A0A087WYD6_HUMAN Loading...

Antigen peptide transporter 2

AlphaFold DB , UniProt , Accession A0A087WYD6, Species HUMAN (Homo sapiens, Human), Gene TAP2, Length 702 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	49.8	Very low	248 Å²	248	123.5 Å²	123.5	100%	1.222	60%	0.597	S	S	*	*				0	124.6	0	-76.9	171.2	169.3	0	0	108.5
2	R	28	Very low	51.2	Low	248 Å²	248	114 Å²	114	94%	0.936	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-80.6	133.8	168.2	-77.4	-179.2	176.9	171.9	-0.8	107.8
3	L	37	Very low	52.3	Low	163 Å²	163	107.9 Å²	107.9	85%	0.853	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-58	136	172.5	-80.8	152.4	0	0	0	109.2
4	P	47.9	Very low	53.4	Low	63 Å²	63	109.3 Å²	109.3	41%	0.409	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-63.9	145.2	177.6	25.4	-32.4	0	0	0	111	L6 W113	P4-L6 PolarHBondContact O-N 3.18Å; P4-W113 HydrophobicContact CB-CH2 3.9Å; P4-W113 HydrophobicContact CB-CZ2 4.36Å; P4-W113 HydrophobicContact CG-CH2 3.6Å; P4-W113 HydrophobicContact CG-CZ2 4.43Å; P4-W113 HydrophobicContact CG-CZ3 4.22Å
5	D	47.4	Very low	54.4	Low	110 Å²	110	105.3 Å²	105.3	59%	0.588	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-62.5	118	-179.7	-128.7	-21.9	0	0	0	110.1	P8	D5-P8 VanDerWaalsContact O-CD 3.31Å; D5-P8 WeakPolarHBondContact O-CD 3.32Å
6	L	54.2	Low	55.3	Low	103 Å²	103	98.8 Å²	98.8	54%	0.539	49%	0.485	S	S	.	.			trans	-83.1	-7.9	-173.2	-81.2	149.8	0	0	0	114	P4 W9 T10	P4-L6 PolarHBondContact O-N 3.18Å; L6-W9 VanDerWaalsContact O-CB 3.31Å; L6-W9 WeakPolarHBondContact O-CB 3.47Å; L6-W9 PolarHBondContact O-N 3.32Å; L6-W9 VanDerWaalsContact O-N 3.13Å; L6-T10 PolarHBondContact O-N 3.15Å
7	R	54.4	Low	56	Low	194 Å²	194	95.5 Å²	95.5	73%	0.732	48%	0.478	S	S	*	.	H	α-helix	trans	-58.1	-40.1	-177.4	-63	178.2	-178.7	-172.9	0	115.7	W9 T10	R7-W9 VanDerWaalsContact C-N 3.26Å; R7-W9 PolarHBondContact O-N 3.11Å; R7-T10 PolarHBondContact O-OG1 3.01Å
8	P	58.9	Low	56.6	Low	30 Å²	30	93.2 Å²	93.2	20%	0.195	48%	0.477	C	S	.	.	H	α-helix	trans	-68.7	-26.8	176	24.1	-30.9	0	0	0	112.4	D5 S11 L12 F61 V62	D5-P8 VanDerWaalsContact O-CD 3.31Å; D5-P8 WeakPolarHBondContact O-CD 3.32Å; P8-S11 PolarHBondContact O-N 2.63Å; P8-S11 PolarHBondContact O-OG 3.14Å; P8-L12 PolarHBondContact O-N 3.42Å; P8-L12 VanDerWaalsContact O-N 3.08Å; P8-F61 HydrophobicContact CG-CD1 4.09Å; P8-F61 HydrophobicContact CG-CE1 3.75Å; P8-V62 HydrophobicContact CB-CG2 4.25Å
9	W	59.8	Low	57.2	Low	73 Å²	73	90.2 Å²	90.2	28%	0.277	46%	0.461	S	S	.	.	H	α-helix	trans	-68.3	-41.6	-179.7	-156.1	72.5	0	0	0	112.2	L6 R7 S11 L12 L13	L6-W9 VanDerWaalsContact O-CB 3.31Å; L6-W9 WeakPolarHBondContact O-CB 3.47Å; L6-W9 PolarHBondContact O-N 3.32Å; L6-W9 VanDerWaalsContact O-N 3.13Å; R7-W9 VanDerWaalsContact C-N 3.26Å; R7-W9 PolarHBondContact O-N 3.11Å; W9-S11 PolarHBondContact O-N 3.35Å; W9-L12 PolarHBondContact O-N 2.86Å; W9-L13 HydrophobicContact CD2-CD1 3.77Å; W9-L13 HydrophobicContact CD2-CG 4.46Å; W9-L13 HydrophobicContact CE3-CD1 3.4Å; W9-L13 VanDerWaalsContact CE3-CD1 3.4Å; W9-L13 HydrophobicContact CH2-CD1 3.68Å; W9-L13 HydrophobicContact CZ2-CD1 4.02Å; W9-L13 HydrophobicContact CZ3-CD1 3.36Å; W9-L13 VanDerWaalsContact O-CG 3.32Å; W9-L13 WeakPolarHBondContact O-CG 3.31Å; W9-L13 PolarHBondContact O-N 2.86Å; W9-L13 VanDerWaalsContact O-N 3.09Å
10	T	60.5	Low	57.8	Low	81 Å²	81	86.3 Å²	86.3	50%	0.497	44%	0.441	S	S	.	.	H	α-helix	trans	-65.8	-39.2	177.5	57	0	0	0	0	112	L6 R7 L14	L6-T10 PolarHBondContact O-N 3.15Å; R7-T10 PolarHBondContact O-OG1 3.01Å; T10-L14 WeakPolarHBondContact O-CB 3.36Å; T10-L14 WeakPolarHBondContact O-CG 3.5Å; T10-L14 PolarHBondContact O-N 2.96Å; T10-L14 VanDerWaalsContact O-N 3.08Å
11	S	64.1	Low	58.3	Low	46 Å²	46	91.2 Å²	91.2	32%	0.322	46%	0.455	S	S	.	.	H	α-helix	trans	-68	-37.4	176.3	65.9	0	0	0	0	113.6	P8 W9 V15	P8-S11 PolarHBondContact O-N 2.63Å; P8-S11 PolarHBondContact O-OG 3.14Å; W9-S11 PolarHBondContact O-N 3.35Å; S11-V15 VanDerWaalsContact O-CG2 3.28Å; S11-V15 WeakPolarHBondContact O-CG2 3.48Å; S11-V15 PolarHBondContact O-N 3.37Å; S11-V15 VanDerWaalsContact O-N 3.16Å
12	L	66.9	Low	59.7	Low	9 Å²	9	84.7 Å²	84.7	5%	0.047	42%	0.424	C	S	.	.	H	α-helix	trans	-65.3	-46.1	175.5	-171	76.8	0	0	0	111.2	P8 W9 L14 V15 D16 L49 L53 V62 L65 L69	P8-L12 PolarHBondContact O-N 3.42Å; P8-L12 VanDerWaalsContact O-N 3.08Å; W9-L12 PolarHBondContact O-N 2.86Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 3.42Å; L12-V15 PolarHBondContact O-N 2.84Å; L12-D16 WeakPolarHBondContact O-CB 3.18Å; L12-D16 PolarHBondContact O-N 2.65Å; L12-L49 HydrophobicContact CD1-CD2 4.42Å; L12-L53 HydrophobicContact CD1-CD1 3.65Å; L12-V62 HydrophobicContact CD1-CG1 3.64Å; L12-V62 HydrophobicContact CD2-CG1 3.74Å; L12-V62 HydrophobicContact CG-CG1 4.18Å; L12-L65 HydrophobicContact CD2-CB 4.28Å; L12-L69 HydrophobicContact CD2-CD2 3.92Å; L12-L69 HydrophobicContact CG-CD2 4.43Å
13	L	66.1	Low	61.4	Low	35 Å²	35	73.3 Å²	73.3	18%	0.183	38%	0.382	C	S	.	.	H	α-helix	trans	-64.2	-36	179.2	-70.4	174.5	0	0	0	112.9	W9 D16 A17 Y106	W9-L13 HydrophobicContact CD2-CD1 3.77Å; W9-L13 HydrophobicContact CD2-CG 4.46Å; W9-L13 HydrophobicContact CE3-CD1 3.4Å; W9-L13 VanDerWaalsContact CE3-CD1 3.4Å; W9-L13 HydrophobicContact CH2-CD1 3.68Å; W9-L13 HydrophobicContact CZ2-CD1 4.02Å; W9-L13 HydrophobicContact CZ3-CD1 3.36Å; W9-L13 VanDerWaalsContact O-CG 3.32Å; W9-L13 WeakPolarHBondContact O-CG 3.31Å; W9-L13 PolarHBondContact O-N 2.86Å; W9-L13 VanDerWaalsContact O-N 3.09Å; L13-D16 PolarHBondContact O-N 3.22Å; L13-A17 VanDerWaalsContact O-CB 3.29Å; L13-A17 WeakPolarHBondContact O-CB 3.33Å; L13-A17 PolarHBondContact O-N 3.31Å; L13-Y106 HydrophobicContact CD2-CD1 3.17Å; L13-Y106 HydrophobicContact CD2-CE1 3.25Å; L13-Y106 HydrophobicContact CD2-CG 3.89Å
14	L	66.8	Low	62.6	Low	127 Å²	127	70.9 Å²	70.9	67%	0.665	37%	0.366	S	S	*	.	H	α-helix	trans	-65.7	-43.3	174.5	-86.8	161.1	0	0	0	112.2	T10 L12 D16 A18	T10-L14 WeakPolarHBondContact O-CB 3.36Å; T10-L14 WeakPolarHBondContact O-CG 3.5Å; T10-L14 PolarHBondContact O-N 2.96Å; T10-L14 VanDerWaalsContact O-N 3.08Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 3.42Å; L14-D16 VanDerWaalsContact C-N 3.32Å; L14-A18 WeakPolarHBondContact O-CB 3.46Å; L14-A18 PolarHBondContact O-N 2.78Å
15	V	68.3	Low	63.3	Low	50 Å²	50	69.1 Å²	69.1	30%	0.303	36%	0.359	S	S	.	.	H	α-helix	trans	-66.8	-39.1	176.7	174.5	0	0	0	0	110.6	S11 L12 A18 L19 L49 L52	S11-V15 VanDerWaalsContact O-CG2 3.28Å; S11-V15 WeakPolarHBondContact O-CG2 3.48Å; S11-V15 PolarHBondContact O-N 3.37Å; S11-V15 VanDerWaalsContact O-N 3.16Å; L12-V15 PolarHBondContact O-N 2.84Å; V15-A18 PolarHBondContact O-N 3.15Å; V15-L19 WeakPolarHBondContact O-CB 3.08Å; V15-L19 PolarHBondContact O-N 3.34Å; V15-L49 HydrophobicContact CB-CD2 4.37Å; V15-L49 HydrophobicContact CG1-CD2 3.69Å; V15-L52 HydrophobicContact CG1-CD1 4.13Å
16	D	69.5	Low	63.7	Low	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-68	-39.3	178.9	-166	25.6	0	0	0	112.5	L12 L13 L14 L19 L20 R45 L49 L69 Y106	L12-D16 WeakPolarHBondContact O-CB 3.18Å; L12-D16 PolarHBondContact O-N 2.65Å; L13-D16 PolarHBondContact O-N 3.22Å; L14-D16 VanDerWaalsContact C-N 3.32Å; D16-L19 PolarHBondContact O-N 3.12Å; D16-L20 WeakPolarHBondContact O-CG 3.33Å; D16-L20 PolarHBondContact O-N 3.27Å; D16-R45 IonicContact OD1-CZ 2.58Å; D16-R45 IonicContact OD1-NE 3.33Å; D16-R45 PolarHBondContact OD1-NE 3.45Å; D16-R45 IonicContact OD1-NH2 3.48Å; D16-R45 PolarHBondContact OD1-NH2 3.39Å; D16-R45 IonicContact OD2-CZ 3.35Å; D16-R45 IonicContact OD2-NE 4Å; D16-R45 IonicContact OD2-NH2 3.65Å; D16-R45 PolarHBondContact OD2-NH2 3.46Å; D16-L49 HydrophobicContact CB-CD1 4.48Å; D16-L69 WeakPolarHBondContact OD2-CD2 3.43Å; D16-Y106 WeakPolarHBondContact OD2-CE1 3.39Å; D16-Y106 PolarHBondContact OD2-OH 3.38Å
17	A	66.8	Low	63.7	Low	43 Å²	43	68.8 Å²	68.8	36%	0.355	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-39.4	171.3	0	0	0	0	0	112.4	L13 L20 W21	L13-A17 VanDerWaalsContact O-CB 3.29Å; L13-A17 WeakPolarHBondContact O-CB 3.33Å; L13-A17 PolarHBondContact O-N 3.31Å; A17-L20 PolarHBondContact O-N 2.82Å; A17-W21 PolarHBondContact O-N 3.26Å
18	A	66.7	Low	63.9	Low	55 Å²	55	59.7 Å²	59.7	46%	0.455	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-37.5	174.9	0	0	0	0	0	112.1	L14 V15 W21 L22	L14-A18 WeakPolarHBondContact O-CB 3.46Å; L14-A18 PolarHBondContact O-N 2.78Å; V15-A18 PolarHBondContact O-N 3.15Å; A18-W21 PolarHBondContact O-N 3.41Å; A18-L22 PolarHBondContact O-N 2.73Å
19	L	68.6	Low	63.8	Low	35 Å²	35	63 Å²	63	18%	0.183	35%	0.35	C	S	.	.	H	α-helix	trans	-68.9	-41	177.3	-150	107.7	0	0	0	111.7	V15 D16 W21 L22 L23 R45	V15-L19 WeakPolarHBondContact O-CB 3.08Å; V15-L19 PolarHBondContact O-N 3.34Å; D16-L19 PolarHBondContact O-N 3.12Å; L19-W21 VanDerWaalsContact C-N 3.33Å; L19-W21 PolarHBondContact O-N 2.79Å; L19-L22 WeakPolarHBondContact O-CB 3.47Å; L19-L22 PolarHBondContact O-N 3.11Å; L19-L23 HydrophobicContact CD2-CD1 3.96Å; L19-L23 HydrophobicContact CG-CD1 4.49Å; L19-L23 WeakPolarHBondContact O-CD1 3.44Å; L19-L23 PolarHBondContact O-N 2.92Å; L19-R45 HydrophobicContact CD2-CB 4.07Å; L19-R45 HydrophobicContact CD2-CG 3.8Å
20	L	68.6	Low	63.8	Low	13 Å²	13	66.5 Å²	66.5	7%	0.068	37%	0.374	C	S	.	.	H	α-helix	trans	-61.1	-40.3	172.5	-77.4	170.6	0	0	0	111.9	D16 A17 L22 L23 Q24 R45 V94 L102	D16-L20 WeakPolarHBondContact O-CG 3.33Å; D16-L20 PolarHBondContact O-N 3.27Å; A17-L20 PolarHBondContact O-N 2.82Å; L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L23 PolarHBondContact O-N 3.08Å; L20-Q24 WeakPolarHBondContact O-CG 3.31Å; L20-Q24 PolarHBondContact O-N 3.5Å; L20-R45 VanDerWaalsContact CD1-NH2 3.29Å; L20-V94 HydrophobicContact CD2-CG1 4.49Å; L20-L102 HydrophobicContact CD1-CD2 3.97Å
21	W	68.2	Low	63.9	Low	189 Å²	189	64 Å²	64	72%	0.716	36%	0.357	S	S	*	.	H	α-helix	trans	-63.9	-38.1	174.7	-172.9	75	0	0	0	112.1	A17 A18 L19 Q24	A17-W21 PolarHBondContact O-N 3.26Å; A18-W21 PolarHBondContact O-N 3.41Å; L19-W21 VanDerWaalsContact C-N 3.33Å; L19-W21 PolarHBondContact O-N 2.79Å; W21-Q24 WeakPolarHBondContact O-CB 3.46Å; W21-Q24 PolarHBondContact O-N 2.83Å
22	L	64.3	Low	63.7	Low	111 Å²	111	65.3 Å²	65.3	58%	0.581	36%	0.364	S	S	*	.	H	α-helix	trans	-67.2	-36.9	175.7	-143.7	112.7	0	0	0	112.4	A18 L19 L20 Q24 G25	A18-L22 PolarHBondContact O-N 2.73Å; L19-L22 WeakPolarHBondContact O-CB 3.47Å; L19-L22 PolarHBondContact O-N 3.11Å; L20-L22 VanDerWaalsContact C-N 3.33Å; L22-Q24 VanDerWaalsContact C-N 3.32Å; L22-G25 PolarHBondContact O-N 3.01Å
23	L	63.9	Low	63.2	Low	10 Å²	10	72.4 Å²	72.4	5%	0.052	40%	0.397	C	S	.	.	H	α-helix	trans	-72.8	-19	175.3	-84.4	150.3	0	0	0	113.4	L19 L20 G25 G28 L31 E41 L44	L19-L23 HydrophobicContact CD2-CD1 3.96Å; L19-L23 HydrophobicContact CG-CD1 4.49Å; L19-L23 WeakPolarHBondContact O-CD1 3.44Å; L19-L23 PolarHBondContact O-N 2.92Å; L20-L23 PolarHBondContact O-N 3.08Å; L23-G25 VanDerWaalsContact C-N 3.29Å; L23-G28 VanDerWaalsContact O-CA 3.3Å; L23-G28 WeakPolarHBondContact O-CA 3.41Å; L23-L31 HydrophobicContact CD2-CD1 4.26Å; L23-E41 HydrophobicContact CD2-CG 4.42Å; L23-L44 HydrophobicContact CD2-CD2 4.09Å
24	Q	63	Low	63	Low	112 Å²	112	72.3 Å²	72.3	52%	0.523	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-19.1	168.4	-72.1	177.3	-18.2	0	0	113	L20 W21 L22 A95	L20-Q24 WeakPolarHBondContact O-CG 3.31Å; L20-Q24 PolarHBondContact O-N 3.5Å; W21-Q24 WeakPolarHBondContact O-CB 3.46Å; W21-Q24 PolarHBondContact O-N 2.83Å; L22-Q24 VanDerWaalsContact C-N 3.32Å; Q24-A95 HydrophobicContact CG-CB 3.76Å; Q24-A95 PolarHBondContact NE2-O 3.21Å
25	G	62.1	Low	62.6	Low	25 Å²	25	70 Å²	70	26%	0.258	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-161.1	-178.6	0	0	0	0	0	114.7	L22 L23 L27 G28	L22-G25 PolarHBondContact O-N 3.01Å; L23-G25 VanDerWaalsContact C-N 3.29Å; G25-L27 PolarHBondContact O-N 3.41Å; G25-G28 PolarHBondContact O-N 3.1Å
26	P	55.4	Low	62.5	Low	113 Å²	113	71.5 Å²	71.5	73%	0.734	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.2	-172.9	26.5	-34.9	0	0	0	114.5	T29	P26-T29 PolarHBondContact O-OG1 2.83Å
27	L	55.5	Low	62.3	Low	93 Å²	93	71.8 Å²	71.8	49%	0.487	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-30.1	173.8	-137.5	85.3	0	0	0	112.2	G25 T29 L44	G25-L27 PolarHBondContact O-N 3.41Å; L27-T29 VanDerWaalsContact C-N 3.33Å; L27-T29 PolarHBondContact O-N 3.17Å; L27-L44 HydrophobicContact CD2-CD2 4.34Å
28	G	57.1	Low	62.3	Low	3 Å²	3	70.1 Å²	70.1	3%	0.031	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-74.1	-19.5	-178.3	0	0	0	0	0	114.3	L23 G25 L30 R93	L23-G28 VanDerWaalsContact O-CA 3.3Å; L23-G28 WeakPolarHBondContact O-CA 3.41Å; G25-G28 PolarHBondContact O-N 3.1Å; G28-L30 VanDerWaalsContact C-N 3.34Å; G28-R93 VanDerWaalsContact O-CZ 3.24Å; G28-R93 PolarHBondContact O-NH2 3.33Å
29	T	57.8	Low	62.3	Low	101 Å²	101	72.1 Å²	72.1	62%	0.62	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-79.9	-15.2	179.6	54.1	0	0	0	0	113.3	P26 L27	P26-T29 PolarHBondContact O-OG1 2.83Å; L27-T29 VanDerWaalsContact C-N 3.33Å; L27-T29 PolarHBondContact O-N 3.17Å
30	L	59.4	Low	62.5	Low	146 Å²	146	74.5 Å²	74.5	76%	0.764	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-85.2	-11.4	176	-77.6	152.7	0	0	0	113.6	G28	G28-L30 VanDerWaalsContact C-N 3.34Å
31	L	62.7	Low	62.5	Low	29 Å²	29	74.5 Å²	74.5	15%	0.152	40%	0.399	C	S	.	.	S	Bend	trans	-86.3	135.4	-177.3	-81.7	137.9	0	0	0	112	L23 L40	L23-L31 HydrophobicContact CD2-CD1 4.26Å; L31-L40 HydrophobicContact CD2-CB 3.68Å; L31-L40 HydrophobicContact CD2-CD2 3.44Å; L31-L40 VanDerWaalsContact CD2-CD2 3.44Å; L31-L40 HydrophobicContact CD2-CG 4.17Å
32	P	60.8	Low	62.5	Low	73 Å²	73	65.8 Å²	65.8	47%	0.474	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-62.8	144.7	179.8	24.8	-32.5	0	0	0	111.7	G37	P32-G37 WeakPolarHBondContact O-CA 3.44Å
33	Q	54.7	Low	62.8	Low	158 Å²	158	63.9 Å²	63.9	74%	0.738	36%	0.361	S	S	*	.	S	Bend	trans	-79.3	144.3	178.9	-61.9	-176.2	4.9	0	0	111.4
34	G	62.4	Low	63.2	Low	33 Å²	33	67.2 Å²	67.2	34%	0.34	38%	0.379	S	S	.	.	S	Bend	trans	106.7	-169.1	177	0	0	0	0	0	114.9	P36 G37 L38	G34-P36 VanDerWaalsContact C-CD 3.48Å; G34-G37 WeakPolarHBondContact O-CA 3.34Å; G34-G37 PolarHBondContact O-N 3.12Å; G34-L38 PolarHBondContact O-N 2.74Å
35	L	59.1	Low	63.6	Low	77 Å²	77	62.4 Å²	62.4	40%	0.403	36%	0.356	S	S	.	.	H	α-helix	trans	-48.8	-44.9	178.5	-80	162.1	0	0	0	114.5	G37 L38 W39 V77 S78	L35-G37 VanDerWaalsContact C-N 3.3Å; L35-G37 PolarHBondContact O-N 3.06Å; L35-L38 WeakPolarHBondContact O-CB 3.47Å; L35-L38 PolarHBondContact O-N 3.37Å; L35-W39 PolarHBondContact O-N 2.93Å; L35-V77 HydrophobicContact CD2-CG1 4.41Å; L35-S78 WeakPolarHBondContact CD2-OG 3.33Å
36	P	64.9	Low	64.1	Low	82 Å²	82	63.5 Å²	63.5	53%	0.532	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-31.1	178.2	19.4	-26.6	0	0	0	113	G34 L40	G34-P36 VanDerWaalsContact C-CD 3.48Å; P36-L40 WeakPolarHBondContact O-CB 3.41Å; P36-L40 PolarHBondContact O-N 3.12Å
37	G	65.2	Low	64.9	Low	6 Å²	6	60 Å²	60	6%	0.062	34%	0.34	C	S	.	.	H	α-helix	trans	-65	-40.8	172.8	0	0	0	0	0	113.3	P32 G34 L35 L40 E41	P32-G37 WeakPolarHBondContact O-CA 3.44Å; G34-G37 WeakPolarHBondContact O-CA 3.34Å; G34-G37 PolarHBondContact O-N 3.12Å; L35-G37 VanDerWaalsContact C-N 3.3Å; L35-G37 PolarHBondContact O-N 3.06Å; G37-L40 PolarHBondContact O-N 3.5Å; G37-E41 WeakPolarHBondContact O-CB 3.37Å; G37-E41 PolarHBondContact O-N 3.39Å
38	L	67.4	Low	65.5	Low	9 Å²	9	56.9 Å²	56.9	5%	0.047	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-40.7	176.6	-103.6	132.5	0	0	0	112.8	G34 L35 G42 P74 V94	G34-L38 PolarHBondContact O-N 2.74Å; L35-L38 WeakPolarHBondContact O-CB 3.47Å; L35-L38 PolarHBondContact O-N 3.37Å; L38-G42 PolarHBondContact O-N 2.68Å; L38-P74 HydrophobicContact CB-CB 4.41Å; L38-P74 HydrophobicContact CD2-CB 4.33Å; L38-V94 HydrophobicContact CD2-CG2 3.4Å; L38-V94 HydrophobicContact CG-CG2 4.29Å
39	W	67.7	Low	66.1	Low	96 Å²	96	56.8 Å²	56.8	36%	0.364	33%	0.329	S	S	.	.	H	α-helix	trans	-70.1	-40.1	174.9	-81.5	91.5	0	0	0	111.7	L35 G42 T43 L71 P74 L75 S78	L35-W39 PolarHBondContact O-N 2.93Å; W39-G42 PolarHBondContact O-N 2.82Å; W39-T43 VanDerWaalsContact O-CG2 3.31Å; W39-T43 WeakPolarHBondContact O-CG2 3.44Å; W39-T43 PolarHBondContact O-N 2.82Å; W39-T43 PolarHBondContact O-OG1 3.11Å; W39-L71 HydrophobicContact CE3-CD2 4.15Å; W39-L71 HydrophobicContact CZ3-CD2 4.03Å; W39-P74 HydrophobicContact CD2-CB 4.33Å; W39-P74 HydrophobicContact CG-CB 4.4Å; W39-L75 HydrophobicContact CH2-CD1 4.1Å; W39-L75 HydrophobicContact CZ2-CD1 4.35Å; W39-S78 PolarHBondContact NE1-OG 3.34Å; W39-S78 VanDerWaalsContact NE1-OG 3.13Å
40	L	71.5	Confident	66.7	Low	85 Å²	85	58.2 Å²	58.2	45%	0.445	32%	0.323	S	S	.	.	H	α-helix	trans	-64.2	-44.1	176.6	-130.6	115.1	0	0	0	111.3	L31 P36 G37 G42 T43 L44	L31-L40 HydrophobicContact CD2-CB 3.68Å; L31-L40 HydrophobicContact CD2-CD2 3.44Å; L31-L40 VanDerWaalsContact CD2-CD2 3.44Å; L31-L40 HydrophobicContact CD2-CG 4.17Å; P36-L40 WeakPolarHBondContact O-CB 3.41Å; P36-L40 PolarHBondContact O-N 3.12Å; G37-L40 PolarHBondContact O-N 3.5Å; L40-G42 PolarHBondContact O-N 2.92Å; L40-T43 WeakPolarHBondContact CA-OG1 3.31Å; L40-T43 PolarHBondContact O-N 3.09Å; L40-T43 PolarHBondContact O-OG1 2.97Å; L40-L44 WeakPolarHBondContact O-CB 3.3Å; L40-L44 PolarHBondContact O-N 3.18Å
41	E	69.8	Low	67	Low	14 Å²	14	52.6 Å²	52.6	7%	0.065	30%	0.301	C	S	.	.	H	α-helix	trans	-57.8	-46	173.8	-171	-179.7	180	0	0	111.2	L23 G37 L44 R45 V94 A95	L23-E41 HydrophobicContact CD2-CG 4.42Å; G37-E41 WeakPolarHBondContact O-CB 3.37Å; G37-E41 PolarHBondContact O-N 3.39Å; E41-L44 PolarHBondContact O-N 3.32Å; E41-R45 VanDerWaalsContact O-CB 3.3Å; E41-R45 WeakPolarHBondContact O-CB 3.44Å; E41-R45 PolarHBondContact O-N 3.02Å; E41-V94 PolarHBondContact OE2-N 2.58Å; E41-V94 VanDerWaalsContact OE2-N 3.12Å; E41-A95 VanDerWaalsContact OE1-CB 3.3Å; E41-A95 WeakPolarHBondContact OE1-CB 3.07Å; E41-A95 PolarHBondContact OE1-N 3.06Å
42	G	68.3	Low	67.1	Low	5 Å²	5	55.7 Å²	55.7	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-39.8	175.6	0	0	0	0	0	113.9	L38 W39 L40 L46	L38-G42 PolarHBondContact O-N 2.68Å; W39-G42 PolarHBondContact O-N 2.82Å; L40-G42 PolarHBondContact O-N 2.92Å; G42-L46 WeakPolarHBondContact O-CB 3.45Å; G42-L46 PolarHBondContact O-N 3.17Å
43	T	69.3	Low	67.3	Low	71 Å²	71	53.1 Å²	53.1	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-72.2	-36.4	177.5	58.3	0	0	0	0	113.2	W39 L40 R45 L46 G47	W39-T43 VanDerWaalsContact O-CG2 3.31Å; W39-T43 WeakPolarHBondContact O-CG2 3.44Å; W39-T43 PolarHBondContact O-N 2.82Å; W39-T43 PolarHBondContact O-OG1 3.11Å; L40-T43 WeakPolarHBondContact CA-OG1 3.31Å; L40-T43 PolarHBondContact O-N 3.09Å; L40-T43 PolarHBondContact O-OG1 2.97Å; T43-R45 VanDerWaalsContact C-N 3.32Å; T43-L46 PolarHBondContact O-N 3.14Å; T43-G47 PolarHBondContact O-N 3.19Å
44	L	72.3	Confident	67.6	Low	81 Å²	81	51.9 Å²	51.9	42%	0.424	29%	0.291	S	S	.	.	H	α-helix	trans	-64.5	-41.6	174.5	-134.3	91.7	0	0	0	110.7	L23 L27 L40 E41 G47 G48	L23-L44 HydrophobicContact CD2-CD2 4.09Å; L27-L44 HydrophobicContact CD2-CD2 4.34Å; L40-L44 WeakPolarHBondContact O-CB 3.3Å; L40-L44 PolarHBondContact O-N 3.18Å; E41-L44 PolarHBondContact O-N 3.32Å; L44-G47 PolarHBondContact O-N 3.2Å; L44-G48 PolarHBondContact O-N 3.48Å
45	R	71.6	Confident	67.6	Low	11 Å²	11	58 Å²	58	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-63.4	-44.3	176.3	-166.8	-179.5	-174.5	-167.5	3.6	112.1	D16 L19 L20 E41 T43 L49	D16-R45 IonicContact OD1-CZ 2.58Å; D16-R45 IonicContact OD1-NE 3.33Å; D16-R45 PolarHBondContact OD1-NE 3.45Å; D16-R45 IonicContact OD1-NH2 3.48Å; D16-R45 PolarHBondContact OD1-NH2 3.39Å; D16-R45 IonicContact OD2-CZ 3.35Å; D16-R45 IonicContact OD2-NE 4Å; D16-R45 IonicContact OD2-NH2 3.65Å; D16-R45 PolarHBondContact OD2-NH2 3.46Å; L19-R45 HydrophobicContact CD2-CB 4.07Å; L19-R45 HydrophobicContact CD2-CG 3.8Å; L20-R45 VanDerWaalsContact CD1-NH2 3.29Å; E41-R45 VanDerWaalsContact O-CB 3.3Å; E41-R45 WeakPolarHBondContact O-CB 3.44Å; E41-R45 PolarHBondContact O-N 3.02Å; T43-R45 VanDerWaalsContact C-N 3.32Å; R45-L49 HydrophobicContact CG-CD1 4.14Å; R45-L49 WeakPolarHBondContact O-CB 3.15Å; R45-L49 WeakPolarHBondContact O-CG 3.02Å; R45-L49 PolarHBondContact O-N 3.08Å
46	L	73.6	Confident	67.4	Low	47 Å²	47	62.8 Å²	62.8	25%	0.246	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-48	173.6	-169.4	89.5	0	0	0	111.3	G42 T43 W50 L66 L67 C70	G42-L46 WeakPolarHBondContact O-CB 3.45Å; G42-L46 PolarHBondContact O-N 3.17Å; T43-L46 PolarHBondContact O-N 3.14Å; L46-W50 WeakPolarHBondContact O-CB 3.43Å; L46-W50 PolarHBondContact O-N 3.39Å; L46-L66 HydrophobicContact CD1-CD2 3.98Å; L46-L66 WeakPolarHBondContact CD1-O 3.09Å; L46-L66 HydrophobicContact CG-CD2 4.29Å; L46-L66 WeakPolarHBondContact O-CD2 3.4Å; L46-L67 HydrophobicContact CD1-CB 4.43Å; L46-L67 HydrophobicContact CD1-CD1 3.91Å; L46-L67 HydrophobicContact CD2-CD1 4.26Å; L46-C70 HydrophobicContact CB-CB 4.14Å; L46-C70 HydrophobicContact CD1-CB 4.01Å
47	G	71.1	Confident	66.8	Low	40 Å²	40	62.2 Å²	62.2	41%	0.412	34%	0.337	S	S	.	.	H	α-helix	trans	-64.6	-43.9	-179.6	0	0	0	0	0	113.3	T43 L44 W50 G51	T43-G47 PolarHBondContact O-N 3.19Å; L44-G47 PolarHBondContact O-N 3.2Å; G47-W50 PolarHBondContact O-N 3.27Å; G47-G51 PolarHBondContact O-N 3.18Å
48	G	69.6	Low	66.3	Low	28 Å²	28	65.2 Å²	65.2	29%	0.289	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-47.2	178.5	0	0	0	0	0	112.7	L44 G51 L52	L44-G48 PolarHBondContact O-N 3.48Å; G48-G51 PolarHBondContact O-N 3.42Å; G48-L52 WeakPolarHBondContact O-CB 3.33Å; G48-L52 PolarHBondContact O-N 3.28Å; G48-L52 VanDerWaalsContact O-N 3.08Å
49	L	69.3	Low	65.7	Low	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-66.9	-38.9	176.9	-75.3	169.1	0	0	0	111.7	L12 V15 D16 R45 L52 L53 L66	L12-L49 HydrophobicContact CD1-CD2 4.42Å; V15-L49 HydrophobicContact CB-CD2 4.37Å; V15-L49 HydrophobicContact CG1-CD2 3.69Å; D16-L49 HydrophobicContact CB-CD1 4.48Å; R45-L49 HydrophobicContact CG-CD1 4.14Å; R45-L49 WeakPolarHBondContact O-CB 3.15Å; R45-L49 WeakPolarHBondContact O-CG 3.02Å; R45-L49 PolarHBondContact O-N 3.08Å; L49-L52 PolarHBondContact O-N 2.94Å; L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 WeakPolarHBondContact O-CD1 3.2Å; L49-L53 PolarHBondContact O-N 3.3Å; L49-L66 HydrophobicContact CB-CD1 4.44Å; L49-L66 HydrophobicContact CB-CD2 3.45Å; L49-L66 VanDerWaalsContact CB-CD2 3.45Å; L49-L66 HydrophobicContact CB-CG 4.09Å; L49-L66 HydrophobicContact CD1-CD2 4.41Å
50	W	70.6	Confident	64.9	Low	131 Å²	131	66.8 Å²	66.8	50%	0.496	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-42.8	177.2	-175.1	77.8	0	0	0	112.1	L46 G47 L53 K54 L66	L46-W50 WeakPolarHBondContact O-CB 3.43Å; L46-W50 PolarHBondContact O-N 3.39Å; G47-W50 PolarHBondContact O-N 3.27Å; W50-L53 PolarHBondContact O-N 3.32Å; W50-K54 HydrophobicContact CH2-CD 4.37Å; W50-K54 WeakPolarHBondContact O-CB 3.21Å; W50-K54 PolarHBondContact O-N 3.12Å; W50-L66 HydrophobicContact CB-CD1 4.4Å; W50-L66 HydrophobicContact CB-CD2 4.35Å
51	G	65.8	Low	63.9	Low	29 Å²	29	67.9 Å²	67.9	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-62.4	-46.3	175.5	0	0	0	0	0	113	G47 G48 K54 L55	G47-G51 PolarHBondContact O-N 3.18Å; G48-G51 PolarHBondContact O-N 3.42Å; G51-K54 PolarHBondContact O-N 3.26Å; G51-L55 PolarHBondContact O-N 2.79Å
52	L	64.4	Low	63.1	Low	94 Å²	94	67.6 Å²	67.6	49%	0.492	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-39.1	178	-86.2	157	0	0	0	112.8	V15 G48 L49 R56	V15-L52 HydrophobicContact CG1-CD1 4.13Å; G48-L52 WeakPolarHBondContact O-CB 3.33Å; G48-L52 PolarHBondContact O-N 3.28Å; G48-L52 VanDerWaalsContact O-N 3.08Å; L49-L52 PolarHBondContact O-N 2.94Å; L52-R56 PolarHBondContact O-N 2.99Å
