3.37Å; M44-E48 WeakPolarHBondContact O-CG 3.49Å; M44-E48 PolarHBondContact O-N 3.19Å
45	V	62.4	Low	58.1	Low	30 Å²	30	66.1 Å²	66.1	18%	0.182	35%	0.346	C	S	.	.	H	α-helix	trans	-62.7	-49.4	178.6	172	0	0	0	0	111.1	M19 L41 L42 Y43 K47 E48 Q49	M19-V45 HydrophobicContact SD-CG2 3.37Å; M19-V45 WeakPolarHBondContact SD-CG2 3.35Å; L41-V45 VanDerWaalsContact O-CG2 3.29Å; L41-V45 WeakPolarHBondContact O-CG2 3.37Å; L41-V45 PolarHBondContact O-N 2.81Å; L42-V45 PolarHBondContact O-N 2.85Å; Y43-V45 VanDerWaalsContact C-N 3.31Å; Y43-V45 PolarHBondContact O-N 3.38Å; V45-K47 VanDerWaalsContact C-N 3.32Å; V45-K47 PolarHBondContact O-N 3.5Å; V45-E48 PolarHBondContact O-N 2.79Å; V45-Q49 HydrophobicContact CG1-CG 4.08Å; V45-Q49 VanDerWaalsContact O-CB 3.25Å; V45-Q49 WeakPolarHBondContact O-CB 3.29Å; V45-Q49 WeakPolarHBondContact O-CG 3.28Å; V45-Q49 PolarHBondContact O-N 2.92Å
46	V	59.6	Low	57.6	Low	4 Å²	4	69.6 Å²	69.6	2%	0.024	37%	0.367	C	S	.	.	H	α-helix	trans	-61.8	-42.9	178.5	174.1	0	0	0	0	110.3	L42 Y43 Q49 S50 L57 M85 M88	L42-V46 HydrophobicContact CG-CG2 4.46Å; L42-V46 WeakPolarHBondContact O-CB 3.42Å; L42-V46 WeakPolarHBondContact O-CG2 3.48Å; L42-V46 PolarHBondContact O-N 3.25Å; Y43-V46 PolarHBondContact O-N 2.81Å; V46-Q49 PolarHBondContact O-N 3.45Å; V46-S50 WeakPolarHBondContact O-CB 3.41Å; V46-S50 PolarHBondContact O-N 2.85Å; V46-S50 PolarHBondContact O-OG 2.81Å; V46-S50 VanDerWaalsContact O-OG 3.12Å; V46-L57 HydrophobicContact CG2-CD1 3.77Å; V46-M85 HydrophobicContact CG1-SD 3.93Å; V46-M88 HydrophobicContact CG1-SD 3.75Å
47	K	57.7	Low	57.3	Low	112 Å²	112	66 Å²	66	49%	0.487	35%	0.353	S	S	.	.	H	α-helix	trans	-63.3	-45.6	178	-173.5	179.5	179.5	178.4	0	112.1	Y43 M44 V45 S50 S51	Y43-K47 HydrophobicContact CE1-CD 4.35Å; Y43-K47 HydrophobicContact CE2-CB 4.42Å; Y43-K47 HydrophobicContact CE2-CD 4.4Å; Y43-K47 WeakPolarHBondContact O-CB 3.22Å; Y43-K47 PolarHBondContact O-N 3.21Å; M44-K47 PolarHBondContact O-N 3.12Å; V45-K47 VanDerWaalsContact C-N 3.32Å; V45-K47 PolarHBondContact O-N 3.5Å; K47-S50 PolarHBondContact O-OG 3.41Å; K47-S51 PolarHBondContact O-N 3.35Å
48	E	60	Low	56.7	Low	134 Å²	134	61.1 Å²	61.1	63%	0.626	33%	0.334	S	S	*	.	H	α-helix	trans	-66.9	-44.9	177.1	-75.7	-176.7	172	0	0	111.6	M44 V45 S50 S51	M44-E48 WeakPolarHBondContact O-CB 3.37Å; M44-E48 WeakPolarHBondContact O-CG 3.49Å; M44-E48 PolarHBondContact O-N 3.19Å; V45-E48 PolarHBondContact O-N 2.79Å; E48-S50 PolarHBondContact O-N 3.24Å; E48-S51 PolarHBondContact O-N 2.83Å; E48-S51 PolarHBondContact O-OG 3.27Å
49	Q	59.9	Low	55.8	Low	51 Å²	51	63.2 Å²	63.2	24%	0.238	35%	0.349	C	S	.	.	H	α-helix	trans	-65.9	-37.3	179.7	-65.7	-106	-42.1	0	0	112.1	V45 V46 S51 L52 G53 V54	V45-Q49 HydrophobicContact CG1-CG 4.08Å; V45-Q49 VanDerWaalsContact O-CB 3.25Å; V45-Q49 WeakPolarHBondContact O-CB 3.29Å; V45-Q49 WeakPolarHBondContact O-CG 3.28Å; V45-Q49 PolarHBondContact O-N 2.92Å; V46-Q49 PolarHBondContact O-N 3.45Å; Q49-S51 VanDerWaalsContact C-N 3.3Å; Q49-S51 PolarHBondContact O-N 3.12Å; Q49-L52 PolarHBondContact O-N 2.89Å; Q49-G53 PolarHBondContact O-N 3.09Å; Q49-V54 PolarHBondContact OE1-O 3.07Å; Q49-V54 VanDerWaalsContact OE1-O 3.06Å
50	S	51.7	Low	55.4	Low	22 Å²	22	65.1 Å²	65.1	15%	0.154	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-37.4	178.2	64.7	0	0	0	0	112.3	V46 K47 E48 L52 G53	V46-S50 WeakPolarHBondContact O-CB 3.41Å; V46-S50 PolarHBondContact O-N 2.85Å; V46-S50 PolarHBondContact O-OG 2.81Å; V46-S50 VanDerWaalsContact O-OG 3.12Å; K47-S50 PolarHBondContact O-OG 3.41Å; E48-S50 PolarHBondContact O-N 3.24Å; S50-L52 PolarHBondContact O-N 3.29Å; S50-G53 PolarHBondContact O-N 3.11Å
51	S	50.4	Low	55.1	Low	96 Å²	96	61.9 Å²	61.9	67%	0.671	35%	0.345	S	S	*	.	H	α-helix	trans	-67.5	-21.5	175.2	73.8	0	0	0	0	113.8	K47 E48 Q49	K47-S51 PolarHBondContact O-N 3.35Å; E48-S51 PolarHBondContact O-N 2.83Å; E48-S51 PolarHBondContact O-OG 3.27Å; Q49-S51 VanDerWaalsContact C-N 3.3Å; Q49-S51 PolarHBondContact O-N 3.12Å
52	L	51.6	Low	54.5	Low	125 Å²	125	59.5 Å²	59.5	65%	0.654	33%	0.333	S	S	*	.	H	α-helix	trans	-93.1	-8.3	179.2	-65.2	169.9	0	0	0	112.6	Q49 S50 V54	Q49-L52 PolarHBondContact O-N 2.89Å; S50-L52 PolarHBondContact O-N 3.29Å; L52-V54 PolarHBondContact O-N 3.31Å; L52-V54 VanDerWaalsContact O-N 3.12Å
53	G	43.6	Very low	53.8	Low	56 Å²	56	64.7 Å²	64.7	58%	0.577	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	11.6	-176.4	0	0	0	0	0	114.4	Q49 S50	Q49-G53 PolarHBondContact O-N 3.09Å; S50-G53 PolarHBondContact O-N 3.11Å
54	V	45.2	Very low	53.4	Low	80 Å²	80	64.7 Å²	64.7	49%	0.485	36%	0.362	S	S	.	.			trans	-106.2	105.6	-178.8	-179.6	0	0	0	0	107.9	Q49 L52 T56	Q49-V54 PolarHBondContact OE1-O 3.07Å; Q49-V54 VanDerWaalsContact OE1-O 3.06Å; L52-V54 PolarHBondContact O-N 3.31Å; L52-V54 VanDerWaalsContact O-N 3.12Å; V54-T56 HydrophobicContact CG1-CG2 4.14Å
55	F	52.4	Low	52.9	Low	77 Å²	77	60.6 Å²	60.6	34%	0.338	34%	0.342	S	S	.	.			trans	-100	97.3	177.2	-67.2	-77.8	0	0	0	110.1	M88 L96 A99	F55-M88 HydrophobicContact CD1-CE 4.23Å; F55-M88 HydrophobicContact CE1-CE 3.25Å; F55-M88 HydrophobicContact CE1-SD 3.88Å; F55-M88 HydrophobicContact CE2-CE 4.49Å; F55-M88 HydrophobicContact CZ-CE 3.42Å; F55-M88 VanDerWaalsContact CZ-CE 3.42Å; F55-M88 HydrophobicContact CZ-SD 4.34Å; F55-L96 HydrophobicContact CE2-CD2 3.66Å; F55-L96 HydrophobicContact CZ-CD2 3.46Å; F55-L96 VanDerWaalsContact CZ-CD2 3.46Å; F55-A99 HydrophobicContact CD2-CB 4.11Å; F55-A99 HydrophobicContact CE2-CB 4.06Å; F55-A99 HydrophobicContact CG-CB 4.4Å; F55-A99 HydrophobicContact CZ-CB 4.31Å
56	T	48.4	Very low	52.3	Low	80 Å²	80	59.8 Å²	59.8	49%	0.491	34%	0.338	S	S	.	.			trans	-119.7	40.1	171.5	57.2	0	0	0	0	112.1	V54 D58	V54-T56 HydrophobicContact CG1-CG2 4.14Å; T56-D58 PolarHBondContact O-N 2.99Å
57	L	53.4	Low	51.7	Low	39 Å²	39	63.1 Å²	63.1	20%	0.204	37%	0.366	C	S	.	.			trans	-73.4	88.1	153.5	-79.7	166.4	0	0	0	105.9	L42 V46 T61 L62 L103	L42-L57 HydrophobicContact CD1-CD2 4.45Å; V46-L57 HydrophobicContact CG2-CD1 3.77Å; L57-T61 HydrophobicContact CD2-CG2 3.66Å; L57-L62 HydrophobicContact CB-CD1 4.41Å; L57-L103 HydrophobicContact CB-CD2 3.98Å; L57-L103 HydrophobicContact CD1-CD1 4.44Å; L57-L103 HydrophobicContact CD1-CD2 4.13Å
58	D	55.4	Low	51.3	Low	46 Å²	46	58 Å²	58	25%	0.246	35%	0.345	C	S	.	.			trans	-59.6	146	175	58.1	25.3	0	0	0	109.4	R17 T56 S60 T61	R17-D58 IonicContact NE-OD2 3.82Å; T56-D58 PolarHBondContact O-N 2.99Å; D58-S60 PolarHBondContact O-N 3.44Å; D58-S60 PolarHBondContact OD1-OG 2.86Å; D58-S60 PolarHBondContact OD2-OG 3.13Å; D58-T61 WeakPolarHBondContact O-CB 3.45Å; D58-T61 PolarHBondContact O-N 3.07Å; D58-T61 WeakPolarHBondContact OD1-CB 3.47Å; D58-T61 PolarHBondContact OD1-N 2.93Å; D58-T61 PolarHBondContact OD1-OG1 2.8Å
59	S	46.8	Very low	51	Low	48 Å²	48	51.7 Å²	51.7	34%	0.336	32%	0.316	S	S	.	.	H	α-helix	trans	-52.6	-27.7	178.1	177.6	0	0	0	0	111.5	T61 L62 Q63 E106	S59-T61 VanDerWaalsContact C-N 3.34Å; S59-T61 PolarHBondContact O-N 3.46Å; S59-L62 PolarHBondContact O-N 2.66Å; S59-Q63 WeakPolarHBondContact O-CB 3.44Å; S59-Q63 WeakPolarHBondContact O-CG 3.32Å; S59-Q63 PolarHBondContact O-N 2.69Å; S59-Q63 PolarHBondContact OG-NE2 3.23Å; S59-E106 PolarHBondContact OG-OE2 2.94Å
60	S	51.5	Low	50.5	Low	52 Å²	52	54.6 Å²	54.6	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-36.3	172	44.3	0	0	0	0	114.2	D58 L64	D58-S60 PolarHBondContact O-N 3.44Å; D58-S60 PolarHBondContact OD1-OG 2.86Å; D58-S60 PolarHBondContact OD2-OG 3.13Å; S60-L64 VanDerWaalsContact O-CB 3.28Å; S60-L64 WeakPolarHBondContact O-CB 3.47Å; S60-L64 VanDerWaalsContact O-CD1 3.28Å; S60-L64 WeakPolarHBondContact O-CD1 3.29Å; S60-L64 WeakPolarHBondContact O-CG 3.48Å; S60-L64 PolarHBondContact O-N 3.19Å
61	T	54.7	Low	50.6	Low	11 Å²	11	57.1 Å²	57.1	7%	0.067	36%	0.356	C	S	.	.	H	α-helix	trans	-66.1	-42.2	176	-62	0	0	0	0	110.5	A20 L57 D58 S59 L64 L65	A20-T61 HydrophobicContact CB-CG2 3.53Å; L57-T61 HydrophobicContact CD2-CG2 3.66Å; D58-T61 WeakPolarHBondContact O-CB 3.45Å; D58-T61 PolarHBondContact O-N 3.07Å; D58-T61 WeakPolarHBondContact OD1-CB 3.47Å; D58-T61 PolarHBondContact OD1-N 2.93Å; D58-T61 PolarHBondContact OD1-OG1 2.8Å; S59-T61 VanDerWaalsContact C-N 3.34Å; S59-T61 PolarHBondContact O-N 3.46Å; T61-L64 PolarHBondContact O-N 3Å; T61-L65 VanDerWaalsContact O-CG 3.29Å; T61-L65 WeakPolarHBondContact O-CG 3.43Å; T61-L65 PolarHBondContact O-N 3.31Å
62	L	52.9	Low	51	Low	8 Å²	8	53.4 Å²	53.4	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-73.2	-38.2	178.6	-70.4	150.8	0	0	0	112.6	L57 S59 L64 L65 A66 F81 L103 E106	L57-L62 HydrophobicContact CB-CD1 4.41Å; S59-L62 PolarHBondContact O-N 2.66Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 2.93Å; L62-L65 HydrophobicContact CD2-CD1 3.92Å; L62-L65 WeakPolarHBondContact O-CB 3.22Å; L62-L65 PolarHBondContact O-N 2.97Å; L62-L65 VanDerWaalsContact O-N 3.16Å; L62-A66 PolarHBondContact O-N 3.39Å; L62-F81 HydrophobicContact CD2-CE2 4.34Å; L62-F81 HydrophobicContact CD2-CZ 4.44Å; L62-L103 HydrophobicContact CD1-CD2 3.64Å; L62-E106 HydrophobicContact CB-CB 3.84Å; L62-E106 HydrophobicContact CB-CG 4.44Å; L62-E106 HydrophobicContact CD1-CB 3.6Å; L62-E106 HydrophobicContact CD1-CG 3.72Å; L62-E106 HydrophobicContact CD2-CB 4.23Å; L62-E106 HydrophobicContact CG-CB 4.06Å
63	Q	50.5	Low	51.7	Low	117 Å²	117	51.2 Å²	51.2	55%	0.547	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-35.4	171.3	-74.6	174.3	7.8	0	0	112.4	S59 A66 A67	S59-Q63 WeakPolarHBondContact O-CB 3.44Å; S59-Q63 WeakPolarHBondContact O-CG 3.32Å; S59-Q63 PolarHBondContact O-N 2.69Å; S59-Q63 PolarHBondContact OG-NE2 3.23Å; Q63-A66 VanDerWaalsContact O-CB 3.32Å; Q63-A66 WeakPolarHBondContact O-CB 3.46Å; Q63-A66 PolarHBondContact O-N 2.87Å; Q63-A67 PolarHBondContact O-N 3.37Å
64	L	50.9	Low	52.9	Low	71 Å²	71	48.6 Å²	48.6	37%	0.372	29%	0.291	S	S	.	.	H	α-helix	trans	-74.4	-34.4	174.5	-78.1	161	0	0	0	111.9	I24 S60 T61 L62 A66 A67 G68	I24-L64 HydrophobicContact CD1-CB 3.08Å; I24-L64 HydrophobicContact CD1-CD1 3.64Å; I24-L64 HydrophobicContact CD1-CD2 4.4Å; I24-L64 HydrophobicContact CD1-CG 3.87Å; I24-L64 HydrophobicContact CG1-CB 3.71Å; I24-L64 HydrophobicContact CG2-CB 4.2Å; I24-L64 VanDerWaalsContact CG2-O 3.31Å; I24-L64 WeakPolarHBondContact CG2-O 3.15Å; S60-L64 VanDerWaalsContact O-CB 3.28Å; S60-L64 WeakPolarHBondContact O-CB 3.47Å; S60-L64 VanDerWaalsContact O-CD1 3.28Å; S60-L64 WeakPolarHBondContact O-CD1 3.29Å; S60-L64 WeakPolarHBondContact O-CG 3.48Å; S60-L64 PolarHBondContact O-N 3.19Å; T61-L64 PolarHBondContact O-N 3Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 2.93Å; L64-A66 VanDerWaalsContact C-N 3.25Å; L64-A66 PolarHBondContact O-N 3.18Å; L64-A67 PolarHBondContact O-N 3.02Å; L64-G68 PolarHBondContact O-N 3.49Å
65	L	52.1	Low	54.2	Low	14 Å²	14	46.6 Å²	46.6	7%	0.073	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-43	168.2	-67.9	171.1	0	0	0	109.8	I23 I24 L27 L42 T61 L62 A67 G68 M69	I23-L65 HydrophobicContact CG2-CD2 3.91Å; I24-L65 HydrophobicContact CG1-CD2 4.08Å; I24-L65 HydrophobicContact CG1-CG 4.37Å; L27-L65 HydrophobicContact CD1-CD2 3.1Å; L42-L65 HydrophobicContact CD1-CD1 4.43Å; L42-L65 HydrophobicContact CD2-CD1 4.21Å; T61-L65 VanDerWaalsContact O-CG 3.29Å; T61-L65 WeakPolarHBondContact O-CG 3.43Å; T61-L65 PolarHBondContact O-N 3.31Å; L62-L65 HydrophobicContact CD2-CD1 3.92Å; L62-L65 WeakPolarHBondContact O-CB 3.22Å; L62-L65 PolarHBondContact O-N 2.97Å; L62-L65 VanDerWaalsContact O-N 3.16Å; L65-A67 VanDerWaalsContact C-N 3.32Å; L65-A67 PolarHBondContact O-N 3.18Å; L65-G68 PolarHBondContact O-N 2.88Å; L65-G68 VanDerWaalsContact O-N 3.17Å; L65-M69 WeakPolarHBondContact O-CG 3.36Å; L65-M69 PolarHBondContact O-N 3.05Å
66	A	49	Very low	55.1	Low	12 Å²	12	46.1 Å²	46.1	10%	0.099	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-38	174.6	0	0	0	0	0	113.1	L62 Q63 L64 G68 M69 A110	L62-A66 PolarHBondContact O-N 3.39Å; Q63-A66 VanDerWaalsContact O-CB 3.32Å; Q63-A66 WeakPolarHBondContact O-CB 3.46Å; Q63-A66 PolarHBondContact O-N 2.87Å; L64-A66 VanDerWaalsContact C-N 3.25Å; L64-A66 PolarHBondContact O-N 3.18Å; A66-G68 VanDerWaalsContact C-N 3.27Å; A66-G68 PolarHBondContact O-N 3.07Å; A66-M69 VanDerWaalsContact CA-CG 3.46Å; A66-M69 WeakPolarHBondContact O-CB 3.39Å; A66-M69 WeakPolarHBondContact O-CG 3.41Å; A66-M69 PolarHBondContact O-N 3.41Å; A66-A110 HydrophobicContact CB-CB 3.44Å; A66-A110 VanDerWaalsContact CB-CB 3.44Å
67	A	47.8	Very low	56.2	Low	74 Å²	74	43 Å²	43	61%	0.612	25%	0.254	S	S	*	.	H	α-helix	trans	-68	-25.2	178.4	0	0	0	0	0	113.4	Q63 L64 L65 P70	Q63-A67 PolarHBondContact O-N 3.37Å; L64-A67 PolarHBondContact O-N 3.02Å; L65-A67 VanDerWaalsContact C-N 3.32Å; L65-A67 PolarHBondContact O-N 3.18Å; A67-P70 WeakPolarHBondContact O-CD 3.4Å
68	G	50.1	Low	57.4	Low	5 Å²	5	41.1 Å²	41.1	5%	0.052	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.9	174.8	0	0	0	0	0	114.5	L64 L65 A66 S71	L64-G68 PolarHBondContact O-N 3.49Å; L65-G68 PolarHBondContact O-N 2.88Å; L65-G68 VanDerWaalsContact O-N 3.17Å; A66-G68 VanDerWaalsContact C-N 3.27Å; A66-G68 PolarHBondContact O-N 3.07Å; G68-S71 PolarHBondContact O-OG 3.02Å
69	M	52.6	Low	58.3	Low	2 Å²	2	40.5 Å²	40.5	1%	0.01	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-57.3	-35.2	-176.3	-68.4	-73.6	-77.5	0	0	117.5	L65 A66 S71 L72 L77 A110 M111 A114	L65-M69 WeakPolarHBondContact O-CG 3.36Å; L65-M69 PolarHBondContact O-N 3.05Å; A66-M69 VanDerWaalsContact CA-CG 3.46Å; A66-M69 WeakPolarHBondContact O-CB 3.39Å; A66-M69 WeakPolarHBondContact O-CG 3.41Å; A66-M69 PolarHBondContact O-N 3.41Å; M69-S71 PolarHBondContact O-N 3.32Å; M69-L72 PolarHBondContact O-N 3.07Å; M69-L72 HydrophobicContact SD-CD1 4.3Å; M69-L77 HydrophobicContact CE-CD2 3.74Å; M69-L77 HydrophobicContact SD-CD2 3.04Å; M69-L77 WeakPolarHBondContact SD-CD2 3.29Å; M69-L77 HydrophobicContact SD-CG 4.47Å; M69-A110 HydrophobicContact CG-CB 4.49Å; M69-M111 HydrophobicContact CE-CE 4.08Å; M69-M111 HydrophobicContact CE-CG 4.18Å; M69-M111 HydrophobicContact CE-SD 3.18Å; M69-M111 WeakPolarHBondContact CE-SD 3.48Å; M69-A114 HydrophobicContact CB-CB 4.27Å; M69-A114 HydrophobicContact CE-CB 4.09Å
70	P	49.7	Very low	59.3	Low	112 Å²	112	39.3 Å²	39.3	73%	0.727	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-61.3	-17	-171.2	-25.1	34.3	0	0	0	114.9	A67	A67-P70 WeakPolarHBondContact O-CD 3.4Å
71	S	52.8	Low	60.4	Low	74 Å²	74	37.1 Å²	37.1	52%	0.517	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-99.7	-3.7	175.9	55.4	0	0	0	0	114.5	A28 G68 M69	A28-S71 PolarHBondContact O-OG 3.27Å; G68-S71 PolarHBondContact O-OG 3.02Å; M69-S71 PolarHBondContact O-N 3.32Å
72	L	59.5	Low	61.5	Low	19 Å²	19	37.5 Å²	37.5	10%	0.099	22%	0.221	C	C	.	.	S	Bend	trans	-97.2	137	-173.6	-74.4	164.6	0	0	0	112	L27 T35 M69 G74	L27-L72 HydrophobicContact CB-CD1 4.18Å; L27-L72 VanDerWaalsContact O-CD2 3.3Å; L27-L72 WeakPolarHBondContact O-CD2 3.43Å; L27-L72 WeakPolarHBondContact O-CG 3.47Å; T35-L72 HydrophobicContact CG2-CD2 3.27Å; M69-L72 PolarHBondContact O-N 3.07Å; M69-L72 HydrophobicContact SD-CD1 4.3Å; L72-G74 PolarHBondContact O-N 3.49Å; L72-G74 VanDerWaalsContact O-N 3.1Å
73	D	67.3	Low	62.4	Low	78 Å²	78	44 Å²	44	42%	0.417	25%	0.249	S	C	.	.			trans	-63.9	106.6	161	178.4	7.8	0	0	0	108.2	N75 R76 L77 R120	D73-N75 VanDerWaalsContact C-N 3.25Å; D73-N75 PolarHBondContact O-N 2.76Å; D73-R76 HydrophobicContact CB-CB 4.16Å; D73-R76 WeakPolarHBondContact O-CB 3.32Å; D73-R76 PolarHBondContact O-N 2.84Å; D73-L77 PolarHBondContact O-N 2.99Å; D73-R120 IonicContact OD1-NH1 3.62Å
74	G	68.5	Low	63.1	Low	1 Å²	1	38.6 Å²	38.6	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-33	-168.3	0	0	0	0	0	112.4	L72 R76 L77 V78 E117	L72-G74 PolarHBondContact O-N 3.49Å; L72-G74 VanDerWaalsContact O-N 3.1Å; G74-R76 VanDerWaalsContact C-N 3.3Å; G74-R76 PolarHBondContact O-N 2.63Å; G74-L77 PolarHBondContact O-N 3.44Å; G74-V78 WeakPolarHBondContact O-CG2 3.42Å; G74-V78 PolarHBondContact O-N 2.98Å; G74-E117 PolarHBondContact N-OE2 3.47Å; G74-E117 VanDerWaalsContact N-OE2 3.16Å
75	N	72.8	Confident	64.1	Low	39 Å²	39	35.2 Å²	35.2	21%	0.209	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-42.1	174.7	-178.9	30.4	0	0	0	111.5	D73 L77 V78 T79	D73-N75 VanDerWaalsContact C-N 3.25Å; D73-N75 PolarHBondContact O-N 2.76Å; N75-L77 VanDerWaalsContact C-N 3.32Å; N75-L77 PolarHBondContact O-N 3.24Å; N75-V78 PolarHBondContact O-N 3.07Å; N75-T79 VanDerWaalsContact O-CB 3.3Å; N75-T79 WeakPolarHBondContact O-CB 3.35Å; N75-T79 PolarHBondContact O-N 3.06Å; N75-T79 PolarHBondContact O-OG1 2.86Å; N75-T79 PolarHBondContact OD1-OG1 3.25Å
76	R	70.5	Confident	65.2	Low	67 Å²	67	36.6 Å²	36.6	25%	0.253	22%	0.22	S	C	.	.	H	α-helix	trans	-63.7	-40.7	178.2	-171.2	178.8	-179.2	-156.4	3.4	111.1	V32 D73 G74 S80	V32-R76 PolarHBondContact O-NH1 2.87Å; V32-R76 PolarHBondContact O-NH2 3.44Å; D73-R76 HydrophobicContact CB-CB 4.16Å; D73-R76 WeakPolarHBondContact O-CB 3.32Å; D73-R76 PolarHBondContact O-N 2.84Å; G74-R76 VanDerWaalsContact C-N 3.3Å; G74-R76 PolarHBondContact O-N 2.63Å; R76-S80 WeakPolarHBondContact O-CB 3.09Å; R76-S80 PolarHBondContact O-N 3.48Å; R76-S80 PolarHBondContact O-OG 3.41Å
77	L	71.2	Confident	66.2	Low	13 Å²	13	38.7 Å²	38.7	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-50	175.9	179.3	69	0	0	0	111.5	M69 D73 G74 N75 T79 S80 F81 L107	M69-L77 HydrophobicContact CE-CD2 3.74Å; M69-L77 HydrophobicContact SD-CD2 3.04Å; M69-L77 WeakPolarHBondContact SD-CD2 3.29Å; M69-L77 HydrophobicContact SD-CG 4.47Å; D73-L77 PolarHBondContact O-N 2.99Å; G74-L77 PolarHBondContact O-N 3.44Å; N75-L77 VanDerWaalsContact C-N 3.32Å; N75-L77 PolarHBondContact O-N 3.24Å; L77-T79 PolarHBondContact O-N 3.13Å; L77-S80 WeakPolarHBondContact O-CB 3.34Å; L77-S80 PolarHBondContact O-N 2.78Å; L77-F81 WeakPolarHBondContact O-CB 3.35Å; L77-F81 PolarHBondContact O-N 3.3Å; L77-L107 HydrophobicContact CD2-CD1 4.07Å; L77-L107 HydrophobicContact CG-CD1 4.28Å
78	V	78.2	Confident	67.4	Low	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-47.1	-179.5	177.8	0	0	0	0	110.3	G74 N75 S80 F81 A82 L107 M111 T123 Q126 L127	G74-V78 WeakPolarHBondContact O-CG2 3.42Å; G74-V78 PolarHBondContact O-N 2.98Å; N75-V78 PolarHBondContact O-N 3.07Å; V78-S80 VanDerWaalsContact C-N 3.26Å; V78-S80 PolarHBondContact O-N 3.36Å; V78-F81 PolarHBondContact O-N 3.43Å; V78-A82 VanDerWaalsContact O-CB 3.27Å; V78-A82 WeakPolarHBondContact O-CB 3.42Å; V78-A82 PolarHBondContact O-N 3.26Å; V78-L107 HydrophobicContact CG1-CD2 4.42Å; V78-L107 HydrophobicContact CG2-CD2 4.36Å; V78-M111 HydrophobicContact CG2-CE 4.27Å; V78-M111 HydrophobicContact CG2-CG 3.96Å; V78-M111 HydrophobicContact CG2-SD 3.58Å; V78-M111 VanDerWaalsContact CG2-SD 3.58Å; V78-T123 HydrophobicContact CB-CG2 4.47Å; V78-T123 HydrophobicContact CG2-CG2 3.8Å; V78-Q126 HydrophobicContact CB-CB 4.39Å; V78-Q126 HydrophobicContact CG1-CB 3.56Å; V78-L127 HydrophobicContact CG1-CD2 3.78Å; V78-L127 HydrophobicContact CG1-CG 3.89Å; V78-L127 HydrophobicContact CG2-CD2 3.9Å; V78-L127 HydrophobicContact CG2-CG 4.13Å
79	T	74.5	Confident	68.9	Low	34 Å²	34	36 Å²	36	21%	0.209	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-41.2	177.7	-59.8	0	0	0	0	111.8	N75 L77 A82 K83	N75-T79 VanDerWaalsContact O-CB 3.3Å; N75-T79 WeakPolarHBondContact O-CB 3.35Å; N75-T79 PolarHBondContact O-N 3.06Å; N75-T79 PolarHBondContact O-OG1 2.86Å; N75-T79 PolarHBondContact OD1-OG1 3.25Å; L77-T79 PolarHBondContact O-N 3.13Å; T79-A82 PolarHBondContact O-N 3.03Å; T79-K83 WeakPolarHBondContact O-CG 3.46Å; T79-K83 PolarHBondContact O-N 3.23Å
80	S	68.3	Low	70.3	Confident	22 Å²	22	40.6 Å²	40.6	15%	0.154	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-45.1	179.3	-70.7	0	0	0	0	112.1	V39 R76 L77 V78 K83 A84	V39-S80 WeakPolarHBondContact CG1-OG 3.46Å; R76-S80 WeakPolarHBondContact O-CB 3.09Å; R76-S80 PolarHBondContact O-N 3.48Å; R76-S80 PolarHBondContact O-OG 3.41Å; L77-S80 WeakPolarHBondContact O-CB 3.34Å; L77-S80 PolarHBondContact O-N 2.78Å; V78-S80 VanDerWaalsContact C-N 3.26Å; V78-S80 PolarHBondContact O-N 3.36Å; S80-K83 PolarHBondContact O-N 3.43Å; S80-A84 PolarHBondContact O-N 3.42Å
81	F	75.1	Confident	71.7	Confident	7 Å²	7	36.4 Å²	36.4	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-39.7	175.6	-160.4	-93.1	0	0	0	111.2	L42 L62 L77 V78 K83 A84 M85 L103 W104 L107	L42-F81 HydrophobicContact CD2-CD2 4Å; L42-F81 HydrophobicContact CD2-CE2 4.19Å; L62-F81 HydrophobicContact CD2-CE2 4.34Å; L62-F81 HydrophobicContact CD2-CZ 4.44Å; L77-F81 WeakPolarHBondContact O-CB 3.35Å; L77-F81 PolarHBondContact O-N 3.3Å; V78-F81 PolarHBondContact O-N 3.43Å; F81-K83 PolarHBondContact O-N 3.15Å; F81-A84 CarbonylContact O-C 3.49Å; F81-A84 WeakPolarHBondContact O-CA 3.32Å; F81-A84 WeakPolarHBondContact O-CB 3.21Å; F81-A84 PolarHBondContact O-N 3.44Å; F81-M85 HydrophobicContact CD1-CG 3.65Å; F81-M85 HydrophobicContact CE1-CG 3.51Å; F81-M85 HydrophobicContact CE1-SD 4.02Å; F81-M85 HydrophobicContact CG-CG 4.49Å; F81-M85 HydrophobicContact CZ-CG 4.24Å; F81-M85 HydrophobicContact CZ-SD 4.2Å; F81-M85 VanDerWaalsContact O-CG 3.29Å; F81-M85 WeakPolarHBondContact O-CG 3.48Å; F81-M85 PolarHBondContact O-N 3.02Å; F81-L103 HydrophobicContact CZ-CB 4.19Å; F81-W104 AromaticContact CD1-CE3 3.75Å; F81-W104 HydrophobicContact CD1-CE3 3.75Å; F81-W104 AromaticContact CD1-CZ3 3.62Å; F81-W104 HydrophobicContact CD1-CZ3 3.62Å; F81-W104 AromaticContact CE1-CE3 3.88Å; F81-W104 HydrophobicContact CE1-CE3 3.88Å; F81-W104 HydrophobicContact CE1-CZ3 4.21Å; F81-L107 HydrophobicContact CB-CD1 4.48Å; F81-L107 HydrophobicContact CB-CD2 4.02Å; F81-L107 HydrophobicContact CD1-CB 4.31Å; F81-L107 HydrophobicContact CD1-CD2 3.59Å; F81-L107 HydrophobicContact CD1-CG 4.38Å; F81-L107 HydrophobicContact CE1-CB 4.17Å; F81-L107 HydrophobicContact CE1-CD2 4.25Å; F81-L107 HydrophobicContact CG-CD1 4.36Å; F81-L107 HydrophobicContact CG-CD2 3.95Å
82	A	77.6	Confident	72.9	Confident	18 Å²	18	39.6 Å²	39.6	15%	0.149	23%	0.228	C	C	.	.	H	α-helix	trans	-57.3	-50	174.3	0	0	0	0	0	111.7	V78 T79 A84 M85 A86 W104	V78-A82 VanDerWaalsContact O-CB 3.27Å; V78-A82 WeakPolarHBondContact O-CB 3.42Å; V78-A82 PolarHBondContact O-N 3.26Å; T79-A82 PolarHBondContact O-N 3.03Å; A82-A84 PolarHBondContact O-N 3.48Å; A82-M85 PolarHBondContact O-N 3.24Å; A82-A86 PolarHBondContact O-N 3.46Å; A82-W104 HydrophobicContact CB-CH2 3.77Å; A82-W104 HydrophobicContact CB-CZ3 4.39Å
83	K	70.8	Confident	73.7	Confident	145 Å²	145	44.2 Å²	44.2	63%	0.63	25%	0.249	S	C	*	.	H	α-helix	trans	-57.6	-36.5	173.6	-74.7	175	-179.1	178.1	0	111.8	T79 S80 F81	T79-K83 WeakPolarHBondContact O-CG 3.46Å; T79-K83 PolarHBondContact O-N 3.23Å; S80-K83 PolarHBondContact O-N 3.43Å; F81-K83 PolarHBondContact O-N 3.15Å
84	A	64.9	Low	74.2	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.033	25%	0.248	C	C	.	.	H	α-helix	trans	-70.5	-39.2	-179.8	0	0	0	0	0	113.7	Y43 S80 F81 A82 P87	Y43-A84 HydrophobicContact CD2-CB 3.58Å; Y43-A84 HydrophobicContact CE2-CB 4.48Å; Y43-A84 HydrophobicContact CG-CB 4.16Å; S80-A84 PolarHBondContact O-N 3.42Å; F81-A84 CarbonylContact O-C 3.49Å; F81-A84 WeakPolarHBondContact O-CA 3.32Å; F81-A84 WeakPolarHBondContact O-CB 3.21Å; F81-A84 PolarHBondContact O-N 3.44Å; A82-A84 PolarHBondContact O-N 3.48Å; A84-P87 WeakPolarHBondContact O-CD 3.31Å
85	M	73.4	Confident	74.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-82.6	-16.7	-179.6	-63.2	-53.5	-61.7	0	0	113.2	V46 F81 A82 P87 M88 F89 A100 L103 W104	V46-M85 HydrophobicContact CG1-SD 3.93Å; F81-M85 HydrophobicContact CD1-CG 3.65Å; F81-M85 HydrophobicContact CE1-CG 3.51Å; F81-M85 HydrophobicContact CE1-SD 4.02Å; F81-M85 HydrophobicContact CG-CG 4.49Å; F81-M85 HydrophobicContact CZ-CG 4.24Å; F81-M85 HydrophobicContact CZ-SD 4.2Å; F81-M85 VanDerWaalsContact O-CG 3.29Å; F81-M85 WeakPolarHBondContact O-CG 3.48Å; F81-M85 PolarHBondContact O-N 3.02Å; A82-M85 PolarHBondContact O-N 3.24Å; M85-P87 VanDerWaalsContact C-CD 3.44Å; M85-M88 HydrophobicContact CE-CB 4.33Å; M85-M88 HydrophobicContact CE-CE 3.91Å; M85-M88 HydrophobicContact CE-CG 4.47Å; M85-M88 HydrophobicContact CE-SD 3.48Å; M85-M88 WeakPolarHBondContact CE-SD 3.18Å; M85-M88 WeakPolarHBondContact O-CA 3.41Å; M85-M88 WeakPolarHBondContact O-CB 3.47Å; M85-M88 PolarHBondContact O-N 3.11Å; M85-M88 HydrophobicContact SD-SD 4.09Å; M85-F89 HydrophobicContact CB-CD2 3.73Å; M85-F89 HydrophobicContact CB-CE2 3.55Å; M85-F89 HydrophobicContact CB-CZ 4.42Å; M85-F89 HydrophobicContact CG-CE2 4.43Å; M85-F89 PolarHBondContact O-N 3.31Å; M85-A100 HydrophobicContact CE-CB 3.28Å; M85-L103 HydrophobicContact CE-CB 4.16Å; M85-L103 HydrophobicContact CE-CD1 3.84Å; M85-L103 HydrophobicContact SD-CD1 4.17Å; M85-W104 HydrophobicContact CB-CE3 4.47Å; M85-W104 HydrophobicContact CB-CZ3 4.17Å; M85-W104 HydrophobicContact CG-CE3 4.18Å; M85-W104 HydrophobicContact CG-CZ3 4.09Å
86	A	74.5	Confident	74.1	Confident	42 Å²	42	53 Å²	53	35%	0.347	28%	0.278	S	S	.	.	H	α-helix	trans	-49.7	-42.9	-177.1	0	0	0	0	0	114.7	A82 M88 F89 S90	A82-A86 PolarHBondContact O-N 3.46Å; A86-M88 VanDerWaalsContact C-N 3.32Å; A86-M88 PolarHBondContact O-N 3.22Å; A86-F89 PolarHBondContact O-N 3.18Å; A86-S90 VanDerWaalsContact O-CB 3.26Å; A86-S90 WeakPolarHBondContact O-CB 3.08Å; A86-S90 PolarHBondContact O-N 3.06Å; A86-S90 PolarHBondContact O-OG 2.94Å
87	P	70.5	Confident	74.5	Confident	56 Å²	56	51 Å²	51	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-64.7	-33	175.4	-20.7	33.9	0	0	0	113.6	Y43 A84 M85 S91	Y43-P87 HydrophobicContact CE2-CG 4.36Å; A84-P87 WeakPolarHBondContact O-CD 3.31Å; M85-P87 VanDerWaalsContact C-CD 3.44Å; P87-S91 PolarHBondContact O-N 3.17Å
88	M	72.9	Confident	74.6	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-74.4	-42.9	178.6	-64.9	-179.4	59.3	0	0	111.3	V46 F55 M85 A86 S90 S91 L96 Q97 A99 A100 L103	V46-M88 HydrophobicContact CG1-SD 3.75Å; F55-M88 HydrophobicContact CD1-CE 4.23Å; F55-M88 HydrophobicContact CE1-CE 3.25Å; F55-M88 HydrophobicContact CE1-SD 3.88Å; F55-M88 HydrophobicContact CE2-CE 4.49Å; F55-M88 HydrophobicContact CZ-CE 3.42Å; F55-M88 VanDerWaalsContact CZ-CE 3.42Å; F55-M88 HydrophobicContact CZ-SD 4.34Å; M85-M88 HydrophobicContact CE-CB 4.33Å; M85-M88 HydrophobicContact CE-CE 3.91Å; M85-M88 HydrophobicContact CE-CG 4.47Å; M85-M88 HydrophobicContact CE-SD 3.48Å; M85-M88 WeakPolarHBondContact CE-SD 3.18Å; M85-M88 WeakPolarHBondContact O-CA 3.41Å; M85-M88 WeakPolarHBondContact O-CB 3.47Å; M85-M88 PolarHBondContact O-N 3.11Å; M85-M88 HydrophobicContact SD-SD 4.09Å; A86-M88 VanDerWaalsContact C-N 3.32Å; A86-M88 PolarHBondContact O-N 3.22Å; M88-S90 VanDerWaalsContact C-N 3.32Å; M88-S91 VanDerWaalsContact O-CB 3.25Å; M88-S91 WeakPolarHBondContact O-CB 3.45Å; M88-S91 PolarHBondContact O-N 3.44Å; M88-L96 WeakPolarHBondContact CE-O 3.39Å; M88-Q97 WeakPolarHBondContact O-CG 3.12Å; M88-A99 HydrophobicContact CE-CB 4.09Å; M88-A100 HydrophobicContact CB-CB 3.95Å; M88-A100 HydrophobicContact CE-CB 4.02Å; M88-L103 HydrophobicContact CE-CD1 4.5Å
89	F	82	Confident	74.2	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-34.8	175.9	-72.1	-44.2	0	0	0	112.6	M85 A86 S91 Q97 A100 F101 W104 P130 I134	M85-F89 HydrophobicContact CB-CD2 3.73Å; M85-F89 HydrophobicContact CB-CE2 3.55Å; M85-F89 HydrophobicContact CB-CZ 4.42Å; M85-F89 HydrophobicContact CG-CE2 4.43Å; M85-F89 PolarHBondContact O-N 3.31Å; A86-F89 PolarHBondContact O-N 3.18Å; F89-S91 VanDerWaalsContact C-N 3.27Å; F89-S91 PolarHBondContact O-N 3.16Å; F89-Q97 PolarHBondContact O-NE2 2.98Å; F89-A100 HydrophobicContact CD1-CB 3.39Å; F89-A100 HydrophobicContact CE1-CB 3.22Å; F89-A100 HydrophobicContact CE2-CB 4.47Å; F89-A100 HydrophobicContact CG-CB 4.19Å; F89-A100 HydrophobicContact CZ-CB 3.81Å; F89-F101 HydrophobicContact CE1-CD1 4.48Å; F89-F101 HydrophobicContact CE1-CD2 4.18Å; F89-F101 HydrophobicContact CE1-CE2 4.23Å; F89-F101 HydrophobicContact CE1-CG 4.31Å; F89-F101 HydrophobicContact CE1-CZ 4.43Å; F89-W104 HydrophobicContact CE2-CD2 4.26Å; F89-W104 AromaticContact CE2-CE3 3.66Å; F89-W104 HydrophobicContact CE2-CE3 3.66Å; F89-W104 HydrophobicContact CE2-CH2 4.5Å; F89-W104 AromaticContact CE2-CZ3 3.78Å; F89-W104 HydrophobicContact CE2-CZ3 3.78Å; F89-W104 HydrophobicContact CZ-CB 4.4Å; F89-W104 HydrophobicContact CZ-CD2 4.06Å; F89-W104 AromaticContact CZ-CE3 3.77Å; F89-W104 HydrophobicContact CZ-CE3 3.77Å; F89-W104 HydrophobicContact CZ-CG 4.34Å; F89-W104 HydrophobicContact CZ-CZ3 4.37Å; F89-P130 HydrophobicContact CD2-CB 4.13Å; F89-P130 HydrophobicContact CD2-CG 4.09Å; F89-P130 HydrophobicContact CE1-CB 4.04Å; F89-P130 HydrophobicContact CE2-CB 3.65Å; F89-P130 HydrophobicContact CE2-CG 3.48Å; F89-P130 VanDerWaalsContact CE2-CG 3.48Å; F89-P130 HydrophobicContact CZ-CB 3.59Å; F89-P130 HydrophobicContact CZ-CG 3.84Å; F89-I134 HydrophobicContact CB-CD1 3.58Å; F89-I134 HydrophobicContact CB-CG1 4.23Å; F89-I134 HydrophobicContact CD1-CD1 3.01Å; F89-I134 HydrophobicContact CD1-CG1 4.37Å; F89-I134 HydrophobicContact CD2-CD1 4.24Å; F89-I134 HydrophobicContact CE1-CD1 3.56Å; F89-I134 HydrophobicContact CG-CD1 3.38Å; F89-I134 HydrophobicContact CG-CG1 4.48Å; F89-I134 HydrophobicContact CZ-CD1 4.39Å
90	S	81.1	Confident	74.4	Confident	100 Å²	100	51.7 Å²	51.7	70%	0.699	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.9	175.9	-51.4	0	0	0	0	113.9	A86 M88	A86-S90 VanDerWaalsContact O-CB 3.26Å; A86-S90 WeakPolarHBondContact O-CB 3.08Å; A86-S90 PolarHBondContact O-N 3.06Å; A86-S90 PolarHBondContact O-OG 2.94Å; M88-S90 VanDerWaalsContact C-N 3.32Å
91	S	78.7	Confident	75	Confident	23 Å²	23	50.6 Å²	50.6	16%	0.161	27%	0.269	C	S	.	.			trans	-69	144.6	-179	-176.5	0	0	0	0	111.6	P87 M88 F89 E93 L96 Q97	P87-S91 PolarHBondContact O-N 3.17Å; M88-S91 VanDerWaalsContact O-CB 3.25Å; M88-S91 WeakPolarHBondContact O-CB 3.45Å; M88-S91 PolarHBondContact O-N 3.44Å; F89-S91 VanDerWaalsContact C-N 3.27Å; F89-S91 PolarHBondContact O-N 3.16Å; S91-E93 PolarHBondContact O-N 3.43Å; S91-E93 PolarHBondContact OG-N 3.37Å; S91-E93 VanDerWaalsContact OG-N 3.09Å; S91-L96 WeakPolarHBondContact OG-CD1 3.49Å; S91-Q97 PolarHBondContact O-NE2 2.8Å
92	T	79.3	Confident	75	Confident	141 Å²	141	53.6 Å²	53.6	87%	0.865	29%	0.289	S	S	*	.	S	Bend	trans	-70.3	-17.3	169.3	52.1	0	0	0	0	112.4	K94	T92-K94 PolarHBondContact O-N 3.13Å
93	E	76.4	Confident	74.8	Confident	116 Å²	116	53.4 Å²	53.4	54%	0.542	29%	0.286	S	S	.	.			trans	-85.3	109.4	179	-61.8	-175.4	-176.9	0	0	111.5	S91 R95 L96 Q97	S91-E93 PolarHBondContact O-N 3.43Å; S91-E93 PolarHBondContact OG-N 3.37Å; S91-E93 VanDerWaalsContact OG-N 3.09Å; E93-R95 PolarHBondContact O-N 3.49Å; E93-R95 VanDerWaalsContact O-N 3.1Å; E93-L96 HydrophobicContact CB-CB 4.4Å; E93-L96 HydrophobicContact CB-CD1 4.03Å; E93-L96 HydrophobicContact CB-CG 4.08Å; E93-L96 HydrophobicContact CG-CD1 4.46Å; E93-L96 WeakPolarHBondContact O-CB 3.42Å; E93-L96 PolarHBondContact O-N 2.85Å; E93-L96 WeakPolarHBondContact OE2-CD1 3.29Å; E93-Q97 PolarHBondContact O-N 3.16Å
94	K	76.6	Confident	75.4	Confident	87 Å²	87	46.5 Å²	46.5	38%	0.378	26%	0.256	S	S	.	.	H	α-helix	trans	-53.4	-33.7	177.6	-66.5	174.9	165.3	-154.6	0	113.8	T92 L96 Q97 I98 D141	T92-K94 PolarHBondContact O-N 3.13Å; K94-L96 VanDerWaalsContact C-N 3.29Å; K94-L96 PolarHBondContact O-N 3.39Å; K94-Q97 PolarHBondContact O-N 3.21Å; K94-I98 VanDerWaalsContact O-CG1 3.29Å; K94-I98 WeakPolarHBondContact O-CG1 3.34Å; K94-I98 PolarHBondContact O-N 3.25Å; K94-D141 VanDerWaalsContact CD-OD2 3.28Å; K94-D141 WeakPolarHBondContact CD-OD2 3.36Å; K94-D141 WeakPolarHBondContact CE-OD2 3.31Å; K94-D141 IonicContact NZ-OD2 2.79Å; K94-D141 PolarHBondContact NZ-OD2 2.96Å
95	R	71.3	Confident	76.1	Confident	190 Å²	190	47.4 Å²	47.4	72%	0.717	26%	0.26	S	S	*	.	H	α-helix	trans	-60.9	-38.4	177.3	-68.5	-177.4	-179.4	172.2	2.2	112.2	E93 A99	E93-R95 PolarHBondContact O-N 3.49Å; E93-R95 VanDerWaalsContact O-N 3.1Å; R95-A99 WeakPolarHBondContact O-CB 3.28Å; R95-A99 PolarHBondContact O-N 3.28Å
96	L	69	Low	76.1	Confident	25 Å²	25	49.3 Å²	49.3	13%	0.131	27%	0.269	C	S	.	.	H	α-helix	trans	-70.1	-39.7	177.2	-67.2	178.2	0	0	0	111.1	F55 M88 S91 E93 K94 A99 A100	F55-L96 HydrophobicContact CE2-CD2 3.66Å; F55-L96 HydrophobicContact CZ-CD2 3.46Å; F55-L96 VanDerWaalsContact CZ-CD2 3.46Å; M88-L96 WeakPolarHBondContact CE-O 3.39Å; S91-L96 WeakPolarHBondContact OG-CD1 3.49Å; E93-L96 HydrophobicContact CB-CB 4.4Å; E93-L96 HydrophobicContact CB-CD1 4.03Å; E93-L96 HydrophobicContact CB-CG 4.08Å; E93-L96 HydrophobicContact CG-CD1 4.46Å; E93-L96 WeakPolarHBondContact O-CB 3.42Å; E93-L96 PolarHBondContact O-N 2.85Å; E93-L96 WeakPolarHBondContact OE2-CD1 3.29Å; K94-L96 VanDerWaalsContact C-N 3.29Å; K94-L96 PolarHBondContact O-N 3.39Å; L96-A99 PolarHBondContact O-N 3.4Å; L96-A100 WeakPolarHBondContact O-CB 3.28Å; L96-A100 PolarHBondContact O-N 3.34Å
97	Q	79	Confident	76.4	Confident	27 Å²	27	47.6 Å²	47.6	13%	0.126	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-42.3	174.3	-63.3	176.8	-28.3	0	0	111.8	M88 F89 S91 E93 K94 A100 F101 F136	M88-Q97 WeakPolarHBondContact O-CG 3.12Å; F89-Q97 PolarHBondContact O-NE2 2.98Å; S91-Q97 PolarHBondContact O-NE2 2.8Å; E93-Q97 PolarHBondContact O-N 3.16Å; K94-Q97 PolarHBondContact O-N 3.21Å; Q97-A100 WeakPolarHBondContact O-CB 3.22Å; Q97-A100 PolarHBondContact O-N 3.48Å; Q97-F101 VanDerWaalsContact O-CD2 3.31Å; Q97-F101 WeakPolarHBondContact O-CD2 3.47Å; Q97-F101 PolarHBondContact O-N 2.87Å; Q97-F136 HydrophobicContact CB-CE1 3.84Å; Q97-F136 HydrophobicContact CB-CZ 3.81Å
98	I	72.3	Confident	77.1	Confident	41 Å²	41	45 Å²	45	21%	0.21	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-49.8	175.4	-73	166.1	0	0	0	111.1	K94 A100 F101 C102 I144	K94-I98 VanDerWaalsContact O-CG1 3.29Å; K94-I98 WeakPolarHBondContact O-CG1 3.34Å; K94-I98 PolarHBondContact O-N 3.25Å; I98-A100 PolarHBondContact O-N 2.82Å; I98-F101 PolarHBondContact O-N 2.9Å; I98-F101 VanDerWaalsContact O-N 3.16Å; I98-C102 PolarHBondContact O-N 2.65Å; I98-C102 PolarHBondContact O-SG 3.19Å; I98-I144 HydrophobicContact CB-CD1 4.31Å; I98-I144 HydrophobicContact CD1-CD1 3.57Å; I98-I144 HydrophobicContact CG1-CD1 3.61Å; I98-I144 HydrophobicContact CG1-CG2 4.39Å; I98-I144 HydrophobicContact CG2-CD1 3.77Å; I98-I144 HydrophobicContact CG2-CG2 4.2Å
99	A	69.5	Low	77.3	Confident	19 Å²	19	49 Å²	49	16%	0.157	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-36	176.7	0	0	0	0	0	111.3	F55 M88 R95 L96 C102 L103	F55-A99 HydrophobicContact CD2-CB 4.11Å; F55-A99 HydrophobicContact CE2-CB 4.06Å; F55-A99 HydrophobicContact CG-CB 4.4Å; F55-A99 HydrophobicContact CZ-CB 4.31Å; M88-A99 HydrophobicContact CE-CB 4.09Å; R95-A99 WeakPolarHBondContact O-CB 3.28Å; R95-A99 PolarHBondContact O-N 3.28Å; L96-A99 PolarHBondContact O-N 3.4Å; A99-C102 PolarHBondContact O-N 3.06Å; A99-L103 WeakPolarHBondContact O-CG 3.2Å; A99-L103 PolarHBondContact O-N 3.4Å
100	A	78.6	Confident	76.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-43.1	176.2	0	0	0	0	0	112.8	M85 M88 F89 L96 Q97 I98 C102 L103 W104	M85-A100 HydrophobicContact CE-CB 3.28Å; M88-A100 HydrophobicContact CB-CB 3.95Å; M88-A100 HydrophobicContact CE-CB 4.02Å; F89-A100 HydrophobicContact CD1-CB 3.39Å; F89-A100 HydrophobicContact CE1-CB 3.22Å; F89-A100 HydrophobicContact CE2-CB 4.47Å; F89-A100 HydrophobicContact CG-CB 4.19Å; F89-A100 HydrophobicContact CZ-CB 3.81Å; L96-A100 WeakPolarHBondContact O-CB 3.28Å; L96-A100 PolarHBondContact O-N 3.34Å; Q97-A100 WeakPolarHBondContact O-CB 3.22Å; Q97-A100 PolarHBondContact O-N 3.48Å; I98-A100 PolarHBondContact O-N 2.82Å; A100-C102 VanDerWaalsContact C-N 3.34Å; A100-C102 PolarHBondContact O-N 3.49Å; A100-L103 PolarHBondContact O-N 2.76Å; A100-W104 WeakPolarHBondContact O-CB 3.45Å; A100-W104 PolarHBondContact O-N 3.28Å
101	F	82.2	Confident	76.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-37.6	173.1	-83.4	-70	0	0	0	112.6	F89 Q97 I98 L103 W104 D105 P130 Y131 I134 F136 I144 K145	F89-F101 HydrophobicContact CE1-CD1 4.48Å; F89-F101 HydrophobicContact CE1-CD2 4.18Å; F89-F101 HydrophobicContact CE1-CE2 4.23Å; F89-F101 HydrophobicContact CE1-CG 4.31Å; F89-F101 HydrophobicContact CE1-CZ 4.43Å; Q97-F101 VanDerWaalsContact O-CD2 3.31Å; Q97-F101 WeakPolarHBondContact O-CD2 3.47Å; Q97-F101 PolarHBondContact O-N 2.87Å; I98-F101 PolarHBondContact O-N 2.9Å; I98-F101 VanDerWaalsContact O-N 3.16Å; F101-L103 VanDerWaalsContact C-N 3.33Å; F101-L103 PolarHBondContact O-N 3.47Å; F101-W104 WeakPolarHBondContact O-CB 3.43Å; F101-W104 PolarHBondContact O-N 3.12Å; F101-D105 PolarHBondContact O-N 3.08Å; F101-P130 HydrophobicContact CE1-CB 4.31Å; F101-P130 HydrophobicContact CZ-CB 4.47Å; F101-Y131 HydrophobicContact CD1-CD1 4.38Å; F101-Y131 AromaticContact CD1-CE1 3.99Å; F101-Y131 HydrophobicContact CD1-CE1 3.99Å; F101-Y131 AromaticContact CE1-CD1 3.67Å; F101-Y131 HydrophobicContact CE1-CD1 3.67Å; F101-Y131 AromaticContact CE1-CE1 3.75Å; F101-Y131 HydrophobicContact CE1-CE1 3.75Å; F101-Y131 HydrophobicContact CE1-CG 4.47Å; F101-I134 HydrophobicContact CE2-CB 4.31Å; F101-I134 HydrophobicContact CE2-CD1 3.74Å; F101-I134 HydrophobicContact CE2-CG2 4.11Å; F101-I134 HydrophobicContact CZ-CB 4.24Å; F101-I134 HydrophobicContact CZ-CD1 3.7Å; F101-F136 AromaticContact CD2-CE2 3.74Å; F101-F136 HydrophobicContact CD2-CE2 3.74Å; F101-F136 AromaticContact CD2-CZ 3.9Å; F101-F136 HydrophobicContact CD2-CZ 3.9Å; F101-F136 HydrophobicContact CE2-CD2 4.44Å; F101-F136 AromaticContact CE2-CE2 3.37Å; F101-F136 HydrophobicContact CE2-CE2 3.37Å; F101-F136 AromaticContact CE2-CZ 3.72Å; F101-F136 HydrophobicContact CE2-CZ 3.72Å; F101-F136 HydrophobicContact CZ-CE2 4.33Å; F101-I144 HydrophobicContact CB-CG2 4.35Å; F101-K145 HydrophobicContact CE1-CG 4.13Å; F101-K145 HydrophobicContact CE2-CB 4.47Å; F101-K145 HydrophobicContact CE2-CG 4.43Å; F101-K145 HydrophobicContact CZ-CB 4.36Å; F101-K145 HydrophobicContact CZ-CD 4.23Å; F101-K145 HydrophobicContact CZ-CG 3.87Å
102	C	73.7	Confident	76.6	Confident	69 Å²	69	43.6 Å²	43.6	47%	0.466	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-39.9	174.1	-64	0	0	0	0	112.5	I98 A99 A100 W104 D105	I98-C102 PolarHBondContact O-N 2.65Å; I98-C102 PolarHBondContact O-SG 3.19Å; A99-C102 PolarHBondContact O-N 3.06Å; A100-C102 VanDerWaalsContact C-N 3.34Å; A100-C102 PolarHBondContact O-N 3.49Å; C102-W104 VanDerWaalsContact C-N 3.33Å; C102-D105 PolarHBondContact O-N 3.28Å
103	L	73.4	Confident	76.4	Confident	15 Å²	15	41.8 Å²	41.8	8%	0.079	21%	0.21	C	C	.	.	H	α-helix	trans	-70.5	-32.9	174.6	-69.5	171.9	0	0	0	112	L57 L62 F81 M85 M88 A99 A100 F101 D105 E106 L107	L57-L103 HydrophobicContact CB-CD2 3.98Å; L57-L103 HydrophobicContact CD1-CD1 4.44Å; L57-L103 HydrophobicContact CD1-CD2 4.13Å; L62-L103 HydrophobicContact CD1-CD2 3.64Å; F81-L103 HydrophobicContact CZ-CB 4.19Å; M85-L103 HydrophobicContact CE-CB 4.16Å; M85-L103 HydrophobicContact CE-CD1 3.84Å; M85-L103 HydrophobicContact SD-CD1 4.17Å; M88-L103 HydrophobicContact CE-CD1 4.5Å; A99-L103 WeakPolarHBondContact O-CG 3.2Å; A99-L103 PolarHBondContact O-N 3.4Å; A100-L103 PolarHBondContact O-N 2.76Å; F101-L103 VanDerWaalsContact C-N 3.33Å; F101-L103 PolarHBondContact O-N 3.47Å; L103-D105 VanDerWaalsContact C-N 3.35Å; L103-E106 PolarHBondContact O-N 3.06Å; L103-L107 PolarHBondContact O-N 3.38Å; L103-L107 VanDerWaalsContact O-N 3.13Å
104	W	84.8	Confident	76.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.8	-39.7	174.6	-151.2	-105.6	0	0	0	111.8	F81 A82 M85 F89 A100 F101 C102 E106 L107 V108 L127 P130 Y131	F81-W104 AromaticContact CD1-CE3 3.75Å; F81-W104 HydrophobicContact CD1-CE3 3.75Å; F81-W104 AromaticContact CD1-CZ3 3.62Å; F81-W104 HydrophobicContact CD1-CZ3 3.62Å; F81-W104 AromaticContact CE1-CE3 3.88Å; F81-W104 HydrophobicContact CE1-CE3 3.88Å; F81-W104 HydrophobicContact CE1-CZ3 4.21Å; A82-W104 HydrophobicContact CB-CH2 3.77Å; A82-W104 HydrophobicContact CB-CZ3 4.39Å; M85-W104 HydrophobicContact CB-CE3 4.47Å; M85-W104 HydrophobicContact CB-CZ3 4.17Å; M85-W104 HydrophobicContact CG-CE3 4.18Å; M85-W104 HydrophobicContact CG-CZ3 4.09Å; F89-W104 HydrophobicContact CE2-CD2 4.26Å; F89-W104 AromaticContact CE2-CE3 3.66Å; F89-W104 HydrophobicContact CE2-CE3 3.66Å; F89-W104 HydrophobicContact CE2-CH2 4.5Å; F89-W104 AromaticContact CE2-CZ3 3.78Å; F89-W104 HydrophobicContact CE2-CZ3 3.78Å; F89-W104 HydrophobicContact CZ-CB 4.4Å; F89-W104 HydrophobicContact CZ-CD2 4.06Å; F89-W104 AromaticContact CZ-CE3 3.77Å; F89-W104 HydrophobicContact CZ-CE3 3.77Å; F89-W104 HydrophobicContact CZ-CG 4.34Å; F89-W104 HydrophobicContact CZ-CZ3 4.37Å; A100-W104 WeakPolarHBondContact O-CB 3.45Å; A100-W104 PolarHBondContact O-N 3.28Å; F101-W104 WeakPolarHBondContact O-CB 3.43Å; F101-W104 PolarHBondContact O-N 3.12Å; C102-W104 VanDerWaalsContact C-N 3.33Å; W104-E106 VanDerWaalsContact C-N 3.31Å; W104-E106 PolarHBondContact O-N 2.87Å; W104-L107 HydrophobicContact CD2-CD2 4.47Å; W104-L107 HydrophobicContact CE3-CD2 4.39Å; W104-L107 HydrophobicContact CH2-CD2 4.39Å; W104-L107 HydrophobicContact CZ2-CD2 4.47Å; W104-L107 HydrophobicContact CZ3-CD2 4.37Å; W104-L107 WeakPolarHBondContact O-CB 3.27Å; W104-L107 PolarHBondContact O-N 3.43Å; W104-L107 VanDerWaalsContact O-N 3.15Å; W104-V108 WeakPolarHBondContact O-CG2 3.3Å; W104-V108 PolarHBondContact O-N 3.31Å; W104-L127 PolarHBondContact NE1-O 3.19Å; W104-L127 VanDerWaalsContact NE1-O 3.1Å; W104-P130 HydrophobicContact CD2-CG 4.09Å; W104-P130 HydrophobicContact CE3-CG 4.36Å; W104-P130 HydrophobicContact CH2-CG 3.77Å; W104-P130 HydrophobicContact CZ2-CG 3.46Å; W104-P130 VanDerWaalsContact CZ2-CG 3.46Å; W104-P130 HydrophobicContact CZ3-CG 4.21Å; W104-Y131 AromaticContact CD1-CE2 3.73Å; W104-Y131 AromaticContact CD1-CZ 3.74Å; W104-Y131 AromaticContact NE1-CE2 3.7Å
105	D	79.7	Confident	76.1	Confident	22 Å²	22	39 Å²	39	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-59.8	-40.6	175.4	-80.9	-6.1	0	0	0	112.6	F101 C102 L103 V108 Q109 S148 N151	F101-D105 PolarHBondContact O-N 3.08Å; C102-D105 PolarHBondContact O-N 3.28Å; L103-D105 VanDerWaalsContact C-N 3.35Å; D105-V108 PolarHBondContact O-N 3.01Å; D105-Q109 WeakPolarHBondContact O-CG 3.43Å; D105-Q109 PolarHBondContact O-N 3.45Å; D105-S148 WeakPolarHBondContact OD1-CA 3.18Å; D105-S148 WeakPolarHBondContact OD1-CB 3.28Å; D105-S148 PolarHBondContact OD1-OG 2.9Å; D105-N151 PolarHBondContact OD2-ND2 3.27Å
106	E	73.5	Confident	76.4	Confident	41 Å²	41	38.8 Å²	38.8	19%	0.192	21%	0.206	C	C	.	.	H	α-helix	trans	-68.8	-35.9	176.9	-61.1	-76.2	134.1	0	0	111.2	S59 L62 L103 W104 Q109 A110	S59-E106 PolarHBondContact OG-OE2 2.94Å; L62-E106 HydrophobicContact CB-CB 3.84Å; L62-E106 HydrophobicContact CB-CG 4.44Å; L62-E106 HydrophobicContact CD1-CB 3.6Å; L62-E106 HydrophobicContact CD1-CG 3.72Å; L62-E106 HydrophobicContact CD2-CB 4.23Å; L62-E106 HydrophobicContact CG-CB 4.06Å; L103-E106 PolarHBondContact O-N 3.06Å; W104-E106 VanDerWaalsContact C-N 3.31Å; W104-E106 PolarHBondContact O-N 2.87Å; E106-Q109 PolarHBondContact O-N 3.38Å; E106-A110 WeakPolarHBondContact O-CB 2.79Å; E106-A110 PolarHBondContact O-N 3.23Å
107	L	80.9	Confident	76.9	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-44.7	170.5	175.7	70.5	0	0	0	111	L77 V78 F81 L103 W104 Q109 A110 M111 L127	L77-L107 HydrophobicContact CD2-CD1 4.07Å; L77-L107 HydrophobicContact CG-CD1 4.28Å; V78-L107 HydrophobicContact CG1-CD2 4.42Å; V78-L107 HydrophobicContact CG2-CD2 4.36Å; F81-L107 HydrophobicContact CB-CD1 4.48Å; F81-L107 HydrophobicContact CB-CD2 4.02Å; F81-L107 HydrophobicContact CD1-CB 4.31Å; F81-L107 HydrophobicContact CD1-CD2 3.59Å; F81-L107 HydrophobicContact CD1-CG 4.38Å; F81-L107 HydrophobicContact CE1-CB 4.17Å; F81-L107 HydrophobicContact CE1-CD2 4.25Å; F81-L107 HydrophobicContact CG-CD1 4.36Å; F81-L107 HydrophobicContact CG-CD2 3.95Å; L103-L107 PolarHBondContact O-N 3.38Å; L103-L107 VanDerWaalsContact O-N 3.13Å; W104-L107 HydrophobicContact CD2-CD2 4.47Å; W104-L107 HydrophobicContact CE3-CD2 4.39Å; W104-L107 HydrophobicContact CH2-CD2 4.39Å; W104-L107 HydrophobicContact CZ2-CD2 4.47Å; W104-L107 HydrophobicContact CZ3-CD2 4.37Å; W104-L107 WeakPolarHBondContact O-CB 3.27Å; W104-L107 PolarHBondContact O-N 3.43Å; W104-L107 VanDerWaalsContact O-N 3.15Å; L107-Q109 VanDerWaalsContact C-N 3.32Å; L107-Q109 PolarHBondContact O-N 3.45Å; L107-A110 WeakPolarHBondContact O-CB 3.38Å; L107-A110 PolarHBondContact O-N 3.36Å; L107-A110 VanDerWaalsContact O-N 3.11Å; L107-M111 HydrophobicContact CD1-CG 4.37Å; L107-M111 HydrophobicContact CG-CG 4.38Å; L107-M111 WeakPolarHBondContact O-CG 3.16Å; L107-M111 PolarHBondContact O-N 3.19Å; L107-L127 HydrophobicContact CD2-CD2 4.18Å
108	V	83.9	Confident	77	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-43.2	177.7	169.3	0	0	0	0	110.9	W104 D105 A110 M111 A112 M118 L127 L152	W104-V108 WeakPolarHBondContact O-CG2 3.3Å; W104-V108 PolarHBondContact O-N 3.31Å; D105-V108 PolarHBondContact O-N 3.01Å; V108-A110 VanDerWaalsContact C-N 3.32Å; V108-A110 PolarHBondContact O-N 2.92Å; V108-M111 PolarHBondContact O-N 2.78Å; V108-A112 WeakPolarHBondContact O-CB 3.36Å; V108-A112 PolarHBondContact O-N 3.31Å; V108-M118 HydrophobicContact CG1-CE 4.22Å; V108-L127 HydrophobicContact CG2-CD2 4.28Å; V108-L152 HydrophobicContact CB-CD1 4.46Å; V108-L152 HydrophobicContact CG1-CB 4.41Å; V108-L152 HydrophobicContact CG1-CD1 3.78Å; V108-L152 HydrophobicContact CG2-CD1 3.77Å
109	Q	76.9	Confident	77.6	Confident	89 Å²	89	37.7 Å²	37.7	42%	0.416	20%	0.198	S	C	.	.	H	α-helix	trans	-62.8	-38.4	174.1	-70.6	175.4	35.2	0	0	112.2	D105 E106 L107 A112	D105-Q109 WeakPolarHBondContact O-CG 3.43Å; D105-Q109 PolarHBondContact O-N 3.45Å; E106-Q109 PolarHBondContact O-N 3.38Å; L107-Q109 VanDerWaalsContact C-N 3.32Å; L107-Q109 PolarHBondContact O-N 3.45Å; Q109-A112 PolarHBondContact O-N 3.1Å
110	A	71.6	Confident	78.3	Confident	5 Å²	5	41.6 Å²	41.6	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-64.6	-43.1	175.5	0	0	0	0	0	112.1	A66 M69 E106 L107 V108 A112 V113	A66-A110 HydrophobicContact CB-CB 3.44Å; A66-A110 VanDerWaalsContact CB-CB 3.44Å; M69-A110 HydrophobicContact CG-CB 4.49Å; E106-A110 WeakPolarHBondContact O-CB 2.79Å; E106-A110 PolarHBondContact O-N 3.23Å; L107-A110 WeakPolarHBondContact O-CB 3.38Å; L107-A110 PolarHBondContact O-N 3.36Å; L107-A110 VanDerWaalsContact O-N 3.11Å; V108-A110 VanDerWaalsContact C-N 3.32Å; V108-A110 PolarHBondContact O-N 2.92Å; A110-A112 VanDerWaalsContact C-N 3.31Å; A110-A112 PolarHBondContact O-N 3.44Å; A110-V113 PolarHBondContact O-N 3.24Å
111	M	79	Confident	78.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-34.8	175.8	-69.8	-58.6	-45.9	0	0	112.2	M69 V78 L107 V108 V113 A114 E117 M118 T123	M69-M111 HydrophobicContact CE-CE 4.08Å; M69-M111 HydrophobicContact CE-CG 4.18Å; M69-M111 HydrophobicContact CE-SD 3.18Å; M69-M111 WeakPolarHBondContact CE-SD 3.48Å; V78-M111 HydrophobicContact CG2-CE 4.27Å; V78-M111 HydrophobicContact CG2-CG 3.96Å; V78-M111 HydrophobicContact CG2-SD 3.58Å; V78-M111 VanDerWaalsContact CG2-SD 3.58Å; L107-M111 HydrophobicContact CD1-CG 4.37Å; L107-M111 HydrophobicContact CG-CG 4.38Å; L107-M111 WeakPolarHBondContact O-CG 3.16Å; L107-M111 PolarHBondContact O-N 3.19Å; V108-M111 PolarHBondContact O-N 2.78Å; M111-V113 PolarHBondContact O-N 3.4Å; M111-A114 CarbonylContact O-C 3.6Å; M111-A114 WeakPolarHBondContact O-CA 3.36Å; M111-A114 PolarHBondContact O-N 2.67Å; M111-E117 HydrophobicContact CE-CB 4.04Å; M111-M118 HydrophobicContact CB-CB 4.32Å; M111-M118 HydrophobicContact CB-CG 4.2Å; M111-M118 HydrophobicContact CB-SD 4.19Å; M111-M118 HydrophobicContact CE-CB 4.27Å; M111-T123 HydrophobicContact CE-CG2 3.78Å
112	A	77.6	Confident	78.8	Confident	22 Å²	22	50.7 Å²	50.7	18%	0.182	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-27.9	177.7	0	0	0	0	0	113.2	V108 Q109 A110 A114 E115 M118 N155	V108-A112 WeakPolarHBondContact O-CB 3.36Å; V108-A112 PolarHBondContact O-N 3.31Å; Q109-A112 PolarHBondContact O-N 3.1Å; A110-A112 VanDerWaalsContact C-N 3.31Å; A110-A112 PolarHBondContact O-N 3.44Å; A112-A114 VanDerWaalsContact C-N 3.27Å; A112-E115 WeakPolarHBondContact O-CG 3.45Å; A112-M118 WeakPolarHBondContact CA-SD 3.39Å; A112-M118 HydrophobicContact CB-SD 4.03Å; A112-N155 HydrophobicContact CB-CB 4.11Å; A112-N155 WeakPolarHBondContact CB-OD1 3.39Å
113	V	73.8	Confident	79.4	Confident	103 Å²	103	47.4 Å²	47.4	62%	0.624	24%	0.237	S	C	*	.	H	α-helix	trans	-69.2	-29.6	171.7	-179.6	0	0	0	0	111.4	A110 M111	A110-V113 PolarHBondContact O-N 3.24Å; M111-V113 PolarHBondContact O-N 3.4Å
114	A	73.3	Confident	80.1	Confident	16 Å²	16	46.9 Å²	46.9	13%	0.132	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	55.6	177.8	0	0	0	0	0	111.4	M69 M111 A112 K116 E117 M118	M69-A114 HydrophobicContact CB-CB 4.27Å; M69-A114 HydrophobicContact CE-CB 4.09Å; M111-A114 CarbonylContact O-C 3.6Å; M111-A114 WeakPolarHBondContact O-CA 3.36Å; M111-A114 PolarHBondContact O-N 2.67Å; A112-A114 VanDerWaalsContact C-N 3.27Å; A114-K116 PolarHBondContact O-N 2.94Å; A114-E117 HydrophobicContact CB-CB 4.41Å; A114-E117 PolarHBondContact O-N 2.76Å; A114-M118 PolarHBondContact O-N 2.89Å
115	E	74.2	Confident	80.3	Confident	128 Å²	128	52.9 Å²	52.9	60%	0.598	26%	0.262	S	S	*	.	H	α-helix	trans	-40.3	-47.3	-175.4	-69.8	179.1	174.1	0	0	113.3	A112 E117 M118 F119	A112-E115 WeakPolarHBondContact O-CG 3.45Å; E115-E117 VanDerWaalsContact C-N 3.27Å; E115-E117 PolarHBondContact O-N 3.4Å; E115-M118 PolarHBondContact O-N 3.34Å; E115-F119 HydrophobicContact CB-CE2 4Å; E115-F119 HydrophobicContact CG-CE2 4.46Å; E115-F119 WeakPolarHBondContact O-CD2 3.04Å; E115-F119 WeakPolarHBondContact O-CE2 3.3Å; E115-F119 PolarHBondContact O-N 3.39Å