53	L	64.3	Low	62.5	Low	18 Å²	18	68.6 Å²	68.6	9%	0.094	39%	0.394	C	S	.	.	H	α-helix	trans	-72.9	-31.6	177.1	-92.1	101.8	0	0	0	113.6	L12 L49 W50 R56 G57 L58 L59 V62 L66	L12-L53 HydrophobicContact CD1-CD1 3.65Å; L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 WeakPolarHBondContact O-CD1 3.2Å; L49-L53 PolarHBondContact O-N 3.3Å; W50-L53 PolarHBondContact O-N 3.32Å; L53-R56 PolarHBondContact O-N 3.44Å; L53-G57 PolarHBondContact O-N 3.34Å; L53-L58 HydrophobicContact CD2-CB 4.24Å; L53-L58 PolarHBondContact O-N 3.44Å; L53-L59 HydrophobicContact CB-CD1 4.08Å; L53-V62 HydrophobicContact CD2-CB 3.42Å; L53-V62 VanDerWaalsContact CD2-CB 3.42Å; L53-V62 HydrophobicContact CD2-CG1 3.54Å; L53-V62 HydrophobicContact CD2-CG2 4.35Å; L53-L66 HydrophobicContact CD1-CD1 4.1Å
54	K	60.6	Low	61.9	Low	133 Å²	133	67.9 Å²	67.9	58%	0.578	39%	0.39	S	S	*	.	H	α-helix	trans	-66	-39.3	174.8	-167.5	177.3	-178.4	-178.6	0	111.7	W50 G51 R56 L59	W50-K54 HydrophobicContact CH2-CD 4.37Å; W50-K54 WeakPolarHBondContact O-CB 3.21Å; W50-K54 PolarHBondContact O-N 3.12Å; G51-K54 PolarHBondContact O-N 3.26Å; K54-R56 VanDerWaalsContact C-N 3.26Å; K54-R56 PolarHBondContact O-N 3.04Å; K54-L59 HydrophobicContact CB-CD1 4.11Å
55	L	62.9	Low	61	Low	160 Å²	160	64.4 Å²	64.4	84%	0.838	37%	0.372	S	S	*	.	H	α-helix	trans	-64.6	-27.2	174.7	-101.3	132.4	0	0	0	113.5	G51	G51-L55 PolarHBondContact O-N 2.79Å
56	R	55.8	Low	60.6	Low	179 Å²	179	64.1 Å²	64.1	68%	0.675	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	3.2	-174.5	-132.1	177	-174.4	-178.8	2	114.5	L52 L53 K54 L58	L52-R56 PolarHBondContact O-N 2.99Å; L53-R56 PolarHBondContact O-N 3.44Å; K54-R56 VanDerWaalsContact C-N 3.26Å; K54-R56 PolarHBondContact O-N 3.04Å; R56-L58 HydrophobicContact CB-CD1 4.38Å; R56-L58 HydrophobicContact CG-CD1 4.45Å; R56-L58 PolarHBondContact O-N 3.49Å
57	G	52.8	Low	59.9	Low	69 Å²	69	66.7 Å²	66.7	71%	0.711	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	8.6	178.7	0	0	0	0	0	115.7	L53 L59	L53-G57 PolarHBondContact O-N 3.34Å; G57-L59 VanDerWaalsContact C-N 3.35Å
58	L	54.2	Low	59.3	Low	70 Å²	70	66.3 Å²	66.3	37%	0.366	37%	0.374	S	S	.	.			trans	-92.2	10.1	-175.2	-87.8	150.8	0	0	0	113.8	L53 R56 G60 F61 V62	L53-L58 HydrophobicContact CD2-CB 4.24Å; L53-L58 PolarHBondContact O-N 3.44Å; R56-L58 HydrophobicContact CB-CD1 4.38Å; R56-L58 HydrophobicContact CG-CD1 4.45Å; R56-L58 PolarHBondContact O-N 3.49Å; L58-G60 VanDerWaalsContact C-N 3.28Å; L58-G60 PolarHBondContact O-N 3.39Å; L58-F61 PolarHBondContact O-N 2.94Å; L58-V62 PolarHBondContact O-N 3.23Å
59	L	55.1	Low	58.9	Low	65 Å²	65	65.5 Å²	65.5	34%	0.34	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-34	-171.6	-149.1	82.8	0	0	0	113	L53 K54 G57 G63	L53-L59 HydrophobicContact CB-CD1 4.08Å; K54-L59 HydrophobicContact CB-CD1 4.11Å; G57-L59 VanDerWaalsContact C-N 3.35Å; L59-G63 VanDerWaalsContact O-CA 3.27Å; L59-G63 WeakPolarHBondContact O-CA 3.47Å; L59-G63 PolarHBondContact O-N 3.35Å
60	G	50.7	Low	58.6	Low	72 Å²	72	65.6 Å²	65.6	74%	0.742	36%	0.364	S	S	*	.	H	α-helix	trans	-69.8	-33.8	-177.4	0	0	0	0	0	114.3	L58	L58-G60 VanDerWaalsContact C-N 3.28Å; L58-G60 PolarHBondContact O-N 3.39Å
61	F	50.5	Low	58.2	Low	109 Å²	109	61 Å²	61	48%	0.478	35%	0.349	S	S	.	.	H	α-helix	trans	-92.3	-29	-175.5	-162.6	-96.7	0	0	0	113	P8 L58	P8-F61 HydrophobicContact CG-CD1 4.09Å; P8-F61 HydrophobicContact CG-CE1 3.75Å; L58-F61 PolarHBondContact O-N 2.94Å
62	V	52.7	Low	58.1	Low	7 Å²	7	61 Å²	61	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-121.1	-9.1	-170.3	-175.8	0	0	0	0	112.9	P8 L12 L53 L58 T64 L65	P8-V62 HydrophobicContact CB-CG2 4.25Å; L12-V62 HydrophobicContact CD1-CG1 3.64Å; L12-V62 HydrophobicContact CD2-CG1 3.74Å; L12-V62 HydrophobicContact CG-CG1 4.18Å; L53-V62 HydrophobicContact CD2-CB 3.42Å; L53-V62 VanDerWaalsContact CD2-CB 3.42Å; L53-V62 HydrophobicContact CD2-CG1 3.54Å; L53-V62 HydrophobicContact CD2-CG2 4.35Å; L58-V62 PolarHBondContact O-N 3.23Å; V62-T64 PolarHBondContact O-N 2.75Å; V62-L65 HydrophobicContact CG1-CB 4.33Å; V62-L65 HydrophobicContact CG1-CD1 4.24Å; V62-L65 WeakPolarHBondContact O-CB 3.38Å; V62-L65 PolarHBondContact O-N 3.48Å; V62-L65 VanDerWaalsContact O-N 3.12Å
63	G	56.5	Low	57.8	Low	26 Å²	26	57.9 Å²	57.9	27%	0.268	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-26.6	179.4	0	0	0	0	0	114.5	L59 L66	L59-G63 VanDerWaalsContact O-CA 3.27Å; L59-G63 WeakPolarHBondContact O-CA 3.47Å; L59-G63 PolarHBondContact O-N 3.35Å; G63-L66 WeakPolarHBondContact O-CB 3.46Å
64	T	55.7	Low	57.7	Low	57 Å²	57	57.1 Å²	57.1	35%	0.35	33%	0.327	S	S	.	.	H	α-helix	trans	-80.3	-18.2	177.5	53.2	0	0	0	0	114	V62 P68 W116	V62-T64 PolarHBondContact O-N 2.75Å; T64-P68 VanDerWaalsContact O-CD 3.27Å; T64-P68 WeakPolarHBondContact O-CD 3.47Å; T64-W116 HydrophobicContact CG2-CD2 4.32Å; T64-W116 HydrophobicContact CG2-CH2 3.6Å; T64-W116 HydrophobicContact CG2-CZ2 3.16Å; T64-W116 HydrophobicContact CG2-CZ3 4.33Å; T64-W116 VanDerWaalsContact OG1-CE3 3.23Å; T64-W116 WeakPolarHBondContact OG1-CH2 3.43Å; T64-W116 WeakPolarHBondContact OG1-CZ2 3.41Å; T64-W116 WeakPolarHBondContact OG1-CZ3 3.26Å
65	L	53.9	Low	57.7	Low	8 Å²	8	55 Å²	55	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-77.8	-25.3	173.5	-95.5	139.8	0	0	0	112.7	L12 V62 P68 L69 W113	L12-L65 HydrophobicContact CD2-CB 4.28Å; V62-L65 HydrophobicContact CG1-CB 4.33Å; V62-L65 HydrophobicContact CG1-CD1 4.24Å; V62-L65 WeakPolarHBondContact O-CB 3.38Å; V62-L65 PolarHBondContact O-N 3.48Å; V62-L65 VanDerWaalsContact O-N 3.12Å; L65-P68 WeakPolarHBondContact O-CD 3.34Å; L65-P68 WeakPolarHBondContact O-CG 3.07Å; L65-L69 WeakPolarHBondContact O-CB 3.5Å; L65-L69 PolarHBondContact O-N 2.67Å; L65-L69 VanDerWaalsContact O-N 3.15Å; L65-W113 HydrophobicContact CD1-CG 3.87Å; L65-W113 HydrophobicContact CD2-CB 3.71Å; L65-W113 HydrophobicContact CD2-CG 3.88Å; L65-W113 HydrophobicContact CG-CB 4.03Å; L65-W113 VanDerWaalsContact CG-CD1 3.46Å; L65-W113 HydrophobicContact CG-CG 3.88Å
66	L	61.7	Low	57.5	Low	5 Å²	5	51.1 Å²	51.1	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-67	-42.7	-167.3	-125.1	149.9	0	0	0	112.6	L46 L49 W50 L53 G63 C70	L46-L66 HydrophobicContact CD1-CD2 3.98Å; L46-L66 WeakPolarHBondContact CD1-O 3.09Å; L46-L66 HydrophobicContact CG-CD2 4.29Å; L46-L66 WeakPolarHBondContact O-CD2 3.4Å; L49-L66 HydrophobicContact CB-CD1 4.44Å; L49-L66 HydrophobicContact CB-CD2 3.45Å; L49-L66 VanDerWaalsContact CB-CD2 3.45Å; L49-L66 HydrophobicContact CB-CG 4.09Å; L49-L66 HydrophobicContact CD1-CD2 4.41Å; W50-L66 HydrophobicContact CB-CD1 4.4Å; W50-L66 HydrophobicContact CB-CD2 4.35Å; L53-L66 HydrophobicContact CD1-CD1 4.1Å; G63-L66 WeakPolarHBondContact O-CB 3.46Å; L66-C70 WeakPolarHBondContact O-CB 3.48Å; L66-C70 PolarHBondContact O-N 2.74Å; L66-C70 VanDerWaalsContact O-N 3.17Å; L66-C70 PolarHBondContact O-SG 3.01Å
67	L	60.2	Low	57.7	Low	100 Å²	100	43.8 Å²	43.8	52%	0.524	28%	0.28	S	S	.	.	H	α-helix	trans	-68.6	-51.6	-179	-161.3	80.3	0	0	0	113.2	L46 L69 C70 L71	L46-L67 HydrophobicContact CD1-CB 4.43Å; L46-L67 HydrophobicContact CD1-CD1 3.91Å; L46-L67 HydrophobicContact CD2-CD1 4.26Å; L67-L69 PolarHBondContact O-N 2.93Å; L67-C70 PolarHBondContact O-N 3.43Å; L67-L71 HydrophobicContact CD1-CD1 3.57Å; L67-L71 HydrophobicContact CG-CD1 3.99Å; L67-L71 WeakPolarHBondContact O-CB 3.12Å; L67-L71 PolarHBondContact O-N 2.68Å
68	P	57.7	Low	58	Low	32 Å²	32	41.9 Å²	41.9	21%	0.208	26%	0.256	C	S	.	.	H	α-helix	trans	-66.7	-35.7	177	24.3	-32.4	0	0	0	112.4	T64 L65 C70 A72	T64-P68 VanDerWaalsContact O-CD 3.27Å; T64-P68 WeakPolarHBondContact O-CD 3.47Å; L65-P68 WeakPolarHBondContact O-CD 3.34Å; L65-P68 WeakPolarHBondContact O-CG 3.07Å; P68-C70 PolarHBondContact O-N 2.82Å; P68-A72 WeakPolarHBondContact O-CB 3.35Å; P68-A72 PolarHBondContact O-N 2.89Å
69	L	61.4	Low	57.9	Low	12 Å²	12	41.9 Å²	41.9	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-39.7	178.4	-171.4	73.8	0	0	0	112.7	L12 D16 L65 L67 Y106 A109	L12-L69 HydrophobicContact CD2-CD2 3.92Å; L12-L69 HydrophobicContact CG-CD2 4.43Å; D16-L69 WeakPolarHBondContact OD2-CD2 3.43Å; L65-L69 WeakPolarHBondContact O-CB 3.5Å; L65-L69 PolarHBondContact O-N 2.67Å; L65-L69 VanDerWaalsContact O-N 3.15Å; L67-L69 PolarHBondContact O-N 2.93Å; L69-Y106 HydrophobicContact CD1-CD1 3.65Å; L69-Y106 HydrophobicContact CD1-CE1 3.85Å; L69-A109 HydrophobicContact CB-CB 4.28Å; L69-A109 HydrophobicContact CD1-CB 3.58Å
70	C	62.5	Low	57.6	Low	1 Å²	1	46.9 Å²	46.9	1%	0.007	27%	0.27	C	S	.	.	H	α-helix	trans	-88.7	-28.5	-175.6	-60.3	0	0	0	0	113.6	L46 L66 L67 P68	L46-C70 HydrophobicContact CB-CB 4.14Å; L46-C70 HydrophobicContact CD1-CB 4.01Å; L66-C70 WeakPolarHBondContact O-CB 3.48Å; L66-C70 PolarHBondContact O-N 2.74Å; L66-C70 VanDerWaalsContact O-N 3.17Å; L66-C70 PolarHBondContact O-SG 3.01Å; L67-C70 PolarHBondContact O-N 3.43Å; P68-C70 PolarHBondContact O-N 2.82Å
71	L	63.8	Low	57.7	Low	35 Å²	35	46.3 Å²	46.3	18%	0.183	26%	0.258	C	S	.	.	H	α-helix	trans	-111.5	-12.1	-170.8	-62.3	172.4	0	0	0	114.6	W39 L67 T73 P74 L75	W39-L71 HydrophobicContact CE3-CD2 4.15Å; W39-L71 HydrophobicContact CZ3-CD2 4.03Å; L67-L71 HydrophobicContact CD1-CD1 3.57Å; L67-L71 HydrophobicContact CG-CD1 3.99Å; L67-L71 WeakPolarHBondContact O-CB 3.12Å; L67-L71 PolarHBondContact O-N 2.68Å; L71-T73 VanDerWaalsContact C-N 3.35Å; L71-T73 PolarHBondContact O-N 3.45Å; L71-P74 HydrophobicContact CD2-CG 4.33Å; L71-P74 VanDerWaalsContact O-CD 3.3Å; L71-P74 WeakPolarHBondContact O-CD 3.45Å; L71-P74 WeakPolarHBondContact O-CG 3.4Å; L71-L75 WeakPolarHBondContact O-CB 3.43Å; L71-L75 PolarHBondContact O-N 2.86Å
72	A	62.2	Low	57.6	Low	28 Å²	28	47.6 Å²	47.6	23%	0.231	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-35.9	178.9	0	0	0	0	0	113.1	P68 T76	P68-A72 WeakPolarHBondContact O-CB 3.35Å; P68-A72 PolarHBondContact O-N 2.89Å; A72-T76 WeakPolarHBondContact O-CB 3.33Å; A72-T76 WeakPolarHBondContact O-CG2 3.49Å; A72-T76 PolarHBondContact O-N 3.24Å; A72-T76 PolarHBondContact O-OG1 2.89Å
73	T	59.6	Low	57.2	Low	30 Å²	30	52.1 Å²	52.1	18%	0.184	30%	0.297	C	S	.	.	H	α-helix	trans	-70.2	-47.7	178.1	46.9	0	0	0	0	113.2	L71 L75 T76 V77	L71-T73 VanDerWaalsContact C-N 3.35Å; L71-T73 PolarHBondContact O-N 3.45Å; T73-L75 VanDerWaalsContact C-N 3.33Å; T73-L75 PolarHBondContact O-N 3.21Å; T73-T76 PolarHBondContact O-OG1 2.88Å; T73-V77 VanDerWaalsContact O-CG2 3.31Å; T73-V77 WeakPolarHBondContact O-CG2 3.46Å; T73-V77 PolarHBondContact O-N 3.32Å; T73-V77 VanDerWaalsContact O-N 3.16Å
74	P	62.4	Low	56.8	Low	1 Å²	1	53.1 Å²	53.1	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-33.5	173.5	23.9	-32.9	0	0	0	112.5	L38 W39 L71 S78	L38-P74 HydrophobicContact CB-CB 4.41Å; L38-P74 HydrophobicContact CD2-CB 4.33Å; W39-P74 HydrophobicContact CD2-CB 4.33Å; W39-P74 HydrophobicContact CG-CB 4.4Å; L71-P74 HydrophobicContact CD2-CG 4.33Å; L71-P74 VanDerWaalsContact O-CD 3.3Å; L71-P74 WeakPolarHBondContact O-CD 3.45Å; L71-P74 WeakPolarHBondContact O-CG 3.4Å; P74-S78 VanDerWaalsContact O-CB 3.28Å; P74-S78 WeakPolarHBondContact O-CB 3.39Å; P74-S78 PolarHBondContact O-N 3.41Å; P74-S78 PolarHBondContact O-OG 2.91Å
75	L	59.6	Low	56.4	Low	88 Å²	88	53.8 Å²	53.8	46%	0.461	32%	0.321	S	S	.	.	H	α-helix	trans	-67.4	-44.4	177.7	-164.5	99.8	0	0	0	112.1	W39 L71 T73 S78 L79	W39-L75 HydrophobicContact CH2-CD1 4.1Å; W39-L75 HydrophobicContact CZ2-CD1 4.35Å; L71-L75 WeakPolarHBondContact O-CB 3.43Å; L71-L75 PolarHBondContact O-N 2.86Å; T73-L75 VanDerWaalsContact C-N 3.33Å; T73-L75 PolarHBondContact O-N 3.21Å; L75-S78 PolarHBondContact O-N 3.15Å; L75-L79 HydrophobicContact CD2-CD1 4.13Å; L75-L79 HydrophobicContact CG-CD1 3.98Å; L75-L79 WeakPolarHBondContact O-CB 3.42Å; L75-L79 WeakPolarHBondContact O-CD1 3.39Å; L75-L79 PolarHBondContact O-N 3.32Å
76	T	58.7	Low	56.1	Low	80 Å²	80	58.3 Å²	58.3	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-67.4	-37.2	178.5	48.7	0	0	0	0	112.7	A72 T73 R80	A72-T76 WeakPolarHBondContact O-CB 3.33Å; A72-T76 WeakPolarHBondContact O-CG2 3.49Å; A72-T76 PolarHBondContact O-N 3.24Å; A72-T76 PolarHBondContact O-OG1 2.89Å; T73-T76 PolarHBondContact O-OG1 2.88Å; T76-R80 VanDerWaalsContact O-CB 3.28Å; T76-R80 WeakPolarHBondContact O-CB 3.27Å; T76-R80 PolarHBondContact O-N 3.1Å
77	V	60	Low	55	Low	25 Å²	25	63 Å²	63	15%	0.152	39%	0.393	C	S	.	.	H	α-helix	trans	-68.9	-39.5	174.2	174.8	0	0	0	0	111	L35 T73 R80 A81 P90	L35-V77 HydrophobicContact CD2-CG1 4.41Å; T73-V77 VanDerWaalsContact O-CG2 3.31Å; T73-V77 WeakPolarHBondContact O-CG2 3.46Å; T73-V77 PolarHBondContact O-N 3.32Å; T73-V77 VanDerWaalsContact O-N 3.16Å; V77-R80 PolarHBondContact O-N 3.37Å; V77-A81 WeakPolarHBondContact O-CB 3.48Å; V77-A81 PolarHBondContact O-N 3.26Å; V77-P90 HydrophobicContact CG1-CB 3.99Å
78	S	59.2	Low	54.1	Low	29 Å²	29	69.8 Å²	69.8	20%	0.203	41%	0.411	C	S	.	.	H	α-helix	trans	-65	-43.6	174.7	-56.6	0	0	0	0	111.7	L35 W39 P74 L75 L82	L35-S78 WeakPolarHBondContact CD2-OG 3.33Å; W39-S78 PolarHBondContact NE1-OG 3.34Å; W39-S78 VanDerWaalsContact NE1-OG 3.13Å; P74-S78 VanDerWaalsContact O-CB 3.28Å; P74-S78 WeakPolarHBondContact O-CB 3.39Å; P74-S78 PolarHBondContact O-N 3.41Å; P74-S78 PolarHBondContact O-OG 2.91Å; L75-S78 PolarHBondContact O-N 3.15Å; S78-L82 PolarHBondContact O-N 2.82Å
79	L	52.3	Low	53.5	Low	69 Å²	69	73 Å²	73	36%	0.361	44%	0.44	S	S	.	.	H	α-helix	trans	-62.2	-43.1	175.3	-108.4	101	0	0	0	111.9	L75 L82 V83 L294	L75-L79 HydrophobicContact CD2-CD1 4.13Å; L75-L79 HydrophobicContact CG-CD1 3.98Å; L75-L79 WeakPolarHBondContact O-CB 3.42Å; L75-L79 WeakPolarHBondContact O-CD1 3.39Å; L75-L79 PolarHBondContact O-N 3.32Å; L79-L82 WeakPolarHBondContact O-CB 3.46Å; L79-L82 PolarHBondContact O-N 3.31Å; L79-V83 WeakPolarHBondContact O-CB 3.39Å; L79-V83 VanDerWaalsContact O-CG2 3.27Å; L79-V83 WeakPolarHBondContact O-CG2 3.38Å; L79-V83 PolarHBondContact O-N 3.31Å; L79-L294 HydrophobicContact CD2-CD2 3.58Å; L79-L294 HydrophobicContact CD2-CG 4.37Å; L79-L294 HydrophobicContact CG-CD2 3.98Å
80	R	49.3	Very low	52.9	Low	170 Å²	170	76.2 Å²	76.2	64%	0.642	46%	0.462	S	S	*	.	H	α-helix	trans	-70.7	-35.8	-177.6	-158.7	175.8	-165.9	163.1	3.7	112.2	T76 V77 L82 V83 A84	T76-R80 VanDerWaalsContact O-CB 3.28Å; T76-R80 WeakPolarHBondContact O-CB 3.27Å; T76-R80 PolarHBondContact O-N 3.1Å; V77-R80 PolarHBondContact O-N 3.37Å; R80-L82 PolarHBondContact O-N 2.85Å; R80-V83 PolarHBondContact O-N 3.01Å; R80-A84 PolarHBondContact O-N 3.01Å
81	A	52.8	Low	52.3	Low	61 Å²	61	78.8 Å²	78.8	50%	0.504	48%	0.479	S	S	.	.	H	α-helix	trans	-65.4	-28.4	171.8	0	0	0	0	0	112.7	V77	V77-A81 WeakPolarHBondContact O-CB 3.48Å; V77-A81 PolarHBondContact O-N 3.26Å
82	L	48.4	Very low	51.8	Low	136 Å²	136	79.9 Å²	79.9	71%	0.712	49%	0.492	S	S	*	.	H	α-helix	trans	-81.1	-31	176.1	-131.2	95.8	0	0	0	113.5	S78 L79 R80	S78-L82 PolarHBondContact O-N 2.82Å; L79-L82 WeakPolarHBondContact O-CB 3.46Å; L79-L82 PolarHBondContact O-N 3.31Å; R80-L82 PolarHBondContact O-N 2.85Å
83	V	44.2	Very low	51.6	Low	101 Å²	101	82.1 Å²	82.1	61%	0.612	50%	0.495	S	S	*	.	H	α-helix	trans	-93.3	-38.6	-173.9	171.1	0	0	0	0	112.8	L79 R80	L79-V83 WeakPolarHBondContact O-CB 3.39Å; L79-V83 VanDerWaalsContact O-CG2 3.27Å; L79-V83 WeakPolarHBondContact O-CG2 3.38Å; L79-V83 PolarHBondContact O-N 3.31Å; R80-V83 PolarHBondContact O-N 3.01Å
84	A	46.4	Very low	51.4	Low	48 Å²	48	81.5 Å²	81.5	40%	0.397	49%	0.491	S	S	.	.	S	Bend	trans	-109.7	93.2	-178.7	0	0	0	0	0	109.1	R80 A86	R80-A84 PolarHBondContact O-N 3.01Å; A84-A86 PolarHBondContact O-N 2.88Å
85	G	47.8	Very low	50.9	Low	71 Å²	71	81.8 Å²	81.8	73%	0.732	49%	0.494	S	S	*	.			trans	-51.9	110.2	167.7	0	0	0	0	0	109.8
86	A	47.3	Very low	50.7	Low	102 Å²	102	81.4 Å²	81.4	84%	0.843	50%	0.498	S	S	*	.	S	Bend	trans	41.8	95.2	169.5	0	0	0	0	0	118.1	A84	A84-A86 PolarHBondContact O-N 2.88Å
87	S	39.2	Very low	50.7	Low	105 Å²	105	78.4 Å²	78.4	73%	0.734	48%	0.482	S	S	*	.	S	Bend	trans	-165.2	70.8	150.6	45.1	0	0	0	0	113.9
88	R	42.4	Very low	50.7	Low	242 Å²	242	80.9 Å²	80.9	91%	0.913	50%	0.498	S	S	*	.	S	Bend	trans	140.7	123.9	155.5	-83.2	173.2	175.4	176.7	-0.2	109.1
89	A	43.8	Very low	50.6	Low	98 Å²	98	88.8 Å²	88.8	81%	0.81	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-53.8	125.1	178.6	0	0	0	0	0	110
90	P	48.6	Very low	50.6	Low	81 Å²	81	89 Å²	89	53%	0.526	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-62.5	148	173	26.6	-31.8	0	0	0	108.9	V77 A92	V77-P90 HydrophobicContact CG1-CB 3.99Å; P90-A92 PolarHBondContact O-N 2.89Å
91	P	50.3	Low	51	Low	55 Å²	55	86.7 Å²	86.7	36%	0.357	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-57.5	131.3	171.7	24.7	-31.7	0	0	0	108.7	R93	P91-R93 PolarHBondContact O-N 3.49Å; P91-R93 VanDerWaalsContact O-N 3.08Å
92	A	54	Low	51.2	Low	57 Å²	57	85.1 Å²	85.1	47%	0.471	51%	0.505	S	S	.	.	S	Bend	trans	-65.5	-12.8	-172.6	0	0	0	0	0	114	P90	P90-A92 PolarHBondContact O-N 2.89Å
93	R	57.6	Low	51.6	Low	75 Å²	75	84 Å²	84	28%	0.283	50%	0.499	S	S	.	.			trans	-148.9	147.3	179.3	-62.7	-176.5	180	161.6	-0.6	111.6	G28 P91 S96	G28-R93 VanDerWaalsContact O-CZ 3.24Å; G28-R93 PolarHBondContact O-NH2 3.33Å; P91-R93 PolarHBondContact O-N 3.49Å; P91-R93 VanDerWaalsContact O-N 3.08Å; R93-S96 PolarHBondContact O-OG 2.9Å
94	V	54.4	Low	52.2	Low	17 Å²	17	84 Å²	84	10%	0.103	50%	0.5	C	S	.	.	S	Bend	trans	-70.8	-37.9	173	179.1	0	0	0	0	110.1	L20 L38 E41 S96 A97	L20-V94 HydrophobicContact CD2-CG1 4.49Å; L38-V94 HydrophobicContact CD2-CG2 3.4Å; L38-V94 HydrophobicContact CG-CG2 4.29Å; E41-V94 PolarHBondContact OE2-N 2.58Å; E41-V94 VanDerWaalsContact OE2-N 3.12Å; V94-S96 VanDerWaalsContact C-N 3.26Å; V94-S96 PolarHBondContact O-N 3.24Å; V94-A97 WeakPolarHBondContact O-CB 3.37Å; V94-A97 PolarHBondContact O-N 3.5Å
95	A	53.3	Low	52.7	Low	8 Å²	8	82.5 Å²	82.5	7%	0.066	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.7	177	0	0	0	0	0	114.6	Q24 E41	Q24-A95 HydrophobicContact CG-CB 3.76Å; Q24-A95 PolarHBondContact NE2-O 3.21Å; E41-A95 VanDerWaalsContact OE1-CB 3.3Å; E41-A95 WeakPolarHBondContact OE1-CB 3.07Å; E41-A95 PolarHBondContact OE1-N 3.06Å
96	S	54.1	Low	53.3	Low	79 Å²	79	80.6 Å²	80.6	55%	0.552	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	9.8	179.6	64	0	0	0	0	113.9	R93 V94	R93-S96 PolarHBondContact O-OG 2.9Å; V94-S96 VanDerWaalsContact C-N 3.26Å; V94-S96 PolarHBondContact O-N 3.24Å
97	A	58.8	Low	53.8	Low	17 Å²	17	77.5 Å²	77.5	14%	0.14	44%	0.437	C	S	.	.	S	Bend	trans	-73.7	141.9	-178.8	0	0	0	0	0	111.3	V94 W101	V94-A97 WeakPolarHBondContact O-CB 3.37Å; V94-A97 PolarHBondContact O-N 3.5Å; A97-W101 HydrophobicContact CB-CB 4.21Å
98	P	61	Low	54.7	Low	77 Å²	77	74.7 Å²	74.7	50%	0.5	42%	0.421	S	S	.	.			trans	-61.1	147.3	175.7	19.8	-26.4	0	0	0	111	S100 W101	P98-S100 PolarHBondContact O-N 3.15Å; P98-W101 PolarHBondContact O-N 3.42Å
99	W	57	Low	55.3	Low	196 Å²	196	63.3 Å²	63.3	74%	0.742	38%	0.378	S	S	*	.	H	α-helix	trans	-50.5	-27.7	-174.8	-89.2	91.3	0	0	0	114.8	W101 L102 L103	W99-W101 VanDerWaalsContact C-N 3.31Å; W99-W101 PolarHBondContact O-N 3.25Å; W99-L102 PolarHBondContact O-N 2.81Å; W99-L103 PolarHBondContact O-N 3.45Å
100	S	52	Low	55.8	Low	72 Å²	72	59.5 Å²	59.5	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-33.9	174.4	52.4	0	0	0	0	113.8	P98 V104	P98-S100 PolarHBondContact O-N 3.15Å; S100-V104 WeakPolarHBondContact O-CG2 3.15Å; S100-V104 PolarHBondContact O-N 3.18Å
101	W	56.7	Low	56.1	Low	123 Å²	123	61.5 Å²	61.5	47%	0.466	35%	0.354	S	S	.	.	H	α-helix	trans	-78.5	-37.1	177.7	-81.8	76.5	0	0	0	112.8	A97 P98 W99 L103 V104 G105	A97-W101 HydrophobicContact CB-CB 4.21Å; P98-W101 PolarHBondContact O-N 3.42Å; W99-W101 VanDerWaalsContact C-N 3.31Å; W99-W101 PolarHBondContact O-N 3.25Å; W101-L103 VanDerWaalsContact C-N 3.32Å; W101-V104 PolarHBondContact O-N 3.37Å; W101-G105 PolarHBondContact O-N 3.36Å
102	L	58.3	Low	56.3	Low	27 Å²	27	61.3 Å²	61.3	14%	0.141	35%	0.354	C	S	.	.	H	α-helix	trans	-62.7	-42	173.4	-73.7	167.4	0	0	0	110.4	L20 W99 V104 G105 Y106	L20-L102 HydrophobicContact CD1-CD2 3.97Å; W99-L102 PolarHBondContact O-N 2.81Å; L102-V104 VanDerWaalsContact C-N 3.34Å; L102-V104 PolarHBondContact O-N 2.93Å; L102-G105 PolarHBondContact O-N 3.15Å; L102-Y106 HydrophobicContact CB-CD2 4.21Å; L102-Y106 HydrophobicContact CB-CE2 3.91Å; L102-Y106 HydrophobicContact CD2-CE2 4.4Å; L102-Y106 WeakPolarHBondContact O-CB 3.46Å; L102-Y106 WeakPolarHBondContact O-CD2 3.21Å; L102-Y106 PolarHBondContact O-N 3.29Å
103	L	56.9	Low	56.4	Low	113 Å²	113	60.2 Å²	60.2	59%	0.592	34%	0.338	S	S	*	.	H	α-helix	trans	-59.4	-38.7	174.1	-86.1	157.3	0	0	0	113.3	W99 W101 G107	W99-L103 PolarHBondContact O-N 3.45Å; W101-L103 VanDerWaalsContact C-N 3.32Å; L103-G107 PolarHBondContact O-N 2.91Å
104	V	56	Low	56.1	Low	102 Å²	102	59 Å²	59	62%	0.618	34%	0.341	S	S	*	.	H	α-helix	trans	-68.6	-40	175	172.9	0	0	0	0	111.4	S100 W101 L102 G107 A108	S100-V104 WeakPolarHBondContact O-CG2 3.15Å; S100-V104 PolarHBondContact O-N 3.18Å; W101-V104 PolarHBondContact O-N 3.37Å; L102-V104 VanDerWaalsContact C-N 3.34Å; L102-V104 PolarHBondContact O-N 2.93Å; V104-G107 PolarHBondContact O-N 2.89Å; V104-A108 WeakPolarHBondContact O-CB 3.45Å; V104-A108 PolarHBondContact O-N 2.91Å
105	G	56.5	Low	55.9	Low	16 Å²	16	62.1 Å²	62.1	17%	0.165	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-44.3	174.5	0	0	0	0	0	112.9	W101 L102 G107 A108 A109	W101-G105 PolarHBondContact O-N 3.36Å; L102-G105 PolarHBondContact O-N 3.15Å; G105-G107 VanDerWaalsContact C-N 3.35Å; G105-A108 PolarHBondContact O-N 3.2Å; G105-A109 WeakPolarHBondContact O-CB 3.37Å; G105-A109 PolarHBondContact O-N 3.43Å
106	Y	61.8	Low	56	Low	31 Å²	31	66.5 Å²	66.5	12%	0.122	37%	0.371	C	S	.	.	H	α-helix	trans	-66.7	-35.4	174.3	-67	-51.6	0	0	0	112.3	L13 D16 L69 L102 G110	L13-Y106 HydrophobicContact CD2-CD1 3.17Å; L13-Y106 HydrophobicContact CD2-CE1 3.25Å; L13-Y106 HydrophobicContact CD2-CG 3.89Å; D16-Y106 WeakPolarHBondContact OD2-CE1 3.39Å; D16-Y106 PolarHBondContact OD2-OH 3.38Å; L69-Y106 HydrophobicContact CD1-CD1 3.65Å; L69-Y106 HydrophobicContact CD1-CE1 3.85Å; L102-Y106 HydrophobicContact CB-CD2 4.21Å; L102-Y106 HydrophobicContact CB-CE2 3.91Å; L102-Y106 HydrophobicContact CD2-CE2 4.4Å; L102-Y106 WeakPolarHBondContact O-CB 3.46Å; L102-Y106 WeakPolarHBondContact O-CD2 3.21Å; L102-Y106 PolarHBondContact O-N 3.29Å; Y106-G110 PolarHBondContact O-N 3.46Å
107	G	57.7	Low	55.9	Low	36 Å²	36	64.4 Å²	64.4	37%	0.371	36%	0.359	S	S	.	.	H	α-helix	trans	-65.4	-42.4	172.4	0	0	0	0	0	112.7	L103 V104 G105 G110 L111	L103-G107 PolarHBondContact O-N 2.91Å; V104-G107 PolarHBondContact O-N 2.89Å; G105-G107 VanDerWaalsContact C-N 3.35Å; G107-G110 PolarHBondContact O-N 3.48Å; G107-L111 WeakPolarHBondContact O-CB 3.38Å; G107-L111 WeakPolarHBondContact O-CG 3.19Å; G107-L111 PolarHBondContact O-N 3.15Å
108	A	57.6	Low	55.5	Low	47 Å²	47	68.4 Å²	68.4	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-68.3	-39.8	175.8	0	0	0	0	0	112.4	V104 G105 L111 S112	V104-A108 WeakPolarHBondContact O-CB 3.45Å; V104-A108 PolarHBondContact O-N 2.91Å; G105-A108 PolarHBondContact O-N 3.2Å; A108-L111 PolarHBondContact O-N 3.14Å; A108-S112 WeakPolarHBondContact O-CB 3.32Å; A108-S112 PolarHBondContact O-N 2.61Å
109	A	54.9	Low	54.8	Low	2 Å²	2	66.8 Å²	66.8	2%	0.017	37%	0.368	C	S	.	.	H	α-helix	trans	-67.2	-37.5	173.1	0	0	0	0	0	111.8	L69 G105 S112 W113	L69-A109 HydrophobicContact CB-CB 4.28Å; L69-A109 HydrophobicContact CD1-CB 3.58Å; G105-A109 WeakPolarHBondContact O-CB 3.37Å; G105-A109 PolarHBondContact O-N 3.43Å; A109-S112 PolarHBondContact O-N 3.37Å; A109-W113 VanDerWaalsContact O-CB 3.31Å; A109-W113 WeakPolarHBondContact O-CB 3.48Å; A109-W113 PolarHBondContact O-N 2.66Å
110	G	54	Low	54.3	Low	18 Å²	18	59.9 Å²	59.9	19%	0.186	35%	0.349	C	S	.	.	H	α-helix	trans	-65.3	-39.9	173	0	0	0	0	0	112.8	Y106 G107 W113 S114	Y106-G110 PolarHBondContact O-N 3.46Å; G107-G110 PolarHBondContact O-N 3.48Å; G110-W113 PolarHBondContact O-N 3.4Å; G110-S114 WeakPolarHBondContact O-CB 3.47Å; G110-S114 PolarHBondContact O-N 2.94Å; G110-S114 PolarHBondContact O-OG 2.78Å
111	L	55.2	Low	54.1	Low	124 Å²	124	59.7 Å²	59.7	65%	0.649	35%	0.347	S	S	*	.	H	α-helix	trans	-68	-41.4	172.5	-81.7	164.4	0	0	0	112	G107 A108 W113 S114 L115	G107-L111 WeakPolarHBondContact O-CB 3.38Å; G107-L111 WeakPolarHBondContact O-CG 3.19Å; G107-L111 PolarHBondContact O-N 3.15Å; A108-L111 PolarHBondContact O-N 3.14Å; L111-W113 VanDerWaalsContact C-N 3.29Å; L111-W113 PolarHBondContact O-N 2.85Å; L111-S114 WeakPolarHBondContact CA-OG 3.3Å; L111-S114 PolarHBondContact O-N 3.23Å; L111-S114 PolarHBondContact O-OG 3.08Å; L111-L115 VanDerWaalsContact O-CB 3.26Å; L111-L115 WeakPolarHBondContact O-CB 3.36Å; L111-L115 PolarHBondContact O-N 2.98Å
112	S	54.6	Low	53.1	Low	51 Å²	51	59.6 Å²	59.6	36%	0.357	36%	0.362	S	S	.	.	H	α-helix	trans	-64.5	-35.7	174	-175.3	0	0	0	0	111.7	A108 A109 W116	A108-S112 WeakPolarHBondContact O-CB 3.32Å; A108-S112 PolarHBondContact O-N 2.61Å; A109-S112 PolarHBondContact O-N 3.37Å; S112-W116 VanDerWaalsContact O-CB 3.24Å; S112-W116 WeakPolarHBondContact O-CB 2.99Å; S112-W116 PolarHBondContact O-N 2.97Å
113	W	56.3	Low	52.4	Low	34 Å²	34	60.4 Å²	60.4	13%	0.129	38%	0.376	C	S	.	.	H	α-helix	trans	-73.7	-41.1	175.2	177.3	72.4	0	0	0	112.2	P4 L65 A109 G110 L111 L115 W116 A117	P4-W113 HydrophobicContact CB-CH2 3.9Å; P4-W113 HydrophobicContact CB-CZ2 4.36Å; P4-W113 HydrophobicContact CG-CH2 3.6Å; P4-W113 HydrophobicContact CG-CZ2 4.43Å; P4-W113 HydrophobicContact CG-CZ3 4.22Å; L65-W113 HydrophobicContact CD1-CG 3.87Å; L65-W113 HydrophobicContact CD2-CB 3.71Å; L65-W113 HydrophobicContact CD2-CG 3.88Å; L65-W113 HydrophobicContact CG-CB 4.03Å; L65-W113 VanDerWaalsContact CG-CD1 3.46Å; L65-W113 HydrophobicContact CG-CG 3.88Å; A109-W113 VanDerWaalsContact O-CB 3.31Å; A109-W113 WeakPolarHBondContact O-CB 3.48Å; A109-W113 PolarHBondContact O-N 2.66Å; G110-W113 PolarHBondContact O-N 3.4Å; L111-W113 VanDerWaalsContact C-N 3.29Å; L111-W113 PolarHBondContact O-N 2.85Å; W113-L115 VanDerWaalsContact C-N 3.29Å; W113-L115 PolarHBondContact O-N 3.46Å; W113-W116 CarbonylContact O-C 3.57Å; W113-W116 PolarHBondContact O-N 2.84Å; W113-A117 WeakPolarHBondContact O-CB 3.4Å; W113-A117 PolarHBondContact O-N 2.63Å
114	S	50.1	Low	51.7	Low	50 Å²	50	58.6 Å²	58.6	35%	0.35	38%	0.378	S	S	.	.	H	α-helix	trans	-65.2	-38.1	174.9	68	0	0	0	0	110.8	G110 L111 V118	G110-S114 WeakPolarHBondContact O-CB 3.47Å; G110-S114 PolarHBondContact O-N 2.94Å; G110-S114 PolarHBondContact O-OG 2.78Å; L111-S114 WeakPolarHBondContact CA-OG 3.3Å; L111-S114 PolarHBondContact O-N 3.23Å; L111-S114 PolarHBondContact O-OG 3.08Å; S114-V118 WeakPolarHBondContact O-CB 3.35Å; S114-V118 WeakPolarHBondContact O-CG2 3.34Å; S114-V118 PolarHBondContact O-N 3.04Å
115	L	51.6	Low	50.6	Low	82 Å²	82	61.9 Å²	61.9	43%	0.429	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-49.6	169.7	-145.9	86.6	0	0	0	110.3	L111 W113 A117 V118 L119	L111-L115 VanDerWaalsContact O-CB 3.26Å; L111-L115 WeakPolarHBondContact O-CB 3.36Å; L111-L115 PolarHBondContact O-N 2.98Å; W113-L115 VanDerWaalsContact C-N 3.29Å; W113-L115 PolarHBondContact O-N 3.46Å; L115-A117 PolarHBondContact O-N 3.03Å; L115-V118 PolarHBondContact O-N 2.8Å; L115-L119 HydrophobicContact CB-CD1 4.46Å; L115-L119 HydrophobicContact CD2-CD1 4.07Å; L115-L119 HydrophobicContact CG-CD1 4.04Å; L115-L119 VanDerWaalsContact O-CB 3.23Å; L115-L119 WeakPolarHBondContact O-CB 3.32Å; L115-L119 VanDerWaalsContact O-CD1 3.24Å; L115-L119 WeakPolarHBondContact O-CD1 3.49Å; L115-L119 WeakPolarHBondContact O-CG 3.31Å; L115-L119 PolarHBondContact O-N 3.3Å
116	W	55.2	Low	49.9	Very low	100 Å²	100	68.9 Å²	68.9	38%	0.379	42%	0.415	S	S	.	.	H	α-helix	trans	-65	-38.2	-179.8	-172.7	77.2	0	0	0	113.2	T64 S112 W113 L119 S120	T64-W116 HydrophobicContact CG2-CD2 4.32Å; T64-W116 HydrophobicContact CG2-CH2 3.6Å; T64-W116 HydrophobicContact CG2-CZ2 3.16Å; T64-W116 HydrophobicContact CG2-CZ3 4.33Å; T64-W116 VanDerWaalsContact OG1-CE3 3.23Å; T64-W116 WeakPolarHBondContact OG1-CH2 3.43Å; T64-W116 WeakPolarHBondContact OG1-CZ2 3.41Å; T64-W116 WeakPolarHBondContact OG1-CZ3 3.26Å; S112-W116 VanDerWaalsContact O-CB 3.24Å; S112-W116 WeakPolarHBondContact O-CB 2.99Å; S112-W116 PolarHBondContact O-N 2.97Å; W113-W116 CarbonylContact O-C 3.57Å; W113-W116 PolarHBondContact O-N 2.84Å; W116-L119 CarbonylContact O-C 3.52Å; W116-L119 WeakPolarHBondContact O-CA 3.46Å; W116-L119 WeakPolarHBondContact O-CB 3.42Å; W116-L119 PolarHBondContact O-N 3.37Å; W116-L119 VanDerWaalsContact O-N 3.15Å; W116-S120 PolarHBondContact O-N 3.35Å; W116-S120 PolarHBondContact O-OG 3.15Å
117	A	50.8	Low	49.2	Very low	35 Å²	35	71.9 Å²	71.9	29%	0.289	43%	0.429	S	S	.	.	H	α-helix	trans	-69.1	-36.1	177.4	0	0	0	0	0	112	W113 L115 L119 S120	W113-A117 WeakPolarHBondContact O-CB 3.4Å; W113-A117 PolarHBondContact O-N 2.63Å; L115-A117 PolarHBondContact O-N 3.03Å; A117-L119 VanDerWaalsContact C-N 3.34Å; A117-S120 WeakPolarHBondContact CA-OG 3.42Å; A117-S120 PolarHBondContact O-OG 3.09Å
118	V	51	Low	48.7	Very low	101 Å²	101	76.3 Å²	76.3	61%	0.612	44%	0.44	S	S	*	.	H	α-helix	trans	-71.9	-30.8	169.7	171.2	0	0	0	0	111.2	S114 L115 V309	S114-V118 WeakPolarHBondContact O-CB 3.35Å; S114-V118 WeakPolarHBondContact O-CG2 3.34Å; S114-V118 PolarHBondContact O-N 3.04Å; L115-V118 PolarHBondContact O-N 2.8Å; V118-V309 HydrophobicContact CG1-CG2 3.89Å
119	L	46.2	Very low	48.2	Very low	42 Å²	42	81.6 Å²	81.6	22%	0.22	46%	0.456	C	S	.	.	H	α-helix	trans	-80.4	-18.7	176.3	-70.2	161.9	0	0	0	113	L115 W116 A117 A305 K308	L115-L119 HydrophobicContact CB-CD1 4.46Å; L115-L119 HydrophobicContact CD2-CD1 4.07Å; L115-L119 HydrophobicContact CG-CD1 4.04Å; L115-L119 VanDerWaalsContact O-CB 3.23Å; L115-L119 WeakPolarHBondContact O-CB 3.32Å; L115-L119 VanDerWaalsContact O-CD1 3.24Å; L115-L119 WeakPolarHBondContact O-CD1 3.49Å; L115-L119 WeakPolarHBondContact O-CG 3.31Å; L115-L119 PolarHBondContact O-N 3.3Å; W116-L119 CarbonylContact O-C 3.52Å; W116-L119 WeakPolarHBondContact O-CA 3.46Å; W116-L119 WeakPolarHBondContact O-CB 3.42Å; W116-L119 PolarHBondContact O-N 3.37Å; W116-L119 VanDerWaalsContact O-N 3.15Å; A117-L119 VanDerWaalsContact C-N 3.34Å; L119-A305 HydrophobicContact CD2-CB 4.16Å; L119-K308 HydrophobicContact CD2-CB 4.41Å; L119-K308 HydrophobicContact CD2-CD 3.66Å; L119-K308 WeakPolarHBondContact O-CE 3.01Å; L119-K308 PolarHBondContact O-NZ 2.96Å
120	S	45.9	Very low	48.3	Very low	51 Å²	51	86.3 Å²	86.3	36%	0.357	48%	0.481	S	S	.	.	S	Bend	trans	-83.3	121.7	178.1	45.5	0	0	0	0	110.7	W116 A117	W116-S120 PolarHBondContact O-N 3.35Å; W116-S120 PolarHBondContact O-OG 3.15Å; A117-S120 WeakPolarHBondContact CA-OG 3.42Å; A117-S120 PolarHBondContact O-OG 3.09Å
121	P	48.2	Very low	48.4	Very low	69 Å²	69	88.7 Å²	88.7	45%	0.448	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-68.3	141.6	-178.5	26.7	-32	0	0	0	111.4
122	P	37.3	Very low	48.5	Very low	121 Å²	121	87.2 Å²	87.2	79%	0.786	48%	0.483	S	S	*	.	S	Bend	trans	-65.6	135	167.9	27.3	-30.8	0	0	0	109.5
123	G	43.4	Very low	49.2	Very low	43 Å²	43	88.3 Å²	88.3	44%	0.443	49%	0.485	S	S	.	.			trans	100.5	43.9	177	0	0	0	0	0	116.1	Q125	G123-Q125 VanDerWaalsContact C-N 3.29Å; G123-Q125 PolarHBondContact O-N 3.06Å
124	A	41.1	Very low	49.9	Very low	75 Å²	75	87.9 Å²	87.9	62%	0.62	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.1	-179	0	0	0	0	0	114.7
125	Q	33.9	Very low	50.9	Low	172 Å²	172	92.2 Å²	92.2	80%	0.804	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-41.2	-176.6	-78.4	180	-45.4	0	0	114.1	G123 K127 E128	G123-Q125 VanDerWaalsContact C-N 3.29Å; G123-Q125 PolarHBondContact O-N 3.06Å; Q125-K127 VanDerWaalsContact C-N 3.32Å; Q125-E128 PolarHBondContact O-N 3.31Å
126	E	41.4	Very low	52.2	Low	163 Å²	163	92.7 Å²	92.7	76%	0.762	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-33.6	173.8	-82.9	175.9	158.9	0	0	111.8	E128	E126-E128 VanDerWaalsContact C-N 3.29Å; E126-E128 PolarHBondContact O-N 2.77Å
127	K	47.7	Very low	53.4	Low	93 Å²	93	88.7 Å²	88.7	40%	0.404	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-23.2	178	-79.6	178	176.7	171.1	0	114.3	Q125 Q131	Q125-K127 VanDerWaalsContact C-N 3.32Å; K127-Q131 WeakPolarHBondContact O-CB 3.4Å; K127-Q131 WeakPolarHBondContact O-CG 3.4Å; K127-Q131 PolarHBondContact O-N 3.24Å
128	E	45.8	Very low	54.6	Low	129 Å²	129	89.5 Å²	89.5	60%	0.603	49%	0.488	S	S	*	.	H	α-helix	trans	-72.3	-39.3	-176.6	-129.8	172.9	-174.1	0	0	111.5	Q125 E126 Q131 V132	Q125-E128 PolarHBondContact O-N 3.31Å; E126-E128 VanDerWaalsContact C-N 3.29Å; E126-E128 PolarHBondContact O-N 2.77Å; E128-Q131 PolarHBondContact O-N 3Å; E128-V132 WeakPolarHBondContact O-CG2 3.39Å; E128-V132 PolarHBondContact O-N 2.63Å; E128-V132 VanDerWaalsContact O-N 3.15Å
129	Q	47.9	Very low	56	Low	159 Å²	159	92 Å²	92	74%	0.743	49%	0.487	S	S	*	.	H	α-helix	trans	-68	-46.9	176.8	-148.1	106.1	2.5	0	0	111.4	Q131 V132 N133	Q129-Q131 VanDerWaalsContact C-N 3.3Å; Q129-Q131 PolarHBondContact O-N 3Å; Q129-V132 PolarHBondContact O-N 2.82Å; Q129-N133 PolarHBondContact O-N 2.85Å
130	D	55.7	Low	57.8	Low	101 Å²	101	93.9 Å²	93.9	54%	0.54	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-37.8	175.8	-73.3	-17.9	0	0	0	111.5	V132 N133 N134	D130-V132 PolarHBondContact O-N 2.87Å; D130-N133 PolarHBondContact O-N 2.85Å; D130-N134 VanDerWaalsContact O-CB 3.24Å; D130-N134 WeakPolarHBondContact O-CB 3.43Å; D130-N134 PolarHBondContact O-N 2.82Å; D130-N134 PolarHBondContact O-ND2 3.2Å; D130-N134 PolarHBondContact O-OD1 3.23Å
131	Q	56.6	Low	59.3	Low	67 Å²	67	91.8 Å²	91.8	31%	0.313	48%	0.476	S	S	.	.	H	α-helix	trans	-66	-36.2	176.7	-83.1	175.5	10	0	0	113.4	K127 E128 Q129 K135 L434	K127-Q131 WeakPolarHBondContact O-CB 3.4Å; K127-Q131 WeakPolarHBondContact O-CG 3.4Å; K127-Q131 PolarHBondContact O-N 3.24Å; E128-Q131 PolarHBondContact O-N 3Å; Q129-Q131 VanDerWaalsContact C-N 3.3Å; Q129-Q131 PolarHBondContact O-N 3Å; Q131-K135 VanDerWaalsContact O-CG 3.31Å; Q131-K135 WeakPolarHBondContact O-CG 3.2Å; Q131-K135 PolarHBondContact O-N 2.84Å; Q131-K135 VanDerWaalsContact O-N 3.1Å; Q131-L434 HydrophobicContact CG-CD2 3.95Å
132	V	58.8	Low	60.9	Low	93 Å²	93	93.1 Å²	93.1	56%	0.564	48%	0.479	S	S	*	.	H	α-helix	trans	-67.1	-45.8	176.4	173.1	0	0	0	0	110.2	E128 Q129 D130 N134 K135 V136	E128-V132 WeakPolarHBondContact O-CG2 3.39Å; E128-V132 PolarHBondContact O-N 2.63Å; E128-V132 VanDerWaalsContact O-N 3.15Å; Q129-V132 PolarHBondContact O-N 2.82Å; D130-V132 PolarHBondContact O-N 2.87Å; V132-N134 VanDerWaalsContact C-N 3.32Å; V132-N134 PolarHBondContact O-N 2.84Å; V132-K135 PolarHBondContact O-N 3.28Å; V132-V136 PolarHBondContact O-N 2.86Å
133	N	67.7	Low	63.2	Low	74 Å²	74	92.7 Å²	92.7	40%	0.396	47%	0.465	S	S	.	.	H	α-helix	trans	-63.5	-40.4	177.8	-152.9	18	0	0	0	111.3	Q129 D130 K135 V136 L137	Q129-N133 PolarHBondContact O-N 2.85Å; D130-N133 PolarHBondContact O-N 2.85Å; N133-K135 PolarHBondContact O-N 3.21Å; N133-V136 PolarHBondContact O-N 3.38Å; N133-L137 WeakPolarHBondContact O-CG 3.37Å; N133-L137 PolarHBondContact O-N 2.76Å
134	N	71.1	Confident	65	Low	26 Å²	26	91.9 Å²	91.9	14%	0.139	45%	0.45	C	S	.	.	H	α-helix	trans	-61.8	-40.6	177.3	-73.2	-7.6	0	0	0	113.2	D130 V132 V136 L137 M138 L434 V437	D130-N134 VanDerWaalsContact O-CB 3.24Å; D130-N134 WeakPolarHBondContact O-CB 3.43Å; D130-N134 PolarHBondContact O-N 2.82Å; D130-N134 PolarHBondContact O-ND2 3.2Å; D130-N134 PolarHBondContact O-OD1 3.23Å; V132-N134 VanDerWaalsContact C-N 3.32Å; V132-N134 PolarHBondContact O-N 2.84Å; N134-V136 VanDerWaalsContact C-N 3.34Å; N134-V136 PolarHBondContact O-N 2.89Å; N134-L137 PolarHBondContact O-N 3.01Å; N134-M138 WeakPolarHBondContact O-CB 3.49Å; N134-M138 VanDerWaalsContact O-CG 3.25Å; N134-M138 WeakPolarHBondContact O-CG 3.45Å; N134-M138 PolarHBondContact O-N 2.97Å; N134-L434 PolarHBondContact ND2-O 2.65Å; N134-L434 VanDerWaalsContact ND2-O 3.16Å; N134-V437 HydrophobicContact CB-CB 4.28Å; N134-V437 HydrophobicContact CB-CG1 4.15Å; N134-V437 HydrophobicContact CB-CG2 3.98Å; N134-V437 VanDerWaalsContact OD1-CB 3.3Å; N134-V437 WeakPolarHBondContact OD1-CB 3.43Å; N134-V437 WeakPolarHBondContact OD1-CG1 3.22Å
135	K	72.2	Confident	67	Low	141 Å²	141	88.7 Å²	88.7	61%	0.613	42%	0.423	S	S	*	.	H	α-helix	trans	-63	-40.6	176.2	-74.9	172.5	-174.3	175.7	0	112	Q131 V132 N133 M138 W139	Q131-K135 VanDerWaalsContact O-CG 3.31Å; Q131-K135 WeakPolarHBondContact O-CG 3.2Å; Q131-K135 PolarHBondContact O-N 2.84Å; Q131-K135 VanDerWaalsContact O-N 3.1Å; V132-K135 PolarHBondContact O-N 3.28Å; N133-K135 PolarHBondContact O-N 3.21Å; K135-M138 PolarHBondContact O-N 3.39Å; K135-W139 WeakPolarHBondContact O-CB 3.43Å; K135-W139 PolarHBondContact O-N 3.09Å
136	V	78.8	Confident	69.4	Low	91 Å²	91	87.1 Å²	87.1	55%	0.552	41%	0.41	S	S	*	.	H	α-helix	trans	-64	-46.7	177.4	175.8	0	0	0	0	110.5	V132 N133 N134 M138 W139 R140	V132-V136 PolarHBondContact O-N 2.86Å; N133-V136 PolarHBondContact O-N 3.38Å; N134-V136 VanDerWaalsContact C-N 3.34Å; N134-V136 PolarHBondContact O-N 2.89Å; V136-M138 PolarHBondContact O-N 3.32Å; V136-W139 PolarHBondContact O-N 2.97Å; V136-R140 WeakPolarHBondContact O-CB 3.49Å; V136-R140 PolarHBondContact O-N 3.15Å
137	L	78.9	Confident	71.6	Confident	17 Å²	17	83.3 Å²	83.3	9%	0.089	40%	0.399	C	S	.	.	H	α-helix	trans	-60.7	-44.3	177.3	-71.8	160.9	0	0	0	111.8	N133 N134 R140 L141 V437 E441 F444	N133-L137 WeakPolarHBondContact O-CG 3.37Å; N133-L137 PolarHBondContact O-N 2.76Å; N134-L137 PolarHBondContact O-N 3.01Å; L137-R140 WeakPolarHBondContact O-CB 3.49Å; L137-R140 PolarHBondContact O-N 3Å; L137-L141 WeakPolarHBondContact O-CB 3.44Å; L137-L141 PolarHBondContact O-N 2.84Å; L137-V437 HydrophobicContact CB-CG1 3.78Å; L137-V437 HydrophobicContact CD1-CG1 3.49Å; L137-V437 VanDerWaalsContact CD1-CG1 3.49Å; L137-V437 HydrophobicContact CG-CG1 4.25Å; L137-E441 HydrophobicContact CD1-CB 3.9Å; L137-E441 HydrophobicContact CD1-CG 4.19Å; L137-F444 HydrophobicContact CD2-CB 4.31Å; L137-F444 HydrophobicContact CD2-CD2 3.47Å; L137-F444 VanDerWaalsContact CD2-CD2 3.47Å; L137-F444 HydrophobicContact CD2-CE2 4.19Å; L137-F444 HydrophobicContact CD2-CG 4.3Å
138	M	76.4	Confident	73.4	Confident	51 Å²	51	79.2 Å²	79.2	25%	0.251	38%	0.382	S	S	.	.	H	α-helix	trans	-62.4	-44	175.5	-74.2	176.6	60.5	0	0	112.4	N134 K135 V136 R140 L141 L142 W263 M433	N134-M138 WeakPolarHBondContact O-CB 3.49Å; N134-M138 VanDerWaalsContact O-CG 3.25Å; N134-M138 WeakPolarHBondContact O-CG 3.45Å; N134-M138 PolarHBondContact O-N 2.97Å; K135-M138 PolarHBondContact O-N 3.39Å; V136-M138 PolarHBondContact O-N 3.32Å; M138-R140 VanDerWaalsContact C-N 3.29Å; M138-R140 PolarHBondContact O-N 3.06Å; M138-L141 WeakPolarHBondContact O-CB 3.19Å; M138-L141 PolarHBondContact O-N 3.42Å; M138-L142 WeakPolarHBondContact O-CB 3.14Å; M138-L142 PolarHBondContact O-N 3.36Å; M138-W263 HydrophobicContact CG-CH2 4.34Å; M138-W263 HydrophobicContact CG-CZ3 4.29Å; M138-W263 HydrophobicContact SD-CH2 4.49Å; M138-M433 HydrophobicContact CE-CE 3.21Å; M138-M433 HydrophobicContact CE-CG 4.11Å; M138-M433 HydrophobicContact CE-SD 3.7Å; M138-M433 HydrophobicContact SD-CG 4.41Å
139	W	81.3	Confident	75.3	Confident	153 Å²	153	77.5 Å²	77.5	58%	0.58	38%	0.376	S	S	*	.	H	α-helix	trans	-64.2	-38.1	178.8	-168.7	82.4	0	0	0	111.7	K135 V136 L142 K143	K135-W139 WeakPolarHBondContact O-CB 3.43Å; K135-W139 PolarHBondContact O-N 3.09Å; V136-W139 PolarHBondContact O-N 2.97Å; W139-L142 WeakPolarHBondContact O-CB 3.37Å; W139-L142 PolarHBondContact O-N 3.36Å; W139-K143 HydrophobicContact CH2-CD 4.49Å; W139-K143 HydrophobicContact CZ3-CD 4.16Å; W139-K143 PolarHBondContact O-N 3Å
140	R	82.7	Confident	77.3	Confident	82 Å²	82	74.5 Å²	74.5	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-64.2	-42.8	174.1	-172.6	178.1	-177.9	159.1	0.1	112.2	V136 L137 M138 L142 K143 L144 F444 D448	V136-R140 WeakPolarHBondContact O-CB 3.49Å; V136-R140 PolarHBondContact O-N 3.15Å; L137-R140 WeakPolarHBondContact O-CB 3.49Å; L137-R140 PolarHBondContact O-N 3Å; M138-R140 VanDerWaalsContact C-N 3.29Å; M138-R140 PolarHBondContact O-N 3.06Å; R140-L142 VanDerWaalsContact C-N 3.3Å; R140-L142 PolarHBondContact O-N 3.32Å; R140-K143 WeakPolarHBondContact O-CB 3.26Å; R140-K143 PolarHBondContact O-N 2.65Å; R140-K143 VanDerWaalsContact O-N 3.14Å; R140-L144 PolarHBondContact O-N 3.03Å; R140-F444 HydrophobicContact CB-CE2 4.41Å; R140-F444 HydrophobicContact CB-CZ 4.24Å; R140-F444 HydrophobicContact CG-CE1 3.98Å; R140-F444 HydrophobicContact CG-CE2 4.31Å; R140-F444 HydrophobicContact CG-CZ 3.76Å; R140-D448 IonicContact CZ-OD1 3.98Å; R140-D448 IonicContact CZ-OD2 3.82Å; R140-D448 VanDerWaalsContact NH1-CG 3.33Å; R140-D448 IonicContact NH1-OD1 2.98Å; R140-D448 PolarHBondContact NH1-OD1 3.47Å; R140-D448 IonicContact NH1-OD2 3.9Å; R140-D448 PolarHBondContact NH1-OD2 3.35Å; R140-D448 IonicContact NH2-OD1 2.93Å; R140-D448 PolarHBondContact NH2-OD1 3.03Å; R140-D448 IonicContact NH2-OD2 2.75Å; R140-D448 PolarHBondContact NH2-OD2 3.04Å
141	L	79.2	Confident	78.8	Confident	7 Å²	7	71.8 Å²	71.8	4%	0.037	36%	0.356	C	S	.	.	H	α-helix	trans	-61.5	-41.2	175.4	-152.9	74.2	0	0	0	111.3	L137 M138 K143 L144 S145 M260 W263 L264 F444	L137-L141 WeakPolarHBondContact O-CB 3.44Å; L137-L141 PolarHBondContact O-N 2.84Å; M138-L141 WeakPolarHBondContact O-CB 3.19Å; M138-L141 PolarHBondContact O-N 3.42Å; L141-K143 VanDerWaalsContact C-N 3.34Å; L141-K143 PolarHBondContact O-N 3.04Å; L141-L144 VanDerWaalsContact O-CB 3.25Å; L141-L144 WeakPolarHBondContact O-CB 3.43Å; L141-L144 PolarHBondContact O-N 3Å; L141-L144 VanDerWaalsContact O-N 3.15Å; L141-S145 PolarHBondContact O-N 3.01Å; L141-M260 HydrophobicContact CD1-CE 3.21Å; L141-M260 HydrophobicContact CD1-CG 3.78Å; L141-M260 HydrophobicContact CD1-SD 4.31Å; L141-W263 HydrophobicContact CD2-CE3 4.28Å; L141-L264 HydrophobicContact CB-CD2 4.07Å; L141-L264 HydrophobicContact CD2-CB 3.45Å; L141-L264 VanDerWaalsContact CD2-CB 3.45Å; L141-L264 HydrophobicContact CD2-CD1 4.32Å; L141-L264 HydrophobicContact CD2-CD2 3.83Å; L141-L264 HydrophobicContact CD2-CG 4.06Å; L141-L264 HydrophobicContact CG-CB 4.22Å; L141-L264 HydrophobicContact CG-CD2 3.74Å; L141-F444 HydrophobicContact CD1-CE2 4.03Å; L141-F444 HydrophobicContact CD1-CZ 3.87Å
142	L	80.4	Confident	80.3	Confident	98 Å²	98	70.7 Å²	70.7	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-65.5	-35.3	173.8	-156.7	88.3	0	0	0	112.2	M138 W139 R140 L144 S145 R146	M138-L142 WeakPolarHBondContact O-CB 3.14Å; M138-L142 PolarHBondContact O-N 3.36Å; W139-L142 WeakPolarHBondContact O-CB 3.37Å; W139-L142 PolarHBondContact O-N 3.36Å; R140-L142 VanDerWaalsContact C-N 3.3Å; R140-L142 PolarHBondContact O-N 3.32Å; L142-L144 PolarHBondContact O-N 2.99Å; L142-S145 PolarHBondContact O-N 3.25Å; L142-S145 PolarHBondContact O-OG 3.16Å; L142-R146 PolarHBondContact O-N 3.34Å
143	K	85.3	Confident	81.7	Confident	111 Å²	111	70.5 Å²	70.5	48%	0.483	35%	0.351	S	S	.	.	H	α-helix	trans	-63.8	-34.6	173.3	-169.8	177.8	178.2	-176.2	0	111.1	W139 R140 L141 S145 R146	W139-K143 HydrophobicContact CH2-CD 4.49Å; W139-K143 HydrophobicContact CZ3-CD 4.16Å; W139-K143 PolarHBondContact O-N 3Å; R140-K143 WeakPolarHBondContact O-CB 3.26Å; R140-K143 PolarHBondContact O-N 2.65Å; R140-K143 VanDerWaalsContact O-N 3.14Å; L141-K143 VanDerWaalsContact C-N 3.34Å; L141-K143 PolarHBondContact O-N 3.04Å; K143-S145 VanDerWaalsContact C-N 3.29Å; K143-S145 PolarHBondContact O-N 2.95Å; K143-R146 WeakPolarHBondContact O-CB 3.48Å; K143-R146 WeakPolarHBondContact O-CG 3.37Å; K143-R146 PolarHBondContact O-N 2.95Å
144	L	82.5	Confident	82.8	Confident	26 Å²	26	68.7 Å²	68.7	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-68.1	-27	177.1	-132.7	106.6	0	0	0	113.1	R140 L141 L142 P147 R224 I225 F444	R140-L144 PolarHBondContact O-N 3.03Å; L141-L144 VanDerWaalsContact O-CB 3.25Å; L141-L144 WeakPolarHBondContact O-CB 3.43Å; L141-L144 PolarHBondContact O-N 3Å; L141-L144 VanDerWaalsContact O-N 3.15Å; L142-L144 PolarHBondContact O-N 2.99Å; L144-P147 WeakPolarHBondContact O-CD 3.5Å; L144-R224 PolarHBondContact O-NH1 3.45Å; L144-I225 HydrophobicContact CD2-CD1 4.03Å; L144-I225 HydrophobicContact CD2-CG1 3.39Å; L144-F444 HydrophobicContact CD1-CE1 4.41Å
145	S	82	Confident	83.8	Confident	9 Å²	9	67.4 Å²	67.4	6%	0.063	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.3	178.5	66.1	0	0	0	0	114.6	L141 L142 K143 P147 D148 L149	L141-S145 PolarHBondContact O-N 3.01Å; L142-S145 PolarHBondContact O-N 3.25Å; L142-S145 PolarHBondContact O-OG 3.16Å; K143-S145 VanDerWaalsContact C-N 3.29Å; K143-S145 PolarHBondContact O-N 2.95Å; S145-P147 VanDerWaalsContact C-N 3.33Å; S145-D148 PolarHBondContact O-N 3.2Å; S145-L149 PolarHBondContact O-N 3.49Å
146	R	84.5	Confident	84.6	Confident	139 Å²	139	64.6 Å²	64.6	53%	0.525	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-48.9	-40.4	175.9	-75.9	-177.9	177.8	-175.2	0	115.5	L142 K143 D148 L149	L142-R146 PolarHBondContact O-N 3.34Å; K143-R146 WeakPolarHBondContact O-CB 3.48Å; K143-R146 WeakPolarHBondContact O-CG 3.37Å; K143-R146 PolarHBondContact O-N 2.95Å; R146-D148 PolarHBondContact O-N 3.21Å; R146-L149 VanDerWaalsContact O-CB 3.27Å; R146-L149 WeakPolarHBondContact O-CB 3.28Å; R146-L149 PolarHBondContact O-N 3.05Å
147	P	87.1	Confident	85.2	Confident	82 Å²	82	66.8 Å²	66.8	53%	0.532	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-64.2	-25	178.8	-19.8	33.1	0	0	0	113.3	L144 S145	L144-P147 WeakPolarHBondContact O-CD 3.5Å; S145-P147 VanDerWaalsContact C-N 3.33Å
148	D	86.8	Confident	85.9	Confident	7 Å²	7	68.8 Å²	68.8	4%	0.037	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-102.3	7.7	-173.5	-51	-72.9	0	0	0	111.7	S145 R146 P150 L151 L152 T217 R224	S145-D148 PolarHBondContact O-N 3.2Å; R146-D148 PolarHBondContact O-N 3.21Å; D148-P150 VanDerWaalsContact C-CD 3.44Å; D148-L151 WeakPolarHBondContact O-CB 3.44Å; D148-L151 PolarHBondContact O-N 3.05Å; D148-L151 VanDerWaalsContact O-N 3.12Å; D148-L152 PolarHBondContact O-N 3.43Å; D148-T217 HydrophobicContact CB-CG2 3.88Å; D148-R224 IonicContact OD1-NH2 3.85Å; D148-R224 IonicContact OD2-CZ 2.68Å; D148-R224 IonicContact OD2-NH1 3.15Å; D148-R224 PolarHBondContact OD2-NH1 2.74Å; D148-R224 IonicContact OD2-NH2 2.74Å; D148-R224 PolarHBondContact OD2-NH2 3.01Å
149	L	85.6	Confident	86.7	Confident	94 Å²	94	66.4 Å²	66.4	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-54.8	-40.5	176.7	-153.6	140.8	0	0	0	114.8	S145 R146 L151 L152 V153	S145-L149 PolarHBondContact O-N 3.49Å; R146-L149 VanDerWaalsContact O-CB 3.27Å; R146-L149 WeakPolarHBondContact O-CB 3.28Å; R146-L149 PolarHBondContact O-N 3.05Å; L149-L151 VanDerWaalsContact C-N 3.27Å; L149-L151 PolarHBondContact O-N 3.14Å; L149-L152 PolarHBondContact O-N 3.37Å; L149-V153 HydrophobicContact CD2-CG2 4.01Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 3.47Å
150	P	89.3	Confident	87.1	Confident	96 Å²	96	61.3 Å²	61.3	62%	0.623	31%	0.312	S	S	*	.	H	α-helix	trans	-62.1	-36.3	176	23.6	-34.1	0	0	0	112.5	D148 V153 A154	D148-P150 VanDerWaalsContact C-CD 3.44Å; P150-V153 PolarHBondContact O-N 3.16Å; P150-A154 PolarHBondContact O-N 3.37Å
151	L	87.8	Confident	87.5	Confident	43 Å²	43	61.5 Å²	61.5	23%	0.225	32%	0.318	C	S	.	.	H	α-helix	trans	-72.7	-35.8	177.9	-173.1	63.9	0	0	0	111.8	D148 L149 A154 A155 C213 Y216 T217	D148-L151 WeakPolarHBondContact O-CB 3.44Å; D148-L151 PolarHBondContact O-N 3.05Å; D148-L151 VanDerWaalsContact O-N 3.12Å; L149-L151 VanDerWaalsContact C-N 3.27Å; L149-L151 PolarHBondContact O-N 3.14Å; L151-A154 PolarHBondContact O-N 2.97Å; L151-A155 WeakPolarHBondContact O-CB 3.49Å; L151-A155 PolarHBondContact O-N 2.82Å; L151-C213 HydrophobicContact CD1-CB 3.94Å; L151-C213 HydrophobicContact CG-CB 4.23Å; L151-Y216 HydrophobicContact CD2-CD1 3.37Å; L151-Y216 HydrophobicContact CD2-CE1 4.09Å; L151-Y216 HydrophobicContact CD2-CG 4.3Å; L151-T217 WeakPolarHBondContact CD2-OG1 3.46Å
152	L	87.6	Confident	88.1	Confident	44 Å²	44	61.2 Å²	61.2	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-64.7	-38.7	172	-72.6	170.3	0	0	0	112	D148 L149 A155 F156 F214 T217	D148-L152 PolarHBondContact O-N 3.43Å; L149-L152 PolarHBondContact O-N 3.37Å; L152-A155 PolarHBondContact O-N 3.15Å; L152-F156 PolarHBondContact O-N 3.07Å; L152-F214 HydrophobicContact CD2-CD1 4.18Å; L152-F214 HydrophobicContact CD2-CE1 3.76Å; L152-T217 HydrophobicContact CD2-CG2 4.04Å; L152-T217 HydrophobicContact CG-CG2 4.15Å