116	K	76.9	Confident	80.6	Confident	187 Å²	187	54 Å²	54	81%	0.813	27%	0.267	S	S	*	.	H	α-helix	trans	-60.3	-30.7	-178.6	-67.6	-174.4	178.8	-178.2	0	114.8	A114	A114-K116 PolarHBondContact O-N 2.94Å
117	E	79.3	Confident	81.4	Confident	31 Å²	31	52.1 Å²	52.1	15%	0.145	26%	0.258	C	S	.	.	H	α-helix	trans	-90.4	-32.5	-178.7	-64.4	-59.6	129.4	0	0	111.9	G74 M111 A114 E115 F119 R120 T123	G74-E117 PolarHBondContact N-OE2 3.47Å; G74-E117 VanDerWaalsContact N-OE2 3.16Å; M111-E117 HydrophobicContact CE-CB 4.04Å; A114-E117 HydrophobicContact CB-CB 4.41Å; A114-E117 PolarHBondContact O-N 2.76Å; E115-E117 VanDerWaalsContact C-N 3.27Å; E115-E117 PolarHBondContact O-N 3.4Å; E117-F119 VanDerWaalsContact C-N 3.33Å; E117-F119 PolarHBondContact O-N 3.4Å; E117-R120 VanDerWaalsContact CD-CZ 3.46Å; E117-R120 PolarHBondContact O-N 3.48Å; E117-R120 IonicContact OE1-CZ 2.78Å; E117-R120 IonicContact OE1-NE 3.06Å; E117-R120 IonicContact OE1-NH1 2.77Å; E117-R120 IonicContact OE1-NH2 3.14Å; E117-R120 PolarHBondContact OE1-NH2 3.2Å; E117-R120 IonicContact OE2-CZ 3.18Å; E117-R120 IonicContact OE2-NE 3.55Å; E117-R120 PolarHBondContact OE2-NE 2.85Å; E117-R120 IonicContact OE2-NH1 2.67Å; E117-R120 PolarHBondContact OE2-NH1 3.27Å; E117-R120 VanDerWaalsContact OE2-NH1 3.15Å; E117-R120 IonicContact OE2-NH2 3.72Å; E117-R120 PolarHBondContact OE2-NH2 2.85Å; E117-T123 WeakPolarHBondContact O-CB 3.21Å; E117-T123 WeakPolarHBondContact O-CG2 3.06Å; E117-T123 PolarHBondContact O-OG1 3.29Å
118	M	82.2	Confident	81.9	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-39.6	-179.3	-176.2	170.2	-175.6	0	0	112.6	V108 M111 A112 A114 E115 R120 I124 L152 N155 F156	V108-M118 HydrophobicContact CG1-CE 4.22Å; M111-M118 HydrophobicContact CB-CB 4.32Å; M111-M118 HydrophobicContact CB-CG 4.2Å; M111-M118 HydrophobicContact CB-SD 4.19Å; M111-M118 HydrophobicContact CE-CB 4.27Å; A112-M118 WeakPolarHBondContact CA-SD 3.39Å; A112-M118 HydrophobicContact CB-SD 4.03Å; A114-M118 PolarHBondContact O-N 2.89Å; E115-M118 PolarHBondContact O-N 3.34Å; M118-R120 VanDerWaalsContact C-N 3.31Å; M118-R120 PolarHBondContact O-N 3.48Å; M118-I124 WeakPolarHBondContact O-CG1 3.39Å; M118-L152 HydrophobicContact CE-CD1 4.28Å; M118-N155 HydrophobicContact CE-CB 3.44Å; M118-N155 VanDerWaalsContact CE-CB 3.44Å; M118-N155 HydrophobicContact SD-CB 4.35Å; M118-F156 HydrophobicContact CE-CD2 3.58Å; M118-F156 HydrophobicContact CE-CE2 3.21Å; M118-F156 HydrophobicContact CE-CZ 4.08Å; M118-F156 HydrophobicContact CG-CE2 4.09Å; M118-F156 HydrophobicContact CG-CZ 4.01Å; M118-F156 HydrophobicContact SD-CE2 4.38Å
119	F	84.2	Confident	82.1	Confident	37 Å²	37	54.5 Å²	54.5	16%	0.162	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	5.7	-175.8	-55.7	-56.7	0	0	0	114.3	E115 E117 F156 H159 H163	E115-F119 HydrophobicContact CB-CE2 4Å; E115-F119 HydrophobicContact CG-CE2 4.46Å; E115-F119 WeakPolarHBondContact O-CD2 3.04Å; E115-F119 WeakPolarHBondContact O-CE2 3.3Å; E115-F119 PolarHBondContact O-N 3.39Å; E117-F119 VanDerWaalsContact C-N 3.33Å; E117-F119 PolarHBondContact O-N 3.4Å; F119-F156 AromaticContact CD1-CD1 3.81Å; F119-F156 HydrophobicContact CD1-CD1 3.81Å; F119-F156 AromaticContact CD1-CE1 3.54Å; F119-F156 HydrophobicContact CD1-CE1 3.54Å; F119-F156 HydrophobicContact CD1-CZ 4.15Å; F119-F156 AromaticContact CE1-CD1 3.72Å; F119-F156 HydrophobicContact CE1-CD1 3.72Å; F119-F156 AromaticContact CE1-CE1 3.83Å; F119-F156 HydrophobicContact CE1-CE1 3.83Å; F119-F156 HydrophobicContact CE1-CG 4.11Å; F119-F156 HydrophobicContact CE1-CZ 4.29Å; F119-H159 HydrophobicContact CD1-CB 4.01Å; F119-H159 AromaticContact CD2-CD2 3.82Å; F119-H159 AromaticContact CD2-NE2 3.96Å; F119-H159 HydrophobicContact CE1-CB 3.97Å; F119-H159 AromaticContact CE1-CD2 3.59Å; F119-H159 AromaticContact CE1-CG 3.99Å; F119-H159 AromaticContact CE2-CD2 3.33Å; F119-H159 WeakPolarHBondContact CE2-CD2 3.38Å; F119-H159 AromaticContact CE2-NE2 3.55Å; F119-H159 HydrophobicContact CZ-CB 4.49Å; F119-H159 AromaticContact CZ-CD2 3.22Å; F119-H159 WeakPolarHBondContact CZ-CD2 3.17Å; F119-H159 AromaticContact CZ-NE2 3.93Å; F119-H163 PolarHBondContact O-CE1 3.24Å
120	R	85	Confident	82.7	Confident	102 Å²	102	50.6 Å²	50.6	39%	0.385	25%	0.253	S	S	.	.	S	Bend	trans	-70.8	135.9	173.9	-67.5	-173.9	179.5	179.1	4.9	110.5	D73 E117 M118 E122 T123 I124	D73-R120 IonicContact OD1-NH1 3.62Å; E117-R120 VanDerWaalsContact CD-CZ 3.46Å; E117-R120 PolarHBondContact O-N 3.48Å; E117-R120 IonicContact OE1-CZ 2.78Å; E117-R120 IonicContact OE1-NE 3.06Å; E117-R120 IonicContact OE1-NH1 2.77Å; E117-R120 IonicContact OE1-NH2 3.14Å; E117-R120 PolarHBondContact OE1-NH2 3.2Å; E117-R120 IonicContact OE2-CZ 3.18Å; E117-R120 IonicContact OE2-NE 3.55Å; E117-R120 PolarHBondContact OE2-NE 2.85Å; E117-R120 IonicContact OE2-NH1 2.67Å; E117-R120 PolarHBondContact OE2-NH1 3.27Å; E117-R120 VanDerWaalsContact OE2-NH1 3.15Å; E117-R120 IonicContact OE2-NH2 3.72Å; E117-R120 PolarHBondContact OE2-NH2 2.85Å; M118-R120 VanDerWaalsContact C-N 3.31Å; M118-R120 PolarHBondContact O-N 3.48Å; R120-E122 VanDerWaalsContact C-N 3.27Å; R120-E122 PolarHBondContact O-N 2.55Å; R120-T123 WeakPolarHBondContact O-CB 3.34Å; R120-T123 PolarHBondContact O-N 2.97Å; R120-I124 WeakPolarHBondContact O-CG1 3.39Å; R120-I124 PolarHBondContact O-N 2.89Å
121	P	85.3	Confident	83.6	Confident	91 Å²	91	50.4 Å²	50.4	59%	0.591	25%	0.251	S	S	*	.	H	α-helix	trans	-52.5	-41.5	-177.8	-28.3	35.3	0	0	0	114.2	I124 Q125	P121-I124 PolarHBondContact O-N 2.92Å; P121-Q125 WeakPolarHBondContact O-CB 3.07Å; P121-Q125 PolarHBondContact O-N 3Å
122	E	86.2	Confident	84	Confident	100 Å²	100	54.1 Å²	54.1	47%	0.467	27%	0.27	S	S	.	.	H	α-helix	trans	-66.3	-42.9	179.7	-58.4	76.5	-167.3	0	0	111.4	R120 Q125 Q126	R120-E122 VanDerWaalsContact C-N 3.27Å; R120-E122 PolarHBondContact O-N 2.55Å; E122-Q125 PolarHBondContact O-N 3.25Å; E122-Q126 WeakPolarHBondContact O-CG 3.49Å; E122-Q126 PolarHBondContact O-N 3.4Å; E122-Q126 VanDerWaalsContact O-N 3.09Å
123	T	86.5	Confident	84.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-45.5	176.5	-53.1	0	0	0	0	110.8	V78 M111 E117 R120 Q126 L127	V78-T123 HydrophobicContact CB-CG2 4.47Å; V78-T123 HydrophobicContact CG2-CG2 3.8Å; M111-T123 HydrophobicContact CE-CG2 3.78Å; E117-T123 WeakPolarHBondContact O-CB 3.21Å; E117-T123 WeakPolarHBondContact O-CG2 3.06Å; E117-T123 PolarHBondContact O-OG1 3.29Å; R120-T123 WeakPolarHBondContact O-CB 3.34Å; R120-T123 PolarHBondContact O-N 2.97Å; T123-Q126 PolarHBondContact O-N 3.15Å; T123-L127 HydrophobicContact CG2-CD1 4.12Å; T123-L127 HydrophobicContact CG2-CG 4.42Å; T123-L127 WeakPolarHBondContact O-CB 3.48Å; T123-L127 WeakPolarHBondContact O-CG 3.11Å; T123-L127 PolarHBondContact O-N 2.85Å
124	I	88	Confident	84.9	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-48.2	178.3	-64.7	170.4	0	0	0	110.1	M118 R120 P121 Q126 L127 M128 F156 H163 A166 V167	M118-I124 WeakPolarHBondContact O-CG1 3.39Å; R120-I124 WeakPolarHBondContact O-CG1 3.39Å; R120-I124 PolarHBondContact O-N 2.89Å; P121-I124 PolarHBondContact O-N 2.92Å; I124-Q126 VanDerWaalsContact C-N 3.25Å; I124-Q126 PolarHBondContact O-N 3.11Å; I124-L127 PolarHBondContact O-N 3.44Å; I124-L127 VanDerWaalsContact O-N 3.15Å; I124-M128 HydrophobicContact CG2-CG 4.08Å; I124-M128 WeakPolarHBondContact O-CB 3.44Å; I124-M128 VanDerWaalsContact O-CG 3.23Å; I124-M128 WeakPolarHBondContact O-CG 3.33Å; I124-M128 PolarHBondContact O-N 3.4Å; I124-F156 HydrophobicContact CD1-CE1 3.76Å; I124-F156 HydrophobicContact CD1-CZ 4.25Å; I124-F156 HydrophobicContact CG1-CE1 3.84Å; I124-F156 HydrophobicContact CG1-CZ 3.8Å; I124-H163 HydrophobicContact CD1-CB 4.38Å; I124-H163 WeakPolarHBondContact CD1-CE1 3.47Å; I124-H163 WeakPolarHBondContact CD1-ND1 3.37Å; I124-A166 HydrophobicContact CG2-CB 3.96Å; I124-V167 HydrophobicContact CG2-CG2 3.82Å
125	Q	87.9	Confident	85.3	Confident	126 Å²	126	61.9 Å²	61.9	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-53.8	-46.6	178.2	-171.7	-178.7	17.4	0	0	110.6	P121 E122 M128 L129	P121-Q125 WeakPolarHBondContact O-CB 3.07Å; P121-Q125 PolarHBondContact O-N 3Å; E122-Q125 PolarHBondContact O-N 3.25Å; Q125-M128 PolarHBondContact O-N 3.38Å; Q125-L129 WeakPolarHBondContact O-CG 3.32Å; Q125-L129 PolarHBondContact O-N 3.22Å
126	Q	86.6	Confident	85.4	Confident	45 Å²	45	56.5 Å²	56.5	21%	0.21	27%	0.266	C	S	.	.	H	α-helix	trans	-68.6	-39.4	178.7	-64.1	-61	-49.4	0	0	113.3	V78 E122 T123 I124 M128 L129	V78-Q126 HydrophobicContact CB-CB 4.39Å; V78-Q126 HydrophobicContact CG1-CB 3.56Å; E122-Q126 WeakPolarHBondContact O-CG 3.49Å; E122-Q126 PolarHBondContact O-N 3.4Å; E122-Q126 VanDerWaalsContact O-N 3.09Å; T123-Q126 PolarHBondContact O-N 3.15Å; I124-Q126 VanDerWaalsContact C-N 3.25Å; I124-Q126 PolarHBondContact O-N 3.11Å; Q126-M128 PolarHBondContact O-N 2.95Å; Q126-L129 PolarHBondContact O-N 3.46Å
127	L	89.5	Confident	85.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-34	175.8	-77.5	174.2	0	0	0	112	V78 W104 L107 V108 T123 I124 Y131 L152	V78-L127 HydrophobicContact CG1-CD2 3.78Å; V78-L127 HydrophobicContact CG1-CG 3.89Å; V78-L127 HydrophobicContact CG2-CD2 3.9Å; V78-L127 HydrophobicContact CG2-CG 4.13Å; W104-L127 PolarHBondContact NE1-O 3.19Å; W104-L127 VanDerWaalsContact NE1-O 3.1Å; L107-L127 HydrophobicContact CD2-CD2 4.18Å; V108-L127 HydrophobicContact CG2-CD2 4.28Å; T123-L127 HydrophobicContact CG2-CD1 4.12Å; T123-L127 HydrophobicContact CG2-CG 4.42Å; T123-L127 WeakPolarHBondContact O-CB 3.48Å; T123-L127 WeakPolarHBondContact O-CG 3.11Å; T123-L127 PolarHBondContact O-N 2.85Å; I124-L127 PolarHBondContact O-N 3.44Å; I124-L127 VanDerWaalsContact O-N 3.15Å; L127-Y131 VanDerWaalsContact O-CD2 3.31Å; L127-Y131 WeakPolarHBondContact O-CD2 3.29Å; L127-Y131 WeakPolarHBondContact O-CE2 3.35Å; L127-L152 HydrophobicContact CD1-CD1 4.42Å
128	M	91.3	Very high	84.6	Confident	5 Å²	5	53 Å²	53	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-78.3	-24.1	-177.3	-72.7	-56.6	-55.4	0	0	114.2	I124 Q125 Q126 Y131 I132 W149 L152 A166 V167	I124-M128 HydrophobicContact CG2-CG 4.08Å; I124-M128 WeakPolarHBondContact O-CB 3.44Å; I124-M128 VanDerWaalsContact O-CG 3.23Å; I124-M128 WeakPolarHBondContact O-CG 3.33Å; I124-M128 PolarHBondContact O-N 3.4Å; Q125-M128 PolarHBondContact O-N 3.38Å; Q126-M128 PolarHBondContact O-N 2.95Å; M128-Y131 WeakPolarHBondContact O-CB 3.14Å; M128-Y131 PolarHBondContact O-N 3.46Å; M128-Y131 HydrophobicContact SD-CD2 4.34Å; M128-I132 HydrophobicContact CB-CD1 4.12Å; M128-I132 HydrophobicContact CE-CD1 4.42Å; M128-I132 HydrophobicContact CE-CG1 4.43Å; M128-I132 PolarHBondContact O-N 2.86Å; M128-I132 VanDerWaalsContact O-N 3.12Å; M128-W149 HydrophobicContact CE-CH2 4.43Å; M128-W149 HydrophobicContact CE-CZ2 3.39Å; M128-L152 HydrophobicContact SD-CD2 3.4Å; M128-L152 WeakPolarHBondContact SD-CD2 3.28Å; M128-A166 WeakPolarHBondContact CE-O 3.46Å; M128-V167 HydrophobicContact CG-CG2 4.36Å; M128-V167 HydrophobicContact SD-CB 4.25Å; M128-V167 HydrophobicContact SD-CG1 4Å; M128-V167 HydrophobicContact SD-CG2 4.03Å
129	L	89.5	Confident	83.9	Confident	51 Å²	51	59.3 Å²	59.3	27%	0.267	29%	0.289	S	S	.	.	H	α-helix	trans	-51.2	-51.7	-173.7	-72.7	172.7	0	0	0	113.6	Q125 Q126 Y131 I132 E133	Q125-L129 WeakPolarHBondContact O-CG 3.32Å; Q125-L129 PolarHBondContact O-N 3.22Å; Q126-L129 PolarHBondContact O-N 3.46Å; L129-Y131 VanDerWaalsContact C-N 3.27Å; L129-Y131 PolarHBondContact O-N 3.37Å; L129-I132 PolarHBondContact O-N 3Å; L129-I132 VanDerWaalsContact O-N 3.08Å; L129-E133 WeakPolarHBondContact O-CB 3.23Å; L129-E133 WeakPolarHBondContact O-CG 3.44Å; L129-E133 PolarHBondContact O-N 3Å
130	P	88.8	Confident	83.2	Confident	8 Å²	8	62.9 Å²	62.9	5%	0.052	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-32	-178.2	-23.4	37.6	0	0	0	113.1	F89 F101 W104 I132 I134	F89-P130 HydrophobicContact CD2-CB 4.13Å; F89-P130 HydrophobicContact CD2-CG 4.09Å; F89-P130 HydrophobicContact CE1-CB 4.04Å; F89-P130 HydrophobicContact CE2-CB 3.65Å; F89-P130 HydrophobicContact CE2-CG 3.48Å; F89-P130 VanDerWaalsContact CE2-CG 3.48Å; F89-P130 HydrophobicContact CZ-CB 3.59Å; F89-P130 HydrophobicContact CZ-CG 3.84Å; F101-P130 HydrophobicContact CE1-CB 4.31Å; F101-P130 HydrophobicContact CZ-CB 4.47Å; W104-P130 HydrophobicContact CD2-CG 4.09Å; W104-P130 HydrophobicContact CE3-CG 4.36Å; W104-P130 HydrophobicContact CH2-CG 3.77Å; W104-P130 HydrophobicContact CZ2-CG 3.46Å; W104-P130 VanDerWaalsContact CZ2-CG 3.46Å; W104-P130 HydrophobicContact CZ3-CG 4.21Å; P130-I132 VanDerWaalsContact C-N 3.29Å; P130-I132 PolarHBondContact O-N 3.37Å; P130-I134 HydrophobicContact CB-CD1 3.82Å; P130-I134 WeakPolarHBondContact O-CB 3.37Å; P130-I134 WeakPolarHBondContact O-CD1 3.5Å; P130-I134 VanDerWaalsContact O-CG1 3.32Å; P130-I134 WeakPolarHBondContact O-CG1 3.4Å; P130-I134 PolarHBondContact O-N 3.44Å
131	Y	90.2	Very high	82.7	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-27.4	176.7	-61.3	-69	0	0	0	112.4	F101 W104 L127 M128 L129 K145 S148 W149 L152	F101-Y131 HydrophobicContact CD1-CD1 4.38Å; F101-Y131 AromaticContact CD1-CE1 3.99Å; F101-Y131 HydrophobicContact CD1-CE1 3.99Å; F101-Y131 AromaticContact CE1-CD1 3.67Å; F101-Y131 HydrophobicContact CE1-CD1 3.67Å; F101-Y131 AromaticContact CE1-CE1 3.75Å; F101-Y131 HydrophobicContact CE1-CE1 3.75Å; F101-Y131 HydrophobicContact CE1-CG 4.47Å; W104-Y131 AromaticContact CD1-CE2 3.73Å; W104-Y131 AromaticContact CD1-CZ 3.74Å; W104-Y131 AromaticContact NE1-CE2 3.7Å; L127-Y131 VanDerWaalsContact O-CD2 3.31Å; L127-Y131 WeakPolarHBondContact O-CD2 3.29Å; L127-Y131 WeakPolarHBondContact O-CE2 3.35Å; M128-Y131 WeakPolarHBondContact O-CB 3.14Å; M128-Y131 PolarHBondContact O-N 3.46Å; M128-Y131 HydrophobicContact SD-CD2 4.34Å; L129-Y131 VanDerWaalsContact C-N 3.27Å; L129-Y131 PolarHBondContact O-N 3.37Å; Y131-K145 HydrophobicContact CD1-CG 4.42Å; Y131-K145 WeakPolarHBondContact O-CE 3.45Å; Y131-K145 PolarHBondContact O-NZ 3.17Å; Y131-S148 WeakPolarHBondContact CE1-OG 3.44Å; Y131-S148 PolarHBondContact OH-O 3.4Å; Y131-S148 PolarHBondContact OH-OG 2.92Å; Y131-W149 HydrophobicContact CD1-CB 3.69Å; Y131-W149 AromaticContact CD1-CD2 3.87Å; Y131-W149 HydrophobicContact CD1-CD2 3.87Å; Y131-W149 HydrophobicContact CD1-CE3 4.06Å; Y131-W149 AromaticContact CD1-CG 3.75Å; Y131-W149 HydrophobicContact CD1-CG 3.75Å; Y131-W149 VanDerWaalsContact CE1-CA 3.47Å; Y131-W149 HydrophobicContact CE1-CB 3.71Å; Y131-W149 HydrophobicContact CE1-CG 4.12Å; Y131-W149 VanDerWaalsContact CE1-N 3.3Å; Y131-W149 HydrophobicContact CG-CB 4.45Å; Y131-W149 AromaticContact CG-CD2 3.92Å; Y131-W149 HydrophobicContact CG-CD2 3.92Å; Y131-W149 HydrophobicContact CG-CE3 4.24Å; Y131-W149 HydrophobicContact CG-CG 4.04Å; Y131-W149 WeakPolarHBondContact O-CZ3 3.4Å; Y131-L152 HydrophobicContact CD2-CD2 4.21Å; Y131-L152 HydrophobicContact CE2-CD2 3.81Å
132	I	87.9	Confident	82.3	Confident	78 Å²	78	56.4 Å²	56.4	40%	0.4	28%	0.275	S	S	.	.	H	α-helix	trans	-89.1	-48.3	179.3	-63.8	169.6	0	0	0	110.2	M128 L129 P130	M128-I132 HydrophobicContact CB-CD1 4.12Å; M128-I132 HydrophobicContact CE-CD1 4.42Å; M128-I132 HydrophobicContact CE-CG1 4.43Å; M128-I132 PolarHBondContact O-N 2.86Å; M128-I132 VanDerWaalsContact O-N 3.12Å; L129-I132 PolarHBondContact O-N 3Å; L129-I132 VanDerWaalsContact O-N 3.08Å; P130-I132 VanDerWaalsContact C-N 3.29Å; P130-I132 PolarHBondContact O-N 3.37Å
133	E	86.8	Confident	81.6	Confident	136 Å²	136	54.1 Å²	54.1	64%	0.636	27%	0.266	S	S	*	.	H	α-helix	trans	-76.8	-32.7	-168.4	-66.1	-178.7	167.2	0	0	113.9	L129 K135	L129-E133 WeakPolarHBondContact O-CB 3.23Å; L129-E133 WeakPolarHBondContact O-CG 3.44Å; L129-E133 PolarHBondContact O-N 3Å; E133-K135 PolarHBondContact O-N 2.77Å
134	I	83.8	Confident	81.1	Confident	12 Å²	12	56.6 Å²	56.6	6%	0.062	28%	0.279	C	S	.	.			trans	-84	113.5	-172.1	-57.2	168.1	0	0	0	110.4	F89 F101 P130 F136 K145	F89-I134 HydrophobicContact CB-CD1 3.58Å; F89-I134 HydrophobicContact CB-CG1 4.23Å; F89-I134 HydrophobicContact CD1-CD1 3.01Å; F89-I134 HydrophobicContact CD1-CG1 4.37Å; F89-I134 HydrophobicContact CD2-CD1 4.24Å; F89-I134 HydrophobicContact CE1-CD1 3.56Å; F89-I134 HydrophobicContact CG-CD1 3.38Å; F89-I134 HydrophobicContact CG-CG1 4.48Å; F89-I134 HydrophobicContact CZ-CD1 4.39Å; F101-I134 HydrophobicContact CE2-CB 4.31Å; F101-I134 HydrophobicContact CE2-CD1 3.74Å; F101-I134 HydrophobicContact CE2-CG2 4.11Å; F101-I134 HydrophobicContact CZ-CB 4.24Å; F101-I134 HydrophobicContact CZ-CD1 3.7Å; P130-I134 HydrophobicContact CB-CD1 3.82Å; P130-I134 WeakPolarHBondContact O-CB 3.37Å; P130-I134 WeakPolarHBondContact O-CD1 3.5Å; P130-I134 VanDerWaalsContact O-CG1 3.32Å; P130-I134 WeakPolarHBondContact O-CG1 3.4Å; P130-I134 PolarHBondContact O-N 3.44Å; I134-F136 HydrophobicContact CG2-CE1 4.32Å; I134-F136 HydrophobicContact CG2-CE2 4.32Å; I134-F136 HydrophobicContact CG2-CZ 4.18Å; I134-K145 PolarHBondContact O-NZ 3.04Å
135	K	81.4	Confident	80.9	Confident	156 Å²	156	56.7 Å²	56.7	68%	0.678	28%	0.279	S	S	*	.			trans	-94.7	113	177.9	-62.6	-168.9	178.8	-167.8	0	110.8	E133	E133-K135 PolarHBondContact O-N 2.77Å
136	F	76.7	Confident	80.5	Confident	15 Å²	15	50.9 Å²	50.9	7%	0.066	25%	0.252	C	S	.	.			trans	-96.6	125.4	170.1	-75.6	-49.4	0	0	0	110.9	Q97 F101 I134 D141 R142 K145	Q97-F136 HydrophobicContact CB-CE1 3.84Å; Q97-F136 HydrophobicContact CB-CZ 3.81Å; F101-F136 AromaticContact CD2-CE2 3.74Å; F101-F136 HydrophobicContact CD2-CE2 3.74Å; F101-F136 AromaticContact CD2-CZ 3.9Å; F101-F136 HydrophobicContact CD2-CZ 3.9Å; F101-F136 HydrophobicContact CE2-CD2 4.44Å; F101-F136 AromaticContact CE2-CE2 3.37Å; F101-F136 HydrophobicContact CE2-CE2 3.37Å; F101-F136 AromaticContact CE2-CZ 3.72Å; F101-F136 HydrophobicContact CE2-CZ 3.72Å; F101-F136 HydrophobicContact CZ-CE2 4.33Å; I134-F136 HydrophobicContact CG2-CE1 4.32Å; I134-F136 HydrophobicContact CG2-CE2 4.32Å; I134-F136 HydrophobicContact CG2-CZ 4.18Å; F136-D141 HydrophobicContact CB-CB 3.79Å; F136-D141 HydrophobicContact CD1-CB 3.36Å; F136-D141 HydrophobicContact CD2-CB 4.02Å; F136-D141 WeakPolarHBondContact CD2-O 3.33Å; F136-D141 HydrophobicContact CE1-CB 3.81Å; F136-D141 HydrophobicContact CE2-CB 4.42Å; F136-D141 WeakPolarHBondContact CE2-O 3.4Å; F136-D141 HydrophobicContact CG-CB 3.47Å; F136-D141 VanDerWaalsContact CG-CB 3.47Å; F136-D141 HydrophobicContact CZ-CB 4.33Å; F136-R142 HydrophobicContact CB-CG 3.73Å; F136-R142 WeakPolarHBondContact O-CD 3.42Å; F136-R142 WeakPolarHBondContact O-CG 3.48Å; F136-K145 HydrophobicContact CD2-CB 3.71Å; F136-K145 HydrophobicContact CD2-CD 3.97Å; F136-K145 HydrophobicContact CD2-CG 4.42Å; F136-K145 HydrophobicContact CE2-CB 3.81Å; F136-K145 HydrophobicContact CE2-CD 4.43Å
137	T	71.6	Confident	79.9	Confident	128 Å²	128	52.2 Å²	52.2	79%	0.785	26%	0.257	S	S	*	.			trans	-92.2	-24	174	54.2	0	0	0	0	112.7
138	G	68.2	Low	79.6	Confident	17 Å²	17	52.2 Å²	52.2	18%	0.175	26%	0.257	C	S	.	.	S	Bend	trans	-83.3	140.5	-179.2	0	0	0	0	0	112.5	N140 D141 R142	G138-N140 PolarHBondContact O-N 3.38Å; G138-D141 WeakPolarHBondContact CA-OD2 3.4Å; G138-D141 PolarHBondContact O-N 3.38Å; G138-R142 WeakPolarHBondContact O-CG 3.39Å; G138-R142 PolarHBondContact O-N 3.09Å
139	R	67.4	Low	79.4	Confident	132 Å²	132	52.1 Å²	52.1	50%	0.498	26%	0.257	S	S	.	.	H	α-helix	trans	-55.5	-49.7	179.4	-180	173.7	166.2	-170.5	-13.7	112.9	D141 R142 L143	R139-D141 VanDerWaalsContact C-N 3.32Å; R139-D141 PolarHBondContact O-N 3.39Å; R139-R142 PolarHBondContact O-N 2.82Å; R139-L143 WeakPolarHBondContact O-CG 3.45Å; R139-L143 PolarHBondContact O-N 3.32Å; R139-L143 VanDerWaalsContact O-N 3.15Å
140	N	67.9	Low	78.9	Confident	112 Å²	112	50 Å²	50	60%	0.599	25%	0.245	S	C	*	.	H	α-helix	trans	-64.7	-37.6	-179.7	-69.7	-20.2	0	0	0	112.3	G138 L143 I144	G138-N140 PolarHBondContact O-N 3.38Å; N140-L143 WeakPolarHBondContact O-CB 3.32Å; N140-L143 PolarHBondContact O-N 2.92Å; N140-I144 WeakPolarHBondContact O-CG1 3.47Å; N140-I144 PolarHBondContact O-N 3.15Å
141	D	74.8	Confident	78.4	Confident	18 Å²	18	50.8 Å²	50.8	10%	0.096	25%	0.249	C	C	.	.	H	α-helix	trans	-68.2	-41.2	-178.9	-44.6	-39.7	0	0	0	110.8	K94 F136 G138 R139 L143 I144 K145	K94-D141 VanDerWaalsContact CD-OD2 3.28Å; K94-D141 WeakPolarHBondContact CD-OD2 3.36Å; K94-D141 WeakPolarHBondContact CE-OD2 3.31Å; K94-D141 IonicContact NZ-OD2 2.79Å; K94-D141 PolarHBondContact NZ-OD2 2.96Å; F136-D141 HydrophobicContact CB-CB 3.79Å; F136-D141 HydrophobicContact CD1-CB 3.36Å; F136-D141 HydrophobicContact CD2-CB 4.02Å; F136-D141 WeakPolarHBondContact CD2-O 3.33Å; F136-D141 HydrophobicContact CE1-CB 3.81Å; F136-D141 HydrophobicContact CE2-CB 4.42Å; F136-D141 WeakPolarHBondContact CE2-O 3.4Å; F136-D141 HydrophobicContact CG-CB 3.47Å; F136-D141 VanDerWaalsContact CG-CB 3.47Å; F136-D141 HydrophobicContact CZ-CB 4.33Å; G138-D141 WeakPolarHBondContact CA-OD2 3.4Å; G138-D141 PolarHBondContact O-N 3.38Å; R139-D141 VanDerWaalsContact C-N 3.32Å; R139-D141 PolarHBondContact O-N 3.39Å; D141-L143 VanDerWaalsContact C-N 3.34Å; D141-L143 PolarHBondContact O-N 2.87Å; D141-I144 PolarHBondContact O-N 3.28Å; D141-K145 PolarHBondContact O-N 3.26Å; D141-K145 VanDerWaalsContact O-N 3.11Å
142	R	76.8	Confident	78.2	Confident	39 Å²	39	50.8 Å²	50.8	15%	0.147	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-41.4	173.2	-73.2	178.2	67.5	174.5	0.3	112.2	F136 G138 R139 I144 K145 M146 F174 E177 V199 M202	F136-R142 HydrophobicContact CB-CG 3.73Å; F136-R142 WeakPolarHBondContact O-CD 3.42Å; F136-R142 WeakPolarHBondContact O-CG 3.48Å; G138-R142 WeakPolarHBondContact O-CG 3.39Å; G138-R142 PolarHBondContact O-N 3.09Å; R139-R142 PolarHBondContact O-N 2.82Å; R142-I144 VanDerWaalsContact C-N 3.28Å; R142-I144 PolarHBondContact O-N 3.39Å; R142-K145 PolarHBondContact O-N 3.04Å; R142-M146 WeakPolarHBondContact O-CB 3.35Å; R142-M146 PolarHBondContact O-N 3.27Å; R142-F174 HydrophobicContact CB-CZ 4.31Å; R142-F174 HydrophobicContact CG-CZ 4.28Å; R142-E177 IonicContact CZ-OE1 2.79Å; R142-E177 IonicContact NH1-OE1 3.37Å; R142-E177 PolarHBondContact NH1-OE1 3.18Å; R142-E177 IonicContact NH2-OE1 4Å; R142-E177 PolarHBondContact NH2-OE1 3.44Å; R142-V199 VanDerWaalsContact NH1-CG2 3.31Å; R142-M202 PolarHBondContact NH2-SD 3.16Å
143	L	73.1	Confident	77.9	Confident	53 Å²	53	47.2 Å²	47.2	28%	0.277	23%	0.231	S	C	.	.	H	α-helix	trans	-61	-37.3	176.4	-71.7	174.2	0	0	0	112.2	R139 N140 D141 M146 K147	R139-L143 WeakPolarHBondContact O-CG 3.45Å; R139-L143 PolarHBondContact O-N 3.32Å; R139-L143 VanDerWaalsContact O-N 3.15Å; N140-L143 WeakPolarHBondContact O-CB 3.32Å; N140-L143 PolarHBondContact O-N 2.92Å; D141-L143 VanDerWaalsContact C-N 3.34Å; D141-L143 PolarHBondContact O-N 2.87Å; L143-M146 HydrophobicContact CD2-CE 3.47Å; L143-M146 VanDerWaalsContact CD2-CE 3.47Å; L143-M146 HydrophobicContact CD2-SD 4.43Å; L143-M146 PolarHBondContact O-N 3.13Å; L143-K147 WeakPolarHBondContact O-CB 3.5Å; L143-K147 PolarHBondContact O-N 3.45Å
144	I	74.5	Confident	77.4	Confident	52 Å²	52	42.3 Å²	42.3	27%	0.267	21%	0.209	S	C	.	.	H	α-helix	trans	-67.1	-48.2	177.9	-68.2	163.7	0	0	0	110.6	I98 F101 N140 D141 R142 M146 K147 S148	I98-I144 HydrophobicContact CB-CD1 4.31Å; I98-I144 HydrophobicContact CD1-CD1 3.57Å; I98-I144 HydrophobicContact CG1-CD1 3.61Å; I98-I144 HydrophobicContact CG1-CG2 4.39Å; I98-I144 HydrophobicContact CG2-CD1 3.77Å; I98-I144 HydrophobicContact CG2-CG2 4.2Å; F101-I144 HydrophobicContact CB-CG2 4.35Å; N140-I144 WeakPolarHBondContact O-CG1 3.47Å; N140-I144 PolarHBondContact O-N 3.15Å; D141-I144 PolarHBondContact O-N 3.28Å; R142-I144 VanDerWaalsContact C-N 3.28Å; R142-I144 PolarHBondContact O-N 3.39Å; I144-M146 VanDerWaalsContact C-N 3.29Å; I144-M146 PolarHBondContact O-N 2.89Å; I144-K147 PolarHBondContact O-N 3.1Å; I144-S148 WeakPolarHBondContact O-CB 3.31Å; I144-S148 PolarHBondContact O-N 3.14Å
145	K	84.3	Confident	77.2	Confident	6 Å²	6	44.3 Å²	44.3	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-56.7	-46.2	174.6	-178.3	176.8	179.5	-175.3	0	111.6	F101 Y131 I134 F136 D141 R142 K147 S148 W149 F174	F101-K145 HydrophobicContact CE1-CG 4.13Å; F101-K145 HydrophobicContact CE2-CB 4.47Å; F101-K145 HydrophobicContact CE2-CG 4.43Å; F101-K145 HydrophobicContact CZ-CB 4.36Å; F101-K145 HydrophobicContact CZ-CD 4.23Å; F101-K145 HydrophobicContact CZ-CG 3.87Å; Y131-K145 HydrophobicContact CD1-CG 4.42Å; Y131-K145 WeakPolarHBondContact O-CE 3.45Å; Y131-K145 PolarHBondContact O-NZ 3.17Å; I134-K145 PolarHBondContact O-NZ 3.04Å; F136-K145 HydrophobicContact CD2-CB 3.71Å; F136-K145 HydrophobicContact CD2-CD 3.97Å; F136-K145 HydrophobicContact CD2-CG 4.42Å; F136-K145 HydrophobicContact CE2-CB 3.81Å; F136-K145 HydrophobicContact CE2-CD 4.43Å; D141-K145 PolarHBondContact O-N 3.26Å; D141-K145 VanDerWaalsContact O-N 3.11Å; R142-K145 PolarHBondContact O-N 3.04Å; K145-K147 VanDerWaalsContact C-N 3.34Å; K145-K147 PolarHBondContact O-N 3.42Å; K145-S148 PolarHBondContact O-N 3.05Å; K145-W149 WeakPolarHBondContact O-CB 3.18Å; K145-W149 PolarHBondContact O-N 3.48Å; K145-F174 HydrophobicContact CD-CE2 3.97Å; K145-F174 HydrophobicContact CD-CZ 3.97Å
146	M	79.2	Confident	77.1	Confident	4 Å²	4	37 Å²	37	2%	0.02	19%	0.187	C	C	.	.	H	α-helix	trans	-63.8	-38.8	179	-173.1	-174	79.5	0	0	111.8	R142 L143 I144 W150 F171 F174 M202 V205 F220	R142-M146 WeakPolarHBondContact O-CB 3.35Å; R142-M146 PolarHBondContact O-N 3.27Å; L143-M146 HydrophobicContact CD2-CE 3.47Å; L143-M146 VanDerWaalsContact CD2-CE 3.47Å; L143-M146 HydrophobicContact CD2-SD 4.43Å; L143-M146 PolarHBondContact O-N 3.13Å; I144-M146 VanDerWaalsContact C-N 3.29Å; I144-M146 PolarHBondContact O-N 2.89Å; M146-W150 WeakPolarHBondContact O-CB 3.42Å; M146-W150 PolarHBondContact O-N 3.17Å; M146-F171 HydrophobicContact CG-CE2 4.12Å; M146-F171 HydrophobicContact CG-CZ 4.42Å; M146-F174 HydrophobicContact CB-CE1 4.36Å; M146-M202 HydrophobicContact CG-CE 4.46Å; M146-M202 HydrophobicContact SD-CE 3.54Å; M146-M202 VanDerWaalsContact SD-CE 3.54Å; M146-V205 HydrophobicContact CE-CB 3.86Å; M146-V205 HydrophobicContact CE-CG1 3.57Å; M146-V205 HydrophobicContact CE-CG2 3.18Å; M146-V205 HydrophobicContact CG-CG1 4.01Å; M146-V205 HydrophobicContact SD-CB 3.81Å; M146-V205 HydrophobicContact SD-CG1 3.5Å; M146-V205 WeakPolarHBondContact SD-CG1 3.41Å; M146-V205 HydrophobicContact SD-CG2 3.7Å; M146-F220 HydrophobicContact CE-CE2 4.03Å; M146-F220 HydrophobicContact CE-CZ 3.54Å
147	K	75.1	Confident	76.9	Confident	73 Å²	73	42.7 Å²	42.7	32%	0.317	21%	0.209	S	C	.	.	H	α-helix	trans	-65.9	-39.3	173.4	-174.7	176.8	-179.8	173.2	0	113.2	L143 I144 K145 W150 N151 F220	L143-K147 WeakPolarHBondContact O-CB 3.5Å; L143-K147 PolarHBondContact O-N 3.45Å; I144-K147 PolarHBondContact O-N 3.1Å; K145-K147 VanDerWaalsContact C-N 3.34Å; K145-K147 PolarHBondContact O-N 3.42Å; K147-W150 WeakPolarHBondContact O-CB 3.21Å; K147-N151 PolarHBondContact O-N 3.16Å; K147-N151 VanDerWaalsContact O-N 3.11Å; K147-N151 PolarHBondContact O-ND2 2.97Å; K147-F220 HydrophobicContact CB-CE1 3.93Å; K147-F220 HydrophobicContact CB-CZ 4.11Å; K147-F220 HydrophobicContact CG-CE1 4.03Å; K147-F220 HydrophobicContact CG-CZ 4.48Å
148	S	82.6	Confident	77	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-67.4	-46	176	176.8	0	0	0	0	111.3	D105 Y131 I144 K145 W150 N151 L152	D105-S148 WeakPolarHBondContact OD1-CA 3.18Å; D105-S148 WeakPolarHBondContact OD1-CB 3.28Å; D105-S148 PolarHBondContact OD1-OG 2.9Å; Y131-S148 WeakPolarHBondContact CE1-OG 3.44Å; Y131-S148 PolarHBondContact OH-O 3.4Å; Y131-S148 PolarHBondContact OH-OG 2.92Å; I144-S148 WeakPolarHBondContact O-CB 3.31Å; I144-S148 PolarHBondContact O-N 3.14Å; K145-S148 PolarHBondContact O-N 3.05Å; S148-W150 VanDerWaalsContact C-N 3.28Å; S148-W150 PolarHBondContact O-N 2.83Å; S148-N151 WeakPolarHBondContact O-CB 3.45Å; S148-N151 PolarHBondContact O-N 3.24Å; S148-N151 VanDerWaalsContact O-N 3.08Å; S148-L152 PolarHBondContact O-N 3.5Å; S148-L152 VanDerWaalsContact O-N 3.11Å
149	W	87.5	Confident	77.4	Confident	3 Å²	3	45.5 Å²	45.5	1%	0.011	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-35.5	176.8	-154.4	-22.3	0	0	0	112	M128 Y131 K145 N151 L152 L153 P170 F171 F174	M128-W149 HydrophobicContact CE-CH2 4.43Å; M128-W149 HydrophobicContact CE-CZ2 3.39Å; Y131-W149 HydrophobicContact CD1-CB 3.69Å; Y131-W149 AromaticContact CD1-CD2 3.87Å; Y131-W149 HydrophobicContact CD1-CD2 3.87Å; Y131-W149 HydrophobicContact CD1-CE3 4.06Å; Y131-W149 AromaticContact CD1-CG 3.75Å; Y131-W149 HydrophobicContact CD1-CG 3.75Å; Y131-W149 VanDerWaalsContact CE1-CA 3.47Å; Y131-W149 HydrophobicContact CE1-CB 3.71Å; Y131-W149 HydrophobicContact CE1-CG 4.12Å; Y131-W149 VanDerWaalsContact CE1-N 3.3Å; Y131-W149 HydrophobicContact CG-CB 4.45Å; Y131-W149 AromaticContact CG-CD2 3.92Å; Y131-W149 HydrophobicContact CG-CD2 3.92Å; Y131-W149 HydrophobicContact CG-CE3 4.24Å; Y131-W149 HydrophobicContact CG-CG 4.04Å; Y131-W149 WeakPolarHBondContact O-CZ3 3.4Å; K145-W149 WeakPolarHBondContact O-CB 3.18Å; K145-W149 PolarHBondContact O-N 3.48Å; W149-N151 PolarHBondContact O-N 2.96Å; W149-L152 VanDerWaalsContact O-CB 3.28Å; W149-L152 WeakPolarHBondContact O-CB 3.33Å; W149-L152 PolarHBondContact O-N 3.08Å; W149-L152 VanDerWaalsContact O-N 3.16Å; W149-L153 WeakPolarHBondContact O-CG 3.37Å; W149-L153 PolarHBondContact O-N 2.8Å; W149-P170 HydrophobicContact CH2-CB 4.06Å; W149-P170 WeakPolarHBondContact CH2-O 3.49Å; W149-P170 HydrophobicContact CZ2-CB 3.94Å; W149-F171 HydrophobicContact CB-CD2 4.16Å; W149-F171 HydrophobicContact CB-CE2 4.37Å; W149-F171 HydrophobicContact CD2-CB 4.2Å; W149-F171 AromaticContact CD2-CD2 3.68Å; W149-F171 HydrophobicContact CD2-CD2 3.68Å; W149-F171 HydrophobicContact CD2-CG 4.43Å; W149-F171 AromaticContact CE3-CD2 3.99Å; W149-F171 HydrophobicContact CE3-CD2 3.99Å; W149-F171 AromaticContact CG-CD2 3.73Å; W149-F171 HydrophobicContact CG-CD2 3.73Å; W149-F171 HydrophobicContact CG-CE2 4.41Å; W149-F171 HydrophobicContact CH2-CB 4.39Å; W149-F171 HydrophobicContact CZ2-CB 3.8Å; W149-F171 VanDerWaalsContact CZ2-N 3.31Å; W149-F174 HydrophobicContact CE3-CD1 4.4Å; W149-F174 HydrophobicContact CH2-CB 4.2Å; W149-F174 HydrophobicContact CZ3-CB 3.81Å; W149-F174 HydrophobicContact CZ3-CD1 4.2Å; W149-F174 HydrophobicContact CZ3-CD2 4.45Å; W149-F174 AromaticContact CZ3-CG 3.89Å; W149-F174 HydrophobicContact CZ3-CG 3.89Å
150	W	79.2	Confident	77.7	Confident	5 Å²	5	39.3 Å²	39.3	2%	0.019	19%	0.185	C	C	.	.	H	α-helix	trans	-57.4	-48.8	170.8	-177.3	-92.6	0	0	0	111.9	M146 K147 S148 L152 L153 L154 F171 N208 F209 F220 L223	M146-W150 WeakPolarHBondContact O-CB 3.42Å; M146-W150 PolarHBondContact O-N 3.17Å; K147-W150 WeakPolarHBondContact O-CB 3.21Å; S148-W150 VanDerWaalsContact C-N 3.28Å; S148-W150 PolarHBondContact O-N 2.83Å; W150-L152 PolarHBondContact O-N 2.93Å; W150-L153 WeakPolarHBondContact O-CB 3.36Å; W150-L153 PolarHBondContact O-N 3.31Å; W150-L154 WeakPolarHBondContact O-CG 3.49Å; W150-L154 PolarHBondContact O-N 3.35Å; W150-F171 HydrophobicContact CE3-CZ 4.47Å; W150-N208 HydrophobicContact CH2-CB 4.32Å; W150-N208 WeakPolarHBondContact CH2-O 3.32Å; W150-F209 HydrophobicContact CE3-CD2 4.06Å; W150-F209 HydrophobicContact CH2-CB 4.17Å; W150-F209 HydrophobicContact CH2-CD2 4.23Å; W150-F209 HydrophobicContact CZ3-CB 3.56Å; W150-F209 AromaticContact CZ3-CD2 3.51Å; W150-F209 HydrophobicContact CZ3-CD2 3.51Å; W150-F209 AromaticContact CZ3-CG 4Å; W150-F209 HydrophobicContact CZ3-CG 4Å; W150-F220 HydrophobicContact CB-CD1 4.36Å; W150-F220 HydrophobicContact CB-CE1 4.05Å; W150-F220 AromaticContact CD1-CD1 3.83Å; W150-F220 HydrophobicContact CD2-CD1 4.16Å; W150-F220 HydrophobicContact CD2-CE1 4.43Å; W150-F220 AromaticContact CG-CD1 3.87Å; W150-F220 HydrophobicContact CG-CD1 3.87Å; W150-F220 HydrophobicContact CG-CE1 4.02Å; W150-L223 HydrophobicContact CH2-CD1 3.54Å; W150-L223 HydrophobicContact CZ2-CD1 3.14Å; W150-L223 HydrophobicContact CZ2-CG 3.81Å
151	N	77.8	Confident	77.8	Confident	26 Å²	26	36.9 Å²	36.9	14%	0.139	17%	0.17	C	C	.	.	H	α-helix	trans	-58.5	-35.9	176.4	-69.6	-28.1	0	0	0	111.8	D105 K147 S148 W149 N155	D105-N151 PolarHBondContact OD2-ND2 3.27Å; K147-N151 PolarHBondContact O-N 3.16Å; K147-N151 VanDerWaalsContact O-N 3.11Å; K147-N151 PolarHBondContact O-ND2 2.97Å; S148-N151 WeakPolarHBondContact O-CB 3.45Å; S148-N151 PolarHBondContact O-N 3.24Å; S148-N151 VanDerWaalsContact O-N 3.08Å; W149-N151 PolarHBondContact O-N 2.96Å; N151-N155 PolarHBondContact O-N 3.11Å; N151-N155 PolarHBondContact O-ND2 3.13Å
152	L	85.8	Confident	77.9	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-60.6	-53.8	171.1	-174.8	74.3	0	0	0	111.4	V108 M118 L127 M128 Y131 S148 W149 W150 L154 N155 F156 V167	V108-L152 HydrophobicContact CB-CD1 4.46Å; V108-L152 HydrophobicContact CG1-CB 4.41Å; V108-L152 HydrophobicContact CG1-CD1 3.78Å; V108-L152 HydrophobicContact CG2-CD1 3.77Å; M118-L152 HydrophobicContact CE-CD1 4.28Å; L127-L152 HydrophobicContact CD1-CD1 4.42Å; M128-L152 HydrophobicContact SD-CD2 3.4Å; M128-L152 WeakPolarHBondContact SD-CD2 3.28Å; Y131-L152 HydrophobicContact CD2-CD2 4.21Å; Y131-L152 HydrophobicContact CE2-CD2 3.81Å; S148-L152 PolarHBondContact O-N 3.5Å; S148-L152 VanDerWaalsContact O-N 3.11Å; W149-L152 VanDerWaalsContact O-CB 3.28Å; W149-L152 WeakPolarHBondContact O-CB 3.33Å; W149-L152 PolarHBondContact O-N 3.08Å; W149-L152 VanDerWaalsContact O-N 3.16Å; W150-L152 PolarHBondContact O-N 2.93Å; L152-L154 PolarHBondContact O-N 3.37Å; L152-N155 PolarHBondContact O-N 3.48Å; L152-F156 HydrophobicContact CD1-CD2 3.97Å; L152-F156 HydrophobicContact CD1-CE2 3.58Å; L152-F156 HydrophobicContact CG-CD2 3.99Å; L152-F156 HydrophobicContact CG-CE2 4.02Å; L152-F156 WeakPolarHBondContact O-CD2 3.41Å; L152-F156 PolarHBondContact O-N 3.32Å; L152-F156 VanDerWaalsContact O-N 3.1Å; L152-V167 HydrophobicContact CD2-CG1 4.01Å
153	L	81.4	Confident	78.2	Confident	2 Å²	2	40 Å²	40	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-56	-38.2	-179.9	-70.4	157.4	0	0	0	112.4	W149 W150 N155 F156 R157 L160 V167 F171 F209	W149-L153 WeakPolarHBondContact O-CG 3.37Å; W149-L153 PolarHBondContact O-N 2.8Å; W150-L153 WeakPolarHBondContact O-CB 3.36Å; W150-L153 PolarHBondContact O-N 3.31Å; L153-N155 VanDerWaalsContact C-N 3.3Å; L153-N155 PolarHBondContact O-N 3.26Å; L153-F156 CarbonylContact O-C 3.17Å; L153-F156 PolarHBondContact O-N 3.32Å; L153-F156 VanDerWaalsContact O-N 3.14Å; L153-R157 PolarHBondContact O-N 2.88Å; L153-L160 HydrophobicContact CD2-CD2 3.72Å; L153-V167 HydrophobicContact CD2-CG1 3.7Å; L153-V167 HydrophobicContact CG-CG1 4.37Å; L153-F171 HydrophobicContact CD1-CB 4.36Å; L153-F171 HydrophobicContact CD1-CD1 3.82Å; L153-F171 HydrophobicContact CD1-CD2 3.91Å; L153-F171 HydrophobicContact CD1-CE1 4.03Å; L153-F171 HydrophobicContact CD1-CE2 4.1Å; L153-F171 HydrophobicContact CD1-CG 3.76Å; L153-F171 HydrophobicContact CD1-CZ 4.16Å; L153-F209 HydrophobicContact CB-CE2 4.35Å; L153-F209 HydrophobicContact CD1-CD2 4.19Å; L153-F209 HydrophobicContact CD1-CE2 3.56Å; L153-F209 HydrophobicContact CD1-CZ 4.18Å; L153-F209 HydrophobicContact CD2-CE2 4.1Å; L153-F209 HydrophobicContact CD2-CZ 4.22Å; L153-F209 HydrophobicContact CG-CE2 4.21Å
154	L	76.4	Confident	78.4	Confident	34 Å²	34	37.6 Å²	37.6	18%	0.178	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-39.3	175.2	-67.1	-174.8	0	0	0	113.2	W150 L152 F156 R157 P221 L223	W150-L154 WeakPolarHBondContact O-CG 3.49Å; W150-L154 PolarHBondContact O-N 3.35Å; L152-L154 PolarHBondContact O-N 3.37Å; L154-F156 VanDerWaalsContact C-N 3.35Å; L154-R157 WeakPolarHBondContact O-CB 3.37Å; L154-R157 WeakPolarHBondContact O-CG 3.3Å; L154-P221 HydrophobicContact CD1-CB 4.19Å; L154-P221 HydrophobicContact CD1-CG 4.21Å; L154-L223 HydrophobicContact CD2-CD1 3.85Å; L154-L223 HydrophobicContact CD2-CD2 3.08Å; L154-L223 HydrophobicContact CD2-CG 3.39Å
155	N	79.5	Confident	78.8	Confident	54 Å²	54	40.7 Å²	40.7	29%	0.289	19%	0.19	S	C	.	.	H	α-helix	trans	-77.6	-24.7	178.9	-70.1	-65.9	0	0	0	112	A112 M118 N151 L152 L153	A112-N155 HydrophobicContact CB-CB 4.11Å; A112-N155 WeakPolarHBondContact CB-OD1 3.39Å; M118-N155 HydrophobicContact CE-CB 3.44Å; M118-N155 VanDerWaalsContact CE-CB 3.44Å; M118-N155 HydrophobicContact SD-CB 4.35Å; N151-N155 PolarHBondContact O-N 3.11Å; N151-N155 PolarHBondContact O-ND2 3.13Å; L152-N155 PolarHBondContact O-N 3.48Å; L153-N155 VanDerWaalsContact C-N 3.3Å; L153-N155 PolarHBondContact O-N 3.26Å
156	F	79.4	Confident	78.8	Confident	1 Å²	1	42.5 Å²	42.5	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-86.7	-4.2	174.7	-84.1	-99.4	0	0	0	114.2	M118 F119 I124 L152 L153 L154 E158 H159 L160 H163 V167	M118-F156 HydrophobicContact CE-CD2 3.58Å; M118-F156 HydrophobicContact CE-CE2 3.21Å; M118-F156 HydrophobicContact CE-CZ 4.08Å; M118-F156 HydrophobicContact CG-CE2 4.09Å; M118-F156 HydrophobicContact CG-CZ 4.01Å; M118-F156 HydrophobicContact SD-CE2 4.38Å; F119-F156 AromaticContact CD1-CD1 3.81Å; F119-F156 HydrophobicContact CD1-CD1 3.81Å; F119-F156 AromaticContact CD1-CE1 3.54Å; F119-F156 HydrophobicContact CD1-CE1 3.54Å; F119-F156 HydrophobicContact CD1-CZ 4.15Å; F119-F156 AromaticContact CE1-CD1 3.72Å; F119-F156 HydrophobicContact CE1-CD1 3.72Å; F119-F156 AromaticContact CE1-CE1 3.83Å; F119-F156 HydrophobicContact CE1-CE1 3.83Å; F119-F156 HydrophobicContact CE1-CG 4.11Å; F119-F156 HydrophobicContact CE1-CZ 4.29Å; I124-F156 HydrophobicContact CD1-CE1 3.76Å; I124-F156 HydrophobicContact CD1-CZ 4.25Å; I124-F156 HydrophobicContact CG1-CE1 3.84Å; I124-F156 HydrophobicContact CG1-CZ 3.8Å; L152-F156 HydrophobicContact CD1-CD2 3.97Å; L152-F156 HydrophobicContact CD1-CE2 3.58Å; L152-F156 HydrophobicContact CG-CD2 3.99Å; L152-F156 HydrophobicContact CG-CE2 4.02Å; L152-F156 WeakPolarHBondContact O-CD2 3.41Å; L152-F156 PolarHBondContact O-N 3.32Å; L152-F156 VanDerWaalsContact O-N 3.1Å; L153-F156 CarbonylContact O-C 3.17Å; L153-F156 PolarHBondContact O-N 3.32Å; L153-F156 VanDerWaalsContact O-N 3.14Å; L154-F156 VanDerWaalsContact C-N 3.35Å; F156-E158 PolarHBondContact O-N 3.11Å; F156-H159 CarbonylContact O-C 3.57Å; F156-H159 WeakPolarHBondContact O-CA 3.35Å; F156-H159 PolarHBondContact O-N 2.95Å; F156-L160 HydrophobicContact CB-CD2 3.47Å; F156-L160 VanDerWaalsContact CB-CD2 3.47Å; F156-L160 HydrophobicContact CB-CG 4.18Å; F156-L160 WeakPolarHBondContact O-CG 3.19Å; F156-L160 PolarHBondContact O-N 3.22Å; F156-H163 HydrophobicContact CD1-CB 4.25Å; F156-H163 AromaticContact CD1-CD2 3.77Å; F156-H163 HydrophobicContact CE1-CB 4.41Å; F156-H163 AromaticContact CE1-CD2 3.74Å; F156-V167 HydrophobicContact CD1-CG2 4.46Å; F156-V167 HydrophobicContact CE1-CG2 4.43Å
157	R	72.4	Confident	79.1	Confident	135 Å²	135	42.3 Å²	42.3	51%	0.509	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-36.8	-166.4	75.4	-177	-175.1	-132.7	-10.9	115.9	L153 L154 H159 L226	L153-R157 PolarHBondContact O-N 2.88Å; L154-R157 WeakPolarHBondContact O-CB 3.37Å; L154-R157 WeakPolarHBondContact O-CG 3.3Å; R157-H159 VanDerWaalsContact C-N 3.35Å; R157-L226 HydrophobicContact CB-CD2 3.5Å
158	E	72.9	Confident	79.3	Confident	140 Å²	140	38.9 Å²	38.9	65%	0.654	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-10.2	-177	-53	-174.9	-170.4	0	0	112.4	F156	F156-E158 PolarHBondContact O-N 3.11Å
159	H	77.6	Confident	79.3	Confident	64 Å²	64	41.5 Å²	41.5	30%	0.296	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.4	8.5	-176.2	-61.2	-73.6	0	0	0	113.4	F119 F156 R157 E161 D162 H163	F119-H159 HydrophobicContact CD1-CB 4.01Å; F119-H159 AromaticContact CD2-CD2 3.82Å; F119-H159 AromaticContact CD2-NE2 3.96Å; F119-H159 HydrophobicContact CE1-CB 3.97Å; F119-H159 AromaticContact CE1-CD2 3.59Å; F119-H159 AromaticContact CE1-CG 3.99Å; F119-H159 AromaticContact CE2-CD2 3.33Å; F119-H159 WeakPolarHBondContact CE2-CD2 3.38Å; F119-H159 AromaticContact CE2-NE2 3.55Å; F119-H159 HydrophobicContact CZ-CB 4.49Å; F119-H159 AromaticContact CZ-CD2 3.22Å; F119-H159 WeakPolarHBondContact CZ-CD2 3.17Å; F119-H159 AromaticContact CZ-NE2 3.93Å; F156-H159 CarbonylContact O-C 3.57Å; F156-H159 WeakPolarHBondContact O-CA 3.35Å; F156-H159 PolarHBondContact O-N 2.95Å; R157-H159 VanDerWaalsContact C-N 3.35Å; H159-E161 PolarHBondContact O-N 2.76Å; H159-D162 PolarHBondContact O-N 3.41Å; H159-H163 PolarHBondContact O-CD2 3.24Å; H159-H163 PolarHBondContact O-N 2.79Å
160	L	73.2	Confident	79.2	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.6	-179.3	-71	174.1	0	0	0	112	L153 F156 D162 H163 F164 C168 L226 C230	L153-L160 HydrophobicContact CD2-CD2 3.72Å; F156-L160 HydrophobicContact CB-CD2 3.47Å; F156-L160 VanDerWaalsContact CB-CD2 3.47Å; F156-L160 HydrophobicContact CB-CG 4.18Å; F156-L160 WeakPolarHBondContact O-CG 3.19Å; F156-L160 PolarHBondContact O-N 3.22Å; L160-D162 VanDerWaalsContact C-N 3.28Å; L160-D162 PolarHBondContact O-N 2.93Å; L160-H163 CarbonylContact O-C 3.58Å; L160-H163 PolarHBondContact O-N 3.03Å; L160-F164 VanDerWaalsContact O-CA 3.32Å; L160-F164 WeakPolarHBondContact O-CA 3.44Å; L160-F164 PolarHBondContact O-N 2.82Å; L160-C168 VanDerWaalsContact CD2-SG 3.54Å; L160-L226 HydrophobicContact CD1-CD1 4.23Å; L160-L226 HydrophobicContact CD1-CD2 3.61Å; L160-C230 HydrophobicContact CB-CB 3.92Å; L160-C230 HydrophobicContact CD1-CB 4.48Å
161	E	70.1	Confident	79.4	Confident	60 Å²	60	42 Å²	42	28%	0.28	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-35.1	175.4	-167.2	-179.5	-162.8	0	0	112.4	H159 H163 P229 S232 K233	H159-E161 PolarHBondContact O-N 2.76Å; E161-H163 VanDerWaalsContact C-N 3.35Å; E161-P229 VanDerWaalsContact CB-O 3.28Å; E161-P229 WeakPolarHBondContact CB-O 3.4Å; E161-P229 WeakPolarHBondContact CG-O 3.37Å; E161-S232 WeakPolarHBondContact OE1-CB 3.31Å; E161-S232 PolarHBondContact OE1-OG 2.74Å; E161-S232 PolarHBondContact OE2-OG 3.46Å; E161-K233 HydrophobicContact CG-CB 4.17Å; E161-K233 HydrophobicContact CG-CD 3.71Å; E161-K233 HydrophobicContact CG-CG 3.73Å; E161-K233 WeakPolarHBondContact O-CD 3.03Å; E161-K233 PolarHBondContact O-NZ 3.19Å; E161-K233 WeakPolarHBondContact OE1-CG 3.33Å; E161-K233 PolarHBondContact OE1-N 3.01Å
162	D	77.7	Confident	79.4	Confident	95 Å²	95	40.8 Å²	40.8	51%	0.508	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-19.8	178.3	-65.3	-35.3	0	0	0	112.8	H159 L160 K233	H159-D162 PolarHBondContact O-N 3.41Å; L160-D162 VanDerWaalsContact C-N 3.28Å; L160-D162 PolarHBondContact O-N 2.93Å; D162-K233 IonicContact OD1-NZ 3.53Å; D162-K233 PolarHBondContact OD1-NZ 3Å
163	H	81.5	Confident	79.2	Confident	28 Å²	28	43 Å²	43	13%	0.13	21%	0.207	C	C	.	.	S	Bend	trans	-126.1	22.2	-172.3	-57.3	-53.7	0	0	0	113.4	F119 I124 F156 H159 L160 E161 E165 A166 V167	F119-H163 PolarHBondContact O-CE1 3.24Å; I124-H163 HydrophobicContact CD1-CB 4.38Å; I124-H163 WeakPolarHBondContact CD1-CE1 3.47Å; I124-H163 WeakPolarHBondContact CD1-ND1 3.37Å; F156-H163 HydrophobicContact CD1-CB 4.25Å; F156-H163 AromaticContact CD1-CD2 3.77Å; F156-H163 HydrophobicContact CE1-CB 4.41Å; F156-H163 AromaticContact CE1-CD2 3.74Å; H159-H163 PolarHBondContact O-CD2 3.24Å; H159-H163 PolarHBondContact O-N 2.79Å; L160-H163 CarbonylContact O-C 3.58Å; L160-H163 PolarHBondContact O-N 3.03Å; E161-H163 VanDerWaalsContact C-N 3.35Å; H163-E165 PolarHBondContact O-N 3.04Å; H163-A166 PolarHBondContact O-N 3.13Å; H163-V167 HydrophobicContact CB-CG2 4.04Å; H163-V167 WeakPolarHBondContact O-CB 3.48Å; H163-V167 PolarHBondContact O-N 2.95Å
164	F	78.3	Confident	79.1	Confident	3 Å²	3	44.4 Å²	44.4	1%	0.013	21%	0.213	C	C	.	.	I	π-helix	trans	-57.6	-51.6	-176	-176.3	-86.6	0	0	0	111.8	L160 A166 V167 C168 Y169 L172 C230 F231 T236 H240 I244	L160-F164 VanDerWaalsContact O-CA 3.32Å; L160-F164 WeakPolarHBondContact O-CA 3.44Å; L160-F164 PolarHBondContact O-N 2.82Å; F164-A166 VanDerWaalsContact C-N 3.27Å; F164-A166 PolarHBondContact O-N 2.93Å; F164-V167 PolarHBondContact O-N 3.26Å; F164-C168 HydrophobicContact CD2-CB 3.55Å; F164-C168 HydrophobicContact CE2-CB 3.74Å; F164-C168 HydrophobicContact CG-CB 4Å; F164-C168 HydrophobicContact CZ-CB 4.36Å; F164-C168 WeakPolarHBondContact O-CA 3.47Å; F164-C168 WeakPolarHBondContact O-CB 3.37Å; F164-C168 PolarHBondContact O-N 3.4Å; F164-Y169 HydrophobicContact CE1-CD2 4.49Å; F164-Y169 PolarHBondContact O-N 3.19Å; F164-L172 HydrophobicContact CZ-CD1 4.12Å; F164-C230 HydrophobicContact CD2-CB 4.17Å; F164-C230 VanDerWaalsContact CD2-O 3.32Å; F164-C230 WeakPolarHBondContact CD2-O 3.22Å; F164-F231 AromaticContact CE2-CD1 3.84Å; F164-F231 HydrophobicContact CE2-CD1 3.84Å; F164-F231 AromaticContact CE2-CE1 3.52Å; F164-F231 HydrophobicContact CE2-CE1 3.52Å; F164-F231 HydrophobicContact CZ-CD1 4.31Å; F164-F231 AromaticContact CZ-CE1 3.87Å; F164-F231 HydrophobicContact CZ-CE1 3.87Å; F164-T236 HydrophobicContact CB-CG2 3.63Å; F164-T236 HydrophobicContact CD1-CG2 3.18Å; F164-T236 HydrophobicContact CD2-CG2 4.31Å; F164-T236 HydrophobicContact CE1-CG2 3.89Å; F164-T236 HydrophobicContact CG-CG2 3.43Å; F164-T236 VanDerWaalsContact CG-CG2 3.43Å; F164-H240 HydrophobicContact CE1-CB 4.3Å; F164-H240 AromaticContact CE1-CD2 3.76Å; F164-I244 HydrophobicContact CE1-CD1 4.49Å; F164-I244 HydrophobicContact CZ-CD1 3.9Å; F164-I244 HydrophobicContact CZ-CG1 4.17Å
165	E	82	Confident	79.1	Confident	117 Å²	117	43.1 Å²	43.1	55%	0.547	21%	0.207	S	C	.	.	I	π-helix	trans	-63.1	-33.7	-178.2	-65.2	-175.7	177.9	0	0	112.5	H163 P170	H163-E165 PolarHBondContact O-N 3.04Å; E165-P170 WeakPolarHBondContact O-CD 3.42Å
166	A	85.5	Confident	78.7	Confident	44 Å²	44	42.2 Å²	42.2	36%	0.364	20%	0.202	S	C	.	.	I	π-helix	trans	-83.7	-32.7	-177	0	0	0	0	0	113.1	I124 M128 H163 F164	I124-A166 HydrophobicContact CG2-CB 3.96Å; M128-A166 WeakPolarHBondContact CE-O 3.46Å; H163-A166 PolarHBondContact O-N 3.13Å; F164-A166 VanDerWaalsContact C-N 3.27Å; F164-A166 PolarHBondContact O-N 2.93Å
167	V	85.8	Confident	78.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.22	C	C	.	.	I	π-helix	trans	-119.2	-54.4	-169	-172.5	0	0	0	0	112.4	I124 M128 L152 L153 F156 H163 F164	I124-V167 HydrophobicContact CG2-CG2 3.82Å; M128-V167 HydrophobicContact CG-CG2 4.36Å; M128-V167 HydrophobicContact SD-CB 4.25Å; M128-V167 HydrophobicContact SD-CG1 4Å; M128-V167 HydrophobicContact SD-CG2 4.03Å; L152-V167 HydrophobicContact CD2-CG1 4.01Å; L153-V167 HydrophobicContact CD2-CG1 3.7Å; L153-V167 HydrophobicContact CG-CG1 4.37Å; F156-V167 HydrophobicContact CD1-CG2 4.46Å; F156-V167 HydrophobicContact CE1-CG2 4.43Å; H163-V167 HydrophobicContact CB-CG2 4.04Å; H163-V167 WeakPolarHBondContact O-CB 3.48Å; H163-V167 PolarHBondContact O-N 2.95Å; F164-V167 PolarHBondContact O-N 3.26Å
168	C	79.6	Confident	77.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	I	π-helix	trans	-74.1	-47.1	-174.6	-62.8	0	0	0	0	112.6	L160 F164 F171 L172	L160-C168 VanDerWaalsContact CD2-SG 3.54Å; F164-C168 HydrophobicContact CD2-CB 3.55Å; F164-C168 HydrophobicContact CE2-CB 3.74Å; F164-C168 HydrophobicContact CG-CB 4Å; F164-C168 HydrophobicContact CZ-CB 4.36Å; F164-C168 WeakPolarHBondContact O-CA 3.47Å; F164-C168 WeakPolarHBondContact O-CB 3.37Å; F164-C168 PolarHBondContact O-N 3.4Å; C168-F171 WeakPolarHBondContact O-CB 3.36Å; C168-F171 PolarHBondContact O-N 2.97Å; C168-L172 WeakPolarHBondContact O-CG 2.94Å; C168-L172 PolarHBondContact O-N 3.05Å
169	Y	80.6	Confident	76.2	Confident	56 Å²	56	39.9 Å²	39.9	22%	0.22	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-47.6	-175.8	174.2	-101.2	0	0	0	112.3	F164 F171 L172 K173 H240 I243	F164-Y169 HydrophobicContact CE1-CD2 4.49Å; F164-Y169 PolarHBondContact O-N 3.19Å; Y169-F171 VanDerWaalsContact C-N 3.25Å; Y169-F171 PolarHBondContact O-N 3.33Å; Y169-L172 PolarHBondContact O-N 2.9Å; Y169-K173 HydrophobicContact CE1-CD 4.29Å; Y169-K173 WeakPolarHBondContact O-CB 3.21Å; Y169-K173 PolarHBondContact O-N 3.45Å; Y169-H240 HydrophobicContact CD2-CB 3.99Å; Y169-H240 AromaticContact CD2-CE1 3.81Å; Y169-H240 AromaticContact CD2-CG 3.55Å; Y169-H240 AromaticContact CD2-ND1 3.43Å; Y169-H240 WeakPolarHBondContact CD2-ND1 3.46Å; Y169-H240 HydrophobicContact CE2-CB 4.07Å; Y169-H240 AromaticContact CE2-CE1 3.67Å; Y169-H240 AromaticContact CE2-CG 3.64Å; Y169-H240 AromaticContact CE2-ND1 3.1Å; Y169-H240 WeakPolarHBondContact CE2-ND1 3.2Å; Y169-H240 AromaticContact CZ-CE1 3.91Å; Y169-H240 AromaticContact CZ-ND1 3.68Å; Y169-I243 HydrophobicContact CE2-CB 4.44Å; Y169-I243 HydrophobicContact CE2-CD1 3.52Å; Y169-I243 HydrophobicContact CE2-CG1 4.22Å
170	P	85.8	Confident	74.6	Confident	19 Å²	19	43 Å²	43	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-30	176.3	-18	32.3	0	0	0	112.3	W149 E165 F174	W149-P170 HydrophobicContact CH2-CB 4.06Å; W149-P170 WeakPolarHBondContact CH2-O 3.49Å; W149-P170 HydrophobicContact CZ2-CB 3.94Å; E165-P170 WeakPolarHBondContact O-CD 3.42Å; P170-F174 WeakPolarHBondContact O-CB 3.47Å; P170-F174 PolarHBondContact O-N 3.38Å