153	V	89.3	Confident	88.6	Confident	89 Å²	89	56.7 Å²	56.7	54%	0.539	29%	0.294	S	S	.	.	H	α-helix	trans	-65.1	-43.8	174.5	171.6	0	0	0	0	110.7	L149 P150 A155 F156 F157	L149-V153 HydrophobicContact CD2-CG2 4.01Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 3.47Å; P150-V153 PolarHBondContact O-N 3.16Å; V153-A155 VanDerWaalsContact C-N 3.33Å; V153-A155 PolarHBondContact O-N 2.85Å; V153-F156 WeakPolarHBondContact O-CB 3.29Å; V153-F156 PolarHBondContact O-N 2.83Å; V153-F157 PolarHBondContact O-N 3.39Å
154	A	91.2	Very high	88.7	Confident	36 Å²	36	55.8 Å²	55.8	30%	0.298	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-43.1	173.4	0	0	0	0	0	111.7	P150 L151 F156 F157 F158	P150-A154 PolarHBondContact O-N 3.37Å; L151-A154 PolarHBondContact O-N 2.97Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 2.89Å; A154-F157 WeakPolarHBondContact O-CB 3.41Å; A154-F157 PolarHBondContact O-N 3.44Å; A154-F158 WeakPolarHBondContact O-CD2 3.3Å; A154-F158 PolarHBondContact O-N 3.39Å
155	A	91.1	Very high	89	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-38.6	175.9	0	0	0	0	0	112.2	L151 L152 V153 L159 C213 F214	L151-A155 WeakPolarHBondContact O-CB 3.49Å; L151-A155 PolarHBondContact O-N 2.82Å; L152-A155 PolarHBondContact O-N 3.15Å; V153-A155 VanDerWaalsContact C-N 3.33Å; V153-A155 PolarHBondContact O-N 2.85Å; A155-L159 VanDerWaalsContact O-CB 3.3Å; A155-L159 WeakPolarHBondContact O-CB 3.4Å; A155-L159 PolarHBondContact O-N 3.07Å; A155-C213 HydrophobicContact CB-CB 3.71Å; A155-F214 HydrophobicContact CB-CD2 3.83Å; A155-F214 HydrophobicContact CB-CE2 3.65Å; A155-F214 HydrophobicContact CB-CG 4.44Å; A155-F214 HydrophobicContact CB-CZ 4.13Å
156	F	90	Very high	89.3	Confident	82 Å²	82	56.5 Å²	56.5	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-66.4	-40.8	174.8	-179.3	-114.9	0	0	0	112.3	L152 V153 A154 L159 V160 L272 V276	L152-F156 PolarHBondContact O-N 3.07Å; V153-F156 WeakPolarHBondContact O-CB 3.29Å; V153-F156 PolarHBondContact O-N 2.83Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 2.89Å; F156-L159 HydrophobicContact CD2-CD2 4.11Å; F156-L159 WeakPolarHBondContact O-CB 3.43Å; F156-L159 PolarHBondContact O-N 3.3Å; F156-V160 HydrophobicContact CD2-CG2 4.37Å; F156-V160 HydrophobicContact CE1-CG2 4.07Å; F156-V160 HydrophobicContact CE2-CG2 3.94Å; F156-V160 HydrophobicContact CZ-CG2 3.79Å; F156-V160 WeakPolarHBondContact O-CG2 3.43Å; F156-V160 PolarHBondContact O-N 3.42Å; F156-L272 HydrophobicContact CB-CD2 4.45Å; F156-L272 HydrophobicContact CD2-CD1 4.03Å; F156-L272 HydrophobicContact CD2-CD2 3.23Å; F156-L272 HydrophobicContact CD2-CG 3.64Å; F156-L272 HydrophobicContact CE2-CD1 3.56Å; F156-L272 HydrophobicContact CE2-CD2 3.72Å; F156-L272 HydrophobicContact CE2-CG 3.62Å; F156-L272 HydrophobicContact CG-CD2 4.15Å; F156-L272 HydrophobicContact CZ-CD1 4.5Å; F156-V276 HydrophobicContact CE2-CG2 4.12Å
157	F	91.4	Very high	89.5	Confident	136 Å²	136	50.2 Å²	50.2	60%	0.596	27%	0.274	S	S	*	.	H	α-helix	trans	-59.5	-49.8	174.6	176.1	-98	0	0	0	111.6	V153 A154 L159 V160 L161	V153-F157 PolarHBondContact O-N 3.39Å; A154-F157 WeakPolarHBondContact O-CB 3.41Å; A154-F157 PolarHBondContact O-N 3.44Å; F157-L159 VanDerWaalsContact C-N 3.25Å; F157-L159 PolarHBondContact O-N 2.97Å; F157-V160 PolarHBondContact O-N 3.17Å; F157-L161 PolarHBondContact O-N 3.31Å
158	F	93.3	Very high	89.7	Confident	60 Å²	60	48.1 Å²	48.1	26%	0.263	26%	0.258	S	S	.	.	H	α-helix	trans	-63.8	-31	175.2	-70.6	-58.2	0	0	0	112.8	A154 A162 S206 C209 R210	A154-F158 WeakPolarHBondContact O-CD2 3.3Å; A154-F158 PolarHBondContact O-N 3.39Å; F158-A162 WeakPolarHBondContact O-CB 3.48Å; F158-A162 PolarHBondContact O-N 3.16Å; F158-S206 WeakPolarHBondContact CA-OG 3.39Å; F158-S206 PolarHBondContact O-OG 3.16Å; F158-C209 HydrophobicContact CB-CB 4.45Å; F158-C209 HydrophobicContact CD1-CB 3.93Å; F158-C209 HydrophobicContact CD2-CB 3.89Å; F158-C209 HydrophobicContact CE1-CB 4.1Å; F158-C209 HydrophobicContact CE2-CB 4.06Å; F158-C209 HydrophobicContact CG-CB 3.83Å; F158-C209 HydrophobicContact CZ-CB 4.16Å; F158-R210 HydrophobicContact CB-CB 3.91Å
159	L	91.6	Very high	89.8	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-49.8	174	174.4	70.2	0	0	0	111.3	A155 F156 F157 L161 A162 V163 L272 R273	A155-L159 VanDerWaalsContact O-CB 3.3Å; A155-L159 WeakPolarHBondContact O-CB 3.4Å; A155-L159 PolarHBondContact O-N 3.07Å; F156-L159 HydrophobicContact CD2-CD2 4.11Å; F156-L159 WeakPolarHBondContact O-CB 3.43Å; F156-L159 PolarHBondContact O-N 3.3Å; F157-L159 VanDerWaalsContact C-N 3.25Å; F157-L159 PolarHBondContact O-N 2.97Å; L159-L161 VanDerWaalsContact C-N 3.34Å; L159-L161 PolarHBondContact O-N 2.96Å; L159-A162 PolarHBondContact O-N 3.24Å; L159-V163 HydrophobicContact CD1-CG2 4.26Å; L159-V163 VanDerWaalsContact O-CG2 3.32Å; L159-V163 WeakPolarHBondContact O-CG2 3.37Å; L159-V163 PolarHBondContact O-N 2.8Å; L159-L272 HydrophobicContact CD2-CB 4.05Å; L159-L272 HydrophobicContact CD2-CD2 4.13Å; L159-L272 HydrophobicContact CD2-CG 3.72Å; L159-R273 HydrophobicContact CD1-CB 3.62Å; L159-R273 HydrophobicContact CD1-CG 3.76Å; L159-R273 HydrophobicContact CD2-CB 4.36Å
160	V	90.5	Very high	90.1	Very high	47 Å²	47	46.1 Å²	46.1	29%	0.285	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-45.5	179.4	173.7	0	0	0	0	110.4	F156 F157 A162 V163 L164 V276	F156-V160 HydrophobicContact CD2-CG2 4.37Å; F156-V160 HydrophobicContact CE1-CG2 4.07Å; F156-V160 HydrophobicContact CE2-CG2 3.94Å; F156-V160 HydrophobicContact CZ-CG2 3.79Å; F156-V160 WeakPolarHBondContact O-CG2 3.43Å; F156-V160 PolarHBondContact O-N 3.42Å; F157-V160 PolarHBondContact O-N 3.17Å; V160-A162 VanDerWaalsContact C-N 3.34Å; V160-A162 PolarHBondContact O-N 3.02Å; V160-V163 PolarHBondContact O-N 3.43Å; V160-L164 HydrophobicContact CG1-CD1 3.96Å; V160-L164 HydrophobicContact CG1-CG 4.41Å; V160-L164 WeakPolarHBondContact O-CG 3.48Å; V160-L164 PolarHBondContact O-N 3.39Å; V160-V276 HydrophobicContact CG2-CG1 4.47Å
161	L	91.1	Very high	90.1	Very high	85 Å²	85	44.9 Å²	44.9	45%	0.445	23%	0.233	S	C	.	.	H	α-helix	trans	-61.2	-41.9	177.6	-176.5	63.8	0	0	0	112.3	F157 L159 G165	F157-L161 PolarHBondContact O-N 3.31Å; L159-L161 VanDerWaalsContact C-N 3.34Å; L159-L161 PolarHBondContact O-N 2.96Å; L161-G165 PolarHBondContact O-N 3.44Å; L161-G165 VanDerWaalsContact O-N 3.09Å
162	A	91.9	Very high	90.2	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-44.2	176.5	0	0	0	0	0	111.7	F158 L159 V160 G165 E166 S206 A207	F158-A162 WeakPolarHBondContact O-CB 3.48Å; F158-A162 PolarHBondContact O-N 3.16Å; L159-A162 PolarHBondContact O-N 3.24Å; V160-A162 VanDerWaalsContact C-N 3.34Å; V160-A162 PolarHBondContact O-N 3.02Å; A162-G165 PolarHBondContact O-N 3.26Å; A162-E166 WeakPolarHBondContact O-CB 3.4Å; A162-E166 WeakPolarHBondContact O-CG 3.48Å; A162-E166 PolarHBondContact O-N 2.85Å; A162-S206 PolarHBondContact N-OG 2.91Å; A162-A207 HydrophobicContact CB-CB 4.31Å
163	V	90.4	Very high	90.3	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-44.1	179.5	171.9	0	0	0	0	111.1	L159 V160 G165 E166 T167 V276 K277	L159-V163 HydrophobicContact CD1-CG2 4.26Å; L159-V163 VanDerWaalsContact O-CG2 3.32Å; L159-V163 WeakPolarHBondContact O-CG2 3.37Å; L159-V163 PolarHBondContact O-N 2.8Å; V160-V163 PolarHBondContact O-N 3.43Å; V163-G165 PolarHBondContact O-N 2.99Å; V163-E166 PolarHBondContact O-N 2.78Å; V163-T167 HydrophobicContact CG1-CG2 3.94Å; V163-T167 WeakPolarHBondContact O-CB 3.3Å; V163-T167 WeakPolarHBondContact O-CG2 3.4Å; V163-T167 PolarHBondContact O-N 2.82Å; V163-T167 PolarHBondContact O-OG1 2.98Å; V163-T167 VanDerWaalsContact O-OG1 3.1Å; V163-V276 HydrophobicContact CB-CG1 4.1Å; V163-V276 HydrophobicContact CG1-CG1 3.95Å; V163-V276 HydrophobicContact CG2-CG1 4.23Å; V163-K277 HydrophobicContact CB-CG 4.33Å; V163-K277 HydrophobicContact CG1-CB 4.5Å; V163-K277 HydrophobicContact CG1-CG 3.7Å; V163-K277 HydrophobicContact CG2-CD 4.46Å; V163-K277 HydrophobicContact CG2-CG 3.65Å
164	L	88.2	Confident	90.2	Very high	92 Å²	92	40 Å²	40	48%	0.482	21%	0.205	S	C	.	.	H	α-helix	trans	-58	-49.1	176.3	-72.6	170.2	0	0	0	111.1	V160 T167 L168	V160-L164 HydrophobicContact CG1-CD1 3.96Å; V160-L164 HydrophobicContact CG1-CG 4.41Å; V160-L164 WeakPolarHBondContact O-CG 3.48Å; V160-L164 PolarHBondContact O-N 3.39Å; L164-T167 WeakPolarHBondContact CA-OG1 3.26Å; L164-T167 PolarHBondContact O-N 2.86Å; L164-T167 PolarHBondContact O-OG1 3.28Å; L164-L168 WeakPolarHBondContact O-CG 3.16Å; L164-L168 PolarHBondContact O-N 2.63Å
165	G	88.5	Confident	90.1	Very high	6 Å²	6	44.5 Å²	44.5	6%	0.062	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-47	176.5	0	0	0	0	0	113	L161 A162 V163 T167 L168	L161-G165 PolarHBondContact O-N 3.44Å; L161-G165 VanDerWaalsContact O-N 3.09Å; A162-G165 PolarHBondContact O-N 3.26Å; V163-G165 PolarHBondContact O-N 2.99Å; G165-T167 VanDerWaalsContact C-N 3.32Å; G165-T167 PolarHBondContact O-N 3.49Å; G165-L168 PolarHBondContact O-N 3.19Å
166	E	89.1	Confident	90	Very high	44 Å²	44	45.7 Å²	45.7	21%	0.206	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-37.8	177.4	-75.6	173.4	-179.1	0	0	112.2	A162 V163 L168 I169 P170 R273 K277	A162-E166 WeakPolarHBondContact O-CB 3.4Å; A162-E166 WeakPolarHBondContact O-CG 3.48Å; A162-E166 PolarHBondContact O-N 2.85Å; V163-E166 PolarHBondContact O-N 2.78Å; E166-L168 VanDerWaalsContact C-N 3.29Å; E166-L168 PolarHBondContact O-N 3.49Å; E166-I169 PolarHBondContact O-N 3.33Å; E166-P170 WeakPolarHBondContact O-CD 3.24Å; E166-R273 IonicContact OE1-NH2 3.37Å; E166-R273 PolarHBondContact OE1-NH2 3.49Å; E166-R273 IonicContact OE2-NH2 3.6Å; E166-K277 WeakPolarHBondContact OE2-CE 3.47Å; E166-K277 IonicContact OE2-NZ 3.02Å; E166-K277 PolarHBondContact OE2-NZ 3.36Å
167	T	88.6	Confident	90	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.037	22%	0.217	C	C	.	.	H	α-helix	trans	-70.3	-24.7	179.1	58	0	0	0	0	113	V163 L164 G165 P170 L281 Y415	V163-T167 HydrophobicContact CG1-CG2 3.94Å; V163-T167 WeakPolarHBondContact O-CB 3.3Å; V163-T167 WeakPolarHBondContact O-CG2 3.4Å; V163-T167 PolarHBondContact O-N 2.82Å; V163-T167 PolarHBondContact O-OG1 2.98Å; V163-T167 VanDerWaalsContact O-OG1 3.1Å; L164-T167 WeakPolarHBondContact CA-OG1 3.26Å; L164-T167 PolarHBondContact O-N 2.86Å; L164-T167 PolarHBondContact O-OG1 3.28Å; G165-T167 VanDerWaalsContact C-N 3.32Å; G165-T167 PolarHBondContact O-N 3.49Å; T167-P170 WeakPolarHBondContact O-CD 3.14Å; T167-L281 HydrophobicContact CG2-CD2 3.85Å; T167-L281 HydrophobicContact CG2-CG 4.17Å; T167-Y415 VanDerWaalsContact O-CE1 3.26Å; T167-Y415 WeakPolarHBondContact O-CE1 3.35Å; T167-Y415 PolarHBondContact O-OH 2.73Å
168	L	89.9	Confident	89.8	Confident	39 Å²	39	40.3 Å²	40.3	20%	0.204	20%	0.202	C	C	.	.	H	α-helix	trans	-79.3	-22.9	178.5	-69.9	169.7	0	0	0	112.6	L164 G165 E166 H171 Y172 F199 F284	L164-L168 WeakPolarHBondContact O-CG 3.16Å; L164-L168 PolarHBondContact O-N 2.63Å; G165-L168 PolarHBondContact O-N 3.19Å; E166-L168 VanDerWaalsContact C-N 3.29Å; E166-L168 PolarHBondContact O-N 3.49Å; L168-H171 WeakPolarHBondContact O-CB 3.27Å; L168-H171 PolarHBondContact O-N 2.78Å; L168-Y172 HydrophobicContact CB-CD2 4.3Å; L168-Y172 HydrophobicContact CB-CE2 4.26Å; L168-Y172 VanDerWaalsContact O-CD2 3.29Å; L168-Y172 WeakPolarHBondContact O-CD2 3.49Å; L168-Y172 PolarHBondContact O-N 2.84Å; L168-Y172 VanDerWaalsContact O-N 3.1Å; L168-F199 HydrophobicContact CB-CD2 4.11Å; L168-F199 HydrophobicContact CB-CG 4.24Å; L168-F199 HydrophobicContact CD1-CD1 3.77Å; L168-F199 HydrophobicContact CD1-CD2 4.07Å; L168-F199 HydrophobicContact CD1-CE1 3.59Å; L168-F199 HydrophobicContact CD1-CE2 3.92Å; L168-F199 HydrophobicContact CD1-CG 4.03Å; L168-F199 HydrophobicContact CD1-CZ 3.68Å; L168-F284 HydrophobicContact CD2-CE1 4.31Å; L168-F284 HydrophobicContact CD2-CZ 3.97Å
169	I	90.1	Very high	89.5	Confident	46 Å²	46	38.6 Å²	38.6	24%	0.236	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-52.8	-177.5	-60.4	167.9	0	0	0	111.5	E166 H171 Y172 S173 M196	E166-I169 PolarHBondContact O-N 3.33Å; I169-H171 VanDerWaalsContact C-N 3.27Å; I169-H171 PolarHBondContact O-N 3.07Å; I169-Y172 PolarHBondContact O-N 3.45Å; I169-S173 PolarHBondContact O-N 2.84Å; I169-S173 PolarHBondContact O-OG 2.78Å; I169-S173 VanDerWaalsContact O-OG 3.07Å; I169-M196 HydrophobicContact CG2-CG 4.43Å
170	P	90.6	Very high	89.3	Confident	12 Å²	12	43.5 Å²	43.5	8%	0.078	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-29	-179.9	-21.7	35.2	0	0	0	113.7	E166 T167 S173 G174 S411 I414 Y415	E166-P170 WeakPolarHBondContact O-CD 3.24Å; T167-P170 WeakPolarHBondContact O-CD 3.14Å; P170-S173 PolarHBondContact O-N 3.09Å; P170-G174 PolarHBondContact O-N 2.99Å; P170-S411 WeakPolarHBondContact O-CB 3.33Å; P170-S411 PolarHBondContact O-OG 2.68Å; P170-I414 HydrophobicContact CB-CB 4.01Å; P170-I414 HydrophobicContact CB-CD1 4.38Å; P170-I414 HydrophobicContact CB-CG2 3.72Å; P170-I414 HydrophobicContact CG-CB 4.45Å; P170-I414 HydrophobicContact CG-CG2 3.63Å; P170-Y415 HydrophobicContact CB-CD1 4.01Å; P170-Y415 HydrophobicContact CB-CE1 3.55Å; P170-Y415 HydrophobicContact CB-CE2 4.4Å; P170-Y415 HydrophobicContact CG-CD1 3.95Å; P170-Y415 HydrophobicContact CG-CE1 3.51Å
171	H	89.8	Confident	88.7	Confident	70 Å²	70	44.1 Å²	44.1	32%	0.324	24%	0.237	S	C	.	.	H	α-helix	trans	-64.8	-47.8	175.3	179.5	76.5	0	0	0	111.2	L168 I169 S173 G174 R175 Y415	L168-H171 WeakPolarHBondContact O-CB 3.27Å; L168-H171 PolarHBondContact O-N 2.78Å; I169-H171 VanDerWaalsContact C-N 3.27Å; I169-H171 PolarHBondContact O-N 3.07Å; H171-S173 VanDerWaalsContact C-N 3.34Å; H171-G174 PolarHBondContact O-N 3.46Å; H171-R175 PolarHBondContact O-N 3.02Å; H171-Y415 WeakPolarHBondContact CB-OH 3.41Å; H171-Y415 PolarHBondContact N-OH 3.22Å
172	Y	89.8	Confident	88.1	Confident	40 Å²	40	42.4 Å²	42.4	16%	0.157	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-34.2	176.1	-77	-77.1	0	0	0	112.2	L168 I169 G174 R175 V176 A192 F195 F199	L168-Y172 HydrophobicContact CB-CD2 4.3Å; L168-Y172 HydrophobicContact CB-CE2 4.26Å; L168-Y172 VanDerWaalsContact O-CD2 3.29Å; L168-Y172 WeakPolarHBondContact O-CD2 3.49Å; L168-Y172 PolarHBondContact O-N 2.84Å; L168-Y172 VanDerWaalsContact O-N 3.1Å; I169-Y172 PolarHBondContact O-N 3.45Å; Y172-G174 VanDerWaalsContact C-N 3.32Å; Y172-G174 PolarHBondContact O-N 3.04Å; Y172-R175 PolarHBondContact O-N 3.11Å; Y172-V176 VanDerWaalsContact O-CG2 3.29Å; Y172-V176 WeakPolarHBondContact O-CG2 2.9Å; Y172-V176 PolarHBondContact O-N 3.23Å; Y172-A192 HydrophobicContact CD1-CB 4.36Å; Y172-F195 HydrophobicContact CD1-CB 4.11Å; Y172-F195 HydrophobicContact CE1-CB 3.62Å; Y172-F195 HydrophobicContact CE1-CD2 4.19Å; Y172-F195 HydrophobicContact CE1-CG 4.18Å; Y172-F195 HydrophobicContact CE2-CB 4.19Å; Y172-F199 HydrophobicContact CD2-CD2 4.01Å; Y172-F199 HydrophobicContact CD2-CE2 4.25Å; Y172-F199 AromaticContact CE2-CD2 3.59Å; Y172-F199 HydrophobicContact CE2-CD2 3.59Å; Y172-F199 AromaticContact CE2-CE2 3.38Å; Y172-F199 HydrophobicContact CE2-CE2 3.38Å; Y172-F199 AromaticContact CZ-CE2 3.85Å
173	S	89.2	Confident	87.3	Confident	33 Å²	33	50.3 Å²	50.3	23%	0.231	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-40.7	171.6	-56.5	0	0	0	0	112.2	I169 P170 H171 V176 I177	I169-S173 PolarHBondContact O-N 2.84Å; I169-S173 PolarHBondContact O-OG 2.78Å; I169-S173 VanDerWaalsContact O-OG 3.07Å; P170-S173 PolarHBondContact O-N 3.09Å; H171-S173 VanDerWaalsContact C-N 3.34Å; S173-V176 PolarHBondContact O-N 3.01Å; S173-I177 PolarHBondContact O-N 2.82Å
174	G	89.1	Confident	87	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-47.2	172.5	0	0	0	0	0	112.3	P170 H171 Y172 V176 I177 D178 G407 S411	P170-G174 PolarHBondContact O-N 2.99Å; H171-G174 PolarHBondContact O-N 3.46Å; Y172-G174 VanDerWaalsContact C-N 3.32Å; Y172-G174 PolarHBondContact O-N 3.04Å; G174-V176 VanDerWaalsContact C-N 3.27Å; G174-V176 PolarHBondContact O-N 3.4Å; G174-I177 WeakPolarHBondContact O-CA 3.25Å; G174-I177 WeakPolarHBondContact O-CB 3.24Å; G174-I177 PolarHBondContact O-N 2.94Å; G174-D178 PolarHBondContact O-N 2.97Å; G174-G407 WeakPolarHBondContact CA-O 3.3Å; G174-G407 WeakPolarHBondContact O-CA 3.33Å; G174-S411 VanDerWaalsContact CA-OG 3.29Å; G174-S411 WeakPolarHBondContact CA-OG 3.16Å; G174-S411 PolarHBondContact N-OG 2.86Å
175	R	88.3	Confident	86.8	Confident	132 Å²	132	54.8 Å²	54.8	50%	0.498	30%	0.301	S	S	.	.	H	α-helix	trans	-58.6	-38.2	177.9	-166.2	-178.4	-179.1	106.4	1.7	112.6	H171 Y172 I177 D178 I179	H171-R175 PolarHBondContact O-N 3.02Å; Y172-R175 PolarHBondContact O-N 3.11Å; R175-I177 VanDerWaalsContact C-N 3.33Å; R175-D178 PolarHBondContact O-N 3.24Å; R175-I179 HydrophobicContact CG-CD1 4.19Å; R175-I179 WeakPolarHBondContact O-CD1 3.34Å; R175-I179 VanDerWaalsContact O-CG1 3.24Å; R175-I179 WeakPolarHBondContact O-CG1 3.38Å; R175-I179 PolarHBondContact O-N 2.97Å
176	V	89.6	Confident	86.7	Confident	24 Å²	24	58.1 Å²	58.1	15%	0.145	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-41.1	174.6	167.5	0	0	0	0	111.1	Y172 S173 G174 I179 L180 F189 A192 I193	Y172-V176 VanDerWaalsContact O-CG2 3.29Å; Y172-V176 WeakPolarHBondContact O-CG2 2.9Å; Y172-V176 PolarHBondContact O-N 3.23Å; S173-V176 PolarHBondContact O-N 3.01Å; G174-V176 VanDerWaalsContact C-N 3.27Å; G174-V176 PolarHBondContact O-N 3.4Å; V176-I179 PolarHBondContact O-N 3.33Å; V176-L180 HydrophobicContact CG1-CD1 3.98Å; V176-L180 WeakPolarHBondContact O-CG 3.01Å; V176-L180 PolarHBondContact O-N 3Å; V176-F189 HydrophobicContact CG1-CD2 4.3Å; V176-F189 HydrophobicContact CG1-CE2 3.76Å; V176-A192 HydrophobicContact CG2-CB 3.86Å; V176-I193 HydrophobicContact CG2-CG1 4.39Å
177	I	88.8	Confident	86.6	Confident	54 Å²	54	63.5 Å²	63.5	28%	0.277	35%	0.346	S	S	.	.	H	α-helix	trans	-67.3	-41.1	175.5	-68	-164.8	0	0	0	111.8	S173 G174 R175 I179 L180 G181 Q406 L410	S173-I177 PolarHBondContact O-N 2.82Å; G174-I177 WeakPolarHBondContact O-CA 3.25Å; G174-I177 WeakPolarHBondContact O-CB 3.24Å; G174-I177 PolarHBondContact O-N 2.94Å; R175-I177 VanDerWaalsContact C-N 3.33Å; I177-I179 VanDerWaalsContact C-N 3.28Å; I177-I179 PolarHBondContact O-N 2.99Å; I177-L180 PolarHBondContact O-N 3.29Å; I177-G181 PolarHBondContact O-N 3.18Å; I177-Q406 HydrophobicContact CG2-CG 4.2Å; I177-L410 HydrophobicContact CD1-CB 4.47Å; I177-L410 HydrophobicContact CD1-CD2 3.13Å; I177-L410 HydrophobicContact CD1-CG 4.33Å; I177-L410 HydrophobicContact CG1-CD2 4.18Å
178	D	87.6	Confident	86.5	Confident	52 Å²	52	64.4 Å²	64.4	28%	0.278	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-39.6	176.4	-75.8	-28.4	0	0	0	111.6	G174 R175 G181 G182 T405 Q406 G407	G174-D178 PolarHBondContact O-N 2.97Å; R175-D178 PolarHBondContact O-N 3.24Å; D178-G181 PolarHBondContact O-N 3.02Å; D178-G182 PolarHBondContact O-N 3.21Å; D178-G182 VanDerWaalsContact O-N 3.14Å; D178-T405 VanDerWaalsContact CG-OG1 3.3Å; D178-T405 VanDerWaalsContact OD1-CB 3.23Å; D178-T405 WeakPolarHBondContact OD1-CB 3.36Å; D178-T405 PolarHBondContact OD1-OG1 3.13Å; D178-T405 WeakPolarHBondContact OD2-CB 3.36Å; D178-T405 PolarHBondContact OD2-OG1 3.19Å; D178-Q406 PolarHBondContact OD1-N 3.13Å; D178-G407 VanDerWaalsContact OD1-CA 3.25Å; D178-G407 WeakPolarHBondContact OD1-CA 3.27Å; D178-G407 PolarHBondContact OD1-N 3.19Å
179	I	87.9	Confident	86.5	Confident	23 Å²	23	65 Å²	65	12%	0.118	36%	0.355	C	S	.	.	H	α-helix	trans	-68.9	-36.9	176.3	-64.6	161.5	0	0	0	111.7	R175 V176 I177 F184 A188 F189 A192	R175-I179 HydrophobicContact CG-CD1 4.19Å; R175-I179 WeakPolarHBondContact O-CD1 3.34Å; R175-I179 VanDerWaalsContact O-CG1 3.24Å; R175-I179 WeakPolarHBondContact O-CG1 3.38Å; R175-I179 PolarHBondContact O-N 2.97Å; V176-I179 PolarHBondContact O-N 3.33Å; I177-I179 VanDerWaalsContact C-N 3.28Å; I177-I179 PolarHBondContact O-N 2.99Å; I179-F184 HydrophobicContact CG2-CD2 4.46Å; I179-A188 HydrophobicContact CD1-CB 4.01Å; I179-F189 HydrophobicContact CG2-CB 4.11Å; I179-F189 HydrophobicContact CG2-CD2 4.41Å; I179-A192 HydrophobicContact CD1-CB 4.27Å
180	L	85.8	Confident	86.5	Confident	103 Å²	103	65.6 Å²	65.6	54%	0.539	37%	0.366	S	S	.	.	H	α-helix	trans	-73.6	-28.7	177.5	-74	169	0	0	0	113.1	V176 I177 F184 F189	V176-L180 HydrophobicContact CG1-CD1 3.98Å; V176-L180 WeakPolarHBondContact O-CG 3.01Å; V176-L180 PolarHBondContact O-N 3Å; I177-L180 PolarHBondContact O-N 3.29Å; L180-F184 HydrophobicContact CD2-CD2 4.33Å; L180-F184 HydrophobicContact CD2-CE2 4.16Å; L180-F189 HydrophobicContact CD1-CE2 4.21Å; L180-F189 HydrophobicContact CD2-CD2 4.48Å; L180-F189 HydrophobicContact CD2-CE2 3.98Å; L180-F189 HydrophobicContact CG-CD2 4.49Å; L180-F189 HydrophobicContact CG-CE2 4.05Å
181	G	79.6	Confident	86.4	Confident	61 Å²	61	67.4 Å²	67.4	63%	0.629	38%	0.379	S	S	*	.	H	α-helix	trans	-87.5	-14.6	179.5	0	0	0	0	0	114.7	I177 D178	I177-G181 PolarHBondContact O-N 3.18Å; D178-G181 PolarHBondContact O-N 3.02Å
182	G	78	Confident	86.4	Confident	48 Å²	48	64.1 Å²	64.1	50%	0.495	36%	0.364	S	S	.	.	S	Bend	trans	-108.8	-152.8	178.2	0	0	0	0	0	113.5	D178 F184	D178-G182 PolarHBondContact O-N 3.21Å; D178-G182 VanDerWaalsContact O-N 3.14Å; G182-F184 PolarHBondContact O-N 2.7Å
183	D	74.7	Confident	86.5	Confident	167 Å²	167	65.1 Å²	65.1	89%	0.893	37%	0.372	S	S	*	.	S	Bend	trans	-69	114	172.7	-69.6	-34.9	0	0	0	109.9	D185	D183-D185 PolarHBondContact O-N 2.9Å; D183-D185 VanDerWaalsContact O-N 3.07Å
184	F	83.1	Confident	86.6	Confident	119 Å²	119	69.7 Å²	69.7	52%	0.522	39%	0.388	S	S	.	.			trans	-68.7	108.1	-174.4	-177.2	-103.5	0	0	0	111.5	I179 L180 G182 P186 F189	I179-F184 HydrophobicContact CG2-CD2 4.46Å; L180-F184 HydrophobicContact CD2-CD2 4.33Å; L180-F184 HydrophobicContact CD2-CE2 4.16Å; G182-F184 PolarHBondContact O-N 2.7Å; F184-P186 HydrophobicContact CD1-CG 4.14Å; F184-P186 HydrophobicContact CE1-CB 4.25Å; F184-P186 HydrophobicContact CE1-CG 3.82Å; F184-P186 WeakPolarHBondContact O-CD 3.44Å; F184-F189 HydrophobicContact CE2-CB 4.21Å; F184-F189 HydrophobicContact CE2-CD2 4.13Å; F184-F189 HydrophobicContact CE2-CG 4.06Å; F184-F189 HydrophobicContact CZ-CB 4.48Å; F184-F189 HydrophobicContact CZ-CG 4.4Å
185	D	85.1	Confident	86.8	Confident	72 Å²	72	73.7 Å²	73.7	39%	0.385	41%	0.405	S	S	.	.			trans	-100.2	109.9	168.7	178.1	11.6	0	0	0	110.7	D183 H187 A188 F189	D183-D185 PolarHBondContact O-N 2.9Å; D183-D185 VanDerWaalsContact O-N 3.07Å; D185-H187 PolarHBondContact O-N 2.96Å; D185-H187 IonicContact OD1-CD2 2.77Å; D185-H187 PolarHBondContact OD1-N 2.98Å; D185-A188 HydrophobicContact CB-CB 3.94Å; D185-A188 PolarHBondContact O-N 3.33Å; D185-A188 WeakPolarHBondContact OD2-CB 3.16Å; D185-A188 PolarHBondContact OD2-N 3.11Å; D185-F189 WeakPolarHBondContact O-CB 3.48Å; D185-F189 PolarHBondContact O-N 3.26Å
186	P	86	Confident	86.9	Confident	75 Å²	75	69.9 Å²	69.9	49%	0.487	39%	0.394	S	S	.	.	H	α-helix	trans	-57.7	-33.4	178.7	-22.1	31.1	0	0	0	113.6	F184 A190	F184-P186 HydrophobicContact CD1-CG 4.14Å; F184-P186 HydrophobicContact CE1-CB 4.25Å; F184-P186 HydrophobicContact CE1-CG 3.82Å; F184-P186 WeakPolarHBondContact O-CD 3.44Å; P186-A190 WeakPolarHBondContact O-CB 3.38Å; P186-A190 PolarHBondContact O-N 2.97Å
187	H	88.1	Confident	87	Confident	157 Å²	157	72 Å²	72	73%	0.727	41%	0.409	S	S	*	.	H	α-helix	trans	-74.7	-44.6	-178	-69.6	-71.1	0	0	0	111.5	D185 F189 A190 S191	D185-H187 PolarHBondContact O-N 2.96Å; D185-H187 IonicContact OD1-CD2 2.77Å; D185-H187 PolarHBondContact OD1-N 2.98Å; H187-F189 VanDerWaalsContact C-N 3.32Å; H187-F189 PolarHBondContact O-N 3.4Å; H187-A190 PolarHBondContact O-N 3.47Å; H187-S191 WeakPolarHBondContact O-CB 3.38Å; H187-S191 PolarHBondContact O-N 3.48Å; H187-S191 PolarHBondContact O-OG 2.96Å
188	A	85.9	Confident	87.2	Confident	25 Å²	25	73.6 Å²	73.6	21%	0.207	42%	0.418	C	S	.	.	H	α-helix	trans	-60.2	-43	173.3	0	0	0	0	0	111.6	I179 D185 S191 A192	I179-A188 HydrophobicContact CD1-CB 4.01Å; D185-A188 HydrophobicContact CB-CB 3.94Å; D185-A188 PolarHBondContact O-N 3.33Å; D185-A188 WeakPolarHBondContact OD2-CB 3.16Å; D185-A188 PolarHBondContact OD2-N 3.11Å; A188-S191 PolarHBondContact O-N 3.31Å; A188-S191 PolarHBondContact O-OG 3.34Å; A188-A192 WeakPolarHBondContact O-CB 3.25Å; A188-A192 PolarHBondContact O-N 2.99Å
189	F	89.1	Confident	87.5	Confident	53 Å²	53	73.8 Å²	73.8	23%	0.232	42%	0.416	C	S	.	.	H	α-helix	trans	-61.7	-48.7	177.2	-176.4	-99.2	0	0	0	112.3	V176 I179 L180 F184 D185 H187 S191 A192 I193	V176-F189 HydrophobicContact CG1-CD2 4.3Å; V176-F189 HydrophobicContact CG1-CE2 3.76Å; I179-F189 HydrophobicContact CG2-CB 4.11Å; I179-F189 HydrophobicContact CG2-CD2 4.41Å; L180-F189 HydrophobicContact CD1-CE2 4.21Å; L180-F189 HydrophobicContact CD2-CD2 4.48Å; L180-F189 HydrophobicContact CD2-CE2 3.98Å; L180-F189 HydrophobicContact CG-CD2 4.49Å; L180-F189 HydrophobicContact CG-CE2 4.05Å; F184-F189 HydrophobicContact CE2-CB 4.21Å; F184-F189 HydrophobicContact CE2-CD2 4.13Å; F184-F189 HydrophobicContact CE2-CG 4.06Å; F184-F189 HydrophobicContact CZ-CB 4.48Å; F184-F189 HydrophobicContact CZ-CG 4.4Å; D185-F189 WeakPolarHBondContact O-CB 3.48Å; D185-F189 PolarHBondContact O-N 3.26Å; H187-F189 VanDerWaalsContact C-N 3.32Å; H187-F189 PolarHBondContact O-N 3.4Å; F189-S191 VanDerWaalsContact C-N 3.32Å; F189-S191 PolarHBondContact O-N 3Å; F189-A192 PolarHBondContact O-N 3.33Å; F189-I193 HydrophobicContact CD1-CD1 3.85Å; F189-I193 HydrophobicContact CE1-CD1 3.25Å; F189-I193 HydrophobicContact CE1-CG1 4.37Å; F189-I193 HydrophobicContact CE2-CD1 4.16Å; F189-I193 HydrophobicContact CZ-CD1 3.44Å; F189-I193 VanDerWaalsContact CZ-CD1 3.44Å; F189-I193 HydrophobicContact CZ-CG1 4.46Å; F189-I193 PolarHBondContact O-N 3.15Å
190	A	90	Very high	87.7	Confident	57 Å²	57	74.4 Å²	74.4	47%	0.471	42%	0.422	S	S	.	.	H	α-helix	trans	-60.6	-40.9	177.4	0	0	0	0	0	112.1	P186 H187 F194	P186-A190 WeakPolarHBondContact O-CB 3.38Å; P186-A190 PolarHBondContact O-N 2.97Å; H187-A190 PolarHBondContact O-N 3.47Å; A190-F194 VanDerWaalsContact O-CB 3.31Å; A190-F194 WeakPolarHBondContact O-CB 3.1Å; A190-F194 PolarHBondContact O-N 3.01Å
191	S	89.9	Confident	88.1	Confident	50 Å²	50	76.8 Å²	76.8	35%	0.35	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-41.7	176.9	75.2	0	0	0	0	112.4	H187 A188 F189 F194 F195	H187-S191 WeakPolarHBondContact O-CB 3.38Å; H187-S191 PolarHBondContact O-N 3.48Å; H187-S191 PolarHBondContact O-OG 2.96Å; A188-S191 PolarHBondContact O-N 3.31Å; A188-S191 PolarHBondContact O-OG 3.34Å; F189-S191 VanDerWaalsContact C-N 3.32Å; F189-S191 PolarHBondContact O-N 3Å; S191-F194 PolarHBondContact O-N 2.98Å; S191-F195 WeakPolarHBondContact O-CD2 3.45Å; S191-F195 PolarHBondContact O-N 3.24Å
192	A	88.9	Confident	88.7	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.008	42%	0.415	C	S	.	.	H	α-helix	trans	-65.1	-42.4	179.7	0	0	0	0	0	111.7	Y172 V176 I179 A188 F189 M196	Y172-A192 HydrophobicContact CD1-CB 4.36Å; V176-A192 HydrophobicContact CG2-CB 3.86Å; I179-A192 HydrophobicContact CD1-CB 4.27Å; A188-A192 WeakPolarHBondContact O-CB 3.25Å; A188-A192 PolarHBondContact O-N 2.99Å; F189-A192 PolarHBondContact O-N 3.33Å; A192-M196 VanDerWaalsContact O-CB 3.32Å; A192-M196 WeakPolarHBondContact O-CB 3.37Å; A192-M196 PolarHBondContact O-N 3.07Å
193	I	91.3	Very high	89.4	Confident	61 Å²	61	73.4 Å²	73.4	31%	0.313	39%	0.393	S	S	.	.	H	α-helix	trans	-65.3	-43.9	173.8	-68.4	-178.5	0	0	0	111	V176 F189 F195 M196 C197	V176-I193 HydrophobicContact CG2-CG1 4.39Å; F189-I193 HydrophobicContact CD1-CD1 3.85Å; F189-I193 HydrophobicContact CE1-CD1 3.25Å; F189-I193 HydrophobicContact CE1-CG1 4.37Å; F189-I193 HydrophobicContact CE2-CD1 4.16Å; F189-I193 HydrophobicContact CZ-CD1 3.44Å; F189-I193 VanDerWaalsContact CZ-CD1 3.44Å; F189-I193 HydrophobicContact CZ-CG1 4.46Å; F189-I193 PolarHBondContact O-N 3.15Å; I193-F195 PolarHBondContact O-N 3.36Å; I193-M196 WeakPolarHBondContact O-CB 3.36Å; I193-M196 PolarHBondContact O-N 2.92Å; I193-C197 WeakPolarHBondContact O-CB 3.44Å; I193-C197 PolarHBondContact O-N 3.37Å; I193-C197 PolarHBondContact O-SG 3.1Å; I193-C197 VanDerWaalsContact O-SG 3.41Å
194	F	92.9	Very high	90.3	Very high	130 Å²	130	69.1 Å²	69.1	57%	0.57	38%	0.376	S	S	*	.	H	α-helix	trans	-58.7	-48.5	178.4	177.4	-97.8	0	0	0	111.8	A190 S191 M196 C197 L198	A190-F194 VanDerWaalsContact O-CB 3.31Å; A190-F194 WeakPolarHBondContact O-CB 3.1Å; A190-F194 PolarHBondContact O-N 3.01Å; S191-F194 PolarHBondContact O-N 2.98Å; F194-M196 PolarHBondContact O-N 3.31Å; F194-C197 PolarHBondContact O-N 2.73Å; F194-L198 HydrophobicContact CE1-CD2 4.43Å; F194-L198 WeakPolarHBondContact O-CB 3.38Å; F194-L198 PolarHBondContact O-N 2.95Å
195	F	91.5	Very high	90.9	Very high	83 Å²	83	68.4 Å²	68.4	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-40.4	175.7	-75.1	-60.4	0	0	0	112	Y172 S191 I193 C197 L198 F199	Y172-F195 HydrophobicContact CD1-CB 4.11Å; Y172-F195 HydrophobicContact CE1-CB 3.62Å; Y172-F195 HydrophobicContact CE1-CD2 4.19Å; Y172-F195 HydrophobicContact CE1-CG 4.18Å; Y172-F195 HydrophobicContact CE2-CB 4.19Å; S191-F195 WeakPolarHBondContact O-CD2 3.45Å; S191-F195 PolarHBondContact O-N 3.24Å; I193-F195 PolarHBondContact O-N 3.36Å; F195-C197 PolarHBondContact O-N 2.8Å; F195-L198 HydrophobicContact CD1-CD2 4.45Å; F195-L198 PolarHBondContact O-N 2.82Å; F195-F199 HydrophobicContact CB-CD2 4.27Å; F195-F199 HydrophobicContact CB-CE2 4.01Å; F195-F199 HydrophobicContact CD1-CE2 4.23Å; F195-F199 HydrophobicContact CG-CE2 4.49Å; F195-F199 WeakPolarHBondContact O-CD2 3.36Å; F195-F199 WeakPolarHBondContact O-CG 3.14Å; F195-F199 PolarHBondContact O-N 2.82Å
196	M	91	Very high	91.3	Very high	52 Å²	52	65.1 Å²	65.1	26%	0.256	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-45	175	-169.8	-173.8	77.3	0	0	111.8	I169 A192 I193 F194 S200	I169-M196 HydrophobicContact CG2-CG 4.43Å; A192-M196 VanDerWaalsContact O-CB 3.32Å; A192-M196 WeakPolarHBondContact O-CB 3.37Å; A192-M196 PolarHBondContact O-N 3.07Å; I193-M196 WeakPolarHBondContact O-CB 3.36Å; I193-M196 PolarHBondContact O-N 2.92Å; F194-M196 PolarHBondContact O-N 3.31Å; M196-S200 VanDerWaalsContact O-CB 3.24Å; M196-S200 WeakPolarHBondContact O-CB 3.26Å; M196-S200 PolarHBondContact O-N 3.31Å; M196-S200 PolarHBondContact O-OG 3.4Å
197	C	92.7	Very high	91.5	Very high	68 Å²	68	62.5 Å²	62.5	46%	0.459	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-44.7	175.4	-72.5	0	0	0	0	111.7	I193 F194 F195 S200 F201	I193-C197 WeakPolarHBondContact O-CB 3.44Å; I193-C197 PolarHBondContact O-N 3.37Å; I193-C197 PolarHBondContact O-SG 3.1Å; I193-C197 VanDerWaalsContact O-SG 3.41Å; F194-C197 PolarHBondContact O-N 2.73Å; F195-C197 PolarHBondContact O-N 2.8Å; C197-S200 PolarHBondContact O-N 3.12Å; C197-F201 WeakPolarHBondContact O-CB 3.22Å; C197-F201 PolarHBondContact O-N 3.45Å
198	L	93.1	Very high	91.7	Very high	89 Å²	89	57.3 Å²	57.3	47%	0.466	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-48.3	178.9	-178.8	64.3	0	0	0	111.6	F194 F195 F201 G202	F194-L198 HydrophobicContact CE1-CD2 4.43Å; F194-L198 WeakPolarHBondContact O-CB 3.38Å; F194-L198 PolarHBondContact O-N 2.95Å; F195-L198 HydrophobicContact CD1-CD2 4.45Å; F195-L198 PolarHBondContact O-N 2.82Å; L198-F201 PolarHBondContact O-N 3.33Å; L198-G202 PolarHBondContact O-N 3.36Å
199	F	93.1	Very high	92	Very high	56 Å²	56	58.3 Å²	58.3	25%	0.246	34%	0.339	C	S	.	.	H	α-helix	trans	-68.5	-36.9	178.2	-68.8	-55	0	0	0	112.1	L168 Y172 F195 S203	L168-F199 HydrophobicContact CB-CD2 4.11Å; L168-F199 HydrophobicContact CB-CG 4.24Å; L168-F199 HydrophobicContact CD1-CD1 3.77Å; L168-F199 HydrophobicContact CD1-CD2 4.07Å; L168-F199 HydrophobicContact CD1-CE1 3.59Å; L168-F199 HydrophobicContact CD1-CE2 3.92Å; L168-F199 HydrophobicContact CD1-CG 4.03Å; L168-F199 HydrophobicContact CD1-CZ 3.68Å; Y172-F199 HydrophobicContact CD2-CD2 4.01Å; Y172-F199 HydrophobicContact CD2-CE2 4.25Å; Y172-F199 AromaticContact CE2-CD2 3.59Å; Y172-F199 HydrophobicContact CE2-CD2 3.59Å; Y172-F199 AromaticContact CE2-CE2 3.38Å; Y172-F199 HydrophobicContact CE2-CE2 3.38Å; Y172-F199 AromaticContact CZ-CE2 3.85Å; F195-F199 HydrophobicContact CB-CD2 4.27Å; F195-F199 HydrophobicContact CB-CE2 4.01Å; F195-F199 HydrophobicContact CD1-CE2 4.23Å; F195-F199 HydrophobicContact CG-CE2 4.49Å; F195-F199 WeakPolarHBondContact O-CD2 3.36Å; F195-F199 WeakPolarHBondContact O-CG 3.14Å; F195-F199 PolarHBondContact O-N 2.82Å; F199-S203 WeakPolarHBondContact O-CB 3.39Å; F199-S203 PolarHBondContact O-N 2.86Å; F199-S203 PolarHBondContact O-OG 3.29Å
200	S	91.5	Very high	92.1	Very high	36 Å²	36	57.3 Å²	57.3	25%	0.252	33%	0.333	S	S	.	.	H	α-helix	trans	-65.1	-42.8	176.5	-60.3	0	0	0	0	112.1	M196 C197 S203 S204	M196-S200 VanDerWaalsContact O-CB 3.24Å; M196-S200 WeakPolarHBondContact O-CB 3.26Å; M196-S200 PolarHBondContact O-N 3.31Å; M196-S200 PolarHBondContact O-OG 3.4Å; C197-S200 PolarHBondContact O-N 3.12Å; S200-S203 PolarHBondContact O-OG 2.87Å; S200-S203 VanDerWaalsContact O-OG 3.1Å; S200-S204 VanDerWaalsContact O-CB 3.29Å; S200-S204 WeakPolarHBondContact O-CB 3.29Å; S200-S204 PolarHBondContact O-N 3.3Å; S200-S204 VanDerWaalsContact O-N 3.1Å; S200-S204 PolarHBondContact O-OG 2.81Å
201	F	93.9	Very high	92.1	Very high	152 Å²	152	55.8 Å²	55.8	67%	0.667	32%	0.323	S	S	*	.	H	α-helix	trans	-70.2	-46.7	177.8	-174.8	-100.1	0	0	0	111.3	C197 L198 S203 S204 L205	C197-F201 WeakPolarHBondContact O-CB 3.22Å; C197-F201 PolarHBondContact O-N 3.45Å; L198-F201 PolarHBondContact O-N 3.33Å; F201-S203 PolarHBondContact O-N 3.34Å; F201-S204 PolarHBondContact O-N 3.22Å; F201-L205 WeakPolarHBondContact O-CB 3.45Å; F201-L205 PolarHBondContact O-N 2.86Å
202	G	93.4	Very high	92.1	Very high	34 Å²	34	55.4 Å²	55.4	35%	0.351	33%	0.327	S	S	.	.	H	α-helix	trans	-60.5	-42.6	177.4	0	0	0	0	0	112.6	L198 S206	L198-G202 PolarHBondContact O-N 3.36Å; G202-S206 VanDerWaalsContact O-CB 3.28Å; G202-S206 WeakPolarHBondContact O-CB 3.36Å; G202-S206 PolarHBondContact O-N 3.08Å
203	S	92.8	Very high	92.2	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.028	33%	0.334	C	S	.	.	H	α-helix	trans	-68.3	-39.5	178.1	72.7	0	0	0	0	112.2	F199 S200 F201 S206 A207	F199-S203 WeakPolarHBondContact O-CB 3.39Å; F199-S203 PolarHBondContact O-N 2.86Å; F199-S203 PolarHBondContact O-OG 3.29Å; S200-S203 PolarHBondContact O-OG 2.87Å; S200-S203 VanDerWaalsContact O-OG 3.1Å; F201-S203 PolarHBondContact O-N 3.34Å; S203-S206 PolarHBondContact O-N 3.02Å; S203-A207 WeakPolarHBondContact O-CB 3.5Å; S203-A207 PolarHBondContact O-N 3.4Å
204	S	93	Very high	92.1	Very high	78 Å²	78	54 Å²	54	55%	0.545	32%	0.321	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176.6	-62.1	0	0	0	0	111.6	S200 F201 A207 G208	S200-S204 VanDerWaalsContact O-CB 3.29Å; S200-S204 WeakPolarHBondContact O-CB 3.29Å; S200-S204 PolarHBondContact O-N 3.3Å; S200-S204 VanDerWaalsContact O-N 3.1Å; S200-S204 PolarHBondContact O-OG 2.81Å; F201-S204 PolarHBondContact O-N 3.22Å; S204-A207 PolarHBondContact O-N 3.12Å; S204-G208 PolarHBondContact O-N 3.07Å
205	L	94.9	Very high	91.9	Very high	103 Å²	103	52.2 Å²	52.2	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-47.7	175.4	-178.3	61.4	0	0	0	111.1	F201 A207 G208 C209	F201-L205 WeakPolarHBondContact O-CB 3.45Å; F201-L205 PolarHBondContact O-N 2.86Å; L205-A207 VanDerWaalsContact C-N 3.29Å; L205-A207 PolarHBondContact O-N 3.16Å; L205-G208 WeakPolarHBondContact O-CA 3.09Å; L205-G208 PolarHBondContact O-N 2.9Å; L205-G208 VanDerWaalsContact O-N 3.09Å; L205-C209 PolarHBondContact O-N 2.84Å; L205-C209 PolarHBondContact O-SG 3.01Å; L205-C209 VanDerWaalsContact O-SG 3.41Å
206	S	93.9	Very high	91.9	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-35.7	177.4	-162.1	0	0	0	0	112.2	F158 A162 G202 S203 C209 R210	F158-S206 WeakPolarHBondContact CA-OG 3.39Å; F158-S206 PolarHBondContact O-OG 3.16Å; A162-S206 PolarHBondContact N-OG 2.91Å; G202-S206 VanDerWaalsContact O-CB 3.28Å; G202-S206 WeakPolarHBondContact O-CB 3.36Å; G202-S206 PolarHBondContact O-N 3.08Å; S203-S206 PolarHBondContact O-N 3.02Å; S206-C209 PolarHBondContact O-N 3.02Å; S206-R210 PolarHBondContact O-N 2.9Å
207	A	90.3	Very high	91.8	Very high	21 Å²	21	52.4 Å²	52.4	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-69.3	-30.8	173.6	0	0	0	0	0	113	A162 S203 S204 L205 R210 G211	A162-A207 HydrophobicContact CB-CB 4.31Å; S203-A207 WeakPolarHBondContact O-CB 3.5Å; S203-A207 PolarHBondContact O-N 3.4Å; S204-A207 PolarHBondContact O-N 3.12Å; L205-A207 VanDerWaalsContact C-N 3.29Å; L205-A207 PolarHBondContact O-N 3.16Å; A207-R210 VanDerWaalsContact O-CG 3.3Å; A207-R210 WeakPolarHBondContact O-CG 3.01Å; A207-G211 PolarHBondContact O-N 3.44Å
208	G	92.3	Very high	91.5	Very high	48 Å²	48	51.3 Å²	51.3	50%	0.495	31%	0.306	S	S	.	.	H	α-helix	trans	-67	-51.2	169.2	0	0	0	0	0	111.5	S204 L205 R210 G211 G212	S204-G208 PolarHBondContact O-N 3.07Å; L205-G208 WeakPolarHBondContact O-CA 3.09Å; L205-G208 PolarHBondContact O-N 2.9Å; L205-G208 VanDerWaalsContact O-N 3.09Å; G208-R210 PolarHBondContact O-N 3.31Å; G208-G211 PolarHBondContact O-N 2.85Å; G208-G211 VanDerWaalsContact O-N 3.13Å; G208-G212 PolarHBondContact O-N 3.42Å
209	C	93.3	Very high	91.4	Very high	46 Å²	46	50.2 Å²	50.2	31%	0.311	31%	0.306	S	S	.	.	H	α-helix	trans	-58.9	-46.4	178.8	-67	0	0	0	0	112.2	F158 L205 S206 G211 G212 C213	F158-C209 HydrophobicContact CB-CB 4.45Å; F158-C209 HydrophobicContact CD1-CB 3.93Å; F158-C209 HydrophobicContact CD2-CB 3.89Å; F158-C209 HydrophobicContact CE1-CB 4.1Å; F158-C209 HydrophobicContact CE2-CB 4.06Å; F158-C209 HydrophobicContact CG-CB 3.83Å; F158-C209 HydrophobicContact CZ-CB 4.16Å; L205-C209 PolarHBondContact O-N 2.84Å; L205-C209 PolarHBondContact O-SG 3.01Å; L205-C209 VanDerWaalsContact O-SG 3.41Å; S206-C209 PolarHBondContact O-N 3.02Å; C209-G211 VanDerWaalsContact C-N 3.29Å; C209-G211 PolarHBondContact O-N 2.94Å; C209-G212 PolarHBondContact O-N 3.43Å; C209-C213 PolarHBondContact O-N 2.96Å; C209-C213 PolarHBondContact O-SG 3.31Å
210	R	90.7	Very high	91.2	Very high	31 Å²	31	53.2 Å²	53.2	12%	0.117	32%	0.316	C	S	.	.	H	α-helix	trans	-58.9	-42.9	175.8	83.8	-173.6	172.9	81.3	9.6	111	F158 S206 A207 G208 C213 F214 N269	F158-R210 HydrophobicContact CB-CB 3.91Å; S206-R210 PolarHBondContact O-N 2.9Å; A207-R210 VanDerWaalsContact O-CG 3.3Å; A207-R210 WeakPolarHBondContact O-CG 3.01Å; G208-R210 PolarHBondContact O-N 3.31Å; R210-C213 PolarHBondContact O-N 3.18Å; R210-F214 WeakPolarHBondContact O-CD2 3.44Å; R210-F214 PolarHBondContact O-N 3.49Å; R210-N269 PolarHBondContact NH1-OD1 2.89Å
211	G	89	Confident	91.1	Very high	25 Å²	25	51.9 Å²	51.9	26%	0.258	31%	0.306	S	S	.	.	H	α-helix	trans	-62.8	-47.5	-179.2	0	0	0	0	0	111	A207 G208 C209 F214 T215	A207-G211 PolarHBondContact O-N 3.44Å; G208-G211 PolarHBondContact O-N 2.85Å; G208-G211 VanDerWaalsContact O-N 3.13Å; C209-G211 VanDerWaalsContact C-N 3.29Å; C209-G211 PolarHBondContact O-N 2.94Å; G211-F214 PolarHBondContact O-N 3.33Å; G211-T215 WeakPolarHBondContact O-CB 3.37Å; G211-T215 PolarHBondContact O-N 3.48Å; G211-T215 PolarHBondContact O-OG1 3.46Å
212	G	90.8	Very high	90.8	Very high	42 Å²	42	45.6 Å²	45.6	43%	0.433	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-48	174.9	0	0	0	0	0	112.9	G208 C209 F214 T215 Y216	G208-G212 PolarHBondContact O-N 3.42Å; C209-G212 PolarHBondContact O-N 3.43Å; G212-F214 PolarHBondContact O-N 3.01Å; G212-T215 PolarHBondContact O-N 3.32Å; G212-Y216 WeakPolarHBondContact O-CB 3.18Å; G212-Y216 PolarHBondContact O-N 3.21Å
213	C	90.6	Very high	90.6	Very high	21 Å²	21	49.1 Å²	49.1	14%	0.142	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-44.7	178.7	-67.5	0	0	0	0	112.4	L151 A155 C209 R210 T217	L151-C213 HydrophobicContact CD1-CB 3.94Å; L151-C213 HydrophobicContact CG-CB 4.23Å; A155-C213 HydrophobicContact CB-CB 3.71Å; C209-C213 PolarHBondContact O-N 2.96Å; C209-C213 PolarHBondContact O-SG 3.31Å; R210-C213 PolarHBondContact O-N 3.18Å; C213-T217 WeakPolarHBondContact O-CB 3.49Å; C213-T217 PolarHBondContact O-N 3.27Å; C213-T217 PolarHBondContact O-OG1 3.01Å
214	F	88.9	Confident	90.5	Very high	12 Å²	12	50.9 Å²	50.9	5%	0.053	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-44.2	177	-88.5	-70	0	0	0	112.2	L152 A155 R210 G211 G212 Y216 T217 M218 P265 N269	L152-F214 HydrophobicContact CD2-CD1 4.18Å; L152-F214 HydrophobicContact CD2-CE1 3.76Å; A155-F214 HydrophobicContact CB-CD2 3.83Å; A155-F214 HydrophobicContact CB-CE2 3.65Å; A155-F214 HydrophobicContact CB-CG 4.44Å; A155-F214 HydrophobicContact CB-CZ 4.13Å; R210-F214 WeakPolarHBondContact O-CD2 3.44Å; R210-F214 PolarHBondContact O-N 3.49Å; G211-F214 PolarHBondContact O-N 3.33Å; G212-F214 PolarHBondContact O-N 3.01Å; F214-Y216 PolarHBondContact O-N 3.04Å; F214-T217 PolarHBondContact O-N 2.9Å; F214-M218 VanDerWaalsContact O-CB 3.27Å; F214-M218 WeakPolarHBondContact O-CB 3.3Å; F214-M218 PolarHBondContact O-N 3.04Å; F214-P265 HydrophobicContact CD1-CB 4.34Å; F214-N269 HydrophobicContact CD1-CB 3.89Å; F214-N269 HydrophobicContact CD2-CB 3.95Å; F214-N269 HydrophobicContact CE1-CB 3.76Å; F214-N269 HydrophobicContact CE2-CB 3.83Å; F214-N269 WeakPolarHBondContact CE2-OD1 3.45Å; F214-N269 HydrophobicContact CG-CB 4Å; F214-N269 HydrophobicContact CZ-CB 3.73Å
215	T	89.6	Confident	90.4	Very high	92 Å²	92	47.2 Å²	47.2	56%	0.564	27%	0.269	S	S	*	.	H	α-helix	trans	-63.2	-41.7	178.2	-60.3	0	0	0	0	111.8	G211 G212 M218 S219	G211-T215 WeakPolarHBondContact O-CB 3.37Å; G211-T215 PolarHBondContact O-N 3.48Å; G211-T215 PolarHBondContact O-OG1 3.46Å; G212-T215 PolarHBondContact O-N 3.32Å; T215-M218 PolarHBondContact O-N 3.06Å; T215-S219 PolarHBondContact O-N 3.46Å
216	Y	90.4	Very high	90.2	Very high	139 Å²	139	46 Å²	46	55%	0.545	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-45.3	175.9	-176	-90.7	0	0	0	111.6	L151 G212 F214 M218 S219 R220	L151-Y216 HydrophobicContact CD2-CD1 3.37Å; L151-Y216 HydrophobicContact CD2-CE1 4.09Å; L151-Y216 HydrophobicContact CD2-CG 4.3Å; G212-Y216 WeakPolarHBondContact O-CB 3.18Å; G212-Y216 PolarHBondContact O-N 3.21Å; F214-Y216 PolarHBondContact O-N 3.04Å; Y216-M218 VanDerWaalsContact C-N 3.32Å; Y216-M218 PolarHBondContact O-N 3.35Å; Y216-S219 PolarHBondContact O-N 3.12Å; Y216-R220 HydrophobicContact CD1-CG 4.21Å; Y216-R220 HydrophobicContact CE1-CG 3.86Å; Y216-R220 PolarHBondContact O-N 3.41Å
217	T	89.1	Confident	90.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-45.8	175.4	-55.3	0	0	0	0	111.4	D148 L151 L152 C213 F214 S219 R220 I221	D148-T217 HydrophobicContact CB-CG2 3.88Å; L151-T217 WeakPolarHBondContact CD2-OG1 3.46Å; L152-T217 HydrophobicContact CD2-CG2 4.04Å; L152-T217 HydrophobicContact CG-CG2 4.15Å; C213-T217 WeakPolarHBondContact O-CB 3.49Å; C213-T217 PolarHBondContact O-N 3.27Å; C213-T217 PolarHBondContact O-OG1 3.01Å; F214-T217 PolarHBondContact O-N 2.9Å; T217-S219 PolarHBondContact O-N 3.06Å; T217-R220 PolarHBondContact O-N 3.2Å; T217-I221 HydrophobicContact CG2-CD1 3.83Å; T217-I221 HydrophobicContact CG2-CG1 4.47Å; T217-I221 WeakPolarHBondContact O-CG1 3.41Å; T217-I221 PolarHBondContact O-N 3.01Å
218	M	87.8	Confident	90.2	Very high	45 Å²	45	55.4 Å²	55.4	22%	0.222	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-44	178	175.6	177.3	158.2	0	0	112.1	F214 T215 Y216 I221 N222 N262 P265	F214-M218 VanDerWaalsContact O-CB 3.27Å; F214-M218 WeakPolarHBondContact O-CB 3.3Å; F214-M218 PolarHBondContact O-N 3.04Å; T215-M218 PolarHBondContact O-N 3.06Å; Y216-M218 VanDerWaalsContact C-N 3.32Å; Y216-M218 PolarHBondContact O-N 3.35Å; M218-I221 PolarHBondContact O-N 2.91Å; M218-N222 WeakPolarHBondContact O-CB 3.22Å; M218-N222 PolarHBondContact O-N 3.35Å; M218-N262 HydrophobicContact CE-CB 3.61Å; M218-N262 VanDerWaalsContact CE-ND2 3.29Å; M218-N262 WeakPolarHBondContact CE-ND2 3.47Å; M218-N262 WeakPolarHBondContact CE-OD1 3.29Å; M218-N262 WeakPolarHBondContact CG-OD1 3.33Å; M218-N262 HydrophobicContact SD-CB 4.41Å; M218-P265 HydrophobicContact CB-CB 4.29Å; M218-P265 HydrophobicContact CB-CG 4.21Å
219	S	89.1	Confident	90.1	Very high	66 Å²	66	53.1 Å²	53.1	46%	0.462	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-43.7	175.8	-177	0	0	0	0	112.4	T215 Y216 T217 I221 N222 L223	T215-S219 PolarHBondContact O-N 3.46Å; Y216-S219 PolarHBondContact O-N 3.12Å; T217-S219 PolarHBondContact O-N 3.06Å; S219-I221 PolarHBondContact O-N 3.24Å; S219-N222 WeakPolarHBondContact O-CB 3.49Å; S219-N222 PolarHBondContact O-N 2.97Å; S219-L223 WeakPolarHBondContact O-CG 3.37Å; S219-L223 PolarHBondContact O-N 2.85Å
220	R	89.6	Confident	90.1	Very high	120 Å²	120	56.1 Å²	56.1	45%	0.453	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-42.3	176.9	-70.7	-147.6	72.6	-179.3	5.3	112.9	Y216 T217 N222 R224	Y216-R220 HydrophobicContact CD1-CG 4.21Å; Y216-R220 HydrophobicContact CE1-CG 3.86Å; Y216-R220 PolarHBondContact O-N 3.41Å; T217-R220 PolarHBondContact O-N 3.2Å; R220-N222 VanDerWaalsContact C-N 3.35Å; R220-R224 WeakPolarHBondContact O-CB 3.41Å; R220-R224 PolarHBondContact O-N 3.49Å; R220-R224 VanDerWaalsContact O-N 3.1Å
221	I	88.7	Confident	90.2	Very high	8 Å²	8	56.9 Å²	56.9	4%	0.041	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-43	176.3	-68.5	169.6	0	0	0	110.1	T217 M218 S219 L223 R224 I225 P265	T217-I221 HydrophobicContact CG2-CD1 3.83Å; T217-I221 HydrophobicContact CG2-CG1 4.47Å; T217-I221 WeakPolarHBondContact O-CG1 3.41Å; T217-I221 PolarHBondContact O-N 3.01Å; M218-I221 PolarHBondContact O-N 2.91Å; S219-I221 PolarHBondContact O-N 3.24Å; I221-L223 PolarHBondContact O-N 3.38Å; I221-R224 PolarHBondContact O-N 3.08Å; I221-I225 HydrophobicContact CG2-CD1 3.66Å; I221-I225 HydrophobicContact CG2-CG1 4.29Å; I221-I225 WeakPolarHBondContact O-CG1 3.27Å; I221-I225 PolarHBondContact O-N 3.05Å; I221-P265 HydrophobicContact CD1-CG 4.05Å
222	N	88.6	Confident	90.3	Very high	19 Å²	19	56.6 Å²	56.6	10%	0.102	29%	0.286	C	S	.	.	H	α-helix	trans	-58.4	-48.9	177.6	-174.9	-98.3	0	0	0	112.2	M218 S219 R220 R224 I225 R226 T257 T258 S261	M218-N222 WeakPolarHBondContact O-CB 3.22Å; M218-N222 PolarHBondContact O-N 3.35Å; S219-N222 WeakPolarHBondContact O-CB 3.49Å; S219-N222 PolarHBondContact O-N 2.97Å; R220-N222 VanDerWaalsContact C-N 3.35Å; N222-R224 PolarHBondContact O-N 3.44Å; N222-I225 PolarHBondContact O-N 3.15Å; N222-R226 WeakPolarHBondContact O-CB 3.49Å; N222-R226 WeakPolarHBondContact O-CG 3.39Å; N222-R226 PolarHBondContact O-N 3.1Å; N222-R226 WeakPolarHBondContact OD1-CD 3.42Å; N222-R226 PolarHBondContact OD1-NE 2.77Å; N222-T257 PolarHBondContact ND2-O 2.82Å; N222-T258 WeakPolarHBondContact ND2-CA 3.29Å; N222-S261 WeakPolarHBondContact CB-OG 3.35Å; N222-S261 PolarHBondContact ND2-OG 2.98Å
223	L	90	Very high	90.3	Very high	109 Å²	109	55.2 Å²	55.2	57%	0.571	27%	0.269	S	S	*	.	H	α-helix	trans	-59.3	-46.2	177.7	-70.6	172.7	0	0	0	111.7	S219 I221 I225 R226 E227	S219-L223 WeakPolarHBondContact O-CG 3.37Å; S219-L223 PolarHBondContact O-N 2.85Å; I221-L223 PolarHBondContact O-N 3.38Å; L223-I225 PolarHBondContact O-N 2.82Å; L223-R226 PolarHBondContact O-N 3.41Å; L223-E227 WeakPolarHBondContact O-CB 3.4Å; L223-E227 PolarHBondContact O-N 3.39Å
224	R	90.4	Very high	90.2	Very high	41 Å²	41	59.8 Å²	59.8	16%	0.155	29%	0.291	C	S	.	.	H	α-helix	trans	-62.3	-43.9	179.4	-170.6	-177.3	-63.3	138.6	9.5	112.3	L144 D148 R220 I221 N222 Q228	L144-R224 PolarHBondContact O-NH1 3.45Å; D148-R224 IonicContact OD1-NH2 3.85Å; D148-R224 IonicContact OD2-CZ 2.68Å; D148-R224 IonicContact OD2-NH1 3.15Å; D148-R224 PolarHBondContact OD2-NH1 2.74Å; D148-R224 IonicContact OD2-NH2 2.74Å; D148-R224 PolarHBondContact OD2-NH2 3.01Å; R220-R224 WeakPolarHBondContact O-CB 3.41Å; R220-R224 PolarHBondContact O-N 3.49Å; R220-R224 VanDerWaalsContact O-N 3.1Å; I221-R224 PolarHBondContact O-N 3.08Å; N222-R224 PolarHBondContact O-N 3.44Å; R224-Q228 WeakPolarHBondContact O-CB 3.14Å; R224-Q228 VanDerWaalsContact O-CG 3.29Å; R224-Q228 WeakPolarHBondContact O-CG 3.42Å; R224-Q228 PolarHBondContact O-N 2.99Å