171	F	84	Confident	72.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-48.7	173.3	175.9	-101.1	0	0	0	111.7	M146 W149 W150 L153 C168 Y169 K173 F174 C175 F209	M146-F171 HydrophobicContact CG-CE2 4.12Å; M146-F171 HydrophobicContact CG-CZ 4.42Å; W149-F171 HydrophobicContact CB-CD2 4.16Å; W149-F171 HydrophobicContact CB-CE2 4.37Å; W149-F171 HydrophobicContact CD2-CB 4.2Å; W149-F171 AromaticContact CD2-CD2 3.68Å; W149-F171 HydrophobicContact CD2-CD2 3.68Å; W149-F171 HydrophobicContact CD2-CG 4.43Å; W149-F171 AromaticContact CE3-CD2 3.99Å; W149-F171 HydrophobicContact CE3-CD2 3.99Å; W149-F171 AromaticContact CG-CD2 3.73Å; W149-F171 HydrophobicContact CG-CD2 3.73Å; W149-F171 HydrophobicContact CG-CE2 4.41Å; W149-F171 HydrophobicContact CH2-CB 4.39Å; W149-F171 HydrophobicContact CZ2-CB 3.8Å; W149-F171 VanDerWaalsContact CZ2-N 3.31Å; W150-F171 HydrophobicContact CE3-CZ 4.47Å; L153-F171 HydrophobicContact CD1-CB 4.36Å; L153-F171 HydrophobicContact CD1-CD1 3.82Å; L153-F171 HydrophobicContact CD1-CD2 3.91Å; L153-F171 HydrophobicContact CD1-CE1 4.03Å; L153-F171 HydrophobicContact CD1-CE2 4.1Å; L153-F171 HydrophobicContact CD1-CG 3.76Å; L153-F171 HydrophobicContact CD1-CZ 4.16Å; C168-F171 WeakPolarHBondContact O-CB 3.36Å; C168-F171 PolarHBondContact O-N 2.97Å; Y169-F171 VanDerWaalsContact C-N 3.25Å; Y169-F171 PolarHBondContact O-N 3.33Å; F171-K173 VanDerWaalsContact C-N 3.3Å; F171-K173 PolarHBondContact O-N 3.44Å; F171-F174 WeakPolarHBondContact O-CB 3.38Å; F171-F174 PolarHBondContact O-N 3.15Å; F171-C175 VanDerWaalsContact CZ-SG 3.58Å; F171-C175 PolarHBondContact O-N 2.66Å; F171-C175 PolarHBondContact O-SG 2.94Å; F171-F209 HydrophobicContact CD1-CD1 4.21Å; F171-F209 HydrophobicContact CD1-CD2 4.4Å; F171-F209 HydrophobicContact CD1-CE1 4.02Å; F171-F209 HydrophobicContact CD1-CE2 4.25Å; F171-F209 HydrophobicContact CD1-CG 4.39Å; F171-F209 HydrophobicContact CD1-CZ 4.04Å; F171-F209 HydrophobicContact CE1-CB 4.27Å; F171-F209 AromaticContact CE1-CD1 3.85Å; F171-F209 HydrophobicContact CE1-CD1 3.85Å; F171-F209 AromaticContact CE1-CD2 3.78Å; F171-F209 HydrophobicContact CE1-CD2 3.78Å; F171-F209 HydrophobicContact CE1-CE1 4.12Å; F171-F209 HydrophobicContact CE1-CE2 4.08Å; F171-F209 AromaticContact CE1-CG 3.67Å; F171-F209 HydrophobicContact CE1-CG 3.67Å; F171-F209 HydrophobicContact CE1-CZ 4.22Å
172	L	78	Confident	70.5	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-58.6	-44.2	175.6	-69.6	176.5	0	0	0	111	F164 C168 Y169 F174 C175 L176 L206 F209 I243 I244 A247	F164-L172 HydrophobicContact CZ-CD1 4.12Å; C168-L172 WeakPolarHBondContact O-CG 2.94Å; C168-L172 PolarHBondContact O-N 3.05Å; Y169-L172 PolarHBondContact O-N 2.9Å; L172-F174 VanDerWaalsContact C-N 3.35Å; L172-F174 PolarHBondContact O-N 3.36Å; L172-C175 WeakPolarHBondContact O-CB 3.47Å; L172-C175 PolarHBondContact O-N 3.44Å; L172-C175 VanDerWaalsContact O-N 3.13Å; L172-L176 WeakPolarHBondContact O-CB 3.44Å; L172-L176 VanDerWaalsContact O-CG 3.31Å; L172-L176 WeakPolarHBondContact O-CG 3.26Å; L172-L176 PolarHBondContact O-N 2.92Å; L172-L206 HydrophobicContact CD2-CD1 3.55Å; L172-F209 HydrophobicContact CD2-CD1 4.02Å; L172-F209 HydrophobicContact CD2-CE1 3.86Å; L172-F209 HydrophobicContact CG-CE1 4.44Å; L172-I243 HydrophobicContact CB-CG2 3.92Å; L172-I244 HydrophobicContact CD1-CG1 4.35Å; L172-A247 HydrophobicContact CD2-CB 4.18Å
173	K	80.7	Confident	68.1	Low	47 Å²	47	47 Å²	47	20%	0.204	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-39.3	178.5	-154	-177	176.1	-159.6	0	112.5	Y169 F171 L176 E177 A178 E179 I243	Y169-K173 HydrophobicContact CE1-CD 4.29Å; Y169-K173 WeakPolarHBondContact O-CB 3.21Å; Y169-K173 PolarHBondContact O-N 3.45Å; F171-K173 VanDerWaalsContact C-N 3.3Å; F171-K173 PolarHBondContact O-N 3.44Å; K173-L176 PolarHBondContact O-N 3.41Å; K173-E177 PolarHBondContact O-N 2.9Å; K173-A178 HydrophobicContact CG-CB 3.76Å; K173-A178 PolarHBondContact O-N 3.44Å; K173-A178 VanDerWaalsContact O-N 3.13Å; K173-E179 HydrophobicContact CD-CG 3.43Å; K173-E179 VanDerWaalsContact CD-CG 3.43Å; K173-E179 VanDerWaalsContact CD-OE1 3.29Å; K173-E179 WeakPolarHBondContact CD-OE1 3.44Å; K173-E179 WeakPolarHBondContact CE-OE1 3.37Å; K173-E179 HydrophobicContact CG-CG 3.8Å; K173-E179 IonicContact NZ-OE1 3.59Å; K173-E179 PolarHBondContact NZ-OE1 3.21Å; K173-I243 HydrophobicContact CG-CD1 4.27Å
174	F	81	Confident	65.3	Low	31 Å²	31	50.4 Å²	50.4	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-41.8	171.6	171.2	-98.6	0	0	0	111.8	R142 K145 M146 W149 P170 F171 L172 L176 E177 M202	R142-F174 HydrophobicContact CB-CZ 4.31Å; R142-F174 HydrophobicContact CG-CZ 4.28Å; K145-F174 HydrophobicContact CD-CE2 3.97Å; K145-F174 HydrophobicContact CD-CZ 3.97Å; M146-F174 HydrophobicContact CB-CE1 4.36Å; W149-F174 HydrophobicContact CE3-CD1 4.4Å; W149-F174 HydrophobicContact CH2-CB 4.2Å; W149-F174 HydrophobicContact CZ3-CB 3.81Å; W149-F174 HydrophobicContact CZ3-CD1 4.2Å; W149-F174 HydrophobicContact CZ3-CD2 4.45Å; W149-F174 AromaticContact CZ3-CG 3.89Å; W149-F174 HydrophobicContact CZ3-CG 3.89Å; P170-F174 WeakPolarHBondContact O-CB 3.47Å; P170-F174 PolarHBondContact O-N 3.38Å; F171-F174 WeakPolarHBondContact O-CB 3.38Å; F171-F174 PolarHBondContact O-N 3.15Å; L172-F174 VanDerWaalsContact C-N 3.35Å; L172-F174 PolarHBondContact O-N 3.36Å; F174-L176 VanDerWaalsContact C-N 3.31Å; F174-L176 PolarHBondContact O-N 3.41Å; F174-E177 PolarHBondContact O-N 3.25Å; F174-M202 HydrophobicContact CE1-CE 4.34Å
175	C	74.9	Confident	63.1	Low	7 Å²	7	55.9 Å²	55.9	5%	0.047	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-33.2	178.6	-69.9	0	0	0	0	113.3	F171 L172 M202 L206	F171-C175 VanDerWaalsContact CZ-SG 3.58Å; F171-C175 PolarHBondContact O-N 2.66Å; F171-C175 PolarHBondContact O-SG 2.94Å; L172-C175 WeakPolarHBondContact O-CB 3.47Å; L172-C175 PolarHBondContact O-N 3.44Å; L172-C175 VanDerWaalsContact O-N 3.13Å; C175-M202 VanDerWaalsContact CA-CE 3.49Å; C175-M202 VanDerWaalsContact CA-SD 3.54Å; C175-M202 HydrophobicContact CB-CE 3.73Å; C175-M202 HydrophobicContact CB-SD 4.35Å; C175-M202 WeakPolarHBondContact SG-CE 3.47Å; C175-L206 HydrophobicContact CB-CD1 4.3Å
176	L	71.4	Confident	60.7	Low	36 Å²	36	53.7 Å²	53.7	19%	0.188	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	0	-179.1	-64.4	175.4	0	0	0	113.8	L172 K173 F174 A178 L206 I243 E246 A247 I250	L172-L176 WeakPolarHBondContact O-CB 3.44Å; L172-L176 VanDerWaalsContact O-CG 3.31Å; L172-L176 WeakPolarHBondContact O-CG 3.26Å; L172-L176 PolarHBondContact O-N 2.92Å; K173-L176 PolarHBondContact O-N 3.41Å; F174-L176 VanDerWaalsContact C-N 3.31Å; F174-L176 PolarHBondContact O-N 3.41Å; L176-A178 HydrophobicContact CB-CB 4.4Å; L176-A178 PolarHBondContact O-N 3.29Å; L176-L206 HydrophobicContact CD2-CD2 4.04Å; L176-I243 HydrophobicContact CD1-CG2 3.66Å; L176-E246 HydrophobicContact CD1-CB 4.24Å; L176-A247 HydrophobicContact CD1-CB 4.17Å; L176-I250 HydrophobicContact CD2-CD1 3.3Å
177	E	70.3	Confident	58	Low	83 Å²	83	58.4 Å²	58.4	39%	0.388	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	18.6	-175	-55.2	-170.8	171.5	0	0	115	R142 K173 F174 E179 N180 V199	R142-E177 IonicContact CZ-OE1 2.79Å; R142-E177 IonicContact NH1-OE1 3.37Å; R142-E177 PolarHBondContact NH1-OE1 3.18Å; R142-E177 IonicContact NH2-OE1 4Å; R142-E177 PolarHBondContact NH2-OE1 3.44Å; K173-E177 PolarHBondContact O-N 2.9Å; F174-E177 PolarHBondContact O-N 3.25Å; E177-E179 PolarHBondContact O-N 3.19Å; E177-N180 PolarHBondContact O-N 2.87Å; E177-V199 WeakPolarHBondContact OE1-CG2 3.29Å
178	A	55.5	Low	55.5	Low	40 Å²	40	65.8 Å²	65.8	33%	0.331	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	9.2	-173.2	0	0	0	0	0	114.4	K173 L176	K173-A178 HydrophobicContact CG-CB 3.76Å; K173-A178 PolarHBondContact O-N 3.44Å; K173-A178 VanDerWaalsContact O-N 3.13Å; L176-A178 HydrophobicContact CB-CB 4.4Å; L176-A178 PolarHBondContact O-N 3.29Å
179	E	47.2	Very low	53.1	Low	103 Å²	103	72.9 Å²	72.9	48%	0.481	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-9.6	178.3	-80.5	-166.9	155.5	0	0	115.7	K173 E177	K173-E179 HydrophobicContact CD-CG 3.43Å; K173-E179 VanDerWaalsContact CD-CG 3.43Å; K173-E179 VanDerWaalsContact CD-OE1 3.29Å; K173-E179 WeakPolarHBondContact CD-OE1 3.44Å; K173-E179 WeakPolarHBondContact CE-OE1 3.37Å; K173-E179 HydrophobicContact CG-CG 3.8Å; K173-E179 IonicContact NZ-OE1 3.59Å; K173-E179 PolarHBondContact NZ-OE1 3.21Å; E177-E179 PolarHBondContact O-N 3.19Å
180	N	43.3	Very low	50.6	Low	129 Å²	129	74 Å²	74	69%	0.69	47%	0.471	S	S	*	.	S	Bend	trans	-112.7	-4.5	-176.3	-64	-38.3	0	0	0	114.8	E177	E177-N180 PolarHBondContact O-N 2.87Å
181	S	29.6	Very low	47.9	Very low	78 Å²	78	76.6 Å²	76.6	55%	0.545	50%	0.502	S	S	.	.			trans	-106.6	86.6	174.8	50.2	0	0	0	0	110.7	A183	S181-A183 PolarHBondContact O-N 3Å
182	G	27.4	Very low	45.3	Very low	96 Å²	96	85.7 Å²	85.7	99%	0.99	54%	0.544	S	S	*	.			trans	-66.5	32.8	164	0	0	0	0	0	113.6
183	A	27.1	Very low	42.8	Very low	69 Å²	69	92.7 Å²	92.7	57%	0.57	58%	0.582	S	S	*	*	S	Bend	trans	-127.6	113.3	-174.9	0	0	0	0	0	109.8	S181 T185	S181-A183 PolarHBondContact O-N 3Å; A183-T185 PolarHBondContact O-N 3.06Å
184	S	24.2	Very low	40.4	Very low	99 Å²	99	98.1 Å²	98.1	69%	0.692	61%	0.613	S	S	*	*			trans	-20.8	113.4	155.9	166.4	0	0	0	0	113.1	A186	S184-A186 PolarHBondContact O-N 3.37Å; S184-A186 WeakPolarHBondContact OG-CB 3.48Å; S184-A186 PolarHBondContact OG-N 3.14Å
185	T	31.7	Very low	38	Very low	119 Å²	119	106 Å²	106	73%	0.73	65%	0.65	S	S	*	*			trans	-85.4	33.2	166.8	43.9	0	0	0	0	112.2	A183 D187	A183-T185 PolarHBondContact O-N 3.06Å; T185-D187 VanDerWaalsContact C-N 3.31Å; T185-D187 PolarHBondContact O-N 3.07Å
186	A	31	Very low	35.8	Very low	71 Å²	71	113.8 Å²	113.8	59%	0.587	69%	0.686	S	S	*	*			trans	-82.1	82.1	150.1	0	0	0	0	0	108	S184	S184-A186 PolarHBondContact O-N 3.37Å; S184-A186 WeakPolarHBondContact OG-CB 3.48Å; S184-A186 PolarHBondContact OG-N 3.14Å
187	D	28.7	Very low	33.9	Very low	142 Å²	142	118.7 Å²	118.7	76%	0.759	72%	0.717	S	S	*	*			trans	-179.8	76.3	153.3	-95	-23.3	0	0	0	109.6	T185 N189	T185-D187 VanDerWaalsContact C-N 3.31Å; T185-D187 PolarHBondContact O-N 3.07Å; D187-N189 PolarHBondContact O-N 3.1Å; D187-N189 VanDerWaalsContact O-N 3.12Å
188	L	33.8	Very low	32.2	Very low	156 Å²	156	119.7 Å²	119.7	82%	0.817	73%	0.729	S	S	*	*			trans	-83.4	55.3	165.2	-74.3	168.9	0	0	0	109.9
189	N	28.5	Very low	31.6	Very low	148 Å²	148	119.6 Å²	119.6	79%	0.791	72%	0.724	S	S	*	*			trans	-140.4	81.3	175.9	-82.4	-31.2	0	0	0	110.3	D187	D187-N189 PolarHBondContact O-N 3.1Å; D187-N189 VanDerWaalsContact O-N 3.12Å
190	G	30.2	Very low	31.6	Very low	80 Å²	80	120.1 Å²	120.1	83%	0.825	73%	0.73	S	S	*	*			trans	172.4	116.2	170.4	0	0	0	0	0	108
191	G	27.9	Very low	32.1	Very low	74 Å²	74	117.9 Å²	117.9	76%	0.763	71%	0.713	S	S	*	*				108.3	102.4	51.7	0	0	0	0	0	105.4	N193	G191-N193 PolarHBondContact O-N 2.98Å; G191-N193 VanDerWaalsContact O-N 3.14Å
192	E	28.5	Very low	33.5	Very low	191 Å²	191	114.8 Å²	114.8	89%	0.893	69%	0.69	S	S	*	*	S	Bend	trans	-49.3	114.6	179.7	-65.7	170.4	154.9	0	0	110.9
193	N	27.2	Very low	34.9	Very low	147 Å²	147	111.7 Å²	111.7	79%	0.786	65%	0.652	S	S	*	*			trans	143.2	101.6	154.2	-74.4	-24.9	0	0	0	109.5	G191	G191-N193 PolarHBondContact O-N 2.98Å; G191-N193 VanDerWaalsContact O-N 3.14Å
194	D	29.7	Very low	36.2	Very low	162 Å²	162	111.4 Å²	111.4	87%	0.866	64%	0.639	S	S	*	*				177.5	142.5	123.2	-88.9	-21.6	0	0	0	110.8	E196	D194-E196 VanDerWaalsContact C-N 3.34Å; D194-E196 PolarHBondContact O-N 3.22Å
195	Q	30.1	Very low	37.7	Very low	196 Å²	196	106.7 Å²	106.7	92%	0.916	61%	0.606	S	S	*	*			trans	-66.8	84.8	179	-70.6	169.8	-36.6	0	0	110.4
196	E	29.8	Very low	39.2	Very low	171 Å²	171	101.1 Å²	101.1	80%	0.799	57%	0.572	S	S	*	*			trans	-95.6	122.2	160.9	-98.7	-177.4	162.9	0	0	109.4	D194 T198	D194-E196 VanDerWaalsContact C-N 3.34Å; D194-E196 PolarHBondContact O-N 3.22Å; E196-T198 PolarHBondContact O-N 2.79Å
197	V	29.7	Very low	40.5	Very low	138 Å²	138	98.3 Å²	98.3	84%	0.836	55%	0.549	S	S	*	.			trans	-65.3	77.9	-178.2	-179.5	0	0	0	0	108.9	V199	V197-V199 PolarHBondContact O-N 3.46Å
198	T	35.5	Very low	41.7	Very low	105 Å²	105	92 Å²	92	64%	0.644	52%	0.515	S	S	*	.			trans	-66.2	126.4	170	44.1	0	0	0	0	108.4	E196 D200	E196-T198 PolarHBondContact O-N 2.79Å; T198-D200 VanDerWaalsContact C-N 3.35Å; T198-D200 PolarHBondContact O-N 3.46Å
199	V	42.7	Very low	42.8	Very low	38 Å²	38	85 Å²	85	23%	0.23	48%	0.478	C	S	.	.			trans	-67.8	93	-179.7	-176.6	0	0	0	0	109.2	R142 E177 V197 Y201 M202 P203	R142-V199 VanDerWaalsContact NH1-CG2 3.31Å; E177-V199 WeakPolarHBondContact OE1-CG2 3.29Å; V197-V199 PolarHBondContact O-N 3.46Å; V199-Y201 PolarHBondContact O-N 3.28Å; V199-M202 HydrophobicContact CB-CB 4.45Å; V199-M202 HydrophobicContact CB-CG 3.66Å; V199-M202 HydrophobicContact CG1-CB 4.25Å; V199-M202 HydrophobicContact CG1-CG 3.25Å; V199-M202 HydrophobicContact CG1-SD 4.42Å; V199-M202 HydrophobicContact CG2-CG 4.45Å; V199-M202 PolarHBondContact O-N 3.37Å; V199-M202 VanDerWaalsContact O-N 3.17Å; V199-P203 WeakPolarHBondContact O-CD 3.49Å
200	D	47.6	Very low	44.2	Very low	114 Å²	114	78.9 Å²	78.9	61%	0.61	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-13.4	-174.9	-71.8	-29.8	0	0	0	115.2	T198	T198-D200 VanDerWaalsContact C-N 3.35Å; T198-D200 PolarHBondContact O-N 3.46Å
201	Y	52.6	Low	45.1	Very low	81 Å²	81	75.7 Å²	75.7	32%	0.318	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-15.7	-173	-75.6	-103.2	0	0	0	114.6	V199 P203 E204 V205 F218	V199-Y201 PolarHBondContact O-N 3.28Å; Y201-P203 VanDerWaalsContact C-CD 3.49Å; Y201-E204 WeakPolarHBondContact CD1-OE2 3.48Å; Y201-E204 PolarHBondContact O-N 3.39Å; Y201-V205 VanDerWaalsContact O-CG2 3.28Å; Y201-V205 WeakPolarHBondContact O-CG2 3.37Å; Y201-V205 PolarHBondContact O-N 2.85Å; Y201-V205 VanDerWaalsContact O-N 3.13Å; Y201-F218 AromaticContact CD1-CE1 3.56Å; Y201-F218 HydrophobicContact CD1-CE1 3.56Å; Y201-F218 AromaticContact CD1-CZ 3.39Å; Y201-F218 HydrophobicContact CD1-CZ 3.39Å; Y201-F218 AromaticContact CE1-CE1 3.78Å; Y201-F218 HydrophobicContact CE1-CE1 3.78Å; Y201-F218 AromaticContact CE1-CZ 3.56Å; Y201-F218 HydrophobicContact CE1-CZ 3.56Å
202	M	60.3	Low	46	Very low	14 Å²	14	75.9 Å²	75.9	7%	0.069	40%	0.395	C	S	.	.	H	α-helix	trans	-63.1	-39.9	178.1	-64.1	-119.4	65.1	0	0	112.3	R142 M146 F174 C175 V199 E204 V205 L206	R142-M202 PolarHBondContact NH2-SD 3.16Å; M146-M202 HydrophobicContact CG-CE 4.46Å; M146-M202 HydrophobicContact SD-CE 3.54Å; M146-M202 VanDerWaalsContact SD-CE 3.54Å; F174-M202 HydrophobicContact CE1-CE 4.34Å; C175-M202 VanDerWaalsContact CA-CE 3.49Å; C175-M202 VanDerWaalsContact CA-SD 3.54Å; C175-M202 HydrophobicContact CB-CE 3.73Å; C175-M202 HydrophobicContact CB-SD 4.35Å; C175-M202 WeakPolarHBondContact SG-CE 3.47Å; V199-M202 HydrophobicContact CB-CB 4.45Å; V199-M202 HydrophobicContact CB-CG 3.66Å; V199-M202 HydrophobicContact CG1-CB 4.25Å; V199-M202 HydrophobicContact CG1-CG 3.25Å; V199-M202 HydrophobicContact CG1-SD 4.42Å; V199-M202 HydrophobicContact CG2-CG 4.45Å; V199-M202 PolarHBondContact O-N 3.37Å; V199-M202 VanDerWaalsContact O-N 3.17Å; M202-E204 VanDerWaalsContact C-N 3.3Å; M202-E204 PolarHBondContact O-N 3.23Å; M202-V205 PolarHBondContact O-N 3.11Å; M202-L206 WeakPolarHBondContact O-CB 3.41Å; M202-L206 PolarHBondContact O-N 2.76Å
203	P	56.7	Low	46.4	Very low	30 Å²	30	72.3 Å²	72.3	20%	0.195	38%	0.382	C	S	.	.	H	α-helix	trans	-57.2	-42.1	174.9	-28.4	38.8	0	0	0	112.7	V199 Y201 L206 A207 I250 L254	V199-P203 WeakPolarHBondContact O-CD 3.49Å; Y201-P203 VanDerWaalsContact C-CD 3.49Å; P203-L206 PolarHBondContact O-N 3.28Å; P203-A207 VanDerWaalsContact O-CB 3.29Å; P203-A207 WeakPolarHBondContact O-CB 3.39Å; P203-A207 PolarHBondContact O-N 2.88Å; P203-I250 HydrophobicContact CB-CG2 3.37Å; P203-I250 HydrophobicContact CG-CG2 3.49Å; P203-I250 VanDerWaalsContact CG-CG2 3.49Å; P203-L254 HydrophobicContact CB-CD1 3.22Å; P203-L254 HydrophobicContact CB-CD2 4.29Å; P203-L254 HydrophobicContact CB-CG 4.11Å; P203-L254 VanDerWaalsContact O-CD1 3.26Å; P203-L254 WeakPolarHBondContact O-CD1 3.33Å
204	E	53.4	Low	46.7	Very low	63 Å²	63	66.9 Å²	66.9	29%	0.294	36%	0.355	S	S	.	.	H	α-helix	trans	-72.1	-33	-178	-61	173.2	153.5	0	0	112	Y201 M202 A207 N208 F218 L254	Y201-E204 WeakPolarHBondContact CD1-OE2 3.48Å; Y201-E204 PolarHBondContact O-N 3.39Å; M202-E204 VanDerWaalsContact C-N 3.3Å; M202-E204 PolarHBondContact O-N 3.23Å; E204-A207 WeakPolarHBondContact O-CB 3.43Å; E204-A207 PolarHBondContact O-N 3.18Å; E204-N208 PolarHBondContact O-N 3.43Å; E204-N208 PolarHBondContact O-ND2 3.35Å; E204-F218 HydrophobicContact CB-CE2 4.28Å; E204-F218 VanDerWaalsContact OE2-CZ 3.3Å; E204-F218 WeakPolarHBondContact OE2-CZ 3.24Å; E204-L254 HydrophobicContact CB-CD1 4.47Å; E204-L254 HydrophobicContact CG-CD1 3.97Å
205	V	56.5	Low	47	Very low	1 Å²	1	61.4 Å²	61.4	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-73.4	-39.9	174.4	177.8	0	0	0	0	110.6	M146 Y201 M202 A207 N208 F209	M146-V205 HydrophobicContact CE-CB 3.86Å; M146-V205 HydrophobicContact CE-CG1 3.57Å; M146-V205 HydrophobicContact CE-CG2 3.18Å; M146-V205 HydrophobicContact CG-CG1 4.01Å; M146-V205 HydrophobicContact SD-CB 3.81Å; M146-V205 HydrophobicContact SD-CG1 3.5Å; M146-V205 WeakPolarHBondContact SD-CG1 3.41Å; M146-V205 HydrophobicContact SD-CG2 3.7Å; Y201-V205 VanDerWaalsContact O-CG2 3.28Å; Y201-V205 WeakPolarHBondContact O-CG2 3.37Å; Y201-V205 PolarHBondContact O-N 2.85Å; Y201-V205 VanDerWaalsContact O-N 3.13Å; M202-V205 PolarHBondContact O-N 3.11Å; V205-A207 PolarHBondContact O-N 2.99Å; V205-N208 CarbonylContact O-C 3.6Å; V205-N208 WeakPolarHBondContact O-CA 3.25Å; V205-N208 WeakPolarHBondContact O-CB 3.12Å; V205-N208 PolarHBondContact O-N 3.41Å; V205-N208 VanDerWaalsContact O-N 3.11Å; V205-F209 WeakPolarHBondContact O-CB 3.33Å; V205-F209 PolarHBondContact O-N 3.07Å
206	L	62.7	Low	47.3	Very low	2 Å²	2	56.1 Å²	56.1	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-35.4	173.7	-165.4	62.1	0	0	0	110.5	L172 C175 L176 M202 P203 F209 L210 A247 I250 V251	L172-L206 HydrophobicContact CD2-CD1 3.55Å; C175-L206 HydrophobicContact CB-CD1 4.3Å; L176-L206 HydrophobicContact CD2-CD2 4.04Å; M202-L206 WeakPolarHBondContact O-CB 3.41Å; M202-L206 PolarHBondContact O-N 2.76Å; P203-L206 PolarHBondContact O-N 3.28Å; L206-F209 HydrophobicContact CD1-CD1 4.3Å; L206-F209 WeakPolarHBondContact O-CB 3.49Å; L206-F209 PolarHBondContact O-N 3.35Å; L206-L210 HydrophobicContact CD1-CD1 4.14Å; L206-L210 HydrophobicContact CD1-CG 4.39Å; L206-L210 HydrophobicContact CG-CD1 3.85Å; L206-L210 HydrophobicContact CG-CG 4.43Å; L206-L210 WeakPolarHBondContact O-CB 3.49Å; L206-L210 VanDerWaalsContact O-CG 3.24Å; L206-L210 WeakPolarHBondContact O-CG 3.29Å; L206-L210 PolarHBondContact O-N 3.12Å; L206-A247 HydrophobicContact CD1-CB 4.14Å; L206-A247 HydrophobicContact CD2-CB 3.59Å; L206-A247 WeakPolarHBondContact CD2-O 3.1Å; L206-A247 HydrophobicContact CG-CB 4.12Å; L206-I250 HydrophobicContact CD2-CG2 4.5Å; L206-V251 HydrophobicContact CB-CG2 3.8Å; L206-V251 HydrophobicContact CD2-CG2 4.12Å; L206-V251 HydrophobicContact CG-CG2 3.8Å
207	A	57.9	Low	47.7	Very low	11 Å²	11	55.7 Å²	55.7	9%	0.091	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-46.6	169.3	0	0	0	0	0	110.1	P203 E204 V205 F209 L210 L211 V251 L254	P203-A207 VanDerWaalsContact O-CB 3.29Å; P203-A207 WeakPolarHBondContact O-CB 3.39Å; P203-A207 PolarHBondContact O-N 2.88Å; E204-A207 WeakPolarHBondContact O-CB 3.43Å; E204-A207 PolarHBondContact O-N 3.18Å; V205-A207 PolarHBondContact O-N 2.99Å; A207-F209 PolarHBondContact O-N 3.28Å; A207-L210 PolarHBondContact O-N 3.14Å; A207-L211 HydrophobicContact CB-CD1 3.92Å; A207-L211 WeakPolarHBondContact O-CA 3.44Å; A207-L211 WeakPolarHBondContact O-CB 3.48Å; A207-L211 WeakPolarHBondContact O-CD1 3.31Å; A207-L211 WeakPolarHBondContact O-CG 3.32Å; A207-L211 PolarHBondContact O-N 2.83Å; A207-V251 HydrophobicContact CB-CB 4.33Å; A207-V251 HydrophobicContact CB-CG1 3.63Å; A207-V251 HydrophobicContact CB-CG2 3.96Å; A207-V251 VanDerWaalsContact N-CG2 3.27Å; A207-L254 HydrophobicContact CB-CD1 4.32Å
208	N	55.1	Low	48.2	Very low	10 Å²	10	51.3 Å²	51.3	5%	0.053	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-34	174.4	-64	-28.9	0	0	0	112.2	W150 E204 V205 L211 P214	W150-N208 HydrophobicContact CH2-CB 4.32Å; W150-N208 WeakPolarHBondContact CH2-O 3.32Å; E204-N208 PolarHBondContact O-N 3.43Å; E204-N208 PolarHBondContact O-ND2 3.35Å; V205-N208 CarbonylContact O-C 3.6Å; V205-N208 WeakPolarHBondContact O-CA 3.25Å; V205-N208 WeakPolarHBondContact O-CB 3.12Å; V205-N208 PolarHBondContact O-N 3.41Å; V205-N208 VanDerWaalsContact O-N 3.11Å; N208-L211 VanDerWaalsContact O-O 3.13Å; N208-P214 HydrophobicContact CB-CB 4.33Å; N208-P214 WeakPolarHBondContact OD1-CA 3.47Å; N208-P214 VanDerWaalsContact OD1-CB 3.25Å; N208-P214 WeakPolarHBondContact OD1-CB 3.48Å
209	F	57.3	Low	48.6	Very low	8 Å²	8	53.3 Å²	53.3	4%	0.035	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-50.4	178.8	-174.5	-120.7	0	0	0	112.8	W150 L153 F171 L172 V205 L206 A207 L211 L226	W150-F209 HydrophobicContact CE3-CD2 4.06Å; W150-F209 HydrophobicContact CH2-CB 4.17Å; W150-F209 HydrophobicContact CH2-CD2 4.23Å; W150-F209 HydrophobicContact CZ3-CB 3.56Å; W150-F209 AromaticContact CZ3-CD2 3.51Å; W150-F209 HydrophobicContact CZ3-CD2 3.51Å; W150-F209 AromaticContact CZ3-CG 4Å; W150-F209 HydrophobicContact CZ3-CG 4Å; L153-F209 HydrophobicContact CB-CE2 4.35Å; L153-F209 HydrophobicContact CD1-CD2 4.19Å; L153-F209 HydrophobicContact CD1-CE2 3.56Å; L153-F209 HydrophobicContact CD1-CZ 4.18Å; L153-F209 HydrophobicContact CD2-CE2 4.1Å; L153-F209 HydrophobicContact CD2-CZ 4.22Å; L153-F209 HydrophobicContact CG-CE2 4.21Å; F171-F209 HydrophobicContact CD1-CD1 4.21Å; F171-F209 HydrophobicContact CD1-CD2 4.4Å; F171-F209 HydrophobicContact CD1-CE1 4.02Å; F171-F209 HydrophobicContact CD1-CE2 4.25Å; F171-F209 HydrophobicContact CD1-CG 4.39Å; F171-F209 HydrophobicContact CD1-CZ 4.04Å; F171-F209 HydrophobicContact CE1-CB 4.27Å; F171-F209 AromaticContact CE1-CD1 3.85Å; F171-F209 HydrophobicContact CE1-CD1 3.85Å; F171-F209 AromaticContact CE1-CD2 3.78Å; F171-F209 HydrophobicContact CE1-CD2 3.78Å; F171-F209 HydrophobicContact CE1-CE1 4.12Å; F171-F209 HydrophobicContact CE1-CE2 4.08Å; F171-F209 AromaticContact CE1-CG 3.67Å; F171-F209 HydrophobicContact CE1-CG 3.67Å; F171-F209 HydrophobicContact CE1-CZ 4.22Å; L172-F209 HydrophobicContact CD2-CD1 4.02Å; L172-F209 HydrophobicContact CD2-CE1 3.86Å; L172-F209 HydrophobicContact CG-CE1 4.44Å; V205-F209 WeakPolarHBondContact O-CB 3.33Å; V205-F209 PolarHBondContact O-N 3.07Å; L206-F209 HydrophobicContact CD1-CD1 4.3Å; L206-F209 WeakPolarHBondContact O-CB 3.49Å; L206-F209 PolarHBondContact O-N 3.35Å; A207-F209 PolarHBondContact O-N 3.28Å; F209-L211 VanDerWaalsContact C-N 3.31Å; F209-L226 HydrophobicContact CE2-CD1 4.23Å
210	L	56.5	Low	48.6	Very low	21 Å²	21	52.9 Å²	52.9	11%	0.11	30%	0.297	C	S	.	.	H	α-helix	trans	-83.3	-16.7	-173.6	-62.4	173.8	0	0	0	110.7	L206 A207 F231 A247 L248 V251	L206-L210 HydrophobicContact CD1-CD1 4.14Å; L206-L210 HydrophobicContact CD1-CG 4.39Å; L206-L210 HydrophobicContact CG-CD1 3.85Å; L206-L210 HydrophobicContact CG-CG 4.43Å; L206-L210 WeakPolarHBondContact O-CB 3.49Å; L206-L210 VanDerWaalsContact O-CG 3.24Å; L206-L210 WeakPolarHBondContact O-CG 3.29Å; L206-L210 PolarHBondContact O-N 3.12Å; A207-L210 PolarHBondContact O-N 3.14Å; L210-F231 HydrophobicContact CD2-CE2 3.96Å; L210-F231 HydrophobicContact CD2-CZ 3.88Å; L210-A247 HydrophobicContact CD1-CB 4.06Å; L210-L248 HydrophobicContact CB-CD2 4.42Å; L210-L248 HydrophobicContact CD1-CD2 3.78Å; L210-L248 HydrophobicContact CD1-CG 4.16Å; L210-V251 HydrophobicContact CD1-CG2 4.15Å
211	L	50.3	Low	48.2	Very low	13 Å²	13	50.2 Å²	50.2	7%	0.068	29%	0.286	C	S	.	.	S	Bend	trans	-131.6	142.6	-162.7	-38.4	175.7	0	0	0	115	A207 N208 F209 N213 V251 F262	A207-L211 HydrophobicContact CB-CD1 3.92Å; A207-L211 WeakPolarHBondContact O-CA 3.44Å; A207-L211 WeakPolarHBondContact O-CB 3.48Å; A207-L211 WeakPolarHBondContact O-CD1 3.31Å; A207-L211 WeakPolarHBondContact O-CG 3.32Å; A207-L211 PolarHBondContact O-N 2.83Å; N208-L211 VanDerWaalsContact O-O 3.13Å; F209-L211 VanDerWaalsContact C-N 3.31Å; L211-N213 PolarHBondContact O-N 2.96Å; L211-V251 HydrophobicContact CD1-CG1 3.34Å; L211-V251 HydrophobicContact CD2-CG1 4.14Å; L211-V251 HydrophobicContact CG-CG1 3.96Å; L211-F262 HydrophobicContact CB-CD2 3.6Å; L211-F262 HydrophobicContact CB-CE2 3.32Å; L211-F262 HydrophobicContact CB-CZ 3.88Å; L211-F262 HydrophobicContact CD1-CD1 3.66Å; L211-F262 HydrophobicContact CD1-CD2 3.83Å; L211-F262 HydrophobicContact CD1-CE1 3.04Å; L211-F262 HydrophobicContact CD1-CE2 3.34Å; L211-F262 HydrophobicContact CD1-CG 4.08Å; L211-F262 HydrophobicContact CD1-CZ 2.95Å; L211-F262 HydrophobicContact CD2-CD2 4.14Å; L211-F262 HydrophobicContact CD2-CE1 3.93Å; L211-F262 HydrophobicContact CD2-CE2 2.99Å; L211-F262 HydrophobicContact CD2-CZ 2.88Å; L211-F262 HydrophobicContact CG-CD2 3.96Å; L211-F262 HydrophobicContact CG-CE1 3.91Å; L211-F262 HydrophobicContact CG-CE2 3.23Å; L211-F262 HydrophobicContact CG-CZ 3.23Å
212	V	45.1	Very low	47.5	Very low	77 Å²	77	57.5 Å²	57.5	47%	0.467	31%	0.313	S	S	.	.	S	Bend	trans	-59.8	-11.8	-169.4	-177.2	0	0	0	0	116.1	P225	V212-P225 HydrophobicContact CB-CB 4.02Å; V212-P225 HydrophobicContact CG1-CB 3.67Å; V212-P225 HydrophobicContact CG1-CG 3.84Å; V212-P225 HydrophobicContact CG2-CB 3.57Å
213	N	36.8	Very low	46.3	Very low	117 Å²	117	58 Å²	58	63%	0.626	32%	0.315	S	S	*	.			trans	-148.6	91.7	-165.5	-147.5	-3.6	0	0	0	112.4	L211 S215	L211-N213 PolarHBondContact O-N 2.96Å; N213-S215 PolarHBondContact O-N 3.33Å
214	P	34.2	Very low	45.2	Very low	33 Å²	33	60.1 Å²	60.1	21%	0.214	34%	0.336	C	S	.	.			trans	-65	133.8	178.1	24.6	-31.5	0	0	0	111	N208	N208-P214 HydrophobicContact CB-CB 4.33Å; N208-P214 WeakPolarHBondContact OD1-CA 3.47Å; N208-P214 VanDerWaalsContact OD1-CB 3.25Å; N208-P214 WeakPolarHBondContact OD1-CB 3.48Å
215	S	36.9	Very low	44.5	Very low	47 Å²	47	60.5 Å²	60.5	33%	0.329	34%	0.344	S	S	.	.			trans	-53.4	141.9	166.9	61.2	0	0	0	0	108.8	N213 H217	N213-S215 PolarHBondContact O-N 3.33Å; S215-H217 PolarHBondContact O-N 3.25Å
216	G	35.7	Very low	43.8	Very low	85 Å²	85	61.8 Å²	61.8	88%	0.876	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	13.8	-175.8	0	0	0	0	0	115.4
217	H	39.1	Very low	42.9	Very low	161 Å²	161	64.6 Å²	64.6	75%	0.745	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-5.6	-174.2	-67.3	-47.6	0	0	0	114.1	S215	S215-H217 PolarHBondContact O-N 3.25Å
218	F	39	Very low	42.4	Very low	47 Å²	47	67 Å²	67	21%	0.206	39%	0.388	C	S	.	.			trans	-130.7	134.6	179.8	-60.1	-84.1	0	0	0	114.4	Y201 E204 F220	Y201-F218 AromaticContact CD1-CE1 3.56Å; Y201-F218 HydrophobicContact CD1-CE1 3.56Å; Y201-F218 AromaticContact CD1-CZ 3.39Å; Y201-F218 HydrophobicContact CD1-CZ 3.39Å; Y201-F218 AromaticContact CE1-CE1 3.78Å; Y201-F218 HydrophobicContact CE1-CE1 3.78Å; Y201-F218 AromaticContact CE1-CZ 3.56Å; Y201-F218 HydrophobicContact CE1-CZ 3.56Å; E204-F218 HydrophobicContact CB-CE2 4.28Å; E204-F218 VanDerWaalsContact OE2-CZ 3.3Å; E204-F218 WeakPolarHBondContact OE2-CZ 3.24Å; F218-F220 HydrophobicContact CB-CD2 3.82Å; F218-F220 HydrophobicContact CG-CD2 4.49Å; F218-F220 PolarHBondContact O-N 3.44Å
219	D	44	Very low	41.9	Very low	147 Å²	147	69.1 Å²	69.1	79%	0.786	40%	0.402	S	S	*	.			trans	-74.7	46.9	168.8	-80.5	-28.5	0	0	0	111.9
220	F	41.9	Very low	41.7	Very low	29 Å²	29	69.4 Å²	69.4	13%	0.127	40%	0.404	C	S	.	.	S	Bend	trans	-87.6	141.5	164	-83.5	-87.7	0	0	0	109.1	M146 K147 W150 F218 R222	M146-F220 HydrophobicContact CE-CE2 4.03Å; M146-F220 HydrophobicContact CE-CZ 3.54Å; K147-F220 HydrophobicContact CB-CE1 3.93Å; K147-F220 HydrophobicContact CB-CZ 4.11Å; K147-F220 HydrophobicContact CG-CE1 4.03Å; K147-F220 HydrophobicContact CG-CZ 4.48Å; W150-F220 HydrophobicContact CB-CD1 4.36Å; W150-F220 HydrophobicContact CB-CE1 4.05Å; W150-F220 AromaticContact CD1-CD1 3.83Å; W150-F220 HydrophobicContact CD2-CD1 4.16Å; W150-F220 HydrophobicContact CD2-CE1 4.43Å; W150-F220 AromaticContact CG-CD1 3.87Å; W150-F220 HydrophobicContact CG-CD1 3.87Å; W150-F220 HydrophobicContact CG-CE1 4.02Å; F218-F220 HydrophobicContact CB-CD2 3.82Å; F218-F220 HydrophobicContact CG-CD2 4.49Å; F218-F220 PolarHBondContact O-N 3.44Å; F220-R222 PolarHBondContact O-N 3.46Å
221	P	41	Very low	41.8	Very low	58 Å²	58	69.5 Å²	69.5	38%	0.377	40%	0.404	S	S	.	.			trans	-55	127.3	173.7	-18.8	29.2	0	0	0	109.6	L154 L223	L154-P221 HydrophobicContact CD1-CB 4.19Å; L154-P221 HydrophobicContact CD1-CG 4.21Å; P221-L223 PolarHBondContact O-N 3.46Å
222	R	36.3	Very low	41.8	Very low	233 Å²	233	71.6 Å²	71.6	88%	0.879	42%	0.42	S	S	*	.			trans	-55.9	110.6	177.3	-70.2	-178.5	-179.6	-175.3	-1.6	109.1	F220 A224	F220-R222 PolarHBondContact O-N 3.46Å; R222-A224 PolarHBondContact O-N 2.74Å
223	L	36.1	Very low	42.6	Very low	24 Å²	24	71 Å²	71	13%	0.126	41%	0.411	C	S	.	.			trans	-70.3	124.1	165.7	-96.1	175.8	0	0	0	108.2	W150 L154 P221 L226	W150-L223 HydrophobicContact CH2-CD1 3.54Å; W150-L223 HydrophobicContact CZ2-CD1 3.14Å; W150-L223 HydrophobicContact CZ2-CG 3.81Å; L154-L223 HydrophobicContact CD2-CD1 3.85Å; L154-L223 HydrophobicContact CD2-CD2 3.08Å; L154-L223 HydrophobicContact CD2-CG 3.39Å; P221-L223 PolarHBondContact O-N 3.46Å; L223-L226 HydrophobicContact CD1-CD1 3.76Å; L223-L226 HydrophobicContact CD1-CG 4.04Å; L223-L226 HydrophobicContact CD2-CG 4.19Å
224	A	34.4	Very low	43.6	Very low	76 Å²	76	69 Å²	69	63%	0.628	40%	0.403	S	S	*	.			trans	-55.4	143	142.6	0	0	0	0	0	106.4	R222 L226	R222-A224 PolarHBondContact O-N 2.74Å; A224-L226 PolarHBondContact O-N 2.93Å
225	P	38.4	Very low	44.9	Very low	71 Å²	71	70.5 Å²	70.5	46%	0.461	41%	0.414	S	S	.	.			trans	-41.9	117	-176.7	14	-26.6	0	0	0	108.9	V212 A227	V212-P225 HydrophobicContact CB-CB 4.02Å; V212-P225 HydrophobicContact CG1-CB 3.67Å; V212-P225 HydrophobicContact CG1-CG 3.84Å; V212-P225 HydrophobicContact CG2-CB 3.57Å; P225-A227 PolarHBondContact O-N 2.93Å
226	L	41.8	Very low	46.1	Very low	27 Å²	27	68.9 Å²	68.9	14%	0.141	40%	0.402	C	S	.	.			trans	-56.3	103.8	148.5	-84.3	167.6	0	0	0	101.3	R157 L160 F209 L223 A224	R157-L226 HydrophobicContact CB-CD2 3.5Å; L160-L226 HydrophobicContact CD1-CD1 4.23Å; L160-L226 HydrophobicContact CD1-CD2 3.61Å; F209-L226 HydrophobicContact CE2-CD1 4.23Å; L223-L226 HydrophobicContact CD1-CD1 3.76Å; L223-L226 HydrophobicContact CD1-CG 4.04Å; L223-L226 HydrophobicContact CD2-CG 4.19Å; A224-L226 PolarHBondContact O-N 2.93Å
227	A	42.3	Very low	47.3	Very low	62 Å²	62	64.9 Å²	64.9	51%	0.512	36%	0.361	S	S	.	.			trans	-51.6	166.9	165.1	0	0	0	0	0	105.4	P225 P229	P225-A227 PolarHBondContact O-N 2.93Å; A227-P229 HydrophobicContact CB-CG 4.28Å; A227-P229 WeakPolarHBondContact O-CD 3.39Å; A227-P229 VanDerWaalsContact O-N 3.09Å
228	V	47.7	Very low	48.4	Very low	62 Å²	62	57.2 Å²	57.2	38%	0.376	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-80.7	31.9	178	179.6	0	0	0	0	112	C230 F231 T269	V228-C230 PolarHBondContact O-N 3.28Å; V228-F231 HydrophobicContact CG1-CB 3.7Å; V228-F231 HydrophobicContact CG1-CD2 3.51Å; V228-F231 HydrophobicContact CG1-CG 4.07Å; V228-F231 PolarHBondContact O-N 3.44Å; V228-T269 HydrophobicContact CG1-CG2 3.86Å
229	P	45	Very low	49.6	Very low	54 Å²	54	58.5 Å²	58.5	35%	0.351	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-70.1	-11.5	172.7	22.8	-33	0	0	0	114.7	E161 A227 F231 S232	E161-P229 VanDerWaalsContact CB-O 3.28Å; E161-P229 WeakPolarHBondContact CB-O 3.4Å; E161-P229 WeakPolarHBondContact CG-O 3.37Å; A227-P229 HydrophobicContact CB-CG 4.28Å; A227-P229 WeakPolarHBondContact O-CD 3.39Å; A227-P229 VanDerWaalsContact O-N 3.09Å; P229-F231 PolarHBondContact O-N 3.36Å; P229-S232 WeakPolarHBondContact CA-OG 3.39Å; P229-S232 PolarHBondContact O-N 2.87Å; P229-S232 PolarHBondContact O-OG 3.24Å
230	C	52.3	Low	50.9	Low	13 Å²	13	52.7 Å²	52.7	9%	0.088	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-67	-20.5	171.4	65.5	0	0	0	0	112.6	L160 F164 V228	L160-C230 HydrophobicContact CB-CB 3.92Å; L160-C230 HydrophobicContact CD1-CB 4.48Å; F164-C230 HydrophobicContact CD2-CB 4.17Å; F164-C230 VanDerWaalsContact CD2-O 3.32Å; F164-C230 WeakPolarHBondContact CD2-O 3.22Å; V228-C230 PolarHBondContact O-N 3.28Å
231	F	58.3	Low	52	Low	23 Å²	23	51.5 Å²	51.5	10%	0.101	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-108	14.1	175.5	-52.7	-50.7	0	0	0	112.8	F164 L210 V228 P229 V237 I244 T269	F164-F231 AromaticContact CE2-CD1 3.84Å; F164-F231 HydrophobicContact CE2-CD1 3.84Å; F164-F231 AromaticContact CE2-CE1 3.52Å; F164-F231 HydrophobicContact CE2-CE1 3.52Å; F164-F231 HydrophobicContact CZ-CD1 4.31Å; F164-F231 AromaticContact CZ-CE1 3.87Å; F164-F231 HydrophobicContact CZ-CE1 3.87Å; L210-F231 HydrophobicContact CD2-CE2 3.96Å; L210-F231 HydrophobicContact CD2-CZ 3.88Å; V228-F231 HydrophobicContact CG1-CB 3.7Å; V228-F231 HydrophobicContact CG1-CD2 3.51Å; V228-F231 HydrophobicContact CG1-CG 4.07Å; V228-F231 PolarHBondContact O-N 3.44Å; P229-F231 PolarHBondContact O-N 3.36Å; F231-V237 VanDerWaalsContact CA-CG2 3.41Å; F231-V237 HydrophobicContact CB-CG2 3.53Å; F231-V237 HydrophobicContact CD1-CG2 4.12Å; F231-V237 HydrophobicContact CG-CG2 4.27Å; F231-V237 WeakPolarHBondContact O-CG2 3.32Å; F231-I244 HydrophobicContact CD1-CD1 3.76Å; F231-I244 HydrophobicContact CD1-CG1 4.3Å; F231-I244 HydrophobicContact CD1-CG2 4.22Å; F231-I244 HydrophobicContact CE1-CB 4.37Å; F231-I244 HydrophobicContact CE1-CD1 3.66Å; F231-I244 HydrophobicContact CE1-CG1 3.69Å; F231-I244 HydrophobicContact CE1-CG2 3.77Å; F231-I244 HydrophobicContact CE2-CG2 4.41Å; F231-I244 HydrophobicContact CZ-CG1 4.43Å; F231-I244 HydrophobicContact CZ-CG2 3.91Å; F231-T269 HydrophobicContact CD2-CG2 4.14Å
232	S	51.5	Low	53.1	Low	58 Å²	58	51.7 Å²	51.7	41%	0.406	30%	0.296	S	S	.	.			trans	-80	-23.6	178.5	49.2	0	0	0	0	113.8	E161 P229 V234	E161-S232 WeakPolarHBondContact OE1-CB 3.31Å; E161-S232 PolarHBondContact OE1-OG 2.74Å; E161-S232 PolarHBondContact OE2-OG 3.46Å; P229-S232 WeakPolarHBondContact CA-OG 3.39Å; P229-S232 PolarHBondContact O-N 2.87Å; P229-S232 PolarHBondContact O-OG 3.24Å; S232-V234 PolarHBondContact O-N 3.43Å
233	K	62.3	Low	54.8	Low	65 Å²	65	41.3 Å²	41.3	28%	0.283	26%	0.258	S	S	.	.			trans	-74	97.1	169.2	-90	173.2	-161.3	162.9	0	110.4	E161 D162 S235 T236 V237	E161-K233 HydrophobicContact CG-CB 4.17Å; E161-K233 HydrophobicContact CG-CD 3.71Å; E161-K233 HydrophobicContact CG-CG 3.73Å; E161-K233 WeakPolarHBondContact O-CD 3.03Å; E161-K233 PolarHBondContact O-NZ 3.19Å; E161-K233 WeakPolarHBondContact OE1-CG 3.33Å; E161-K233 PolarHBondContact OE1-N 3.01Å; D162-K233 IonicContact OD1-NZ 3.53Å; D162-K233 PolarHBondContact OD1-NZ 3Å; K233-S235 PolarHBondContact O-N 3.37Å; K233-S235 VanDerWaalsContact O-N 3.12Å; K233-T236 WeakPolarHBondContact O-CB 3.44Å; K233-T236 PolarHBondContact O-N 2.85Å; K233-V237 PolarHBondContact O-N 3.14Å
234	V	56.7	Low	56.3	Low	75 Å²	75	40.2 Å²	40.2	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-42.1	-45.8	175.2	174.5	0	0	0	0	112.3	S232 A238 A276 V280	S232-V234 PolarHBondContact O-N 3.43Å; V234-A238 VanDerWaalsContact O-CB 3.24Å; V234-A238 WeakPolarHBondContact O-CB 2.96Å; V234-A238 PolarHBondContact O-N 2.98Å; V234-A276 HydrophobicContact CB-CB 4.31Å; V234-A276 HydrophobicContact CG1-CB 3.86Å; V234-A276 WeakPolarHBondContact CG1-O 3.5Å; V234-A276 HydrophobicContact CG2-CB 4.23Å; V234-V280 HydrophobicContact CG1-CG2 4.08Å
235	S	61.5	Low	57.8	Low	63 Å²	63	36.9 Å²	36.9	44%	0.441	22%	0.224	S	C	.	.	H	α-helix	trans	-65.1	-42.3	179.5	53.7	0	0	0	0	113.6	K233 A238 N239	K233-S235 PolarHBondContact O-N 3.37Å; K233-S235 VanDerWaalsContact O-N 3.12Å; S235-A238 PolarHBondContact O-N 3.25Å; S235-N239 WeakPolarHBondContact O-CB 2.96Å; S235-N239 PolarHBondContact O-N 3.27Å; S235-N239 PolarHBondContact O-ND2 2.91Å
236	T	63.2	Low	59.4	Low	13 Å²	13	36 Å²	36	8%	0.08	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-42.2	-179.9	-56.9	0	0	0	0	111.4	F164 K233 N239 H240	F164-T236 HydrophobicContact CB-CG2 3.63Å; F164-T236 HydrophobicContact CD1-CG2 3.18Å; F164-T236 HydrophobicContact CD2-CG2 4.31Å; F164-T236 HydrophobicContact CE1-CG2 3.89Å; F164-T236 HydrophobicContact CG-CG2 3.43Å; F164-T236 VanDerWaalsContact CG-CG2 3.43Å; K233-T236 WeakPolarHBondContact O-CB 3.44Å; K233-T236 PolarHBondContact O-N 2.85Å; T236-N239 PolarHBondContact O-N 3.43Å; T236-H240 PolarHBondContact O-CD2 3.32Å; T236-H240 PolarHBondContact O-N 2.76Å
237	V	60.4	Low	60.7	Low	2 Å²	2	34.8 Å²	34.8	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-45.5	174.2	174.8	0	0	0	0	110.9	F231 K233 N239 H240 A241 I244 C273	F231-V237 VanDerWaalsContact CA-CG2 3.41Å; F231-V237 HydrophobicContact CB-CG2 3.53Å; F231-V237 HydrophobicContact CD1-CG2 4.12Å; F231-V237 HydrophobicContact CG-CG2 4.27Å; F231-V237 WeakPolarHBondContact O-CG2 3.32Å; K233-V237 PolarHBondContact O-N 3.14Å; V237-N239 VanDerWaalsContact C-N 3.35Å; V237-N239 PolarHBondContact O-N 3.36Å; V237-H240 CarbonylContact O-C 3.57Å; V237-H240 PolarHBondContact O-N 2.92Å; V237-A241 WeakPolarHBondContact O-CA 3.28Å; V237-A241 VanDerWaalsContact O-CB 3.31Å; V237-A241 WeakPolarHBondContact O-CB 3.49Å; V237-A241 PolarHBondContact O-N 2.93Å; V237-I244 HydrophobicContact CB-CD1 4.5Å; V237-I244 HydrophobicContact CG1-CD1 4.36Å; V237-C273 HydrophobicContact CG1-CB 3.36Å; V237-C273 WeakPolarHBondContact CG1-SG 3.5Å
238	A	61.4	Low	61.8	Low	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-43.1	-179.9	0	0	0	0	0	112.2	V234 S235 H240 A277 V280 I281	V234-A238 VanDerWaalsContact O-CB 3.24Å; V234-A238 WeakPolarHBondContact O-CB 2.96Å; V234-A238 PolarHBondContact O-N 2.98Å; S235-A238 PolarHBondContact O-N 3.25Å; A238-H240 VanDerWaalsContact C-N 3.27Å; A238-H240 PolarHBondContact O-N 2.92Å; A238-A277 HydrophobicContact CB-CB 4.01Å; A238-V280 HydrophobicContact CB-CB 3.76Å; A238-V280 HydrophobicContact CB-CG1 3.54Å; A238-V280 HydrophobicContact CB-CG2 4.45Å; A238-I281 HydrophobicContact CB-CG2 4.15Å; A238-I281 WeakPolarHBondContact O-CG2 3.38Å
239	N	65.9	Low	62.6	Low	73 Å²	73	29.2 Å²	29.2	39%	0.39	17%	0.167	S	C	.	.	H	α-helix	trans	-65.3	-28.7	-178.7	-73.7	-15.9	0	0	0	113.8	S235 T236 V237 R285	S235-N239 WeakPolarHBondContact O-CB 2.96Å; S235-N239 PolarHBondContact O-N 3.27Å; S235-N239 PolarHBondContact O-ND2 2.91Å; T236-N239 PolarHBondContact O-N 3.43Å; V237-N239 VanDerWaalsContact C-N 3.35Å; V237-N239 PolarHBondContact O-N 3.36Å; N239-R285 PolarHBondContact O-NH2 2.87Å
240	H	69.7	Low	63.7	Low	25 Å²	25	29.3 Å²	29.3	12%	0.116	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	19.6	-174.4	-57.4	-56.9	0	0	0	113.1	F164 Y169 T236 V237 A238 D242 I243 I244	F164-H240 HydrophobicContact CE1-CB 4.3Å; F164-H240 AromaticContact CE1-CD2 3.76Å; Y169-H240 HydrophobicContact CD2-CB 3.99Å; Y169-H240 AromaticContact CD2-CE1 3.81Å; Y169-H240 AromaticContact CD2-CG 3.55Å; Y169-H240 AromaticContact CD2-ND1 3.43Å; Y169-H240 WeakPolarHBondContact CD2-ND1 3.46Å; Y169-H240 HydrophobicContact CE2-CB 4.07Å; Y169-H240 AromaticContact CE2-CE1 3.67Å; Y169-H240 AromaticContact CE2-CG 3.64Å; Y169-H240 AromaticContact CE2-ND1 3.1Å; Y169-H240 WeakPolarHBondContact CE2-ND1 3.2Å; Y169-H240 AromaticContact CZ-CE1 3.91Å; Y169-H240 AromaticContact CZ-ND1 3.68Å; T236-H240 PolarHBondContact O-CD2 3.32Å; T236-H240 PolarHBondContact O-N 2.76Å; V237-H240 CarbonylContact O-C 3.57Å; V237-H240 PolarHBondContact O-N 2.92Å; A238-H240 VanDerWaalsContact C-N 3.27Å; A238-H240 PolarHBondContact O-N 2.92Å; H240-D242 VanDerWaalsContact C-OD1 3.3Å; H240-D242 PolarHBondContact O-N 3.49Å; H240-D242 VanDerWaalsContact O-N 3.15Å; H240-I243 PolarHBondContact O-N 2.84Å; H240-I243 VanDerWaalsContact O-N 3.14Å; H240-I244 HydrophobicContact CB-CD1 4.11Å; H240-I244 HydrophobicContact CB-CG1 4.45Å; H240-I244 VanDerWaalsContact O-CG1 3.32Å; H240-I244 WeakPolarHBondContact O-CG1 3.38Å; H240-I244 PolarHBondContact O-N 3Å
241	A	65.1	Low	64.3	Low	5 Å²	5	28.7 Å²	28.7	4%	0.041	16%	0.159	C	C	.	.	H	α-helix	trans	-59.6	-30.7	-171.4	0	0	0	0	0	112.6	V237 L245 L289	V237-A241 WeakPolarHBondContact O-CA 3.28Å; V237-A241 VanDerWaalsContact O-CB 3.31Å; V237-A241 WeakPolarHBondContact O-CB 3.49Å; V237-A241 PolarHBondContact O-N 2.93Å; A241-L245 WeakPolarHBondContact O-CB 3.32Å; A241-L245 PolarHBondContact O-N 3.05Å; A241-L289 HydrophobicContact CB-CD1 3.85Å; A241-L289 HydrophobicContact CB-CD2 3.54Å; A241-L289 HydrophobicContact CB-CG 4.36Å
242	D	65.2	Low	64.4	Low	61 Å²	61	27.6 Å²	27.6	33%	0.326	16%	0.155	S	C	.	.	H	α-helix	trans	-62.8	-49.7	175.8	57.9	-39	0	0	0	112.6	H240 E246 R285	H240-D242 VanDerWaalsContact C-OD1 3.3Å; H240-D242 PolarHBondContact O-N 3.49Å; H240-D242 VanDerWaalsContact O-N 3.15Å; D242-E246 WeakPolarHBondContact O-CB 3.44Å; D242-E246 PolarHBondContact O-N 3.01Å; D242-R285 IonicContact OD1-NH2 3.85Å
243	I	71.3	Confident	64.8	Low	16 Å²	16	27 Å²	27	8%	0.082	15%	0.149	C	C	.	.	H	α-helix	trans	-70.8	-40.2	179.8	-61	-155.9	0	0	0	110.6	Y169 L172 K173 L176 H240 E246 A247	Y169-I243 HydrophobicContact CE2-CB 4.44Å; Y169-I243 HydrophobicContact CE2-CD1 3.52Å; Y169-I243 HydrophobicContact CE2-CG1 4.22Å; L172-I243 HydrophobicContact CB-CG2 3.92Å; K173-I243 HydrophobicContact CG-CD1 4.27Å; L176-I243 HydrophobicContact CD1-CG2 3.66Å; H240-I243 PolarHBondContact O-N 2.84Å; H240-I243 VanDerWaalsContact O-N 3.14Å; I243-E246 PolarHBondContact O-N 2.93Å; I243-A247 VanDerWaalsContact O-CB 3.31Å; I243-A247 WeakPolarHBondContact O-CB 3.2Å; I243-A247 PolarHBondContact O-N 3.41Å
244	I	67.8	Low	64.6	Low	1 Å²	1	27 Å²	27	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-64.1	-46.3	177.5	-64.8	167.5	0	0	0	110.3	F164 L172 F231 V237 H240 A247 L248	F164-I244 HydrophobicContact CE1-CD1 4.49Å; F164-I244 HydrophobicContact CZ-CD1 3.9Å; F164-I244 HydrophobicContact CZ-CG1 4.17Å; L172-I244 HydrophobicContact CD1-CG1 4.35Å; F231-I244 HydrophobicContact CD1-CD1 3.76Å; F231-I244 HydrophobicContact CD1-CG1 4.3Å; F231-I244 HydrophobicContact CD1-CG2 4.22Å; F231-I244 HydrophobicContact CE1-CB 4.37Å; F231-I244 HydrophobicContact CE1-CD1 3.66Å; F231-I244 HydrophobicContact CE1-CG1 3.69Å; F231-I244 HydrophobicContact CE1-CG2 3.77Å; F231-I244 HydrophobicContact CE2-CG2 4.41Å; F231-I244 HydrophobicContact CZ-CG1 4.43Å; F231-I244 HydrophobicContact CZ-CG2 3.91Å; V237-I244 HydrophobicContact CB-CD1 4.5Å; V237-I244 HydrophobicContact CG1-CD1 4.36Å; H240-I244 HydrophobicContact CB-CD1 4.11Å; H240-I244 HydrophobicContact CB-CG1 4.45Å; H240-I244 VanDerWaalsContact O-CG1 3.32Å; H240-I244 WeakPolarHBondContact O-CG1 3.38Å; H240-I244 PolarHBondContact O-N 3Å; I244-A247 WeakPolarHBondContact O-CB 3Å; I244-A247 PolarHBondContact O-N 2.68Å; I244-L248 HydrophobicContact CG2-CD1 3.73Å; I244-L248 VanDerWaalsContact O-CG 3.32Å; I244-L248 WeakPolarHBondContact O-CG 3.28Å; I244-L248 PolarHBondContact O-N 3.33Å
245	L	66.6	Low	64.7	Low	6 Å²	6	23.7 Å²	23.7	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-50	176.7	-175.5	67.6	0	0	0	109.9	A241 A247 L248 L249 I270 L289 R292 C293	A241-L245 WeakPolarHBondContact O-CB 3.32Å; A241-L245 PolarHBondContact O-N 3.05Å; L245-A247 VanDerWaalsContact C-N 3.27Å; L245-A247 PolarHBondContact O-N 2.95Å; L245-L248 PolarHBondContact O-N 3.33Å; L245-L248 VanDerWaalsContact O-N 3.14Å; L245-L249 HydrophobicContact CD1-CD1 4.15Å; L245-L249 HydrophobicContact CD1-CD2 4.49Å; L245-L249 HydrophobicContact CD1-CG 4.15Å; L245-L249 HydrophobicContact CD2-CD1 4.28Å; L245-L249 HydrophobicContact CG-CD1 3.66Å; L245-L249 HydrophobicContact CG-CG 4.11Å; L245-L249 VanDerWaalsContact O-CB 3.31Å; L245-L249 WeakPolarHBondContact O-CB 3.23Å; L245-L249 WeakPolarHBondContact O-CG 3.35Å; L245-L249 PolarHBondContact O-N 3.38Å; L245-I270 HydrophobicContact CD1-CB 4.34Å; L245-I270 HydrophobicContact CD1-CD1 4.45Å; L245-I270 HydrophobicContact CD1-CG1 4.17Å; L245-I270 HydrophobicContact CD1-CG2 3.34Å; L245-L289 HydrophobicContact CB-CD1 4.29Å; L245-L289 HydrophobicContact CD2-CD1 3.64Å; L245-L289 HydrophobicContact CD2-CG 4.35Å; L245-R292 HydrophobicContact CD2-CB 4.1Å; L245-C293 HydrophobicContact CD1-CB 4.21Å; L245-C293 HydrophobicContact CD2-CB 4.17Å
246	E	70.8	Confident	64.3	Low	52 Å²	52	25.6 Å²	25.6	24%	0.243	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-42.1	178.4	-162.6	69.6	-168.4	0	0	112	L176 D242 I243 L249 I250 R292	L176-E246 HydrophobicContact CD1-CB 4.24Å; D242-E246 WeakPolarHBondContact O-CB 3.44Å; D242-E246 PolarHBondContact O-N 3.01Å; I243-E246 PolarHBondContact O-N 2.93Å; E246-L249 PolarHBondContact O-N 3.15Å; E246-I250 HydrophobicContact CG-CD1 4.18Å; E246-I250 WeakPolarHBondContact O-CB 3.08Å; E246-I250 WeakPolarHBondContact O-CG1 3.31Å; E246-I250 PolarHBondContact O-N 3.02Å; E246-R292 IonicContact OE2-CZ 3.36Å; E246-R292 IonicContact OE2-NH2 3.15Å; E246-R292 PolarHBondContact OE2-NH2 3.34Å
247	A	69.7	Low	63.8	Low	1 Å²	1	31 Å²	31	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-60.7	-49.5	175.7	0	0	0	0	0	112.5	L172 L176 L206 L210 I243 I244 L245 L249 I250 V251	L172-A247 HydrophobicContact CD2-CB 4.18Å; L176-A247 HydrophobicContact CD1-CB 4.17Å; L206-A247 HydrophobicContact CD1-CB 4.14Å; L206-A247 HydrophobicContact CD2-CB 3.59Å; L206-A247 WeakPolarHBondContact CD2-O 3.1Å; L206-A247 HydrophobicContact CG-CB 4.12Å; L210-A247 HydrophobicContact CD1-CB 4.06Å; I243-A247 VanDerWaalsContact O-CB 3.31Å; I243-A247 WeakPolarHBondContact O-CB 3.2Å; I243-A247 PolarHBondContact O-N 3.41Å; I244-A247 WeakPolarHBondContact O-CB 3Å; I244-A247 PolarHBondContact O-N 2.68Å; L245-A247 VanDerWaalsContact C-N 3.27Å; L245-A247 PolarHBondContact O-N 2.95Å; A247-L249 VanDerWaalsContact C-N 3.29Å; A247-L249 PolarHBondContact O-N 2.87Å; A247-I250 PolarHBondContact O-N 3.32Å; A247-V251 VanDerWaalsContact O-CG2 3.29Å; A247-V251 WeakPolarHBondContact O-CG2 3.32Å; A247-V251 PolarHBondContact O-N 3.24Å
248	L	65.2	Low	63.5	Low	4 Å²	4	34.7 Å²	34.7	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-34.2	179.5	-68.8	162.7	0	0	0	111.8	L210 I244 L245 V251 A252 T269 I270	L210-L248 HydrophobicContact CB-CD2 4.42Å; L210-L248 HydrophobicContact CD1-CD2 3.78Å; L210-L248 HydrophobicContact CD1-CG 4.16Å; I244-L248 HydrophobicContact CG2-CD1 3.73Å; I244-L248 VanDerWaalsContact O-CG 3.32Å; I244-L248 WeakPolarHBondContact O-CG 3.28Å; I244-L248 PolarHBondContact O-N 3.33Å; L245-L248 PolarHBondContact O-N 3.33Å; L245-L248 VanDerWaalsContact O-N 3.14Å; L248-V251 PolarHBondContact O-N 3.31Å; L248-A252 WeakPolarHBondContact O-CB 3.33Å; L248-A252 PolarHBondContact O-N 3.38Å; L248-T269 HydrophobicContact CD1-CG2 4.39Å; L248-I270 HydrophobicContact CB-CD1 3.73Å; L248-I270 HydrophobicContact CB-CG1 3.63Å; L248-I270 HydrophobicContact CD1-CG1 3.54Å; L248-I270 HydrophobicContact CG-CG1 4.13Å
249	L	64.8	Low	63.4	Low	4 Å²	4	37.7 Å²	37.7	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-72.7	-33	179.1	-70.8	176.4	0	0	0	114	L245 E246 A247 V251 P253 W267 I270 W296	L245-L249 HydrophobicContact CD1-CD1 4.15Å; L245-L249 HydrophobicContact CD1-CD2 4.49Å; L245-L249 HydrophobicContact CD1-CG 4.15Å; L245-L249 HydrophobicContact CD2-CD1 4.28Å; L245-L249 HydrophobicContact CG-CD1 3.66Å; L245-L249 HydrophobicContact CG-CG 4.11Å; L245-L249 VanDerWaalsContact O-CB 3.31Å; L245-L249 WeakPolarHBondContact O-CB 3.23Å; L245-L249 WeakPolarHBondContact O-CG 3.35Å; L245-L249 PolarHBondContact O-N 3.38Å; E246-L249 PolarHBondContact O-N 3.15Å; A247-L249 VanDerWaalsContact C-N 3.29Å; A247-L249 PolarHBondContact O-N 2.87Å; L249-V251 VanDerWaalsContact C-N 3.27Å; L249-P253 WeakPolarHBondContact O-CD 3.32Å; L249-W267 HydrophobicContact CD2-CH2 3.48Å; L249-W267 VanDerWaalsContact CD2-CH2 3.48Å; L249-W267 HydrophobicContact CD2-CZ2 4.17Å; L249-W267 HydrophobicContact CD2-CZ3 4.13Å; L249-I270 HydrophobicContact CD2-CD1 4.21Å; L249-W296 HydrophobicContact CB-CD2 4.38Å; L249-W296 HydrophobicContact CD1-CB 3.72Å; L249-W296 HydrophobicContact CD1-CD2 3.77Å; L249-W296 HydrophobicContact CD1-CG 3.29Å; L249-W296 HydrophobicContact CD2-CB 3.26Å; L249-W296 HydrophobicContact CD2-CD2 4.37Å; L249-W296 HydrophobicContact CD2-CG 3.8Å; L249-W296 HydrophobicContact CG-CB 4.01Å; L249-W296 HydrophobicContact CG-CD2 4.38Å; L249-W296 HydrophobicContact CG-CG 4.01Å
250	I	68	Low	63.1	Low	55 Å²	55	38.2 Å²	38.2	28%	0.282	22%	0.224	S	C	.	.	H	α-helix	trans	-68.8	-32.8	172.3	-77.6	166.5	0	0	0	110.8	L176 P203 L206 E246 A247	L176-I250 HydrophobicContact CD2-CD1 3.3Å; P203-I250 HydrophobicContact CB-CG2 3.37Å; P203-I250 HydrophobicContact CG-CG2 3.49Å; P203-I250 VanDerWaalsContact CG-CG2 3.49Å; L206-I250 HydrophobicContact CD2-CG2 4.5Å; E246-I250 HydrophobicContact CG-CD1 4.18Å; E246-I250 WeakPolarHBondContact O-CB 3.08Å; E246-I250 WeakPolarHBondContact O-CG1 3.31Å; E246-I250 PolarHBondContact O-N 3.02Å; A247-I250 PolarHBondContact O-N 3.32Å
251	V	64.2	Low	62.6	Low	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-79.1	-41.1	-178.6	166.3	0	0	0	0	112.6	L206 A207 L210 L211 A247 L248 L249 P253 L254	L206-V251 HydrophobicContact CB-CG2 3.8Å; L206-V251 HydrophobicContact CD2-CG2 4.12Å; L206-V251 HydrophobicContact CG-CG2 3.8Å; A207-V251 HydrophobicContact CB-CB 4.33Å; A207-V251 HydrophobicContact CB-CG1 3.63Å; A207-V251 HydrophobicContact CB-CG2 3.96Å; A207-V251 VanDerWaalsContact N-CG2 3.27Å; L210-V251 HydrophobicContact CD1-CG2 4.15Å; L211-V251 HydrophobicContact CD1-CG1 3.34Å; L211-V251 HydrophobicContact CD2-CG1 4.14Å; L211-V251 HydrophobicContact CG-CG1 3.96Å; A247-V251 VanDerWaalsContact O-CG2 3.29Å; A247-V251 WeakPolarHBondContact O-CG2 3.32Å; A247-V251 PolarHBondContact O-N 3.24Å; L248-V251 PolarHBondContact O-N 3.31Å; L249-V251 VanDerWaalsContact C-N 3.27Å; V251-P253 VanDerWaalsContact C-CD 3.46Å; V251-P253 VanDerWaalsContact C-N 3.34Å; V251-L254 WeakPolarHBondContact O-CB 3.3Å; V251-L254 PolarHBondContact O-N 3.38Å
252	A	62.1	Low	62.2	Low	1 Å²	1	46.4 Å²	46.4	1%	0.008	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-52.6	-39.3	-173.6	0	0	0	0	0	115	L248 F300	L248-A252 WeakPolarHBondContact O-CB 3.33Å; L248-A252 PolarHBondContact O-N 3.38Å; A252-F300 HydrophobicContact CB-CD2 4.5Å
253	P	58.9	Low	62.1	Low	44 Å²	44	44 Å²	44	29%	0.286	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-73.8	-19.3	178	-19.5	32.9	0	0	0	115.4	L249 V251 C255	L249-P253 WeakPolarHBondContact O-CD 3.32Å; V251-P253 VanDerWaalsContact C-CD 3.46Å; V251-P253 VanDerWaalsContact C-N 3.34Å; P253-C255 PolarHBondContact O-N 2.67Å