225	I	90.1	Very high	90.2	Very high	0 Å²	0	68 Å²	68	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-44.9	177.5	-69.4	172	0	0	0	110.3	L144 I221 N222 L223 Q228 L229 T257 M260 V443 M447	L144-I225 HydrophobicContact CD2-CD1 4.03Å; L144-I225 HydrophobicContact CD2-CG1 3.39Å; I221-I225 HydrophobicContact CG2-CD1 3.66Å; I221-I225 HydrophobicContact CG2-CG1 4.29Å; I221-I225 WeakPolarHBondContact O-CG1 3.27Å; I221-I225 PolarHBondContact O-N 3.05Å; N222-I225 PolarHBondContact O-N 3.15Å; L223-I225 PolarHBondContact O-N 2.82Å; I225-Q228 PolarHBondContact O-N 3.44Å; I225-L229 VanDerWaalsContact O-CB 3.23Å; I225-L229 WeakPolarHBondContact O-CB 3.43Å; I225-L229 PolarHBondContact O-N 3.15Å; I225-T257 HydrophobicContact CG2-CG2 3.87Å; I225-M260 HydrophobicContact CD1-CE 4.31Å; I225-M260 HydrophobicContact CD1-CG 4.3Å; I225-M260 HydrophobicContact CD1-SD 4.27Å; I225-M260 HydrophobicContact CG2-SD 4.28Å; I225-V443 HydrophobicContact CG2-CG1 4.05Å; I225-M447 HydrophobicContact CG2-CE 4.33Å
226	R	91.3	Very high	90.2	Very high	79 Å²	79	64.2 Å²	64.2	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-43.2	178.9	-76.4	-179.7	172.6	-174.9	0.1	112.2	N222 L223 F230 L253 S254 T257 T258	N222-R226 WeakPolarHBondContact O-CB 3.49Å; N222-R226 WeakPolarHBondContact O-CG 3.39Å; N222-R226 PolarHBondContact O-N 3.1Å; N222-R226 WeakPolarHBondContact OD1-CD 3.42Å; N222-R226 PolarHBondContact OD1-NE 2.77Å; L223-R226 PolarHBondContact O-N 3.41Å; R226-F230 WeakPolarHBondContact O-CB 3.37Å; R226-F230 PolarHBondContact O-N 2.82Å; R226-L253 HydrophobicContact CB-CD1 4.46Å; R226-L253 PolarHBondContact NE-O 3.46Å; R226-S254 PolarHBondContact NH2-O 2.96Å; R226-T257 HydrophobicContact CG-CG2 4.03Å; R226-T257 WeakPolarHBondContact CG-OG1 3.41Å; R226-T257 PolarHBondContact NE-OG1 3.24Å; R226-T257 VanDerWaalsContact NE-OG1 3.14Å; R226-T258 PolarHBondContact NH2-OG1 2.88Å
227	E	91.8	Very high	90.2	Very high	143 Å²	143	58.3 Å²	58.3	67%	0.668	28%	0.276	S	S	*	.	H	α-helix	trans	-61.8	-49.1	176.3	-175.8	-174.8	-178.6	0	0	111.5	L223 F230 S231	L223-E227 WeakPolarHBondContact O-CB 3.4Å; L223-E227 PolarHBondContact O-N 3.39Å; E227-F230 PolarHBondContact O-N 2.74Å; E227-S231 VanDerWaalsContact O-CB 3.3Å; E227-S231 WeakPolarHBondContact O-CB 3.35Å; E227-S231 PolarHBondContact O-N 3.48Å
228	Q	91.3	Very high	90	Very high	78 Å²	78	61.5 Å²	61.5	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-64.2	-42.4	178.9	-73.1	178.2	-3.6	0	0	112.2	R224 I225 S232 M447	R224-Q228 WeakPolarHBondContact O-CB 3.14Å; R224-Q228 VanDerWaalsContact O-CG 3.29Å; R224-Q228 WeakPolarHBondContact O-CG 3.42Å; R224-Q228 PolarHBondContact O-N 2.99Å; I225-Q228 PolarHBondContact O-N 3.44Å; Q228-S232 WeakPolarHBondContact O-CB 3.18Å; Q228-S232 PolarHBondContact O-N 3.1Å; Q228-M447 HydrophobicContact CB-CE 3.82Å; Q228-M447 HydrophobicContact CB-SD 4.11Å
229	L	91.9	Very high	89.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-48.5	177	179.2	62.1	0	0	0	110.5	I225 S231 S232 L233 L253 T257 V443 M447	I225-L229 VanDerWaalsContact O-CB 3.23Å; I225-L229 WeakPolarHBondContact O-CB 3.43Å; I225-L229 PolarHBondContact O-N 3.15Å; L229-S231 PolarHBondContact O-N 3.33Å; L229-S232 PolarHBondContact O-N 3.46Å; L229-S232 VanDerWaalsContact O-N 3.16Å; L229-L233 HydrophobicContact CD1-CD1 4.31Å; L229-L233 HydrophobicContact CD1-CG 4.19Å; L229-L233 HydrophobicContact CG-CD1 4.04Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CB 3.34Å; L229-L233 VanDerWaalsContact O-CG 3.27Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 3.48Å; L229-L253 HydrophobicContact CB-CD1 4.33Å; L229-L253 HydrophobicContact CD2-CD1 3.95Å; L229-L253 HydrophobicContact CG-CD1 4.19Å; L229-T257 HydrophobicContact CD2-CG2 3.52Å; L229-V443 HydrophobicContact CD2-CG1 4.29Å; L229-M447 HydrophobicContact CB-CE 4.21Å
230	F	92.7	Very high	89.7	Confident	108 Å²	108	56.6 Å²	56.6	47%	0.474	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-44.5	178.6	-173.4	-110	0	0	0	111.7	R226 E227 S232 L233 L234 L253	R226-F230 WeakPolarHBondContact O-CB 3.37Å; R226-F230 PolarHBondContact O-N 2.82Å; E227-F230 PolarHBondContact O-N 2.74Å; F230-S232 VanDerWaalsContact C-N 3.31Å; F230-S232 PolarHBondContact O-N 3.49Å; F230-L233 PolarHBondContact O-N 3.29Å; F230-L234 HydrophobicContact CD1-CD1 3.95Å; F230-L234 HydrophobicContact CD1-CG 4.49Å; F230-L234 HydrophobicContact CE1-CD1 3.44Å; F230-L234 VanDerWaalsContact CE1-CD1 3.44Å; F230-L234 HydrophobicContact CE1-CG 4.18Å; F230-L234 HydrophobicContact CE2-CD1 4.49Å; F230-L234 HydrophobicContact CE2-CG 4.43Å; F230-L234 HydrophobicContact CZ-CD1 3.75Å; F230-L234 HydrophobicContact CZ-CD2 4.27Å; F230-L234 HydrophobicContact CZ-CG 4.13Å; F230-L234 WeakPolarHBondContact O-CG 3.48Å; F230-L234 PolarHBondContact O-N 2.96Å; F230-L253 HydrophobicContact CB-CD1 4.15Å; F230-L253 HydrophobicContact CD2-CD2 3.93Å
231	S	91.8	Very high	89.5	Confident	48 Å²	48	54.7 Å²	54.7	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-36.2	175.1	-180	0	0	0	0	112.6	E227 L229 R235	E227-S231 VanDerWaalsContact O-CB 3.3Å; E227-S231 WeakPolarHBondContact O-CB 3.35Å; E227-S231 PolarHBondContact O-N 3.48Å; L229-S231 PolarHBondContact O-N 3.33Å; S231-R235 WeakPolarHBondContact O-CG 3.43Å
232	S	91.3	Very high	89.2	Confident	19 Å²	19	59.1 Å²	59.1	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-72	-42.1	176.7	-173	0	0	0	0	111.4	Q228 L229 F230 L234 R235 Q236 Y446 M447	Q228-S232 WeakPolarHBondContact O-CB 3.18Å; Q228-S232 PolarHBondContact O-N 3.1Å; L229-S232 PolarHBondContact O-N 3.46Å; L229-S232 VanDerWaalsContact O-N 3.16Å; F230-S232 VanDerWaalsContact C-N 3.31Å; F230-S232 PolarHBondContact O-N 3.49Å; S232-L234 PolarHBondContact O-N 2.95Å; S232-R235 PolarHBondContact O-N 2.85Å; S232-R235 VanDerWaalsContact O-N 3.12Å; S232-Q236 WeakPolarHBondContact O-CG 3.23Å; S232-Q236 PolarHBondContact O-N 2.84Å; S232-Q236 PolarHBondContact O-NE2 3.32Å; S232-Q236 VanDerWaalsContact O-NE2 3.08Å; S232-Q236 PolarHBondContact OG-NE2 3.47Å; S232-Y446 PolarHBondContact OG-O 2.85Å; S232-M447 PolarHBondContact OG-O 2.95Å
233	L	91.3	Very high	88.9	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-46.2	176.4	-72.9	174	0	0	0	111.7	L229 F230 R235 Q236 F240 F241 L249 Y446	L229-L233 HydrophobicContact CD1-CD1 4.31Å; L229-L233 HydrophobicContact CD1-CG 4.19Å; L229-L233 HydrophobicContact CG-CD1 4.04Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CB 3.34Å; L229-L233 VanDerWaalsContact O-CG 3.27Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 3.48Å; F230-L233 PolarHBondContact O-N 3.29Å; L233-R235 PolarHBondContact O-N 3.37Å; L233-R235 VanDerWaalsContact O-N 3.16Å; L233-Q236 WeakPolarHBondContact O-CB 3.35Å; L233-Q236 WeakPolarHBondContact O-CG 3.45Å; L233-Q236 PolarHBondContact O-N 3.25Å; L233-F240 HydrophobicContact CD2-CE1 3.81Å; L233-F240 HydrophobicContact CD2-CZ 3.8Å; L233-F241 WeakPolarHBondContact O-CE2 3.27Å; L233-F241 WeakPolarHBondContact O-CZ 3.46Å; L233-L249 HydrophobicContact CD2-CD2 3.92Å; L233-Y446 HydrophobicContact CD2-CD1 3.99Å
234	L	89.5	Confident	88.5	Confident	117 Å²	117	59.8 Å²	59.8	61%	0.613	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.3	178.8	-70.9	-178.5	0	0	0	114.4	F230 S232	F230-L234 HydrophobicContact CD1-CD1 3.95Å; F230-L234 HydrophobicContact CD1-CG 4.49Å; F230-L234 HydrophobicContact CE1-CD1 3.44Å; F230-L234 VanDerWaalsContact CE1-CD1 3.44Å; F230-L234 HydrophobicContact CE1-CG 4.18Å; F230-L234 HydrophobicContact CE2-CD1 4.49Å; F230-L234 HydrophobicContact CE2-CG 4.43Å; F230-L234 HydrophobicContact CZ-CD1 3.75Å; F230-L234 HydrophobicContact CZ-CD2 4.27Å; F230-L234 HydrophobicContact CZ-CG 4.13Å; F230-L234 WeakPolarHBondContact O-CG 3.48Å; F230-L234 PolarHBondContact O-N 2.96Å; S232-L234 PolarHBondContact O-N 2.95Å
235	R	88.3	Confident	88.1	Confident	183 Å²	183	65.8 Å²	65.8	69%	0.691	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-4.3	176.5	-67.4	175.1	-174.8	-169	2.3	113.1	S231 S232 L233 P451	S231-R235 WeakPolarHBondContact O-CG 3.43Å; S232-R235 PolarHBondContact O-N 2.85Å; S232-R235 VanDerWaalsContact O-N 3.12Å; L233-R235 PolarHBondContact O-N 3.37Å; L233-R235 VanDerWaalsContact O-N 3.16Å; R235-P451 WeakPolarHBondContact O-CB 3.35Å
236	Q	90.1	Very high	87.6	Confident	14 Å²	14	71.4 Å²	71.4	7%	0.065	34%	0.34	C	S	.	.	S	Bend	trans	-71.9	154	178.4	-58.7	-54.7	-46.1	0	0	111.3	S232 L233 F240 F241 R449	S232-Q236 WeakPolarHBondContact O-CG 3.23Å; S232-Q236 PolarHBondContact O-N 2.84Å; S232-Q236 PolarHBondContact O-NE2 3.32Å; S232-Q236 VanDerWaalsContact O-NE2 3.08Å; S232-Q236 PolarHBondContact OG-NE2 3.47Å; L233-Q236 WeakPolarHBondContact O-CB 3.35Å; L233-Q236 WeakPolarHBondContact O-CG 3.45Å; L233-Q236 PolarHBondContact O-N 3.25Å; Q236-F240 HydrophobicContact CB-CB 4.25Å; Q236-F240 HydrophobicContact CB-CD1 3.72Å; Q236-F240 HydrophobicContact CB-CE1 4.33Å; Q236-F240 HydrophobicContact CB-CG 4.08Å; Q236-F240 HydrophobicContact CG-CD1 4.11Å; Q236-F240 HydrophobicContact CG-CE1 4.28Å; Q236-F240 HydrophobicContact CG-CG 4.48Å; Q236-F241 HydrophobicContact CB-CE2 4.11Å; Q236-R449 PolarHBondContact NE2-O 3.43Å; Q236-R449 VanDerWaalsContact OE1-CG 3.31Å; Q236-R449 PolarHBondContact OE1-O 3.37Å
237	D	88.9	Confident	87	Confident	14 Å²	14	70.3 Å²	70.3	8%	0.075	35%	0.353	C	S	.	.			trans	-65.8	158.8	174.1	59.5	-87.4	0	0	0	112.3	G239 F240 F241 R449 N452 L453	D237-G239 PolarHBondContact O-N 2.9Å; D237-G239 WeakPolarHBondContact OD2-CA 3.4Å; D237-G239 PolarHBondContact OD2-N 3.3Å; D237-G239 VanDerWaalsContact OD2-N 3.15Å; D237-F240 WeakPolarHBondContact O-CB 3.36Å; D237-F240 PolarHBondContact O-N 2.95Å; D237-F240 PolarHBondContact OD2-N 3.2Å; D237-F241 WeakPolarHBondContact O-CD2 3.4Å; D237-R449 IonicContact OD1-CZ 2.73Å; D237-R449 IonicContact OD1-NH1 3.28Å; D237-R449 PolarHBondContact OD1-NH1 2.74Å; D237-R449 IonicContact OD1-NH2 3.48Å; D237-R449 PolarHBondContact OD1-NH2 3.34Å; D237-R449 VanDerWaalsContact OD1-NH2 3.15Å; D237-R449 IonicContact OD2-NH2 3.57Å; D237-N452 PolarHBondContact OD1-N 3.37Å; D237-L453 HydrophobicContact CB-CD1 3.75Å; D237-L453 HydrophobicContact CB-CG 4.11Å
238	L	86.6	Confident	86.5	Confident	67 Å²	67	66.8 Å²	66.8	35%	0.351	34%	0.337	S	S	.	.	H	α-helix	trans	-66.7	-24.1	179.4	-78.6	152.4	0	0	0	113.5	F240 F241 Q242 L519 Y520	L238-F240 VanDerWaalsContact C-N 3.32Å; L238-F240 PolarHBondContact O-N 2.99Å; L238-F241 PolarHBondContact O-N 3.4Å; L238-Q242 WeakPolarHBondContact O-CG 3.45Å; L238-Q242 PolarHBondContact O-N 3.29Å; L238-L519 HydrophobicContact CD1-CB 3.58Å; L238-L519 HydrophobicContact CD1-CD1 4Å; L238-L519 HydrophobicContact CD1-CD2 3.91Å; L238-L519 HydrophobicContact CD1-CG 4.01Å; L238-Y520 HydrophobicContact CB-CE1 4.21Å; L238-Y520 HydrophobicContact CB-CE2 4.45Å; L238-Y520 WeakPolarHBondContact CB-OH 3.38Å; L238-Y520 HydrophobicContact CD1-CE2 4.4Å
239	G	83.6	Confident	86.3	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-43.1	176.4	0	0	0	0	0	111.5	D237 F241 Q242 E243	D237-G239 PolarHBondContact O-N 2.9Å; D237-G239 WeakPolarHBondContact OD2-CA 3.4Å; D237-G239 PolarHBondContact OD2-N 3.3Å; D237-G239 VanDerWaalsContact OD2-N 3.15Å; G239-F241 VanDerWaalsContact C-N 3.32Å; G239-F241 PolarHBondContact O-N 3Å; G239-Q242 WeakPolarHBondContact O-CB 3.49Å; G239-Q242 PolarHBondContact O-N 3.28Å; G239-E243 PolarHBondContact O-N 3.42Å; G239-E243 VanDerWaalsContact O-N 3.09Å
240	F	86.2	Confident	86	Confident	7 Å²	7	69.4 Å²	69.4	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-53.6	-44.2	173.4	170.4	-101	0	0	0	113.9	L233 Q236 D237 L238 Q242 E243 T244 L249 Y446	L233-F240 HydrophobicContact CD2-CE1 3.81Å; L233-F240 HydrophobicContact CD2-CZ 3.8Å; Q236-F240 HydrophobicContact CB-CB 4.25Å; Q236-F240 HydrophobicContact CB-CD1 3.72Å; Q236-F240 HydrophobicContact CB-CE1 4.33Å; Q236-F240 HydrophobicContact CB-CG 4.08Å; Q236-F240 HydrophobicContact CG-CD1 4.11Å; Q236-F240 HydrophobicContact CG-CE1 4.28Å; Q236-F240 HydrophobicContact CG-CG 4.48Å; D237-F240 WeakPolarHBondContact O-CB 3.36Å; D237-F240 PolarHBondContact O-N 2.95Å; D237-F240 PolarHBondContact OD2-N 3.2Å; L238-F240 VanDerWaalsContact C-N 3.32Å; L238-F240 PolarHBondContact O-N 2.99Å; F240-Q242 VanDerWaalsContact C-N 3.29Å; F240-Q242 PolarHBondContact O-N 3.33Å; F240-E243 PolarHBondContact O-N 2.89Å; F240-T244 VanDerWaalsContact O-CB 3.29Å; F240-T244 WeakPolarHBondContact O-CB 3.46Å; F240-T244 PolarHBondContact O-N 3.49Å; F240-T244 PolarHBondContact O-OG1 3.47Å; F240-L249 HydrophobicContact CE1-CD2 3.94Å; F240-L249 HydrophobicContact CZ-CD2 3.81Å; F240-Y446 AromaticContact CE2-CD1 3.68Å; F240-Y446 HydrophobicContact CE2-CD1 3.68Å; F240-Y446 AromaticContact CE2-CE1 3.41Å; F240-Y446 HydrophobicContact CE2-CE1 3.41Å; F240-Y446 VanDerWaalsContact CE2-CE1 3.41Å; F240-Y446 AromaticContact CZ-CD1 3.46Å; F240-Y446 HydrophobicContact CZ-CD1 3.46Å; F240-Y446 VanDerWaalsContact CZ-CD1 3.46Å; F240-Y446 AromaticContact CZ-CE1 3.34Å; F240-Y446 HydrophobicContact CZ-CE1 3.34Å
241	F	86.1	Confident	85.5	Confident	80 Å²	80	67.1 Å²	67.1	35%	0.351	35%	0.351	S	S	.	.	H	α-helix	trans	-74.5	-18.5	179.7	-70.8	-77.5	0	0	0	113.4	L233 Q236 D237 L238 G239 L249	L233-F241 WeakPolarHBondContact O-CE2 3.27Å; L233-F241 WeakPolarHBondContact O-CZ 3.46Å; Q236-F241 HydrophobicContact CB-CE2 4.11Å; D237-F241 WeakPolarHBondContact O-CD2 3.4Å; L238-F241 PolarHBondContact O-N 3.4Å; G239-F241 VanDerWaalsContact C-N 3.32Å; G239-F241 PolarHBondContact O-N 3Å; F241-L249 HydrophobicContact CD1-CD1 3.63Å; F241-L249 HydrophobicContact CE1-CD1 3.66Å
242	Q	82.2	Confident	85	Confident	102 Å²	102	66.7 Å²	66.7	48%	0.477	34%	0.342	S	S	.	.	H	α-helix	trans	-81.4	-31.7	173.1	-70.3	173.5	-17.2	0	0	112	L238 G239 F240 Y520	L238-Q242 WeakPolarHBondContact O-CG 3.45Å; L238-Q242 PolarHBondContact O-N 3.29Å; G239-Q242 WeakPolarHBondContact O-CB 3.49Å; G239-Q242 PolarHBondContact O-N 3.28Å; F240-Q242 VanDerWaalsContact C-N 3.29Å; F240-Q242 PolarHBondContact O-N 3.33Å; Q242-Y520 VanDerWaalsContact CD-OH 3.31Å; Q242-Y520 PolarHBondContact NE2-OH 2.68Å; Q242-Y520 PolarHBondContact OE1-OH 2.92Å
243	E	80.9	Confident	84.8	Confident	123 Å²	123	67.8 Å²	67.8	58%	0.575	35%	0.346	S	S	*	.	H	α-helix	trans	-80.2	-38.4	175.3	-65.8	-179.5	167.7	0	0	112.1	G239 F240 N479	G239-E243 PolarHBondContact O-N 3.42Å; G239-E243 VanDerWaalsContact O-N 3.09Å; F240-E243 PolarHBondContact O-N 2.89Å; E243-N479 WeakPolarHBondContact CG-ND2 3.36Å; E243-N479 PolarHBondContact OE1-OD1 3.36Å
244	T	81.5	Confident	84.5	Confident	19 Å²	19	70 Å²	70	12%	0.117	36%	0.363	C	S	.	.	S	Bend	trans	-95.3	123.1	-173	-46	0	0	0	0	111.2	F240 E248 L249	F240-T244 VanDerWaalsContact O-CB 3.29Å; F240-T244 WeakPolarHBondContact O-CB 3.46Å; F240-T244 PolarHBondContact O-N 3.49Å; F240-T244 PolarHBondContact O-OG1 3.47Å; T244-E248 HydrophobicContact CG2-CB 4.34Å; T244-E248 HydrophobicContact CG2-CG 4.34Å; T244-L249 HydrophobicContact CG2-CD2 3.76Å; T244-L249 HydrophobicContact CG2-CG 3.93Å
245	K	82.3	Confident	84.2	Confident	166 Å²	166	67 Å²	67	72%	0.722	35%	0.351	S	S	*	.			trans	-67	138.2	178.7	-64.7	177.9	-178.7	176.7	0	111	G247 E248 L249	K245-G247 PolarHBondContact O-N 3.26Å; K245-G247 VanDerWaalsContact O-N 3.15Å; K245-E248 WeakPolarHBondContact O-CA 3.37Å; K245-E248 WeakPolarHBondContact O-CB 3.36Å; K245-E248 PolarHBondContact O-N 2.97Å; K245-L249 PolarHBondContact O-N 3.41Å
246	T	79.1	Confident	84	Confident	118 Å²	118	59.1 Å²	59.1	72%	0.724	32%	0.323	S	S	*	.	H	α-helix	trans	-55.3	-36.3	177.8	-41.2	0	0	0	0	113.1	E248 L249 N250	T246-E248 VanDerWaalsContact C-N 3.3Å; T246-E248 PolarHBondContact O-N 3.04Å; T246-L249 PolarHBondContact O-N 3.03Å; T246-N250 PolarHBondContact O-N 3.27Å
247	G	79.3	Confident	83.8	Confident	56 Å²	56	58.5 Å²	58.5	58%	0.577	32%	0.32	S	S	*	.	H	α-helix	trans	-64.6	-32.3	175.8	0	0	0	0	0	113.5	K245 S251	K245-G247 PolarHBondContact O-N 3.26Å; K245-G247 VanDerWaalsContact O-N 3.15Å; G247-S251 PolarHBondContact O-N 2.6Å; G247-S251 VanDerWaalsContact O-N 3.11Å
248	E	82.1	Confident	83.6	Confident	70 Å²	70	59.8 Å²	59.8	33%	0.327	33%	0.328	S	S	.	.	H	α-helix	trans	-67.2	-48.4	172.9	178.9	169.6	-177.9	0	0	110.3	T244 K245 T246 N250 S251 R252 Y446	T244-E248 HydrophobicContact CG2-CB 4.34Å; T244-E248 HydrophobicContact CG2-CG 4.34Å; K245-E248 WeakPolarHBondContact O-CA 3.37Å; K245-E248 WeakPolarHBondContact O-CB 3.36Å; K245-E248 PolarHBondContact O-N 2.97Å; T246-E248 VanDerWaalsContact C-N 3.3Å; T246-E248 PolarHBondContact O-N 3.04Å; E248-N250 VanDerWaalsContact C-N 3.29Å; E248-N250 PolarHBondContact O-N 3.33Å; E248-S251 WeakPolarHBondContact O-CB 3.29Å; E248-S251 PolarHBondContact O-N 3.14Å; E248-S251 VanDerWaalsContact O-N 3.07Å; E248-R252 HydrophobicContact CG-CG 4.26Å; E248-R252 WeakPolarHBondContact O-CG 3.25Å; E248-R252 PolarHBondContact O-N 3.41Å; E248-R252 IonicContact OE1-CZ 2.61Å; E248-R252 IonicContact OE1-NE 2.95Å; E248-R252 PolarHBondContact OE1-NE 3.18Å; E248-R252 IonicContact OE1-NH2 3.1Å; E248-R252 PolarHBondContact OE1-NH2 3.03Å; E248-Y446 PolarHBondContact OE1-OH 2.93Å; E248-Y446 VanDerWaalsContact OE1-OH 3.09Å
249	L	86.1	Confident	83.4	Confident	21 Å²	21	61.3 Å²	61.3	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-56.9	-42	178.2	-64.1	174.8	0	0	0	112.3	L233 F240 F241 T244 K245 T246 R252 L253 Y446	L233-L249 HydrophobicContact CD2-CD2 3.92Å; F240-L249 HydrophobicContact CE1-CD2 3.94Å; F240-L249 HydrophobicContact CZ-CD2 3.81Å; F241-L249 HydrophobicContact CD1-CD1 3.63Å; F241-L249 HydrophobicContact CE1-CD1 3.66Å; T244-L249 HydrophobicContact CG2-CD2 3.76Å; T244-L249 HydrophobicContact CG2-CG 3.93Å; K245-L249 PolarHBondContact O-N 3.41Å; T246-L249 PolarHBondContact O-N 3.03Å; L249-R252 PolarHBondContact O-N 3.23Å; L249-L253 WeakPolarHBondContact O-CB 3.37Å; L249-L253 PolarHBondContact O-N 3.31Å; L249-Y446 HydrophobicContact CD2-CE1 4.34Å
250	N	85.3	Confident	83.4	Confident	111 Å²	111	61.4 Å²	61.4	59%	0.594	34%	0.337	S	S	*	.	H	α-helix	trans	-64.9	-41.5	176.5	-169.5	40.3	0	0	0	112	T246 E248 L253 S254	T246-N250 PolarHBondContact O-N 3.27Å; E248-N250 VanDerWaalsContact C-N 3.29Å; E248-N250 PolarHBondContact O-N 3.33Å; N250-L253 PolarHBondContact O-N 3.43Å; N250-S254 VanDerWaalsContact O-CB 3.3Å; N250-S254 WeakPolarHBondContact O-CB 3.46Å; N250-S254 PolarHBondContact O-N 2.87Å
251	S	82.1	Confident	83.1	Confident	60 Å²	60	61.1 Å²	61.1	42%	0.42	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-42.3	174.8	-171.9	0	0	0	0	111.8	G247 E248 S254 S255 D256	G247-S251 PolarHBondContact O-N 2.6Å; G247-S251 VanDerWaalsContact O-N 3.11Å; E248-S251 WeakPolarHBondContact O-CB 3.29Å; E248-S251 PolarHBondContact O-N 3.14Å; E248-S251 VanDerWaalsContact O-N 3.07Å; S251-S254 PolarHBondContact O-N 3.5Å; S251-S255 WeakPolarHBondContact O-CA 3.48Å; S251-S255 VanDerWaalsContact O-CB 3.32Å; S251-S255 WeakPolarHBondContact O-CB 3.5Å; S251-S255 PolarHBondContact O-N 3.14Å; S251-D256 PolarHBondContact O-N 2.9Å
252	R	83	Confident	82.9	Confident	40 Å²	40	59.4 Å²	59.4	15%	0.151	33%	0.33	C	S	.	.	I	π-helix	trans	-60.2	-50.5	175	-63.1	-50.9	179.8	-164	-9.2	111.1	E248 L249 S254 D256 T257 K442 Y446	E248-R252 HydrophobicContact CG-CG 4.26Å; E248-R252 WeakPolarHBondContact O-CG 3.25Å; E248-R252 PolarHBondContact O-N 3.41Å; E248-R252 IonicContact OE1-CZ 2.61Å; E248-R252 IonicContact OE1-NE 2.95Å; E248-R252 PolarHBondContact OE1-NE 3.18Å; E248-R252 IonicContact OE1-NH2 3.1Å; E248-R252 PolarHBondContact OE1-NH2 3.03Å; L249-R252 PolarHBondContact O-N 3.23Å; R252-S254 VanDerWaalsContact C-N 3.33Å; R252-S254 PolarHBondContact O-N 2.89Å; R252-D256 WeakPolarHBondContact CD-OD2 3.47Å; R252-D256 IonicContact CZ-OD2 3.55Å; R252-D256 IonicContact NE-OD2 3.07Å; R252-D256 IonicContact NH1-OD2 3.94Å; R252-D256 PolarHBondContact NH1-OD2 3.26Å; R252-T257 WeakPolarHBondContact O-CG2 3.3Å; R252-T257 PolarHBondContact O-N 3.43Å; R252-K442 VanDerWaalsContact NH1-CD 3.3Å; R252-Y446 HydrophobicContact CG-CD2 4.4Å; R252-Y446 HydrophobicContact CG-CE2 4Å
253	L	86.7	Confident	82.7	Confident	42 Å²	42	56 Å²	56	22%	0.22	31%	0.313	C	S	.	.	I	π-helix	trans	-67.9	-32.4	-175.8	-170.3	64.8	0	0	0	112.6	R226 L229 F230 L249 N250 T257	R226-L253 HydrophobicContact CB-CD1 4.46Å; R226-L253 PolarHBondContact NE-O 3.46Å; L229-L253 HydrophobicContact CB-CD1 4.33Å; L229-L253 HydrophobicContact CD2-CD1 3.95Å; L229-L253 HydrophobicContact CG-CD1 4.19Å; F230-L253 HydrophobicContact CB-CD1 4.15Å; F230-L253 HydrophobicContact CD2-CD2 3.93Å; L249-L253 WeakPolarHBondContact O-CB 3.37Å; L249-L253 PolarHBondContact O-N 3.31Å; N250-L253 PolarHBondContact O-N 3.43Å; L253-T257 WeakPolarHBondContact O-CG2 3.45Å; L253-T257 PolarHBondContact O-OG1 3.4Å
254	S	84.8	Confident	82.4	Confident	60 Å²	60	51 Å²	51	42%	0.42	29%	0.29	S	S	.	.	I	π-helix	trans	-95.2	-64.6	-179.4	-173.4	0	0	0	0	112.9	R226 N250 S251 R252 T257 T258	R226-S254 PolarHBondContact NH2-O 2.96Å; N250-S254 VanDerWaalsContact O-CB 3.3Å; N250-S254 WeakPolarHBondContact O-CB 3.46Å; N250-S254 PolarHBondContact O-N 2.87Å; S251-S254 PolarHBondContact O-N 3.5Å; R252-S254 VanDerWaalsContact C-N 3.33Å; R252-S254 PolarHBondContact O-N 2.89Å; S254-T257 PolarHBondContact O-OG1 3.41Å; S254-T258 WeakPolarHBondContact O-CB 3.11Å; S254-T258 PolarHBondContact O-N 2.62Å; S254-T258 PolarHBondContact O-OG1 3.21Å
255	S	83.1	Confident	82.3	Confident	53 Å²	53	50.5 Å²	50.5	37%	0.371	29%	0.287	S	S	.	.	I	π-helix	trans	-72.9	-54.6	-171.8	-178.6	0	0	0	0	111.9	S251 T257 T258 L259	S251-S255 WeakPolarHBondContact O-CA 3.48Å; S251-S255 VanDerWaalsContact O-CB 3.32Å; S251-S255 WeakPolarHBondContact O-CB 3.5Å; S251-S255 PolarHBondContact O-N 3.14Å; S255-T257 PolarHBondContact O-N 3.43Å; S255-T258 WeakPolarHBondContact O-CB 3.36Å; S255-T258 PolarHBondContact O-N 2.6Å; S255-T258 VanDerWaalsContact O-N 3.11Å; S255-L259 WeakPolarHBondContact O-CG 3.41Å; S255-L259 PolarHBondContact O-N 3.46Å
256	D	83.5	Confident	82.2	Confident	18 Å²	18	47 Å²	47	10%	0.096	28%	0.276	C	S	.	.	I	π-helix	trans	-70	-37.4	-171.7	-67.3	-9.3	0	0	0	112.2	S251 R252 T258 L259 M260 V443	S251-D256 PolarHBondContact O-N 2.9Å; R252-D256 WeakPolarHBondContact CD-OD2 3.47Å; R252-D256 IonicContact CZ-OD2 3.55Å; R252-D256 IonicContact NE-OD2 3.07Å; R252-D256 IonicContact NH1-OD2 3.94Å; R252-D256 PolarHBondContact NH1-OD2 3.26Å; D256-T258 VanDerWaalsContact C-N 3.28Å; D256-T258 PolarHBondContact O-N 3.32Å; D256-L259 PolarHBondContact O-N 3.31Å; D256-M260 WeakPolarHBondContact O-CB 3.44Å; D256-M260 PolarHBondContact O-N 3.15Å; D256-V443 HydrophobicContact CB-CG2 3.77Å
257	T	85.6	Confident	82.4	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-37	172	62.9	0	0	0	0	112.1	N222 I225 R226 L229 R252 L253 S254 S255 S261	N222-T257 PolarHBondContact ND2-O 2.82Å; I225-T257 HydrophobicContact CG2-CG2 3.87Å; R226-T257 HydrophobicContact CG-CG2 4.03Å; R226-T257 WeakPolarHBondContact CG-OG1 3.41Å; R226-T257 PolarHBondContact NE-OG1 3.24Å; R226-T257 VanDerWaalsContact NE-OG1 3.14Å; L229-T257 HydrophobicContact CD2-CG2 3.52Å; R252-T257 WeakPolarHBondContact O-CG2 3.3Å; R252-T257 PolarHBondContact O-N 3.43Å; L253-T257 WeakPolarHBondContact O-CG2 3.45Å; L253-T257 PolarHBondContact O-OG1 3.4Å; S254-T257 PolarHBondContact O-OG1 3.41Å; S255-T257 PolarHBondContact O-N 3.43Å; T257-S261 VanDerWaalsContact O-CB 3.23Å; T257-S261 WeakPolarHBondContact O-CB 3.2Å; T257-S261 PolarHBondContact O-N 3.46Å; T257-S261 PolarHBondContact O-OG 3.4Å
258	T	85.9	Confident	82.4	Confident	41 Å²	41	41 Å²	41	25%	0.252	23%	0.231	S	C	.	.	H	α-helix	trans	-68.9	-46.9	177.5	-55.5	0	0	0	0	110.9	N222 R226 S254 S255 D256 M260 S261 N262	N222-T258 WeakPolarHBondContact ND2-CA 3.29Å; R226-T258 PolarHBondContact NH2-OG1 2.88Å; S254-T258 WeakPolarHBondContact O-CB 3.11Å; S254-T258 PolarHBondContact O-N 2.62Å; S254-T258 PolarHBondContact O-OG1 3.21Å; S255-T258 WeakPolarHBondContact O-CB 3.36Å; S255-T258 PolarHBondContact O-N 2.6Å; S255-T258 VanDerWaalsContact O-N 3.11Å; D256-T258 VanDerWaalsContact C-N 3.28Å; D256-T258 PolarHBondContact O-N 3.32Å; T258-M260 VanDerWaalsContact C-N 3.35Å; T258-M260 PolarHBondContact O-N 3.09Å; T258-S261 PolarHBondContact O-N 2.82Å; T258-S261 PolarHBondContact O-OG 3.42Å; T258-S261 VanDerWaalsContact O-OG 3.06Å; T258-N262 VanDerWaalsContact CG2-ND2 3.32Å; T258-N262 WeakPolarHBondContact CG2-ND2 3.38Å; T258-N262 WeakPolarHBondContact O-CB 3.46Å; T258-N262 PolarHBondContact O-N 3.36Å; T258-N262 PolarHBondContact O-ND2 2.93Å; T258-N262 PolarHBondContact O-OD1 3.09Å; T258-N262 VanDerWaalsContact O-OD1 3.12Å