254	L	58.9	Low	61.6	Low	65 Å²	65	44.7 Å²	44.7	34%	0.34	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-76.4	-12.1	-179.1	-62.1	175.2	0	0	0	112.8	P203 E204 A207 V251 C256	P203-L254 HydrophobicContact CB-CD1 3.22Å; P203-L254 HydrophobicContact CB-CD2 4.29Å; P203-L254 HydrophobicContact CB-CG 4.11Å; P203-L254 VanDerWaalsContact O-CD1 3.26Å; P203-L254 WeakPolarHBondContact O-CD1 3.33Å; E204-L254 HydrophobicContact CB-CD1 4.47Å; E204-L254 HydrophobicContact CG-CD1 3.97Å; A207-L254 HydrophobicContact CB-CD1 4.32Å; V251-L254 WeakPolarHBondContact O-CB 3.3Å; V251-L254 PolarHBondContact O-N 3.38Å; L254-C256 PolarHBondContact O-N 3.49Å
255	C	58.7	Low	61.3	Low	7 Å²	7	47 Å²	47	5%	0.047	27%	0.271	C	S	.	.			trans	-80.2	93.5	-178	-58.2	0	0	0	0	108.9	P253 Q259 F262 V263	P253-C255 PolarHBondContact O-N 2.67Å; C255-Q259 HydrophobicContact CB-CB 4.12Å; C255-F262 HydrophobicContact CB-CD1 4.05Å; C255-F262 HydrophobicContact CB-CE1 4.36Å; C255-F262 WeakPolarHBondContact SG-CD1 3.49Å; C255-F262 WeakPolarHBondContact SG-CE1 3.5Å; C255-V263 HydrophobicContact CB-CG2 3.23Å
256	C	53.5	Low	61.1	Low	103 Å²	103	46.8 Å²	46.8	70%	0.696	27%	0.271	S	S	*	.			trans	-55.3	159.6	172.8	-61	0	0	0	0	111.6	L254 G258 Q259	L254-C256 PolarHBondContact O-N 3.49Å; C256-G258 PolarHBondContact O-N 2.97Å; C256-Q259 PolarHBondContact O-N 3.37Å
257	D	50.8	Low	61.1	Low	126 Å²	126	44.4 Å²	44.4	67%	0.674	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-5.6	-173.1	-73.3	-37.6	0	0	0	118	K260	D257-K260 WeakPolarHBondContact O-CE 3.4Å
258	G	54	Low	60.9	Low	79 Å²	79	45.4 Å²	45.4	81%	0.814	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.5	173.4	0	0	0	0	0	116.1	C256	C256-G258 PolarHBondContact O-N 2.97Å
259	Q	61	Low	60.9	Low	63 Å²	63	46.2 Å²	46.2	29%	0.294	27%	0.27	S	S	.	.			trans	-112.1	40.8	-175.4	-71.2	-170.3	-15.2	0	0	112.5	C255 C256 F262 V263	C255-Q259 HydrophobicContact CB-CB 4.12Å; C256-Q259 PolarHBondContact O-N 3.37Å; Q259-F262 HydrophobicContact CB-CB 4.03Å; Q259-F262 HydrophobicContact CB-CD1 4.22Å; Q259-F262 HydrophobicContact CB-CG 4.41Å; Q259-F262 VanDerWaalsContact O-CB 3.26Å; Q259-F262 WeakPolarHBondContact O-CB 3.24Å; Q259-F262 PolarHBondContact O-N 3.06Å; Q259-V263 WeakPolarHBondContact O-CG2 3.43Å; Q259-V263 PolarHBondContact O-N 3.46Å
260	K	59.8	Low	61	Low	84 Å²	84	46.1 Å²	46.1	37%	0.365	27%	0.27	S	S	.	.	H	α-helix	trans	-67.2	-44	-172.9	-63.9	-173.6	178.1	-167.2	0	114.2	D257 F262 V263 N264 E310	D257-K260 WeakPolarHBondContact O-CE 3.4Å; K260-F262 PolarHBondContact O-N 2.84Å; K260-V263 PolarHBondContact O-N 3.42Å; K260-N264 VanDerWaalsContact O-CG 3.31Å; K260-N264 PolarHBondContact O-N 3.2Å; K260-E310 IonicContact NZ-OE1 3.98Å; K260-E310 PolarHBondContact NZ-OE1 3.16Å; K260-E310 IonicContact NZ-OE2 3.64Å; K260-E310 PolarHBondContact NZ-OE2 2.96Å
261	E	58	Low	61	Low	173 Å²	173	43.5 Å²	43.5	81%	0.808	26%	0.256	S	S	*	.	H	α-helix	trans	-57.9	-38.2	174	-67.1	-178.6	171.1	0	0	111.2	N264 A265	E261-N264 PolarHBondContact O-N 3.24Å; E261-A265 WeakPolarHBondContact O-CB 3.38Å; E261-A265 PolarHBondContact O-N 3.28Å
262	F	57.3	Low	61.1	Low	30 Å²	30	46.7 Å²	46.7	13%	0.132	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-51	179.7	168.9	-84	0	0	0	110.7	L211 C255 Q259 K260 N264 A265 C266	L211-F262 HydrophobicContact CB-CD2 3.6Å; L211-F262 HydrophobicContact CB-CE2 3.32Å; L211-F262 HydrophobicContact CB-CZ 3.88Å; L211-F262 HydrophobicContact CD1-CD1 3.66Å; L211-F262 HydrophobicContact CD1-CD2 3.83Å; L211-F262 HydrophobicContact CD1-CE1 3.04Å; L211-F262 HydrophobicContact CD1-CE2 3.34Å; L211-F262 HydrophobicContact CD1-CG 4.08Å; L211-F262 HydrophobicContact CD1-CZ 2.95Å; L211-F262 HydrophobicContact CD2-CD2 4.14Å; L211-F262 HydrophobicContact CD2-CE1 3.93Å; L211-F262 HydrophobicContact CD2-CE2 2.99Å; L211-F262 HydrophobicContact CD2-CZ 2.88Å; L211-F262 HydrophobicContact CG-CD2 3.96Å; L211-F262 HydrophobicContact CG-CE1 3.91Å; L211-F262 HydrophobicContact CG-CE2 3.23Å; L211-F262 HydrophobicContact CG-CZ 3.23Å; C255-F262 HydrophobicContact CB-CD1 4.05Å; C255-F262 HydrophobicContact CB-CE1 4.36Å; C255-F262 WeakPolarHBondContact SG-CD1 3.49Å; C255-F262 WeakPolarHBondContact SG-CE1 3.5Å; Q259-F262 HydrophobicContact CB-CB 4.03Å; Q259-F262 HydrophobicContact CB-CD1 4.22Å; Q259-F262 HydrophobicContact CB-CG 4.41Å; Q259-F262 VanDerWaalsContact O-CB 3.26Å; Q259-F262 WeakPolarHBondContact O-CB 3.24Å; Q259-F262 PolarHBondContact O-N 3.06Å; K260-F262 PolarHBondContact O-N 2.84Å; F262-N264 VanDerWaalsContact C-N 3.31Å; F262-N264 PolarHBondContact O-N 3.27Å; F262-A265 WeakPolarHBondContact O-CB 2.88Å; F262-A265 PolarHBondContact O-N 3.09Å; F262-A265 VanDerWaalsContact O-N 3.13Å; F262-C266 HydrophobicContact CE1-CB 4.15Å; F262-C266 HydrophobicContact CZ-CB 3.67Å; F262-C266 VanDerWaalsContact CZ-SG 3.58Å; F262-C266 PolarHBondContact O-N 2.8Å
263	V	62.1	Low	61.3	Low	9 Å²	9	47.1 Å²	47.1	6%	0.055	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-42.3	175.9	167.5	0	0	0	0	112.3	C255 Q259 K260 C266 W267 F300	C255-V263 HydrophobicContact CB-CG2 3.23Å; Q259-V263 WeakPolarHBondContact O-CG2 3.43Å; Q259-V263 PolarHBondContact O-N 3.46Å; K260-V263 PolarHBondContact O-N 3.42Å; V263-C266 VanDerWaalsContact O-CB 3.24Å; V263-C266 WeakPolarHBondContact O-CB 3.39Å; V263-C266 PolarHBondContact O-N 3.26Å; V263-W267 VanDerWaalsContact O-CD1 3.29Å; V263-W267 PolarHBondContact O-N 2.88Å; V263-F300 HydrophobicContact CB-CE2 4.4Å; V263-F300 HydrophobicContact CB-CZ 4.48Å; V263-F300 HydrophobicContact CG1-CD2 4.17Å; V263-F300 HydrophobicContact CG1-CE1 4.07Å; V263-F300 HydrophobicContact CG1-CE2 3.08Å; V263-F300 HydrophobicContact CG1-CZ 3.04Å; V263-F300 HydrophobicContact CG2-CE2 4.48Å
264	N	62.6	Low	61.7	Low	32 Å²	32	45.1 Å²	45.1	17%	0.171	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-43.7	176	-70.6	-6.8	0	0	0	111.3	K260 E261 F262 C266 W267 V268 L314 L317	K260-N264 VanDerWaalsContact O-CG 3.31Å; K260-N264 PolarHBondContact O-N 3.2Å; E261-N264 PolarHBondContact O-N 3.24Å; F262-N264 VanDerWaalsContact C-N 3.31Å; F262-N264 PolarHBondContact O-N 3.27Å; N264-C266 VanDerWaalsContact C-N 3.31Å; N264-C266 PolarHBondContact O-N 3.05Å; N264-W267 PolarHBondContact O-N 2.96Å; N264-V268 WeakPolarHBondContact O-CB 3.29Å; N264-V268 VanDerWaalsContact O-CG2 3.26Å; N264-V268 WeakPolarHBondContact O-CG2 3.29Å; N264-V268 PolarHBondContact O-N 3.26Å; N264-L314 HydrophobicContact CB-CD1 4.13Å; N264-L317 HydrophobicContact CB-CD1 4.45Å
265	A	61.3	Low	62.1	Low	48 Å²	48	42.5 Å²	42.5	40%	0.397	25%	0.252	S	S	.	.	H	α-helix	trans	-61.5	-40.6	175.4	0	0	0	0	0	111.7	E261 F262 W267 V268 T269	E261-A265 WeakPolarHBondContact O-CB 3.38Å; E261-A265 PolarHBondContact O-N 3.28Å; F262-A265 WeakPolarHBondContact O-CB 2.88Å; F262-A265 PolarHBondContact O-N 3.09Å; F262-A265 VanDerWaalsContact O-N 3.13Å; A265-W267 PolarHBondContact O-N 3.35Å; A265-V268 PolarHBondContact O-N 2.88Å; A265-T269 PolarHBondContact O-N 3.17Å; A265-T269 PolarHBondContact O-OG1 3.49Å; A265-T269 VanDerWaalsContact O-OG1 3.09Å
266	C	62	Low	62.4	Low	3 Å²	3	43.3 Å²	43.3	2%	0.02	26%	0.259	C	S	.	.	H	α-helix	trans	-56.4	-50.5	175.6	-136.1	0	0	0	0	111.4	F262 V263 N264 T269 I270	F262-C266 HydrophobicContact CE1-CB 4.15Å; F262-C266 HydrophobicContact CZ-CB 3.67Å; F262-C266 VanDerWaalsContact CZ-SG 3.58Å; F262-C266 PolarHBondContact O-N 2.8Å; V263-C266 VanDerWaalsContact O-CB 3.24Å; V263-C266 WeakPolarHBondContact O-CB 3.39Å; V263-C266 PolarHBondContact O-N 3.26Å; N264-C266 VanDerWaalsContact C-N 3.31Å; N264-C266 PolarHBondContact O-N 3.05Å; C266-T269 PolarHBondContact O-N 3.02Å; C266-I270 VanDerWaalsContact O-CG1 3.3Å; C266-I270 WeakPolarHBondContact O-CG1 3.36Å; C266-I270 PolarHBondContact O-N 2.8Å
267	W	70.6	Confident	63.1	Low	1 Å²	1	38.4 Å²	38.4	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-43.6	177.1	-77.7	113.8	0	0	0	112.5	L249 V263 N264 A265 T269 I270 F271 W296 F297 F300 L314 L318	L249-W267 HydrophobicContact CD2-CH2 3.48Å; L249-W267 VanDerWaalsContact CD2-CH2 3.48Å; L249-W267 HydrophobicContact CD2-CZ2 4.17Å; L249-W267 HydrophobicContact CD2-CZ3 4.13Å; V263-W267 VanDerWaalsContact O-CD1 3.29Å; V263-W267 PolarHBondContact O-N 2.88Å; N264-W267 PolarHBondContact O-N 2.96Å; A265-W267 PolarHBondContact O-N 3.35Å; W267-T269 VanDerWaalsContact C-N 3.28Å; W267-T269 PolarHBondContact O-N 3.44Å; W267-I270 HydrophobicContact CD2-CD1 3.95Å; W267-I270 HydrophobicContact CE3-CB 4.1Å; W267-I270 HydrophobicContact CE3-CD1 3.47Å; W267-I270 VanDerWaalsContact CE3-CD1 3.47Å; W267-I270 HydrophobicContact CE3-CG1 4.38Å; W267-I270 HydrophobicContact CE3-CG2 4.04Å; W267-I270 HydrophobicContact CH2-CD1 4.12Å; W267-I270 HydrophobicContact CZ3-CD1 3.61Å; W267-I270 HydrophobicContact CZ3-CG2 4.03Å; W267-I270 WeakPolarHBondContact O-CB 3.47Å; W267-I270 PolarHBondContact O-N 2.8Å; W267-I270 VanDerWaalsContact O-N 3.11Å; W267-F271 HydrophobicContact CE3-CD2 4.18Å; W267-F271 AromaticContact CE3-CE2 3.6Å; W267-F271 HydrophobicContact CE3-CE2 3.6Å; W267-F271 HydrophobicContact CZ3-CE2 4.14Å; W267-F271 WeakPolarHBondContact O-CD2 3.43Å; W267-F271 PolarHBondContact O-N 2.88Å; W267-W296 HydrophobicContact CH2-CB 4.27Å; W267-F297 HydrophobicContact CB-CE2 4.33Å; W267-F297 AromaticContact CD2-CD2 3.38Å; W267-F297 HydrophobicContact CD2-CD2 3.38Å; W267-F297 AromaticContact CD2-CE2 3.83Å; W267-F297 HydrophobicContact CD2-CE2 3.83Å; W267-F297 AromaticContact CE2-CD2 3.57Å; W267-F297 HydrophobicContact CE3-CB 4.35Å; W267-F297 AromaticContact CE3-CD2 3.48Å; W267-F297 HydrophobicContact CE3-CD2 3.48Å; W267-F297 VanDerWaalsContact CE3-CD2 3.48Å; W267-F297 HydrophobicContact CE3-CE2 4.22Å; W267-F297 HydrophobicContact CE3-CG 4.38Å; W267-F297 AromaticContact CG-CD2 3.92Å; W267-F297 HydrophobicContact CG-CD2 3.92Å; W267-F297 AromaticContact CG-CE2 3.84Å; W267-F297 HydrophobicContact CG-CE2 3.84Å; W267-F297 HydrophobicContact CH2-CB 3.68Å; W267-F297 AromaticContact CH2-CD2 3.96Å; W267-F297 HydrophobicContact CH2-CD2 3.96Å; W267-F297 HydrophobicContact CH2-CG 4.35Å; W267-F297 HydrophobicContact CZ2-CB 4.2Å; W267-F297 AromaticContact CZ2-CD2 3.88Å; W267-F297 HydrophobicContact CZ2-CD2 3.88Å; W267-F297 HydrophobicContact CZ3-CB 3.74Å; W267-F297 AromaticContact CZ3-CD2 3.75Å; W267-F297 HydrophobicContact CZ3-CD2 3.75Å; W267-F297 HydrophobicContact CZ3-CG 4.25Å; W267-F300 AromaticContact CD1-CD1 3.86Å; W267-F300 AromaticContact CD1-CE1 3.72Å; W267-F300 AromaticContact CE2-CD1 3.67Å; W267-F300 AromaticContact CE2-CG 3.71Å; W267-F300 HydrophobicContact CZ2-CB 3.49Å; W267-F300 VanDerWaalsContact CZ2-CB 3.49Å; W267-F300 HydrophobicContact CZ2-CD1 4.03Å; W267-F300 AromaticContact CZ2-CG 3.76Å; W267-F300 HydrophobicContact CZ2-CG 3.76Å; W267-F300 AromaticContact NE1-CD1 3.05Å; W267-F300 AromaticContact NE1-CD2 3.53Å; W267-F300 AromaticContact NE1-CE1 3.36Å; W267-F300 AromaticContact NE1-CE2 3.82Å; W267-F300 AromaticContact NE1-CG 3.16Å; W267-F300 AromaticContact NE1-CZ 3.77Å; W267-L314 HydrophobicContact CB-CD1 4.07Å; W267-L318 HydrophobicContact CB-CD1 4.44Å; W267-L318 HydrophobicContact CB-CD2 4.47Å
268	V	65.5	Low	64	Low	22 Å²	22	34.9 Å²	34.9	13%	0.133	21%	0.211	C	C	.	.	H	α-helix	trans	-53.6	-47.8	174.3	165.4	0	0	0	0	111	N264 A265 F271 D272 L317 L318	N264-V268 WeakPolarHBondContact O-CB 3.29Å; N264-V268 VanDerWaalsContact O-CG2 3.26Å; N264-V268 WeakPolarHBondContact O-CG2 3.29Å; N264-V268 PolarHBondContact O-N 3.26Å; A265-V268 PolarHBondContact O-N 2.88Å; V268-F271 PolarHBondContact O-N 3.46Å; V268-D272 WeakPolarHBondContact O-CB 3.14Å; V268-D272 VanDerWaalsContact O-CG 3.3Å; V268-D272 PolarHBondContact O-N 3.27Å; V268-L317 HydrophobicContact CG2-CB 4.03Å; V268-L318 HydrophobicContact CG2-CD2 4.08Å
269	T	64.6	Low	64.6	Low	21 Å²	21	34.9 Å²	34.9	13%	0.129	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-44.2	176	-60.8	0	0	0	0	112.4	V228 F231 L248 A265 C266 W267 F271 D272 C273	V228-T269 HydrophobicContact CG1-CG2 3.86Å; F231-T269 HydrophobicContact CD2-CG2 4.14Å; L248-T269 HydrophobicContact CD1-CG2 4.39Å; A265-T269 PolarHBondContact O-N 3.17Å; A265-T269 PolarHBondContact O-OG1 3.49Å; A265-T269 VanDerWaalsContact O-OG1 3.09Å; C266-T269 PolarHBondContact O-N 3.02Å; W267-T269 VanDerWaalsContact C-N 3.28Å; W267-T269 PolarHBondContact O-N 3.44Å; T269-F271 VanDerWaalsContact C-N 3.31Å; T269-F271 PolarHBondContact O-N 3.11Å; T269-D272 PolarHBondContact O-N 3.47Å; T269-C273 WeakPolarHBondContact O-CB 3.46Å; T269-C273 PolarHBondContact O-N 3.28Å; T269-C273 PolarHBondContact O-SG 3.37Å
270	I	67.4	Low	65.2	Low	2 Å²	2	35.1 Å²	35.1	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-55	-48.9	175	-73	167.7	0	0	0	110.3	L245 L248 L249 C266 W267 C273 V274 C293	L245-I270 HydrophobicContact CD1-CB 4.34Å; L245-I270 HydrophobicContact CD1-CD1 4.45Å; L245-I270 HydrophobicContact CD1-CG1 4.17Å; L245-I270 HydrophobicContact CD1-CG2 3.34Å; L248-I270 HydrophobicContact CB-CD1 3.73Å; L248-I270 HydrophobicContact CB-CG1 3.63Å; L248-I270 HydrophobicContact CD1-CG1 3.54Å; L248-I270 HydrophobicContact CG-CG1 4.13Å; L249-I270 HydrophobicContact CD2-CD1 4.21Å; C266-I270 VanDerWaalsContact O-CG1 3.3Å; C266-I270 WeakPolarHBondContact O-CG1 3.36Å; C266-I270 PolarHBondContact O-N 2.8Å; W267-I270 HydrophobicContact CD2-CD1 3.95Å; W267-I270 HydrophobicContact CE3-CB 4.1Å; W267-I270 HydrophobicContact CE3-CD1 3.47Å; W267-I270 VanDerWaalsContact CE3-CD1 3.47Å; W267-I270 HydrophobicContact CE3-CG1 4.38Å; W267-I270 HydrophobicContact CE3-CG2 4.04Å; W267-I270 HydrophobicContact CH2-CD1 4.12Å; W267-I270 HydrophobicContact CZ3-CD1 3.61Å; W267-I270 HydrophobicContact CZ3-CG2 4.03Å; W267-I270 WeakPolarHBondContact O-CB 3.47Å; W267-I270 PolarHBondContact O-N 2.8Å; W267-I270 VanDerWaalsContact O-N 3.11Å; I270-C273 WeakPolarHBondContact O-CB 3.41Å; I270-C273 PolarHBondContact O-N 3.33Å; I270-V274 WeakPolarHBondContact O-CG2 3.5Å; I270-V274 PolarHBondContact O-N 2.99Å; I270-C293 WeakPolarHBondContact CG2-SG 3.42Å
271	F	68.4	Low	65.6	Low	0 Å²	0	32.1 Å²	32.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-69.1	-37.6	-178.1	-81.5	-78.7	0	0	0	112.7	W267 V268 T269 C273 V274 G275 C293 F297 L318 R321 Y322 F325 F347	W267-F271 HydrophobicContact CE3-CD2 4.18Å; W267-F271 AromaticContact CE3-CE2 3.6Å; W267-F271 HydrophobicContact CE3-CE2 3.6Å; W267-F271 HydrophobicContact CZ3-CE2 4.14Å; W267-F271 WeakPolarHBondContact O-CD2 3.43Å; W267-F271 PolarHBondContact O-N 2.88Å; V268-F271 PolarHBondContact O-N 3.46Å; T269-F271 VanDerWaalsContact C-N 3.31Å; T269-F271 PolarHBondContact O-N 3.11Å; F271-C273 VanDerWaalsContact C-N 3.29Å; F271-C273 PolarHBondContact O-N 2.95Å; F271-V274 PolarHBondContact O-N 3.24Å; F271-G275 PolarHBondContact O-N 3.29Å; F271-C293 WeakPolarHBondContact CZ-SG 3.28Å; F271-F297 HydrophobicContact CE2-CD2 4.14Å; F271-F297 HydrophobicContact CE2-CE2 4.46Å; F271-L318 HydrophobicContact CB-CD2 3.88Å; F271-L318 HydrophobicContact CD2-CD1 3.9Å; F271-L318 HydrophobicContact CD2-CD2 3.34Å; F271-L318 HydrophobicContact CD2-CG 4.2Å; F271-L318 HydrophobicContact CE2-CD1 3.9Å; F271-L318 HydrophobicContact CE2-CD2 4.2Å; F271-L318 HydrophobicContact CG-CD2 3.76Å; F271-R321 HydrophobicContact CB-CB 4.31Å; F271-Y322 HydrophobicContact CB-CE2 4.25Å; F271-Y322 HydrophobicContact CD1-CD1 4.47Å; F271-Y322 AromaticContact CD1-CD2 3.52Å; F271-Y322 HydrophobicContact CD1-CD2 3.52Å; F271-Y322 HydrophobicContact CD1-CE1 4.04Å; F271-Y322 AromaticContact CD1-CE2 2.96Å; F271-Y322 HydrophobicContact CD1-CE2 2.96Å; F271-Y322 HydrophobicContact CD1-CG 4.3Å; F271-Y322 AromaticContact CD1-CZ 3.38Å; F271-Y322 AromaticContact CD2-CE2 3.77Å; F271-Y322 HydrophobicContact CD2-CE2 3.77Å; F271-Y322 HydrophobicContact CE1-CD1 4.15Å; F271-Y322 AromaticContact CE1-CD2 3.92Å; F271-Y322 HydrophobicContact CE1-CD2 3.92Å; F271-Y322 AromaticContact CE1-CE1 3.4Å; F271-Y322 HydrophobicContact CE1-CE1 3.4Å; F271-Y322 AromaticContact CE1-CE2 3.12Å; F271-Y322 HydrophobicContact CE1-CE2 3.12Å; F271-Y322 HydrophobicContact CE1-CG 4.43Å; F271-Y322 AromaticContact CE1-CZ 2.91Å; F271-Y322 WeakPolarHBondContact CE1-OH 3.26Å; F271-Y322 AromaticContact CE2-CE2 3.89Å; F271-Y322 HydrophobicContact CE2-CE2 3.89Å; F271-Y322 AromaticContact CE2-CZ 3.75Å; F271-Y322 WeakPolarHBondContact CE2-OH 3.26Å; F271-Y322 HydrophobicContact CG-CD2 4.09Å; F271-Y322 AromaticContact CG-CE2 3.37Å; F271-Y322 HydrophobicContact CG-CE2 3.37Å; F271-Y322 AromaticContact CZ-CE1 3.92Å; F271-Y322 HydrophobicContact CZ-CE1 3.92Å; F271-Y322 AromaticContact CZ-CE2 3.65Å; F271-Y322 HydrophobicContact CZ-CE2 3.65Å; F271-Y322 AromaticContact CZ-CZ 3.2Å; F271-Y322 WeakPolarHBondContact CZ-OH 3.36Å; F271-F325 HydrophobicContact CD1-CD2 4.47Å; F271-F325 AromaticContact CD1-CE2 3.43Å; F271-F325 HydrophobicContact CD1-CE2 3.43Å; F271-F325 VanDerWaalsContact CD1-CE2 3.43Å; F271-F325 AromaticContact CD1-CZ 3.57Å; F271-F325 HydrophobicContact CD1-CZ 3.57Å; F271-F325 HydrophobicContact CE1-CE1 4.02Å; F271-F325 AromaticContact CE1-CE2 3.55Å; F271-F325 HydrophobicContact CE1-CE2 3.55Å; F271-F325 AromaticContact CE1-CZ 3.23Å; F271-F325 HydrophobicContact CE1-CZ 3.23Å; F271-F325 HydrophobicContact CZ-CZ 4.35Å; F271-F347 HydrophobicContact CE1-CZ 4.36Å; F271-F347 AromaticContact CZ-CZ 3.84Å; F271-F347 HydrophobicContact CZ-CZ 3.84Å
272	D	66	Low	66.4	Low	68 Å²	68	28 Å²	28	36%	0.364	19%	0.188	S	C	.	.	H	α-helix	trans	-60.8	-40.1	171.3	-72.8	-25.7	0	0	0	110.9	V268 T269 G275 A276 R321	V268-D272 WeakPolarHBondContact O-CB 3.14Å; V268-D272 VanDerWaalsContact O-CG 3.3Å; V268-D272 PolarHBondContact O-N 3.27Å; T269-D272 PolarHBondContact O-N 3.47Å; D272-G275 PolarHBondContact O-N 2.81Å; D272-A276 WeakPolarHBondContact O-CB 3.4Å; D272-A276 PolarHBondContact O-N 3.26Å; D272-R321 WeakPolarHBondContact OD1-CD 3.4Å; D272-R321 VanDerWaalsContact OD1-CG 3.31Å; D272-R321 WeakPolarHBondContact OD1-CG 3.1Å; D272-R321 IonicContact OD1-CZ 2.7Å; D272-R321 IonicContact OD1-NE 2.67Å; D272-R321 PolarHBondContact OD1-NE 2.91Å; D272-R321 IonicContact OD2-NE 3.69Å; D272-R321 PolarHBondContact OD2-NE 3.27Å; D272-R321 IonicContact OD2-NH2 3.32Å
273	C	65.5	Low	66.9	Low	10 Å²	10	32.6 Å²	32.6	7%	0.068	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-43.2	177	-67.4	0	0	0	0	112.5	V237 T269 I270 F271 A276 A277	V237-C273 HydrophobicContact CG1-CB 3.36Å; V237-C273 WeakPolarHBondContact CG1-SG 3.5Å; T269-C273 WeakPolarHBondContact O-CB 3.46Å; T269-C273 PolarHBondContact O-N 3.28Å; T269-C273 PolarHBondContact O-SG 3.37Å; I270-C273 WeakPolarHBondContact O-CB 3.41Å; I270-C273 PolarHBondContact O-N 3.33Å; F271-C273 VanDerWaalsContact C-N 3.29Å; F271-C273 PolarHBondContact O-N 2.95Å; C273-A276 PolarHBondContact O-N 3.13Å; C273-A277 PolarHBondContact O-N 3.43Å
274	V	67.7	Low	67.2	Low	2 Å²	2	39.8 Å²	39.8	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-39	176.8	177.4	0	0	0	0	111.1	I270 F271 A277 H286 L289 C290 C293 F325	I270-V274 WeakPolarHBondContact O-CG2 3.5Å; I270-V274 PolarHBondContact O-N 2.99Å; F271-V274 PolarHBondContact O-N 3.24Å; V274-A277 PolarHBondContact O-N 3.27Å; V274-H286 PolarHBondContact O-NE2 2.94Å; V274-L289 HydrophobicContact CB-CD2 4.33Å; V274-L289 HydrophobicContact CG1-CD2 4.3Å; V274-L289 HydrophobicContact CG2-CD2 3.9Å; V274-L289 HydrophobicContact CG2-CG 4.07Å; V274-C290 WeakPolarHBondContact CG1-SG 3.45Å; V274-C293 HydrophobicContact CG2-CB 4.14Å; V274-F325 HydrophobicContact CB-CE2 4.2Å; V274-F325 HydrophobicContact CB-CZ 4.1Å; V274-F325 HydrophobicContact CG1-CE1 4.28Å; V274-F325 HydrophobicContact CG1-CE2 3.66Å; V274-F325 HydrophobicContact CG1-CZ 3.5Å; V274-F325 VanDerWaalsContact CG1-CZ 3.5Å; V274-F325 HydrophobicContact CG2-CZ 4.48Å
275	G	66.8	Low	67.3	Low	9 Å²	9	43.3 Å²	43.3	9%	0.093	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-46.4	174.4	0	0	0	0	0	112.3	F271 D272 A277 S278	F271-G275 PolarHBondContact O-N 3.29Å; D272-G275 PolarHBondContact O-N 2.81Å; G275-A277 PolarHBondContact O-N 2.98Å; G275-S278 WeakPolarHBondContact O-CB 3.31Å; G275-S278 PolarHBondContact O-N 3.3Å
276	A	65.6	Low	67.6	Low	25 Å²	25	41.2 Å²	41.2	21%	0.207	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-31.4	175.7	0	0	0	0	0	113.1	V234 D272 C273 S278 V280	V234-A276 HydrophobicContact CB-CB 4.31Å; V234-A276 HydrophobicContact CG1-CB 3.86Å; V234-A276 WeakPolarHBondContact CG1-O 3.5Å; V234-A276 HydrophobicContact CG2-CB 4.23Å; D272-A276 WeakPolarHBondContact O-CB 3.4Å; D272-A276 PolarHBondContact O-N 3.26Å; C273-A276 PolarHBondContact O-N 3.13Å; A276-S278 VanDerWaalsContact C-N 3.26Å; A276-S278 PolarHBondContact O-N 3.39Å; A276-V280 WeakPolarHBondContact O-CG2 3.24Å
277	A	67.5	Low	67.7	Low	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-71.7	-19	175.9	0	0	0	0	0	113.4	A238 C273 V274 G275 G279 V280 I281 L289	A238-A277 HydrophobicContact CB-CB 4.01Å; C273-A277 PolarHBondContact O-N 3.43Å; V274-A277 PolarHBondContact O-N 3.27Å; G275-A277 PolarHBondContact O-N 2.98Å; A277-G279 PolarHBondContact O-N 2.98Å; A277-V280 PolarHBondContact O-N 2.98Å; A277-V280 VanDerWaalsContact O-N 3.1Å; A277-I281 HydrophobicContact CB-CD1 3.98Å; A277-I281 HydrophobicContact CB-CG1 4.15Å; A277-I281 WeakPolarHBondContact O-CG1 3.48Å; A277-I281 PolarHBondContact O-N 3.45Å; A277-L289 HydrophobicContact CB-CD2 4.15Å
278	S	69.7	Low	67.3	Low	51 Å²	51	47.1 Å²	47.1	36%	0.357	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	119.8	-179.8	-178.8	0	0	0	0	111.2	G275 A276 V280	G275-S278 WeakPolarHBondContact O-CB 3.31Å; G275-S278 PolarHBondContact O-N 3.3Å; A276-S278 VanDerWaalsContact C-N 3.26Å; A276-S278 PolarHBondContact O-N 3.39Å; S278-V280 VanDerWaalsContact C-N 3.26Å; S278-V280 PolarHBondContact O-N 3.47Å
279	G	68.1	Low	67.3	Low	80 Å²	80	46.7 Å²	46.7	83%	0.825	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	-0.2	-179.6	0	0	0	0	0	115.1	A277	A277-G279 PolarHBondContact O-N 2.98Å
280	V	71.7	Confident	67.3	Low	67 Å²	67	45.7 Å²	45.7	41%	0.406	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-42.3	174.1	-177.6	0	0	0	0	111.4	V234 A238 A276 A277 S278	V234-V280 HydrophobicContact CG1-CG2 4.08Å; A238-V280 HydrophobicContact CB-CB 3.76Å; A238-V280 HydrophobicContact CB-CG1 3.54Å; A238-V280 HydrophobicContact CB-CG2 4.45Å; A276-V280 WeakPolarHBondContact O-CG2 3.24Å; A277-V280 PolarHBondContact O-N 2.98Å; A277-V280 VanDerWaalsContact O-N 3.1Å; S278-V280 VanDerWaalsContact C-N 3.26Å; S278-V280 PolarHBondContact O-N 3.47Å
281	I	69	Low	67	Low	21 Å²	21	49.8 Å²	49.8	11%	0.108	28%	0.278	C	S	.	.	S	Bend	trans	-97.6	166.7	174	56.9	170.8	0	0	0	111.1	A238 A277 R285 H286	A238-I281 HydrophobicContact CB-CG2 4.15Å; A238-I281 WeakPolarHBondContact O-CG2 3.38Å; A277-I281 HydrophobicContact CB-CD1 3.98Å; A277-I281 HydrophobicContact CB-CG1 4.15Å; A277-I281 WeakPolarHBondContact O-CG1 3.48Å; A277-I281 PolarHBondContact O-N 3.45Å; I281-R285 HydrophobicContact CD1-CB 4.2Å; I281-R285 HydrophobicContact CD1-CG 4.04Å; I281-H286 HydrophobicContact CD1-CB 3.94Å; I281-H286 HydrophobicContact CG1-CB 4Å
282	D	74.4	Confident	66.8	Low	86 Å²	86	54.1 Å²	54.1	46%	0.46	29%	0.294	S	S	.	.			trans	-58.4	144.4	172.8	65.9	98.9	0	0	0	110.9	E284 R285 H286	D282-E284 PolarHBondContact O-N 3.42Å; D282-R285 PolarHBondContact O-N 3.12Å; D282-R285 WeakPolarHBondContact OD1-CB 3.3Å; D282-R285 PolarHBondContact OD1-N 3.43Å; D282-R285 WeakPolarHBondContact OD2-CB 3.28Å; D282-H286 PolarHBondContact O-N 2.8Å
283	Q	68.8	Low	66.8	Low	128 Å²	128	50.9 Å²	50.9	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-61.7	-36.2	-171.2	-158.1	-175.9	-8.7	0	0	111.6	H286 Y287	Q283-H286 WeakPolarHBondContact O-CB 3.28Å; Q283-H286 PolarHBondContact O-N 3.27Å; Q283-Y287 HydrophobicContact CB-CE2 4.5Å; Q283-Y287 HydrophobicContact CG-CD2 4.02Å; Q283-Y287 HydrophobicContact CG-CE2 3.53Å; Q283-Y287 PolarHBondContact NE2-OH 3.46Å; Q283-Y287 WeakPolarHBondContact O-CD2 3.44Å; Q283-Y287 PolarHBondContact O-N 3.03Å
284	E	67	Low	66.7	Low	160 Å²	160	50.4 Å²	50.4	75%	0.748	27%	0.274	S	S	*	.	H	α-helix	trans	-63.7	-47.4	178.3	-171.8	177.2	178.4	0	0	111.9	D282 H286 Y287 A288	D282-E284 PolarHBondContact O-N 3.42Å; E284-H286 VanDerWaalsContact C-N 3.29Å; E284-H286 PolarHBondContact O-N 2.96Å; E284-Y287 PolarHBondContact O-N 3.02Å; E284-A288 PolarHBondContact O-N 2.95Å
285	R	65.9	Low	66.2	Low	105 Å²	105	51.2 Å²	51.2	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-63.8	-35.5	174	-169.8	176.5	-179.3	-172.6	-5.1	112	N239 D242 I281 D282 A288 L289	N239-R285 PolarHBondContact O-NH2 2.87Å; D242-R285 IonicContact OD1-NH2 3.85Å; I281-R285 HydrophobicContact CD1-CB 4.2Å; I281-R285 HydrophobicContact CD1-CG 4.04Å; D282-R285 PolarHBondContact O-N 3.12Å; D282-R285 WeakPolarHBondContact OD1-CB 3.3Å; D282-R285 PolarHBondContact OD1-N 3.43Å; D282-R285 WeakPolarHBondContact OD2-CB 3.28Å; R285-A288 PolarHBondContact O-N 2.9Å; R285-L289 WeakPolarHBondContact O-CB 3.4Å; R285-L289 PolarHBondContact O-N 3.46Å
286	H	66.4	Low	66	Low	5 Å²	5	54.7 Å²	54.7	2%	0.023	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-45	174.1	-174.9	-108.4	0	0	0	112.1	V274 I281 D282 Q283 E284 L289 C290 H324	V274-H286 PolarHBondContact O-NE2 2.94Å; I281-H286 HydrophobicContact CD1-CB 3.94Å; I281-H286 HydrophobicContact CG1-CB 4Å; D282-H286 PolarHBondContact O-N 2.8Å; Q283-H286 WeakPolarHBondContact O-CB 3.28Å; Q283-H286 PolarHBondContact O-N 3.27Å; E284-H286 VanDerWaalsContact C-N 3.29Å; E284-H286 PolarHBondContact O-N 2.96Å; H286-L289 WeakPolarHBondContact O-CB 3.46Å; H286-L289 PolarHBondContact O-N 3.04Å; H286-C290 PolarHBondContact O-N 3.16Å; H286-C290 PolarHBondContact O-SG 3.05Å; H286-H324 PolarHBondContact CE1-O 3.43Å; H286-H324 VanDerWaalsContact CE1-O 3.32Å
287	Y	64.5	Low	66.2	Low	82 Å²	82	53.5 Å²	53.5	32%	0.322	28%	0.279	S	S	.	.	H	α-helix	trans	-59.3	-46.8	173.5	-79.3	-69.1	0	0	0	112.1	Q283 E284 L289 C290 E291 P326 L327	Q283-Y287 HydrophobicContact CB-CE2 4.5Å; Q283-Y287 HydrophobicContact CG-CD2 4.02Å; Q283-Y287 HydrophobicContact CG-CE2 3.53Å; Q283-Y287 PolarHBondContact NE2-OH 3.46Å; Q283-Y287 WeakPolarHBondContact O-CD2 3.44Å; Q283-Y287 PolarHBondContact O-N 3.03Å; E284-Y287 PolarHBondContact O-N 3.02Å; Y287-L289 VanDerWaalsContact C-N 3.3Å; Y287-L289 PolarHBondContact O-N 3.24Å; Y287-C290 WeakPolarHBondContact O-CB 3.36Å; Y287-C290 PolarHBondContact O-N 3.08Å; Y287-E291 PolarHBondContact O-N 2.89Å; Y287-P326 HydrophobicContact CD1-CB 4.11Å; Y287-P326 HydrophobicContact CD1-CG 3.69Å; Y287-P326 HydrophobicContact CE1-CB 3.28Å; Y287-P326 HydrophobicContact CE1-CG 3.39Å; Y287-P326 HydrophobicContact CE2-CG 4.49Å; Y287-P326 HydrophobicContact CG-CG 4.36Å; Y287-P326 WeakPolarHBondContact OH-CB 3.4Å; Y287-L327 HydrophobicContact CD1-CG 4.34Å; Y287-L327 HydrophobicContact CE1-CG 4.29Å
288	A	62.1	Low	65.7	Low	46 Å²	46	53.6 Å²	53.6	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-38.9	178.7	0	0	0	0	0	112.1	E284 R285 E291 R292	E284-A288 PolarHBondContact O-N 2.95Å; R285-A288 PolarHBondContact O-N 2.9Å; A288-E291 PolarHBondContact O-N 3.35Å; A288-R292 WeakPolarHBondContact O-CB 3.46Å; A288-R292 WeakPolarHBondContact O-CG 3.11Å; A288-R292 PolarHBondContact O-N 2.98Å
289	L	65.3	Low	65.2	Low	13 Å²	13	55.7 Å²	55.7	7%	0.068	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-44.9	174.8	-173.4	76	0	0	0	111.4	A241 L245 V274 A277 R285 H286 Y287 R292 C293	A241-L289 HydrophobicContact CB-CD1 3.85Å; A241-L289 HydrophobicContact CB-CD2 3.54Å; A241-L289 HydrophobicContact CB-CG 4.36Å; L245-L289 HydrophobicContact CB-CD1 4.29Å; L245-L289 HydrophobicContact CD2-CD1 3.64Å; L245-L289 HydrophobicContact CD2-CG 4.35Å; V274-L289 HydrophobicContact CB-CD2 4.33Å; V274-L289 HydrophobicContact CG1-CD2 4.3Å; V274-L289 HydrophobicContact CG2-CD2 3.9Å; V274-L289 HydrophobicContact CG2-CG 4.07Å; A277-L289 HydrophobicContact CB-CD2 4.15Å; R285-L289 WeakPolarHBondContact O-CB 3.4Å; R285-L289 PolarHBondContact O-N 3.46Å; H286-L289 WeakPolarHBondContact O-CB 3.46Å; H286-L289 PolarHBondContact O-N 3.04Å; Y287-L289 VanDerWaalsContact C-N 3.3Å; Y287-L289 PolarHBondContact O-N 3.24Å; L289-R292 PolarHBondContact O-N 3.33Å; L289-C293 VanDerWaalsContact O-CB 3.28Å; L289-C293 WeakPolarHBondContact O-CB 3.46Å; L289-C293 PolarHBondContact O-N 3.4Å
290	C	65.6	Low	65.1	Low	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-46.6	175.4	-70	0	0	0	0	111.5	V274 H286 Y287 C293 A294 F325	V274-C290 WeakPolarHBondContact CG1-SG 3.45Å; H286-C290 PolarHBondContact O-N 3.16Å; H286-C290 PolarHBondContact O-SG 3.05Å; Y287-C290 WeakPolarHBondContact O-CB 3.36Å; Y287-C290 PolarHBondContact O-N 3.08Å; C290-C293 PolarHBondContact O-N 2.61Å; C290-A294 VanDerWaalsContact O-CB 3.28Å; C290-A294 WeakPolarHBondContact O-CB 3.47Å; C290-A294 PolarHBondContact O-N 3.41Å; C290-F325 HydrophobicContact CB-CD1 3.54Å; C290-F325 HydrophobicContact CB-CE1 3.49Å; C290-F325 VanDerWaalsContact CB-CE1 3.49Å; C290-F325 HydrophobicContact CB-CG 4.45Å; C290-F325 HydrophobicContact CB-CZ 4.33Å
291	E	60.8	Low	64.5	Low	87 Å²	87	50.5 Å²	50.5	41%	0.407	23%	0.231	S	C	.	.	H	α-helix	trans	-62.5	-47.5	178.9	-166	-162.4	153.1	0	0	111.4	Y287 A288 A294 I295	Y287-E291 PolarHBondContact O-N 2.89Å; A288-E291 PolarHBondContact O-N 3.35Å; E291-A294 PolarHBondContact O-N 2.97Å; E291-A294 VanDerWaalsContact O-N 3.08Å; E291-I295 HydrophobicContact CG-CD1 3.92Å; E291-I295 WeakPolarHBondContact O-CD1 3.44Å; E291-I295 VanDerWaalsContact O-CG1 3.3Å; E291-I295 WeakPolarHBondContact O-CG1 3.24Å; E291-I295 PolarHBondContact O-N 3.24Å
292	R	63.5	Low	63.9	Low	91 Å²	91	53.2 Å²	53.2	34%	0.343	24%	0.243	S	C	.	.	H	α-helix	trans	-58.4	-53.1	176.3	-77.1	180	74.2	163.8	2.1	110.8	L245 E246 A288 L289 A294 I295 W296	L245-R292 HydrophobicContact CD2-CB 4.1Å; E246-R292 IonicContact OE2-CZ 3.36Å; E246-R292 IonicContact OE2-NH2 3.15Å; E246-R292 PolarHBondContact OE2-NH2 3.34Å; A288-R292 WeakPolarHBondContact O-CB 3.46Å; A288-R292 WeakPolarHBondContact O-CG 3.11Å; A288-R292 PolarHBondContact O-N 2.98Å; L289-R292 PolarHBondContact O-N 3.33Å; R292-A294 PolarHBondContact O-N 2.91Å; R292-A294 VanDerWaalsContact O-N 3.16Å; R292-I295 PolarHBondContact O-N 3.39Å; R292-W296 PolarHBondContact O-N 2.88Å
293	C	67.9	Low	63.1	Low	0 Å²	0	57.5 Å²	57.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-50.4	-43.1	175.8	-177.2	0	0	0	0	110.1	L245 I270 F271 V274 L289 C290 W296 F297	L245-C293 HydrophobicContact CD1-CB 4.21Å; L245-C293 HydrophobicContact CD2-CB 4.17Å; I270-C293 WeakPolarHBondContact CG2-SG 3.42Å; F271-C293 WeakPolarHBondContact CZ-SG 3.28Å; V274-C293 HydrophobicContact CG2-CB 4.14Å; L289-C293 VanDerWaalsContact O-CB 3.28Å; L289-C293 WeakPolarHBondContact O-CB 3.46Å; L289-C293 PolarHBondContact O-N 3.4Å; C290-C293 PolarHBondContact O-N 2.61Å; C293-W296 PolarHBondContact O-N 3.07Å; C293-F297 WeakPolarHBondContact O-CB 3.44Å; C293-F297 PolarHBondContact O-N 3.41Å
294	A	61.8	Low	62.6	Low	0 Å²	0	52.5 Å²	52.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.4	-44.5	-173.9	0	0	0	0	0	113.7	C290 E291 R292 W296 F297 G298 Y346 F347 I350	C290-A294 VanDerWaalsContact O-CB 3.28Å; C290-A294 WeakPolarHBondContact O-CB 3.47Å; C290-A294 PolarHBondContact O-N 3.41Å; E291-A294 PolarHBondContact O-N 2.97Å; E291-A294 VanDerWaalsContact O-N 3.08Å; R292-A294 PolarHBondContact O-N 2.91Å; R292-A294 VanDerWaalsContact O-N 3.16Å; A294-W296 VanDerWaalsContact C-N 3.32Å; A294-W296 PolarHBondContact O-N 2.89Å; A294-F297 PolarHBondContact O-N 3.21Å; A294-G298 PolarHBondContact O-N 2.95Å; A294-G298 VanDerWaalsContact O-N 3.07Å; A294-Y346 HydrophobicContact CB-CE1 4.38Å; A294-F347 HydrophobicContact CB-CD1 4.31Å; A294-F347 HydrophobicContact CB-CE1 3.76Å; A294-F347 WeakPolarHBondContact O-CD1 3.42Å; A294-F347 WeakPolarHBondContact O-CE1 3.12Å; A294-I350 HydrophobicContact CB-CD1 3.51Å
295	I	56.9	Low	62.1	Low	20 Å²	20	52.8 Å²	52.8	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-46.9	175.7	-70.2	157.1	0	0	0	110.7	E291 R292 G298 Y299 I350 K354	E291-I295 HydrophobicContact CG-CD1 3.92Å; E291-I295 WeakPolarHBondContact O-CD1 3.44Å; E291-I295 VanDerWaalsContact O-CG1 3.3Å; E291-I295 WeakPolarHBondContact O-CG1 3.24Å; E291-I295 PolarHBondContact O-N 3.24Å; R292-I295 PolarHBondContact O-N 3.39Å; I295-G298 WeakPolarHBondContact O-CA 3.36Å; I295-G298 PolarHBondContact O-N 3.2Å; I295-Y299 HydrophobicContact CG2-CD2 3.76Å; I295-Y299 HydrophobicContact CG2-CE2 3.52Å; I295-Y299 WeakPolarHBondContact O-CD2 3.42Å; I295-Y299 PolarHBondContact O-N 2.98Å; I295-I350 HydrophobicContact CB-CG2 4.49Å; I295-I350 HydrophobicContact CG1-CG2 3.73Å; I295-K354 HydrophobicContact CD1-CD 4.13Å; I295-K354 HydrophobicContact CG1-CD 4.32Å; I295-K354 HydrophobicContact CG2-CD 4.47Å
296	W	64.3	Low	61.7	Low	82 Å²	82	49.1 Å²	49.1	31%	0.311	22%	0.223	S	C	.	.	H	α-helix	trans	-71.6	-32.8	-176.7	-76.8	110.2	0	0	0	113.1	L249 W267 R292 C293 A294 G298 Y299 F300	L249-W296 HydrophobicContact CB-CD2 4.38Å; L249-W296 HydrophobicContact CD1-CB 3.72Å; L249-W296 HydrophobicContact CD1-CD2 3.77Å; L249-W296 HydrophobicContact CD1-CG 3.29Å; L249-W296 HydrophobicContact CD2-CB 3.26Å; L249-W296 HydrophobicContact CD2-CD2 4.37Å; L249-W296 HydrophobicContact CD2-CG 3.8Å; L249-W296 HydrophobicContact CG-CB 4.01Å; L249-W296 HydrophobicContact CG-CD2 4.38Å; L249-W296 HydrophobicContact CG-CG 4.01Å; W267-W296 HydrophobicContact CH2-CB 4.27Å; R292-W296 PolarHBondContact O-N 2.88Å; C293-W296 PolarHBondContact O-N 3.07Å; A294-W296 VanDerWaalsContact C-N 3.32Å; A294-W296 PolarHBondContact O-N 2.89Å; W296-G298 VanDerWaalsContact C-N 3.29Å; W296-G298 PolarHBondContact O-N 3.28Å; W296-Y299 HydrophobicContact CE3-CD2 4.36Å; W296-Y299 PolarHBondContact O-N 3.07Å; W296-F300 WeakPolarHBondContact O-CB 3.44Å; W296-F300 PolarHBondContact O-N 2.88Å
297	F	68.1	Low	61.2	Low	0 Å²	0	55.3 Å²	55.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-44.4	169.1	-172.1	-107	0	0	0	110.7	W267 F271 C293 A294 Y299 F300 L301 L314 L315 L318 F347	W267-F297 HydrophobicContact CB-CE2 4.33Å; W267-F297 AromaticContact CD2-CD2 3.38Å; W267-F297 HydrophobicContact CD2-CD2 3.38Å; W267-F297 AromaticContact CD2-CE2 3.83Å; W267-F297 HydrophobicContact CD2-CE2 3.83Å; W267-F297 AromaticContact CE2-CD2 3.57Å; W267-F297 HydrophobicContact CE3-CB 4.35Å; W267-F297 AromaticContact CE3-CD2 3.48Å; W267-F297 HydrophobicContact CE3-CD2 3.48Å; W267-F297 VanDerWaalsContact CE3-CD2 3.48Å; W267-F297 HydrophobicContact CE3-CE2 4.22Å; W267-F297 HydrophobicContact CE3-CG 4.38Å; W267-F297 AromaticContact CG-CD2 3.92Å; W267-F297 HydrophobicContact CG-CD2 3.92Å; W267-F297 AromaticContact CG-CE2 3.84Å; W267-F297 HydrophobicContact CG-CE2 3.84Å; W267-F297 HydrophobicContact CH2-CB 3.68Å; W267-F297 AromaticContact CH2-CD2 3.96Å; W267-F297 HydrophobicContact CH2-CD2 3.96Å; W267-F297 HydrophobicContact CH2-CG 4.35Å; W267-F297 HydrophobicContact CZ2-CB 4.2Å; W267-F297 AromaticContact CZ2-CD2 3.88Å; W267-F297 HydrophobicContact CZ2-CD2 3.88Å; W267-F297 HydrophobicContact CZ3-CB 3.74Å; W267-F297 AromaticContact CZ3-CD2 3.75Å; W267-F297 HydrophobicContact CZ3-CD2 3.75Å; W267-F297 HydrophobicContact CZ3-CG 4.25Å; F271-F297 HydrophobicContact CE2-CD2 4.14Å; F271-F297 HydrophobicContact CE2-CE2 4.46Å; C293-F297 WeakPolarHBondContact O-CB 3.44Å; C293-F297 PolarHBondContact O-N 3.41Å; A294-F297 PolarHBondContact O-N 3.21Å; F297-Y299 PolarHBondContact O-N 2.89Å; F297-F300 HydrophobicContact CD2-CD1 4.21Å; F297-F300 HydrophobicContact CE2-CD1 4.29Å; F297-F300 HydrophobicContact CE2-CE1 4.47Å; F297-F300 WeakPolarHBondContact O-CB 3.37Å; F297-F300 PolarHBondContact O-N 3.06Å; F297-L301 HydrophobicContact CD1-CD1 3.83Å; F297-L301 HydrophobicContact CD1-CG 4.12Å; F297-L301 HydrophobicContact CE1-CD1 3.6Å; F297-L301 HydrophobicContact CE1-CD2 4.22Å; F297-L301 HydrophobicContact CE1-CG 3.98Å; F297-L301 HydrophobicContact CZ-CD1 4.37Å; F297-L301 HydrophobicContact CZ-CD2 4.17Å; F297-L301 HydrophobicContact CZ-CG 4.38Å; F297-L301 WeakPolarHBondContact O-CG 3.45Å; F297-L301 PolarHBondContact O-N 2.88Å; F297-L314 HydrophobicContact CE2-CD2 3.64Å; F297-L314 HydrophobicContact CE2-CG 4.14Å; F297-L314 HydrophobicContact CZ-CD2 3.62Å; F297-L314 HydrophobicContact CZ-CG 3.99Å; F297-L315 HydrophobicContact CE1-CD2 4.26Å; F297-L315 HydrophobicContact CZ-CD2 4.45Å; F297-L318 HydrophobicContact CE2-CD1 3.66Å; F297-L318 HydrophobicContact CZ-CD1 3.66Å; F297-F347 HydrophobicContact CB-CD1 4.1Å; F297-F347 HydrophobicContact CB-CE1 3.56Å; F297-F347 HydrophobicContact CB-CZ 4.15Å; F297-F347 HydrophobicContact CD1-CB 4.49Å; F297-F347 AromaticContact CD1-CD1 3.45Å; F297-F347 HydrophobicContact CD1-CD1 3.45Å; F297-F347 VanDerWaalsContact CD1-CD1 3.45Å; F297-F347 AromaticContact CD1-CD2 3.67Å; F297-F347 HydrophobicContact CD1-CD2 3.67Å; F297-F347 AromaticContact CD1-CE1 3.32Å; F297-F347 HydrophobicContact CD1-CE1 3.32Å; F297-F347 AromaticContact CD1-CE2 3.6Å; F297-F347 HydrophobicContact CD1-CE2 3.6Å; F297-F347 AromaticContact CD1-CG 3.62Å; F297-F347 HydrophobicContact CD1-CG 3.62Å; F297-F347 AromaticContact CD1-CZ 3.46Å; F297-F347 HydrophobicContact CD1-CZ 3.46Å; F297-F347 VanDerWaalsContact CD1-CZ 3.46Å; F297-F347 HydrophobicContact CE1-CD1 4.34Å; F297-F347 AromaticContact CE1-CD2 3.73Å; F297-F347 HydrophobicContact CE1-CD2 3.73Å; F297-F347 HydrophobicContact CE1-CE1 4.26Å; F297-F347 AromaticContact CE1-CE2 3.71Å; F297-F347 HydrophobicContact CE1-CE2 3.71Å; F297-F347 HydrophobicContact CE1-CG 4.08Å; F297-F347 HydrophobicContact CE1-CZ 4.02Å; F297-F347 HydrophobicContact CG-CD1 4.2Å; F297-F347 AromaticContact CG-CE1 3.73Å; F297-F347 HydrophobicContact CG-CE1 3.73Å; F297-F347 HydrophobicContact CG-CE2 4.46Å; F297-F347 AromaticContact CG-CZ 3.95Å; F297-F347 HydrophobicContact CG-CZ 3.95Å
298	G	58.1	Low	60.5	Low	2 Å²	2	52.2 Å²	52.2	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-55.7	-47.2	172.8	0	0	0	0	0	113.6	A294 I295 W296 F300 L301 Q302	A294-G298 PolarHBondContact O-N 2.95Å; A294-G298 VanDerWaalsContact O-N 3.07Å; I295-G298 WeakPolarHBondContact O-CA 3.36Å; I295-G298 PolarHBondContact O-N 3.2Å; W296-G298 VanDerWaalsContact C-N 3.29Å; W296-G298 PolarHBondContact O-N 3.28Å; G298-F300 VanDerWaalsContact C-N 3.33Å; G298-F300 PolarHBondContact O-N 3.37Å; G298-L301 PolarHBondContact O-N 3.11Å; G298-Q302 PolarHBondContact O-N 2.93Å
299	Y	58.3	Low	60.1	Low	94 Å²	94	54 Å²	54	37%	0.369	24%	0.24	S	C	.	.	H	α-helix	trans	-62.5	-39.3	175	-81.5	-60.5	0	0	0	113	I295 W296 F297 Q302 R303	I295-Y299 HydrophobicContact CG2-CD2 3.76Å; I295-Y299 HydrophobicContact CG2-CE2 3.52Å; I295-Y299 WeakPolarHBondContact O-CD2 3.42Å; I295-Y299 PolarHBondContact O-N 2.98Å; W296-Y299 HydrophobicContact CE3-CD2 4.36Å; W296-Y299 PolarHBondContact O-N 3.07Å; F297-Y299 PolarHBondContact O-N 2.89Å; Y299-Q302 PolarHBondContact O-N 3.45Å; Y299-R303 PolarHBondContact O-N 3.34Å
300	F	65.8	Low	59.7	Low	9 Å²	9	54.8 Å²	54.8	4%	0.039	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-48.8	175.3	157.2	-98	0	0	0	111.5	A252 V263 W267 W296 F297 G298 Q302 R303 C304 V306 L314	A252-F300 HydrophobicContact CB-CD2 4.5Å; V263-F300 HydrophobicContact CB-CE2 4.4Å; V263-F300 HydrophobicContact CB-CZ 4.48Å; V263-F300 HydrophobicContact CG1-CD2 4.17Å; V263-F300 HydrophobicContact CG1-CE1 4.07Å; V263-F300 HydrophobicContact CG1-CE2 3.08Å; V263-F300 HydrophobicContact CG1-CZ 3.04Å; V263-F300 HydrophobicContact CG2-CE2 4.48Å; W267-F300 AromaticContact CD1-CD1 3.86Å; W267-F300 AromaticContact CD1-CE1 3.72Å; W267-F300 AromaticContact CE2-CD1 3.67Å; W267-F300 AromaticContact CE2-CG 3.71Å; W267-F300 HydrophobicContact CZ2-CB 3.49Å; W267-F300 VanDerWaalsContact CZ2-CB 3.49Å; W267-F300 HydrophobicContact CZ2-CD1 4.03Å; W267-F300 AromaticContact CZ2-CG 3.76Å; W267-F300 HydrophobicContact CZ2-CG 3.76Å; W267-F300 AromaticContact NE1-CD1 3.05Å; W267-F300 AromaticContact NE1-CD2 3.53Å; W267-F300 AromaticContact NE1-CE1 3.36Å; W267-F300 AromaticContact NE1-CE2 3.82Å; W267-F300 AromaticContact NE1-CG 3.16Å; W267-F300 AromaticContact NE1-CZ 3.77Å; W296-F300 WeakPolarHBondContact O-CB 3.44Å; W296-F300 PolarHBondContact O-N 2.88Å; F297-F300 HydrophobicContact CD2-CD1 4.21Å; F297-F300 HydrophobicContact CE2-CD1 4.29Å; F297-F300 HydrophobicContact CE2-CE1 4.47Å; F297-F300 WeakPolarHBondContact O-CB 3.37Å; F297-F300 PolarHBondContact O-N 3.06Å; G298-F300 VanDerWaalsContact C-N 3.33Å; G298-F300 PolarHBondContact O-N 3.37Å; F300-Q302 PolarHBondContact O-N 2.87Å; F300-R303 PolarHBondContact O-N 3.3Å; F300-R303 VanDerWaalsContact O-N 3.11Å; F300-C304 HydrophobicContact CD2-CB 4.23Å; F300-C304 VanDerWaalsContact CD2-SG 3.54Å; F300-C304 HydrophobicContact CE2-CB 3.7Å; F300-C304 WeakPolarHBondContact CE2-SG 2.97Å; F300-C304 HydrophobicContact CZ-CB 4.1Å; F300-C304 WeakPolarHBondContact O-CB 2.99Å; F300-C304 PolarHBondContact O-N 3.33Å; F300-V306 HydrophobicContact CE1-CG2 4.08Å; F300-V306 HydrophobicContact CZ-CG2 3.91Å; F300-L314 HydrophobicContact CE1-CD2 3.89Å
301	L	61.1	Low	59.5	Low	29 Å²	29	56.1 Å²	56.1	15%	0.152	25%	0.25	C	S	.	.	H	α-helix	trans	-57.5	-39.1	176.3	-68.6	-176.6	0	0	0	111.6	F297 G298 V306 L311 L314	F297-L301 HydrophobicContact CD1-CD1 3.83Å; F297-L301 HydrophobicContact CD1-CG 4.12Å; F297-L301 HydrophobicContact CE1-CD1 3.6Å; F297-L301 HydrophobicContact CE1-CD2 4.22Å; F297-L301 HydrophobicContact CE1-CG 3.98Å; F297-L301 HydrophobicContact CZ-CD1 4.37Å; F297-L301 HydrophobicContact CZ-CD2 4.17Å; F297-L301 HydrophobicContact CZ-CG 4.38Å; F297-L301 WeakPolarHBondContact O-CG 3.45Å; F297-L301 PolarHBondContact O-N 2.88Å; G298-L301 PolarHBondContact O-N 3.11Å; L301-V306 HydrophobicContact CD2-CB 4.25Å; L301-V306 HydrophobicContact CD2-CG2 4.04Å; L301-L311 HydrophobicContact CD1-CD1 3.84Å; L301-L311 HydrophobicContact CD2-CD1 3.62Å; L301-L311 HydrophobicContact CG-CD1 4.39Å; L301-L314 HydrophobicContact CD2-CD2 4.46Å
302	Q	55.6	Low	59.1	Low	79 Å²	79	54.6 Å²	54.6	37%	0.369	25%	0.247	S	C	.	.	H	α-helix	trans	-67.2	-41	176.9	-170.4	-177.3	30.5	0	0	112.7	G298 Y299 F300	G298-Q302 PolarHBondContact O-N 2.93Å; Y299-Q302 PolarHBondContact O-N 3.45Å; F300-Q302 PolarHBondContact O-N 2.87Å
303	R	57.9	Low	58.9	Low	175 Å²	175	53.8 Å²	53.8	66%	0.66	25%	0.252	S	S	*	.	H	α-helix	trans	-74.9	-41.9	-177.7	-84.1	-172.7	167.5	170.1	-2.9	112.9	Y299 F300 Q305	Y299-R303 PolarHBondContact O-N 3.34Å; F300-R303 PolarHBondContact O-N 3.3Å; F300-R303 VanDerWaalsContact O-N 3.11Å; R303-Q305 PolarHBondContact O-N 3.32Å
304	C	57.5	Low	58.7	Low	24 Å²	24	53.8 Å²	53.8	16%	0.162	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	5.9	-169.3	-66.8	0	0	0	0	114.6	F300 V306	F300-C304 HydrophobicContact CD2-CB 4.23Å; F300-C304 VanDerWaalsContact CD2-SG 3.54Å; F300-C304 HydrophobicContact CE2-CB 3.7Å; F300-C304 WeakPolarHBondContact CE2-SG 2.97Å; F300-C304 HydrophobicContact CZ-CB 4.1Å; F300-C304 WeakPolarHBondContact O-CB 2.99Å; F300-C304 PolarHBondContact O-N 3.33Å; C304-V306 HydrophobicContact CB-CG2 3.86Å; C304-V306 PolarHBondContact O-N 3.04Å
305	Q	56.8	Low	58.6	Low	166 Å²	166	53.9 Å²	53.9	78%	0.776	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	39.1	178.9	-58.4	-173.7	17.4	0	0	113.3	R303 R307	R303-Q305 PolarHBondContact O-N 3.32Å; Q305-R307 PolarHBondContact O-N 3.47Å
306	V	58.3	Low	58.7	Low	28 Å²	28	55.6 Å²	55.6	17%	0.17	27%	0.267	C	S	.	.			trans	-58	124.2	-173.3	-176.8	0	0	0	0	109.3	F300 L301 C304 E310 L311	F300-V306 HydrophobicContact CE1-CG2 4.08Å; F300-V306 HydrophobicContact CZ-CG2 3.91Å; L301-V306 HydrophobicContact CD2-CB 4.25Å; L301-V306 HydrophobicContact CD2-CG2 4.04Å; C304-V306 HydrophobicContact CB-CG2 3.86Å; C304-V306 PolarHBondContact O-N 3.04Å; V306-E310 HydrophobicContact CG1-CB 3.55Å; V306-L311 HydrophobicContact CG1-CB 4.12Å
307	R	54.9	Low	58.4	Low	135 Å²	135	55 Å²	55	51%	0.509	27%	0.269	S	S	.	.			trans	-69.6	154.4	179.5	-61.3	-175.5	-63.9	140.2	17.7	110.2	Q305 D309 E310 L311	Q305-R307 PolarHBondContact O-N 3.47Å; R307-D309 VanDerWaalsContact C-N 3.29Å; R307-D309 WeakPolarHBondContact CB-OD1 3.44Å; R307-D309 IonicContact CZ-OD1 2.66Å; R307-D309 IonicContact CZ-OD2 3.41Å; R307-D309 VanDerWaalsContact CZ-OD2 3.32Å; R307-D309 IonicContact NE-OD1 3.75Å; R307-D309 IonicContact NH1-OD2 2.75Å; R307-D309 IonicContact NH2-OD1 2.98Å; R307-D309 IonicContact NH2-OD2 2.67Å; R307-D309 PolarHBondContact NH2-OD2 3.46Å; R307-D309 PolarHBondContact O-N 2.9Å; R307-E310 HydrophobicContact CB-CG 4.26Å; R307-E310 IonicContact CZ-OE1 2.74Å; R307-E310 PolarHBondContact N-OE2 3.32Å; R307-E310 IonicContact NE-OE1 3.89Å; R307-E310 PolarHBondContact NE-OE1 3.36Å; R307-E310 IonicContact NH2-OE1 3.1Å; R307-E310 PolarHBondContact NH2-OE1 3.41Å; R307-E310 CarbonylContact O-C 3.51Å; R307-E310 WeakPolarHBondContact O-CA 3.43Å; R307-E310 WeakPolarHBondContact O-CB 3.46Å; R307-E310 PolarHBondContact O-N 2.88Å; R307-L311 PolarHBondContact O-N 3.18Å
308	A	49.3	Very low	58.1	Low	17 Å²	17	55 Å²	55	14%	0.14	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-36.1	-177.9	0	0	0	0	0	114.6	E310 L311 T312 Q375	A308-E310 VanDerWaalsContact C-N 3.31Å; A308-L311 PolarHBondContact O-N 2.95Å; A308-T312 WeakPolarHBondContact O-CB 3.07Å; A308-T312 PolarHBondContact O-N 3.47Å; A308-T312 PolarHBondContact O-OG1 3.25Å; A308-Q375 HydrophobicContact CB-CB 4.19Å; A308-Q375 HydrophobicContact CB-CG 3.9Å
309	D	54	Low	58	Low	82 Å²	82	55 Å²	55	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-61.4	-42.6	173.3	55.7	-42	0	0	0	111	R307 T312 V313	R307-D309 VanDerWaalsContact C-N 3.29Å; R307-D309 WeakPolarHBondContact CB-OD1 3.44Å; R307-D309 IonicContact CZ-OD1 2.66Å; R307-D309 IonicContact CZ-OD2 3.41Å; R307-D309 VanDerWaalsContact CZ-OD2 3.32Å; R307-D309 IonicContact NE-OD1 3.75Å; R307-D309 IonicContact NH1-OD2 2.75Å; R307-D309 IonicContact NH2-OD1 2.98Å; R307-D309 IonicContact NH2-OD2 2.67Å; R307-D309 PolarHBondContact NH2-OD2 3.46Å; R307-D309 PolarHBondContact O-N 2.9Å; D309-T312 PolarHBondContact O-N 2.95Å; D309-V313 WeakPolarHBondContact O-CG2 3.4Å; D309-V313 PolarHBondContact O-N 3.09Å
310	E	58.1	Low	57.9	Low	30 Å²	30	53.9 Å²	53.9	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-69.6	-40.8	178.2	-63.8	168.2	-176.3	0	0	111.9	K260 V306 R307 A308 T312 V313 L314	K260-E310 IonicContact NZ-OE1 3.98Å; K260-E310 PolarHBondContact NZ-OE1 3.16Å; K260-E310 IonicContact NZ-OE2 3.64Å; K260-E310 PolarHBondContact NZ-OE2 2.96Å; V306-E310 HydrophobicContact CG1-CB 3.55Å; R307-E310 HydrophobicContact CB-CG 4.26Å; R307-E310 IonicContact CZ-OE1 2.74Å; R307-E310 PolarHBondContact N-OE2 3.32Å; R307-E310 IonicContact NE-OE1 3.89Å; R307-E310 PolarHBondContact NE-OE1 3.36Å; R307-E310 IonicContact NH2-OE1 3.1Å; R307-E310 PolarHBondContact NH2-OE1 3.41Å; R307-E310 CarbonylContact O-C 3.51Å; R307-E310 WeakPolarHBondContact O-CA 3.43Å; R307-E310 WeakPolarHBondContact O-CB 3.46Å; R307-E310 PolarHBondContact O-N 2.88Å; A308-E310 VanDerWaalsContact C-N 3.31Å; E310-T312 VanDerWaalsContact C-N 3.32Å; E310-V313 PolarHBondContact O-N 2.78Å; E310-L314 VanDerWaalsContact O-CB 3.29Å; E310-L314 WeakPolarHBondContact O-CB 3.34Å; E310-L314 PolarHBondContact O-N 2.86Å
311	L	59.6	Low	57.5	Low	28 Å²	28	57 Å²	57	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-40.7	173.4	179.3	62.5	0	0	0	110.5	L301 V306 R307 A308 L314 L315	L301-L311 HydrophobicContact CD1-CD1 3.84Å; L301-L311 HydrophobicContact CD2-CD1 3.62Å; L301-L311 HydrophobicContact CG-CD1 4.39Å; V306-L311 HydrophobicContact CG1-CB 4.12Å; R307-L311 PolarHBondContact O-N 3.18Å; A308-L311 PolarHBondContact O-N 2.95Å; L311-L314 PolarHBondContact O-N 3.21Å; L311-L315 HydrophobicContact CD1-CD1 3.8Å; L311-L315 HydrophobicContact CD1-CD2 4.42Å; L311-L315 HydrophobicContact CD1-CG 3.81Å; L311-L315 HydrophobicContact CD2-CD1 4.31Å; L311-L315 HydrophobicContact CG-CD1 3.68Å; L311-L315 HydrophobicContact CG-CG 4.12Å; L311-L315 WeakPolarHBondContact O-CB 3.45Å; L311-L315 WeakPolarHBondContact O-CG 3.14Å; L311-L315 PolarHBondContact O-N 2.98Å
312	T	52.7	Low	57.4	Low	55 Å²	55	55.8 Å²	55.8	34%	0.337	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-41.8	178	-56.5	0	0	0	0	111.2	A308 D309 E310 S316 V340	A308-T312 WeakPolarHBondContact O-CB 3.07Å; A308-T312 PolarHBondContact O-N 3.47Å; A308-T312 PolarHBondContact O-OG1 3.25Å; D309-T312 PolarHBondContact O-N 2.95Å; E310-T312 VanDerWaalsContact C-N 3.32Å; T312-S316 VanDerWaalsContact O-CB 3.26Å; T312-S316 WeakPolarHBondContact O-CB 3.4Å; T312-S316 PolarHBondContact O-N 2.79Å; T312-S316 PolarHBondContact O-OG 2.87Å; T312-V340 HydrophobicContact CG2-CG1 4.28Å
313	V	60.3	Low	57.3	Low	75 Å²	75	56.4 Å²	56.4	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-66.8	-43.9	175.2	172.8	0	0	0	0	111.3	D309 E310 S316 L317	D309-V313 WeakPolarHBondContact O-CG2 3.4Å; D309-V313 PolarHBondContact O-N 3.09Å; E310-V313 PolarHBondContact O-N 2.78Å; V313-S316 WeakPolarHBondContact CA-OG 3.42Å; V313-S316 PolarHBondContact O-N 2.82Å; V313-S316 PolarHBondContact O-OG 3.29Å; V313-L317 HydrophobicContact CG1-CD1 4.25Å; V313-L317 VanDerWaalsContact O-CG 3.28Å; V313-L317 WeakPolarHBondContact O-CG 3.46Å; V313-L317 PolarHBondContact O-N 2.86Å
314	L	62.9	Low	57.1	Low	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-50.6	177.1	179.3	56.7	0	0	0	110.2	N264 W267 F297 F300 L301 E310 L311 S316 L317 L318	N264-L314 HydrophobicContact CB-CD1 4.13Å; W267-L314 HydrophobicContact CB-CD1 4.07Å; F297-L314 HydrophobicContact CE2-CD2 3.64Å; F297-L314 HydrophobicContact CE2-CG 4.14Å; F297-L314 HydrophobicContact CZ-CD2 3.62Å; F297-L314 HydrophobicContact CZ-CG 3.99Å; F300-L314 HydrophobicContact CE1-CD2 3.89Å; L301-L314 HydrophobicContact CD2-CD2 4.46Å; E310-L314 VanDerWaalsContact O-CB 3.29Å; E310-L314 WeakPolarHBondContact O-CB 3.34Å; E310-L314 PolarHBondContact O-N 2.86Å; L311-L314 PolarHBondContact O-N 3.21Å; L314-S316 VanDerWaalsContact C-N 3.31Å; L314-S316 PolarHBondContact O-N 3.45Å; L314-L317 WeakPolarHBondContact O-CB 3.36Å; L314-L317 PolarHBondContact O-N 3.29Å; L314-L318 HydrophobicContact CD1-CD1 3.79Å; L314-L318 HydrophobicContact CD1-CG 4.07Å; L314-L318 HydrophobicContact CG-CD1 3.82Å; L314-L318 HydrophobicContact CG-CG 4.42Å; L314-L318 WeakPolarHBondContact O-CB 3.44Å; L314-L318 WeakPolarHBondContact O-CG 3.44Å; L314-L318 PolarHBondContact O-N 2.83Å
315	L	60.9	Low	56.9	Low	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-37.8	176.6	-70.3	175.3	0	0	0	111.8	F297 L311 L317 L318 V319 V340 V343 F347	F297-L315 HydrophobicContact CE1-CD2 4.26Å; F297-L315 HydrophobicContact CZ-CD2 4.45Å; L311-L315 HydrophobicContact CD1-CD1 3.8Å; L311-L315 HydrophobicContact CD1-CD2 4.42Å; L311-L315 HydrophobicContact CD1-CG 3.81Å; L311-L315 HydrophobicContact CD2-CD1 4.31Å; L311-L315 HydrophobicContact CG-CD1 3.68Å; L311-L315 HydrophobicContact CG-CG 4.12Å; L311-L315 WeakPolarHBondContact O-CB 3.45Å; L311-L315 WeakPolarHBondContact O-CG 3.14Å; L311-L315 PolarHBondContact O-N 2.98Å; L315-L317 PolarHBondContact O-N 3.24Å; L315-L318 CarbonylContact O-C 3.35Å; L315-L318 PolarHBondContact O-N 3.3Å; L315-L318 VanDerWaalsContact O-N 3.15Å; L315-V319 VanDerWaalsContact O-CB 3.29Å; L315-V319 WeakPolarHBondContact O-CB 3.42Å; L315-V319 WeakPolarHBondContact O-CG2 3.17Å; L315-V319 PolarHBondContact O-N 2.82Å; L315-V340 HydrophobicContact CB-CB 4.21Å; L315-V340 HydrophobicContact CB-CG1 3.53Å; L315-V340 HydrophobicContact CB-CG2 4.12Å; L315-V340 HydrophobicContact CD1-CG1 3.85Å; L315-V340 HydrophobicContact CG-CG1 4.35Å; L315-V343 HydrophobicContact CD2-CB 4.25Å; L315-V343 HydrophobicContact CD2-CG1 3.62Å; L315-F347 HydrophobicContact CD2-CD2 4.38Å; L315-F347 HydrophobicContact CD2-CE2 4.49Å
316	S	57.2	Low	56.4	Low	57 Å²	57	44 Å²	44	40%	0.399	23%	0.23	S	C	.	.	H	α-helix	trans	-69	-33.2	177.9	70.6	0	0	0	0	113	T312 V313 L314 L318 P320	T312-S316 VanDerWaalsContact O-CB 3.26Å; T312-S316 WeakPolarHBondContact O-CB 3.4Å; T312-S316 PolarHBondContact O-N 2.79Å; T312-S316 PolarHBondContact O-OG 2.87Å; V313-S316 WeakPolarHBondContact CA-OG 3.42Å; V313-S316 PolarHBondContact O-N 2.82Å; V313-S316 PolarHBondContact O-OG 3.29Å; L314-S316 VanDerWaalsContact C-N 3.31Å; L314-S316 PolarHBondContact O-N 3.45Å; S316-L318 VanDerWaalsContact C-N 3.29Å; S316-P320 VanDerWaalsContact O-CD 3.28Å; S316-P320 WeakPolarHBondContact O-CD 3.27Å
317	L	59.6	Low	55.8	Low	69 Å²	69	45.6 Å²	45.6	36%	0.361	24%	0.238	S	C	.	.	H	α-helix	trans	-66.8	-35.3	170	-70.8	169.2	0	0	0	111.7	N264 V268 V313 L314 L315 R321	N264-L317 HydrophobicContact CB-CD1 4.45Å; V268-L317 HydrophobicContact CG2-CB 4.03Å; V313-L317 HydrophobicContact CG1-CD1 4.25Å; V313-L317 VanDerWaalsContact O-CG 3.28Å; V313-L317 WeakPolarHBondContact O-CG 3.46Å; V313-L317 PolarHBondContact O-N 2.86Å; L314-L317 WeakPolarHBondContact O-CB 3.36Å; L314-L317 PolarHBondContact O-N 3.29Å; L315-L317 PolarHBondContact O-N 3.24Å; L317-R321 PolarHBondContact O-NH1 2.65Å
318	L	61.5	Low	55.3	Low	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-82.7	-41.1	-173.1	-79.4	-171.3	0	0	0	112.2	W267 V268 F271 F297 L314 L315 S316 P320 R321 Y322	W267-L318 HydrophobicContact CB-CD1 4.44Å; W267-L318 HydrophobicContact CB-CD2 4.47Å; V268-L318 HydrophobicContact CG2-CD2 4.08Å; F271-L318 HydrophobicContact CB-CD2 3.88Å; F271-L318 HydrophobicContact CD2-CD1 3.9Å; F271-L318 HydrophobicContact CD2-CD2 3.34Å; F271-L318 HydrophobicContact CD2-CG 4.2Å; F271-L318 HydrophobicContact CE2-CD1 3.9Å; F271-L318 HydrophobicContact CE2-CD2 4.2Å; F271-L318 HydrophobicContact CG-CD2 3.76Å; F297-L318 HydrophobicContact CE2-CD1 3.66Å; F297-L318 HydrophobicContact CZ-CD1 3.66Å; L314-L318 HydrophobicContact CD1-CD1 3.79Å; L314-L318 HydrophobicContact CD1-CG 4.07Å; L314-L318 HydrophobicContact CG-CD1 3.82Å; L314-L318 HydrophobicContact CG-CG 4.42Å; L314-L318 WeakPolarHBondContact O-CB 3.44Å; L314-L318 WeakPolarHBondContact O-CG 3.44Å; L314-L318 PolarHBondContact O-N 2.83Å; L315-L318 CarbonylContact O-C 3.35Å; L315-L318 PolarHBondContact O-N 3.3Å; L315-L318 VanDerWaalsContact O-N 3.15Å; S316-L318 VanDerWaalsContact C-N 3.29Å; L318-P320 VanDerWaalsContact O-N 3.15Å; L318-R321 WeakPolarHBondContact O-CA 3.28Å; L318-R321 VanDerWaalsContact O-CB 3.27Å; L318-R321 WeakPolarHBondContact O-CB 2.98Å; L318-R321 PolarHBondContact O-N 3.28Å; L318-Y322 VanDerWaalsContact C-CD2 3.49Å; L318-Y322 HydrophobicContact CB-CD2 3.96Å; L318-Y322 HydrophobicContact CB-CE2 3.38Å; L318-Y322 HydrophobicContact CD1-CE2 4.02Å; L318-Y322 WeakPolarHBondContact CD1-OH 3.46Å; L318-Y322 HydrophobicContact CD2-CE2 4.12Å; L318-Y322 HydrophobicContact CG-CE2 4Å; L318-Y322 WeakPolarHBondContact O-CD2 3.26Å; L318-Y322 PolarHBondContact O-N 2.9Å
319	V	55.4	Low	55	Low	3 Å²	3	46.9 Å²	46.9	2%	0.018	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-42.3	-50.5	-177.6	146.3	0	0	0	0	115.3	L315 R321 Y322 T339 V340 V343	L315-V319 VanDerWaalsContact O-CB 3.29Å; L315-V319 WeakPolarHBondContact O-CB 3.42Å; L315-V319 WeakPolarHBondContact O-CG2 3.17Å; L315-V319 PolarHBondContact O-N 2.82Å; V319-R321 PolarHBondContact O-N 2.96Å; V319-R321 VanDerWaalsContact O-N 3.16Å; V319-Y322 PolarHBondContact O-N 3.31Å; V319-Y322 VanDerWaalsContact O-N 3.13Å; V319-T339 HydrophobicContact CB-CG2 4.16Å; V319-T339 HydrophobicContact CG1-CG2 3.56Å; V319-T339 HydrophobicContact CG2-CG2 3.8Å; V319-T339 WeakPolarHBondContact CG2-O 3.43Å; V319-V340 HydrophobicContact CB-CG2 4.48Å; V319-V340 HydrophobicContact CG2-CB 4.3Å; V319-V340 HydrophobicContact CG2-CG2 3.67Å; V319-V343 HydrophobicContact CG2-CG2 4.21Å
320	P	56.3	Low	54.1	Low	69 Å²	69	45 Å²	45	45%	0.448	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-63.5	-24.4	-179.4	-22.6	34.7	0	0	0	113	S316 L318	S316-P320 VanDerWaalsContact O-CD 3.28Å; S316-P320 WeakPolarHBondContact O-CD 3.27Å; L318-P320 VanDerWaalsContact O-N 3.15Å
321	R	58.4	Low	52.9	Low	74 Å²	74	48.7 Å²	48.7	28%	0.279	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-90.3	-12.9	-178.2	-57.3	164.6	162.8	82.8	4	112.4	F271 D272 L317 L318 V319 H324	F271-R321 HydrophobicContact CB-CB 4.31Å; D272-R321 WeakPolarHBondContact OD1-CD 3.4Å; D272-R321 VanDerWaalsContact OD1-CG 3.31Å; D272-R321 WeakPolarHBondContact OD1-CG 3.1Å; D272-R321 IonicContact OD1-CZ 2.7Å; D272-R321 IonicContact OD1-NE 2.67Å; D272-R321 PolarHBondContact OD1-NE 2.91Å; D272-R321 IonicContact OD2-NE 3.69Å; D272-R321 PolarHBondContact OD2-NE 3.27Å; D272-R321 IonicContact OD2-NH2 3.32Å; L317-R321 PolarHBondContact O-NH1 2.65Å; L318-R321 WeakPolarHBondContact O-CA 3.28Å; L318-R321 VanDerWaalsContact O-CB 3.27Å; L318-R321 WeakPolarHBondContact O-CB 2.98Å; L318-R321 PolarHBondContact O-N 3.28Å; V319-R321 PolarHBondContact O-N 2.96Å; V319-R321 VanDerWaalsContact O-N 3.16Å; R321-H324 PolarHBondContact O-CD2 3.1Å
322	Y	58.1	Low	51.7	Low	5 Å²	5	51.6 Å²	51.6	2%	0.02	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-85.1	-10.3	-176.6	-90.2	-117.6	0	0	0	114.3	F271 L318 V319 H324 F325 V343 F347	F271-Y322 HydrophobicContact CB-CE2 4.25Å; F271-Y322 HydrophobicContact CD1-CD1 4.47Å; F271-Y322 AromaticContact CD1-CD2 3.52Å; F271-Y322 HydrophobicContact CD1-CD2 3.52Å; F271-Y322 HydrophobicContact CD1-CE1 4.04Å; F271-Y322 AromaticContact CD1-CE2 2.96Å; F271-Y322 HydrophobicContact CD1-CE2 2.96Å; F271-Y322 HydrophobicContact CD1-CG 4.3Å; F271-Y322 AromaticContact CD1-CZ 3.38Å; F271-Y322 AromaticContact CD2-CE2 3.77Å; F271-Y322 HydrophobicContact CD2-CE2 3.77Å; F271-Y322 HydrophobicContact CE1-CD1 4.15Å; F271-Y322 AromaticContact CE1-CD2 3.92Å; F271-Y322 HydrophobicContact CE1-CD2 3.92Å; F271-Y322 AromaticContact CE1-CE1 3.4Å; F271-Y322 HydrophobicContact CE1-CE1 3.4Å; F271-Y322 AromaticContact CE1-CE2 3.12Å; F271-Y322 HydrophobicContact CE1-CE2 3.12Å; F271-Y322 HydrophobicContact CE1-CG 4.43Å; F271-Y322 AromaticContact CE1-CZ 2.91Å; F271-Y322 WeakPolarHBondContact CE1-OH 3.26Å; F271-Y322 AromaticContact CE2-CE2 3.89Å; F271-Y322 HydrophobicContact CE2-CE2 3.89Å; F271-Y322 AromaticContact CE2-CZ 3.75Å; F271-Y322 WeakPolarHBondContact CE2-OH 3.26Å; F271-Y322 HydrophobicContact CG-CD2 4.09Å; F271-Y322 AromaticContact CG-CE2 3.37Å; F271-Y322 HydrophobicContact CG-CE2 3.37Å; F271-Y322 AromaticContact CZ-CE1 3.92Å; F271-Y322 HydrophobicContact CZ-CE1 3.92Å; F271-Y322 AromaticContact CZ-CE2 3.65Å; F271-Y322 HydrophobicContact CZ-CE2 3.65Å; F271-Y322 AromaticContact CZ-CZ 3.2Å; F271-Y322 WeakPolarHBondContact CZ-OH 3.36Å; L318-Y322 VanDerWaalsContact C-CD2 3.49Å; L318-Y322 HydrophobicContact CB-CD2 3.96Å; L318-Y322 HydrophobicContact CB-CE2 3.38Å; L318-Y322 HydrophobicContact CD1-CE2 4.02Å; L318-Y322 WeakPolarHBondContact CD1-OH 3.46Å; L318-Y322 HydrophobicContact CD2-CE2 4.12Å; L318-Y322 HydrophobicContact CG-CE2 4Å; L318-Y322 WeakPolarHBondContact O-CD2 3.26Å; L318-Y322 PolarHBondContact O-N 2.9Å; V319-Y322 PolarHBondContact O-N 3.31Å; V319-Y322 VanDerWaalsContact O-N 3.13Å; Y322-H324 PolarHBondContact O-N 3.44Å; Y322-F325 HydrophobicContact CD1-CD2 4.22Å; Y322-F325 HydrophobicContact CD1-CG 4.44Å; Y322-F325 HydrophobicContact CG-CD2 4.36Å; Y322-F325 WeakPolarHBondContact O-CB 2.97Å; Y322-F325 PolarHBondContact O-N 2.97Å; Y322-V343 HydrophobicContact CD1-CB 4.44Å; Y322-V343 HydrophobicContact CD1-CG1 3.62Å; Y322-V343 HydrophobicContact CD1-CG2 3.86Å; Y322-V343 HydrophobicContact CE1-CG1 3.29Å; Y322-V343 HydrophobicContact CE1-CG2 4.4Å; Y322-V343 HydrophobicContact CG-CG1 4.31Å; Y322-V343 HydrophobicContact CG-CG2 4.17Å; Y322-F347 AromaticContact CE1-CE2 3.31Å; Y322-F347 HydrophobicContact CE1-CE2 3.31Å; Y322-F347 AromaticContact CE1-CZ 3.41Å; Y322-F347 HydrophobicContact CE1-CZ 3.41Å; Y322-F347 VanDerWaalsContact CE1-CZ 3.41Å; Y322-F347 AromaticContact CZ-CE2 3.51Å; Y322-F347 AromaticContact CZ-CZ 3.59Å; Y322-F347 WeakPolarHBondContact OH-CE2 3.26Å; Y322-F347 WeakPolarHBondContact OH-CZ 3.44Å
323	M	53.2	Low	50.9	Low	91 Å²	91	52.2 Å²	52.2	45%	0.448	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-59	-15.4	178.1	-63	-164.6	-174.8	0	0	113.1	V332	M323-V332 HydrophobicContact CE-CB 4.28Å; M323-V332 HydrophobicContact CE-CG1 3.44Å; M323-V332 VanDerWaalsContact CE-CG1 3.44Å; M323-V332 HydrophobicContact CE-CG2 3.78Å; M323-V332 HydrophobicContact CG-CG2 4.33Å; M323-V332 HydrophobicContact SD-CG1 4.28Å; M323-V332 HydrophobicContact SD-CG2 3.59Å; M323-V332 VanDerWaalsContact SD-CG2 3.59Å
324	H	54.1	Low	49.9	Very low	82 Å²	82	57.9 Å²	57.9	38%	0.38	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-83.6	-12.5	176.5	-56.2	-60.1	0	0	0	114.2	H286 R321 Y322 P326	H286-H324 PolarHBondContact CE1-O 3.43Å; H286-H324 VanDerWaalsContact CE1-O 3.32Å; R321-H324 PolarHBondContact O-CD2 3.1Å; Y322-H324 PolarHBondContact O-N 3.44Å; H324-P326 VanDerWaalsContact O-CD 3.29Å; H324-P326 WeakPolarHBondContact O-CD 2.96Å
325	F	53.6	Low	48.9	Very low	2 Å²	2	62.7 Å²	62.7	1%	0.009	33%	0.33	C	S	.	.			trans	-73.7	113.8	-179.7	-83	-110.1	0	0	0	109.1	F271 V274 C290 Y322 L327 L328	F271-F325 HydrophobicContact CD1-CD2 4.47Å; F271-F325 AromaticContact CD1-CE2 3.43Å; F271-F325 HydrophobicContact CD1-CE2 3.43Å; F271-F325 VanDerWaalsContact CD1-CE2 3.43Å; F271-F325 AromaticContact CD1-CZ 3.57Å; F271-F325 HydrophobicContact CD1-CZ 3.57Å; F271-F325 HydrophobicContact CE1-CE1 4.02Å; F271-F325 AromaticContact CE1-CE2 3.55Å; F271-F325 HydrophobicContact CE1-CE2 3.55Å; F271-F325 AromaticContact CE1-CZ 3.23Å; F271-F325 HydrophobicContact CE1-CZ 3.23Å; F271-F325 HydrophobicContact CZ-CZ 4.35Å; V274-F325 HydrophobicContact CB-CE2 4.2Å; V274-F325 HydrophobicContact CB-CZ 4.1Å; V274-F325 HydrophobicContact CG1-CE1 4.28Å; V274-F325 HydrophobicContact CG1-CE2 3.66Å; V274-F325 HydrophobicContact CG1-CZ 3.5Å; V274-F325 VanDerWaalsContact CG1-CZ 3.5Å; V274-F325 HydrophobicContact CG2-CZ 4.48Å; C290-F325 HydrophobicContact CB-CD1 3.54Å; C290-F325 HydrophobicContact CB-CE1 3.49Å; C290-F325 VanDerWaalsContact CB-CE1 3.49Å; C290-F325 HydrophobicContact CB-CG 4.45Å; C290-F325 HydrophobicContact CB-CZ 4.33Å; Y322-F325 HydrophobicContact CD1-CD2 4.22Å; Y322-F325 HydrophobicContact CD1-CG 4.44Å; Y322-F325 HydrophobicContact CG-CD2 4.36Å; Y322-F325 WeakPolarHBondContact O-CB 2.97Å; Y322-F325 PolarHBondContact O-N 2.97Å; F325-L327 PolarHBondContact O-N 3.44Å; F325-L327 VanDerWaalsContact O-N 3.17Å; F325-L328 PolarHBondContact O-N 3.04Å
326	P	47.1	Very low	48	Very low	21 Å²	21	68.3 Å²	68.3	14%	0.136	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-74.7	-14.9	-166.4	4.9	6.1	0	0	0	113.2	Y287 H324 L328	Y287-P326 HydrophobicContact CD1-CB 4.11Å; Y287-P326 HydrophobicContact CD1-CG 3.69Å; Y287-P326 HydrophobicContact CE1-CB 3.28Å; Y287-P326 HydrophobicContact CE1-CG 3.39Å; Y287-P326 HydrophobicContact CE2-CG 4.49Å; Y287-P326 HydrophobicContact CG-CG 4.36Å; Y287-P326 WeakPolarHBondContact OH-CB 3.4Å; H324-P326 VanDerWaalsContact O-CD 3.29Å; H324-P326 WeakPolarHBondContact O-CD 2.96Å; P326-L328 PolarHBondContact O-N 3.09Å
327	L	45.1	Very low	47	Very low	61 Å²	61	73.5 Å²	73.5	32%	0.319	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-73.8	-2.8	169.6	-72.2	163	0	0	0	113.7	Y287 F325 Y346 L401	Y287-L327 HydrophobicContact CD1-CG 4.34Å; Y287-L327 HydrophobicContact CE1-CG 4.29Å; F325-L327 PolarHBondContact O-N 3.44Å; F325-L327 VanDerWaalsContact O-N 3.17Å; L327-Y346 HydrophobicContact CB-CE2 4.12Å; L327-Y346 WeakPolarHBondContact CB-OH 3.05Å; L327-Y346 WeakPolarHBondContact CD1-OH 2.75Å; L327-L401 HydrophobicContact CD2-CD2 4.44Å
328	L	44.5	Very low	46.1	Very low	23 Å²	23	73.2 Å²	73.2	12%	0.12	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-136.7	29.2	-176.5	-71	171.1	0	0	0	112.6	F325 P326 L330 Y346	F325-L328 PolarHBondContact O-N 3.04Å; P326-L328 PolarHBondContact O-N 3.09Å; L328-L330 HydrophobicContact CD2-CD1 4.13Å; L328-L330 PolarHBondContact O-N 2.91Å; L328-Y346 HydrophobicContact CD1-CD1 3.82Å; L328-Y346 HydrophobicContact CD1-CD2 4.25Å; L328-Y346 HydrophobicContact CD1-CE1 4.19Å; L328-Y346 HydrophobicContact CD1-CG 3.84Å; L328-Y346 HydrophobicContact CD2-CD2 3.98Å; L328-Y346 HydrophobicContact CD2-CG 4.2Å; L328-Y346 HydrophobicContact CG-CD2 4.17Å; L328-Y346 HydrophobicContact CG-CE2 4.36Å; L328-Y346 HydrophobicContact CG-CG 4.27Å
329	Q	41.8	Very low	45.1	Very low	157 Å²	157	74.5 Å²	74.5	73%	0.734	38%	0.38	S	S	*	.			trans	-68.2	50	166.2	-71.3	-172.1	-1.8	0	0	111.8
330	L	36	Very low	44.3	Very low	41 Å²	41	74.6 Å²	74.6	22%	0.215	38%	0.381	C	S	.	.			trans	-71.7	141.3	167.3	-71.1	163	0	0	0	107.7	L328 V332 L342 L389	L328-L330 HydrophobicContact CD2-CD1 4.13Å; L328-L330 PolarHBondContact O-N 2.91Å; L330-V332 PolarHBondContact O-N 3.47Å; L330-L342 HydrophobicContact CD1-CD2 3.77Å; L330-L389 HydrophobicContact CD1-CD2 4.19Å; L330-L389 HydrophobicContact CD2-CD2 3.85Å; L330-L389 HydrophobicContact CG-CD2 4.49Å
331	P	31.9	Very low	43.6	Very low	109 Å²	109	71.8 Å²	71.8	71%	0.708	36%	0.362	S	S	*	.			trans	-54.4	115.7	177.2	20.9	-30.7	0	0	0	108.9	V333	P331-V333 PolarHBondContact O-N 2.87Å
332	V	35.1	Very low	43.1	Very low	88 Å²	88	69.8 Å²	69.8	53%	0.533	36%	0.357	S	S	.	.			trans	-56.6	104.9	-180	176.3	0	0	0	0	108.1	M323 L330	M323-V332 HydrophobicContact CE-CB 4.28Å; M323-V332 HydrophobicContact CE-CG1 3.44Å; M323-V332 VanDerWaalsContact CE-CG1 3.44Å; M323-V332 HydrophobicContact CE-CG2 3.78Å; M323-V332 HydrophobicContact CG-CG2 4.33Å; M323-V332 HydrophobicContact SD-CG1 4.28Å; M323-V332 HydrophobicContact SD-CG2 3.59Å; M323-V332 VanDerWaalsContact SD-CG2 3.59Å; L330-V332 PolarHBondContact O-N 3.47Å
333	V	35.2	Very low	42.6	Very low	68 Å²	68	69.7 Å²	69.7	41%	0.412	36%	0.357	S	S	.	.			trans	-85.1	124.8	167.6	-174.1	0	0	0	0	106.6	P331 E335	P331-V333 PolarHBondContact O-N 2.87Å; V333-E335 PolarHBondContact O-N 2.87Å
334	E	39.1	Very low	42.5	Very low	195 Å²	195	65.9 Å²	65.9	91%	0.911	34%	0.341	S	S	*	.	S	Bend	trans	-60.3	15.4	-167.3	-65	-179.9	145.7	0	0	117.1
335	E	43.8	Very low	42.4	Very low	100 Å²	100	63.6 Å²	63.6	47%	0.467	33%	0.332	S	S	.	.			trans	-111.6	109	-177.9	-79.8	179.2	-163.5	0	0	112.4	V333 Q337 R338	V333-E335 PolarHBondContact O-N 2.87Å; E335-Q337 PolarHBondContact O-N 3.19Å; E335-R338 HydrophobicContact CB-CG 3.92Å; E335-R338 WeakPolarHBondContact O-CB 3.1Å; E335-R338 PolarHBondContact O-N 3.19Å; E335-R338 IonicContact OE1-CZ 2.79Å; E335-R338 IonicContact OE1-NH2 3.9Å; E335-R338 PolarHBondContact OE1-NH2 3.32Å; E335-R338 VanDerWaalsContact OE1-NH2 3.12Å; E335-R338 IonicContact OE2-CZ 2.82Å; E335-R338 IonicContact OE2-NE 2.65Å; E335-R338 PolarHBondContact OE2-NE 3Å; E335-R338 IonicContact OE2-NH2 3.8Å; E335-R338 PolarHBondContact OE2-NH2 3.42Å
336	N	41.5	Very low	42.4	Very low	120 Å²	120	63.8 Å²	63.8	64%	0.642	33%	0.332	S	S	*	.	H	α-helix	trans	-49.7	-27.6	-179.4	-79.8	-24.6	0	0	0	115.1	V340	N336-V340 WeakPolarHBondContact O-CG2 3.31Å
337	Q	35.9	Very low	42.6	Very low	166 Å²	166	63 Å²	63	78%	0.776	33%	0.326	S	S	*	.	H	α-helix	trans	-72.8	-33.8	177.1	-77.1	-175.7	-14.1	0	0	113	E335 V340 S341	E335-Q337 PolarHBondContact O-N 3.19Å; Q337-V340 PolarHBondContact O-N 3.01Å; Q337-S341 PolarHBondContact O-N 3.22Å; Q337-S341 PolarHBondContact O-OG 3.38Å
338	R	39.8	Very low	42.9	Very low	62 Å²	62	61.7 Å²	61.7	23%	0.234	32%	0.32	C	S	.	.	H	α-helix	trans	-68.2	-40.7	-177.4	-59.5	-171.8	-169.4	-173.2	7.4	111.6	E335 V340 S341 L342 D383 C385	E335-R338 HydrophobicContact CB-CG 3.92Å; E335-R338 WeakPolarHBondContact O-CB 3.1Å; E335-R338 PolarHBondContact O-N 3.19Å; E335-R338 IonicContact OE1-CZ 2.79Å; E335-R338 IonicContact OE1-NH2 3.9Å; E335-R338 PolarHBondContact OE1-NH2 3.32Å; E335-R338 VanDerWaalsContact OE1-NH2 3.12Å; E335-R338 IonicContact OE2-CZ 2.82Å; E335-R338 IonicContact OE2-NE 2.65Å; E335-R338 PolarHBondContact OE2-NE 3Å; E335-R338 IonicContact OE2-NH2 3.8Å; E335-R338 PolarHBondContact OE2-NH2 3.42Å; R338-V340 VanDerWaalsContact C-N 3.32Å; R338-V340 PolarHBondContact O-N 2.94Å; R338-S341 PolarHBondContact O-N 3.29Å; R338-L342 WeakPolarHBondContact O-CG 3.47Å; R338-L342 PolarHBondContact O-N 3.42Å; R338-L342 VanDerWaalsContact O-N 3.13Å; R338-D383 WeakPolarHBondContact CA-OD2 3.1Å; R338-D383 WeakPolarHBondContact CG-OD2 3.17Å; R338-C385 PolarHBondContact NH1-SG 3.41Å; R338-C385 VanDerWaalsContact NH1-SG 3.39Å
339	T	40.3	Very low	43.1	Very low	27 Å²	27	61.2 Å²	61.2	17%	0.166	32%	0.318	C	S	.	.	H	α-helix	trans	-69.5	-29.4	-179.3	-33.5	0	0	0	0	112.4	V319 V343	V319-T339 HydrophobicContact CB-CG2 4.16Å; V319-T339 HydrophobicContact CG1-CG2 3.56Å; V319-T339 HydrophobicContact CG2-CG2 3.8Å; V319-T339 WeakPolarHBondContact CG2-O 3.43Å; T339-V343 HydrophobicContact CG2-CG2 4.45Å; T339-V343 WeakPolarHBondContact O-CB 3.43Å; T339-V343 VanDerWaalsContact O-CG2 3.22Å; T339-V343 WeakPolarHBondContact O-CG2 3.37Å; T339-V343 PolarHBondContact O-N 3.38Å
340	V	39.1	Very low	43.3	Very low	6 Å²	6	54 Å²	54	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-45.9	175.8	167.7	0	0	0	0	110.7	T312 L315 V319 N336 Q337 R338 G344 F379	T312-V340 HydrophobicContact CG2-CG1 4.28Å; L315-V340 HydrophobicContact CB-CB 4.21Å; L315-V340 HydrophobicContact CB-CG1 3.53Å; L315-V340 HydrophobicContact CB-CG2 4.12Å; L315-V340 HydrophobicContact CD1-CG1 3.85Å; L315-V340 HydrophobicContact CG-CG1 4.35Å; V319-V340 HydrophobicContact CB-CG2 4.48Å; V319-V340 HydrophobicContact CG2-CB 4.3Å; V319-V340 HydrophobicContact CG2-CG2 3.67Å; N336-V340 WeakPolarHBondContact O-CG2 3.31Å; Q337-V340 PolarHBondContact O-N 3.01Å; R338-V340 VanDerWaalsContact C-N 3.32Å; R338-V340 PolarHBondContact O-N 2.94Å; V340-G344 PolarHBondContact O-N 2.92Å; V340-F379 HydrophobicContact CG1-CE1 4.08Å; V340-F379 HydrophobicContact CG1-CZ 4.34Å
341	S	42.7	Very low	43.7	Very low	9 Å²	9	54 Å²	54	6%	0.063	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-44.2	176.8	-56.3	0	0	0	0	111.9	Q337 R338 G344 L345 F379	Q337-S341 PolarHBondContact O-N 3.22Å; Q337-S341 PolarHBondContact O-OG 3.38Å; R338-S341 PolarHBondContact O-N 3.29Å; S341-G344 PolarHBondContact O-N 3.07Å; S341-L345 WeakPolarHBondContact O-CB 3.15Å; S341-L345 WeakPolarHBondContact O-CD1 3.04Å; S341-L345 VanDerWaalsContact O-CG 3.27Å; S341-L345 WeakPolarHBondContact O-CG 3.39Å; S341-L345 PolarHBondContact O-N 3.15Å; S341-F379 WeakPolarHBondContact OG-CD1 3.31Å
342	L	46.9	Very low	44.1	Very low	33 Å²	33	49.3 Å²	49.3	17%	0.173	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-52.9	176.5	-84.4	163	0	0	0	112.7	L330 R338 L345 Y346 L389	L330-L342 HydrophobicContact CD1-CD2 3.77Å; R338-L342 WeakPolarHBondContact O-CG 3.47Å; R338-L342 PolarHBondContact O-N 3.42Å; R338-L342 VanDerWaalsContact O-N 3.13Å; L342-L345 PolarHBondContact O-N 2.87Å; L342-Y346 PolarHBondContact O-N 2.7Å; L342-L389 HydrophobicContact CD1-CD1 4.09Å; L342-L389 HydrophobicContact CD2-CB 3.74Å; L342-L389 HydrophobicContact CD2-CD1 3.88Å; L342-L389 HydrophobicContact CD2-CD2 4.47Å; L342-L389 HydrophobicContact CD2-CG 4.23Å; L342-L389 HydrophobicContact CG-CD1 4.26Å
343	V	48.3	Very low	44.4	Very low	3 Å²	3	46.3 Å²	46.3	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-43	-178.1	173.4	0	0	0	0	110.2	L315 V319 Y322 T339 L345 Y346 F347	L315-V343 HydrophobicContact CD2-CB 4.25Å; L315-V343 HydrophobicContact CD2-CG1 3.62Å; V319-V343 HydrophobicContact CG2-CG2 4.21Å; Y322-V343 HydrophobicContact CD1-CB 4.44Å; Y322-V343 HydrophobicContact CD1-CG1 3.62Å; Y322-V343 HydrophobicContact CD1-CG2 3.86Å; Y322-V343 HydrophobicContact CE1-CG1 3.29Å; Y322-V343 HydrophobicContact CE1-CG2 4.4Å; Y322-V343 HydrophobicContact CG-CG1 4.31Å; Y322-V343 HydrophobicContact CG-CG2 4.17Å; T339-V343 HydrophobicContact CG2-CG2 4.45Å; T339-V343 WeakPolarHBondContact O-CB 3.43Å; T339-V343 VanDerWaalsContact O-CG2 3.22Å; T339-V343 WeakPolarHBondContact O-CG2 3.37Å; T339-V343 PolarHBondContact O-N 3.38Å; V343-L345 VanDerWaalsContact C-N 3.34Å; V343-L345 PolarHBondContact O-N 3.49Å; V343-Y346 PolarHBondContact O-N 3.37Å; V343-F347 HydrophobicContact CG1-CD2 3.64Å; V343-F347 HydrophobicContact CG1-CE2 3.3Å; V343-F347 HydrophobicContact CG1-CZ 4.48Å; V343-F347 WeakPolarHBondContact O-CD2 3.18Å; V343-F347 PolarHBondContact O-N 2.86Å
344	G	51.4	Low	44.8	Very low	11 Å²	11	47.8 Å²	47.8	11%	0.113	24%	0.239	C	C	.	.	H	α-helix	trans	-57.8	-43.5	174.9	0	0	0	0	0	113	V340 S341 F347 I348	V340-G344 PolarHBondContact O-N 2.92Å; S341-G344 PolarHBondContact O-N 3.07Å; G344-F347 PolarHBondContact O-N 3.42Å; G344-I348 WeakPolarHBondContact O-CB 3.45Å; G344-I348 WeakPolarHBondContact O-CD1 3.28Å; G344-I348 WeakPolarHBondContact O-CG1 3.15Å; G344-I348 PolarHBondContact O-N 2.83Å
345	L	51.8	Low	45.1	Very low	34 Å²	34	40.1 Å²	40.1	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-68.2	-36.2	177.9	-74.8	165.5	0	0	0	113.1	S341 L342 V343 I348 S349 A386 L390	S341-L345 WeakPolarHBondContact O-CB 3.15Å; S341-L345 WeakPolarHBondContact O-CD1 3.04Å; S341-L345 VanDerWaalsContact O-CG 3.27Å; S341-L345 WeakPolarHBondContact O-CG 3.39Å; S341-L345 PolarHBondContact O-N 3.15Å; L342-L345 PolarHBondContact O-N 2.87Å; V343-L345 VanDerWaalsContact C-N 3.34Å; V343-L345 PolarHBondContact O-N 3.49Å; L345-I348 PolarHBondContact O-N 3.23Å; L345-S349 WeakPolarHBondContact O-CB 3.26Å; L345-S349 PolarHBondContact O-N 2.74Å; L345-A386 HydrophobicContact CD1-CB 4.24Å; L345-L390 HydrophobicContact CD1-CD1 3.35Å; L345-L390 HydrophobicContact CD1-CG 3.94Å; L345-L390 HydrophobicContact CD2-CD1 3.82Å; L345-L390 HydrophobicContact CG-CD1 4.1Å
346	Y	52.1	Low	44.8	Very low	6 Å²	6	40 Å²	40	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-41.4	173.6	179.1	-100.2	0	0	0	112.2	A294 L327 L328 L342 V343 S349 I350 F393	A294-Y346 HydrophobicContact CB-CE1 4.38Å; L327-Y346 HydrophobicContact CB-CE2 4.12Å; L327-Y346 WeakPolarHBondContact CB-OH 3.05Å; L327-Y346 WeakPolarHBondContact CD1-OH 2.75Å; L328-Y346 HydrophobicContact CD1-CD1 3.82Å; L328-Y346 HydrophobicContact CD1-CD2 4.25Å; L328-Y346 HydrophobicContact CD1-CE1 4.19Å; L328-Y346 HydrophobicContact CD1-CG 3.84Å; L328-Y346 HydrophobicContact CD2-CD2 3.98Å; L328-Y346 HydrophobicContact CD2-CG 4.2Å; L328-Y346 HydrophobicContact CG-CD2 4.17Å; L328-Y346 HydrophobicContact CG-CE2 4.36Å; L328-Y346 HydrophobicContact CG-CG 4.27Å; L342-Y346 PolarHBondContact O-N 2.7Å; V343-Y346 PolarHBondContact O-N 3.37Å; Y346-S349 PolarHBondContact O-N 3.28Å; Y346-S349 PolarHBondContact O-OG 3.16Å; Y346-I350 HydrophobicContact CD1-CD1 3.83Å; Y346-I350 HydrophobicContact CE1-CD1 3.24Å; Y346-I350 HydrophobicContact CE1-CG1 4.36Å; Y346-I350 HydrophobicContact CE2-CD1 4.17Å; Y346-I350 VanDerWaalsContact CZ-CD1 3.43Å; Y346-I350 WeakPolarHBondContact O-CG1 3.26Å; Y346-I350 PolarHBondContact O-N 3.48Å; Y346-F393 AromaticContact CD2-CE2 3.94Å; Y346-F393 HydrophobicContact CD2-CE2 3.94Å; Y346-F393 AromaticContact CD2-CZ 3.68Å; Y346-F393 HydrophobicContact CD2-CZ 3.68Å; Y346-F393 HydrophobicContact CE2-CE2 4.19Å; Y346-F393 AromaticContact CE2-CZ 3.88Å; Y346-F393 HydrophobicContact CE2-CZ 3.88Å
347	F	52.3	Low	44.6	Very low	3 Å²	3	38.8 Å²	38.8	1%	0.013	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-42.2	172.8	-79.7	-65	0	0	0	113.1	F271 A294 F297 L315 Y322 V343 G344 S349 I350 V351	F271-F347 HydrophobicContact CE1-CZ 4.36Å; F271-F347 AromaticContact CZ-CZ 3.84Å; F271-F347 HydrophobicContact CZ-CZ 3.84Å; A294-F347 HydrophobicContact CB-CD1 4.31Å; A294-F347 HydrophobicContact CB-CE1 3.76Å; A294-F347 WeakPolarHBondContact O-CD1 3.42Å; A294-F347 WeakPolarHBondContact O-CE1 3.12Å; F297-F347 HydrophobicContact CB-CD1 4.1Å; F297-F347 HydrophobicContact CB-CE1 3.56Å; F297-F347 HydrophobicContact CB-CZ 4.15Å; F297-F347 HydrophobicContact CD1-CB 4.49Å; F297-F347 AromaticContact CD1-CD1 3.45Å; F297-F347 HydrophobicContact CD1-CD1 3.45Å; F297-F347 VanDerWaalsContact CD1-CD1 3.45Å; F297-F347 AromaticContact CD1-CD2 3.67Å; F297-F347 HydrophobicContact CD1-CD2 3.67Å; F297-F347 AromaticContact CD1-CE1 3.32Å; F297-F347 HydrophobicContact CD1-CE1 3.32Å; F297-F347 AromaticContact CD1-CE2 3.6Å; F297-F347 HydrophobicContact CD1-CE2 3.6Å; F297-F347 AromaticContact CD1-CG 3.62Å; F297-F347 HydrophobicContact CD1-CG 3.62Å; F297-F347 AromaticContact CD1-CZ 3.46Å; F297-F347 HydrophobicContact CD1-CZ 3.46Å; F297-F347 VanDerWaalsContact CD1-CZ 3.46Å; F297-F347 HydrophobicContact CE1-CD1 4.34Å; F297-F347 AromaticContact CE1-CD2 3.73Å; F297-F347 HydrophobicContact CE1-CD2 3.73Å; F297-F347 HydrophobicContact CE1-CE1 4.26Å; F297-F347 AromaticContact CE1-CE2 3.71Å; F297-F347 HydrophobicContact CE1-CE2 3.71Å; F297-F347 HydrophobicContact CE1-CG 4.08Å; F297-F347 HydrophobicContact CE1-CZ 4.02Å; F297-F347 HydrophobicContact CG-CD1 4.2Å; F297-F347 AromaticContact CG-CE1 3.73Å; F297-F347 HydrophobicContact CG-CE1 3.73Å; F297-F347 HydrophobicContact CG-CE2 4.46Å; F297-F347 AromaticContact CG-CZ 3.95Å; F297-F347 HydrophobicContact CG-CZ 3.95Å; L315-F347 HydrophobicContact CD2-CD2 4.38Å; L315-F347 HydrophobicContact CD2-CE2 4.49Å; Y322-F347 AromaticContact CE1-CE2 3.31Å; Y322-F347 HydrophobicContact CE1-CE2 3.31Å; Y322-F347 AromaticContact CE1-CZ 3.41Å; Y322-F347 HydrophobicContact CE1-CZ 3.41Å; Y322-F347 VanDerWaalsContact CE1-CZ 3.41Å; Y322-F347 AromaticContact CZ-CE2 3.51Å; Y322-F347 AromaticContact CZ-CZ 3.59Å; Y322-F347 WeakPolarHBondContact OH-CE2 3.26Å; Y322-F347 WeakPolarHBondContact OH-CZ 3.44Å; V343-F347 HydrophobicContact CG1-CD2 3.64Å; V343-F347 HydrophobicContact CG1-CE2 3.3Å; V343-F347 HydrophobicContact CG1-CZ 4.48Å; V343-F347 WeakPolarHBondContact O-CD2 3.18Å; V343-F347 PolarHBondContact O-N 2.86Å; G344-F347 PolarHBondContact O-N 3.42Å; F347-S349 VanDerWaalsContact C-N 3.28Å; F347-S349 PolarHBondContact O-N 3.23Å; F347-I350 PolarHBondContact O-N 3.44Å; F347-V351 WeakPolarHBondContact O-CB 3.44Å; F347-V351 VanDerWaalsContact O-CG2 3.26Å; F347-V351 WeakPolarHBondContact O-CG2 3.1Å; F347-V351 PolarHBondContact O-N 2.86Å
348	I	50.7	Low	44.5	Very low	34 Å²	34	32.9 Å²	32.9	17%	0.174	18%	0.183	C	C	.	.	H	α-helix	trans	-59.5	-44.1	175.2	-72	165	0	0	0	109	G344 L345 I350 V351 L352 W368	G344-I348 WeakPolarHBondContact O-CB 3.45Å; G344-I348 WeakPolarHBondContact O-CD1 3.28Å; G344-I348 WeakPolarHBondContact O-CG1 3.15Å; G344-I348 PolarHBondContact O-N 2.83Å; L345-I348 PolarHBondContact O-N 3.23Å; I348-I350 PolarHBondContact O-N 2.89Å; I348-V351 PolarHBondContact O-N 3.01Å; I348-L352 HydrophobicContact CG2-CD1 3.38Å; I348-L352 HydrophobicContact CG2-CG 4.2Å; I348-L352 VanDerWaalsContact O-CB 3.27Å; I348-L352 WeakPolarHBondContact O-CB 3.44Å; I348-L352 VanDerWaalsContact O-CD1 3.28Å; I348-L352 WeakPolarHBondContact O-CD1 3.19Å; I348-L352 WeakPolarHBondContact O-CG 3.29Å; I348-L352 PolarHBondContact O-N 3.48Å; I348-W368 HydrophobicContact CD1-CH2 4.46Å; I348-W368 HydrophobicContact CG1-CH2 4.37Å
349	S	48.8	Very low	44.3	Very low	13 Å²	13	34.5 Å²	34.5	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-36.9	178.8	73.6	0	0	0	0	113.6	L345 Y346 F347 L352 S353	L345-S349 WeakPolarHBondContact O-CB 3.26Å; L345-S349 PolarHBondContact O-N 2.74Å; Y346-S349 PolarHBondContact O-N 3.28Å; Y346-S349 PolarHBondContact O-OG 3.16Å; F347-S349 VanDerWaalsContact C-N 3.28Å; F347-S349 PolarHBondContact O-N 3.23Å; S349-L352 CarbonylContact O-C 3.51Å; S349-L352 PolarHBondContact O-N 3.47Å; S349-S353 WeakPolarHBondContact O-CB 3.37Å; S349-S353 PolarHBondContact O-N 3.01Å
350	I	46.3	Very low	44	Very low	6 Å²	6	37.7 Å²	37.7	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-41.9	173.4	-71	176.7	0	0	0	112.1	A294 I295 Y346 F347 I348 L352 S353	A294-I350 HydrophobicContact CB-CD1 3.51Å; I295-I350 HydrophobicContact CB-CG2 4.49Å; I295-I350 HydrophobicContact CG1-CG2 3.73Å; Y346-I350 HydrophobicContact CD1-CD1 3.83Å; Y346-I350 HydrophobicContact CE1-CD1 3.24Å; Y346-I350 HydrophobicContact CE1-CG1 4.36Å; Y346-I350 HydrophobicContact CE2-CD1 4.17Å; Y346-I350 VanDerWaalsContact CZ-CD1 3.43Å; Y346-I350 WeakPolarHBondContact O-CG1 3.26Å; Y346-I350 PolarHBondContact O-N 3.48Å; F347-I350 PolarHBondContact O-N 3.44Å; I348-I350 PolarHBondContact O-N 2.89Å; I350-L352 PolarHBondContact O-N 3.32Å; I350-S353 PolarHBondContact O-N 3.45Å; I350-S353 PolarHBondContact O-OG 3.3Å
351	V	44.2	Very low	43.8	Very low	40 Å²	40	43.7 Å²	43.7	24%	0.242	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-38.2	174.1	171.2	0	0	0	0	110.3	F347 I348 S353 L365	F347-V351 WeakPolarHBondContact O-CB 3.44Å; F347-V351 VanDerWaalsContact O-CG2 3.26Å; F347-V351 WeakPolarHBondContact O-CG2 3.1Å; F347-V351 PolarHBondContact O-N 2.86Å; I348-V351 PolarHBondContact O-N 3.01Å; V351-S353 VanDerWaalsContact C-N 3.35Å; V351-L365 HydrophobicContact CG1-CD1 4.49Å
352	L	40.8	Very low	43.6	Very low	12 Å²	12	46.3 Å²	46.3	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-73.6	-21.7	179.1	-67.1	167.2	0	0	0	113.3	I348 S349 I350 L365 L369 A412	I348-L352 HydrophobicContact CG2-CD1 3.38Å; I348-L352 HydrophobicContact CG2-CG 4.2Å; I348-L352 VanDerWaalsContact O-CB 3.27Å; I348-L352 WeakPolarHBondContact O-CB 3.44Å; I348-L352 VanDerWaalsContact O-CD1 3.28Å; I348-L352 WeakPolarHBondContact O-CD1 3.19Å; I348-L352 WeakPolarHBondContact O-CG 3.29Å; I348-L352 PolarHBondContact O-N 3.48Å; S349-L352 CarbonylContact O-C 3.51Å; S349-L352 PolarHBondContact O-N 3.47Å; I350-L352 PolarHBondContact O-N 3.32Å; L352-L365 HydrophobicContact CD2-CD1 3.69Å; L352-L365 HydrophobicContact CD2-CD2 3.33Å; L352-L365 HydrophobicContact CD2-CG 3.82Å; L352-L369 HydrophobicContact CD2-CD1 4.29Å; L352-A412 HydrophobicContact CB-CB 3.29Å; L352-A412 HydrophobicContact CD1-CB 3.39Å; L352-A412 HydrophobicContact CG-CB 3.87Å
353	S	42.4	Very low	43.3	Very low	24 Å²	24	53.4 Å²	53.4	17%	0.168	29%	0.288	C	S	.	.	H	α-helix	trans	-78.6	-37.5	-176.3	68.9	0	0	0	0	114.3	S349 I350 V351	S349-S353 WeakPolarHBondContact O-CB 3.37Å; S349-S353 PolarHBondContact O-N 3.01Å; I350-S353 PolarHBondContact O-N 3.45Å; I350-S353 PolarHBondContact O-OG 3.3Å; V351-S353 VanDerWaalsContact C-N 3.35Å
354	K	42.7	Very low	43	Very low	99 Å²	99	60 Å²	60	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-86.9	-8.3	-177.1	-80.4	-163	173.4	-172.6	0	115.5	I295 R356	I295-K354 HydrophobicContact CD1-CD 4.13Å; I295-K354 HydrophobicContact CG1-CD 4.32Å; I295-K354 HydrophobicContact CG2-CD 4.47Å; K354-R356 PolarHBondContact O-N 2.87Å
355	D	44.9	Very low	42.6	Very low	34 Å²	34	60.4 Å²	60.4	18%	0.182	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-79.8	14	-174.6	-137.5	10.5	0	0	0	114.4	A357 R361 L365	D355-A357 VanDerWaalsContact C-N 3.3Å; D355-A357 PolarHBondContact O-N 3.41Å; D355-R361 VanDerWaalsContact OD1-CB 3.23Å; D355-R361 WeakPolarHBondContact OD1-CB 3.34Å; D355-L365 HydrophobicContact CB-CD2 4.38Å
356	R	38.2	Very low	42.2	Very low	97 Å²	97	64.6 Å²	64.6	37%	0.366	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-71.9	-13.8	179.5	-80.1	-137.4	169.8	95.2	1.2	115.7	K354 Y407 Y411	K354-R356 PolarHBondContact O-N 2.87Å; R356-Y407 VanDerWaalsContact NH1-CG 3.33Å; R356-Y407 PolarHBondContact NH2-O 3.13Å; R356-Y411 VanDerWaalsContact NH2-CG 3.29Å
357	A	36.7	Very low	42.1	Very low	95 Å²	95	67.5 Å²	67.5	79%	0.785	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-89.2	-6.7	-171.4	0	0	0	0	0	115.3	D355	D355-A357 VanDerWaalsContact C-N 3.3Å; D355-A357 PolarHBondContact O-N 3.41Å
358	S	34.3	Very low	41.9	Very low	43 Å²	43	71.6 Å²	71.6	30%	0.301	37%	0.369	S	S	.	.			trans	-151.1	126.9	179.6	72.8	0	0	0	0	115.6	V360 R361	S358-V360 PolarHBondContact O-N 2.97Å; S358-V360 VanDerWaalsContact O-N 3.09Å; S358-R361 PolarHBondContact O-N 2.84Å; S358-R361 WeakPolarHBondContact OG-CB 3.35Å; S358-R361 WeakPolarHBondContact OG-CD 3.34Å; S358-R361 WeakPolarHBondContact OG-CG 3.43Å
359	S	35.3	Very low	41.8	Very low	95 Å²	95	70.1 Å²	70.1	66%	0.664	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-12.6	177	61.9	0	0	0	0	114.6
360	V	33.5	Very low	41.8	Very low	95 Å²	95	73.1 Å²	73.1	58%	0.576	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-28.3	-178.7	-177.4	0	0	0	0	111.6	S358	S358-V360 PolarHBondContact O-N 2.97Å; S358-V360 VanDerWaalsContact O-N 3.09Å
361	R	35.8	Very low	42	Very low	131 Å²	131	77.7 Å²	77.7	49%	0.494	41%	0.405	S	S	.	.	H	α-helix	trans	-88.2	-27.8	-177.8	-69	-177.6	-168.7	179.5	3.9	114.2	D355 S358 R363 K364 L365	D355-R361 VanDerWaalsContact OD1-CB 3.23Å; D355-R361 WeakPolarHBondContact OD1-CB 3.34Å; S358-R361 PolarHBondContact O-N 2.84Å; S358-R361 WeakPolarHBondContact OG-CB 3.35Å; S358-R361 WeakPolarHBondContact OG-CD 3.34Å; S358-R361 WeakPolarHBondContact OG-CG 3.43Å; R361-R363 PolarHBondContact O-N 3.19Å; R361-K364 WeakPolarHBondContact O-CA 3.46Å; R361-K364 WeakPolarHBondContact O-CB 3.31Å; R361-K364 PolarHBondContact O-N 2.79Å; R361-L365 PolarHBondContact O-N 2.88Å
362	S	38	Very low	42.2	Very low	64 Å²	64	77 Å²	77	45%	0.448	40%	0.4	S	S	.	.	H	α-helix	trans	-55.4	-28.7	170.5	77.4	0	0	0	0	113.1	K366	S362-K366 WeakPolarHBondContact O-CB 3.29Å; S362-K366 PolarHBondContact O-N 3.17Å
363	R	41.1	Very low	42.6	Very low	182 Å²	182	76.6 Å²	76.6	69%	0.687	40%	0.398	S	S	*	.	H	α-helix	trans	-70	-39.6	173.7	-109.4	-176.3	-84.2	169.9	-7	112.8	R361 S367	R361-R363 PolarHBondContact O-N 3.19Å; R363-S367 VanDerWaalsContact O-CB 3.29Å; R363-S367 WeakPolarHBondContact O-CB 3.13Å; R363-S367 PolarHBondContact O-N 3.32Å
364	K	42.6	Very low	42.9	Very low	142 Å²	142	79.7 Å²	79.7	62%	0.617	41%	0.413	S	S	*	.	H	α-helix	trans	-69.6	-42.1	177.2	-73.2	-173.7	176.2	-177.4	0	111	R361 S367 W368	R361-K364 WeakPolarHBondContact O-CA 3.46Å; R361-K364 WeakPolarHBondContact O-CB 3.31Å; R361-K364 PolarHBondContact O-N 2.79Å; K364-S367 WeakPolarHBondContact O-CB 3.38Å; K364-S367 PolarHBondContact O-N 3.48Å; K364-W368 WeakPolarHBondContact O-CB 3Å; K364-W368 PolarHBondContact O-N 2.98Å
365	L	42	Very low	43.2	Very low	19 Å²	19	78.2 Å²	78.2	10%	0.099	41%	0.408	C	S	.	.	H	α-helix	trans	-65.5	-45.2	174.8	178.8	64	0	0	0	112	V351 L352 D355 R361 S367 W368 L369	V351-L365 HydrophobicContact CG1-CD1 4.49Å; L352-L365 HydrophobicContact CD2-CD1 3.69Å; L352-L365 HydrophobicContact CD2-CD2 3.33Å; L352-L365 HydrophobicContact CD2-CG 3.82Å; D355-L365 HydrophobicContact CB-CD2 4.38Å; R361-L365 PolarHBondContact O-N 2.88Å; L365-S367 VanDerWaalsContact C-N 3.29Å; L365-S367 PolarHBondContact O-N 3.1Å; L365-W368 PolarHBondContact O-N 3.24Å; L365-W368 VanDerWaalsContact O-N 3.16Å; L365-L369 HydrophobicContact CD1-CG 4.45Å; L365-L369 HydrophobicContact CG-CD1 4.3Å; L365-L369 WeakPolarHBondContact O-CB 3.44Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 3.34Å
366	K	44.3	Very low	43.5	Very low	122 Å²	122	77.3 Å²	77.3	53%	0.53	40%	0.403	S	S	.	.	H	α-helix	trans	-60	-40.2	172.7	-174.8	175.7	-176.8	176.7	0	111.6	S362 N370	S362-K366 WeakPolarHBondContact O-CB 3.29Å; S362-K366 PolarHBondContact O-N 3.17Å; K366-N370 VanDerWaalsContact O-CB 3.24Å; K366-N370 WeakPolarHBondContact O-CB 3.35Å; K366-N370 PolarHBondContact O-N 2.94Å; K366-N370 PolarHBondContact O-ND2 3.37Å
367	S	48.6	Very low	44	Very low	68 Å²	68	73.6 Å²	73.6	48%	0.476	39%	0.39	S	S	.	.	H	α-helix	trans	-62.6	-47.1	173.3	-169.2	0	0	0	0	110.9	R363 K364 L365 N370 T371	R363-S367 VanDerWaalsContact O-CB 3.29Å; R363-S367 WeakPolarHBondContact O-CB 3.13Å; R363-S367 PolarHBondContact O-N 3.32Å; K364-S367 WeakPolarHBondContact O-CB 3.38Å; K364-S367 PolarHBondContact O-N 3.48Å; L365-S367 VanDerWaalsContact C-N 3.29Å; L365-S367 PolarHBondContact O-N 3.1Å; S367-N370 PolarHBondContact O-N 2.76Å; S367-T371 WeakPolarHBondContact O-CB 3.44Å; S367-T371 PolarHBondContact O-N 3.38Å; S367-T371 PolarHBondContact O-OG1 2.96Å
368	W	49.6	Very low	44.7	Very low	88 Å²	88	75.5 Å²	75.5	33%	0.333	38%	0.381	S	S	.	.	H	α-helix	trans	-63.2	-46.2	179.5	-177.8	91.8	0	0	0	112.1	I348 K364 L365 N370 T371 N372 I376	I348-W368 HydrophobicContact CD1-CH2 4.46Å; I348-W368 HydrophobicContact CG1-CH2 4.37Å; K364-W368 WeakPolarHBondContact O-CB 3Å; K364-W368 PolarHBondContact O-N 2.98Å; L365-W368 PolarHBondContact O-N 3.24Å; L365-W368 VanDerWaalsContact O-N 3.16Å; W368-N370 VanDerWaalsContact C-N 3.32Å; W368-N370 PolarHBondContact O-N 3.38Å; W368-T371 PolarHBondContact O-N 2.85Å; W368-N372 VanDerWaalsContact CD1-ND2 3.32Å; W368-N372 VanDerWaalsContact CE2-ND2 3.32Å; W368-N372 HydrophobicContact CZ2-CB 4.47Å; W368-N372 PolarHBondContact NE1-ND2 2.91Å; W368-N372 VanDerWaalsContact NE1-ND2 3.18Å; W368-N372 WeakPolarHBondContact O-CB 3.42Å; W368-N372 PolarHBondContact O-N 3Å; W368-N372 PolarHBondContact O-ND2 3.34Å; W368-I376 HydrophobicContact CZ3-CD1 4.08Å
369	L	48.1	Very low	45.4	Very low	3 Å²	3	75.7 Å²	75.7	2%	0.016	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-44	174.7	-77.2	172.2	0	0	0	110.8	L352 L365 N372 L373 I376	L352-L369 HydrophobicContact CD2-CD1 4.29Å; L365-L369 HydrophobicContact CD1-CG 4.45Å; L365-L369 HydrophobicContact CG-CD1 4.3Å; L365-L369 WeakPolarHBondContact O-CB 3.44Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 3.34Å; L369-N372 CarbonylContact O-C 3.55Å; L369-N372 PolarHBondContact O-N 2.86Å; L369-L373 VanDerWaalsContact O-CA 3.26Å; L369-L373 WeakPolarHBondContact O-CA 2.96Å; L369-L373 VanDerWaalsContact O-CB 3.26Å; L369-L373 WeakPolarHBondContact O-CB 3.49Å; L369-L373 PolarHBondContact O-N 3.47Å; L369-I376 HydrophobicContact CD2-CD1 3.63Å
370	N	48.9	Very low	46.1	Very low	76 Å²	76	72.4 Å²	72.4	41%	0.406	35%	0.351	S	S	.	.	H	α-helix	trans	-67.7	-35.1	177.1	-73	-13.7	0	0	0	112.7	K366 S367 W368 S419	K366-N370 VanDerWaalsContact O-CB 3.24Å; K366-N370 WeakPolarHBondContact O-CB 3.35Å; K366-N370 PolarHBondContact O-N 2.94Å; K366-N370 PolarHBondContact O-ND2 3.37Å; S367-N370 PolarHBondContact O-N 2.76Å; W368-N370 VanDerWaalsContact C-N 3.32Å; W368-N370 PolarHBondContact O-N 3.38Å; N370-S419 PolarHBondContact OD1-OG 2.9Å; N370-S419 VanDerWaalsContact OD1-OG 3.1Å
371	T	49.8	Very low	46.7	Very low	102 Å²	102	69.6 Å²	69.6	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-71.1	-36.6	177.2	-61.1	0	0	0	0	111.9	S367 W368	S367-T371 WeakPolarHBondContact O-CB 3.44Å; S367-T371 PolarHBondContact O-N 3.38Å; S367-T371 PolarHBondContact O-OG1 2.96Å; W368-T371 PolarHBondContact O-N 2.85Å
372	N	47.8	Very low	47	Very low	25 Å²	25	70 Å²	70	13%	0.134	35%	0.346	C	S	.	.	S	Bend	trans	-103	10.1	-177	-60.6	-73.4	0	0	0	112.8	W368 L369 D374 Q375 I376	W368-N372 VanDerWaalsContact CD1-ND2 3.32Å; W368-N372 VanDerWaalsContact CE2-ND2 3.32Å; W368-N372 HydrophobicContact CZ2-CB 4.47Å; W368-N372 PolarHBondContact NE1-ND2 2.91Å; W368-N372 VanDerWaalsContact NE1-ND2 3.18Å; W368-N372 WeakPolarHBondContact O-CB 3.42Å; W368-N372 PolarHBondContact O-N 3Å; W368-N372 PolarHBondContact O-ND2 3.34Å; L369-N372 CarbonylContact O-C 3.55Å; L369-N372 PolarHBondContact O-N 2.86Å; N372-D374 VanDerWaalsContact C-N 3.31Å; N372-D374 PolarHBondContact O-N 3.32Å; N372-Q375 WeakPolarHBondContact O-CA 3.4Å; N372-Q375 WeakPolarHBondContact O-CB 3.46Å; N372-Q375 PolarHBondContact O-N 3.23Å; N372-Q375 PolarHBondContact OD1-OE1 2.67Å; N372-I376 WeakPolarHBondContact O-CG1 3.45Å; N372-I376 PolarHBondContact O-N 2.85Å
373	L	50.3	Low	47.8	Very low	4 Å²	4	67.8 Å²	67.8	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-43.1	-174.8	-171.7	65.8	0	0	0	111.5	L369 Q375 I376 V377 S419 L420 N423	L369-L373 VanDerWaalsContact O-CA 3.26Å; L369-L373 WeakPolarHBondContact O-CA 2.96Å; L369-L373 VanDerWaalsContact O-CB 3.26Å; L369-L373 WeakPolarHBondContact O-CB 3.49Å; L369-L373 PolarHBondContact O-N 3.47Å; L373-Q375 PolarHBondContact O-N 2.82Å; L373-I376 PolarHBondContact O-N 3.38Å; L373-V377 HydrophobicContact CD1-CG2 4.27Å; L373-V377 HydrophobicContact CG-CG2 4.02Å; L373-V377 VanDerWaalsContact O-CB 3.29Å; L373-V377 WeakPolarHBondContact O-CB 3.24Å; L373-V377 WeakPolarHBondContact O-CG2 3.1Å; L373-V377 PolarHBondContact O-N 2.74Å; L373-S419 WeakPolarHBondContact CD2-O 3.5Å; L373-L420 HydrophobicContact CD1-CD2 4.03Å; L373-L420 HydrophobicContact CD1-CG 4.37Å; L373-N423 HydrophobicContact CD2-CB 3.46Å; L373-N423 VanDerWaalsContact CD2-CB 3.46Å; L373-N423 WeakPolarHBondContact CD2-ND2 3.48Å
374	D	48.4	Very low	48.2	Very low	89 Å²	89	63.3 Å²	63.3	48%	0.476	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-29.5	177.9	-66.6	-16.8	0	0	0	111.6	N372 K378	N372-D374 VanDerWaalsContact C-N 3.31Å; N372-D374 PolarHBondContact O-N 3.32Å; D374-K378 WeakPolarHBondContact O-CB 3.49Å; D374-K378 WeakPolarHBondContact O-CG 3.06Å; D374-K378 PolarHBondContact O-N 3.47Å
375	Q	49.7	Very low	48.2	Very low	69 Å²	69	58 Å²	58	32%	0.322	30%	0.299	S	S	.	.	H	α-helix	trans	-79.1	-41.7	176.7	-61.7	174	0.4	0	0	111.3	A308 N372 L373 V377 K378 F379	A308-Q375 HydrophobicContact CB-CB 4.19Å; A308-Q375 HydrophobicContact CB-CG 3.9Å; N372-Q375 WeakPolarHBondContact O-CA 3.4Å; N372-Q375 WeakPolarHBondContact O-CB 3.46Å; N372-Q375 PolarHBondContact O-N 3.23Å; N372-Q375 PolarHBondContact OD1-OE1 2.67Å; L373-Q375 PolarHBondContact O-N 2.82Å; Q375-V377 VanDerWaalsContact C-N 3.34Å; Q375-K378 WeakPolarHBondContact O-CB 3.27Å; Q375-K378 PolarHBondContact O-N 2.96Å; Q375-F379 WeakPolarHBondContact O-CD2 3.27Å; Q375-F379 PolarHBondContact O-N 3.24Å
376	I	50.4	Low	48.5	Very low	15 Å²	15	57.2 Å²	57.2	8%	0.077	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-42.6	173.7	-64.7	167.8	0	0	0	110.3	W368 L369 N372 L373 F379 L380	W368-I376 HydrophobicContact CZ3-CD1 4.08Å; L369-I376 HydrophobicContact CD2-CD1 3.63Å; N372-I376 WeakPolarHBondContact O-CG1 3.45Å; N372-I376 PolarHBondContact O-N 2.85Å; L373-I376 PolarHBondContact O-N 3.38Å; I376-F379 WeakPolarHBondContact O-CB 3.37Å; I376-F379 PolarHBondContact O-N 3Å; I376-L380 HydrophobicContact CG2-CD1 3.92Å; I376-L380 HydrophobicContact CG2-CG 4.43Å; I376-L380 WeakPolarHBondContact O-CB 3.41Å; I376-L380 VanDerWaalsContact O-CG 3.28Å; I376-L380 WeakPolarHBondContact O-CG 3.45Å; I376-L380 PolarHBondContact O-N 3.25Å
377	V	49.5	Very low	48.6	Very low	18 Å²	18	51.6 Å²	51.6	11%	0.109	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-48.6	172.7	171.6	0	0	0	0	109.3	L373 Q375 F379 L380 V381 L420 V427 A431	L373-V377 HydrophobicContact CD1-CG2 4.27Å; L373-V377 HydrophobicContact CG-CG2 4.02Å; L373-V377 VanDerWaalsContact O-CB 3.29Å; L373-V377 WeakPolarHBondContact O-CB 3.24Å; L373-V377 WeakPolarHBondContact O-CG2 3.1Å; L373-V377 PolarHBondContact O-N 2.74Å; Q375-V377 VanDerWaalsContact C-N 3.34Å; V377-F379 VanDerWaalsContact C-N 3.3Å; V377-F379 PolarHBondContact O-N 2.96Å; V377-L380 CarbonylContact O-C 3.56Å; V377-L380 PolarHBondContact O-N 3.15Å; V377-L380 VanDerWaalsContact O-N 3.14Å; V377-V381 HydrophobicContact CG1-CG2 3.76Å; V377-V381 WeakPolarHBondContact O-CB 3.23Å; V377-V381 WeakPolarHBondContact O-CG2 3.49Å; V377-V381 PolarHBondContact O-N 2.94Å; V377-L420 HydrophobicContact CG2-CD2 3.27Å; V377-V427 HydrophobicContact CG2-CG2 4.31Å; V377-A431 HydrophobicContact CG1-CB 4.4Å
378	K	50.8	Low	48.6	Very low	136 Å²	136	52.4 Å²	52.4	59%	0.591	27%	0.268	S	S	*	.	H	α-helix	trans	-56.5	-44	174.2	-79.3	171.1	-175.3	-175.9	0	111.9	D374 Q375 L380 V381 L382	D374-K378 WeakPolarHBondContact O-CB 3.49Å; D374-K378 WeakPolarHBondContact O-CG 3.06Å; D374-K378 PolarHBondContact O-N 3.47Å; Q375-K378 WeakPolarHBondContact O-CB 3.27Å; Q375-K378 PolarHBondContact O-N 2.96Å; K378-L380 PolarHBondContact O-N 3.19Å; K378-V381 PolarHBondContact O-N 3.21Å; K378-L382 VanDerWaalsContact O-CB 3.26Å; K378-L382 WeakPolarHBondContact O-CB 3.45Å; K378-L382 VanDerWaalsContact O-CD1 3.28Å; K378-L382 WeakPolarHBondContact O-CD1 3.42Å; K378-L382 WeakPolarHBondContact O-CG 3.48Å; K378-L382 PolarHBondContact O-N 3.02Å
379	F	49.8	Very low	48.5	Very low	46 Å²	46	49.8 Å²	49.8	20%	0.202	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-43.3	175.2	-96.2	-73.1	0	0	0	112.9	V340 S341 Q375 I376 V377	V340-F379 HydrophobicContact CG1-CE1 4.08Å; V340-F379 HydrophobicContact CG1-CZ 4.34Å; S341-F379 WeakPolarHBondContact OG-CD1 3.31Å; Q375-F379 WeakPolarHBondContact O-CD2 3.27Å; Q375-F379 PolarHBondContact O-N 3.24Å; I376-F379 WeakPolarHBondContact O-CB 3.37Å; I376-F379 PolarHBondContact O-N 3Å; V377-F379 VanDerWaalsContact C-N 3.3Å; V377-F379 PolarHBondContact O-N 2.96Å
380	L	49.1	Very low	48.6	Very low	26 Å²	26	51.9 Å²	51.9	14%	0.136	27%	0.271	C	S	.	.	H	α-helix	trans	-72.6	-31.8	176.9	-69.5	168.7	0	0	0	112.9	I376 V377 K378 L390 V416 L420	I376-L380 HydrophobicContact CG2-CD1 3.92Å; I376-L380 HydrophobicContact CG2-CG 4.43Å; I376-L380 WeakPolarHBondContact O-CB 3.41Å; I376-L380 VanDerWaalsContact O-CG 3.28Å; I376-L380 WeakPolarHBondContact O-CG 3.45Å; I376-L380 PolarHBondContact O-N 3.25Å; V377-L380 CarbonylContact O-C 3.56Å; V377-L380 PolarHBondContact O-N 3.15Å; V377-L380 VanDerWaalsContact O-N 3.14Å; K378-L380 PolarHBondContact O-N 3.19Å; L380-L390 HydrophobicContact CD2-CD1 3.95Å; L380-V416 HydrophobicContact CD1-CG1 4.47Å; L380-L420 HydrophobicContact CD1-CD1 3.87Å; L380-L420 HydrophobicContact CD1-CD2 4.44Å
381	V	45.5	Very low	48.6	Very low	37 Å²	37	48.5 Å²	48.5	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-75.3	-31.5	178.9	169.6	0	0	0	0	111.1	V377 K378 D383 A431 K434	V377-V381 HydrophobicContact CG1-CG2 3.76Å; V377-V381 WeakPolarHBondContact O-CB 3.23Å; V377-V381 WeakPolarHBondContact O-CG2 3.49Å; V377-V381 PolarHBondContact O-N 2.94Å; K378-V381 PolarHBondContact O-N 3.21Å; V381-D383 PolarHBondContact O-N 3.49Å; V381-A431 HydrophobicContact CG2-CB 3.21Å; V381-K434 VanDerWaalsContact O-CE 3.31Å; V381-K434 WeakPolarHBondContact O-CE 3.41Å; V381-K434 PolarHBondContact O-NZ 3.39Å
382	L	43.6	Very low	48.5	Very low	140 Å²	140	46.1 Å²	46.1	73%	0.733	24%	0.24	S	C	*	.	H	α-helix	trans	-78	-16.3	-175.5	-74.5	165.7	0	0	0	113.9	K378	K378-L382 VanDerWaalsContact O-CB 3.26Å; K378-L382 WeakPolarHBondContact O-CB 3.45Å; K378-L382 VanDerWaalsContact O-CD1 3.28Å; K378-L382 WeakPolarHBondContact O-CD1 3.42Å; K378-L382 WeakPolarHBondContact O-CG 3.48Å; K378-L382 PolarHBondContact O-N 3.02Å
383	D	53.2	Low	48.5	Very low	17 Å²	17	46.5 Å²	46.5	9%	0.091	24%	0.241	C	C	.	.			trans	-144.3	107.1	-170.2	-167.1	-9.1	0	0	0	113.6	R338 V381 C385 A386	R338-D383 WeakPolarHBondContact CA-OD2 3.1Å; R338-D383 WeakPolarHBondContact CG-OD2 3.17Å; V381-D383 PolarHBondContact O-N 3.49Å; D383-C385 PolarHBondContact O-N 3.17Å; D383-C385 WeakPolarHBondContact OD1-CA 3.22Å; D383-C385 WeakPolarHBondContact OD1-CB 3.15Å; D383-C385 PolarHBondContact OD1-N 3.32Å; D383-A386 HydrophobicContact CB-CB 3.81Å; D383-A386 WeakPolarHBondContact O-CB 3.41Å; D383-A386 PolarHBondContact O-N 2.73Å; D383-A386 VanDerWaalsContact O-N 3.16Å; D383-A386 PolarHBondContact OD1-N 3.34Å
384	D	49.3	Very low	48.5	Very low	88 Å²	88	46.9 Å²	46.9	47%	0.471	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-29.6	173.8	-69.4	-20.5	0	0	0	112	Q388 K434	D384-Q388 WeakPolarHBondContact O-CG 3.29Å; D384-Q388 PolarHBondContact O-N 2.87Å; D384-K434 WeakPolarHBondContact OD1-CE 3.33Å; D384-K434 IonicContact OD1-NZ 2.83Å; D384-K434 PolarHBondContact OD1-NZ 3.43Å
385	C	43.4	Very low	48.4	Very low	31 Å²	31	46.7 Å²	46.7	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-72.1	-33.3	176	-65.5	0	0	0	0	111.1	R338 D383 A387 Q388 L389	R338-C385 PolarHBondContact NH1-SG 3.41Å; R338-C385 VanDerWaalsContact NH1-SG 3.39Å; D383-C385 PolarHBondContact O-N 3.17Å; D383-C385 WeakPolarHBondContact OD1-CA 3.22Å; D383-C385 WeakPolarHBondContact OD1-CB 3.15Å; D383-C385 PolarHBondContact OD1-N 3.32Å; C385-A387 VanDerWaalsContact C-N 3.31Å; C385-A387 PolarHBondContact O-N 2.88Å; C385-Q388 PolarHBondContact O-N 2.74Å; C385-L389 HydrophobicContact CB-CD1 4.01Å; C385-L389 WeakPolarHBondContact O-CB 3.28Å; C385-L389 VanDerWaalsContact O-CD1 3.29Å; C385-L389 WeakPolarHBondContact O-CD1 3.21Å; C385-L389 VanDerWaalsContact O-CG 3.25Å; C385-L389 WeakPolarHBondContact O-CG 3.12Å; C385-L389 PolarHBondContact O-N 3.1Å