259	L	82.4	Confident	82.6	Confident	99 Å²	99	39 Å²	39	52%	0.518	22%	0.222	S	C	.	.	H	α-helix	trans	-57	-51	175	-69.2	174	0	0	0	110.3	S255 D256 S261 N262 W263	S255-L259 WeakPolarHBondContact O-CG 3.41Å; S255-L259 PolarHBondContact O-N 3.46Å; D256-L259 PolarHBondContact O-N 3.31Å; L259-S261 PolarHBondContact O-N 3.13Å; L259-N262 PolarHBondContact O-N 2.92Å; L259-W263 WeakPolarHBondContact O-CB 3.46Å; L259-W263 PolarHBondContact O-N 3.1Å
260	M	82.8	Confident	82.6	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-46.3	179.3	179.1	-176.2	-179.6	0	0	113.2	L141 I225 D256 T258 N262 A440 V443 F444	L141-M260 HydrophobicContact CD1-CE 3.21Å; L141-M260 HydrophobicContact CD1-CG 3.78Å; L141-M260 HydrophobicContact CD1-SD 4.31Å; I225-M260 HydrophobicContact CD1-CE 4.31Å; I225-M260 HydrophobicContact CD1-CG 4.3Å; I225-M260 HydrophobicContact CD1-SD 4.27Å; I225-M260 HydrophobicContact CG2-SD 4.28Å; D256-M260 WeakPolarHBondContact O-CB 3.44Å; D256-M260 PolarHBondContact O-N 3.15Å; T258-M260 VanDerWaalsContact C-N 3.35Å; T258-M260 PolarHBondContact O-N 3.09Å; M260-N262 VanDerWaalsContact C-N 3.31Å; M260-N262 PolarHBondContact O-N 3.04Å; M260-A440 HydrophobicContact CE-CB 4.21Å; M260-A440 HydrophobicContact CG-CB 3.97Å; M260-A440 HydrophobicContact SD-CB 4.24Å; M260-V443 HydrophobicContact CE-CB 4.46Å; M260-V443 HydrophobicContact CE-CG1 4.23Å; M260-V443 HydrophobicContact SD-CB 3.51Å; M260-V443 VanDerWaalsContact SD-CB 3.51Å; M260-V443 HydrophobicContact SD-CG1 3.46Å; M260-V443 WeakPolarHBondContact SD-CG1 3.36Å; M260-V443 HydrophobicContact SD-CG2 3.98Å; M260-F444 HydrophobicContact CE-CD1 4.06Å; M260-F444 HydrophobicContact CE-CD2 3.71Å; M260-F444 HydrophobicContact CE-CE1 3.59Å; M260-F444 HydrophobicContact CE-CE2 3.25Å; M260-F444 HydrophobicContact CE-CG 4.12Å; M260-F444 HydrophobicContact CE-CZ 3.17Å
261	S	81.1	Confident	82.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-31.1	-178.8	64.5	0	0	0	0	112.9	N222 T257 T258 L259 P265	N222-S261 WeakPolarHBondContact CB-OG 3.35Å; N222-S261 PolarHBondContact ND2-OG 2.98Å; T257-S261 VanDerWaalsContact O-CB 3.23Å; T257-S261 WeakPolarHBondContact O-CB 3.2Å; T257-S261 PolarHBondContact O-N 3.46Å; T257-S261 PolarHBondContact O-OG 3.4Å; T258-S261 PolarHBondContact O-N 2.82Å; T258-S261 PolarHBondContact O-OG 3.42Å; T258-S261 VanDerWaalsContact O-OG 3.06Å; L259-S261 PolarHBondContact O-N 3.13Å; S261-P265 WeakPolarHBondContact O-CD 3.27Å; S261-P265 WeakPolarHBondContact O-CG 3.33Å
262	N	81.3	Confident	82.9	Confident	45 Å²	45	37.4 Å²	37.4	24%	0.241	21%	0.21	C	C	.	.	H	α-helix	trans	-81.4	-35.2	-178.8	-65.4	0.2	0	0	0	110.8	M218 T258 L259 M260 L264 P265 L266	M218-N262 HydrophobicContact CE-CB 3.61Å; M218-N262 VanDerWaalsContact CE-ND2 3.29Å; M218-N262 WeakPolarHBondContact CE-ND2 3.47Å; M218-N262 WeakPolarHBondContact CE-OD1 3.29Å; M218-N262 WeakPolarHBondContact CG-OD1 3.33Å; M218-N262 HydrophobicContact SD-CB 4.41Å; T258-N262 VanDerWaalsContact CG2-ND2 3.32Å; T258-N262 WeakPolarHBondContact CG2-ND2 3.38Å; T258-N262 WeakPolarHBondContact O-CB 3.46Å; T258-N262 PolarHBondContact O-N 3.36Å; T258-N262 PolarHBondContact O-ND2 2.93Å; T258-N262 PolarHBondContact O-OD1 3.09Å; T258-N262 VanDerWaalsContact O-OD1 3.12Å; L259-N262 PolarHBondContact O-N 2.92Å; M260-N262 VanDerWaalsContact C-N 3.31Å; M260-N262 PolarHBondContact O-N 3.04Å; N262-L264 PolarHBondContact O-N 3.26Å; N262-P265 WeakPolarHBondContact O-CD 3.43Å; N262-L266 WeakPolarHBondContact O-CB 3Å; N262-L266 PolarHBondContact O-N 3.11Å
263	W	77.8	Confident	83.2	Confident	30 Å²	30	38.3 Å²	38.3	11%	0.114	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-45.8	-171.7	-174.2	84	0	0	0	112.7	M138 L141 L259 N267 M433 N436 V437	M138-W263 HydrophobicContact CG-CH2 4.34Å; M138-W263 HydrophobicContact CG-CZ3 4.29Å; M138-W263 HydrophobicContact SD-CH2 4.49Å; L141-W263 HydrophobicContact CD2-CE3 4.28Å; L259-W263 WeakPolarHBondContact O-CB 3.46Å; L259-W263 PolarHBondContact O-N 3.1Å; W263-N267 PolarHBondContact NE1-ND2 3.04Å; W263-N267 VanDerWaalsContact NE1-ND2 3.17Å; W263-N267 WeakPolarHBondContact O-CB 3.23Å; W263-N267 PolarHBondContact O-N 3.45Å; W263-N267 PolarHBondContact O-ND2 3.27Å; W263-M433 HydrophobicContact CH2-CG 3.71Å; W263-M433 VanDerWaalsContact CH2-O 3.23Å; W263-M433 WeakPolarHBondContact CH2-O 3.36Å; W263-M433 VanDerWaalsContact CZ2-CA 3.46Å; W263-M433 HydrophobicContact CZ2-CB 4.3Å; W263-M433 HydrophobicContact CZ2-CG 3.94Å; W263-M433 WeakPolarHBondContact CZ2-O 3.28Å; W263-N436 HydrophobicContact CZ2-CB 4.1Å; W263-V437 HydrophobicContact CH2-CG2 3.88Å; W263-V437 HydrophobicContact CZ2-CG2 4.26Å
264	L	75.6	Confident	83.3	Confident	18 Å²	18	36.4 Å²	36.4	9%	0.094	20%	0.204	C	C	.	.	H	α-helix	trans	-69.4	-53.8	-177.6	178.4	71	0	0	0	113.5	L141 N262 L266 A268	L141-L264 HydrophobicContact CB-CD2 4.07Å; L141-L264 HydrophobicContact CD2-CB 3.45Å; L141-L264 VanDerWaalsContact CD2-CB 3.45Å; L141-L264 HydrophobicContact CD2-CD1 4.32Å; L141-L264 HydrophobicContact CD2-CD2 3.83Å; L141-L264 HydrophobicContact CD2-CG 4.06Å; L141-L264 HydrophobicContact CG-CB 4.22Å; L141-L264 HydrophobicContact CG-CD2 3.74Å; N262-L264 PolarHBondContact O-N 3.26Å; L264-L266 VanDerWaalsContact C-N 3.33Å; L264-L266 PolarHBondContact O-N 3.2Å; L264-A268 WeakPolarHBondContact O-CB 3.13Å; L264-A268 PolarHBondContact O-N 2.9Å
265	P	78.7	Confident	83.6	Confident	8 Å²	8	37.5 Å²	37.5	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-37.2	-179.7	-21.5	34.7	0	0	0	112.5	F214 M218 I221 S261 N262 N269	F214-P265 HydrophobicContact CD1-CB 4.34Å; M218-P265 HydrophobicContact CB-CB 4.29Å; M218-P265 HydrophobicContact CB-CG 4.21Å; I221-P265 HydrophobicContact CD1-CG 4.05Å; S261-P265 WeakPolarHBondContact O-CD 3.27Å; S261-P265 WeakPolarHBondContact O-CG 3.33Å; N262-P265 WeakPolarHBondContact O-CD 3.43Å; P265-N269 WeakPolarHBondContact O-CB 3.39Å; P265-N269 PolarHBondContact O-N 3.34Å
266	L	80.3	Confident	83.9	Confident	94 Å²	94	36.5 Å²	36.5	49%	0.492	20%	0.196	S	C	.	.	H	α-helix	trans	-70	-49.1	-179.4	-166.9	133.1	0	0	0	111	N262 L264 A268 N269 V270	N262-L266 WeakPolarHBondContact O-CB 3Å; N262-L266 PolarHBondContact O-N 3.11Å; L264-L266 VanDerWaalsContact C-N 3.33Å; L264-L266 PolarHBondContact O-N 3.2Å; L266-A268 PolarHBondContact O-N 3.26Å; L266-N269 PolarHBondContact O-N 3.02Å; L266-V270 VanDerWaalsContact O-CG2 3.31Å; L266-V270 WeakPolarHBondContact O-CG2 3.47Å; L266-V270 PolarHBondContact O-N 3.41Å
267	N	82.3	Confident	84.3	Confident	12 Å²	12	36.2 Å²	36.2	6%	0.064	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-40.4	176	-77.9	-67.1	0	0	0	111.8	W263 N269 V270 L271 I429	W263-N267 PolarHBondContact NE1-ND2 3.04Å; W263-N267 VanDerWaalsContact NE1-ND2 3.17Å; W263-N267 WeakPolarHBondContact O-CB 3.23Å; W263-N267 PolarHBondContact O-N 3.45Å; W263-N267 PolarHBondContact O-ND2 3.27Å; N267-N269 PolarHBondContact O-N 3.23Å; N267-V270 PolarHBondContact O-N 3.19Å; N267-L271 WeakPolarHBondContact O-CB 3.48Å; N267-L271 PolarHBondContact O-N 3.33Å; N267-I429 HydrophobicContact CB-CG2 4.47Å
268	A	80.8	Confident	84.5	Confident	36 Å²	36	37.1 Å²	37.1	30%	0.298	20%	0.199	S	C	.	.	H	α-helix	trans	-61.1	-45	175	0	0	0	0	0	111.9	L264 L266 L272	L264-A268 WeakPolarHBondContact O-CB 3.13Å; L264-A268 PolarHBondContact O-N 2.9Å; L266-A268 PolarHBondContact O-N 3.26Å; A268-L272 WeakPolarHBondContact O-CB 3.29Å; A268-L272 PolarHBondContact O-N 2.92Å
269	N	85.6	Confident	84.7	Confident	26 Å²	26	39.9 Å²	39.9	14%	0.139	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-50	176.8	177.7	27	0	0	0	111.5	R210 F214 P265 L266 N267 R273	R210-N269 PolarHBondContact NH1-OD1 2.89Å; F214-N269 HydrophobicContact CD1-CB 3.89Å; F214-N269 HydrophobicContact CD2-CB 3.95Å; F214-N269 HydrophobicContact CE1-CB 3.76Å; F214-N269 HydrophobicContact CE2-CB 3.83Å; F214-N269 WeakPolarHBondContact CE2-OD1 3.45Å; F214-N269 HydrophobicContact CG-CB 4Å; F214-N269 HydrophobicContact CZ-CB 3.73Å; P265-N269 WeakPolarHBondContact O-CB 3.39Å; P265-N269 PolarHBondContact O-N 3.34Å; L266-N269 PolarHBondContact O-N 3.02Å; N267-N269 PolarHBondContact O-N 3.23Å; N269-R273 WeakPolarHBondContact O-CB 3.32Å; N269-R273 PolarHBondContact O-N 3.09Å
270	V	86.9	Confident	85	Confident	45 Å²	45	36.4 Å²	36.4	27%	0.273	20%	0.204	S	C	.	.	H	α-helix	trans	-70.6	-40.6	-177.6	-168.8	0	0	0	0	111.1	L266 N267 R273 S274 T425 I429	L266-V270 VanDerWaalsContact O-CG2 3.31Å; L266-V270 WeakPolarHBondContact O-CG2 3.47Å; L266-V270 PolarHBondContact O-N 3.41Å; N267-V270 PolarHBondContact O-N 3.19Å; V270-R273 PolarHBondContact O-N 3.06Å; V270-S274 VanDerWaalsContact O-CB 3.24Å; V270-S274 WeakPolarHBondContact O-CB 3.35Å; V270-S274 PolarHBondContact O-N 2.64Å; V270-S274 PolarHBondContact O-OG 2.89Å; V270-T425 HydrophobicContact CG1-CG2 3.56Å; V270-I429 HydrophobicContact CB-CD1 3.61Å; V270-I429 HydrophobicContact CG1-CD1 3.36Å
271	L	86.6	Confident	85.4	Confident	60 Å²	60	36.6 Å²	36.6	31%	0.314	21%	0.205	S	C	.	.	H	α-helix	trans	-59	-52.1	176.1	-173.9	86.2	0	0	0	110.8	N267 S274 L275 L426 I429	N267-L271 WeakPolarHBondContact O-CB 3.48Å; N267-L271 PolarHBondContact O-N 3.33Å; L271-S274 PolarHBondContact O-N 2.9Å; L271-L275 VanDerWaalsContact O-CB 3.29Å; L271-L275 WeakPolarHBondContact O-CB 3.42Å; L271-L275 PolarHBondContact O-N 3.28Å; L271-L426 HydrophobicContact CD1-CD1 3.65Å; L271-L426 HydrophobicContact CG-CD1 4.32Å; L271-I429 HydrophobicContact CB-CG2 4.33Å; L271-I429 HydrophobicContact CD1-CG2 3.89Å
272	L	86.3	Confident	85.8	Confident	55 Å²	55	38.2 Å²	38.2	29%	0.288	21%	0.212	S	C	.	.	H	α-helix	trans	-66.1	-41.8	-177.3	-167.3	56.1	0	0	0	111.2	F156 L159 A268 L275 V276	F156-L272 HydrophobicContact CB-CD2 4.45Å; F156-L272 HydrophobicContact CD2-CD1 4.03Å; F156-L272 HydrophobicContact CD2-CD2 3.23Å; F156-L272 HydrophobicContact CD2-CG 3.64Å; F156-L272 HydrophobicContact CE2-CD1 3.56Å; F156-L272 HydrophobicContact CE2-CD2 3.72Å; F156-L272 HydrophobicContact CE2-CG 3.62Å; F156-L272 HydrophobicContact CG-CD2 4.15Å; F156-L272 HydrophobicContact CZ-CD1 4.5Å; L159-L272 HydrophobicContact CD2-CB 4.05Å; L159-L272 HydrophobicContact CD2-CD2 4.13Å; L159-L272 HydrophobicContact CD2-CG 3.72Å; A268-L272 WeakPolarHBondContact O-CB 3.29Å; A268-L272 PolarHBondContact O-N 2.92Å; L272-L275 PolarHBondContact O-N 3.39Å; L272-V276 WeakPolarHBondContact O-CB 3.3Å; L272-V276 VanDerWaalsContact O-CG2 3.24Å; L272-V276 WeakPolarHBondContact O-CG2 3.32Å; L272-V276 PolarHBondContact O-N 3.46Å
273	R	88.5	Confident	86.2	Confident	58 Å²	58	38 Å²	38	22%	0.219	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-51.6	174.2	179.5	175.4	-167.2	-156.9	2.6	111.4	L159 E166 N269 V270 L275 V276 K277	L159-R273 HydrophobicContact CD1-CB 3.62Å; L159-R273 HydrophobicContact CD1-CG 3.76Å; L159-R273 HydrophobicContact CD2-CB 4.36Å; E166-R273 IonicContact OE1-NH2 3.37Å; E166-R273 PolarHBondContact OE1-NH2 3.49Å; E166-R273 IonicContact OE2-NH2 3.6Å; N269-R273 WeakPolarHBondContact O-CB 3.32Å; N269-R273 PolarHBondContact O-N 3.09Å; V270-R273 PolarHBondContact O-N 3.06Å; R273-L275 VanDerWaalsContact C-N 3.32Å; R273-L275 PolarHBondContact O-N 2.9Å; R273-V276 PolarHBondContact O-N 3.45Å; R273-K277 HydrophobicContact CG-CD 4.34Å; R273-K277 WeakPolarHBondContact O-CB 3.44Å; R273-K277 WeakPolarHBondContact O-CG 3.33Å; R273-K277 PolarHBondContact O-N 3.43Å
274	S	90.3	Very high	86.7	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.014	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-41.3	-178.5	-65	0	0	0	0	110.8	V270 L271 K277 V278	V270-S274 VanDerWaalsContact O-CB 3.24Å; V270-S274 WeakPolarHBondContact O-CB 3.35Å; V270-S274 PolarHBondContact O-N 2.64Å; V270-S274 PolarHBondContact O-OG 2.89Å; L271-S274 PolarHBondContact O-N 2.9Å; S274-K277 PolarHBondContact O-N 3.03Å; S274-V278 WeakPolarHBondContact O-CB 3.4Å; S274-V278 WeakPolarHBondContact O-CG2 3.43Å; S274-V278 PolarHBondContact O-N 2.89Å
275	L	90.1	Very high	87.4	Confident	83 Å²	83	38.4 Å²	38.4	44%	0.435	22%	0.222	S	C	.	.	H	α-helix	trans	-61.9	-52.3	176.8	-174.7	68.9	0	0	0	111.8	L271 L272 R273 K277 V278 V279	L271-L275 VanDerWaalsContact O-CB 3.29Å; L271-L275 WeakPolarHBondContact O-CB 3.42Å; L271-L275 PolarHBondContact O-N 3.28Å; L272-L275 PolarHBondContact O-N 3.39Å; R273-L275 VanDerWaalsContact C-N 3.32Å; R273-L275 PolarHBondContact O-N 2.9Å; L275-K277 VanDerWaalsContact C-N 3.28Å; L275-K277 PolarHBondContact O-N 3.33Å; L275-V278 PolarHBondContact O-N 3.41Å; L275-V279 WeakPolarHBondContact O-CG2 3.32Å; L275-V279 PolarHBondContact O-N 3.12Å
276	V	90.5	Very high	87.8	Confident	33 Å²	33	42.6 Å²	42.6	20%	0.2	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-39.7	179.6	176.2	0	0	0	0	110.7	F156 V160 V163 L272 R273 G280	F156-V276 HydrophobicContact CE2-CG2 4.12Å; V160-V276 HydrophobicContact CG2-CG1 4.47Å; V163-V276 HydrophobicContact CB-CG1 4.1Å; V163-V276 HydrophobicContact CG1-CG1 3.95Å; V163-V276 HydrophobicContact CG2-CG1 4.23Å; L272-V276 WeakPolarHBondContact O-CB 3.3Å; L272-V276 VanDerWaalsContact O-CG2 3.24Å; L272-V276 WeakPolarHBondContact O-CG2 3.32Å; L272-V276 PolarHBondContact O-N 3.46Å; R273-V276 PolarHBondContact O-N 3.45Å; V276-G280 PolarHBondContact O-N 3.06Å
277	K	90.3	Very high	88.2	Confident	12 Å²	12	42.5 Å²	42.5	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-47.2	176	-79.2	-164.6	172.4	-153.2	0	113.3	V163 E166 R273 S274 L275 V279 G280 L281 Y422	V163-K277 HydrophobicContact CB-CG 4.33Å; V163-K277 HydrophobicContact CG1-CB 4.5Å; V163-K277 HydrophobicContact CG1-CG 3.7Å; V163-K277 HydrophobicContact CG2-CD 4.46Å; V163-K277 HydrophobicContact CG2-CG 3.65Å; E166-K277 WeakPolarHBondContact OE2-CE 3.47Å; E166-K277 IonicContact OE2-NZ 3.02Å; E166-K277 PolarHBondContact OE2-NZ 3.36Å; R273-K277 HydrophobicContact CG-CD 4.34Å; R273-K277 WeakPolarHBondContact O-CB 3.44Å; R273-K277 WeakPolarHBondContact O-CG 3.33Å; R273-K277 PolarHBondContact O-N 3.43Å; S274-K277 PolarHBondContact O-N 3.03Å; L275-K277 VanDerWaalsContact C-N 3.28Å; L275-K277 PolarHBondContact O-N 3.33Å; K277-V279 VanDerWaalsContact C-N 3.33Å; K277-V279 PolarHBondContact O-N 2.97Å; K277-G280 PolarHBondContact O-N 2.82Å; K277-L281 HydrophobicContact CB-CD1 4.34Å; K277-L281 WeakPolarHBondContact O-CB 3.43Å; K277-L281 WeakPolarHBondContact O-CD1 3.47Å; K277-L281 WeakPolarHBondContact O-CG 3.29Å; K277-L281 PolarHBondContact O-N 3.49Å; K277-Y422 HydrophobicContact CB-CD1 4.42Å; K277-Y422 HydrophobicContact CB-CD2 4.03Å; K277-Y422 HydrophobicContact CB-CE2 4.48Å; K277-Y422 HydrophobicContact CB-CG 4.07Å; K277-Y422 HydrophobicContact CD-CD1 3.8Å; K277-Y422 HydrophobicContact CD-CD2 3.78Å; K277-Y422 HydrophobicContact CD-CE1 3.4Å; K277-Y422 VanDerWaalsContact CD-CE1 3.4Å; K277-Y422 HydrophobicContact CD-CE2 3.43Å; K277-Y422 VanDerWaalsContact CD-CE2 3.43Å; K277-Y422 HydrophobicContact CD-CG 4.01Å; K277-Y422 PolarHBondContact NZ-OH 2.95Å
278	V	90.4	Very high	88.4	Confident	18 Å²	18	43.7 Å²	43.7	11%	0.109	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-47.2	179.6	168.1	0	0	0	0	109.9	S274 L275 Y282 V423	S274-V278 WeakPolarHBondContact O-CB 3.4Å; S274-V278 WeakPolarHBondContact O-CG2 3.43Å; S274-V278 PolarHBondContact O-N 2.89Å; L275-V278 PolarHBondContact O-N 3.41Å; V278-Y282 HydrophobicContact CG1-CD2 3.69Å; V278-Y282 HydrophobicContact CG1-CE2 3.84Å; V278-Y282 WeakPolarHBondContact O-CB 3.43Å; V278-Y282 VanDerWaalsContact O-CD2 3.31Å; V278-Y282 WeakPolarHBondContact O-CD2 3.49Å; V278-Y282 PolarHBondContact O-N 2.86Å; V278-V423 HydrophobicContact CG1-CG2 4.13Å; V278-V423 HydrophobicContact CG2-CG2 3.81Å
279	V	90.1	Very high	88.7	Confident	99 Å²	99	42.2 Å²	42.2	60%	0.6	24%	0.244	S	C	*	.	H	α-helix	trans	-63.4	-48.3	178	175	0	0	0	0	111.3	L275 K277 G283	L275-V279 WeakPolarHBondContact O-CG2 3.32Å; L275-V279 PolarHBondContact O-N 3.12Å; K277-V279 VanDerWaalsContact C-N 3.33Å; K277-V279 PolarHBondContact O-N 2.97Å; V279-G283 PolarHBondContact O-N 3.36Å
280	G	89.6	Confident	88.7	Confident	26 Å²	26	45.1 Å²	45.1	27%	0.268	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-48.8	-179.6	0	0	0	0	0	112.7	V276 K277 G283 F284	V276-G280 PolarHBondContact O-N 3.06Å; K277-G280 PolarHBondContact O-N 2.82Å; G280-G283 PolarHBondContact O-N 3Å; G280-F284 VanDerWaalsContact O-CD2 3.29Å; G280-F284 WeakPolarHBondContact O-CD2 3.4Å; G280-F284 PolarHBondContact O-N 3.43Å
281	L	90.8	Very high	88.5	Confident	9 Å²	9	48.4 Å²	48.4	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-43.2	-178.5	-69	167.6	0	0	0	112.2	T167 K277 G283 F284 M285 Y415 V419 Y422	T167-L281 HydrophobicContact CG2-CD2 3.85Å; T167-L281 HydrophobicContact CG2-CG 4.17Å; K277-L281 HydrophobicContact CB-CD1 4.34Å; K277-L281 WeakPolarHBondContact O-CB 3.43Å; K277-L281 WeakPolarHBondContact O-CD1 3.47Å; K277-L281 WeakPolarHBondContact O-CG 3.29Å; K277-L281 PolarHBondContact O-N 3.49Å; L281-G283 VanDerWaalsContact C-N 3.28Å; L281-G283 PolarHBondContact O-N 3.48Å; L281-F284 PolarHBondContact O-N 3.42Å; L281-M285 VanDerWaalsContact O-CG 3.28Å; L281-M285 WeakPolarHBondContact O-CG 3.43Å; L281-M285 PolarHBondContact O-N 3.36Å; L281-Y415 HydrophobicContact CD2-CD1 3.45Å; L281-Y415 VanDerWaalsContact CD2-CD1 3.45Å; L281-Y415 HydrophobicContact CD2-CE1 3.89Å; L281-Y415 HydrophobicContact CD2-CG 4.34Å; L281-V419 HydrophobicContact CB-CG2 3.23Å; L281-V419 HydrophobicContact CD1-CG2 3.57Å; L281-V419 HydrophobicContact CG-CG2 3.98Å; L281-Y422 HydrophobicContact CD1-CD2 3.94Å; L281-Y422 HydrophobicContact CD1-CE2 4.28Å
282	Y	89.4	Confident	88.4	Confident	34 Å²	34	45.6 Å²	45.6	13%	0.133	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-36	173.9	-86.1	-57.9	0	0	0	112	V278 M285 L286 T293 M300 V419 V423	V278-Y282 HydrophobicContact CG1-CD2 3.69Å; V278-Y282 HydrophobicContact CG1-CE2 3.84Å; V278-Y282 WeakPolarHBondContact O-CB 3.43Å; V278-Y282 VanDerWaalsContact O-CD2 3.31Å; V278-Y282 WeakPolarHBondContact O-CD2 3.49Å; V278-Y282 PolarHBondContact O-N 2.86Å; Y282-M285 HydrophobicContact CD1-SD 4.29Å; Y282-M285 PolarHBondContact O-N 3.27Å; Y282-L286 WeakPolarHBondContact O-CB 3.44Å; Y282-L286 VanDerWaalsContact O-CG 3.27Å; Y282-L286 WeakPolarHBondContact O-CG 3.48Å; Y282-L286 PolarHBondContact O-N 3.46Å; Y282-T293 HydrophobicContact CD1-CG2 4.04Å; Y282-T293 HydrophobicContact CE1-CG2 4.47Å; Y282-M300 WeakPolarHBondContact OH-CG 3.4Å; Y282-V419 HydrophobicContact CD2-CG1 4.03Å; Y282-V419 HydrophobicContact CE1-CG1 4.09Å; Y282-V419 HydrophobicContact CE2-CG1 3.44Å; Y282-V419 VanDerWaalsContact CE2-CG1 3.44Å; Y282-V419 VanDerWaalsContact CZ-CG1 3.47Å; Y282-V423 HydrophobicContact CE2-CG2 4.38Å
283	G	89.5	Confident	88.5	Confident	41 Å²	41	43.2 Å²	43.2	42%	0.423	25%	0.245	S	C	.	.	H	α-helix	trans	-57.2	-47.3	172	0	0	0	0	0	112.4	V279 G280 L281 S287	V279-G283 PolarHBondContact O-N 3.36Å; G280-G283 PolarHBondContact O-N 3Å; L281-G283 VanDerWaalsContact C-N 3.28Å; L281-G283 PolarHBondContact O-N 3.48Å; G283-S287 PolarHBondContact O-N 3.46Å; G283-S287 VanDerWaalsContact O-N 3.14Å
284	F	88.6	Confident	88.3	Confident	55 Å²	55	44 Å²	44	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-43.5	175.5	-84.7	-73.8	0	0	0	112.6	L168 G280 L281 L286 S287 I288 Y415	L168-F284 HydrophobicContact CD2-CE1 4.31Å; L168-F284 HydrophobicContact CD2-CZ 3.97Å; G280-F284 VanDerWaalsContact O-CD2 3.29Å; G280-F284 WeakPolarHBondContact O-CD2 3.4Å; G280-F284 PolarHBondContact O-N 3.43Å; L281-F284 PolarHBondContact O-N 3.42Å; F284-L286 VanDerWaalsContact C-N 3.34Å; F284-L286 PolarHBondContact O-N 3.11Å; F284-S287 WeakPolarHBondContact O-CB 3.45Å; F284-S287 PolarHBondContact O-N 3.2Å; F284-S287 VanDerWaalsContact O-N 3.13Å; F284-S287 PolarHBondContact O-OG 3.43Å; F284-I288 PolarHBondContact O-N 2.9Å; F284-I288 VanDerWaalsContact O-N 3.13Å; F284-Y415 HydrophobicContact CB-CE2 4.32Å
285	M	89.3	Confident	88	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-43.4	178	-70.8	174.1	74.8	0	0	111.6	L281 Y282 S287 I288 S289 T293 F412 Y415 Q416 V419	L281-M285 VanDerWaalsContact O-CG 3.28Å; L281-M285 WeakPolarHBondContact O-CG 3.43Å; L281-M285 PolarHBondContact O-N 3.36Å; Y282-M285 HydrophobicContact CD1-SD 4.29Å; Y282-M285 PolarHBondContact O-N 3.27Å; M285-S287 VanDerWaalsContact C-N 3.28Å; M285-S287 PolarHBondContact O-N 3.25Å; M285-I288 PolarHBondContact O-N 3.44Å; M285-S289 PolarHBondContact O-N 3.3Å; M285-T293 HydrophobicContact CB-CG2 4.17Å; M285-T293 PolarHBondContact O-OG1 3.09Å; M285-F412 HydrophobicContact CB-CD2 4.38Å; M285-F412 HydrophobicContact CB-CE2 3.8Å; M285-F412 HydrophobicContact CB-CZ 4.33Å; M285-F412 HydrophobicContact CE-CD1 4.31Å; M285-F412 HydrophobicContact CE-CE1 3.54Å; M285-F412 HydrophobicContact CE-CE2 3.92Å; M285-F412 HydrophobicContact CE-CZ 3.3Å; M285-F412 HydrophobicContact CG-CD2 4.43Å; M285-F412 HydrophobicContact CG-CE2 4.14Å; M285-F412 HydrophobicContact CG-CZ 4.47Å; M285-Y415 HydrophobicContact CG-CD2 4.41Å; M285-Y415 HydrophobicContact CG-CG 4.39Å; M285-Q416 HydrophobicContact CE-CB 4.16Å; M285-V419 HydrophobicContact SD-CG2 3.84Å
286	L	88.8	Confident	87.6	Confident	96 Å²	96	41.9 Å²	41.9	50%	0.503	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-35.6	175.2	-76	168.5	0	0	0	112.5	Y282 F284 I288 T293	Y282-L286 WeakPolarHBondContact O-CB 3.44Å; Y282-L286 VanDerWaalsContact O-CG 3.27Å; Y282-L286 WeakPolarHBondContact O-CG 3.48Å; Y282-L286 PolarHBondContact O-N 3.46Å; F284-L286 VanDerWaalsContact C-N 3.34Å; F284-L286 PolarHBondContact O-N 3.11Å; L286-I288 VanDerWaalsContact C-N 3.33Å; L286-T293 HydrophobicContact CD2-CG2 3.63Å; L286-T293 HydrophobicContact CG-CG2 3.79Å; L286-T293 PolarHBondContact N-OG1 2.91Å
287	S	87.6	Confident	87.3	Confident	91 Å²	91	44.6 Å²	44.6	64%	0.636	26%	0.255	S	S	*	.	H	α-helix	trans	-69.5	-28.9	176.9	78.1	0	0	0	0	113.5	G283 F284 M285	G283-S287 PolarHBondContact O-N 3.46Å; G283-S287 VanDerWaalsContact O-N 3.14Å; F284-S287 WeakPolarHBondContact O-CB 3.45Å; F284-S287 PolarHBondContact O-N 3.2Å; F284-S287 VanDerWaalsContact O-N 3.13Å; F284-S287 PolarHBondContact O-OG 3.43Å; M285-S287 VanDerWaalsContact C-N 3.28Å; M285-S287 PolarHBondContact O-N 3.25Å
288	I	86.6	Confident	86.8	Confident	38 Å²	38	50.4 Å²	50.4	20%	0.195	29%	0.286	C	S	.	.	H	α-helix	trans	-81.1	-58.1	178.3	-66.6	168.9	0	0	0	109.9	F284 M285 L286 L404 F412 Y415	F284-I288 PolarHBondContact O-N 2.9Å; F284-I288 VanDerWaalsContact O-N 3.13Å; M285-I288 PolarHBondContact O-N 3.44Å; L286-I288 VanDerWaalsContact C-N 3.33Å; I288-L404 HydrophobicContact CG2-CD1 3.67Å; I288-F412 HydrophobicContact CB-CD2 4.29Å; I288-F412 HydrophobicContact CG2-CD2 4.14Å; I288-Y415 HydrophobicContact CD1-CD2 4.03Å; I288-Y415 HydrophobicContact CD1-CE2 3.82Å
289	S	87.6	Confident	86.4	Confident	5 Å²	5	50.6 Å²	50.6	4%	0.035	29%	0.285	C	S	.	.			trans	-153.7	118.1	176.8	60.8	0	0	0	0	112	M285 R291 L292 T293	M285-S289 PolarHBondContact O-N 3.3Å; S289-R291 VanDerWaalsContact C-N 3.27Å; S289-R291 PolarHBondContact O-N 3.34Å; S289-L292 WeakPolarHBondContact OG-CB 3.17Å; S289-L292 WeakPolarHBondContact OG-CD1 3.47Å; S289-L292 WeakPolarHBondContact OG-CG 3.45Å; S289-T293 WeakPolarHBondContact O-CB 3.35Å; S289-T293 PolarHBondContact O-N 3.28Å; S289-T293 PolarHBondContact O-OG1 3.26Å
290	P	85.4	Confident	85.9	Confident	87 Å²	87	46.5 Å²	46.5	57%	0.565	26%	0.26	S	S	*	.	H	α-helix	trans	-67.6	-29.7	177.9	24.8	-32.1	0	0	0	112.1	T293 L294	P290-T293 PolarHBondContact O-N 3.24Å; P290-L294 WeakPolarHBondContact O-CB 3.35Å; P290-L294 PolarHBondContact O-N 2.9Å
291	R	83.3	Confident	85.5	Confident	113 Å²	113	48.6 Å²	48.6	43%	0.426	27%	0.269	S	S	.	.	H	α-helix	trans	-66	-50.2	-180	-69.4	178.4	176	157.8	-2	112.5	S289 T293 L294 L295 E403	S289-R291 VanDerWaalsContact C-N 3.27Å; S289-R291 PolarHBondContact O-N 3.34Å; R291-T293 VanDerWaalsContact C-N 3.3Å; R291-T293 PolarHBondContact O-N 3.49Å; R291-L294 PolarHBondContact O-N 2.96Å; R291-L295 PolarHBondContact O-N 3.45Å; R291-E403 IonicContact CZ-OE1 2.83Å; R291-E403 IonicContact CZ-OE2 2.66Å; R291-E403 IonicContact NH1-OE1 2.64Å; R291-E403 PolarHBondContact NH1-OE1 3.11Å; R291-E403 IonicContact NH1-OE2 3.88Å; R291-E403 PolarHBondContact NH1-OE2 3.15Å; R291-E403 IonicContact NH2-OE1 3.73Å