386	A	47.7	Very low	48.1	Very low	1 Å²	1	48.5 Å²	48.5	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-63.1	-37.9	176.5	0	0	0	0	0	112	L345 D383 L390	L345-A386 HydrophobicContact CD1-CB 4.24Å; D383-A386 HydrophobicContact CB-CB 3.81Å; D383-A386 WeakPolarHBondContact O-CB 3.41Å; D383-A386 PolarHBondContact O-N 2.73Å; D383-A386 VanDerWaalsContact O-N 3.16Å; D383-A386 PolarHBondContact OD1-N 3.34Å; A386-L390 WeakPolarHBondContact O-CB 3.41Å; A386-L390 PolarHBondContact O-N 2.95Å
387	A	47.8	Very low	47.8	Very low	4 Å²	4	47.9 Å²	47.9	3%	0.033	24%	0.244	C	C	.	.	H	α-helix	trans	-68.6	-42.9	175.1	0	0	0	0	0	112.4	C385 A391	C385-A387 VanDerWaalsContact C-N 3.31Å; C385-A387 PolarHBondContact O-N 2.88Å; A387-A391 PolarHBondContact O-N 2.93Å
388	Q	48.7	Very low	47.6	Very low	86 Å²	86	48.5 Å²	48.5	40%	0.402	25%	0.248	S	C	.	.	H	α-helix	trans	-67.5	-38.6	175.9	-70.1	175.9	4.7	0	0	112	D384 C385 A391 C392 L437	D384-Q388 WeakPolarHBondContact O-CG 3.29Å; D384-Q388 PolarHBondContact O-N 2.87Å; C385-Q388 PolarHBondContact O-N 2.74Å; Q388-A391 CarbonylContact O-C 3.58Å; Q388-A391 WeakPolarHBondContact O-CB 3.26Å; Q388-A391 PolarHBondContact O-N 3.41Å; Q388-C392 PolarHBondContact O-N 2.95Å; Q388-C392 PolarHBondContact O-SG 2.93Å; Q388-L437 HydrophobicContact CG-CD2 4.11Å
389	L	46.8	Very low	47.2	Very low	33 Å²	33	48 Å²	48	17%	0.173	25%	0.25	C	C	.	.	H	α-helix	trans	-76.3	-32.7	-179.3	-75.8	155.1	0	0	0	112.3	L330 L342 C385 A391 C392 F393	L330-L389 HydrophobicContact CD1-CD2 4.19Å; L330-L389 HydrophobicContact CD2-CD2 3.85Å; L330-L389 HydrophobicContact CG-CD2 4.49Å; L342-L389 HydrophobicContact CD1-CD1 4.09Å; L342-L389 HydrophobicContact CD2-CB 3.74Å; L342-L389 HydrophobicContact CD2-CD1 3.88Å; L342-L389 HydrophobicContact CD2-CD2 4.47Å; L342-L389 HydrophobicContact CD2-CG 4.23Å; L342-L389 HydrophobicContact CG-CD1 4.26Å; C385-L389 HydrophobicContact CB-CD1 4.01Å; C385-L389 WeakPolarHBondContact O-CB 3.28Å; C385-L389 VanDerWaalsContact O-CD1 3.29Å; C385-L389 WeakPolarHBondContact O-CD1 3.21Å; C385-L389 VanDerWaalsContact O-CG 3.25Å; C385-L389 WeakPolarHBondContact O-CG 3.12Å; C385-L389 PolarHBondContact O-N 3.1Å; L389-A391 PolarHBondContact O-N 2.97Å; L389-C392 PolarHBondContact O-N 3.23Å; L389-F393 WeakPolarHBondContact O-CB 3.44Å; L389-F393 PolarHBondContact O-N 3.44Å
390	L	50.3	Low	46.6	Very low	47 Å²	47	51.3 Å²	51.3	25%	0.246	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-37.7	166	-102.6	154	0	0	0	111.5	L345 L380 A386 Y394	L345-L390 HydrophobicContact CD1-CD1 3.35Å; L345-L390 HydrophobicContact CD1-CG 3.94Å; L345-L390 HydrophobicContact CD2-CD1 3.82Å; L345-L390 HydrophobicContact CG-CD1 4.1Å; L380-L390 HydrophobicContact CD2-CD1 3.95Å; A386-L390 WeakPolarHBondContact O-CB 3.41Å; A386-L390 PolarHBondContact O-N 2.95Å; L390-Y394 WeakPolarHBondContact O-CB 3.22Å; L390-Y394 PolarHBondContact O-N 3.49Å
391	A	49	Very low	46.3	Very low	5 Å²	5	52.3 Å²	52.3	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-70.1	-43.4	175	0	0	0	0	0	112.2	A387 Q388 L389 F393 Y394 E395 Y441	A387-A391 PolarHBondContact O-N 2.93Å; Q388-A391 CarbonylContact O-C 3.58Å; Q388-A391 WeakPolarHBondContact O-CB 3.26Å; Q388-A391 PolarHBondContact O-N 3.41Å; L389-A391 PolarHBondContact O-N 2.97Å; A391-F393 VanDerWaalsContact C-N 3.31Å; A391-F393 PolarHBondContact O-N 3.35Å; A391-Y394 VanDerWaalsContact O-CB 3.31Å; A391-Y394 WeakPolarHBondContact O-CB 3.4Å; A391-Y394 PolarHBondContact O-N 2.66Å; A391-Y394 VanDerWaalsContact O-N 3.14Å; A391-E395 PolarHBondContact O-N 3.27Å; A391-Y441 VanDerWaalsContact CB-CB 3.45Å; A391-Y441 HydrophobicContact CB-CD1 3.5Å; A391-Y441 HydrophobicContact CB-CD2 3.76Å; A391-Y441 HydrophobicContact CB-CE1 4.12Å; A391-Y441 HydrophobicContact CB-CE2 4.35Å; A391-Y441 HydrophobicContact CB-CG 3.3Å
392	C	47	Very low	46.3	Very low	51 Å²	51	54 Å²	54	35%	0.345	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-38.5	171.8	-63.9	0	0	0	0	111.6	Q388 L389 Y394 E395 E396	Q388-C392 PolarHBondContact O-N 2.95Å; Q388-C392 PolarHBondContact O-SG 2.93Å; L389-C392 PolarHBondContact O-N 3.23Å; C392-Y394 VanDerWaalsContact C-N 3.27Å; C392-Y394 PolarHBondContact O-N 3.37Å; C392-E395 WeakPolarHBondContact O-CB 3.46Å; C392-E395 PolarHBondContact O-N 2.83Å; C392-E396 WeakPolarHBondContact O-CB 3.45Å; C392-E396 PolarHBondContact O-N 3.48Å
393	F	48.3	Very low	46.4	Very low	34 Å²	34	51.5 Å²	51.5	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-32.9	175.4	-167.5	-98.6	0	0	0	111	Y346 L389 A391 A397 L409	Y346-F393 AromaticContact CD2-CE2 3.94Å; Y346-F393 HydrophobicContact CD2-CE2 3.94Å; Y346-F393 AromaticContact CD2-CZ 3.68Å; Y346-F393 HydrophobicContact CD2-CZ 3.68Å; Y346-F393 HydrophobicContact CE2-CE2 4.19Å; Y346-F393 AromaticContact CE2-CZ 3.88Å; Y346-F393 HydrophobicContact CE2-CZ 3.88Å; L389-F393 WeakPolarHBondContact O-CB 3.44Å; L389-F393 PolarHBondContact O-N 3.44Å; A391-F393 VanDerWaalsContact C-N 3.31Å; A391-F393 PolarHBondContact O-N 3.35Å; F393-A397 WeakPolarHBondContact O-CA 3.26Å; F393-A397 WeakPolarHBondContact O-CB 3.45Å; F393-A397 PolarHBondContact O-N 2.87Å; F393-L409 HydrophobicContact CD1-CD1 3.77Å; F393-L409 HydrophobicContact CD1-CD2 4.33Å; F393-L409 HydrophobicContact CE1-CD1 3.45Å; F393-L409 VanDerWaalsContact CE1-CD1 3.45Å
394	Y	49.9	Very low	45.9	Very low	12 Å²	12	57 Å²	57	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-67.8	-43.9	171	-158.7	-86.9	0	0	0	111.3	L390 A391 C392 A397 V398 L409 H445 L449	L390-Y394 WeakPolarHBondContact O-CB 3.22Å; L390-Y394 PolarHBondContact O-N 3.49Å; A391-Y394 VanDerWaalsContact O-CB 3.31Å; A391-Y394 WeakPolarHBondContact O-CB 3.4Å; A391-Y394 PolarHBondContact O-N 2.66Å; A391-Y394 VanDerWaalsContact O-N 3.14Å; C392-Y394 VanDerWaalsContact C-N 3.27Å; C392-Y394 PolarHBondContact O-N 3.37Å; Y394-A397 PolarHBondContact O-N 3.27Å; Y394-V398 HydrophobicContact CD1-CG2 3.96Å; Y394-V398 HydrophobicContact CE1-CG2 3.88Å; Y394-V398 WeakPolarHBondContact O-CB 2.97Å; Y394-V398 WeakPolarHBondContact O-CG2 3.36Å; Y394-V398 PolarHBondContact O-N 3.43Å; Y394-L409 HydrophobicContact CD2-CD2 3.47Å; Y394-L409 VanDerWaalsContact CD2-CD2 3.47Å; Y394-L409 HydrophobicContact CD2-CG 4.46Å; Y394-L409 HydrophobicContact CE2-CD2 4.03Å; Y394-L409 HydrophobicContact CG-CD2 4.15Å; Y394-H445 HydrophobicContact CD1-CB 3.76Å; Y394-H445 HydrophobicContact CE1-CB 4.08Å; Y394-L449 HydrophobicContact CE1-CD2 4.2Å; Y394-L449 HydrophobicContact CE1-CG 4.45Å; Y394-L449 WeakPolarHBondContact OH-CD1 3.38Å; Y394-L449 WeakPolarHBondContact OH-CD2 3.07Å
395	E	47	Very low	45.6	Very low	85 Å²	85	55.1 Å²	55.1	40%	0.397	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-49.3	175.8	-175.3	170.4	-160.4	0	0	111.5	A391 C392 V398 I399 H445	A391-E395 PolarHBondContact O-N 3.27Å; C392-E395 WeakPolarHBondContact O-CB 3.46Å; C392-E395 PolarHBondContact O-N 2.83Å; E395-V398 PolarHBondContact O-N 3.35Å; E395-I399 HydrophobicContact CG-CD1 4.03Å; E395-I399 WeakPolarHBondContact O-CD1 3.35Å; E395-I399 VanDerWaalsContact O-CG1 3.23Å; E395-I399 WeakPolarHBondContact O-CG1 3.16Å; E395-I399 PolarHBondContact O-N 3.23Å; E395-I399 VanDerWaalsContact O-N 3.15Å; E395-H445 VanDerWaalsContact CD-CE1 3.44Å; E395-H445 IonicContact OE1-CE1 3.12Å; E395-H445 IonicContact OE2-CE1 3.22Å
396	E	42.5	Very low	45.8	Very low	107 Å²	107	54.5 Å²	54.5	50%	0.5	29%	0.292	S	S	.	.	H	α-helix	trans	-68.5	-39.4	177.2	-74.3	-145.9	168.6	0	0	112.7	C392 V398 I399 L400	C392-E396 WeakPolarHBondContact O-CB 3.45Å; C392-E396 PolarHBondContact O-N 3.48Å; E396-V398 VanDerWaalsContact C-N 3.29Å; E396-V398 PolarHBondContact O-N 3.13Å; E396-I399 PolarHBondContact O-N 3.16Å; E396-I399 VanDerWaalsContact O-N 3.13Å; E396-L400 HydrophobicContact CB-CD1 4.08Å; E396-L400 HydrophobicContact CG-CD1 4.45Å; E396-L400 VanDerWaalsContact O-CB 3.22Å; E396-L400 WeakPolarHBondContact O-CB 3.29Å; E396-L400 WeakPolarHBondContact O-CG 3.14Å; E396-L400 PolarHBondContact O-N 2.82Å
397	A	44	Very low	45.8	Very low	2 Å²	2	58.3 Å²	58.3	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-39.8	176.3	0	0	0	0	0	111.8	F393 Y394 I399 L401 C406 L409	F393-A397 WeakPolarHBondContact O-CA 3.26Å; F393-A397 WeakPolarHBondContact O-CB 3.45Å; F393-A397 PolarHBondContact O-N 2.87Å; Y394-A397 PolarHBondContact O-N 3.27Å; A397-I399 VanDerWaalsContact C-N 3.29Å; A397-I399 PolarHBondContact O-N 3.03Å; A397-L401 HydrophobicContact CB-CD1 3.57Å; A397-L401 HydrophobicContact CB-CG 4.43Å; A397-L401 VanDerWaalsContact O-CB 3.31Å; A397-L401 WeakPolarHBondContact O-CB 3.5Å; A397-L401 PolarHBondContact O-N 3.4Å; A397-L401 VanDerWaalsContact O-N 3.15Å; A397-C406 PolarHBondContact O-SG 3.45Å; A397-L409 HydrophobicContact CB-CD2 3.73Å
398	V	45.9	Very low	45.7	Very low	31 Å²	31	58.2 Å²	58.2	19%	0.188	31%	0.306	C	S	.	.	H	α-helix	trans	-69.1	-29.1	177	173.8	0	0	0	0	112.1	Y394 E395 E396 Y448 L449	Y394-V398 HydrophobicContact CD1-CG2 3.96Å; Y394-V398 HydrophobicContact CE1-CG2 3.88Å; Y394-V398 WeakPolarHBondContact O-CB 2.97Å; Y394-V398 WeakPolarHBondContact O-CG2 3.36Å; Y394-V398 PolarHBondContact O-N 3.43Å; E395-V398 PolarHBondContact O-N 3.35Å; E396-V398 VanDerWaalsContact C-N 3.29Å; E396-V398 PolarHBondContact O-N 3.13Å; V398-Y448 VanDerWaalsContact CG1-CB 3.42Å; V398-Y448 VanDerWaalsContact CG1-O 3.3Å; V398-Y448 WeakPolarHBondContact CG1-O 3.44Å; V398-L449 HydrophobicContact CG2-CD2 3.8Å
399	I	42.2	Very low	45.8	Very low	124 Å²	124	54.9 Å²	54.9	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-85.7	-36.6	179.4	-67	167	0	0	0	112.4	E395 E396 A397	E395-I399 HydrophobicContact CG-CD1 4.03Å; E395-I399 WeakPolarHBondContact O-CD1 3.35Å; E395-I399 VanDerWaalsContact O-CG1 3.23Å; E395-I399 WeakPolarHBondContact O-CG1 3.16Å; E395-I399 PolarHBondContact O-N 3.23Å; E395-I399 VanDerWaalsContact O-N 3.15Å; E396-I399 PolarHBondContact O-N 3.16Å; E396-I399 VanDerWaalsContact O-N 3.13Å; A397-I399 VanDerWaalsContact C-N 3.29Å; A397-I399 PolarHBondContact O-N 3.03Å
400	L	37.5	Very low	46.1	Very low	117 Å²	117	53.5 Å²	53.5	61%	0.613	28%	0.283	S	S	*	.	H	α-helix	trans	-108.1	-17.8	-164	-65	172	0	0	0	114.9	E396	E396-L400 HydrophobicContact CB-CD1 4.08Å; E396-L400 HydrophobicContact CG-CD1 4.45Å; E396-L400 VanDerWaalsContact O-CB 3.22Å; E396-L400 WeakPolarHBondContact O-CB 3.29Å; E396-L400 WeakPolarHBondContact O-CG 3.14Å; E396-L400 PolarHBondContact O-N 2.82Å
401	L	41.9	Very low	46.2	Very low	46 Å²	46	53.9 Å²	53.9	24%	0.241	28%	0.282	C	S	.	.	S	Bend	trans	-111.9	145.8	-165.5	-54.5	171.8	0	0	0	113.1	L327 A397 Y405	L327-L401 HydrophobicContact CD2-CD2 4.44Å; A397-L401 HydrophobicContact CB-CD1 3.57Å; A397-L401 HydrophobicContact CB-CG 4.43Å; A397-L401 VanDerWaalsContact O-CB 3.31Å; A397-L401 WeakPolarHBondContact O-CB 3.5Å; A397-L401 PolarHBondContact O-N 3.4Å; A397-L401 VanDerWaalsContact O-N 3.15Å; L401-Y405 HydrophobicContact CB-CD1 4.37Å; L401-Y405 HydrophobicContact CB-CG 4.24Å; L401-Y405 HydrophobicContact CD1-CD1 3.21Å; L401-Y405 HydrophobicContact CD1-CE1 3.61Å; L401-Y405 HydrophobicContact CD1-CG 3.85Å; L401-Y405 HydrophobicContact CG-CD1 4.28Å; L401-Y405 HydrophobicContact CG-CG 4.48Å
402	A	46	Very low	46.3	Very low	74 Å²	74	53.9 Å²	53.9	61%	0.612	28%	0.282	S	S	*	.			trans	-55.5	149.7	174.3	0	0	0	0	0	111.2	D404 Y405	A402-D404 PolarHBondContact O-N 2.67Å; A402-Y405 PolarHBondContact O-N 3.4Å
403	D	45.9	Very low	46.8	Very low	87 Å²	87	53 Å²	53	47%	0.465	27%	0.271	S	S	.	.	H	α-helix	trans	-46.7	-34.1	-174.2	-71.6	-46.3	0	0	0	113.4	Y405 Y407 N450	D403-Y405 PolarHBondContact O-N 3.35Å; D403-Y407 WeakPolarHBondContact O-CB 3.3Å; D403-Y407 PolarHBondContact O-N 2.82Å; D403-Y407 VanDerWaalsContact O-N 3.09Å; D403-N450 PolarHBondContact OD1-ND2 3.27Å
404	D	43.2	Very low	47.2	Very low	132 Å²	132	55.1 Å²	55.1	71%	0.706	28%	0.278	S	S	*	.	H	α-helix	trans	-64.6	-36.6	179.3	-67	-35	0	0	0	113.9	A402 A408	A402-D404 PolarHBondContact O-N 2.67Å; D404-A408 WeakPolarHBondContact O-CB 3.28Å; D404-A408 PolarHBondContact O-N 2.89Å
405	Y	42.5	Very low	47.4	Very low	49 Å²	49	56.3 Å²	56.3	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-76.5	-39.8	-178.8	-147.1	-82.2	0	0	0	111.3	L401 A402 D403 Y407 A408 L409	L401-Y405 HydrophobicContact CB-CD1 4.37Å; L401-Y405 HydrophobicContact CB-CG 4.24Å; L401-Y405 HydrophobicContact CD1-CD1 3.21Å; L401-Y405 HydrophobicContact CD1-CE1 3.61Å; L401-Y405 HydrophobicContact CD1-CG 3.85Å; L401-Y405 HydrophobicContact CG-CD1 4.28Å; L401-Y405 HydrophobicContact CG-CG 4.48Å; A402-Y405 PolarHBondContact O-N 3.4Å; D403-Y405 PolarHBondContact O-N 3.35Å; Y405-Y407 VanDerWaalsContact C-N 3.29Å; Y405-Y407 PolarHBondContact O-N 3.03Å; Y405-A408 WeakPolarHBondContact O-CB 3.42Å; Y405-A408 PolarHBondContact O-N 2.97Å; Y405-L409 WeakPolarHBondContact O-CB 3.02Å; Y405-L409 PolarHBondContact O-N 2.97Å
406	C	47.2	Very low	47.6	Very low	17 Å²	17	53.4 Å²	53.4	12%	0.115	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-44.3	171.7	-70.6	0	0	0	0	111.1	A397 A408 L409 Y410	A397-C406 PolarHBondContact O-SG 3.45Å; C406-A408 PolarHBondContact O-N 3.05Å; C406-L409 PolarHBondContact O-N 2.72Å; C406-Y410 WeakPolarHBondContact O-CB 3.42Å; C406-Y410 PolarHBondContact O-N 2.76Å
407	Y	48.7	Very low	48.4	Very low	81 Å²	81	48.6 Å²	48.6	32%	0.318	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-45.9	177.8	-166.2	-136.8	0	0	0	109.8	R356 D403 Y405 Y410 Y411 V453	R356-Y407 VanDerWaalsContact NH1-CG 3.33Å; R356-Y407 PolarHBondContact NH2-O 3.13Å; D403-Y407 WeakPolarHBondContact O-CB 3.3Å; D403-Y407 PolarHBondContact O-N 2.82Å; D403-Y407 VanDerWaalsContact O-N 3.09Å; Y405-Y407 VanDerWaalsContact C-N 3.29Å; Y405-Y407 PolarHBondContact O-N 3.03Å; Y407-Y410 PolarHBondContact O-N 2.97Å; Y407-Y411 HydrophobicContact CD2-CD2 4.23Å; Y407-Y411 AromaticContact CD2-CE2 3.77Å; Y407-Y411 HydrophobicContact CD2-CE2 3.77Å; Y407-Y411 HydrophobicContact CE1-CE2 4.35Å; Y407-Y411 HydrophobicContact CE2-CD2 4.06Å; Y407-Y411 AromaticContact CE2-CE2 3.18Å; Y407-Y411 HydrophobicContact CE2-CE2 3.18Å; Y407-Y411 AromaticContact CE2-CZ 3.87Å; Y407-Y411 AromaticContact CZ-CE2 3.46Å; Y407-Y411 VanDerWaalsContact CZ-CE2 3.46Å; Y407-Y411 AromaticContact CZ-CZ 3.75Å; Y407-Y411 WeakPolarHBondContact O-CD2 3.39Å; Y407-Y411 PolarHBondContact O-N 3.41Å; Y407-Y411 VanDerWaalsContact O-N 3.16Å; Y407-Y411 PolarHBondContact OH-OH 3.45Å; Y407-V453 HydrophobicContact CD2-CG2 4.46Å
408	A	46	Very low	48.8	Very low	3 Å²	3	49.9 Å²	49.9	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-47.9	176.6	0	0	0	0	0	113.4	D404 Y405 C406 Y410 Y411 A412	D404-A408 WeakPolarHBondContact O-CB 3.28Å; D404-A408 PolarHBondContact O-N 2.89Å; Y405-A408 WeakPolarHBondContact O-CB 3.42Å; Y405-A408 PolarHBondContact O-N 2.97Å; C406-A408 PolarHBondContact O-N 3.05Å; A408-Y410 VanDerWaalsContact C-N 3.28Å; A408-Y410 PolarHBondContact O-N 3.5Å; A408-Y411 PolarHBondContact O-N 2.75Å; A408-Y411 VanDerWaalsContact O-N 3.15Å; A408-A412 WeakPolarHBondContact O-CB 3.22Å; A408-A412 PolarHBondContact O-N 3.15Å
409	L	49.9	Very low	49.2	Very low	15 Å²	15	48.7 Å²	48.7	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-40.7	177.4	-155.7	89.1	0	0	0	111.5	F393 Y394 A397 Y405 C406 Y411 A412 W413	F393-L409 HydrophobicContact CD1-CD1 3.77Å; F393-L409 HydrophobicContact CD1-CD2 4.33Å; F393-L409 HydrophobicContact CE1-CD1 3.45Å; F393-L409 VanDerWaalsContact CE1-CD1 3.45Å; Y394-L409 HydrophobicContact CD2-CD2 3.47Å; Y394-L409 VanDerWaalsContact CD2-CD2 3.47Å; Y394-L409 HydrophobicContact CD2-CG 4.46Å; Y394-L409 HydrophobicContact CE2-CD2 4.03Å; Y394-L409 HydrophobicContact CG-CD2 4.15Å; A397-L409 HydrophobicContact CB-CD2 3.73Å; Y405-L409 WeakPolarHBondContact O-CB 3.02Å; Y405-L409 PolarHBondContact O-N 2.97Å; C406-L409 PolarHBondContact O-N 2.72Å; L409-Y411 PolarHBondContact O-N 3.42Å; L409-A412 WeakPolarHBondContact O-CB 3.26Å; L409-A412 PolarHBondContact O-N 2.91Å; L409-W413 WeakPolarHBondContact O-CB 3.44Å; L409-W413 PolarHBondContact O-N 2.91Å
410	Y	53.1	Low	49.8	Very low	5 Å²	5	43.1 Å²	43.1	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-39.3	175.7	175.4	-101.6	0	0	0	112.8	C406 Y407 A408 W413 R414 L449 V453 V458	C406-Y410 WeakPolarHBondContact O-CB 3.42Å; C406-Y410 PolarHBondContact O-N 2.76Å; Y407-Y410 PolarHBondContact O-N 2.97Å; A408-Y410 VanDerWaalsContact C-N 3.28Å; A408-Y410 PolarHBondContact O-N 3.5Å; Y410-W413 HydrophobicContact CD2-CE3 4.08Å; Y410-W413 HydrophobicContact CD2-CZ3 4.39Å; Y410-W413 HydrophobicContact CE2-CE3 4.07Å; Y410-W413 AromaticContact CE2-CZ3 3.94Å; Y410-W413 HydrophobicContact CE2-CZ3 3.94Å; Y410-R414 VanDerWaalsContact O-CB 3.24Å; Y410-R414 WeakPolarHBondContact O-CB 3.43Å; Y410-R414 PolarHBondContact O-N 3.22Å; Y410-L449 HydrophobicContact CD2-CD1 4.2Å; Y410-V453 HydrophobicContact CD1-CG1 4.49Å; Y410-V453 HydrophobicContact CE1-CG1 4.34Å; Y410-V458 HydrophobicContact CE2-CG2 4.34Å
411	Y	52.8	Low	50.7	Low	54 Å²	54	37.8 Å²	37.8	21%	0.212	20%	0.199	C	C	.	.	H	α-helix	trans	-76.8	-35.9	179	-86.1	-112.8	0	0	0	112.8	R356 Y407 A408 L409 W413 R414 S415	R356-Y411 VanDerWaalsContact NH2-CG 3.29Å; Y407-Y411 HydrophobicContact CD2-CD2 4.23Å; Y407-Y411 AromaticContact CD2-CE2 3.77Å; Y407-Y411 HydrophobicContact CD2-CE2 3.77Å; Y407-Y411 HydrophobicContact CE1-CE2 4.35Å; Y407-Y411 HydrophobicContact CE2-CD2 4.06Å; Y407-Y411 AromaticContact CE2-CE2 3.18Å; Y407-Y411 HydrophobicContact CE2-CE2 3.18Å; Y407-Y411 AromaticContact CE2-CZ 3.87Å; Y407-Y411 AromaticContact CZ-CE2 3.46Å; Y407-Y411 VanDerWaalsContact CZ-CE2 3.46Å; Y407-Y411 AromaticContact CZ-CZ 3.75Å; Y407-Y411 WeakPolarHBondContact O-CD2 3.39Å; Y407-Y411 PolarHBondContact O-N 3.41Å; Y407-Y411 VanDerWaalsContact O-N 3.16Å; Y407-Y411 PolarHBondContact OH-OH 3.45Å; A408-Y411 PolarHBondContact O-N 2.75Å; A408-Y411 VanDerWaalsContact O-N 3.15Å; L409-Y411 PolarHBondContact O-N 3.42Å; Y411-W413 VanDerWaalsContact C-N 3.35Å; Y411-R414 PolarHBondContact O-N 2.95Å; Y411-S415 PolarHBondContact O-N 2.87Å; Y411-S415 PolarHBondContact O-OG 3.25Å
412	A	51	Low	51.4	Low	5 Å²	5	41.1 Å²	41.1	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-55.2	-55	169.3	0	0	0	0	0	110.1	L352 A408 L409 R414 S415 V416	L352-A412 HydrophobicContact CB-CB 3.29Å; L352-A412 HydrophobicContact CD1-CB 3.39Å; L352-A412 HydrophobicContact CG-CB 3.87Å; A408-A412 WeakPolarHBondContact O-CB 3.22Å; A408-A412 PolarHBondContact O-N 3.15Å; L409-A412 WeakPolarHBondContact O-CB 3.26Å; L409-A412 PolarHBondContact O-N 2.91Å; A412-R414 PolarHBondContact O-N 3.42Å; A412-S415 PolarHBondContact O-N 3.26Å; A412-V416 WeakPolarHBondContact O-CG2 3.41Å; A412-V416 PolarHBondContact O-N 3.21Å; A412-V416 VanDerWaalsContact O-N 3.13Å
413	W	57.1	Low	51.9	Low	34 Å²	34	39 Å²	39	13%	0.129	19%	0.191	C	C	.	.	H	α-helix	trans	-54.1	-53.6	175.1	175.9	87.2	0	0	0	111.4	L409 Y410 Y411 S415 V416 V417 W438 A442	L409-W413 WeakPolarHBondContact O-CB 3.44Å; L409-W413 PolarHBondContact O-N 2.91Å; Y410-W413 HydrophobicContact CD2-CE3 4.08Å; Y410-W413 HydrophobicContact CD2-CZ3 4.39Å; Y410-W413 HydrophobicContact CE2-CE3 4.07Å; Y410-W413 AromaticContact CE2-CZ3 3.94Å; Y410-W413 HydrophobicContact CE2-CZ3 3.94Å; Y411-W413 VanDerWaalsContact C-N 3.35Å; W413-S415 PolarHBondContact O-N 3.19Å; W413-V416 CarbonylContact O-C 3.58Å; W413-V416 WeakPolarHBondContact O-CA 3.41Å; W413-V416 WeakPolarHBondContact O-CB 3.11Å; W413-V416 PolarHBondContact O-N 2.95Å; W413-V417 HydrophobicContact CD2-CG2 3.54Å; W413-V417 HydrophobicContact CE3-CG2 3.81Å; W413-V417 HydrophobicContact CG-CG2 4.22Å; W413-V417 HydrophobicContact CH2-CG2 3.61Å; W413-V417 HydrophobicContact CZ2-CG2 3.31Å; W413-V417 HydrophobicContact CZ3-CG2 3.84Å; W413-V417 VanDerWaalsContact O-CG2 3.31Å; W413-V417 WeakPolarHBondContact O-CG2 3.26Å; W413-V417 PolarHBondContact O-N 2.84Å; W413-W438 AromaticContact CD1-CE2 3.49Å; W413-W438 VanDerWaalsContact CD1-CE2 3.49Å; W413-W438 AromaticContact CD1-CH2 3.96Å; W413-W438 AromaticContact CD1-CZ2 3.12Å; W413-W438 AromaticContact CD1-NE1 3.72Å; W413-W438 HydrophobicContact CD2-CZ2 4.5Å; W413-W438 AromaticContact CG-CZ2 3.98Å; W413-W438 HydrophobicContact CG-CZ2 3.98Å; W413-W438 AromaticContact NE1-CD2 3.9Å; W413-W438 AromaticContact NE1-CE2 3.23Å; W413-W438 AromaticContact NE1-CH2 3.68Å; W413-W438 AromaticContact NE1-CZ2 3.11Å; W413-W438 AromaticContact NE1-NE1 3.66Å; W413-A442 VanDerWaalsContact CE2-CB 3.48Å; W413-A442 HydrophobicContact CH2-CB 4.18Å; W413-A442 HydrophobicContact CZ2-CB 3.23Å
414	R	57	Low	52.6	Low	77 Å²	77	36.8 Å²	36.8	29%	0.291	18%	0.176	S	C	.	.	H	α-helix	trans	-52.3	-42.2	178.2	176.8	-169.3	171.8	179.1	8.4	112.3	Y410 Y411 A412 V417 T418 H461	Y410-R414 VanDerWaalsContact O-CB 3.24Å; Y410-R414 WeakPolarHBondContact O-CB 3.43Å; Y410-R414 PolarHBondContact O-N 3.22Å; Y411-R414 PolarHBondContact O-N 2.95Å; A412-R414 PolarHBondContact O-N 3.42Å; R414-V417 PolarHBondContact O-N 3.32Å; R414-T418 VanDerWaalsContact O-CB 3.23Å; R414-T418 WeakPolarHBondContact O-CB 3.3Å; R414-T418 PolarHBondContact O-N 3.26Å; R414-T418 PolarHBondContact O-OG1 3.12Å; R414-H461 PolarHBondContact NE-CE1 2.83Å; R414-H461 PolarHBondContact NE-NE2 3.48Å; R414-H461 PolarHBondContact NH2-CE1 3.25Å; R414-H461 VanDerWaalsContact NH2-CE1 3.28Å; R414-H461 PolarHBondContact NH2-NE2 3.24Å
415	S	53	Low	53.3	Low	38 Å²	38	38.3 Å²	38.3	27%	0.266	18%	0.184	S	C	.	.	H	α-helix	trans	-66.7	-43.3	-179.5	-56.9	0	0	0	0	111	Y411 A412 W413 T418 S419	Y411-S415 PolarHBondContact O-N 2.87Å; Y411-S415 PolarHBondContact O-OG 3.25Å; A412-S415 PolarHBondContact O-N 3.26Å; W413-S415 PolarHBondContact O-N 3.19Å; S415-T418 PolarHBondContact O-N 3.15Å; S415-S419 WeakPolarHBondContact O-CB 3.32Å; S415-S419 PolarHBondContact O-N 2.73Å; S415-S419 PolarHBondContact O-OG 3.18Å
416	V	52.9	Low	54.1	Low	23 Å²	23	42.4 Å²	42.4	14%	0.139	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-47.5	173.9	176	0	0	0	0	110.7	L380 A412 W413 T418 S419 L420 W438	L380-V416 HydrophobicContact CD1-CG1 4.47Å; A412-V416 WeakPolarHBondContact O-CG2 3.41Å; A412-V416 PolarHBondContact O-N 3.21Å; A412-V416 VanDerWaalsContact O-N 3.13Å; W413-V416 CarbonylContact O-C 3.58Å; W413-V416 WeakPolarHBondContact O-CA 3.41Å; W413-V416 WeakPolarHBondContact O-CB 3.11Å; W413-V416 PolarHBondContact O-N 2.95Å; V416-T418 VanDerWaalsContact C-N 3.33Å; V416-T418 PolarHBondContact O-N 2.66Å; V416-S419 PolarHBondContact O-N 3.33Å; V416-L420 HydrophobicContact CG1-CD1 3.62Å; V416-L420 HydrophobicContact CG1-CG 4.28Å; V416-L420 WeakPolarHBondContact O-CB 3.36Å; V416-L420 WeakPolarHBondContact O-CG 3.45Å; V416-L420 PolarHBondContact O-N 2.87Å; V416-W438 HydrophobicContact CB-CH2 4.27Å; V416-W438 HydrophobicContact CB-CZ2 4.4Å; V416-W438 HydrophobicContact CG1-CH2 3.95Å; V416-W438 HydrophobicContact CG1-CZ2 4.07Å
417	V	57.5	Low	54.5	Low	6 Å²	6	42.2 Å²	42.2	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-50.6	179.9	-178.4	0	0	0	0	109	W413 R414 S419 L420 L421 W438 L439 L465	W413-V417 HydrophobicContact CD2-CG2 3.54Å; W413-V417 HydrophobicContact CE3-CG2 3.81Å; W413-V417 HydrophobicContact CG-CG2 4.22Å; W413-V417 HydrophobicContact CH2-CG2 3.61Å; W413-V417 HydrophobicContact CZ2-CG2 3.31Å; W413-V417 HydrophobicContact CZ3-CG2 3.84Å; W413-V417 VanDerWaalsContact O-CG2 3.31Å; W413-V417 WeakPolarHBondContact O-CG2 3.26Å; W413-V417 PolarHBondContact O-N 2.84Å; R414-V417 PolarHBondContact O-N 3.32Å; V417-S419 VanDerWaalsContact C-N 3.34Å; V417-S419 PolarHBondContact O-N 2.76Å; V417-L420 PolarHBondContact O-N 3.25Å; V417-L421 HydrophobicContact CG1-CD1 3.58Å; V417-L421 HydrophobicContact CG1-CG 4.09Å; V417-L421 WeakPolarHBondContact O-CB 3.47Å; V417-L421 VanDerWaalsContact O-CG 3.26Å; V417-L421 WeakPolarHBondContact O-CG 3.43Å; V417-L421 PolarHBondContact O-N 3.2Å; V417-W438 VanDerWaalsContact CA-CH2 3.47Å; V417-W438 HydrophobicContact CB-CH2 3.66Å; V417-W438 HydrophobicContact CB-CZ3 3.73Å; V417-W438 HydrophobicContact CG1-CH2 4.44Å; V417-W438 HydrophobicContact CG1-CZ3 4.02Å; V417-W438 HydrophobicContact CG2-CE3 4.33Å; V417-W438 HydrophobicContact CG2-CH2 2.99Å; V417-W438 HydrophobicContact CG2-CZ2 3.91Å; V417-W438 HydrophobicContact CG2-CZ3 3.23Å; V417-L439 HydrophobicContact CG1-CD2 4.14Å; V417-L465 HydrophobicContact CG1-CD1 4.32Å
418	T	53.2	Low	54.9	Low	29 Å²	29	45.4 Å²	45.4	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-44.8	-175.5	-57.7	0	0	0	0	110.3	R414 S415 V416 H422 L464	R414-T418 VanDerWaalsContact O-CB 3.23Å; R414-T418 WeakPolarHBondContact O-CB 3.3Å; R414-T418 PolarHBondContact O-N 3.26Å; R414-T418 PolarHBondContact O-OG1 3.12Å; S415-T418 PolarHBondContact O-N 3.15Å; V416-T418 VanDerWaalsContact C-N 3.33Å; V416-T418 PolarHBondContact O-N 2.66Å; T418-H422 WeakPolarHBondContact O-CB 3.47Å; T418-H422 PolarHBondContact O-N 3.34Å; T418-H422 PolarHBondContact O-ND1 3.46Å; T418-L464 HydrophobicContact CG2-CD2 4.23Å
419	S	54.2	Low	55.3	Low	7 Å²	7	54.4 Å²	54.4	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-65.9	-41.3	178	-74.1	0	0	0	0	112.2	N370 L373 S415 V416 V417 H422 N423	N370-S419 PolarHBondContact OD1-OG 2.9Å; N370-S419 VanDerWaalsContact OD1-OG 3.1Å; L373-S419 WeakPolarHBondContact CD2-O 3.5Å; S415-S419 WeakPolarHBondContact O-CB 3.32Å; S415-S419 PolarHBondContact O-N 2.73Å; S415-S419 PolarHBondContact O-OG 3.18Å; V416-S419 PolarHBondContact O-N 3.33Å; V417-S419 VanDerWaalsContact C-N 3.34Å; V417-S419 PolarHBondContact O-N 2.76Å; S419-H422 PolarHBondContact O-N 3.48Å; S419-N423 PolarHBondContact O-N 2.75Å; S419-N423 PolarHBondContact O-ND2 2.8Å
420	L	55.1	Low	55.5	Low	6 Å²	6	59 Å²	59	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-46.3	176.3	-70.8	171.3	0	0	0	111.7	L373 V377 L380 V416 V417 N423 W424 L435 W438	L373-L420 HydrophobicContact CD1-CD2 4.03Å; L373-L420 HydrophobicContact CD1-CG 4.37Å; V377-L420 HydrophobicContact CG2-CD2 3.27Å; L380-L420 HydrophobicContact CD1-CD1 3.87Å; L380-L420 HydrophobicContact CD1-CD2 4.44Å; V416-L420 HydrophobicContact CG1-CD1 3.62Å; V416-L420 HydrophobicContact CG1-CG 4.28Å; V416-L420 WeakPolarHBondContact O-CB 3.36Å; V416-L420 WeakPolarHBondContact O-CG 3.45Å; V416-L420 PolarHBondContact O-N 2.87Å; V417-L420 PolarHBondContact O-N 3.25Å; L420-N423 CarbonylContact O-C 3.34Å; L420-N423 PolarHBondContact O-N 3.01Å; L420-W424 PolarHBondContact O-N 3.42Å; L420-W424 VanDerWaalsContact O-N 3.08Å; L420-L435 HydrophobicContact CB-CD1 4.1Å; L420-L435 HydrophobicContact CB-CD2 4.14Å; L420-L435 HydrophobicContact CD1-CD1 3.64Å; L420-L435 HydrophobicContact CG-CD1 4.44Å; L420-W438 HydrophobicContact CD1-CH2 4.38Å; L420-W438 HydrophobicContact CD1-CZ3 4.31Å
421	L	56.4	Low	55.5	Low	6 Å²	6	59.1 Å²	59.1	3%	0.031	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-42.7	176.4	-68.5	171.7	0	0	0	112.1	V417 N423 W424 L465 V468	V417-L421 HydrophobicContact CG1-CD1 3.58Å; V417-L421 HydrophobicContact CG1-CG 4.09Å; V417-L421 WeakPolarHBondContact O-CB 3.47Å; V417-L421 VanDerWaalsContact O-CG 3.26Å; V417-L421 WeakPolarHBondContact O-CG 3.43Å; V417-L421 PolarHBondContact O-N 3.2Å; L421-N423 PolarHBondContact O-N 3.03Å; L421-N423 VanDerWaalsContact O-N 3.15Å; L421-W424 HydrophobicContact CD2-CE3 4.11Å; L421-W424 HydrophobicContact CD2-CZ3 4.37Å; L421-W424 VanDerWaalsContact O-CB 3.3Å; L421-W424 WeakPolarHBondContact O-CB 3.34Å; L421-W424 PolarHBondContact O-N 3.01Å; L421-W424 VanDerWaalsContact O-N 3.12Å; L421-L465 HydrophobicContact CD1-CD1 3.89Å; L421-L465 HydrophobicContact CD1-CG 3.66Å; L421-L465 HydrophobicContact CD2-CD2 4.5Å; L421-L465 HydrophobicContact CD2-CG 4.33Å; L421-V468 HydrophobicContact CB-CG1 4.46Å; L421-V468 VanDerWaalsContact O-CG1 3.27Å; L421-V468 WeakPolarHBondContact O-CG1 3.32Å
422	H	56.9	Low	55.6	Low	115 Å²	115	57.5 Å²	57.5	53%	0.532	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-19.1	177.5	-82.5	72.1	0	0	0	113.4	T418 S419	T418-H422 WeakPolarHBondContact O-CB 3.47Å; T418-H422 PolarHBondContact O-N 3.34Å; T418-H422 PolarHBondContact O-ND1 3.46Å; S419-H422 PolarHBondContact O-N 3.48Å
423	N	56.7	Low	55.8	Low	30 Å²	30	60.5 Å²	60.5	16%	0.16	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	23.9	178	-66	-92.9	0	0	0	111.4	L373 S419 L420 L421 D425 K426 V427	L373-N423 HydrophobicContact CD2-CB 3.46Å; L373-N423 VanDerWaalsContact CD2-CB 3.46Å; L373-N423 WeakPolarHBondContact CD2-ND2 3.48Å; S419-N423 PolarHBondContact O-N 2.75Å; S419-N423 PolarHBondContact O-ND2 2.8Å; L420-N423 CarbonylContact O-C 3.34Å; L420-N423 PolarHBondContact O-N 3.01Å; L421-N423 PolarHBondContact O-N 3.03Å; L421-N423 VanDerWaalsContact O-N 3.15Å; N423-D425 PolarHBondContact O-N 2.78Å; N423-D425 VanDerWaalsContact O-N 3.1Å; N423-K426 HydrophobicContact CB-CD 4.35Å; N423-K426 WeakPolarHBondContact O-CA 3.46Å; N423-K426 WeakPolarHBondContact O-CB 3.18Å; N423-K426 PolarHBondContact O-N 2.91Å; N423-K426 PolarHBondContact OD1-NZ 3.31Å; N423-V427 WeakPolarHBondContact O-CG2 3.08Å; N423-V427 PolarHBondContact O-N 3.49Å
424	W	60	Low	55.7	Low	40 Å²	40	60.6 Å²	60.6	15%	0.152	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-50.5	-39.4	-177.9	-175.4	-85.7	0	0	0	112.5	L420 L421 K426 V427 A432 L435 P470	L420-W424 PolarHBondContact O-N 3.42Å; L420-W424 VanDerWaalsContact O-N 3.08Å; L421-W424 HydrophobicContact CD2-CE3 4.11Å; L421-W424 HydrophobicContact CD2-CZ3 4.37Å; L421-W424 VanDerWaalsContact O-CB 3.3Å; L421-W424 WeakPolarHBondContact O-CB 3.34Å; L421-W424 PolarHBondContact O-N 3.01Å; L421-W424 VanDerWaalsContact O-N 3.12Å; W424-K426 PolarHBondContact O-N 3.09Å; W424-K426 VanDerWaalsContact O-N 3.16Å; W424-V427 WeakPolarHBondContact O-CB 3.27Å; W424-V427 PolarHBondContact O-N 2.85Å; W424-A432 HydrophobicContact CH2-CB 3.98Å; W424-A432 HydrophobicContact CZ2-CB 3.84Å; W424-L435 HydrophobicContact CE3-CD2 3.63Å; W424-L435 HydrophobicContact CH2-CD2 4.3Å; W424-L435 HydrophobicContact CZ3-CD2 3.28Å; W424-L435 HydrophobicContact CZ3-CG 4.11Å; W424-P470 HydrophobicContact CZ2-CG 3.92Å
425	D	58.8	Low	55.7	Low	164 Å²	164	57.4 Å²	57.4	88%	0.877	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-63.4	-20.6	178	-62.9	-26.6	0	0	0	114.3	N423	N423-D425 PolarHBondContact O-N 2.78Å; N423-D425 VanDerWaalsContact O-N 3.1Å
426	K	58.6	Low	55.9	Low	135 Å²	135	58.3 Å²	58.3	59%	0.587	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-96.6	-12.2	176.6	-58.9	-180	-176.8	167.5	0	112.9	N423 W424 E428	N423-K426 HydrophobicContact CB-CD 4.35Å; N423-K426 WeakPolarHBondContact O-CA 3.46Å; N423-K426 WeakPolarHBondContact O-CB 3.18Å; N423-K426 PolarHBondContact O-N 2.91Å; N423-K426 PolarHBondContact OD1-NZ 3.31Å; W424-K426 PolarHBondContact O-N 3.09Å; W424-K426 VanDerWaalsContact O-N 3.16Å; K426-E428 PolarHBondContact O-N 3.16Å
427	V	55.8	Low	56.2	Low	14 Å²	14	59.9 Å²	59.9	9%	0.085	30%	0.298	C	S	.	.	S	Bend	trans	-84.8	103	-178.4	172.7	0	0	0	0	106.3	V377 N423 W424 A431 L435	V377-V427 HydrophobicContact CG2-CG2 4.31Å; N423-V427 WeakPolarHBondContact O-CG2 3.08Å; N423-V427 PolarHBondContact O-N 3.49Å; W424-V427 WeakPolarHBondContact O-CB 3.27Å; W424-V427 PolarHBondContact O-N 2.85Å; V427-A431 HydrophobicContact CB-CB 4.33Å; V427-A431 HydrophobicContact CG1-CB 3.3Å; V427-L435 HydrophobicContact CG1-CD2 4.47Å
428	E	57.5	Low	56.3	Low	147 Å²	147	60.5 Å²	60.5	69%	0.687	30%	0.3	S	S	*	.			trans	-54.4	159.4	-178.8	-65.1	-178.1	172.4	0	0	111.9	K426 D430 A431 A432	K426-E428 PolarHBondContact O-N 3.16Å; E428-D430 PolarHBondContact O-N 2.87Å; E428-D430 VanDerWaalsContact O-N 3.09Å; E428-A431 WeakPolarHBondContact O-CA 3.31Å; E428-A431 WeakPolarHBondContact O-CB 3.47Å; E428-A431 PolarHBondContact O-N 3.32Å; E428-A432 PolarHBondContact O-N 2.84Å
429	K	54.8	Low	56.6	Low	192 Å²	192	59.3 Å²	59.3	84%	0.835	29%	0.293	S	S	*	.	H	α-helix	trans	-52.5	-37.3	-174.7	-84.7	-175.6	175.3	-179.5	0	114.5	A431 A432 S433	K429-A431 VanDerWaalsContact C-N 3.29Å; K429-A432 WeakPolarHBondContact O-CB 3.21Å; K429-A432 PolarHBondContact O-N 3.5Å; K429-S433 PolarHBondContact O-N 3.3Å
430	D	52.3	Low	56.6	Low	112 Å²	112	60.3 Å²	60.3	60%	0.599	30%	0.299	S	S	*	.	H	α-helix	trans	-70.7	-27.5	176.7	-75.7	-9.6	0	0	0	112.5	E428 S433 K434	E428-D430 PolarHBondContact O-N 2.87Å; E428-D430 VanDerWaalsContact O-N 3.09Å; D430-S433 PolarHBondContact O-OG 3.1Å; D430-K434 VanDerWaalsContact O-CG 3.31Å; D430-K434 WeakPolarHBondContact O-CG 3.46Å; D430-K434 PolarHBondContact O-N 3.2Å
431	A	53.4	Low	56.6	Low	7 Å²	7	62.9 Å²	62.9	6%	0.058	31%	0.309	C	S	.	.	H	α-helix	trans	-73.8	-34.1	173.3	0	0	0	0	0	111.2	V377 V381 V427 E428 K429 K434 L435	V377-A431 HydrophobicContact CG1-CB 4.4Å; V381-A431 HydrophobicContact CG2-CB 3.21Å; V427-A431 HydrophobicContact CB-CB 4.33Å; V427-A431 HydrophobicContact CG1-CB 3.3Å; E428-A431 WeakPolarHBondContact O-CA 3.31Å; E428-A431 WeakPolarHBondContact O-CB 3.47Å; E428-A431 PolarHBondContact O-N 3.32Å; K429-A431 VanDerWaalsContact C-N 3.29Å; A431-K434 PolarHBondContact O-N 3.49Å; A431-L435 WeakPolarHBondContact O-CB 3.25Å; A431-L435 PolarHBondContact O-N 3Å
432	A	54.7	Low	56.4	Low	21 Å²	21	63 Å²	63	17%	0.174	31%	0.311	C	S	.	.	H	α-helix	trans	-66.4	-38.4	176.2	0	0	0	0	0	112.8	W424 E428 K429 W436	W424-A432 HydrophobicContact CH2-CB 3.98Å; W424-A432 HydrophobicContact CZ2-CB 3.84Å; E428-A432 PolarHBondContact O-N 2.84Å; K429-A432 WeakPolarHBondContact O-CB 3.21Å; K429-A432 PolarHBondContact O-N 3.5Å; A432-W436 VanDerWaalsContact O-CB 3.25Å; A432-W436 WeakPolarHBondContact O-CB 3.36Å; A432-W436 PolarHBondContact O-N 3.5Å
433	S	55.7	Low	56.3	Low	68 Å²	68	57.9 Å²	57.9	48%	0.476	29%	0.287	S	S	.	.	H	α-helix	trans	-70.5	-34.1	176.3	62.2	0	0	0	0	112.7	K429 D430 W436 L437	K429-S433 PolarHBondContact O-N 3.3Å; D430-S433 PolarHBondContact O-OG 3.1Å; S433-W436 WeakPolarHBondContact O-CB 3.5Å; S433-W436 PolarHBondContact O-N 2.81Å; S433-L437 PolarHBondContact O-N 2.79Å
434	K	55.2	Low	56.2	Low	36 Å²	36	64.5 Å²	64.5	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-72.8	-41.3	174	-66.5	174.9	-166.4	-130.8	0	112	V381 D384 D430 A431 W436 L437 W438	V381-K434 VanDerWaalsContact O-CE 3.31Å; V381-K434 WeakPolarHBondContact O-CE 3.41Å; V381-K434 PolarHBondContact O-NZ 3.39Å; D384-K434 WeakPolarHBondContact OD1-CE 3.33Å; D384-K434 IonicContact OD1-NZ 2.83Å; D384-K434 PolarHBondContact OD1-NZ 3.43Å; D430-K434 VanDerWaalsContact O-CG 3.31Å; D430-K434 WeakPolarHBondContact O-CG 3.46Å; D430-K434 PolarHBondContact O-N 3.2Å; A431-K434 PolarHBondContact O-N 3.49Å; K434-W436 PolarHBondContact O-N 3.13Å; K434-L437 PolarHBondContact O-N 3.15Å; K434-W438 WeakPolarHBondContact O-CB 3.35Å; K434-W438 PolarHBondContact O-N 3.11Å
435	L	56.3	Low	55.9	Low	10 Å²	10	63 Å²	63	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-35.7	170.5	-177.6	59	0	0	0	111.4	L420 W424 V427 A431 W438 L439	L420-L435 HydrophobicContact CB-CD1 4.1Å; L420-L435 HydrophobicContact CB-CD2 4.14Å; L420-L435 HydrophobicContact CD1-CD1 3.64Å; L420-L435 HydrophobicContact CG-CD1 4.44Å; W424-L435 HydrophobicContact CE3-CD2 3.63Å; W424-L435 HydrophobicContact CH2-CD2 4.3Å; W424-L435 HydrophobicContact CZ3-CD2 3.28Å; W424-L435 HydrophobicContact CZ3-CG 4.11Å; V427-L435 HydrophobicContact CG1-CD2 4.47Å; A431-L435 WeakPolarHBondContact O-CB 3.25Å; A431-L435 PolarHBondContact O-N 3Å; L435-W438 HydrophobicContact CD1-CE3 3.52Å; L435-W438 HydrophobicContact CD1-CZ3 3.64Å; L435-W438 WeakPolarHBondContact O-CB 3.22Å; L435-W438 PolarHBondContact O-N 3.04Å; L435-L439 HydrophobicContact CG-CD1 4.45Å; L435-L439 WeakPolarHBondContact O-CB 3.47Å; L435-L439 WeakPolarHBondContact O-CG 3.44Å; L435-L439 PolarHBondContact O-N 2.85Å
436	W	58.4	Low	55.6	Low	56 Å²	56	56.1 Å²	56.1	21%	0.212	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-49.3	174.8	-177.8	-100.6	0	0	0	112.5	A432 S433 K434 W438 L439 S440 M476 L477	A432-W436 VanDerWaalsContact O-CB 3.25Å; A432-W436 WeakPolarHBondContact O-CB 3.36Å; A432-W436 PolarHBondContact O-N 3.5Å; S433-W436 WeakPolarHBondContact O-CB 3.5Å; S433-W436 PolarHBondContact O-N 2.81Å; K434-W436 PolarHBondContact O-N 3.13Å; W436-W438 PolarHBondContact O-N 3.32Å; W436-L439 PolarHBondContact O-N 3.38Å; W436-S440 PolarHBondContact O-N 3.48Å; W436-M476 VanDerWaalsContact CE2-SD 3.59Å; W436-M476 HydrophobicContact CH2-CB 3.94Å; W436-M476 HydrophobicContact CH2-CG 3.86Å; W436-M476 HydrophobicContact CH2-SD 3.94Å; W436-M476 HydrophobicContact CZ2-CB 4.11Å; W436-M476 HydrophobicContact CZ2-CG 3.5Å; W436-M476 HydrophobicContact CZ2-SD 3.22Å; W436-M476 WeakPolarHBondContact CZ2-SD 3.39Å; W436-L477 HydrophobicContact CH2-CB 4.4Å; W436-L477 HydrophobicContact CH2-CD1 4.26Å; W436-L477 HydrophobicContact CZ3-CD1 3.85Å
437	L	57.9	Low	55.2	Low	57 Å²	57	52 Å²	52	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-53.7	-45.8	173.5	-171.4	70.2	0	0	0	110	Q388 S433 K434 S440 Y441	Q388-L437 HydrophobicContact CG-CD2 4.11Å; S433-L437 PolarHBondContact O-N 2.79Å; K434-L437 PolarHBondContact O-N 3.15Å; L437-S440 PolarHBondContact O-N 3.43Å; L437-S440 PolarHBondContact O-OG 2.81Å; L437-Y441 HydrophobicContact CD1-CD2 4.31Å; L437-Y441 HydrophobicContact CD1-CE2 3.85Å; L437-Y441 HydrophobicContact CD2-CE2 4.36Å; L437-Y441 HydrophobicContact CG-CD2 4.02Å; L437-Y441 HydrophobicContact CG-CE2 3.84Å; L437-Y441 VanDerWaalsContact O-CD2 3.28Å; L437-Y441 WeakPolarHBondContact O-CD2 3.22Å; L437-Y441 PolarHBondContact O-N 2.9Å
438	W	61	Low	55	Low	18 Å²	18	58.6 Å²	58.6	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-45.9	179.6	-179.9	74.2	0	0	0	114.1	W413 V416 V417 L420 K434 L435 W436 S440 Y441 A442	W413-W438 AromaticContact CD1-CE2 3.49Å; W413-W438 VanDerWaalsContact CD1-CE2 3.49Å; W413-W438 AromaticContact CD1-CH2 3.96Å; W413-W438 AromaticContact CD1-CZ2 3.12Å; W413-W438 AromaticContact CD1-NE1 3.72Å; W413-W438 HydrophobicContact CD2-CZ2 4.5Å; W413-W438 AromaticContact CG-CZ2 3.98Å; W413-W438 HydrophobicContact CG-CZ2 3.98Å; W413-W438 AromaticContact NE1-CD2 3.9Å; W413-W438 AromaticContact NE1-CE2 3.23Å; W413-W438 AromaticContact NE1-CH2 3.68Å; W413-W438 AromaticContact NE1-CZ2 3.11Å; W413-W438 AromaticContact NE1-NE1 3.66Å; V416-W438 HydrophobicContact CB-CH2 4.27Å; V416-W438 HydrophobicContact CB-CZ2 4.4Å; V416-W438 HydrophobicContact CG1-CH2 3.95Å; V416-W438 HydrophobicContact CG1-CZ2 4.07Å; V417-W438 VanDerWaalsContact CA-CH2 3.47Å; V417-W438 HydrophobicContact CB-CH2 3.66Å; V417-W438 HydrophobicContact CB-CZ3 3.73Å; V417-W438 HydrophobicContact CG1-CH2 4.44Å; V417-W438 HydrophobicContact CG1-CZ3 4.02Å; V417-W438 HydrophobicContact CG2-CE3 4.33Å; V417-W438 HydrophobicContact CG2-CH2 2.99Å; V417-W438 HydrophobicContact CG2-CZ2 3.91Å; V417-W438 HydrophobicContact CG2-CZ3 3.23Å; L420-W438 HydrophobicContact CD1-CH2 4.38Å; L420-W438 HydrophobicContact CD1-CZ3 4.31Å; K434-W438 WeakPolarHBondContact O-CB 3.35Å; K434-W438 PolarHBondContact O-N 3.11Å; L435-W438 HydrophobicContact CD1-CE3 3.52Å; L435-W438 HydrophobicContact CD1-CZ3 3.64Å; L435-W438 WeakPolarHBondContact O-CB 3.22Å; L435-W438 PolarHBondContact O-N 3.04Å; W436-W438 PolarHBondContact O-N 3.32Å; W438-S440 VanDerWaalsContact C-N 3.31Å; W438-S440 PolarHBondContact O-N 3.2Å; W438-Y441 PolarHBondContact O-N 3.21Å; W438-A442 PolarHBondContact O-N 2.95Å
439	L	58.1	Low	54.7	Low	5 Å²	5	52.5 Å²	52.5	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-45	174	-76.7	170.7	0	0	0	110.5	V417 L435 W436 Y441 A442 F443 L465	V417-L439 HydrophobicContact CG1-CD2 4.14Å; L435-L439 HydrophobicContact CG-CD1 4.45Å; L435-L439 WeakPolarHBondContact O-CB 3.47Å; L435-L439 WeakPolarHBondContact O-CG 3.44Å; L435-L439 PolarHBondContact O-N 2.85Å; W436-L439 PolarHBondContact O-N 3.38Å; L439-Y441 VanDerWaalsContact C-N 3.33Å; L439-Y441 PolarHBondContact O-N 3.02Å; L439-A442 PolarHBondContact O-N 2.83Å; L439-F443 HydrophobicContact CB-CD2 4.27Å; L439-F443 HydrophobicContact CB-CE2 3.83Å; L439-F443 HydrophobicContact CD2-CE2 4.13Å; L439-F443 HydrophobicContact CD2-CZ 4.08Å; L439-F443 HydrophobicContact CG-CE2 4.5Å; L439-F443 WeakPolarHBondContact O-CB 3.13Å; L439-F443 WeakPolarHBondContact O-CD2 3.46Å; L439-F443 WeakPolarHBondContact O-CG 3.28Å; L439-F443 PolarHBondContact O-N 3.45Å; L439-L465 HydrophobicContact CD1-CD2 3.96Å; L439-L465 HydrophobicContact CD2-CD1 4.23Å; L439-L465 HydrophobicContact CD2-CD2 4.2Å
440	S	55.9	Low	54.6	Low	27 Å²	27	47.6 Å²	47.6	19%	0.189	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-37	179.7	75	0	0	0	0	113.5	W436 L437 W438 R444	W436-S440 PolarHBondContact O-N 3.48Å; L437-S440 PolarHBondContact O-N 3.43Å; L437-S440 PolarHBondContact O-OG 2.81Å; W438-S440 VanDerWaalsContact C-N 3.31Å; W438-S440 PolarHBondContact O-N 3.2Å; S440-R444 VanDerWaalsContact O-CB 3.31Å; S440-R444 WeakPolarHBondContact O-CB 3.42Å; S440-R444 PolarHBondContact O-N 3.47Å
441	Y	54.3	Low	54.4	Low	60 Å²	60	49.9 Å²	49.9	24%	0.235	24%	0.241	C	C	.	.	H	α-helix	trans	-70.4	-47.1	175.1	-88.3	-75.4	0	0	0	111.8	A391 L437 W438 L439 F443 R444 H445	A391-Y441 VanDerWaalsContact CB-CB 3.45Å; A391-Y441 HydrophobicContact CB-CD1 3.5Å; A391-Y441 HydrophobicContact CB-CD2 3.76Å; A391-Y441 HydrophobicContact CB-CE1 4.12Å; A391-Y441 HydrophobicContact CB-CE2 4.35Å; A391-Y441 HydrophobicContact CB-CG 3.3Å; L437-Y441 HydrophobicContact CD1-CD2 4.31Å; L437-Y441 HydrophobicContact CD1-CE2 3.85Å; L437-Y441 HydrophobicContact CD2-CE2 4.36Å; L437-Y441 HydrophobicContact CG-CD2 4.02Å; L437-Y441 HydrophobicContact CG-CE2 3.84Å; L437-Y441 VanDerWaalsContact O-CD2 3.28Å; L437-Y441 WeakPolarHBondContact O-CD2 3.22Å; L437-Y441 PolarHBondContact O-N 2.9Å; W438-Y441 PolarHBondContact O-N 3.21Å; L439-Y441 VanDerWaalsContact C-N 3.33Å; L439-Y441 PolarHBondContact O-N 3.02Å; Y441-F443 PolarHBondContact O-N 3.14Å; Y441-R444 PolarHBondContact O-N 2.71Å; Y441-R444 VanDerWaalsContact O-N 3.12Å; Y441-H445 AromaticContact CD1-NE2 3.8Å; Y441-H445 PolarHBondContact O-CD2 3.47Å; Y441-H445 PolarHBondContact O-N 3.39Å
442	A	52.9	Low	54.1	Low	8 Å²	8	57.2 Å²	57.2	7%	0.066	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-39.7	177.7	0	0	0	0	0	111.3	W413 W438 L439 A446	W413-A442 VanDerWaalsContact CE2-CB 3.48Å; W413-A442 HydrophobicContact CH2-CB 4.18Å; W413-A442 HydrophobicContact CZ2-CB 3.23Å; W438-A442 PolarHBondContact O-N 2.95Å; L439-A442 PolarHBondContact O-N 2.83Å; A442-A446 VanDerWaalsContact O-CB 3.27Å; A442-A446 WeakPolarHBondContact O-CB 3.41Å; A442-A446 PolarHBondContact O-N 2.84Å
443	F	54.2	Low	54	Low	9 Å²	9	57.3 Å²	57.3	4%	0.039	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-55.1	172.2	-66.5	-35.4	0	0	0	111.2	L439 Y441 H445 A446 P447 W462 L465 M484	L439-F443 HydrophobicContact CB-CD2 4.27Å; L439-F443 HydrophobicContact CB-CE2 3.83Å; L439-F443 HydrophobicContact CD2-CE2 4.13Å; L439-F443 HydrophobicContact CD2-CZ 4.08Å; L439-F443 HydrophobicContact CG-CE2 4.5Å; L439-F443 WeakPolarHBondContact O-CB 3.13Å; L439-F443 WeakPolarHBondContact O-CD2 3.46Å; L439-F443 WeakPolarHBondContact O-CG 3.28Å; L439-F443 PolarHBondContact O-N 3.45Å; Y441-F443 PolarHBondContact O-N 3.14Å; F443-H445 PolarHBondContact O-N 2.74Å; F443-A446 WeakPolarHBondContact O-CB 3.27Å; F443-A446 PolarHBondContact O-N 3.17Å; F443-P447 VanDerWaalsContact O-CD 3.29Å; F443-P447 WeakPolarHBondContact O-CD 3.3Å; F443-W462 AromaticContact CD1-CH2 3.01Å; F443-W462 HydrophobicContact CD1-CH2 3.01Å; F443-W462 AromaticContact CD1-CZ2 3.42Å; F443-W462 HydrophobicContact CD1-CZ2 3.42Å; F443-W462 VanDerWaalsContact CD1-CZ2 3.42Å; F443-W462 AromaticContact CD1-CZ3 3.74Å; F443-W462 HydrophobicContact CD1-CZ3 3.74Å; F443-W462 AromaticContact CD2-CH2 3.87Å; F443-W462 HydrophobicContact CD2-CH2 3.87Å; F443-W462 HydrophobicContact CD2-CZ3 4.02Å; F443-W462 HydrophobicContact CE1-CD2 4.28Å; F443-W462 AromaticContact CE1-CE2 3.96Å; F443-W462 AromaticContact CE1-CE3 3.86Å; F443-W462 HydrophobicContact CE1-CE3 3.86Å; F443-W462 AromaticContact CE1-CH2 2.87Å; F443-W462 HydrophobicContact CE1-CH2 2.87Å; F443-W462 AromaticContact CE1-CZ2 3.28Å; F443-W462 HydrophobicContact CE1-CZ2 3.28Å; F443-W462 AromaticContact CE1-CZ3 3.14Å; F443-W462 HydrophobicContact CE1-CZ3 3.14Å; F443-W462 HydrophobicContact CE2-CE3 4.46Å; F443-W462 AromaticContact CE2-CH2 3.75Å; F443-W462 HydrophobicContact CE2-CH2 3.75Å; F443-W462 AromaticContact CE2-CZ3 3.46Å; F443-W462 HydrophobicContact CE2-CZ3 3.46Å; F443-W462 VanDerWaalsContact CE2-CZ3 3.46Å; F443-W462 AromaticContact CG-CH2 3.55Å; F443-W462 HydrophobicContact CG-CH2 3.55Å; F443-W462 HydrophobicContact CG-CZ2 4.33Å; F443-W462 HydrophobicContact CG-CZ3 4.17Å; F443-W462 AromaticContact CZ-CE3 3.7Å; F443-W462 HydrophobicContact CZ-CE3 3.7Å; F443-W462 AromaticContact CZ-CH2 3.28Å; F443-W462 HydrophobicContact CZ-CH2 3.28Å; F443-W462 HydrophobicContact CZ-CZ2 4.08Å; F443-W462 AromaticContact CZ-CZ3 2.98Å; F443-W462 HydrophobicContact CZ-CZ3 2.98Å; F443-L465 HydrophobicContact CZ-CD1 4.33Å; F443-M484 VanDerWaalsContact CA-SD 3.56Å; F443-M484 HydrophobicContact CB-CE 3.48Å; F443-M484 VanDerWaalsContact CB-CE 3.48Å; F443-M484 HydrophobicContact CB-CG 4Å; F443-M484 HydrophobicContact CB-SD 3.59Å; F443-M484 VanDerWaalsContact CB-SD 3.59Å; F443-M484 HydrophobicContact CD1-CE 3.45Å; F443-M484 VanDerWaalsContact CD1-CE 3.45Å; F443-M484 HydrophobicContact CE1-CE 4.5Å; F443-M484 HydrophobicContact CG-CE 3.73Å; F443-M484 HydrophobicContact CG-SD 4.47Å
444	R	54.7	Low	53.7	Low	168 Å²	168	58.5 Å²	58.5	63%	0.634	27%	0.271	S	S	*	.	H	α-helix	trans	-50	-36.1	178.4	-173.5	178.1	-176.8	179.2	-2	113.9	S440 Y441	S440-R444 VanDerWaalsContact O-CB 3.31Å; S440-R444 WeakPolarHBondContact O-CB 3.42Å; S440-R444 PolarHBondContact O-N 3.47Å; Y441-R444 PolarHBondContact O-N 2.71Å; Y441-R444 VanDerWaalsContact O-N 3.12Å
445	H	53.8	Low	53.4	Low	9 Å²	9	60.9 Å²	60.9	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-98.9	-10	-177.7	-62.4	-78.3	0	0	0	114.9	Y394 E395 Y441 F443 P447 Y448	Y394-H445 HydrophobicContact CD1-CB 3.76Å; Y394-H445 HydrophobicContact CE1-CB 4.08Å; E395-H445 VanDerWaalsContact CD-CE1 3.44Å; E395-H445 IonicContact OE1-CE1 3.12Å; E395-H445 IonicContact OE2-CE1 3.22Å; Y441-H445 AromaticContact CD1-NE2 3.8Å; Y441-H445 PolarHBondContact O-CD2 3.47Å; Y441-H445 PolarHBondContact O-N 3.39Å; F443-H445 PolarHBondContact O-N 2.74Å; H445-P447 VanDerWaalsContact C-N 3.33Å; H445-Y448 HydrophobicContact CB-CD2 4.36Å; H445-Y448 PolarHBondContact O-N 3.04Å; H445-Y448 VanDerWaalsContact O-N 3.1Å
446	A	51.7	Low	52.9	Low	19 Å²	19	66.6 Å²	66.6	16%	0.157	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-55	-37.1	177.2	0	0	0	0	0	114.5	A442 F443 Y448 L449 M484	A442-A446 VanDerWaalsContact O-CB 3.27Å; A442-A446 WeakPolarHBondContact O-CB 3.41Å; A442-A446 PolarHBondContact O-N 2.84Å; F443-A446 WeakPolarHBondContact O-CB 3.27Å; F443-A446 PolarHBondContact O-N 3.17Å; A446-Y448 PolarHBondContact O-N 3.24Å; A446-L449 HydrophobicContact CB-CD1 4.42Å; A446-L449 VanDerWaalsContact O-CB 3.32Å; A446-L449 WeakPolarHBondContact O-CB 3.44Å; A446-L449 WeakPolarHBondContact O-CG 3.4Å; A446-L449 PolarHBondContact O-N 2.93Å; A446-L449 VanDerWaalsContact O-N 3.1Å; A446-M484 HydrophobicContact CB-CE 4.45Å
447	P	50.6	Low	52.6	Low	49 Å²	49	68.6 Å²	68.6	32%	0.318	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-62.9	-20.3	177.5	-24.6	34.7	0	0	0	114.9	F443 H445 L449	F443-P447 VanDerWaalsContact O-CD 3.29Å; F443-P447 WeakPolarHBondContact O-CD 3.3Å; H445-P447 VanDerWaalsContact C-N 3.33Å; P447-L449 VanDerWaalsContact C-N 3.32Å
448	Y	52.2	Low	52.2	Low	152 Å²	152	66.7 Å²	66.7	60%	0.596	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-84.1	-9	177.7	-58.5	-77.5	0	0	0	112.8	V398 H445 A446 N450	V398-Y448 VanDerWaalsContact CG1-CB 3.42Å; V398-Y448 VanDerWaalsContact CG1-O 3.3Å; V398-Y448 WeakPolarHBondContact CG1-O 3.44Å; H445-Y448 HydrophobicContact CB-CD2 4.36Å; H445-Y448 PolarHBondContact O-N 3.04Å; H445-Y448 VanDerWaalsContact O-N 3.1Å; A446-Y448 PolarHBondContact O-N 3.24Å; Y448-N450 PolarHBondContact O-N 3.46Å
449	L	51.5	Low	51.7	Low	20 Å²	20	67.4 Å²	67.4	11%	0.105	31%	0.312	C	S	.	.	S	Bend	trans	-66.4	120.9	170.7	-62	166.9	0	0	0	108.7	Y394 V398 Y410 A446 P447 V453	Y394-L449 HydrophobicContact CE1-CD2 4.2Å; Y394-L449 HydrophobicContact CE1-CG 4.45Å; Y394-L449 WeakPolarHBondContact OH-CD1 3.38Å; Y394-L449 WeakPolarHBondContact OH-CD2 3.07Å; V398-L449 HydrophobicContact CG2-CD2 3.8Å; Y410-L449 HydrophobicContact CD2-CD1 4.2Å; A446-L449 HydrophobicContact CB-CD1 4.42Å; A446-L449 VanDerWaalsContact O-CB 3.32Å; A446-L449 WeakPolarHBondContact O-CB 3.44Å; A446-L449 WeakPolarHBondContact O-CG 3.4Å; A446-L449 PolarHBondContact O-N 2.93Å; A446-L449 VanDerWaalsContact O-N 3.1Å; P447-L449 VanDerWaalsContact C-N 3.32Å; L449-V453 HydrophobicContact CB-CB 4.31Å; L449-V453 HydrophobicContact CB-CG2 4.28Å; L449-V453 HydrophobicContact CD1-CG1 4.42Å
450	N	51.5	Low	51.5	Low	88 Å²	88	71.7 Å²	71.7	47%	0.471	34%	0.335	S	S	.	.			trans	-49.4	146.9	179.8	-162.7	-2.7	0	0	0	111.5	D403 Y448 Q452 V453	D403-N450 PolarHBondContact OD1-ND2 3.27Å; Y448-N450 PolarHBondContact O-N 3.46Å; N450-Q452 PolarHBondContact O-N 3.05Å; N450-V453 PolarHBondContact O-N 2.8Å
451	K	48.8	Very low	51.4	Low	160 Å²	160	71.8 Å²	71.8	70%	0.696	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-11.4	-167.3	-69.7	-177.1	177.1	-178.2	0	116
452	Q	47	Very low	51.6	Low	162 Å²	162	69.2 Å²	69.2	76%	0.757	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-21.1	177.4	-65.1	-169.2	10.3	0	0	114	N450 E454	N450-Q452 PolarHBondContact O-N 3.05Å; Q452-E454 VanDerWaalsContact C-N 3.27Å; Q452-E454 PolarHBondContact O-N 3.36Å
453	V	51.7	Low	51.7	Low	22 Å²	22	70.8 Å²	70.8	13%	0.133	33%	0.331	C	S	.	.	S	Bend	trans	-75	91.1	164.1	-176.5	0	0	0	0	105.9	Y407 Y410 L449 N450 L455 V458	Y407-V453 HydrophobicContact CD2-CG2 4.46Å; Y410-V453 HydrophobicContact CD1-CG1 4.49Å; Y410-V453 HydrophobicContact CE1-CG1 4.34Å; L449-V453 HydrophobicContact CB-CB 4.31Å; L449-V453 HydrophobicContact CB-CG2 4.28Å; L449-V453 HydrophobicContact CD1-CG1 4.42Å; N450-V453 PolarHBondContact O-N 2.8Å; V453-L455 PolarHBondContact O-N 2.8Å; V453-V458 HydrophobicContact CG1-CG2 4.47Å
454	E	50.2	Low	51.8	Low	94 Å²	94	73 Å²	73	44%	0.439	34%	0.343	S	S	.	.			trans	-51.4	119.1	179.6	-63.8	-174.8	157.9	0	0	107.4	Q452 K456 Y457	Q452-E454 VanDerWaalsContact C-N 3.27Å; Q452-E454 PolarHBondContact O-N 3.36Å; E454-K456 HydrophobicContact CB-CB 3.83Å; E454-K456 CarbonylContact O-C 3.59Å; E454-K456 PolarHBondContact O-N 2.88Å; E454-Y457 HydrophobicContact CB-CD2 3.85Å; E454-Y457 HydrophobicContact CB-CE2 4.26Å; E454-Y457 HydrophobicContact CG-CD2 4.43Å; E454-Y457 HydrophobicContact CG-CE2 4.36Å; E454-Y457 PolarHBondContact O-N 3.39Å
455	L	48.4	Very low	51.8	Low	85 Å²	85	65.3 Å²	65.3	45%	0.445	31%	0.314	S	S	.	.	H	α-helix	trans	-43.9	-29.1	168.5	-100.8	138.5	0	0	0	110.8	V453 Y457 V458 F459	V453-L455 PolarHBondContact O-N 2.8Å; L455-Y457 PolarHBondContact O-N 3.49Å; L455-V458 CarbonylContact O-C 3.42Å; L455-V458 WeakPolarHBondContact O-CA 3.19Å; L455-V458 WeakPolarHBondContact O-CB 3.28Å; L455-V458 PolarHBondContact O-N 3.48Å; L455-V458 VanDerWaalsContact O-N 3.1Å; L455-F459 VanDerWaalsContact C-CD2 3.43Å; L455-F459 HydrophobicContact CB-CD2 4.02Å; L455-F459 HydrophobicContact CB-CE2 3.83Å; L455-F459 HydrophobicContact CD2-CD2 4.37Å; L455-F459 HydrophobicContact CD2-CE2 3.57Å; L455-F459 HydrophobicContact CD2-CZ 4Å; L455-F459 HydrophobicContact CG-CE2 4.33Å; L455-F459 WeakPolarHBondContact O-CB 3.05Å; L455-F459 WeakPolarHBondContact O-CD2 3.42Å; L455-F459 WeakPolarHBondContact O-CG 3.26Å; L455-F459 PolarHBondContact O-N 3.11Å
456	K	47.3	Very low	52	Low	131 Å²	131	65.2 Å²	65.2	57%	0.57	31%	0.314	S	S	*	.	H	α-helix	trans	-51.2	-43.1	169.2	-168.4	-178.9	178.8	-175.9	0	115	E454 F459 N460	E454-K456 HydrophobicContact CB-CB 3.83Å; E454-K456 CarbonylContact O-C 3.59Å; E454-K456 PolarHBondContact O-N 2.88Å; K456-F459 PolarHBondContact O-N 2.89Å; K456-N460 PolarHBondContact O-N 3.13Å
457	Y	50	Low	52.2	Low	97 Å²	97	69.3 Å²	69.3	38%	0.38	33%	0.333	S	S	.	.	H	α-helix	trans	-66.2	-43.1	174.7	-75.9	-70.7	0	0	0	110.5	E454 L455 N460 H461	E454-Y457 HydrophobicContact CB-CD2 3.85Å; E454-Y457 HydrophobicContact CB-CE2 4.26Å; E454-Y457 HydrophobicContact CG-CD2 4.43Å; E454-Y457 HydrophobicContact CG-CE2 4.36Å; E454-Y457 PolarHBondContact O-N 3.39Å; L455-Y457 PolarHBondContact O-N 3.49Å; Y457-N460 PolarHBondContact O-N 2.9Å; Y457-H461 PolarHBondContact O-N 3.41Å; Y457-H461 PolarHBondContact O-ND1 3.14Å
458	V	49.7	Very low	52.4	Low	17 Å²	17	69.6 Å²	69.6	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-56.6	-54	171.7	-168.7	0	0	0	0	108.1	Y410 V453 L455 N460 H461 W462	Y410-V458 HydrophobicContact CE2-CG2 4.34Å; V453-V458 HydrophobicContact CG1-CG2 4.47Å; L455-V458 CarbonylContact O-C 3.42Å; L455-V458 WeakPolarHBondContact O-CA 3.19Å; L455-V458 WeakPolarHBondContact O-CB 3.28Å; L455-V458 PolarHBondContact O-N 3.48Å; L455-V458 VanDerWaalsContact O-N 3.1Å; V458-N460 PolarHBondContact O-N 3.37Å; V458-H461 WeakPolarHBondContact O-CA 3.25Å; V458-H461 WeakPolarHBondContact O-CB 3.41Å; V458-H461 PolarHBondContact O-N 3.32Å; V458-W462 HydrophobicContact CG1-CZ2 4.04Å; V458-W462 PolarHBondContact O-N 3.42Å; V458-W462 PolarHBondContact O-NE1 3.42Å
459	F	50.7	Low	52.6	Low	33 Å²	33	63.5 Å²	63.5	15%	0.145	31%	0.314	C	S	.	.	H	α-helix	trans	-46.4	-49.7	176.1	-74.4	-57.6	0	0	0	114.8	L455 K456 H461 W462 A507 F511	L455-F459 VanDerWaalsContact C-CD2 3.43Å; L455-F459 HydrophobicContact CB-CD2 4.02Å; L455-F459 HydrophobicContact CB-CE2 3.83Å; L455-F459 HydrophobicContact CD2-CD2 4.37Å; L455-F459 HydrophobicContact CD2-CE2 3.57Å; L455-F459 HydrophobicContact CD2-CZ 4Å; L455-F459 HydrophobicContact CG-CE2 4.33Å; L455-F459 WeakPolarHBondContact O-CB 3.05Å; L455-F459 WeakPolarHBondContact O-CD2 3.42Å; L455-F459 WeakPolarHBondContact O-CG 3.26Å; L455-F459 PolarHBondContact O-N 3.11Å; K456-F459 PolarHBondContact O-N 2.89Å; F459-H461 PolarHBondContact O-N 2.85Å; F459-W462 AromaticContact CD1-CD1 3.94Å; F459-W462 VanDerWaalsContact N-CD1 3.34Å; F459-W462 WeakPolarHBondContact O-CB 3.39Å; F459-W462 PolarHBondContact O-N 3.44Å; F459-A507 HydrophobicContact CD2-CB 3.82Å; F459-A507 HydrophobicContact CE2-CB 3.66Å; F459-A507 HydrophobicContact CG-CB 4.44Å; F459-A507 HydrophobicContact CZ-CB 4.17Å; F459-F511 HydrophobicContact CD1-CB 4.5Å
460	N	54.6	Low	52.8	Low	96 Å²	96	64.4 Å²	64.4	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-27.7	177.2	-73.2	-21.1	0	0	0	113.6	K456 Y457 V458	K456-N460 PolarHBondContact O-N 3.13Å; Y457-N460 PolarHBondContact O-N 2.9Å; V458-N460 PolarHBondContact O-N 3.37Å
461	H	54.3	Low	52.9	Low	28 Å²	28	63.9 Å²	63.9	13%	0.13	32%	0.323	C	S	.	.	H	α-helix	trans	-82.2	-20.1	176.2	-67.2	85.3	0	0	0	112.6	R414 Y457 V458 F459 L464 L465	R414-H461 PolarHBondContact NE-CE1 2.83Å; R414-H461 PolarHBondContact NE-NE2 3.48Å; R414-H461 PolarHBondContact NH2-CE1 3.25Å; R414-H461 VanDerWaalsContact NH2-CE1 3.28Å; R414-H461 PolarHBondContact NH2-NE2 3.24Å; Y457-H461 PolarHBondContact O-N 3.41Å; Y457-H461 PolarHBondContact O-ND1 3.14Å; V458-H461 WeakPolarHBondContact O-CA 3.25Å; V458-H461 WeakPolarHBondContact O-CB 3.41Å; V458-H461 PolarHBondContact O-N 3.32Å; F459-H461 PolarHBondContact O-N 2.85Å; H461-L464 WeakPolarHBondContact O-CB 3.35Å; H461-L464 PolarHBondContact O-N 3.16Å; H461-L465 PolarHBondContact O-N 3.08Å
462	W	57.2	Low	53.1	Low	6 Å²	6	61.9 Å²	61.9	2%	0.023	33%	0.325	C	S	.	.	H	α-helix	trans	-69.2	-38.3	173.9	-62.5	90.6	0	0	0	112.3	F443 V458 F459 L464 L465 L466 L481 M484 F511	F443-W462 AromaticContact CD1-CH2 3.01Å; F443-W462 HydrophobicContact CD1-CH2 3.01Å; F443-W462 AromaticContact CD1-CZ2 3.42Å; F443-W462 HydrophobicContact CD1-CZ2 3.42Å; F443-W462 VanDerWaalsContact CD1-CZ2 3.42Å; F443-W462 AromaticContact CD1-CZ3 3.74Å; F443-W462 HydrophobicContact CD1-CZ3 3.74Å; F443-W462 AromaticContact CD2-CH2 3.87Å; F443-W462 HydrophobicContact CD2-CH2 3.87Å; F443-W462 HydrophobicContact CD2-CZ3 4.02Å; F443-W462 HydrophobicContact CE1-CD2 4.28Å; F443-W462 AromaticContact CE1-CE2 3.96Å; F443-W462 AromaticContact CE1-CE3 3.86Å; F443-W462 HydrophobicContact CE1-CE3 3.86Å; F443-W462 AromaticContact CE1-CH2 2.87Å; F443-W462 HydrophobicContact CE1-CH2 2.87Å; F443-W462 AromaticContact CE1-CZ2 3.28Å; F443-W462 HydrophobicContact CE1-CZ2 3.28Å; F443-W462 AromaticContact CE1-CZ3 3.14Å; F443-W462 HydrophobicContact CE1-CZ3 3.14Å; F443-W462 HydrophobicContact CE2-CE3 4.46Å; F443-W462 AromaticContact CE2-CH2 3.75Å; F443-W462 HydrophobicContact CE2-CH2 3.75Å; F443-W462 AromaticContact CE2-CZ3 3.46Å; F443-W462 HydrophobicContact CE2-CZ3 3.46Å; F443-W462 VanDerWaalsContact CE2-CZ3 3.46Å; F443-W462 AromaticContact CG-CH2 3.55Å; F443-W462 HydrophobicContact CG-CH2 3.55Å; F443-W462 HydrophobicContact CG-CZ2 4.33Å; F443-W462 HydrophobicContact CG-CZ3 4.17Å; F443-W462 AromaticContact CZ-CE3 3.7Å; F443-W462 HydrophobicContact CZ-CE3 3.7Å; F443-W462 AromaticContact CZ-CH2 3.28Å; F443-W462 HydrophobicContact CZ-CH2 3.28Å; F443-W462 HydrophobicContact CZ-CZ2 4.08Å; F443-W462 AromaticContact CZ-CZ3 2.98Å; F443-W462 HydrophobicContact CZ-CZ3 2.98Å; V458-W462 HydrophobicContact CG1-CZ2 4.04Å; V458-W462 PolarHBondContact O-N 3.42Å; V458-W462 PolarHBondContact O-NE1 3.42Å; F459-W462 AromaticContact CD1-CD1 3.94Å; F459-W462 VanDerWaalsContact N-CD1 3.34Å; F459-W462 WeakPolarHBondContact O-CB 3.39Å; F459-W462 PolarHBondContact O-N 3.44Å; W462-L464 PolarHBondContact O-N 3.04Å; W462-L465 WeakPolarHBondContact O-CB 3.45Å; W462-L465 PolarHBondContact O-N 2.82Å; W462-L465 VanDerWaalsContact O-N 3.11Å; W462-L466 WeakPolarHBondContact O-CB 3.34Å; W462-L466 VanDerWaalsContact O-CG 3.22Å; W462-L466 WeakPolarHBondContact O-CG 3.23Å; W462-L466 PolarHBondContact O-N 3.27Å; W462-L481 HydrophobicContact CD2-CD1 4.18Å; W462-L481 HydrophobicContact CD2-CD2 3.38Å; W462-L481 HydrophobicContact CD2-CG 4.15Å; W462-L481 HydrophobicContact CE3-CD1 3.35Å; W462-L481 HydrophobicContact CE3-CD2 3.28Å; W462-L481 HydrophobicContact CE3-CG 3.52Å; W462-L481 HydrophobicContact CG-CD2 4.1Å; W462-L481 HydrophobicContact CH2-CD1 4.31Å; W462-L481 HydrophobicContact CH2-CD2 3.21Å; W462-L481 HydrophobicContact CH2-CG 3.56Å; W462-L481 HydrophobicContact CZ2-CD2 3.48Å; W462-L481 VanDerWaalsContact CZ2-CD2 3.48Å; W462-L481 HydrophobicContact CZ2-CG 4.33Å; W462-L481 HydrophobicContact CZ3-CD1 3.42Å; W462-L481 VanDerWaalsContact CZ3-CD1 3.42Å; W462-L481 HydrophobicContact CZ3-CD2 3.18Å; W462-L481 HydrophobicContact CZ3-CG 3.16Å; W462-M484 HydrophobicContact CH2-CE 3.54Å; W462-M484 HydrophobicContact CZ2-CE 3.37Å; W462-F511 HydrophobicContact CB-CD2 4.21Å; W462-F511 HydrophobicContact CB-CE2 3.98Å; W462-F511 HydrophobicContact CG-CE2 4.45Å
463	T	55.4	Low	53.4	Low	41 Å²	41	55.8 Å²	55.8	25%	0.252	30%	0.3	S	S	.	.	H	α-helix	trans	-59.1	-43	173.8	-38.9	0	0	0	0	110.1	L465 L466 D467	T463-L465 PolarHBondContact O-N 3.1Å; T463-L466 PolarHBondContact O-N 3.35Å; T463-D467 WeakPolarHBondContact O-CB 3.25Å; T463-D467 VanDerWaalsContact O-CG 3.22Å; T463-D467 PolarHBondContact O-N 3.12Å
464	L	56.4	Low	53.6	Low	55 Å²	55	55.2 Å²	55.2	29%	0.288	30%	0.295	S	S	.	.	H	α-helix	trans	-63.3	-41	174.2	-167	81.8	0	0	0	112	T418 H461 W462 V468	T418-L464 HydrophobicContact CG2-CD2 4.23Å; H461-L464 WeakPolarHBondContact O-CB 3.35Å; H461-L464 PolarHBondContact O-N 3.16Å; W462-L464 PolarHBondContact O-N 3.04Å; L464-V468 WeakPolarHBondContact O-CG2 3.29Å; L464-V468 PolarHBondContact O-N 2.9Å
465	L	55.8	Low	53.8	Low	8 Å²	8	54.9 Å²	54.9	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-44	177.1	-118.5	124.3	0	0	0	111.4	V417 L421 L439 F443 H461 W462 T463 V468 C469 L477	V417-L465 HydrophobicContact CG1-CD1 4.32Å; L421-L465 HydrophobicContact CD1-CD1 3.89Å; L421-L465 HydrophobicContact CD1-CG 3.66Å; L421-L465 HydrophobicContact CD2-CD2 4.5Å; L421-L465 HydrophobicContact CD2-CG 4.33Å; L439-L465 HydrophobicContact CD1-CD2 3.96Å; L439-L465 HydrophobicContact CD2-CD1 4.23Å; L439-L465 HydrophobicContact CD2-CD2 4.2Å; F443-L465 HydrophobicContact CZ-CD1 4.33Å; H461-L465 PolarHBondContact O-N 3.08Å; W462-L465 WeakPolarHBondContact O-CB 3.45Å; W462-L465 PolarHBondContact O-N 2.82Å; W462-L465 VanDerWaalsContact O-N 3.11Å; T463-L465 PolarHBondContact O-N 3.1Å; L465-V468 PolarHBondContact O-N 3.35Å; L465-C469 WeakPolarHBondContact O-CB 3.38Å; L465-C469 PolarHBondContact O-N 2.92Å; L465-L477 HydrophobicContact CB-CD2 4.43Å; L465-L477 HydrophobicContact CD2-CD1 3.65Å; L465-L477 HydrophobicContact CD2-CD2 4.11Å
466	L	58.1	Low	54.4	Low	7 Å²	7	55.5 Å²	55.5	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-67.9	-37.6	179	-70.3	165.2	0	0	0	112.3	W462 T463 V468 F474 L477 F511 V515	W462-L466 WeakPolarHBondContact O-CB 3.34Å; W462-L466 VanDerWaalsContact O-CG 3.22Å; W462-L466 WeakPolarHBondContact O-CG 3.23Å; W462-L466 PolarHBondContact O-N 3.27Å; T463-L466 PolarHBondContact O-N 3.35Å; L466-V468 PolarHBondContact O-N 3.48Å; L466-F474 HydrophobicContact CB-CE2 4Å; L466-F474 HydrophobicContact CD2-CD2 3.97Å; L466-F474 HydrophobicContact CD2-CE1 4.43Å; L466-F474 HydrophobicContact CD2-CE2 3.38Å; L466-F474 HydrophobicContact CD2-CZ 3.66Å; L466-F474 HydrophobicContact CG-CE2 4.26Å; L466-L477 HydrophobicContact CD2-CD2 3.62Å; L466-L477 HydrophobicContact CG-CD2 4.13Å; L466-F511 HydrophobicContact CD1-CD2 4.33Å; L466-F511 HydrophobicContact CD1-CE2 3.59Å; L466-F511 HydrophobicContact CD1-CZ 4.17Å; L466-V515 HydrophobicContact CD1-CB 4.46Å; L466-V515 HydrophobicContact CD1-CG2 3.31Å; L466-V515 HydrophobicContact CD2-CG2 4.12Å; L466-V515 HydrophobicContact CG-CG2 4.37Å
467	D	55.7	Low	54.9	Low	105 Å²	105	49.5 Å²	49.5	56%	0.561	27%	0.27	S	S	*	.	H	α-helix	trans	-65.3	-28.5	177.9	-79.7	-20.9	0	0	0	112.8	T463 T518	T463-D467 WeakPolarHBondContact O-CB 3.25Å; T463-D467 VanDerWaalsContact O-CG 3.22Å; T463-D467 PolarHBondContact O-N 3.12Å; D467-T518 VanDerWaalsContact OD1-CG2 3.22Å; D467-T518 WeakPolarHBondContact OD1-CG2 3.34Å
468	V	53.6	Low	55.2	Low	55 Å²	55	44.9 Å²	44.9	33%	0.333	25%	0.252	S	S	.	.	H	α-helix	trans	-108.8	-14.5	-172.1	-166.1	0	0	0	0	112	L421 L464 L465 L466	L421-V468 HydrophobicContact CB-CG1 4.46Å; L421-V468 VanDerWaalsContact O-CG1 3.27Å; L421-V468 WeakPolarHBondContact O-CG1 3.32Å; L464-V468 WeakPolarHBondContact O-CG2 3.29Å; L464-V468 PolarHBondContact O-N 2.9Å; L465-V468 PolarHBondContact O-N 3.35Å; L466-V468 PolarHBondContact O-N 3.48Å
469	C	56.4	Low	55.7	Low	24 Å²	24	46 Å²	46	16%	0.162	26%	0.257	C	S	.	.	S	Bend	trans	-67.1	132.1	179.4	-173.4	0	0	0	0	111.2	L465 C473	L465-C469 WeakPolarHBondContact O-CB 3.38Å; L465-C469 PolarHBondContact O-N 2.92Å; C469-C473 VanDerWaalsContact SG-CB 3.51Å
470	P	55.5	Low	56.1	Low	39 Å²	39	47.4 Å²	47.4	25%	0.253	26%	0.264	S	S	.	.			trans	-56.9	141.3	169	-22.1	31.8	0	0	0	111.2	W424 T472 C473 F474	W424-P470 HydrophobicContact CZ2-CG 3.92Å; P470-T472 PolarHBondContact O-N 3.17Å; P470-C473 PolarHBondContact O-N 2.94Å; P470-F474 PolarHBondContact O-N 3.34Å
471	S	54.9	Low	56.2	Low	76 Å²	76	43.1 Å²	43.1	53%	0.531	24%	0.241	S	C	.	.	H	α-helix	trans	-53.6	-34.1	-179.7	57.2	0	0	0	0	113	C473 F474	S471-C473 PolarHBondContact O-N 3.35Å; S471-C473 VanDerWaalsContact O-N 3.12Å; S471-F474 WeakPolarHBondContact O-CB 3.22Å; S471-F474 PolarHBondContact O-N 3.15Å
472	T	51.8	Low	56.4	Low	118 Å²	118	42 Å²	42	72%	0.724	24%	0.236	S	C	*	.	H	α-helix	trans	-60.3	-22.1	176.7	53.6	0	0	0	0	114.3	P470	P470-T472 PolarHBondContact O-N 3.17Å
473	C	52.9	Low	56.4	Low	34 Å²	34	45.4 Å²	45.4	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-109.4	-9.8	-176.8	-62	0	0	0	0	112.1	C469 P470 S471 E475 M476 L477	C469-C473 VanDerWaalsContact SG-CB 3.51Å; P470-C473 PolarHBondContact O-N 2.94Å; S471-C473 PolarHBondContact O-N 3.35Å; S471-C473 VanDerWaalsContact O-N 3.12Å; C473-E475 PolarHBondContact O-N 3.16Å; C473-M476 PolarHBondContact O-N 2.89Å; C473-L477 PolarHBondContact O-N 2.91Å
474	F	56.5	Low	56.4	Low	10 Å²	10	44.6 Å²	44.6	4%	0.044	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-45.4	-173.8	-170.7	-84.5	0	0	0	112.4	L466 P470 S471 M476 L477 C478 V515 I519 I528	L466-F474 HydrophobicContact CB-CE2 4Å; L466-F474 HydrophobicContact CD2-CD2 3.97Å; L466-F474 HydrophobicContact CD2-CE1 4.43Å; L466-F474 HydrophobicContact CD2-CE2 3.38Å; L466-F474 HydrophobicContact CD2-CZ 3.66Å; L466-F474 HydrophobicContact CG-CE2 4.26Å; P470-F474 PolarHBondContact O-N 3.34Å; S471-F474 WeakPolarHBondContact O-CB 3.22Å; S471-F474 PolarHBondContact O-N 3.15Å; F474-M476 PolarHBondContact O-N 3.46Å; F474-L477 PolarHBondContact O-N 3.12Å; F474-C478 WeakPolarHBondContact CE1-SG 3.4Å; F474-C478 WeakPolarHBondContact O-CB 3.25Å; F474-C478 PolarHBondContact O-N 3.37Å; F474-C478 PolarHBondContact O-SG 2.82Å; F474-V515 HydrophobicContact CE1-CG1 3.84Å; F474-V515 HydrophobicContact CZ-CB 4.49Å; F474-V515 HydrophobicContact CZ-CG1 3.82Å; F474-I519 HydrophobicContact CD1-CD1 4.49Å; F474-I519 HydrophobicContact CD1-CG1 3.93Å; F474-I519 HydrophobicContact CE1-CD1 3.56Å; F474-I519 HydrophobicContact CE1-CG1 3.1Å; F474-I519 HydrophobicContact CE2-CG1 4.42Å; F474-I519 HydrophobicContact CZ-CD1 4.11Å; F474-I519 HydrophobicContact CZ-CG1 3.38Å; F474-I528 HydrophobicContact CD1-CD1 3.74Å; F474-I528 HydrophobicContact CE1-CD1 3.47Å; F474-I528 VanDerWaalsContact CE1-CD1 3.47Å
475	E	55.6	Low	56.2	Low	87 Å²	87	42.6 Å²	42.6	41%	0.407	24%	0.24	S	C	.	.	H	α-helix	trans	-58.8	-47.2	178.1	-173.1	-176.3	161.6	0	0	111.3	C473 L477 C478 I479 V527	C473-E475 PolarHBondContact O-N 3.16Å; E475-L477 PolarHBondContact O-N 3.23Å; E475-C478 WeakPolarHBondContact O-CB 3.32Å; E475-C478 PolarHBondContact O-N 2.94Å; E475-I479 HydrophobicContact CG-CD1 4.19Å; E475-I479 VanDerWaalsContact O-CG1 3.32Å; E475-I479 WeakPolarHBondContact O-CG1 3.2Å; E475-I479 PolarHBondContact O-N 2.83Å; E475-V527 HydrophobicContact CG-CG1 4.14Å; E475-V527 WeakPolarHBondContact OE1-CG1 3.46Å
476	M	59	Low	56.1	Low	98 Å²	98	43.8 Å²	43.8	48%	0.483	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-40	-179.4	-159.4	-174.9	-50.3	0	0	112	W436 C473 F474 C478 I479 Q480	W436-M476 VanDerWaalsContact CE2-SD 3.59Å; W436-M476 HydrophobicContact CH2-CB 3.94Å; W436-M476 HydrophobicContact CH2-CG 3.86Å; W436-M476 HydrophobicContact CH2-SD 3.94Å; W436-M476 HydrophobicContact CZ2-CB 4.11Å; W436-M476 HydrophobicContact CZ2-CG 3.5Å; W436-M476 HydrophobicContact CZ2-SD 3.22Å; W436-M476 WeakPolarHBondContact CZ2-SD 3.39Å; C473-M476 PolarHBondContact O-N 2.89Å; F474-M476 PolarHBondContact O-N 3.46Å; M476-C478 VanDerWaalsContact C-N 3.33Å; M476-I479 PolarHBondContact O-N 3.44Å; M476-Q480 PolarHBondContact O-N 3.1Å
477	L	57.9	Low	55.9	Low	5 Å²	5	47.7 Å²	47.7	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-44.4	175.6	-162.9	95.2	0	0	0	110.6	W436 L465 L466 C473 F474 E475 I479 Q480 L481	W436-L477 HydrophobicContact CH2-CB 4.4Å; W436-L477 HydrophobicContact CH2-CD1 4.26Å; W436-L477 HydrophobicContact CZ3-CD1 3.85Å; L465-L477 HydrophobicContact CB-CD2 4.43Å; L465-L477 HydrophobicContact CD2-CD1 3.65Å; L465-L477 HydrophobicContact CD2-CD2 4.11Å; L466-L477 HydrophobicContact CD2-CD2 3.62Å; L466-L477 HydrophobicContact CG-CD2 4.13Å; C473-L477 PolarHBondContact O-N 2.91Å; F474-L477 PolarHBondContact O-N 3.12Å; E475-L477 PolarHBondContact O-N 3.23Å; L477-I479 VanDerWaalsContact C-N 3.34Å; L477-I479 PolarHBondContact O-N 2.79Å; L477-Q480 PolarHBondContact O-N 2.92Å; L477-L481 HydrophobicContact CD2-CD1 3.78Å; L477-L481 HydrophobicContact CG-CD1 3.92Å; L477-L481 WeakPolarHBondContact O-CB 3.23Å; L477-L481 VanDerWaalsContact O-CD1 3.3Å; L477-L481 WeakPolarHBondContact O-CD1 3.25Å; L477-L481 WeakPolarHBondContact O-CG 3.28Å; L477-L481 PolarHBondContact O-N 3.44Å
478	C	57.7	Low	55.7	Low	1 Å²	1	43.9 Å²	43.9	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-40.4	176.8	-69.6	0	0	0	0	112	F474 E475 M476 L481 I482 I528	F474-C478 WeakPolarHBondContact CE1-SG 3.4Å; F474-C478 WeakPolarHBondContact O-CB 3.25Å; F474-C478 PolarHBondContact O-N 3.37Å; F474-C478 PolarHBondContact O-SG 2.82Å; E475-C478 WeakPolarHBondContact O-CB 3.32Å; E475-C478 PolarHBondContact O-N 2.94Å; M476-C478 VanDerWaalsContact C-N 3.33Å; C478-L481 WeakPolarHBondContact O-CB 3.41Å; C478-L481 PolarHBondContact O-N 3.08Å; C478-I482 VanDerWaalsContact O-CD1 3.27Å; C478-I482 WeakPolarHBondContact O-CD1 3.21Å; C478-I482 WeakPolarHBondContact O-CG1 3.48Å; C478-I482 PolarHBondContact O-N 2.83Å; C478-I528 HydrophobicContact CB-CD1 3.83Å; C478-I528 HydrophobicContact CB-CG1 3.81Å; C478-I528 HydrophobicContact CB-CG2 4.36Å; C478-I528 VanDerWaalsContact SG-CD1 3.54Å
479	I	59.7	Low	55.5	Low	40 Å²	40	42.7 Å²	42.7	21%	0.205	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-50.7	177.1	-66.8	167.7	0	0	0	110.8	E475 M476 L477 L481 I482 D483 Q531	E475-I479 HydrophobicContact CG-CD1 4.19Å; E475-I479 VanDerWaalsContact O-CG1 3.32Å; E475-I479 WeakPolarHBondContact O-CG1 3.2Å; E475-I479 PolarHBondContact O-N 2.83Å; M476-I479 PolarHBondContact O-N 3.44Å; L477-I479 VanDerWaalsContact C-N 3.34Å; L477-I479 PolarHBondContact O-N 2.79Å; I479-L481 PolarHBondContact O-N 2.99Å; I479-I482 WeakPolarHBondContact O-CB 3.44Å; I479-I482 PolarHBondContact O-N 3.28Å; I479-D483 PolarHBondContact O-N 2.92Å; I479-Q531 HydrophobicContact CG1-CG 4.2Å
480	Q	58.5	Low	55.2	Low	62 Å²	62	47.4 Å²	47.4	29%	0.29	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-33.7	179.1	-70.2	-142.9	-19.5	0	0	112.8	M476 L477 I482 D483 M484	M476-Q480 PolarHBondContact O-N 3.1Å; L477-Q480 PolarHBondContact O-N 2.92Å; Q480-I482 VanDerWaalsContact C-N 3.33Å; Q480-D483 PolarHBondContact O-N 2.88Å; Q480-M484 VanDerWaalsContact O-CB 3.25Å; Q480-M484 WeakPolarHBondContact O-CB 3.36Å; Q480-M484 VanDerWaalsContact O-CG 3.28Å; Q480-M484 WeakPolarHBondContact O-CG 3.4Å; Q480-M484 PolarHBondContact O-N 3.12Å
481	L	57	Low	54.9	Low	7 Å²	7	48.9 Å²	48.9	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-41.2	172.9	-97	153.6	0	0	0	113.1	W462 L477 C478 I479 M484 A485 F511	W462-L481 HydrophobicContact CD2-CD1 4.18Å; W462-L481 HydrophobicContact CD2-CD2 3.38Å; W462-L481 HydrophobicContact CD2-CG 4.15Å; W462-L481 HydrophobicContact CE3-CD1 3.35Å; W462-L481 HydrophobicContact CE3-CD2 3.28Å; W462-L481 HydrophobicContact CE3-CG 3.52Å; W462-L481 HydrophobicContact CG-CD2 4.1Å; W462-L481 HydrophobicContact CH2-CD1 4.31Å; W462-L481 HydrophobicContact CH2-CD2 3.21Å; W462-L481 HydrophobicContact CH2-CG 3.56Å; W462-L481 HydrophobicContact CZ2-CD2 3.48Å; W462-L481 VanDerWaalsContact CZ2-CD2 3.48Å; W462-L481 HydrophobicContact CZ2-CG 4.33Å; W462-L481 HydrophobicContact CZ3-CD1 3.42Å; W462-L481 VanDerWaalsContact CZ3-CD1 3.42Å; W462-L481 HydrophobicContact CZ3-CD2 3.18Å; W462-L481 HydrophobicContact CZ3-CG 3.16Å; L477-L481 HydrophobicContact CD2-CD1 3.78Å; L477-L481 HydrophobicContact CG-CD1 3.92Å; L477-L481 WeakPolarHBondContact O-CB 3.23Å; L477-L481 VanDerWaalsContact O-CD1 3.3Å; L477-L481 WeakPolarHBondContact O-CD1 3.25Å; L477-L481 WeakPolarHBondContact O-CG 3.28Å; L477-L481 PolarHBondContact O-N 3.44Å; C478-L481 WeakPolarHBondContact O-CB 3.41Å; C478-L481 PolarHBondContact O-N 3.08Å; I479-L481 PolarHBondContact O-N 2.99Å; L481-M484 WeakPolarHBondContact O-CB 3.3Å; L481-A485 PolarHBondContact O-N 3Å; L481-F511 HydrophobicContact CB-CE1 4.05Å; L481-F511 HydrophobicContact CB-CZ 3.76Å; L481-F511 HydrophobicContact CD1-CE1 4.35Å; L481-F511 HydrophobicContact CD1-CE2 3.63Å; L481-F511 HydrophobicContact CD1-CZ 3.27Å; L481-F511 HydrophobicContact CD2-CD2 4.47Å; L481-F511 HydrophobicContact CD2-CE1 4.21Å; L481-F511 HydrophobicContact CD2-CE2 3.73Å; L481-F511 HydrophobicContact CD2-CZ 3.61Å; L481-F511 HydrophobicContact CG-CE1 4.42Å; L481-F511 HydrophobicContact CG-CE2 4.17Å; L481-F511 HydrophobicContact CG-CZ 3.7Å
482	I	58.3	Low	54.4	Low	5 Å²	5	47.8 Å²	47.8	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-67.5	-46.9	176.3	-66.5	159.5	0	0	0	109.9	C478 I479 Q480 M484 A485 E486 Q531 L532 S535	C478-I482 VanDerWaalsContact O-CD1 3.27Å; C478-I482 WeakPolarHBondContact O-CD1 3.21Å; C478-I482 WeakPolarHBondContact O-CG1 3.48Å; C478-I482 PolarHBondContact O-N 2.83Å; I479-I482 WeakPolarHBondContact O-CB 3.44Å; I479-I482 PolarHBondContact O-N 3.28Å; Q480-I482 VanDerWaalsContact C-N 3.33Å; I482-M484 VanDerWaalsContact C-N 3.27Å; I482-M484 PolarHBondContact O-N 3.04Å; I482-A485 PolarHBondContact O-N 3.17Å; I482-A485 VanDerWaalsContact O-N 3.14Å; I482-E486 PolarHBondContact O-N 3.26Å; I482-Q531 HydrophobicContact CD1-CB 3.95Å; I482-Q531 HydrophobicContact CD1-CG 4.15Å; I482-L532 HydrophobicContact CD1-CD1 4.44Å; I482-L532 HydrophobicContact CD1-CD2 4Å; I482-L532 HydrophobicContact CD1-CG 3.64Å; I482-L532 HydrophobicContact CG1-CD2 3.71Å; I482-L532 HydrophobicContact CG1-CG 3.96Å; I482-S535 VanDerWaalsContact CG2-CB 3.47Å; I482-S535 WeakPolarHBondContact CG2-OG 3.35Å
483	D	58.7	Low	53.9	Low	76 Å²	76	49.1 Å²	49.1	41%	0.406	27%	0.267	S	S	.	.	H	α-helix	trans	-59.2	-40.1	178.1	-65.6	-19	0	0	0	111.6	I479 Q480 E486 L487	I479-D483 PolarHBondContact O-N 2.92Å; Q480-D483 PolarHBondContact O-N 2.88Å; D483-E486 WeakPolarHBondContact O-CB 3.33Å; D483-E486 PolarHBondContact O-N 2.83Å; D483-L487 WeakPolarHBondContact O-CB 3.21Å; D483-L487 PolarHBondContact O-N 3.36Å
484	M	54	Low	53	Low	25 Å²	25	53.9 Å²	53.9	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-44.7	174.5	-90.7	-102.2	-76	0	0	113.4	F443 A446 W462 Q480 L481 I482 E486 L487 S488	F443-M484 VanDerWaalsContact CA-SD 3.56Å; F443-M484 HydrophobicContact CB-CE 3.48Å; F443-M484 VanDerWaalsContact CB-CE 3.48Å; F443-M484 HydrophobicContact CB-CG 4Å; F443-M484 HydrophobicContact CB-SD 3.59Å; F443-M484 VanDerWaalsContact CB-SD 3.59Å; F443-M484 HydrophobicContact CD1-CE 3.45Å; F443-M484 VanDerWaalsContact CD1-CE 3.45Å; F443-M484 HydrophobicContact CE1-CE 4.5Å; F443-M484 HydrophobicContact CG-CE 3.73Å; F443-M484 HydrophobicContact CG-SD 4.47Å; A446-M484 HydrophobicContact CB-CE 4.45Å; W462-M484 HydrophobicContact CH2-CE 3.54Å; W462-M484 HydrophobicContact CZ2-CE 3.37Å; Q480-M484 VanDerWaalsContact O-CB 3.25Å; Q480-M484 WeakPolarHBondContact O-CB 3.36Å; Q480-M484 VanDerWaalsContact O-CG 3.28Å; Q480-M484 WeakPolarHBondContact O-CG 3.4Å; Q480-M484 PolarHBondContact O-N 3.12Å; L481-M484 WeakPolarHBondContact O-CB 3.3Å; I482-M484 VanDerWaalsContact C-N 3.27Å; I482-M484 PolarHBondContact O-N 3.04Å; M484-E486 VanDerWaalsContact C-N 3.34Å; M484-L487 WeakPolarHBondContact O-CB 2.92Å; M484-L487 PolarHBondContact O-N 3.23Å; M484-S488 PolarHBondContact O-N 2.98Å
485	A	52.1	Low	52.3	Low	13 Å²	13	57 Å²	57	11%	0.107	33%	0.333	C	S	.	.	H	α-helix	trans	-68.5	-37.7	178.5	0	0	0	0	0	111.4	L481 I482 S488 A489 L508	L481-A485 PolarHBondContact O-N 3Å; I482-A485 PolarHBondContact O-N 3.17Å; I482-A485 VanDerWaalsContact O-N 3.14Å; A485-S488 PolarHBondContact O-N 2.94Å; A485-S488 PolarHBondContact O-OG 3.14Å; A485-A489 PolarHBondContact O-N 3.37Å; A485-A489 VanDerWaalsContact O-N 3.1Å; A485-L508 HydrophobicContact CB-CD1 3.15Å
486	E	54.6	Low	51.3	Low	33 Å²	33	59 Å²	59	15%	0.154	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-45	169.7	-74.5	-168.1	174.9	0	0	111.8	I482 D483 M484 A489 N490 S535 L539	I482-E486 PolarHBondContact O-N 3.26Å; D483-E486 WeakPolarHBondContact O-CB 3.33Å; D483-E486 PolarHBondContact O-N 2.83Å; M484-E486 VanDerWaalsContact C-N 3.34Å; E486-A489 PolarHBondContact O-N 3.1Å; E486-N490 WeakPolarHBondContact O-CB 3.17Å; E486-N490 VanDerWaalsContact O-CG 3.31Å; E486-N490 PolarHBondContact O-N 2.82Å; E486-N490 PolarHBondContact O-ND2 2.94Å; E486-S535 WeakPolarHBondContact OE1-CA 3.28Å; E486-S535 WeakPolarHBondContact OE1-CB 3.5Å; E486-S535 PolarHBondContact OE1-OG 2.96Å; E486-L539 HydrophobicContact CG-CD1 4.44Å
487	L	53.9	Low	50.2	Low	89 Å²	89	62.6 Å²	62.6	47%	0.466	36%	0.355	S	S	.	.	H	α-helix	trans	-59	-46.9	175.4	-102.3	148.9	0	0	0	111.4	D483 M484 A489 N490 C491	D483-L487 WeakPolarHBondContact O-CB 3.21Å; D483-L487 PolarHBondContact O-N 3.36Å; M484-L487 WeakPolarHBondContact O-CB 2.92Å; M484-L487 PolarHBondContact O-N 3.23Å; L487-A489 VanDerWaalsContact C-N 3.25Å; L487-A489 PolarHBondContact O-N 2.84Å; L487-N490 PolarHBondContact O-N 2.92Å; L487-N490 VanDerWaalsContact O-N 3.15Å; L487-C491 WeakPolarHBondContact O-CB 3.38Å; L487-C491 PolarHBondContact O-N 3.28Å; L487-C491 PolarHBondContact O-SG 3.29Å
488	S	50.1	Low	49.3	Very low	25 Å²	25	65.3 Å²	65.3	18%	0.175	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-35	178.7	87.9	0	0	0	0	112.5	M484 A485	M484-S488 PolarHBondContact O-N 2.98Å; A485-S488 PolarHBondContact O-N 2.94Å; A485-S488 PolarHBondContact O-OG 3.14Å
489	A	50.4	Low	48.5	Very low	29 Å²	29	69.2 Å²	69.2	24%	0.24	41%	0.407	C	S	.	.	H	α-helix	trans	-73.5	-34.4	177.3	0	0	0	0	0	112.4	A485 E486 L487 L539	A485-A489 PolarHBondContact O-N 3.37Å; A485-A489 VanDerWaalsContact O-N 3.1Å; E486-A489 PolarHBondContact O-N 3.1Å; L487-A489 VanDerWaalsContact C-N 3.25Å; L487-A489 PolarHBondContact O-N 2.84Å; A489-L539 HydrophobicContact CB-CD2 3.3Å
490	N	51.1	Low	47.8	Very low	123 Å²	123	69.3 Å²	69.3	66%	0.658	41%	0.411	S	S	*	.	H	α-helix	trans	-80.1	-21.8	178	-69.2	-31.1	0	0	0	113.4	E486 L487 N492	E486-N490 WeakPolarHBondContact O-CB 3.17Å; E486-N490 VanDerWaalsContact O-CG 3.31Å; E486-N490 PolarHBondContact O-N 2.82Å; E486-N490 PolarHBondContact O-ND2 2.94Å; L487-N490 PolarHBondContact O-N 2.92Å; L487-N490 VanDerWaalsContact O-N 3.15Å; N490-N492 PolarHBondContact O-N 3.37Å
491	C	48.2	Very low	47.6	Very low	71 Å²	71	68 Å²	68	48%	0.48	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.3	176	-73.7	0	0	0	0	113.7	L487 L493	L487-C491 WeakPolarHBondContact O-CB 3.38Å; L487-C491 PolarHBondContact O-N 3.28Å; L487-C491 PolarHBondContact O-SG 3.29Å; C491-L493 PolarHBondContact O-N 3.45Å
492	N	45.1	Very low	47.4	Very low	53 Å²	53	70.9 Å²	70.9	28%	0.283	42%	0.419	S	S	.	.	S	Bend	trans	-73.2	107.9	167.3	-74.7	-23.5	0	0	0	109	N490 D501	N490-N492 PolarHBondContact O-N 3.37Å; N492-D501 PolarHBondContact ND2-OD1 3.03Å
493	L	40.1	Very low	47.2	Very low	145 Å²	145	75 Å²	75	76%	0.759	45%	0.445	S	S	*	.			trans	-38.1	132.3	172.1	-84.5	137.1	0	0	0	110.9	C491 G495 Q496	C491-L493 PolarHBondContact O-N 3.45Å; L493-G495 PolarHBondContact O-N 3.01Å; L493-Q496 PolarHBondContact O-N 3.32Å
494	P	35.1	Very low	46.9	Very low	134 Å²	134	72.9 Å²	72.9	87%	0.87	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	114.9	-176.9	22.1	-31.5	0	0	0	109.9
495	G	40.2	Very low	46.9	Very low	76 Å²	76	73.1 Å²	73.1	78%	0.784	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.3	-3.5	176.7	0	0	0	0	0	116.8	L493	L493-G495 PolarHBondContact O-N 3.01Å
496	Q	36.4	Very low	47.2	Very low	128 Å²	128	75 Å²	75	60%	0.598	44%	0.444	S	S	*	.			trans	-119	71.1	174.9	-72.6	-173.3	-3.6	0	0	112.4	L493 S498	L493-Q496 PolarHBondContact O-N 3.32Å; Q496-S498 PolarHBondContact O-N 3.07Å
497	F	34.7	Very low	47.3	Very low	175 Å²	175	74.7 Å²	74.7	77%	0.768	45%	0.447	S	S	*	.			trans	-70.3	81.4	156.8	-83.6	-81.2	0	0	0	108	D501	F497-D501 VanDerWaalsContact CD1-OD2 3.25Å; F497-D501 WeakPolarHBondContact CD1-OD2 3.15Å
498	S	40	Very low	47.4	Very low	62 Å²	62	71.1 Å²	71.1	43%	0.434	43%	0.429	S	S	.	.			trans	-113.2	159.8	174.9	77.2	0	0	0	0	109.1	Q496 S500 D501	Q496-S498 PolarHBondContact O-N 3.07Å; S498-S500 PolarHBondContact O-N 2.75Å; S498-S500 PolarHBondContact O-OG 3.22Å; S498-D501 PolarHBondContact O-N 3.22Å; S498-D501 VanDerWaalsContact O-N 3.12Å
499	A	39.8	Very low	47.8	Very low	82 Å²	82	70.9 Å²	70.9	68%	0.678	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-6.6	-169.4	0	0	0	0	0	118	D501 T503	A499-D501 VanDerWaalsContact C-N 3.28Å; A499-D501 PolarHBondContact O-N 3.26Å; A499-T503 PolarHBondContact O-OG1 3.39Å
500	S	45.7	Very low	48.3	Very low	43 Å²	43	73 Å²	73	30%	0.301	43%	0.429	S	S	.	.	H	α-helix	trans	-58.9	-35.1	167.3	57.8	0	0	0	0	113.2	S498 E502 T503 T504	S498-S500 PolarHBondContact O-N 2.75Å; S498-S500 PolarHBondContact O-OG 3.22Å; S500-E502 PolarHBondContact O-N 3.11Å; S500-T503 PolarHBondContact O-N 3.28Å; S500-T504 PolarHBondContact O-N 2.93Å; S500-T504 PolarHBondContact O-OG1 2.95Å
501	D	53.8	Low	48.8	Very low	34 Å²	34	67.8 Å²	67.8	18%	0.182	40%	0.401	C	S	.	.	H	α-helix	trans	-68.7	-37.8	-174.9	-69.5	-19	0	0	0	112.8	N492 F497 S498 A499 T504 L505	N492-D501 PolarHBondContact ND2-OD1 3.03Å; F497-D501 VanDerWaalsContact CD1-OD2 3.25Å; F497-D501 WeakPolarHBondContact CD1-OD2 3.15Å; S498-D501 PolarHBondContact O-N 3.22Å; S498-D501 VanDerWaalsContact O-N 3.12Å; A499-D501 VanDerWaalsContact C-N 3.28Å; A499-D501 PolarHBondContact O-N 3.26Å; D501-T504 PolarHBondContact O-N 3.23Å; D501-L505 WeakPolarHBondContact O-CB 3.34Å; D501-L505 WeakPolarHBondContact O-CG 3.25Å; D501-L505 PolarHBondContact O-N 2.89Å
502	E	52.3	Low	49.2	Very low	67 Å²	67	64.8 Å²	64.8	31%	0.313	38%	0.38	S	S	.	.	H	α-helix	trans	-68.6	-39	177.2	-170.5	177.1	161.4	0	0	111.3	S500 T504 L505 I506 S545	S500-E502 PolarHBondContact O-N 3.11Å; E502-T504 VanDerWaalsContact C-N 3.34Å; E502-T504 PolarHBondContact O-N 2.97Å; E502-L505 PolarHBondContact O-N 2.87Å; E502-I506 HydrophobicContact CG-CD1 3.94Å; E502-I506 HydrophobicContact CG-CG1 4.43Å; E502-I506 WeakPolarHBondContact O-CB 3.19Å; E502-I506 VanDerWaalsContact O-CG1 3.26Å; E502-I506 WeakPolarHBondContact O-CG1 3.35Å; E502-I506 PolarHBondContact O-N 3.22Å; E502-S545 WeakPolarHBondContact OE1-CB 3.41Å; E502-S545 PolarHBondContact OE1-OG 3.22Å; E502-S545 PolarHBondContact OE2-OG 3.21Å
503	T	54.5	Low	50	Low	93 Å²	93	64.5 Å²	64.5	57%	0.571	38%	0.376	S	S	*	.	H	α-helix	trans	-65.6	-40.9	178.2	-40.1	0	0	0	0	110.8	A499 S500 I506 A507	A499-T503 PolarHBondContact O-OG1 3.39Å; S500-T503 PolarHBondContact O-N 3.28Å; T503-I506 PolarHBondContact O-N 3.3Å; T503-A507 VanDerWaalsContact O-CB 3.26Å; T503-A507 WeakPolarHBondContact O-CB 3.29Å; T503-A507 PolarHBondContact O-N 3.35Å
504	T	52.8	Low	51	Low	31 Å²	31	59.6 Å²	59.6	19%	0.19	35%	0.351	C	S	.	.	H	α-helix	trans	-65.6	-42.7	174.1	-58	0	0	0	0	111.5	S500 D501 E502 A507 L508	S500-T504 PolarHBondContact O-N 2.93Å; S500-T504 PolarHBondContact O-OG1 2.95Å; D501-T504 PolarHBondContact O-N 3.23Å; E502-T504 VanDerWaalsContact C-N 3.34Å; E502-T504 PolarHBondContact O-N 2.97Å; T504-A507 PolarHBondContact O-N 3.16Å; T504-L508 WeakPolarHBondContact O-CB 3.32Å; T504-L508 PolarHBondContact O-N 3.31Å
505	L	54	Low	52	Low	30 Å²	30	53.3 Å²	53.3	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-42.6	175.9	-82.9	165.6	0	0	0	112.1	D501 E502 L508 F509 V540 F546	D501-L505 WeakPolarHBondContact O-CB 3.34Å; D501-L505 WeakPolarHBondContact O-CG 3.25Å; D501-L505 PolarHBondContact O-N 2.89Å; E502-L505 PolarHBondContact O-N 2.87Å; L505-L508 PolarHBondContact O-N 3.31Å; L505-F509 WeakPolarHBondContact O-CB 3.41Å; L505-F509 PolarHBondContact O-N 3.38Å; L505-V540 HydrophobicContact CD1-CG1 4.27Å; L505-V540 HydrophobicContact CD1-CG2 4.44Å; L505-V540 HydrophobicContact CD2-CG2 3.85Å; L505-F546 HydrophobicContact CB-CD2 4.4Å; L505-F546 HydrophobicContact CB-CE2 4.42Å
506	I	58.1	Low	52.8	Low	52 Å²	52	50.5 Å²	50.5	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-42.7	175	-69	168.1	0	0	0	110.3	E502 T503 F509 Q510 F549	E502-I506 HydrophobicContact CG-CD1 3.94Å; E502-I506 HydrophobicContact CG-CG1 4.43Å; E502-I506 WeakPolarHBondContact O-CB 3.19Å; E502-I506 VanDerWaalsContact O-CG1 3.26Å; E502-I506 WeakPolarHBondContact O-CG1 3.35Å; E502-I506 PolarHBondContact O-N 3.22Å; T503-I506 PolarHBondContact O-N 3.3Å; I506-F509 WeakPolarHBondContact O-CB 3.33Å; I506-F509 PolarHBondContact O-N 3.41Å; I506-Q510 WeakPolarHBondContact O-CB 3.38Å; I506-Q510 PolarHBondContact O-N 3.4Å; I506-F549 HydrophobicContact CG1-CD1 4.49Å; I506-F549 HydrophobicContact CG2-CE1 4.48Å; I506-F549 HydrophobicContact CG2-CE2 4.17Å; I506-F549 HydrophobicContact CG2-CZ 4.05Å
507	A	56.5	Low	54	Low	26 Å²	26	49.2 Å²	49.2	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-42.2	176.8	0	0	0	0	0	111.7	F459 T503 T504 F509 Q510 F511	F459-A507 HydrophobicContact CD2-CB 3.82Å; F459-A507 HydrophobicContact CE2-CB 3.66Å; F459-A507 HydrophobicContact CG-CB 4.44Å; F459-A507 HydrophobicContact CZ-CB 4.17Å; T503-A507 VanDerWaalsContact O-CB 3.26Å; T503-A507 WeakPolarHBondContact O-CB 3.29Å; T503-A507 PolarHBondContact O-N 3.35Å; T504-A507 PolarHBondContact O-N 3.16Å; A507-F509 VanDerWaalsContact C-N 3.33Å; A507-Q510 PolarHBondContact O-N 2.87Å; A507-F511 WeakPolarHBondContact O-CB 3.49Å; A507-F511 PolarHBondContact O-N 2.86Å
508	L	56.2	Low	55	Low	15 Å²	15	42.9 Å²	42.9	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-44.1	172	-168.2	102.2	0	0	0	110.5	A485 T504 L505 Q510 F511 V512 L532 V536	A485-L508 HydrophobicContact CB-CD1 3.15Å; T504-L508 WeakPolarHBondContact O-CB 3.32Å; T504-L508 PolarHBondContact O-N 3.31Å; L505-L508 PolarHBondContact O-N 3.31Å; L508-Q510 PolarHBondContact O-N 3.39Å; L508-F511 WeakPolarHBondContact O-CB 3.47Å; L508-F511 PolarHBondContact O-N 3.35Å; L508-V512 VanDerWaalsContact O-CG2 3.23Å; L508-V512 WeakPolarHBondContact O-CG2 3.43Å; L508-V512 PolarHBondContact O-N 2.91Å; L508-L532 HydrophobicContact CD2-CD2 4.42Å; L508-V536 HydrophobicContact CD2-CG2 3.8Å
509	F	59	Low	55.9	Low	20 Å²	20	40.6 Å²	40.6	9%	0.088	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-43.8	179.8	-142.4	-90.5	0	0	0	112.3	L505 I506 A507 F511 V512 K513 F546 F549 I562 L574 F576	L505-F509 WeakPolarHBondContact O-CB 3.41Å; L505-F509 PolarHBondContact O-N 3.38Å; I506-F509 WeakPolarHBondContact O-CB 3.33Å; I506-F509 PolarHBondContact O-N 3.41Å; A507-F509 VanDerWaalsContact C-N 3.33Å; F509-F511 VanDerWaalsContact C-N 3.35Å; F509-V512 PolarHBondContact O-N 2.97Å; F509-K513 WeakPolarHBondContact O-CB 3.48Å; F509-K513 PolarHBondContact O-N 2.76Å; F509-F546 AromaticContact CD2-CE2 3.68Å; F509-F546 HydrophobicContact CD2-CE2 3.68Å; F509-F546 AromaticContact CD2-CZ 3.48Å; F509-F546 HydrophobicContact CD2-CZ 3.48Å; F509-F546 VanDerWaalsContact CD2-CZ 3.48Å; F509-F546 HydrophobicContact CE2-CE2 4.22Å; F509-F546 AromaticContact CE2-CZ 3.56Å; F509-F546 HydrophobicContact CE2-CZ 3.56Å; F509-F546 HydrophobicContact CG-CE2 4.27Å; F509-F546 HydrophobicContact CG-CZ 4.41Å; F509-F549 HydrophobicContact CB-CE1 4.07Å; F509-F549 AromaticContact CD1-CE1 3.86Å; F509-F549 HydrophobicContact CD1-CE1 3.86Å; F509-F549 HydrophobicContact CG-CE1 4.13Å; F509-I562 HydrophobicContact CE1-CD1 3.53Å; F509-I562 HydrophobicContact CE1-CG1 4.49Å; F509-I562 HydrophobicContact CE2-CD1 4.49Å; F509-I562 HydrophobicContact CZ-CD1 3.24Å; F509-I562 HydrophobicContact CZ-CG1 3.79Å; F509-L574 HydrophobicContact CE2-CD2 4.27Å; F509-F576 HydrophobicContact CE2-CE1 4.03Å; F509-F576 HydrophobicContact CE2-CZ 4.08Å; F509-F576 AromaticContact CZ-CE1 3.94Å; F509-F576 HydrophobicContact CZ-CE1 3.94Å; F509-F576 HydrophobicContact CZ-CZ 4.45Å
510	Q	61.4	Low	56.7	Low	72 Å²	72	48.5 Å²	48.5	34%	0.336	25%	0.246	S	C	.	.	H	α-helix	trans	-66.3	-40.5	176.5	-164.5	68.8	29	0	0	110.6	I506 A507 L508 K513 D514	I506-Q510 WeakPolarHBondContact O-CB 3.38Å; I506-Q510 PolarHBondContact O-N 3.4Å; A507-Q510 PolarHBondContact O-N 2.87Å; L508-Q510 PolarHBondContact O-N 3.39Å; Q510-K513 WeakPolarHBondContact O-CB 3.15Å; Q510-K513 PolarHBondContact O-N 2.85Å; Q510-D514 WeakPolarHBondContact O-CB 3.19Å; Q510-D514 PolarHBondContact O-N 3.06Å
511	F	60.1	Low	57.5	Low	15 Å²	15	49.7 Å²	49.7	7%	0.066	25%	0.249	C	C	.	.	H	α-helix	trans	-59.3	-49.4	173.4	168.3	-97.2	0	0	0	111.7	F459 W462 L466 L481 A507 L508 F509 K513 D514 V515	F459-F511 HydrophobicContact CD1-CB 4.5Å; W462-F511 HydrophobicContact CB-CD2 4.21Å; W462-F511 HydrophobicContact CB-CE2 3.98Å; W462-F511 HydrophobicContact CG-CE2 4.45Å; L466-F511 HydrophobicContact CD1-CD2 4.33Å; L466-F511 HydrophobicContact CD1-CE2 3.59Å; L466-F511 HydrophobicContact CD1-CZ 4.17Å; L481-F511 HydrophobicContact CB-CE1 4.05Å; L481-F511 HydrophobicContact CB-CZ 3.76Å; L481-F511 HydrophobicContact CD1-CE1 4.35Å; L481-F511 HydrophobicContact CD1-CE2 3.63Å; L481-F511 HydrophobicContact CD1-CZ 3.27Å; L481-F511 HydrophobicContact CD2-CD2 4.47Å; L481-F511 HydrophobicContact CD2-CE1 4.21Å; L481-F511 HydrophobicContact CD2-CE2 3.73Å; L481-F511 HydrophobicContact CD2-CZ 3.61Å; L481-F511 HydrophobicContact CG-CE1 4.42Å; L481-F511 HydrophobicContact CG-CE2 4.17Å; L481-F511 HydrophobicContact CG-CZ 3.7Å; A507-F511 WeakPolarHBondContact O-CB 3.49Å; A507-F511 PolarHBondContact O-N 2.86Å; L508-F511 WeakPolarHBondContact O-CB 3.47Å; L508-F511 PolarHBondContact O-N 3.35Å; F509-F511 VanDerWaalsContact C-N 3.35Å; F511-K513 VanDerWaalsContact C-N 3.27Å; F511-K513 PolarHBondContact O-N 3.49Å; F511-D514 PolarHBondContact O-N 3.05Å; F511-V515 HydrophobicContact CD1-CG2 4.22Å; F511-V515 HydrophobicContact CD2-CG2 4.22Å; F511-V515 HydrophobicContact CE1-CG2 3.72Å; F511-V515 HydrophobicContact CE2-CG2 3.73Å; F511-V515 HydrophobicContact CG-CG2 4.42Å; F511-V515 HydrophobicContact CZ-CG2 3.42Å; F511-V515 VanDerWaalsContact CZ-CG2 3.42Å; F511-V515 WeakPolarHBondContact O-CB 3.48Å; F511-V515 WeakPolarHBondContact O-CG2 3.48Å; F511-V515 PolarHBondContact O-N 3.45Å
512	V	58.3	Low	57.7	Low	8 Å²	8	54.8 Å²	54.8	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-40.2	176.6	171.7	0	0	0	0	111	L508 F509 C516 L529 L532	L508-V512 VanDerWaalsContact O-CG2 3.23Å; L508-V512 WeakPolarHBondContact O-CG2 3.43Å; L508-V512 PolarHBondContact O-N 2.91Å; F509-V512 PolarHBondContact O-N 2.97Å; V512-C516 WeakPolarHBondContact O-CB 3.37Å; V512-C516 PolarHBondContact O-N 2.71Å; V512-C516 PolarHBondContact O-SG 3.31Å; V512-L529 HydrophobicContact CG1-CD2 4.19Å; V512-L532 HydrophobicContact CB-CD1 4.12Å; V512-L532 HydrophobicContact CG1-CD1 3.6Å; V512-L532 HydrophobicContact CG2-CD1 3.38Å; V512-L532 HydrophobicContact CG2-CD2 3.42Å; V512-L532 VanDerWaalsContact CG2-CD2 3.42Å; V512-L532 HydrophobicContact CG2-CG 4.01Å
513	K	60.7	Low	58	Low	46 Å²	46	56.6 Å²	56.6	20%	0.2	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-48.1	175.4	179.7	-176.2	176.9	175.8	0	110.8	F509 Q510 F511 C516 L517	F509-K513 WeakPolarHBondContact O-CB 3.48Å; F509-K513 PolarHBondContact O-N 2.76Å; Q510-K513 WeakPolarHBondContact O-CB 3.15Å; Q510-K513 PolarHBondContact O-N 2.85Å; F511-K513 VanDerWaalsContact C-N 3.27Å; F511-K513 PolarHBondContact O-N 3.49Å; K513-C516 PolarHBondContact O-N 2.9Å; K513-L517 HydrophobicContact CG-CD1 4.13Å; K513-L517 VanDerWaalsContact O-CG 3.25Å; K513-L517 WeakPolarHBondContact O-CG 3.17Å; K513-L517 PolarHBondContact O-N 3.15Å
514	D	61.1	Low	58.2	Low	43 Å²	43	54 Å²	54	23%	0.23	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-39.8	-179.3	-64.7	-14.3	0	0	0	111.5	Q510 F511 L517 T518	Q510-D514 WeakPolarHBondContact O-CB 3.19Å; Q510-D514 PolarHBondContact O-N 3.06Å; F511-D514 PolarHBondContact O-N 3.05Å; D514-L517 PolarHBondContact O-N 3.28Å; D514-T518 WeakPolarHBondContact O-CG2 3.25Å; D514-T518 PolarHBondContact O-N 2.81Å; D514-T518 PolarHBondContact O-OG1 3.09Å
515	V	55.9	Low	58.4	Low	1 Å²	1	54.2 Å²	54.2	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-56.5	-51.1	168.9	166	0	0	0	0	110.7	L466 F474 F511 L517 T518 I519 I528	L466-V515 HydrophobicContact CD1-CB 4.46Å; L466-V515 HydrophobicContact CD1-CG2 3.31Å; L466-V515 HydrophobicContact CD2-CG2 4.12Å; L466-V515 HydrophobicContact CG-CG2 4.37Å; F474-V515 HydrophobicContact CE1-CG1 3.84Å; F474-V515 HydrophobicContact CZ-CB 4.49Å; F474-V515 HydrophobicContact CZ-CG1 3.82Å; F511-V515 HydrophobicContact CD1-CG2 4.22Å; F511-V515 HydrophobicContact CD2-CG2 4.22Å; F511-V515 HydrophobicContact CE1-CG2 3.72Å; F511-V515 HydrophobicContact CE2-CG2 3.73Å; F511-V515 HydrophobicContact CG-CG2 4.42Å; F511-V515 HydrophobicContact CZ-CG2 3.42Å; F511-V515 VanDerWaalsContact CZ-CG2 3.42Å; F511-V515 WeakPolarHBondContact O-CB 3.48Å; F511-V515 WeakPolarHBondContact O-CG2 3.48Å; F511-V515 PolarHBondContact O-N 3.45Å; V515-L517 PolarHBondContact O-N 2.97Å; V515-T518 WeakPolarHBondContact CA-OG1 3.49Å; V515-T518 PolarHBondContact O-N 3Å; V515-T518 VanDerWaalsContact O-N 3.11Å; V515-T518 PolarHBondContact O-OG1 3.22Å; V515-I519 HydrophobicContact CG1-CD1 3.66Å; V515-I519 HydrophobicContact CG1-CG1 4.32Å; V515-I519 WeakPolarHBondContact O-CD1 3.48Å; V515-I519 WeakPolarHBondContact O-CG1 3.31Å; V515-I519 PolarHBondContact O-N 3.49Å; V515-I528 HydrophobicContact CG1-CD1 4.19Å; V515-I528 HydrophobicContact CG1-CG2 4.06Å
516	C	57.7	Low	58.6	Low	18 Å²	18	55.1 Å²	55.1	12%	0.122	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-27.4	-180	-68.3	0	0	0	0	113.1	V512 K513	V512-C516 WeakPolarHBondContact O-CB 3.37Å; V512-C516 PolarHBondContact O-N 2.71Å; V512-C516 PolarHBondContact O-SG 3.31Å; K513-C516 PolarHBondContact O-N 2.9Å
517	L	61.5	Low	58.7	Low	101 Å²	101	55 Å²	55	53%	0.529	26%	0.264	S	S	.	.	H	α-helix	trans	-78.8	-23.7	175.7	-71	171	0	0	0	112.9	K513 D514 V515	K513-L517 HydrophobicContact CG-CD1 4.13Å; K513-L517 VanDerWaalsContact O-CG 3.25Å; K513-L517 WeakPolarHBondContact O-CG 3.17Å; K513-L517 PolarHBondContact O-N 3.15Å; D514-L517 PolarHBondContact O-N 3.28Å; V515-L517 PolarHBondContact O-N 2.97Å
518	T	55.5	Low	58.7	Low	41 Å²	41	54 Å²	54	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-91.2	-28.6	-179.4	40.4	0	0	0	0	112.9	D467 D514 V515 R520	D467-T518 VanDerWaalsContact OD1-CG2 3.22Å; D467-T518 WeakPolarHBondContact OD1-CG2 3.34Å; D514-T518 WeakPolarHBondContact O-CG2 3.25Å; D514-T518 PolarHBondContact O-N 2.81Å; D514-T518 PolarHBondContact O-OG1 3.09Å; V515-T518 WeakPolarHBondContact CA-OG1 3.49Å; V515-T518 PolarHBondContact O-N 3Å; V515-T518 VanDerWaalsContact O-N 3.11Å; V515-T518 PolarHBondContact O-OG1 3.22Å; T518-R520 PolarHBondContact O-N 3.1Å
519	I	58.3	Low	58.8	Low	15 Å²	15	53.5 Å²	53.5	8%	0.077	25%	0.253	C	S	.	.			trans	-65.8	127.5	178.5	-63.9	158.3	0	0	0	111.6	F474 V515 D521 E524 I525 I528	F474-I519 HydrophobicContact CD1-CD1 4.49Å; F474-I519 HydrophobicContact CD1-CG1 3.93Å; F474-I519 HydrophobicContact CE1-CD1 3.56Å; F474-I519 HydrophobicContact CE1-CG1 3.1Å; F474-I519 HydrophobicContact CE2-CG1 4.42Å; F474-I519 HydrophobicContact CZ-CD1 4.11Å; F474-I519 HydrophobicContact CZ-CG1 3.38Å; V515-I519 HydrophobicContact CG1-CD1 3.66Å; V515-I519 HydrophobicContact CG1-CG1 4.32Å; V515-I519 WeakPolarHBondContact O-CD1 3.48Å; V515-I519 WeakPolarHBondContact O-CG1 3.31Å; V515-I519 PolarHBondContact O-N 3.49Å; I519-D521 WeakPolarHBondContact CG2-O 3.3Å; I519-E524 HydrophobicContact CG2-CB 3.6Å; I519-E524 WeakPolarHBondContact CG2-OE2 3.44Å; I519-I525 HydrophobicContact CB-CD1 4.23Å; I519-I525 HydrophobicContact CB-CG1 3.63Å; I519-I525 HydrophobicContact CD1-CB 4.39Å; I519-I525 HydrophobicContact CD1-CG1 3.74Å; I519-I525 HydrophobicContact CG1-CG1 4.31Å; I519-I525 HydrophobicContact CG2-CD1 4.18Å; I519-I525 HydrophobicContact CG2-CG1 3.41Å; I519-I525 VanDerWaalsContact CG2-CG1 3.41Å; I519-I528 HydrophobicContact CD1-CD1 3.49Å; I519-I528 VanDerWaalsContact CD1-CD1 3.49Å; I519-I528 HydrophobicContact CG1-CD1 4.31Å
520	R	57.9	Low	58.9	Low	248 Å²	248	59.5 Å²	59.5	94%	0.936	28%	0.279	S	S	*	.			trans	-90.8	-24.5	178.5	-61.4	-177.1	-176.8	-179	3.2	113.3	T518	T518-R520 PolarHBondContact O-N 3.1Å
521	D	61.7	Low	58.7	Low	68 Å²	68	59.6 Å²	59.6	36%	0.364	28%	0.279	S	S	.	.			trans	-102.8	126.6	179.6	-171.1	-6.6	0	0	0	112.2	I519 N523 E524 I525	I519-D521 WeakPolarHBondContact CG2-O 3.3Å; D521-N523 PolarHBondContact O-N 3.3Å; D521-N523 PolarHBondContact OD1-N 2.93Å; D521-E524 HydrophobicContact CB-CB 4.37Å; D521-E524 HydrophobicContact CB-CG 4.03Å; D521-E524 PolarHBondContact O-N 3.26Å; D521-I525 PolarHBondContact O-N 3.42Å
522	R	57.4	Low	58.5	Low	140 Å²	140	59 Å²	59	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-54.9	-34.7	174.6	179.6	-179.1	169.3	-176.2	-0	112.9	I525 I526	R522-I525 PolarHBondContact O-N 3.36Å; R522-I526 HydrophobicContact CG-CD1 4.1Å; R522-I526 WeakPolarHBondContact O-CG1 3.49Å; R522-I526 PolarHBondContact O-N 2.88Å; R522-I526 VanDerWaalsContact O-N 3.15Å
523	N	59.6	Low	58.4	Low	105 Å²	105	60.2 Å²	60.2	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-69.8	-40.4	-178.6	-67.3	-39.1	0	0	0	111.7	D521 I525 I526 V527	D521-N523 PolarHBondContact O-N 3.3Å; D521-N523 PolarHBondContact OD1-N 2.93Å; N523-I525 VanDerWaalsContact C-N 3.34Å; N523-I525 PolarHBondContact O-N 2.92Å; N523-I526 PolarHBondContact O-N 2.94Å; N523-V527 WeakPolarHBondContact O-CG2 3.45Å; N523-V527 PolarHBondContact O-N 3.07Å
524	E	58.8	Low	58.2	Low	40 Å²	40	60.6 Å²	60.6	19%	0.187	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-43.2	175.1	-68.4	172.1	177.8	0	0	110.6	I519 D521 I526 V527 I528	I519-E524 HydrophobicContact CG2-CB 3.6Å; I519-E524 WeakPolarHBondContact CG2-OE2 3.44Å; D521-E524 HydrophobicContact CB-CB 4.37Å; D521-E524 HydrophobicContact CB-CG 4.03Å; D521-E524 PolarHBondContact O-N 3.26Å; E524-I526 VanDerWaalsContact C-N 3.35Å; E524-I526 PolarHBondContact O-N 3.14Å; E524-V527 PolarHBondContact O-N 2.98Å; E524-I528 WeakPolarHBondContact O-CB 3.36Å; E524-I528 WeakPolarHBondContact O-CD1 3.25Å; E524-I528 WeakPolarHBondContact O-CG1 3.49Å; E524-I528 PolarHBondContact O-N 3.34Å
525	I	57	Low	57.7	Low	34 Å²	34	59 Å²	59	17%	0.174	29%	0.289	C	S	.	.	H	α-helix	trans	-57.4	-48	174.3	-61.1	176.7	0	0	0	110.7	I519 D521 R522 N523 V527 I528 L529	I519-I525 HydrophobicContact CB-CD1 4.23Å; I519-I525 HydrophobicContact CB-CG1 3.63Å; I519-I525 HydrophobicContact CD1-CB 4.39Å; I519-I525 HydrophobicContact CD1-CG1 3.74Å; I519-I525 HydrophobicContact CG1-CG1 4.31Å; I519-I525 HydrophobicContact CG2-CD1 4.18Å; I519-I525 HydrophobicContact CG2-CG1 3.41Å; I519-I525 VanDerWaalsContact CG2-CG1 3.41Å; D521-I525 PolarHBondContact O-N 3.42Å; R522-I525 PolarHBondContact O-N 3.36Å; N523-I525 VanDerWaalsContact C-N 3.34Å; N523-I525 PolarHBondContact O-N 2.92Å; I525-V527 VanDerWaalsContact C-N 3.34Å; I525-V527 PolarHBondContact O-N 3.4Å; I525-I528 PolarHBondContact O-N 3.31Å; I525-L529 HydrophobicContact CG2-CD1 3.61Å; I525-L529 HydrophobicContact CG2-CG 4.05Å; I525-L529 VanDerWaalsContact O-CB 3.31Å; I525-L529 WeakPolarHBondContact O-CB 3.08Å; I525-L529 WeakPolarHBondContact O-CG 3.42Å; I525-L529 PolarHBondContact O-N 2.91Å
526	I	57.1	Low	57.5	Low	50 Å²	50	59.3 Å²	59.3	26%	0.256	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-40.6	-177	-69.8	167.4	0	0	0	111.2	R522 N523 E524 K530 P578	R522-I526 HydrophobicContact CG-CD1 4.1Å; R522-I526 WeakPolarHBondContact O-CG1 3.49Å; R522-I526 PolarHBondContact O-N 2.88Å; R522-I526 VanDerWaalsContact O-N 3.15Å; N523-I526 PolarHBondContact O-N 2.94Å; E524-I526 VanDerWaalsContact C-N 3.35Å; E524-I526 PolarHBondContact O-N 3.14Å; I526-K530 HydrophobicContact CG2-CD 4.28Å; I526-K530 WeakPolarHBondContact O-CB 3.31Å; I526-K530 WeakPolarHBondContact O-CG 3.2Å; I526-K530 PolarHBondContact O-N 3.11Å; I526-P578 HydrophobicContact CG1-CG 4.5Å
527	V	60.4	Low	57.3	Low	49 Å²	49	61.7 Å²	61.7	30%	0.297	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-48.5	178.7	173.8	0	0	0	0	110.5	E475 N523 E524 I525 L529 K530 Q531	E475-V527 HydrophobicContact CG-CG1 4.14Å; E475-V527 WeakPolarHBondContact OE1-CG1 3.46Å; N523-V527 WeakPolarHBondContact O-CG2 3.45Å; N523-V527 PolarHBondContact O-N 3.07Å; E524-V527 PolarHBondContact O-N 2.98Å; I525-V527 VanDerWaalsContact C-N 3.34Å; I525-V527 PolarHBondContact O-N 3.4Å; V527-L529 PolarHBondContact O-N 2.81Å; V527-K530 WeakPolarHBondContact O-CB 3.5Å; V527-K530 PolarHBondContact O-N 2.77Å; V527-Q531 PolarHBondContact O-N 3.04Å
528	I	57.8	Low	56.8	Low	4 Å²	4	66.4 Å²	66.4	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-45.5	179.2	-71	165.1	0	0	0	111.1	F474 C478 V515 I519 E524 I525 K530 Q531 L532	F474-I528 HydrophobicContact CD1-CD1 3.74Å; F474-I528 HydrophobicContact CE1-CD1 3.47Å; F474-I528 VanDerWaalsContact CE1-CD1 3.47Å; C478-I528 HydrophobicContact CB-CD1 3.83Å; C478-I528 HydrophobicContact CB-CG1 3.81Å; C478-I528 HydrophobicContact CB-CG2 4.36Å; C478-I528 VanDerWaalsContact SG-CD1 3.54Å; V515-I528 HydrophobicContact CG1-CD1 4.19Å; V515-I528 HydrophobicContact CG1-CG2 4.06Å; I519-I528 HydrophobicContact CD1-CD1 3.49Å; I519-I528 VanDerWaalsContact CD1-CD1 3.49Å; I519-I528 HydrophobicContact CG1-CD1 4.31Å; E524-I528 WeakPolarHBondContact O-CB 3.36Å; E524-I528 WeakPolarHBondContact O-CD1 3.25Å; E524-I528 WeakPolarHBondContact O-CG1 3.49Å; E524-I528 PolarHBondContact O-N 3.34Å; I525-I528 PolarHBondContact O-N 3.31Å; I528-K530 VanDerWaalsContact C-N 3.32Å; I528-K530 PolarHBondContact O-N 3.06Å; I528-Q531 PolarHBondContact O-N 3.29Å; I528-L532 HydrophobicContact CG2-CD1 3.61Å; I528-L532 WeakPolarHBondContact O-CB 3.44Å; I528-L532 WeakPolarHBondContact O-CD1 3.27Å; I528-L532 WeakPolarHBondContact O-CG 3.42Å; I528-L532 PolarHBondContact O-N 3.31Å
529	L	58.5	Low	56.4	Low	6 Å²	6	66.6 Å²	66.6	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-37.3	176.9	-72	178.9	0	0	0	112.3	V512 I525 V527 T533 F576	V512-L529 HydrophobicContact CG1-CD2 4.19Å; I525-L529 HydrophobicContact CG2-CD1 3.61Å; I525-L529 HydrophobicContact CG2-CG 4.05Å; I525-L529 VanDerWaalsContact O-CB 3.31Å; I525-L529 WeakPolarHBondContact O-CB 3.08Å; I525-L529 WeakPolarHBondContact O-CG 3.42Å; I525-L529 PolarHBondContact O-N 2.91Å; V527-L529 PolarHBondContact O-N 2.81Å; L529-T533 WeakPolarHBondContact O-CB 3.14Å; L529-T533 PolarHBondContact O-N 3.47Å; L529-T533 PolarHBondContact O-OG1 3.43Å; L529-F576 HydrophobicContact CB-CB 4.19Å; L529-F576 HydrophobicContact CD1-CB 4.04Å; L529-F576 HydrophobicContact CD2-CB 3.77Å; L529-F576 HydrophobicContact CD2-CD1 3.8Å; L529-F576 HydrophobicContact CD2-CD2 4.48Å; L529-F576 HydrophobicContact CD2-CG 3.79Å; L529-F576 HydrophobicContact CG-CB 4.22Å
530	K	59.3	Low	56	Low	146 Å²	146	67.2 Å²	67.2	64%	0.635	32%	0.321	S	S	*	.	H	α-helix	trans	-64.5	-44.5	175.3	-81.2	177.8	178.1	-180	0	111.8	I526 V527 I528 T533 A534	I526-K530 HydrophobicContact CG2-CD 4.28Å; I526-K530 WeakPolarHBondContact O-CB 3.31Å; I526-K530 WeakPolarHBondContact O-CG 3.2Å; I526-K530 PolarHBondContact O-N 3.11Å; V527-K530 WeakPolarHBondContact O-CB 3.5Å; V527-K530 PolarHBondContact O-N 2.77Å; I528-K530 VanDerWaalsContact C-N 3.32Å; I528-K530 PolarHBondContact O-N 3.06Å; K530-T533 PolarHBondContact O-N 3.42Å; K530-A534 PolarHBondContact O-N 3.04Å
531	Q	58.8	Low	55.7	Low	73 Å²	73	61.6 Å²	61.6	34%	0.341	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-48.5	177.1	-147.2	100.5	-7.8	0	0	110.3	I479 I482 V527 I528 T533 A534 S535	I479-Q531 HydrophobicContact CG1-CG 4.2Å; I482-Q531 HydrophobicContact CD1-CB 3.95Å; I482-Q531 HydrophobicContact CD1-CG 4.15Å; V527-Q531 PolarHBondContact O-N 3.04Å; I528-Q531 PolarHBondContact O-N 3.29Å; Q531-T533 PolarHBondContact O-N 2.96Å; Q531-A534 WeakPolarHBondContact O-CB 3.41Å; Q531-A534 PolarHBondContact O-N 2.66Å; Q531-S535 PolarHBondContact O-N 3.21Å; Q531-S535 VanDerWaalsContact O-N 3.07Å; Q531-S535 PolarHBondContact O-OG 2.96Å
532	L	56.1	Low	55.3	Low	2 Å²	2	60.2 Å²	60.2	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-40.6	176.6	-81.3	156.7	0	0	0	113.5	I482 L508 V512 I528 A534 S535 V536	I482-L532 HydrophobicContact CD1-CD1 4.44Å; I482-L532 HydrophobicContact CD1-CD2 4Å; I482-L532 HydrophobicContact CD1-CG 3.64Å; I482-L532 HydrophobicContact CG1-CD2 3.71Å; I482-L532 HydrophobicContact CG1-CG 3.96Å; L508-L532 HydrophobicContact CD2-CD2 4.42Å; V512-L532 HydrophobicContact CB-CD1 4.12Å; V512-L532 HydrophobicContact CG1-CD1 3.6Å; V512-L532 HydrophobicContact CG2-CD1 3.38Å; V512-L532 HydrophobicContact CG2-CD2 3.42Å; V512-L532 VanDerWaalsContact CG2-CD2 3.42Å; V512-L532 HydrophobicContact CG2-CG 4.01Å; I528-L532 HydrophobicContact CG2-CD1 3.61Å; I528-L532 WeakPolarHBondContact O-CB 3.44Å; I528-L532 WeakPolarHBondContact O-CD1 3.27Å; I528-L532 WeakPolarHBondContact O-CG 3.42Å; I528-L532 PolarHBondContact O-N 3.31Å; L532-A534 VanDerWaalsContact C-N 3.27Å; L532-A534 PolarHBondContact O-N 3.25Å; L532-S535 PolarHBondContact O-N 3.26Å; L532-V536 VanDerWaalsContact O-CB 3.3Å; L532-V536 WeakPolarHBondContact O-CB 3.36Å; L532-V536 VanDerWaalsContact O-CG2 3.25Å; L532-V536 WeakPolarHBondContact O-CG2 3.49Å; L532-V536 PolarHBondContact O-N 3.45Å
533	T	55.1	Low	55.1	Low	34 Å²	34	55.5 Å²	55.5	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-58.8	-44.5	177.3	-57.1	0	0	0	0	109.8	L529 K530 Q531 S537 L574 F576	L529-T533 WeakPolarHBondContact O-CB 3.14Å; L529-T533 PolarHBondContact O-N 3.47Å; L529-T533 PolarHBondContact O-OG1 3.43Å; K530-T533 PolarHBondContact O-N 3.42Å; Q531-T533 PolarHBondContact O-N 2.96Å; T533-S537 WeakPolarHBondContact O-CB 3.49Å; T533-S537 PolarHBondContact O-N 3.47Å; T533-S537 VanDerWaalsContact O-N 3.08Å; T533-S537 PolarHBondContact O-OG 3.02Å; T533-L574 VanDerWaalsContact CG2-O 3.27Å; T533-L574 WeakPolarHBondContact CG2-O 3.33Å; T533-F576 WeakPolarHBondContact OG1-CD2 3.45Å
534	A	56.3	Low	54.9	Low	54 Å²	54	57.1 Å²	57.1	45%	0.446	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-44.4	177.6	0	0	0	0	0	111.5	K530 Q531 L532 S537	K530-A534 PolarHBondContact O-N 3.04Å; Q531-A534 WeakPolarHBondContact O-CB 3.41Å; Q531-A534 PolarHBondContact O-N 2.66Å; L532-A534 VanDerWaalsContact C-N 3.27Å; L532-A534 PolarHBondContact O-N 3.25Å; A534-S537 PolarHBondContact O-OG 3.34Å
535	S	51.9	Low	54.7	Low	11 Å²	11	57.5 Å²	57.5	8%	0.077	31%	0.311	C	S	.	.	H	α-helix	trans	-70.7	-48.9	-178.8	-65.3	0	0	0	0	114.1	I482 E486 Q531 L532 S537 R538	I482-S535 VanDerWaalsContact CG2-CB 3.47Å; I482-S535 WeakPolarHBondContact CG2-OG 3.35Å; E486-S535 WeakPolarHBondContact OE1-CA 3.28Å; E486-S535 WeakPolarHBondContact OE1-CB 3.5Å; E486-S535 PolarHBondContact OE1-OG 2.96Å; Q531-S535 PolarHBondContact O-N 3.21Å; Q531-S535 VanDerWaalsContact O-N 3.07Å; Q531-S535 PolarHBondContact O-OG 2.96Å; L532-S535 PolarHBondContact O-N 3.26Å; S535-S537 VanDerWaalsContact C-N 3.3Å; S535-S537 PolarHBondContact O-N 3.33Å; S535-R538 WeakPolarHBondContact O-CB 3.49Å; S535-R538 PolarHBondContact O-N 3Å; S535-R538 VanDerWaalsContact O-N 3.1Å
536	V	51.5	Low	54.6	Low	7 Å²	7	56 Å²	56	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-66.2	-33.7	179.5	177	0	0	0	0	111.1	L508 L532 R538 L539 V540 L574	L508-V536 HydrophobicContact CD2-CG2 3.8Å; L532-V536 VanDerWaalsContact O-CB 3.3Å; L532-V536 WeakPolarHBondContact O-CB 3.36Å; L532-V536 VanDerWaalsContact O-CG2 3.25Å; L532-V536 WeakPolarHBondContact O-CG2 3.49Å; L532-V536 PolarHBondContact O-N 3.45Å; V536-R538 PolarHBondContact O-N 3.35Å; V536-L539 PolarHBondContact O-N 3.39Å; V536-V540 HydrophobicContact CG1-CG2 3.71Å; V536-V540 WeakPolarHBondContact O-CG2 3.32Å; V536-L574 HydrophobicContact CG1-CB 4.5Å; V536-L574 HydrophobicContact CG1-CD1 4.11Å; V536-L574 HydrophobicContact CG1-CD2 4.4Å
537	S	52.7	Low	54.6	Low	67 Å²	67	54.9 Å²	54.9	47%	0.469	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-20.2	175.5	72	0	0	0	0	113.7	T533 A534 S535	T533-S537 WeakPolarHBondContact O-CB 3.49Å; T533-S537 PolarHBondContact O-N 3.47Å; T533-S537 VanDerWaalsContact O-N 3.08Å; T533-S537 PolarHBondContact O-OG 3.02Å; A534-S537 PolarHBondContact O-OG 3.34Å; S535-S537 VanDerWaalsContact C-N 3.3Å; S535-S537 PolarHBondContact O-N 3.33Å
538	R	51.5	Low	54.5	Low	200 Å²	200	57.5 Å²	57.5	76%	0.755	31%	0.307	S	S	*	.	H	α-helix	trans	-87.4	-18.8	175.3	-63.5	176.4	174.3	178.9	-2.1	113.6	S535 V536	S535-R538 WeakPolarHBondContact O-CB 3.49Å; S535-R538 PolarHBondContact O-N 3Å; S535-R538 VanDerWaalsContact O-N 3.1Å; V536-R538 PolarHBondContact O-N 3.35Å
539	L	47.6	Very low	54.6	Low	46 Å²	46	59.6 Å²	59.6	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-97.3	-19.1	-166.2	-75.6	167.6	0	0	0	115.1	E486 A489 V536	E486-L539 HydrophobicContact CG-CD1 4.44Å; A489-L539 HydrophobicContact CB-CD2 3.3Å; V536-L539 PolarHBondContact O-N 3.39Å
540	V	50.1	Low	54.3	Low	27 Å²	27	59.5 Å²	59.5	16%	0.164	32%	0.316	C	S	.	.			trans	-119.2	104.8	-157.7	-155.8	0	0	0	0	114.1	L505 V536 I542	L505-V540 HydrophobicContact CD1-CG1 4.27Å; L505-V540 HydrophobicContact CD1-CG2 4.44Å; L505-V540 HydrophobicContact CD2-CG2 3.85Å; V536-V540 HydrophobicContact CG1-CG2 3.71Å; V536-V540 WeakPolarHBondContact O-CG2 3.32Å; V540-I542 HydrophobicContact CB-CG1 4.03Å; V540-I542 HydrophobicContact CG1-CB 3.95Å; V540-I542 HydrophobicContact CG1-CG1 3.54Å; V540-I542 HydrophobicContact CG1-CG2 4.29Å; V540-I542 PolarHBondContact O-N 2.7Å
541	V	51.4	Low	54.2	Low	130 Å²	130	57.8 Å²	57.8	79%	0.788	31%	0.309	S	S	*	.			trans	-74.8	105.7	139.2	177	0	0	0	0	105.9	S543	V541-S543 PolarHBondContact O-N 3.08Å
542	I	52.6	Low	54.3	Low	39 Å²	39	62.2 Å²	62.2	20%	0.2	32%	0.323	C	S	.	.			trans	-74.7	113.4	-167.1	-43.3	-167.5	0	0	0	109.9	V540 F546 V547 L564 A572 L574	V540-I542 HydrophobicContact CB-CG1 4.03Å; V540-I542 HydrophobicContact CG1-CB 3.95Å; V540-I542 HydrophobicContact CG1-CG1 3.54Å; V540-I542 HydrophobicContact CG1-CG2 4.29Å; V540-I542 PolarHBondContact O-N 2.7Å; I542-F546 HydrophobicContact CG2-CB 4.42Å; I542-F546 HydrophobicContact CG2-CD1 3.76Å; I542-V547 HydrophobicContact CG2-CG2 3.62Å; I542-L564 HydrophobicContact CD1-CD2 3.24Å; I542-A572 HydrophobicContact CD1-CB 3.36Å; I542-A572 HydrophobicContact CG1-CB 4.04Å; I542-L574 HydrophobicContact CD1-CD1 4.1Å
543	S	53.9	Low	54.3	Low	42 Å²	42	63.1 Å²	63.1	29%	0.294	33%	0.329	S	S	.	.			trans	-69.5	147	171.8	70.3	0	0	0	0	110.7	V541 S545 F546 V547	V541-S543 PolarHBondContact O-N 3.08Å; S543-S545 WeakPolarHBondContact CB-OG 3.22Å; S543-S545 PolarHBondContact O-N 3.25Å; S543-S545 PolarHBondContact OG-OG 3.48Å; S543-F546 PolarHBondContact O-N 3.19Å; S543-F546 VanDerWaalsContact O-N 3.12Å; S543-F546 PolarHBondContact OG-N 3.25Å; S543-F546 VanDerWaalsContact OG-N 3.16Å; S543-V547 PolarHBondContact O-N 3.12Å; S543-V547 VanDerWaalsContact O-N 3.15Å
544	D	55	Low	54.2	Low	139 Å²	139	64.4 Å²	64.4	74%	0.743	33%	0.334	S	S	*	.	H	α-helix	trans	-58	-30.8	174	-79.5	-30	0	0	0	112	V547 Q548	D544-V547 PolarHBondContact O-N 2.87Å; D544-Q548 VanDerWaalsContact O-CG 3.28Å; D544-Q548 WeakPolarHBondContact O-CG 3.09Å; D544-Q548 PolarHBondContact O-N 3.39Å
545	S	54.8	Low	54.1	Low	47 Å²	47	69.2 Å²	69.2	33%	0.329	35%	0.351	S	S	.	.	H	α-helix	trans	-65	-42.2	176.2	49.2	0	0	0	0	112.4	E502 S543 Q548 F549	E502-S545 WeakPolarHBondContact OE1-CB 3.41Å; E502-S545 PolarHBondContact OE1-OG 3.22Å; E502-S545 PolarHBondContact OE2-OG 3.21Å; S543-S545 WeakPolarHBondContact CB-OG 3.22Å; S543-S545 PolarHBondContact O-N 3.25Å; S543-S545 PolarHBondContact OG-OG 3.48Å; S545-Q548 PolarHBondContact O-N 3.48Å; S545-F549 PolarHBondContact O-N 3.5Å
546	F	55.1	Low	54.3	Low	2 Å²	2	75.5 Å²	75.5	1%	0.009	38%	0.38	C	S	.	.	H	α-helix	trans	-64	-42.3	172.9	-177.1	-94.6	0	0	0	111.4	L505 F509 I542 S543 Q548 F549 S550 L574	L505-F546 HydrophobicContact CB-CD2 4.4Å; L505-F546 HydrophobicContact CB-CE2 4.42Å; F509-F546 AromaticContact CD2-CE2 3.68Å; F509-F546 HydrophobicContact CD2-CE2 3.68Å; F509-F546 AromaticContact CD2-CZ 3.48Å; F509-F546 HydrophobicContact CD2-CZ 3.48Å; F509-F546 VanDerWaalsContact CD2-CZ 3.48Å; F509-F546 HydrophobicContact CE2-CE2 4.22Å; F509-F546 AromaticContact CE2-CZ 3.56Å; F509-F546 HydrophobicContact CE2-CZ 3.56Å; F509-F546 HydrophobicContact CG-CE2 4.27Å; F509-F546 HydrophobicContact CG-CZ 4.41Å; I542-F546 HydrophobicContact CG2-CB 4.42Å; I542-F546 HydrophobicContact CG2-CD1 3.76Å; S543-F546 PolarHBondContact O-N 3.19Å; S543-F546 VanDerWaalsContact O-N 3.12Å; S543-F546 PolarHBondContact OG-N 3.25Å; S543-F546 VanDerWaalsContact OG-N 3.16Å; F546-Q548 VanDerWaalsContact C-N 3.28Å; F546-Q548 PolarHBondContact O-N 2.97Å; F546-F549 PolarHBondContact O-N 2.67Å; F546-F549 VanDerWaalsContact O-N 3.16Å; F546-S550 WeakPolarHBondContact CE1-OG 3.37Å; F546-S550 PolarHBondContact O-N 3.12Å; F546-S550 PolarHBondContact O-OG 2.97Å; F546-S550 VanDerWaalsContact O-OG 3.08Å; F546-L574 HydrophobicContact CE1-CD1 4.12Å
547	V	55.3	Low	54	Low	28 Å²	28	79.4 Å²	79.4	17%	0.17	40%	0.397	C	S	.	.	H	α-helix	trans	-58.6	-42.1	175.2	177.6	0	0	0	0	111.1	I542 S543 D544 K551 L564	I542-V547 HydrophobicContact CG2-CG2 3.62Å; S543-V547 PolarHBondContact O-N 3.12Å; S543-V547 VanDerWaalsContact O-N 3.15Å; D544-V547 PolarHBondContact O-N 2.87Å; V547-K551 HydrophobicContact CG1-CD 4.12Å; V547-K551 WeakPolarHBondContact O-CB 3.33Å; V547-K551 VanDerWaalsContact O-CG 3.25Å; V547-K551 WeakPolarHBondContact O-CG 3.06Å; V547-K551 PolarHBondContact O-N 3.2Å; V547-L564 HydrophobicContact CG2-CD1 4.18Å
548	Q	59.3	Low	53.8	Low	103 Å²	103	81.9 Å²	81.9	48%	0.481	41%	0.405	S	S	.	.	H	α-helix	trans	-68.2	-39.3	176.7	-68.3	-66.3	-14.1	0	0	112.2	D544 S545 F546 K551 R552	D544-Q548 VanDerWaalsContact O-CG 3.28Å; D544-Q548 WeakPolarHBondContact O-CG 3.09Å; D544-Q548 PolarHBondContact O-N 3.39Å; S545-Q548 PolarHBondContact O-N 3.48Å; F546-Q548 VanDerWaalsContact C-N 3.28Å; F546-Q548 PolarHBondContact O-N 2.97Å; Q548-K551 PolarHBondContact O-N 3.28Å; Q548-R552 WeakPolarHBondContact O-CG 3.21Å; Q548-R552 PolarHBondContact O-N 3.01Å
549	F	58.8	Low	53.5	Low	49 Å²	49	75.7 Å²	75.7	22%	0.215	39%	0.392	C	S	.	.	H	α-helix	trans	-63	-46.5	174.4	175.1	-97.1	0	0	0	111.9	I506 F509 S545 F546 R552 S553	I506-F549 HydrophobicContact CG1-CD1 4.49Å; I506-F549 HydrophobicContact CG2-CE1 4.48Å; I506-F549 HydrophobicContact CG2-CE2 4.17Å; I506-F549 HydrophobicContact CG2-CZ 4.05Å; F509-F549 HydrophobicContact CB-CE1 4.07Å; F509-F549 AromaticContact CD1-CE1 3.86Å; F509-F549 HydrophobicContact CD1-CE1 3.86Å; F509-F549 HydrophobicContact CG-CE1 4.13Å; S545-F549 PolarHBondContact O-N 3.5Å; F546-F549 PolarHBondContact O-N 2.67Å; F546-F549 VanDerWaalsContact O-N 3.16Å; F549-R552 PolarHBondContact O-N 3.08Å; F549-S553 WeakPolarHBondContact O-CB 3.47Å; F549-S553 PolarHBondContact O-N 2.69Å; F549-S553 PolarHBondContact O-OG 2.75Å; F549-S553 VanDerWaalsContact O-OG 3.09Å
550	S	53	Low	53.6	Low	4 Å²	4	75.4 Å²	75.4	3%	0.028	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-42.5	175.9	-54.9	0	0	0	0	111.3	F546 R552 S553 L554	F546-S550 WeakPolarHBondContact CE1-OG 3.37Å; F546-S550 PolarHBondContact O-N 3.12Å; F546-S550 PolarHBondContact O-OG 2.97Å; F546-S550 VanDerWaalsContact O-OG 3.08Å; S550-R552 PolarHBondContact O-N 3.08Å; S550-S553 PolarHBondContact O-N 3.07Å; S550-L554 VanDerWaalsContact O-CB 3.25Å; S550-L554 WeakPolarHBondContact O-CB 3.42Å; S550-L554 WeakPolarHBondContact O-CD1 3.35Å; S550-L554 WeakPolarHBondContact O-CG 3.27Å; S550-L554 PolarHBondContact O-N 3.1Å
551	K	57.6	Low	53.4	Low	109 Å²	109	75.1 Å²	75.1	47%	0.474	40%	0.395	S	S	.	.	H	α-helix	trans	-60.4	-43.7	175.1	-79.1	175.2	-179.4	175.5	0	112.1	V547 Q548 L555	V547-K551 HydrophobicContact CG1-CD 4.12Å; V547-K551 WeakPolarHBondContact O-CB 3.33Å; V547-K551 VanDerWaalsContact O-CG 3.25Å; V547-K551 WeakPolarHBondContact O-CG 3.06Å; V547-K551 PolarHBondContact O-N 3.2Å; Q548-K551 PolarHBondContact O-N 3.28Å; K551-L555 WeakPolarHBondContact O-CB 3.1Å; K551-L555 WeakPolarHBondContact O-CD1 3.31Å; K551-L555 VanDerWaalsContact O-CG 3.3Å; K551-L555 WeakPolarHBondContact O-CG 3.44Å; K551-L555 PolarHBondContact O-N 2.77Å
552	R	60.6	Low	53.2	Low	167 Å²	167	69.9 Å²	69.9	63%	0.63	36%	0.362	S	S	*	.	H	α-helix	trans	-64.9	-47.6	175.6	-75.9	-177.1	-171.5	173.7	3.6	111.6	Q548 F549 S550 L554 L555 E556	Q548-R552 WeakPolarHBondContact O-CG 3.21Å; Q548-R552 PolarHBondContact O-N 3.01Å; F549-R552 PolarHBondContact O-N 3.08Å; S550-R552 PolarHBondContact O-N 3.08Å; R552-L554 VanDerWaalsContact C-N 3.27Å; R552-L554 PolarHBondContact O-N 2.78Å; R552-L555 PolarHBondContact O-N 2.99Å; R552-L555 VanDerWaalsContact O-N 3.11Å; R552-E556 WeakPolarHBondContact O-CB 3.31Å; R552-E556 WeakPolarHBondContact O-CG 3.34Å; R552-E556 PolarHBondContact O-N 3.38Å
553	S	55.6	Low	52.8	Low	20 Å²	20	71.2 Å²	71.2	14%	0.14	37%	0.372	C	S	.	.	H	α-helix	trans	-61.2	-35.9	178.2	-66.3	0	0	0	0	112.6	F549 S550 E556 Q557	F549-S553 WeakPolarHBondContact O-CB 3.47Å; F549-S553 PolarHBondContact O-N 2.69Å; F549-S553 PolarHBondContact O-OG 2.75Å; F549-S553 VanDerWaalsContact O-OG 3.09Å; S550-S553 PolarHBondContact O-N 3.07Å; S553-E556 PolarHBondContact O-N 2.62Å; S553-Q557 PolarHBondContact O-N 2.85Å
554	L	53.1	Low	52.2	Low	62 Å²	62	72 Å²	72	33%	0.325	37%	0.373	S	S	.	.	H	α-helix	trans	-71	-33.9	175	-79.2	165	0	0	0	113.5	S550 R552 E556 V560 I562	S550-L554 VanDerWaalsContact O-CB 3.25Å; S550-L554 WeakPolarHBondContact O-CB 3.42Å; S550-L554 WeakPolarHBondContact O-CD1 3.35Å; S550-L554 WeakPolarHBondContact O-CG 3.27Å; S550-L554 PolarHBondContact O-N 3.1Å; R552-L554 VanDerWaalsContact C-N 3.27Å; R552-L554 PolarHBondContact O-N 2.78Å; L554-E556 VanDerWaalsContact C-N 3.3Å; L554-V560 VanDerWaalsContact CD2-O 3.22Å; L554-V560 WeakPolarHBondContact CD2-O 2.87Å; L554-I562 HydrophobicContact CD1-CB 4.23Å; L554-I562 HydrophobicContact CD1-CD1 4.39Å; L554-I562 HydrophobicContact CD2-CD1 4.12Å; L554-I562 HydrophobicContact CG-CD1 4.11Å
555	L	55.1	Low	51.5	Low	154 Å²	154	69.7 Å²	69.7	81%	0.806	36%	0.359	S	S	*	.	H	α-helix	trans	-73.8	-26.2	175.8	-78.1	163.3	0	0	0	111.8	K551 R552	K551-L555 WeakPolarHBondContact O-CB 3.1Å; K551-L555 WeakPolarHBondContact O-CD1 3.31Å; K551-L555 VanDerWaalsContact O-CG 3.3Å; K551-L555 WeakPolarHBondContact O-CG 3.44Å; K551-L555 PolarHBondContact O-N 2.77Å; R552-L555 PolarHBondContact O-N 2.99Å; R552-L555 VanDerWaalsContact O-N 3.11Å
556	E	55.6	Low	50.6	Low	144 Å²	144	71.9 Å²	71.9	67%	0.673	38%	0.375	S	S	*	.	H	α-helix	trans	-89.2	-19	-174.8	-74.7	176.2	-176.3	0	0	114.4	R552 S553 L554	R552-E556 WeakPolarHBondContact O-CB 3.31Å; R552-E556 WeakPolarHBondContact O-CG 3.34Å; R552-E556 PolarHBondContact O-N 3.38Å; S553-E556 PolarHBondContact O-N 2.62Å; L554-E556 VanDerWaalsContact C-N 3.3Å
557	Q	46.2	Very low	49.6	Very low	88 Å²	88	73.7 Å²	73.7	41%	0.411	39%	0.394	S	S	.	.			trans	-144.6	135.6	-173.6	-65.2	-164.8	-11.6	0	0	116.4	S553 C559	S553-Q557 PolarHBondContact O-N 2.85Å; Q557-C559 VanDerWaalsContact C-N 3.27Å; Q557-C559 PolarHBondContact O-N 3.36Å; Q557-C559 VanDerWaalsContact O-N 3.14Å
558	D	47.9	Very low	48.5	Very low	119 Å²	119	82.6 Å²	82.6	64%	0.636	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	11.3	-175.2	-93.2	-32.7	0	0	0	116.2	L581	D558-L581 HydrophobicContact CB-CD1 4.36Å
559	C	44.9	Very low	47.4	Very low	71 Å²	71	87.2 Å²	87.2	48%	0.48	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-22.9	-159	-64.5	0	0	0	0	118.6	Q557	Q557-C559 VanDerWaalsContact C-N 3.27Å; Q557-C559 PolarHBondContact O-N 3.36Å; Q557-C559 VanDerWaalsContact O-N 3.14Å
560	V	50.3	Low	46.2	Very low	40 Å²	40	89 Å²	89	24%	0.242	48%	0.484	C	S	.	.			trans	-149.6	118.7	175.4	-177	0	0	0	0	109.6	L554 F576	L554-V560 VanDerWaalsContact CD2-O 3.22Å; L554-V560 WeakPolarHBondContact CD2-O 2.87Å; V560-F576 HydrophobicContact CG1-CD1 4.25Å
561	G	46.1	Very low	45.4	Very low	21 Å²	21	91 Å²	91	22%	0.216	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.5	174.4	0	0	0	0	0	110.6	F577	G561-F577 PolarHBondContact N-O 3.4Å; G561-F577 WeakPolarHBondContact O-CB 3.39Å; G561-F577 PolarHBondContact O-N 3.43Å
562	I	47.2	Very low	44.7	Very low	19 Å²	19	87.5 Å²	87.5	10%	0.097	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.3	170.8	-56.6	125	0	0	0	106.9	F509 L554 L574 Y575 F576	F509-I562 HydrophobicContact CE1-CD1 3.53Å; F509-I562 HydrophobicContact CE1-CG1 4.49Å; F509-I562 HydrophobicContact CE2-CD1 4.49Å; F509-I562 HydrophobicContact CZ-CD1 3.24Å; F509-I562 HydrophobicContact CZ-CG1 3.79Å; L554-I562 HydrophobicContact CD1-CB 4.23Å; L554-I562 HydrophobicContact CD1-CD1 4.39Å; L554-I562 HydrophobicContact CD2-CD1 4.12Å; L554-I562 HydrophobicContact CG-CD1 4.11Å; I562-L574 HydrophobicContact CG2-CD2 3.61Å; I562-L574 HydrophobicContact CG2-CG 4.14Å; I562-Y575 WeakPolarHBondContact CA-O 3.35Å; I562-F576 HydrophobicContact CG1-CD1 3.96Å; I562-F576 HydrophobicContact CG1-CE1 4.07Å
563	V	44	Very low	44	Very low	68 Å²	68	84.8 Å²	84.8	41%	0.412	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	114	171.3	-177	0	0	0	0	107.5	I565 Y575 F577	V563-I565 HydrophobicContact CG1-CG1 3.92Å; V563-Y575 PolarHBondContact N-O 3.25Å; V563-Y575 PolarHBondContact O-N 3.07Å; V563-F577 HydrophobicContact CB-CD2 4.11Å; V563-F577 HydrophobicContact CB-CE2 3.81Å; V563-F577 HydrophobicContact CG2-CD2 3.67Å; V563-F577 HydrophobicContact CG2-CE2 3.71Å
564	L	40.2	Very low	43.4	Very low	59 Å²	59	84 Å²	84	31%	0.309	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	113.7	165.6	-81.5	162.3	0	0	0	108.3	I542 V547 L574	I542-L564 HydrophobicContact CD1-CD2 3.24Å; V547-L564 HydrophobicContact CG2-CD1 4.18Å; L564-L574 HydrophobicContact CD2-CD1 3.67Å; L564-L574 HydrophobicContact CD2-CG 3.9Å
565	I	40.1	Very low	42.9	Very low	89 Å²	89	85 Å²	85	46%	0.456	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	105.2	167.8	-54.6	-175.5	0	0	0	106.8	V563 G567 Q573 Y575	V563-I565 HydrophobicContact CG1-CG1 3.92Å; I565-G567 PolarHBondContact O-N 3.17Å; I565-Q573 PolarHBondContact N-O 3.41Å; I565-Q573 VanDerWaalsContact N-O 3.08Å; I565-Q573 PolarHBondContact O-N 3.2Å; I565-Y575 HydrophobicContact CB-CE2 4.31Å; I565-Y575 HydrophobicContact CD1-CD2 3.87Å; I565-Y575 HydrophobicContact CD1-CE2 3.68Å; I565-Y575 HydrophobicContact CG1-CD2 3.99Å; I565-Y575 HydrophobicContact CG1-CE2 4.08Å
566	S	36.5	Very low	42.5	Very low	94 Å²	94	78.8 Å²	78.8	66%	0.657	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	108.1	168.5	64.2	0	0	0	0	108.5	F568	S566-F568 PolarHBondContact O-N 2.59Å
567	G	34.1	Very low	41.9	Very low	40 Å²	40	76 Å²	76	41%	0.412	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	127.6	167.7	0	0	0	0	0	109.5	I565 Q569 G571	I565-G567 PolarHBondContact O-N 3.17Å; G567-Q569 PolarHBondContact O-N 2.97Å; G567-G571 WeakPolarHBondContact CA-O 3.47Å; G567-G571 PolarHBondContact N-O 3.28Å
568	F	31.5	Very low	41.8	Very low	214 Å²	214	74.1 Å²	74.1	94%	0.939	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	59.5	169.7	-115.1	-88.1	0	0	0	109.9	S566	S566-F568 PolarHBondContact O-N 2.59Å
569	Q	36.2	Very low	41.6	Very low	200 Å²	200	76 Å²	76	94%	0.935	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-174	34.3	169.9	-109.2	172.8	18.5	0	0	113	G567	G567-Q569 PolarHBondContact O-N 2.97Å
570	G	34	Very low	41.3	Very low	86 Å²	86	77.1 Å²	77.1	89%	0.887	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	21.9	166	0	0	0	0	0	116.5
571	G	37.3	Very low	40.7	Very low	46 Å²	46	81.2 Å²	81.2	47%	0.474	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	124.3	170.6	0	0	0	0	0	111	G567	G567-G571 WeakPolarHBondContact CA-O 3.47Å; G567-G571 PolarHBondContact N-O 3.28Å
572	A	43.1	Very low	40	Very low	37 Å²	37	86 Å²	86	31%	0.306	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.3	167.7	0	0	0	0	0	108.4	I542	I542-A572 HydrophobicContact CD1-CB 3.36Å; I542-A572 HydrophobicContact CG1-CB 4.04Å
573	Q	44.7	Very low	39.2	Very low	109 Å²	109	97 Å²	97	51%	0.509	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.9	173.6	-71.9	-177.7	-6.2	0	0	108.8	I565 Y575	I565-Q573 PolarHBondContact N-O 3.41Å; I565-Q573 VanDerWaalsContact N-O 3.08Å; I565-Q573 PolarHBondContact O-N 3.2Å; Q573-Y575 HydrophobicContact CB-CD2 4.28Å; Q573-Y575 HydrophobicContact CB-CE2 3.69Å; Q573-Y575 PolarHBondContact OE1-OH 3.17Å
574	L	43.6	Very low	38.5	Very low	4 Å²	4	97 Å²	97	2%	0.021	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.8	171.5	-119.5	113.6	0	0	0	108	F509 T533 V536 I542 F546 I562 L564 F576	F509-L574 HydrophobicContact CE2-CD2 4.27Å; T533-L574 VanDerWaalsContact CG2-O 3.27Å; T533-L574 WeakPolarHBondContact CG2-O 3.33Å; V536-L574 HydrophobicContact CG1-CB 4.5Å; V536-L574 HydrophobicContact CG1-CD1 4.11Å; V536-L574 HydrophobicContact CG1-CD2 4.4Å; I542-L574 HydrophobicContact CD1-CD1 4.1Å; F546-L574 HydrophobicContact CE1-CD1 4.12Å; I562-L574 HydrophobicContact CG2-CD2 3.61Å; I562-L574 HydrophobicContact CG2-CG 4.14Å; L564-L574 HydrophobicContact CD2-CD1 3.67Å; L564-L574 HydrophobicContact CD2-CG 3.9Å; L574-F576 HydrophobicContact CD2-CE1 4.42Å; L574-F576 HydrophobicContact CD2-CE2 3.88Å; L574-F576 HydrophobicContact CD2-CZ 3.74Å
575	Y	43.4	Very low	37.9	Very low	83 Å²	83	102.3 Å²	102.3	33%	0.325	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.2	128.6	170.5	-69.9	-87.3	0	0	0	110.3	I562 V563 I565 Q573 F577	I562-Y575 WeakPolarHBondContact CA-O 3.35Å; V563-Y575 PolarHBondContact N-O 3.25Å; V563-Y575 PolarHBondContact O-N 3.07Å; I565-Y575 HydrophobicContact CB-CE2 4.31Å; I565-Y575 HydrophobicContact CD1-CD2 3.87Å; I565-Y575 HydrophobicContact CD1-CE2 3.68Å; I565-Y575 HydrophobicContact CG1-CD2 3.99Å; I565-Y575 HydrophobicContact CG1-CE2 4.08Å; Q573-Y575 HydrophobicContact CB-CD2 4.28Å; Q573-Y575 HydrophobicContact CB-CE2 3.69Å; Q573-Y575 PolarHBondContact OE1-OH 3.17Å; Y575-F577 VanDerWaalsContact CB-CE2 3.43Å; Y575-F577 HydrophobicContact CG-CE2 4.29Å
576	F	45.5	Very low	37.5	Very low	24 Å²	24	102.4 Å²	102.4	11%	0.105	57%	0.574	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.2	120.2	171.2	-64.5	-92.8	0	0	0	109.9	F509 L529 T533 V560 I562 L574	F509-F576 HydrophobicContact CE2-CE1 4.03Å; F509-F576 HydrophobicContact CE2-CZ 4.08Å; F509-F576 AromaticContact CZ-CE1 3.94Å; F509-F576 HydrophobicContact CZ-CE1 3.94Å; F509-F576 HydrophobicContact CZ-CZ 4.45Å; L529-F576 HydrophobicContact CB-CB 4.19Å; L529-F576 HydrophobicContact CD1-CB 4.04Å; L529-F576 HydrophobicContact CD2-CB 3.77Å; L529-F576 HydrophobicContact CD2-CD1 3.8Å; L529-F576 HydrophobicContact CD2-CD2 4.48Å; L529-F576 HydrophobicContact CD2-CG 3.79Å; L529-F576 HydrophobicContact CG-CB 4.22Å; T533-F576 WeakPolarHBondContact OG1-CD2 3.45Å; V560-F576 HydrophobicContact CG1-CD1 4.25Å; I562-F576 HydrophobicContact CG1-CD1 3.96Å; I562-F576 HydrophobicContact CG1-CE1 4.07Å; L574-F576 HydrophobicContact CD2-CE1 4.42Å; L574-F576 HydrophobicContact CD2-CE2 3.88Å; L574-F576 HydrophobicContact CD2-CZ 3.74Å
577	F	44.1	Very low	37.1	Very low	86 Å²	86	104.4 Å²	104.4	38%	0.377	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.8	117.7	175.1	-67.8	-84.5	0	0	0	109.9	G561 V563 Y575 K579 I590	G561-F577 PolarHBondContact N-O 3.4Å; G561-F577 WeakPolarHBondContact O-CB 3.39Å; G561-F577 PolarHBondContact O-N 3.43Å; V563-F577 HydrophobicContact CB-CD2 4.11Å; V563-F577 HydrophobicContact CB-CE2 3.81Å; V563-F577 HydrophobicContact CG2-CD2 3.67Å; V563-F577 HydrophobicContact CG2-CE2 3.71Å; Y575-F577 VanDerWaalsContact CB-CE2 3.43Å; Y575-F577 HydrophobicContact CG-CE2 4.29Å; F577-K579 PolarHBondContact O-N 2.88Å; F577-K579 VanDerWaalsContact O-N 3.11Å; F577-I590 HydrophobicContact CE1-CD1 4.47Å
578	P	42.4	Very low	37	Very low	48 Å²	48	111.5 Å²	111.5	31%	0.312	60%	0.602	S	S	.	*			trans	-66.7	112.3	166.7	25.4	-29.5	0	0	0	108.4	I526 I580	I526-P578 HydrophobicContact CG1-CG 4.5Å; P578-I580 PolarHBondContact O-N 2.92Å
579	K	44.9	Very low	36.8	Very low	159 Å²	159	109.1 Å²	109.1	69%	0.691	59%	0.594	S	S	*	*			trans	-85.5	97.1	173.3	-158.9	-178	-175.6	-174.8	0	107.6	F577 L581	F577-K579 PolarHBondContact O-N 2.88Å; F577-K579 VanDerWaalsContact O-N 3.11Å; K579-L581 PolarHBondContact O-N 3.45Å
580	I	39.3	Very low	36.5	Very low	94 Å²	94	105.9 Å²	105.9	48%	0.482	58%	0.581	S	S	.	*			trans	-78.9	115.5	-179	-60.9	166	0	0	0	107.9	P578 D582	P578-I580 PolarHBondContact O-N 2.92Å; I580-D582 PolarHBondContact O-N 3.27Å; I580-D582 VanDerWaalsContact O-N 3.08Å
581	L	36.1	Very low	36	Very low	126 Å²	126	110.3 Å²	110.3	66%	0.66	58%	0.576	S	S	*	*			trans	-60.8	106	169.6	-86	153.3	0	0	0	110.1	D558 K579	D558-L581 HydrophobicContact CB-CD1 4.36Å; K579-L581 PolarHBondContact O-N 3.45Å
582	D	31.8	Very low	35.6	Very low	120 Å²	120	112.9 Å²	112.9	64%	0.642	59%	0.585	S	S	*	*			trans	23.7	115.2	153.5	-87.5	-22.5	0	0	0	118.5	I580 K605	I580-D582 PolarHBondContact O-N 3.27Å; I580-D582 VanDerWaalsContact O-N 3.08Å; D582-K605 IonicContact OD2-NZ 3.82Å
583	R	30.6	Very low	35	Very low	251 Å²	251	119.3 Å²	119.3	95%	0.947	61%	0.613	S	S	*	*				-177.6	103.5	113.1	-96.2	174.5	-163.1	-158.8	6.7	110.7
584	G	28.8	Very low	34.2	Very low	69 Å²	69	121.9 Å²	121.9	71%	0.711	63%	0.63	S	S	*	*	S	Bend	trans	91.7	118.4	159.7	0	0	0	0	0	115.7
585	D	27.3	Very low	33.6	Very low	170 Å²	170	124.8 Å²	124.8	91%	0.909	66%	0.661	S	S	*	*			trans	57.3	85.7	151.4	-56.7	-20	0	0	0	118.8
586	A	32.8	Very low	33	Very low	90 Å²	90	128.4 Å²	128.4	74%	0.744	69%	0.686	S	S	*	*				-174.4	106	129.2	0	0	0	0	0	109.8	F588	A586-F588 PolarHBondContact O-N 3.02Å; A586-F588 VanDerWaalsContact O-N 3.07Å
587	T	28.2	Very low	32.2	Very low	136 Å²	136	135.3 Å²	135.3	83%	0.834	72%	0.721	S	S	*	*			trans	-59.8	104.3	162.3	38	0	0	0	0	109.9	Q589	T587-Q589 PolarHBondContact O-N 3.44Å
588	F	31.3	Very low	31.6	Very low	190 Å²	190	137.7 Å²	137.7	83%	0.833	74%	0.743	S	S	*	*			trans	-78.2	95.3	161.3	-113.1	-91.8	0	0	0	108.2	A586 I590	A586-F588 PolarHBondContact O-N 3.02Å; A586-F588 VanDerWaalsContact O-N 3.07Å; F588-I590 PolarHBondContact O-N 3.03Å
589	Q	26.9	Very low	30.9	Very low	164 Å²	164	140.8 Å²	140.8	77%	0.766	76%	0.764	S	S	*	*			trans	-81.6	105.3	166.4	-76.7	-168.4	-2.8	0	0	109	T587 K591	T587-Q589 PolarHBondContact O-N 3.44Å; Q589-K591 PolarHBondContact O-N 3.32Å
590	I	30.4	Very low	30.2	Very low	131 Å²	131	141.1 Å²	141.1	67%	0.672	77%	0.773	S	S	*	*			trans	-73.5	107.3	159.6	-60.2	175	0	0	0	105.9	F577 F588 P592	F577-I590 HydrophobicContact CE1-CD1 4.47Å; F588-I590 PolarHBondContact O-N 3.03Å; I590-P592 VanDerWaalsContact O-CD 3.27Å; I590-P592 WeakPolarHBondContact O-CD 3.49Å
591	K	24	Very low	29.8	Very low	180 Å²	180	141.3 Å²	141.3	78%	0.783	78%	0.783	S	S	*	*			trans	-66.4	116.8	167.9	-89.7	-178.1	175.4	177.6	0	108	Q589 L593	Q589-K591 PolarHBondContact O-N 3.32Å; K591-L593 PolarHBondContact O-N 3.2Å
592	P	28.4	Very low	29.5	Very low	100 Å²	100	140.6 Å²	140.6	65%	0.649	78%	0.784	S	S	*	*			trans	-69.3	129.3	168.5	26.2	-24.6	0	0	0	108	I590 N594	I590-P592 VanDerWaalsContact O-CD 3.27Å; I590-P592 WeakPolarHBondContact O-CD 3.49Å; P592-N594 PolarHBondContact O-N 3.15Å
593	L	29.9	Very low	29.4	Very low	172 Å²	172	142.2 Å²	142.2	90%	0.901	79%	0.792	S	S	*	*	S	Bend	trans	-62.4	105.5	161.4	-96.6	111.2	0	0	0	107.3	K591	K591-L593 PolarHBondContact O-N 3.2Å
594	N	29.5	Very low	29.4	Very low	162 Å²	162	134.6 Å²	134.6	87%	0.866	78%	0.776	S	S	*	*	S	Bend	trans	57.1	103.7	168	-67.3	-17.1	0	0	0	117.8	P592	P592-N594 PolarHBondContact O-N 3.15Å
595	G	31.1	Very low	29.5	Very low	65 Å²	65	139.7 Å²	139.7	67%	0.67	78%	0.779	S	S	*	*			trans	160.8	97.7	161.4	0	0	0	0	0	112.6
596	N	29.8	Very low	29.8	Very low	160 Å²	160	140.1 Å²	140.1	86%	0.856	77%	0.773	S	S	*	*			trans	-61.2	131.3	179.3	-77	-28.4	0	0	0	112.9
597	M	29.8	Very low	29.7	Very low	169 Å²	169	145.1 Å²	145.1	83%	0.833	77%	0.772	S	S	*	*				152.6	110	118.2	-80.5	-161.8	175.7	0	0	114.3
598	T	31.5	Very low	30	Very low	136 Å²	136	145.3 Å²	145.3	83%	0.834	77%	0.768	S	S	*	*			trans	43.5	122.8	136.4	53.7	0	0	0	0	124.4
599	C	26.3	Very low	30	Very low	113 Å²	113	146 Å²	146	76%	0.764	77%	0.77	S	S	*	*			trans	-44.4	153.3	161.6	-79	0	0	0	0	117.7
600	N	30.1	Very low	30.3	Very low	165 Å²	165	141.5 Å²	141.5	88%	0.882	77%	0.768	S	S	*	*				-156.4	130	116.4	-91.4	-27.3	0	0	0	112.5
601	S	30.9	Very low	30.3	Very low	98 Å²	98	140 Å²	140	69%	0.685	78%	0.775	S	S	*	*			trans	-73.4	174.5	176.9	37.9	0	0	0	0	111.6
602	V	29.3	Very low	30.6	Very low	111 Å²	111	139.3 Å²	139.3	67%	0.673	78%	0.775	S	S	*	*				166.6	129.4	90.3	153.7	0	0	0	0	111.2
603	L	30.5	Very low	30.7	Very low	155 Å²	155	140.8 Å²	140.8	81%	0.812	78%	0.778	S	S	*	*			trans	69.6	154	144.7	-62.1	169.2	0	0	0	122.7
604	S	31.2	Very low	30.8	Very low	90 Å²	90	140 Å²	140	63%	0.629	78%	0.779	S	S	*	*			cis	173.6	140.3	-32.3	55.8	0	0	0	0	110.7
605	K	29.5	Very low	30.9	Very low	177 Å²	177	136.7 Å²	136.7	77%	0.77	77%	0.769	S	S	*	*			trans	38.1	131.6	140.6	-83.3	176.1	174.3	166.9	0	123.2	D582	D582-K605 IonicContact OD2-NZ 3.82Å
606	K	33.8	Very low	30.7	Very low	179 Å²	179	139.4 Å²	139.4	78%	0.778	77%	0.773	S	S	*	*			trans	174.3	148.4	134.8	-105.7	179.5	178.8	169.8	0	109.2
607	R	31.8	Very low	30.8	Very low	194 Å²	194	139.9 Å²	139.9	73%	0.732	77%	0.767	S	S	*	*			cis	177.1	157.2	2.4	-144.5	177.3	-175.4	-169	2.4	109.5
608	L	33.7	Very low	30.7	Very low	141 Å²	141	141.1 Å²	141.1	74%	0.738	76%	0.763	S	S	*	*			trans	65.5	160.3	155.2	-75.1	123.2	0	0	0	120.8
609	K	31.8	Very low	30.5	Very low	203 Å²	203	143.4 Å²	143.4	88%	0.883	76%	0.756	S	S	*	*			cis	158	138.1	-27.7	-146.1	-174.1	-170.4	-170.3	0	106.2
610	G	32.5	Very low	30.4	Very low	70 Å²	70	146 Å²	146	72%	0.722	76%	0.755	S	S	*	*			trans	135.7	115.5	162.5	0	0	0	0	0	115.1
611	A	31.6	Very low	30.1	Very low	100 Å²	100	144.5 Å²	144.5	83%	0.826	75%	0.751	S	S	*	*				88.2	144.7	99.5	0	0	0	0	0	111.8
612	E	30	Very low	29.8	Very low	165 Å²	165	146.6 Å²	146.6	77%	0.771	76%	0.759	S	S	*	*			cis	-175.3	154.1	-7.1	-121.5	-178.6	-170.9	0	0	105.9
613	N	30.2	Very low	29.5	Very low	132 Å²	132	146.9 Å²	146.9	71%	0.706	77%	0.767	S	S	*	*			trans	64.4	134	148.8	-61.3	-33.7	0	0	0	122.5
614	V	33.1	Very low	29.3	Very low	154 Å²	154	142.6 Å²	142.6	93%	0.933	76%	0.759	S	S	*	*				-178.2	143.9	115.8	169	0	0	0	0	110.7
615	S	29.5	Very low	29.1	Very low	93 Å²	93	147.8 Å²	147.8	65%	0.65	77%	0.773	S	S	*	*			trans	-105.5	161.7	-159.5	88.5	0	0	0	0	117.7
616	T	28.6	Very low	28.9	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	77%	0.768	S	S	*	*			trans	39.8	135.6	137.3	68	0	0	0	0	124.7
617	K	30.4	Very low	28.5	Very low	171 Å²	171	141.5 Å²	141.5	74%	0.743	77%	0.768	S	S	*	*			trans	-176.5	124.9	131.9	-104.3	171.5	-178.2	170.6	0	117.1
618	R	28.8	Very low	28.4	Very low	194 Å²	194	138.6 Å²	138.6	73%	0.732	77%	0.767	S	S	*	*			trans	65.1	152.4	134.6	-65.3	170	-178	-163.9	-0.7	122
619	R	26.5	Very low	28.3	Very low	185 Å²	185	139 Å²	139	70%	0.698	77%	0.765	S	S	*	*			cis	173.8	136.7	-23.1	-94.8	-171.5	-170.6	167.8	-3.7	105.8
620	F	25.6	Very low	27.9	Very low	167 Å²	167	137.7 Å²	137.7	73%	0.732	77%	0.766	S	S	*	*				137.1	123	116	-73.2	-70.5	0	0	0	107.3
621	V	23.6	Very low	27.7	Very low	134 Å²	134	140.2 Å²	140.2	81%	0.812	77%	0.768	S	S	*	*				67.6	120.7	61.5	-170.5	0	0	0	0	115.6
622	V	24.9	Very low	27.4	Very low	141 Å²	141	142.6 Å²	142.6	86%	0.855	77%	0.766	S	S	*	*				173.2	141.5	120.6	164.9	0	0	0	0	111.4
623	S	23	Very low	27.4	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	77%	0.769	S	S	*	*			trans	-110.7	177.2	-178.7	65.3	0	0	0	0	113.7
624	G	25.9	Very low	27.1	Very low	64 Å²	64	146.7 Å²	146.7	66%	0.66	78%	0.775	S	S	*	*			trans	137.8	109.3	156.3	0	0	0	0	0	113.8
625	H	26.4	Very low	26.9	Very low	200 Å²	200	150.4 Å²	150.4	93%	0.926	77%	0.773	S	S	*	*				62.9	145.3	93.3	-84.6	-3.2	0	0	0	114.2
626	A	26.2	Very low	26.9	Very low	80 Å²	80	155.7 Å²	155.7	66%	0.661	79%	0.787	S	S	*	*			cis	-169.6	171.2	-5.4	0	0	0	0	0	106.4
627	N	25.3	Very low	26.8	Very low	143 Å²	143	158 Å²	158	77%	0.765	79%	0.794	S	S	*	*			trans	9.6	133.4	156	-61.4	-18.3	0	0	0	119.7
628	D	28.8	Very low	26.9	Very low	133 Å²	133	158 Å²	158	71%	0.711	80%	0.801	S	S	*	*				171.7	140	112.7	-92.9	-19.6	0	0	0	116.1
629	H	31.4	Very low	27	Very low	151 Å²	151	154.6 Å²	154.6	70%	0.699	80%	0.804	S	S	*	*			trans	72.7	106.8	142.7	-62.3	-47.3	0	0	0	123.8
630	L	23.3	Very low	27.2	Very low	174 Å²	174	149.3 Å²	149.3	91%	0.911	81%	0.807	S	S	*	*				-26.5	122.5	129.6	-77.2	152.3	0	0	0	113.7
631	V	28.8	Very low	27.6	Very low	124 Å²	124	150.4 Å²	150.4	75%	0.752	81%	0.811	S	S	*	*			trans	-145.1	117.1	153.6	179.1	0	0	0	0	111.5
632	D	25.6	Very low	28	Very low	150 Å²	150	151.5 Å²	151.5	80%	0.802	81%	0.813	S	S	*	*			trans	-43.8	128.6	156.8	-112.8	-38.3	0	0	0	113.3
633	I	28.5	Very low	28.4	Very low	163 Å²	163	149 Å²	149	84%	0.836	80%	0.801	S	S	*	*			trans	-124.1	84.7	162.1	-57.3	-178.6	0	0	0	109.5
634	R	25.3	Very low	28.9	Very low	220 Å²	220	153 Å²	153	83%	0.83	81%	0.807	S	S	*	*			trans	-94.3	134.6	153.3	-99.1	-179	173	177.9	0.6	108.5
635	R	28.1	Very low	29.4	Very low	232 Å²	232	157.1 Å²	157.1	88%	0.875	81%	0.814	S	S	*	*			trans	70.7	107.9	162	-63.4	176	170.6	-178.3	-3.1	117.5
636	Q	30.7	Very low	29.5	Very low	204 Å²	204	151.8 Å²	151.8	95%	0.953	80%	0.799	S	S	*	*				-146.4	100.6	124.6	-69.7	-163.1	-3.3	0	0	109.8
637	L	25.9	Very low	29.7	Very low	171 Å²	171	152.9 Å²	152.9	90%	0.895	80%	0.8	S	S	*	*			trans	-97.8	133.3	155.6	-88.1	162.7	0	0	0	106.3
638	L	32.2	Very low	29.8	Very low	171 Å²	171	152.2 Å²	152.2	90%	0.895	80%	0.795	S	S	*	*			trans	-178	154	142.1	-93.3	166	0	0	0	108.1
639	P	30.5	Very low	29.7	Very low	122 Å²	122	155.2 Å²	155.2	79%	0.792	80%	0.802	S	S	*	*				-113.8	152.8	-128.5	36.1	-23.4	0	0	0	113.4
640	G	31.1	Very low	29.5	Very low	73 Å²	73	154.6 Å²	154.6	75%	0.753	80%	0.802	S	S	*	*			trans	-157.9	99.6	175.7	0	0	0	0	0	113.4
641	K	34	Very low	29.5	Very low	190 Å²	190	151 Å²	151	83%	0.826	80%	0.798	S	S	*	*			trans	46	115.7	147.4	-69.6	-179	172.8	-178.4	0	120.1
642	D	31.1	Very low	29.4	Very low	158 Å²	158	151 Å²	151	85%	0.845	79%	0.793	S	S	*	*			trans	57	78.4	137.7	-49.3	-29	0	0	0	117.5
643	S	34.9	Very low	29.5	Very low	88 Å²	88	149.7 Å²	149.7	62%	0.615	79%	0.793	S	S	*	*			trans	-145.9	134.2	148.5	79.8	0	0	0	0	111.2	D645	S643-D645 PolarHBondContact O-N 3.41Å
644	E	33.7	Very low	29.3	Very low	203 Å²	203	146.1 Å²	146.1	95%	0.949	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	10.9	-173.8	-72	-172.2	141.2	0	0	114.9
645	D	35.2	Very low	29.5	Very low	150 Å²	150	140.8 Å²	140.8	80%	0.802	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	31.7	-171.7	-74	-43.8	0	0	0	114.4	S643	S643-D645 PolarHBondContact O-N 3.41Å
646	S	28	Very low	29.6	Very low	88 Å²	88	133.8 Å²	133.8	62%	0.615	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-81.3	126.1	176.2	-63.9	0	0	0	0	112.1	I648	S646-I648 PolarHBondContact O-N 3.41Å
647	P	30.2	Very low	29.4	Very low	103 Å²	103	133.4 Å²	133.4	67%	0.669	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65.7	124.3	178.2	24.9	-32	0	0	0	111.4
648	I	28.4	Very low	29.6	Very low	129 Å²	129	132.7 Å²	132.7	66%	0.662	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-83.4	118.2	174.8	-61.2	174	0	0	0	108.8	S646 I650	S646-I648 PolarHBondContact O-N 3.41Å; I648-I650 HydrophobicContact CG2-CG1 4.42Å; I648-I650 PolarHBondContact O-N 3.02Å
649	F	26.3	Very low	29.3	Very low	195 Å²	195	129.4 Å²	129.4	86%	0.855	75%	0.748	S	S	*	*			trans	-74.8	111.3	168.9	-69.1	-91	0	0	0	109.8
650	I	27.1	Very low	29.1	Very low	138 Å²	138	132.1 Å²	132.1	71%	0.708	76%	0.755	S	S	*	*			trans	-90.5	110.7	168.4	-59	176.1	0	0	0	107.6	I648 L652	I648-I650 HydrophobicContact CG2-CG1 4.42Å; I648-I650 PolarHBondContact O-N 3.02Å; I650-L652 HydrophobicContact CG2-CD2 4.35Å; I650-L652 PolarHBondContact O-N 2.94Å
651	A	23.7	Very low	29	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	76%	0.758	S	S	*	*			trans	-74	102	169.1	0	0	0	0	0	109.1
652	L	27.5	Very low	28.7	Very low	124 Å²	124	130 Å²	130	65%	0.649	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.7	140.7	167.7	-68.5	171.4	0	0	0	109.3	I650 S654	I650-L652 HydrophobicContact CG2-CD2 4.35Å; I650-L652 PolarHBondContact O-N 2.94Å; L652-S654 PolarHBondContact O-N 2.78Å
653	P	26.6	Very low	28.6	Very low	122 Å²	122	134 Å²	134	79%	0.792	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-60.7	126.8	173.5	23.7	-30.5	0	0	0	109.9
654	S	24.4	Very low	28.2	Very low	88 Å²	88	138.4 Å²	138.4	62%	0.615	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-53.8	135.2	176.4	175.8	0	0	0	0	111	L652 A656	L652-S654 PolarHBondContact O-N 2.78Å; S654-A656 PolarHBondContact O-N 3.48Å; S654-A656 PolarHBondContact OG-N 3.25Å
655	P	30.6	Very low	28	Very low	107 Å²	107	134 Å²	134	70%	0.695	76%	0.757	S	S	*	*	S	Bend	trans	-66.1	-7.3	177.9	-16.2	29.1	0	0	0	114.1	K657	P655-K657 PolarHBondContact O-N 3.03Å
656	A	29.2	Very low	27.9	Very low	86 Å²	86	138.4 Å²	138.4	71%	0.711	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	19.3	-169.5	0	0	0	0	0	115.6	S654	S654-A656 PolarHBondContact O-N 3.48Å; S654-A656 PolarHBondContact OG-N 3.25Å
657	K	27.4	Very low	28.1	Very low	196 Å²	196	141.5 Å²	141.5	85%	0.852	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.3	27.7	-179.5	-71.6	-169.3	179.3	-179.8	0	115.4	P655	P655-K657 PolarHBondContact O-N 3.03Å
658	L	29.2	Very low	28.4	Very low	155 Å²	155	142.1 Å²	142.1	81%	0.812	77%	0.774	S	S	*	*	S	Bend	trans	-93	130.2	165	-74.2	168.2	0	0	0	110.1	L660	L658-L660 PolarHBondContact O-N 3.21Å
659	P	27.3	Very low	28.8	Very low	102 Å²	102	143.7 Å²	143.7	66%	0.662	78%	0.784	S	S	*	*			trans	-62.3	136.4	177.4	26.9	-32.3	0	0	0	109.2	V661	P659-V661 VanDerWaalsContact C-N 3.34Å; P659-V661 PolarHBondContact O-N 2.84Å
660	L	26	Very low	29.2	Very low	179 Å²	179	137.9 Å²	137.9	94%	0.937	78%	0.779	S	S	*	*			trans	-46.9	96.4	166.4	-83.8	149.5	0	0	0	109.4	L658 A662	L658-L660 PolarHBondContact O-N 3.21Å; L660-A662 VanDerWaalsContact C-N 3.28Å; L660-A662 PolarHBondContact O-N 3.07Å
661	V	28.4	Very low	29.5	Very low	137 Å²	137	137.2 Å²	137.2	83%	0.83	79%	0.787	S	S	*	*			trans	-75.3	95.6	163.4	179.6	0	0	0	0	105.1	P659 R663	P659-V661 VanDerWaalsContact C-N 3.34Å; P659-V661 PolarHBondContact O-N 2.84Å; V661-R663 PolarHBondContact O-N 3.43Å
662	A	27.2	Very low	30.1	Very low	81 Å²	81	138 Å²	138	67%	0.669	78%	0.783	S	S	*	*			trans	-47.1	130.1	171	0	0	0	0	0	109.6	L660 M664	L660-A662 VanDerWaalsContact C-N 3.28Å; L660-A662 PolarHBondContact O-N 3.07Å; A662-M664 PolarHBondContact O-N 3.28Å; A662-M664 VanDerWaalsContact O-N 3.07Å
663	R	29.2	Very low	30.4	Very low	244 Å²	244	136.8 Å²	136.8	92%	0.921	79%	0.791	S	S	*	*			trans	-45.4	118.3	166.6	-79.7	177.7	170.4	167.7	-4	108.6	V661	V661-R663 PolarHBondContact O-N 3.43Å
664	M	27.2	Very low	30.8	Very low	180 Å²	180	136.3 Å²	136.3	89%	0.887	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-60.3	124.8	168.5	-149.8	172.8	170.9	0	0	107.6	A662 R666	A662-M664 PolarHBondContact O-N 3.28Å; A662-M664 VanDerWaalsContact O-N 3.07Å; M664-R666 PolarHBondContact O-N 3.24Å
665	P	28.2	Very low	31	Very low	111 Å²	111	139.7 Å²	139.7	72%	0.721	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.3	125.3	-175.3	26.1	-30.5	0	0	0	109.6	I667	P665-I667 PolarHBondContact O-N 3.01Å
666	R	33.4	Very low	31.1	Very low	241 Å²	241	139.8 Å²	139.8	91%	0.909	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-61.1	119.8	163.3	-75.5	-177.6	177.4	164.2	-0.9	107.5	M664 P668	M664-R666 PolarHBondContact O-N 3.24Å; R666-P668 VanDerWaalsContact O-CD 3.26Å; R666-P668 WeakPolarHBondContact O-CD 3.27Å
667	I	32.8	Very low	31	Very low	153 Å²	153	141.5 Å²	141.5	79%	0.785	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.3	174.8	-61.7	166.4	0	0	0	108.4	P665	P665-I667 PolarHBondContact O-N 3.01Å
668	P	35.3	Very low	31.1	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-92.2	117.7	163.9	21.1	-3.7	0	0	0	108.5	R666 G670	R666-P668 VanDerWaalsContact O-CD 3.26Å; R666-P668 WeakPolarHBondContact O-CD 3.27Å; P668-G670 PolarHBondContact O-N 3.44Å
669	N	37.1	Very low	31	Very low	162 Å²	162	138.4 Å²	138.4	87%	0.866	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.3	120.4	162.6	-80.7	-21.8	0	0	0	108.7
670	G	34.8	Very low	31.4	Very low	73 Å²	73	139.2 Å²	139.2	75%	0.753	81%	0.809	S	S	*	*	S	Bend	trans	113.2	82.6	150.8	0	0	0	0	0	118.9	P668	P668-G670 PolarHBondContact O-N 3.44Å
671	S	34.1	Very low	31.6	Very low	124 Å²	124	136 Å²	136	87%	0.867	80%	0.802	S	S	*	*			trans	70.4	137	142	-147.6	0	0	0	0	122.3
672	P	35.5	Very low	31.6	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	80%	0.797	S	S	*	*			trans	-111.6	156.3	-166.7	40.4	-27.9	0	0	0	114.4
673	A	34.1	Very low	31.7	Very low	97 Å²	97	139.8 Å²	139.8	80%	0.802	80%	0.801	S	S	*	*			trans	-172.6	149.1	130.5	0	0	0	0	0	111.9
674	P	35	Very low	31.7	Very low	112 Å²	112	134.7 Å²	134.7	73%	0.727	79%	0.792	S	S	*	*			trans	-127.2	165.4	-148.8	35.3	-15.8	0	0	0	116.6
675	L	29.5	Very low	31.9	Very low	160 Å²	160	134 Å²	134	84%	0.838	79%	0.79	S	S	*	*			trans	64.1	115.3	145.4	-70.3	159.7	0	0	0	120.3
676	S	32.6	Very low	31.9	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	79%	0.794	S	S	*	*				-172.2	118.5	113.8	28.6	0	0	0	0	112.7
677	T	27	Very low	31.7	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	78%	0.784	S	S	*	*			trans	23.1	129	135.2	47.9	0	0	0	0	120.2
678	I	30.1	Very low	31.6	Very low	172 Å²	172	129.4 Å²	129.4	88%	0.882	78%	0.778	S	S	*	*				179.6	146.1	113.5	-84	150.7	0	0	0	110.1
679	S	27.2	Very low	31.5	Very low	114 Å²	114	131.2 Å²	131.2	80%	0.797	78%	0.781	S	S	*	*			trans	-81.6	180	-170.1	-101.1	0	0	0	0	115.1
680	P	34.9	Very low	31	Very low	120 Å²	120	129.3 Å²	129.3	78%	0.779	78%	0.776	S	S	*	*			trans	-97.9	158.9	-144.8	39.3	-35.8	0	0	0	115.9
681	S	30.9	Very low	30.8	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	78%	0.781	S	S	*	*			trans	-167.7	131.3	159.5	57.4	0	0	0	0	112.9
682	N	28.6	Very low	30.4	Very low	139 Å²	139	132.7 Å²	132.7	74%	0.743	77%	0.773	S	S	*	*			trans	36	138.9	138.6	-72.4	10.2	0	0	0	123.5
683	E	28.4	Very low	30.2	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.743	78%	0.775	S	S	*	*			trans	81.1	122.7	139.4	-74.9	170.7	-158.4	0	0	120
684	D	29.4	Very low	30.1	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	78%	0.775	S	S	*	*			trans	55.5	134.9	146.7	-60.9	-22.4	0	0	0	120.1
685	I	32	Very low	29.7	Very low	167 Å²	167	138.2 Å²	138.2	86%	0.856	78%	0.78	S	S	*	*				164.8	134.5	116	-78.8	152.8	0	0	0	110.5
686	F	27.5	Very low	29.9	Very low	181 Å²	181	138.2 Å²	138.2	79%	0.794	78%	0.779	S	S	*	*			trans	-47.2	164.5	171.6	-90	-105.5	0	0	0	118.1
687	D	29.8	Very low	30	Very low	133 Å²	133	141.5 Å²	141.5	71%	0.711	78%	0.782	S	S	*	*			trans	91.4	108.9	139.6	-75.1	-21.5	0	0	0	122.8
688	S	30.2	Very low	30.1	Very low	93 Å²	93	144.1 Å²	144.1	65%	0.65	79%	0.786	S	S	*	*				62.8	129.3	125.7	74.1	0	0	0	0	120.5
689	N	32.5	Very low	30.3	Very low	156 Å²	156	142.1 Å²	142.1	83%	0.834	78%	0.781	S	S	*	*				-170.6	123.1	122	-94	-37.9	0	0	0	114.1
690	T	27.7	Very low	30.7	Very low	122 Å²	122	141.8 Å²	141.8	75%	0.748	78%	0.779	S	S	*	*			trans	-43.6	148.5	161.4	0.6	0	0	0	0	116.4
691	I	29.8	Very low	30.8	Very low	169 Å²	169	145.1 Å²	145.1	87%	0.867	79%	0.785	S	S	*	*			trans	-138.8	128.4	143.2	-60.9	-176.8	0	0	0	109.9
692	S	25.2	Very low	31.3	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	78%	0.783	S	S	*	*			trans	-99.1	154.4	178.3	48.4	0	0	0	0	113.3
693	T	32.3	Very low	32	Very low	132 Å²	132	143.8 Å²	143.8	81%	0.81	78%	0.781	S	S	*	*			trans	-158.5	98.8	153.7	8.7	0	0	0	0	109.5
694	I	31.6	Very low	32.4	Very low	156 Å²	156	141 Å²	141	80%	0.8	78%	0.779	S	S	*	*				76.6	115.4	100.1	-61.8	169.7	0	0	0	115.7
695	N	26.4	Very low	32.7	Very low	155 Å²	155	141.4 Å²	141.4	83%	0.829	79%	0.787	S	S	*	*			trans	-66	143.3	172	-81.9	-28.6	0	0	0	114.5
696	I	34.8	Very low	32.9	Very low	160 Å²	160	136.6 Å²	136.6	82%	0.821	78%	0.778	S	S	*	*			trans	-145.5	107.6	147.4	-57	-176.6	0	0	0	111.4
697	H	33.1	Very low	33.3	Very low	177 Å²	177	135 Å²	135	82%	0.819	78%	0.776	S	S	*	*			trans	43.3	120.5	143.5	-89.5	-71.5	0	0	0	124.9
698	E	29.1	Very low	33.6	Very low	176 Å²	176	140 Å²	140	82%	0.822	79%	0.785	S	S	*	*			trans	-75.3	144.4	143	-67.6	176.5	146.6	0	0	111.5
699	T	35.4	Very low	33.8	Very low	130 Å²	130	140.3 Å²	140.3	80%	0.798	79%	0.787	S	S	*	*				176.2	140.2	124.1	25.8	0	0	0	0	114.5
700	S	36.3	Very low	33.6	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	79%	0.787	S	S	*	*			trans	84	99.4	148.7	63	0	0	0	0	123.3
701	E	35.3	Very low	34	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	79%	0.791	S	S	*	*				80.5	147.9	121.2	-72.6	-162.1	164.3	0	0	124.9
702	P	42.7	Very low	34.7	Very low	113 Å²	113	145.5 Å²	145.5	73%	0.734	81%	0.81	S	S	*	*			trans	-112.5	-152.3	-155.1	42.5	-24.2	0	0	0	111.2
703	P	42	Very low	35.2	Very low	109 Å²	109	147.9 Å²	147.9	71%	0.708	82%	0.816	S	S	*	*			cis	-140.8	178.8	-0.1	38.6	-16.8	0	0	0	116.5
704	S	36.7	Very low	35.3	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	82%	0.816	S	S	*	*				143.7	130.3	121.3	65.2	0	0	0	0	117.2
705	T	37	Very low	35.5	Very low	144 Å²	144	148.3 Å²	148.3	88%	0.883	82%	0.817	S	S	*	*			trans	77.6	123.7	142.8	41.4	0	0	0	0	123.3
706	G	35.4	Very low	36.1	Very low	66 Å²	66	147.9 Å²	147.9	68%	0.68	82%	0.816	S	S	*	*			trans	134.6	71.2	144.8	0	0	0	0	0	116.2
707	I	36.9	Very low	36.1	Very low	148 Å²	148	147.2 Å²	147.2	76%	0.759	82%	0.816	S	S	*	*				82.9	112.7	95.9	-69.6	174.8	0	0	0	115.8
708	R	34.4	Very low	36.4	Very low	236 Å²	236	145.2 Å²	145.2	89%	0.891	82%	0.816	S	S	*	*			trans	59.5	150.5	142.9	-69.8	175.4	177.7	175.9	-4.7	119.1
709	S	35.2	Very low	36.9	Very low	100 Å²	100	143 Å²	143	70%	0.699	82%	0.815	S	S	*	*			cis	-175.5	129.4	-6.3	53.4	0	0	0	0	105.1
710	L	28.9	Very low	37	Very low	157 Å²	157	144 Å²	144	82%	0.822	82%	0.817	S	S	*	*				58.4	138.1	110.3	-101.4	166.3	0	0	0	119.3
711	L	34.6	Very low	37	Very low	159 Å²	159	147.1 Å²	147.1	83%	0.832	82%	0.822	S	S	*	*			trans	97.2	116.9	165.6	-56.6	163.7	0	0	0	114.1
712	L	45.5	Very low	37.2	Very low	241 Å²	241	143.1 Å²	143.1	100%	1.262	82%	0.816	S	S	*	*			cis	-134.8	0	24.9	-93.6	154.6	0	0	0	111.9

Retrieved 712 of 712 residues in 551.3 ms (Link to these results)

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