292	L	84.3	Confident	85.1	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-32.9	177	-58.1	178.8	0	0	0	111.1	S289 L294 L295 S296 M391 C394 L404 L409 F412	S289-L292 WeakPolarHBondContact OG-CB 3.17Å; S289-L292 WeakPolarHBondContact OG-CD1 3.47Å; S289-L292 WeakPolarHBondContact OG-CG 3.45Å; L292-L294 PolarHBondContact O-N 3.38Å; L292-L295 WeakPolarHBondContact O-CB 3.47Å; L292-L295 PolarHBondContact O-N 2.91Å; L292-S296 PolarHBondContact O-N 2.57Å; L292-M391 HydrophobicContact CD2-CG 4.12Å; L292-C394 HydrophobicContact CD2-CB 3.78Å; L292-L404 HydrophobicContact CD1-CD2 3.93Å; L292-L409 HydrophobicContact CD1-CD1 4.18Å; L292-F412 VanDerWaalsContact C-CZ 3.4Å; L292-F412 HydrophobicContact CB-CD1 4.25Å; L292-F412 HydrophobicContact CB-CD2 4.4Å; L292-F412 HydrophobicContact CB-CE1 3.63Å; L292-F412 HydrophobicContact CB-CE2 3.78Å; L292-F412 HydrophobicContact CB-CZ 3.36Å; L292-F412 HydrophobicContact CD1-CD1 4.32Å; L292-F412 HydrophobicContact CD1-CG 4.36Å
293	T	87.1	Confident	84.7	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-43.2	177.1	-56	0	0	0	0	111.8	Y282 M285 L286 S289 P290 R291 L295 S296 L297 F412	Y282-T293 HydrophobicContact CD1-CG2 4.04Å; Y282-T293 HydrophobicContact CE1-CG2 4.47Å; M285-T293 HydrophobicContact CB-CG2 4.17Å; M285-T293 PolarHBondContact O-OG1 3.09Å; L286-T293 HydrophobicContact CD2-CG2 3.63Å; L286-T293 HydrophobicContact CG-CG2 3.79Å; L286-T293 PolarHBondContact N-OG1 2.91Å; S289-T293 WeakPolarHBondContact O-CB 3.35Å; S289-T293 PolarHBondContact O-N 3.28Å; S289-T293 PolarHBondContact O-OG1 3.26Å; P290-T293 PolarHBondContact O-N 3.24Å; R291-T293 VanDerWaalsContact C-N 3.3Å; R291-T293 PolarHBondContact O-N 3.49Å; T293-L295 VanDerWaalsContact C-N 3.31Å; T293-L295 PolarHBondContact O-N 2.93Å; T293-S296 PolarHBondContact O-N 3.31Å; T293-S296 PolarHBondContact O-OG 3.45Å; T293-L297 PolarHBondContact O-N 2.91Å; T293-F412 WeakPolarHBondContact OG1-CE2 3.11Å
294	L	84.2	Confident	84.3	Confident	75 Å²	75	52.9 Å²	52.9	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-39.1	175.9	-171.9	63.2	0	0	0	112.3	L79 P290 R291 L292 L297 L298	L79-L294 HydrophobicContact CD2-CD2 3.58Å; L79-L294 HydrophobicContact CD2-CG 4.37Å; L79-L294 HydrophobicContact CG-CD2 3.98Å; P290-L294 WeakPolarHBondContact O-CB 3.35Å; P290-L294 PolarHBondContact O-N 2.9Å; R291-L294 PolarHBondContact O-N 2.96Å; L292-L294 PolarHBondContact O-N 3.38Å; L294-L297 PolarHBondContact O-N 3.31Å; L294-L298 PolarHBondContact O-N 2.8Å
295	L	84.2	Confident	83.9	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.199	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-43.4	174.6	-176.9	64.7	0	0	0	111.6	R291 L292 T293 L297 L298 H299 L390 M391	R291-L295 PolarHBondContact O-N 3.45Å; L292-L295 WeakPolarHBondContact O-CB 3.47Å; L292-L295 PolarHBondContact O-N 2.91Å; T293-L295 VanDerWaalsContact C-N 3.31Å; T293-L295 PolarHBondContact O-N 2.93Å; L295-L297 VanDerWaalsContact C-N 3.3Å; L295-L297 PolarHBondContact O-N 2.97Å; L295-L298 PolarHBondContact O-N 2.93Å; L295-H299 PolarHBondContact O-N 3.13Å; L295-L390 HydrophobicContact CD1-CD2 3.8Å; L295-L390 HydrophobicContact CD1-CG 4.45Å; L295-L390 HydrophobicContact CD2-CD2 4.24Å; L295-L390 HydrophobicContact CD2-CG 4.01Å; L295-M391 HydrophobicContact CD2-CB 4.38Å; L295-M391 HydrophobicContact CD2-CG 4.39Å
296	S	83.1	Confident	83.5	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-36.4	175.6	80.5	0	0	0	0	112.4	L292 T293 H299	L292-S296 PolarHBondContact O-N 2.57Å; T293-S296 PolarHBondContact O-N 3.31Å; T293-S296 PolarHBondContact O-OG 3.45Å; S296-H299 PolarHBondContact O-N 2.84Å
297	L	82.9	Confident	83.2	Confident	91 Å²	91	49 Å²	49	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-36.7	177.9	-170.7	68.3	0	0	0	111.4	T293 L294 L295 H299 M300 P301	T293-L297 PolarHBondContact O-N 2.91Å; L294-L297 PolarHBondContact O-N 3.31Å; L295-L297 VanDerWaalsContact C-N 3.3Å; L295-L297 PolarHBondContact O-N 2.97Å; L297-H299 VanDerWaalsContact C-N 3.28Å; L297-H299 PolarHBondContact O-N 2.8Å; L297-M300 PolarHBondContact O-N 3.49Å; L297-P301 WeakPolarHBondContact O-CD 3.48Å
298	L	81.3	Confident	82.8	Confident	133 Å²	133	48.5 Å²	48.5	70%	0.696	25%	0.254	S	S	*	.	H	α-helix	trans	-65.9	-29.8	177	-174.8	63	0	0	0	112.9	L294 L295 P301	L294-L298 PolarHBondContact O-N 2.8Å; L295-L298 PolarHBondContact O-N 2.93Å; L298-P301 WeakPolarHBondContact O-CD 3.32Å
299	H	80.3	Confident	82.6	Confident	22 Å²	22	50.5 Å²	50.5	10%	0.102	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-32.3	176.2	174.2	59.7	0	0	0	113	L295 S296 L297 F302 T303 V387	L295-H299 PolarHBondContact O-N 3.13Å; S296-H299 PolarHBondContact O-N 2.84Å; L297-H299 VanDerWaalsContact C-N 3.28Å; L297-H299 PolarHBondContact O-N 2.8Å; H299-F302 PolarHBondContact O-N 3.11Å; H299-T303 WeakPolarHBondContact CE1-CG2 3.46Å; H299-T303 VanDerWaalsContact NE2-CG2 3.34Å; H299-T303 WeakPolarHBondContact NE2-CG2 3.2Å; H299-T303 PolarHBondContact O-N 3.15Å; H299-V387 HydrophobicContact CB-CG1 4.05Å; H299-V387 HydrophobicContact CB-CG2 4.18Å; H299-V387 VanDerWaalsContact ND1-CG2 3.32Å; H299-V387 WeakPolarHBondContact ND1-CG2 2.98Å
300	M	80.8	Confident	82.5	Confident	14 Å²	14	51.8 Å²	51.8	7%	0.069	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-46.4	-172.7	-69.2	-59.9	178.7	0	0	114.8	Y282 L297 F302 T303 I304 V419 V423	Y282-M300 WeakPolarHBondContact OH-CG 3.4Å; L297-M300 PolarHBondContact O-N 3.49Å; M300-F302 PolarHBondContact O-N 2.9Å; M300-T303 PolarHBondContact O-N 2.96Å; M300-T303 PolarHBondContact O-OG1 3.43Å; M300-I304 WeakPolarHBondContact O-CB 3.34Å; M300-I304 VanDerWaalsContact O-CG1 3.25Å; M300-I304 WeakPolarHBondContact O-CG1 3.17Å; M300-I304 PolarHBondContact O-N 3.07Å; M300-V419 HydrophobicContact CE-CG1 4.02Å; M300-V423 HydrophobicContact CE-CG2 4.39Å; M300-V423 HydrophobicContact SD-CB 4.34Å; M300-V423 HydrophobicContact SD-CG1 4.19Å
301	P	80.7	Confident	82.3	Confident	70 Å²	70	50 Å²	50	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-56.6	-35.1	176.6	-27.3	33.6	0	0	0	113.4	L297 L298 A305	L297-P301 WeakPolarHBondContact O-CD 3.48Å; L298-P301 WeakPolarHBondContact O-CD 3.32Å; P301-A305 VanDerWaalsContact O-CB 3.27Å; P301-A305 WeakPolarHBondContact O-CB 3.2Å; P301-A305 PolarHBondContact O-N 3.28Å
302	F	81.8	Confident	82.2	Confident	113 Å²	113	48.7 Å²	48.7	50%	0.496	26%	0.263	S	S	.	.	H	α-helix	trans	-70.3	-44.1	-180	-170.5	-78.3	0	0	0	111.5	H299 M300 A305 A306 L383	H299-F302 PolarHBondContact O-N 3.11Å; M300-F302 PolarHBondContact O-N 2.9Å; F302-A305 PolarHBondContact O-N 2.95Å; F302-A306 WeakPolarHBondContact O-CB 3.4Å; F302-A306 PolarHBondContact O-N 3.24Å; F302-L383 HydrophobicContact CD1-CD1 3.58Å; F302-L383 HydrophobicContact CD1-CD2 3.19Å; F302-L383 HydrophobicContact CD1-CG 3.97Å; F302-L383 HydrophobicContact CE1-CD1 3.39Å; F302-L383 HydrophobicContact CE1-CD2 3.45Å; F302-L383 VanDerWaalsContact CE1-CD2 3.45Å; F302-L383 HydrophobicContact CE1-CG 3.94Å; F302-L383 HydrophobicContact CG-CD1 4.33Å; F302-L383 HydrophobicContact CG-CD2 4.32Å; F302-L383 HydrophobicContact CZ-CD1 4.03Å
303	T	81.1	Confident	82.2	Confident	11 Å²	11	51.7 Å²	51.7	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-42.6	177.6	54.2	0	0	0	0	111.5	H299 M300 A305 A306 E307 L383	H299-T303 WeakPolarHBondContact CE1-CG2 3.46Å; H299-T303 VanDerWaalsContact NE2-CG2 3.34Å; H299-T303 WeakPolarHBondContact NE2-CG2 3.2Å; H299-T303 PolarHBondContact O-N 3.15Å; M300-T303 PolarHBondContact O-N 2.96Å; M300-T303 PolarHBondContact O-OG1 3.43Å; T303-A305 PolarHBondContact O-N 3.48Å; T303-A306 PolarHBondContact O-N 2.95Å; T303-E307 VanDerWaalsContact O-CB 3.26Å; T303-E307 WeakPolarHBondContact O-CB 3.12Å; T303-E307 PolarHBondContact O-N 2.85Å; T303-L383 HydrophobicContact CG2-CD2 3.75Å
304	I	81	Confident	82.1	Confident	49 Å²	49	53.8 Å²	53.8	25%	0.251	28%	0.283	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.4	-66.1	170.7	0	0	0	110.9	M300 E307 K308 V423 V427	M300-I304 WeakPolarHBondContact O-CB 3.34Å; M300-I304 VanDerWaalsContact O-CG1 3.25Å; M300-I304 WeakPolarHBondContact O-CG1 3.17Å; M300-I304 PolarHBondContact O-N 3.07Å; I304-E307 PolarHBondContact O-N 3.35Å; I304-K308 WeakPolarHBondContact O-CB 3.3Å; I304-K308 PolarHBondContact O-N 3.34Å; I304-V423 HydrophobicContact CD1-CG1 4.12Å; I304-V427 HydrophobicContact CD1-CG2 4.09Å; I304-V427 HydrophobicContact CG1-CG2 4.17Å; I304-V427 HydrophobicContact CG2-CG1 4.43Å; I304-V427 HydrophobicContact CG2-CG2 4.45Å
305	A	80	Confident	81.9	Confident	14 Å²	14	56.7 Å²	56.7	12%	0.116	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-47.5	178.1	0	0	0	0	0	112	L119 P301 F302 T303 E307 K308 V309	L119-A305 HydrophobicContact CD2-CB 4.16Å; P301-A305 VanDerWaalsContact O-CB 3.27Å; P301-A305 WeakPolarHBondContact O-CB 3.2Å; P301-A305 PolarHBondContact O-N 3.28Å; F302-A305 PolarHBondContact O-N 2.95Å; T303-A305 PolarHBondContact O-N 3.48Å; A305-E307 VanDerWaalsContact C-N 3.33Å; A305-E307 PolarHBondContact O-N 2.91Å; A305-K308 PolarHBondContact O-N 3.49Å; A305-V309 WeakPolarHBondContact O-CG2 3.05Å; A305-V309 PolarHBondContact O-N 3.19Å; A305-V309 VanDerWaalsContact O-N 3.12Å
306	A	82.2	Confident	82	Confident	36 Å²	36	59.6 Å²	59.6	30%	0.298	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-42.6	177.6	0	0	0	0	0	112	F302 T303 Y310	F302-A306 WeakPolarHBondContact O-CB 3.4Å; F302-A306 PolarHBondContact O-N 3.24Å; T303-A306 PolarHBondContact O-N 2.95Å; A306-Y310 PolarHBondContact O-N 3.31Å; A306-Y310 VanDerWaalsContact O-N 3.11Å
307	E	81.4	Confident	82.2	Confident	22 Å²	22	59.5 Å²	59.5	10%	0.103	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-40.3	177.5	-176.4	167.2	-173	0	0	112.5	T303 I304 A305 V309 Y310 N311 Q424	T303-E307 VanDerWaalsContact O-CB 3.26Å; T303-E307 WeakPolarHBondContact O-CB 3.12Å; T303-E307 PolarHBondContact O-N 2.85Å; I304-E307 PolarHBondContact O-N 3.35Å; A305-E307 VanDerWaalsContact C-N 3.33Å; A305-E307 PolarHBondContact O-N 2.91Å; E307-V309 PolarHBondContact O-N 3.49Å; E307-Y310 PolarHBondContact O-N 3.15Å; E307-N311 WeakPolarHBondContact O-CB 3.49Å; E307-N311 PolarHBondContact O-N 2.87Å; E307-Q424 WeakPolarHBondContact OE2-CG 3.49Å
308	K	79.7	Confident	82.4	Confident	79 Å²	79	58.2 Å²	58.2	34%	0.343	30%	0.3	S	S	.	.	H	α-helix	trans	-63.1	-43.5	177.3	-172.6	172.9	-167.4	160	0	112.7	L119 I304 A305 Y310 N311 T312	L119-K308 HydrophobicContact CD2-CB 4.41Å; L119-K308 HydrophobicContact CD2-CD 3.66Å; L119-K308 WeakPolarHBondContact O-CE 3.01Å; L119-K308 PolarHBondContact O-NZ 2.96Å; I304-K308 WeakPolarHBondContact O-CB 3.3Å; I304-K308 PolarHBondContact O-N 3.34Å; A305-K308 PolarHBondContact O-N 3.49Å; K308-Y310 VanDerWaalsContact C-N 3.32Å; K308-N311 PolarHBondContact O-N 2.93Å; K308-T312 PolarHBondContact O-N 3.27Å; K308-T312 PolarHBondContact O-OG1 3.43Å
309	V	82.8	Confident	82.6	Confident	81 Å²	81	59.4 Å²	59.4	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-47	176.7	172.3	0	0	0	0	109.6	V118 A305 E307 R313	V118-V309 HydrophobicContact CG1-CG2 3.89Å; A305-V309 WeakPolarHBondContact O-CG2 3.05Å; A305-V309 PolarHBondContact O-N 3.19Å; A305-V309 VanDerWaalsContact O-N 3.12Å; E307-V309 PolarHBondContact O-N 3.49Å; V309-R313 PolarHBondContact O-N 3.43Å
310	Y	85.6	Confident	83.2	Confident	32 Å²	32	61.2 Å²	61.2	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-51	176.3	172.3	-105	0	0	0	112.1	A306 E307 K308 T312 R313 H314 R373 Y376	A306-Y310 PolarHBondContact O-N 3.31Å; A306-Y310 VanDerWaalsContact O-N 3.11Å; E307-Y310 PolarHBondContact O-N 3.15Å; K308-Y310 VanDerWaalsContact C-N 3.32Å; Y310-T312 VanDerWaalsContact C-N 3.32Å; Y310-T312 PolarHBondContact O-N 2.87Å; Y310-R313 PolarHBondContact O-N 3.46Å; Y310-H314 HydrophobicContact CE1-CB 4.3Å; Y310-H314 HydrophobicContact CE2-CB 4.49Å; Y310-H314 WeakPolarHBondContact O-CB 3.49Å; Y310-H314 PolarHBondContact O-N 3.36Å; Y310-R373 HydrophobicContact CE2-CB 4.35Å; Y310-R373 WeakPolarHBondContact OH-CB 3.06Å; Y310-R373 WeakPolarHBondContact OH-CG 3.01Å; Y310-Y376 AromaticContact CD1-CD1 3.83Å; Y310-Y376 HydrophobicContact CD1-CD1 3.83Å; Y310-Y376 HydrophobicContact CD1-CD2 4.34Å; Y310-Y376 AromaticContact CD1-CE1 3.87Å; Y310-Y376 HydrophobicContact CD1-CE1 3.87Å; Y310-Y376 HydrophobicContact CD1-CE2 4.37Å; Y310-Y376 HydrophobicContact CD1-CG 4.07Å; Y310-Y376 HydrophobicContact CD2-CD1 4.03Å; Y310-Y376 HydrophobicContact CD2-CD2 4.1Å; Y310-Y376 AromaticContact CD2-CG 3.62Å; Y310-Y376 HydrophobicContact CD2-CG 3.62Å; Y310-Y376 AromaticContact CE1-CD1 3.98Å; Y310-Y376 HydrophobicContact CE1-CD1 3.98Å; Y310-Y376 HydrophobicContact CE1-CE1 4.18Å; Y310-Y376 HydrophobicContact CE2-CD1 4.19Å; Y310-Y376 HydrophobicContact CE2-CG 4.13Å; Y310-Y376 AromaticContact CG-CD1 3.84Å; Y310-Y376 HydrophobicContact CG-CD1 3.84Å; Y310-Y376 AromaticContact CG-CD2 3.73Å; Y310-Y376 HydrophobicContact CG-CD2 3.73Å; Y310-Y376 HydrophobicContact CG-CE1 4.21Å; Y310-Y376 HydrophobicContact CG-CE2 4.09Å; Y310-Y376 AromaticContact CG-CG 3.58Å; Y310-Y376 HydrophobicContact CG-CG 3.58Å
311	N	81.3	Confident	83.8	Confident	48 Å²	48	60.9 Å²	60.9	26%	0.257	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-39.2	-177.3	-78	-13.4	0	0	0	112.5	E307 K308 H314 Q315	E307-N311 WeakPolarHBondContact O-CB 3.49Å; E307-N311 PolarHBondContact O-N 2.87Å; K308-N311 PolarHBondContact O-N 2.93Å; N311-H314 PolarHBondContact O-N 3.45Å; N311-Q315 WeakPolarHBondContact O-CB 3.38Å; N311-Q315 WeakPolarHBondContact O-CG 3.34Å; N311-Q315 PolarHBondContact O-N 3.43Å
312	T	80.4	Confident	84.2	Confident	86 Å²	86	63.2 Å²	63.2	53%	0.528	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-46.9	177.7	-53.8	0	0	0	0	111.1	K308 Y310 E316	K308-T312 PolarHBondContact O-N 3.27Å; K308-T312 PolarHBondContact O-OG1 3.43Å; Y310-T312 VanDerWaalsContact C-N 3.32Å; Y310-T312 PolarHBondContact O-N 2.87Å; T312-E316 PolarHBondContact O-N 3.48Å
313	R	83.6	Confident	84.7	Confident	65 Å²	65	61.3 Å²	61.3	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-41.2	177.2	-172.1	70.9	-176.2	98.8	32.8	111.8	V309 Y310 Q315 E316 V317 E372	V309-R313 PolarHBondContact O-N 3.43Å; Y310-R313 PolarHBondContact O-N 3.46Å; R313-Q315 PolarHBondContact O-N 3.04Å; R313-E316 IonicContact CZ-OE2 2.88Å; R313-E316 IonicContact NH1-OE2 3.07Å; R313-E316 PolarHBondContact NH1-OE2 2.93Å; R313-E316 PolarHBondContact O-N 3.33Å; R313-V317 WeakPolarHBondContact O-CG2 3.13Å; R313-V317 PolarHBondContact O-N 2.95Å; R313-V317 VanDerWaalsContact O-N 3.1Å; R313-E372 WeakPolarHBondContact CG-OE2 3.19Å; R313-E372 IonicContact CZ-OE1 2.85Å; R313-E372 IonicContact NE-OE1 2.58Å; R313-E372 IonicContact NE-OE2 3.77Å; R313-E372 IonicContact NH2-OE1 3.39Å; R313-E372 PolarHBondContact NH2-OE1 2.83Å; R313-E372 IonicContact NH2-OE2 3.96Å
314	H	85.1	Confident	85.2	Confident	49 Å²	49	60.9 Å²	60.9	23%	0.227	30%	0.3	C	S	.	.	H	α-helix	trans	-60.1	-43.9	178.4	-179.7	68.1	0	0	0	111.8	Y310 N311 E316 V317 L318	Y310-H314 HydrophobicContact CE1-CB 4.3Å; Y310-H314 HydrophobicContact CE2-CB 4.49Å; Y310-H314 WeakPolarHBondContact O-CB 3.49Å; Y310-H314 PolarHBondContact O-N 3.36Å; N311-H314 PolarHBondContact O-N 3.45Å; H314-E316 PolarHBondContact O-N 3.09Å; H314-V317 PolarHBondContact O-N 2.9Å; H314-L318 VanDerWaalsContact O-CB 3.27Å; H314-L318 WeakPolarHBondContact O-CB 3.5Å; H314-L318 PolarHBondContact O-N 3.07Å
315	Q	81.3	Confident	85.9	Confident	135 Å²	135	61.8 Å²	61.8	63%	0.631	31%	0.307	S	S	*	.	H	α-helix	trans	-63.3	-39.6	177.3	-77.3	-177.9	-11.6	0	0	112.6	N311 R313 L318 R319	N311-Q315 WeakPolarHBondContact O-CB 3.38Å; N311-Q315 WeakPolarHBondContact O-CG 3.34Å; N311-Q315 PolarHBondContact O-N 3.43Å; R313-Q315 PolarHBondContact O-N 3.04Å; Q315-L318 PolarHBondContact O-N 3.15Å; Q315-R319 PolarHBondContact O-N 2.83Å
316	E	85.1	Confident	86.4	Confident	100 Å²	100	63.6 Å²	63.6	47%	0.467	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-49.1	176.2	-173.9	179.3	-147.7	0	0	111.5	T312 R313 H314 L318 R319 E320	T312-E316 PolarHBondContact O-N 3.48Å; R313-E316 IonicContact CZ-OE2 2.88Å; R313-E316 IonicContact NH1-OE2 3.07Å; R313-E316 PolarHBondContact NH1-OE2 2.93Å; R313-E316 PolarHBondContact O-N 3.33Å; H314-E316 PolarHBondContact O-N 3.09Å; E316-L318 VanDerWaalsContact C-N 3.31Å; E316-L318 PolarHBondContact O-N 3.47Å; E316-R319 WeakPolarHBondContact O-CB 3.47Å; E316-R319 PolarHBondContact O-N 3.42Å; E316-E320 PolarHBondContact O-N 3.09Å; E316-E320 VanDerWaalsContact O-N 3.13Å
317	V	87.6	Confident	86.9	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-37.1	176.8	177.2	0	0	0	0	111.3	R313 H314 R319 E320 I321 R369	R313-V317 WeakPolarHBondContact O-CG2 3.13Å; R313-V317 PolarHBondContact O-N 2.95Å; R313-V317 VanDerWaalsContact O-N 3.1Å; H314-V317 PolarHBondContact O-N 2.9Å; V317-R319 VanDerWaalsContact C-N 3.3Å; V317-R319 PolarHBondContact O-N 3.3Å; V317-E320 PolarHBondContact O-N 2.93Å; V317-I321 HydrophobicContact CG1-CD1 4Å; V317-I321 HydrophobicContact CG1-CG1 4.43Å; V317-I321 VanDerWaalsContact O-CG1 3.31Å; V317-I321 WeakPolarHBondContact O-CG1 3.31Å; V317-I321 PolarHBondContact O-N 3.26Å; V317-R369 HydrophobicContact CG1-CB 3.85Å; V317-R369 HydrophobicContact CG1-CG 4.43Å
318	L	87.1	Confident	87.5	Confident	63 Å²	63	66.6 Å²	66.6	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-64	-37.2	177.7	-168.9	66.1	0	0	0	111.6	H314 Q315 E316 I321 Q322	H314-L318 VanDerWaalsContact O-CB 3.27Å; H314-L318 WeakPolarHBondContact O-CB 3.5Å; H314-L318 PolarHBondContact O-N 3.07Å; Q315-L318 PolarHBondContact O-N 3.15Å; E316-L318 VanDerWaalsContact C-N 3.31Å; E316-L318 PolarHBondContact O-N 3.47Å; L318-I321 PolarHBondContact O-N 2.86Å; L318-Q322 WeakPolarHBondContact O-CG 3.32Å; L318-Q322 PolarHBondContact O-N 2.67Å
319	R	86.6	Confident	88.2	Confident	159 Å²	159	64.2 Å²	64.2	60%	0.6	32%	0.323	S	S	*	.	H	α-helix	trans	-65.1	-44.8	173.9	-165.2	178.6	74.3	104.5	-0.2	111.6	Q315 E316 V317 I321 Q322 D323	Q315-R319 PolarHBondContact O-N 2.83Å; E316-R319 WeakPolarHBondContact O-CB 3.47Å; E316-R319 PolarHBondContact O-N 3.42Å; V317-R319 VanDerWaalsContact C-N 3.3Å; V317-R319 PolarHBondContact O-N 3.3Å; R319-I321 VanDerWaalsContact C-N 3.29Å; R319-I321 PolarHBondContact O-N 3.01Å; R319-Q322 PolarHBondContact O-N 2.77Å; R319-D323 PolarHBondContact O-N 2.91Å
320	E	92.1	Very high	88.8	Confident	59 Å²	59	65 Å²	65	28%	0.276	32%	0.322	S	S	.	.	H	α-helix	trans	-58.5	-40.8	174.1	-68.3	174.4	-170.4	0	0	111.9	E316 V317 D323 A324 L365 R368	E316-E320 PolarHBondContact O-N 3.09Å; E316-E320 VanDerWaalsContact O-N 3.13Å; V317-E320 PolarHBondContact O-N 2.93Å; E320-D323 PolarHBondContact O-N 3.47Å; E320-A324 WeakPolarHBondContact O-CB 3.24Å; E320-A324 PolarHBondContact O-N 2.88Å; E320-L365 HydrophobicContact CB-CD1 4.18Å; E320-L365 HydrophobicContact CB-CD2 4.15Å; E320-L365 WeakPolarHBondContact OE2-CD2 3.41Å; E320-R368 IonicContact OE2-NH1 2.62Å
321	I	92.5	Very high	89.2	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.036	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-45.9	175.2	-70.5	167.9	0	0	0	110.8	V317 L318 R319 D323 A324 V325 L365 Y366 R369	V317-I321 HydrophobicContact CG1-CD1 4Å; V317-I321 HydrophobicContact CG1-CG1 4.43Å; V317-I321 VanDerWaalsContact O-CG1 3.31Å; V317-I321 WeakPolarHBondContact O-CG1 3.31Å; V317-I321 PolarHBondContact O-N 3.26Å; L318-I321 PolarHBondContact O-N 2.86Å; R319-I321 VanDerWaalsContact C-N 3.29Å; R319-I321 PolarHBondContact O-N 3.01Å; I321-D323 VanDerWaalsContact C-N 3.32Å; I321-D323 PolarHBondContact O-N 3.3Å; I321-A324 PolarHBondContact O-N 3.41Å; I321-V325 HydrophobicContact CG2-CG2 4.21Å; I321-V325 WeakPolarHBondContact O-CB 3.25Å; I321-V325 VanDerWaalsContact O-CG2 3.3Å; I321-V325 WeakPolarHBondContact O-CG2 3.43Å; I321-V325 PolarHBondContact O-N 2.87Å; I321-L365 HydrophobicContact CG1-CB 3.68Å; I321-L365 HydrophobicContact CG1-CD1 4.46Å; I321-Y366 HydrophobicContact CD1-CD1 4.17Å; I321-Y366 HydrophobicContact CD1-CE1 4.31Å; I321-Y366 HydrophobicContact CG2-CE1 3.97Å; I321-Y366 HydrophobicContact CG2-CE2 4.37Å; I321-R369 HydrophobicContact CD1-CB 4.08Å; I321-R369 HydrophobicContact CD1-CG 4.36Å
322	Q	88.9	Confident	89.9	Confident	119 Å²	119	65 Å²	65	56%	0.556	33%	0.327	S	S	*	.	H	α-helix	trans	-59.3	-44.2	178	-75.2	175.6	0.8	0	0	111.5	L318 R319 V325 A326	L318-Q322 WeakPolarHBondContact O-CG 3.32Å; L318-Q322 PolarHBondContact O-N 2.67Å; R319-Q322 PolarHBondContact O-N 2.77Å; Q322-V325 PolarHBondContact O-N 3.35Å; Q322-A326 WeakPolarHBondContact O-CB 3.21Å; Q322-A326 PolarHBondContact O-N 2.93Å
323	D	92.4	Very high	90.6	Very high	74 Å²	74	69 Å²	69	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-41.2	176.9	-68.8	-23.1	0	0	0	111.6	R319 E320 I321 A326 R327	R319-D323 PolarHBondContact O-N 2.91Å; E320-D323 PolarHBondContact O-N 3.47Å; I321-D323 VanDerWaalsContact C-N 3.32Å; I321-D323 PolarHBondContact O-N 3.3Å; D323-A326 PolarHBondContact O-N 3.28Å; D323-R327 WeakPolarHBondContact O-CG 3.4Å; D323-R327 PolarHBondContact O-N 3.46Å; D323-R327 PolarHBondContact O-NH1 2.88Å
324	A	93.2	Very high	91.1	Very high	2 Å²	2	70.1 Å²	70.1	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-65.9	-42.7	177	0	0	0	0	0	112.6	E320 I321 A326 R327 A328 L365	E320-A324 WeakPolarHBondContact O-CB 3.24Å; E320-A324 PolarHBondContact O-N 2.88Å; I321-A324 PolarHBondContact O-N 3.41Å; A324-A326 VanDerWaalsContact C-N 3.35Å; A324-R327 PolarHBondContact O-N 3.03Å; A324-A328 PolarHBondContact O-N 3.1Å; A324-L365 HydrophobicContact CB-CD1 3.67Å
325	V	93.9	Very high	91.5	Very high	68 Å²	68	68.7 Å²	68.7	41%	0.412	34%	0.337	S	S	.	.	H	α-helix	trans	-64.7	-39.7	175.3	170.8	0	0	0	0	110.9	I321 Q322 R327 A328 G329	I321-V325 HydrophobicContact CG2-CG2 4.21Å; I321-V325 WeakPolarHBondContact O-CB 3.25Å; I321-V325 VanDerWaalsContact O-CG2 3.3Å; I321-V325 WeakPolarHBondContact O-CG2 3.43Å; I321-V325 PolarHBondContact O-N 2.87Å; Q322-V325 PolarHBondContact O-N 3.35Å; V325-R327 VanDerWaalsContact C-N 3.34Å; V325-R327 PolarHBondContact O-N 3.33Å; V325-A328 PolarHBondContact O-N 2.94Å; V325-G329 PolarHBondContact O-N 3.1Å
326	A	91.6	Very high	92.1	Very high	52 Å²	52	66.9 Å²	66.9	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-62.3	-40.1	176	0	0	0	0	0	112.1	Q322 D323 A324 G329 Q330	Q322-A326 WeakPolarHBondContact O-CB 3.21Å; Q322-A326 PolarHBondContact O-N 2.93Å; D323-A326 PolarHBondContact O-N 3.28Å; A324-A326 VanDerWaalsContact C-N 3.35Å; A326-G329 PolarHBondContact O-N 3.38Å; A326-Q330 PolarHBondContact O-N 2.93Å
327	R	92.7	Very high	92.5	Very high	116 Å²	116	65.5 Å²	65.5	44%	0.438	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-46.7	173	-72.1	-170.9	-62	-85.4	6	112	D323 A324 V325 G329 Q330 V331	D323-R327 WeakPolarHBondContact O-CG 3.4Å; D323-R327 PolarHBondContact O-N 3.46Å; D323-R327 PolarHBondContact O-NH1 2.88Å; A324-R327 PolarHBondContact O-N 3.03Å; V325-R327 VanDerWaalsContact C-N 3.34Å; V325-R327 PolarHBondContact O-N 3.33Å; R327-G329 VanDerWaalsContact C-N 3.3Å; R327-G329 PolarHBondContact O-N 2.99Å; R327-Q330 WeakPolarHBondContact O-CB 3.24Å; R327-Q330 PolarHBondContact O-N 2.88Å; R327-Q330 VanDerWaalsContact O-N 3.09Å; R327-V331 PolarHBondContact O-N 2.84Å; R327-V331 VanDerWaalsContact O-N 3.17Å
328	A	94.9	Very high	92.8	Very high	5 Å²	5	66.6 Å²	66.6	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-41.7	175.7	0	0	0	0	0	111.7	A324 V325 Q330 V331 V332 Y355 A358	A324-A328 PolarHBondContact O-N 3.1Å; V325-A328 PolarHBondContact O-N 2.94Å; A328-Q330 VanDerWaalsContact C-N 3.31Å; A328-Q330 PolarHBondContact O-N 3.41Å; A328-V331 PolarHBondContact O-N 3.21Å; A328-V332 PolarHBondContact O-N 2.96Å; A328-Y355 HydrophobicContact CB-CE2 4.17Å; A328-A358 HydrophobicContact CB-CB 3.98Å
329	G	94.3	Very high	93.2	Very high	28 Å²	28	67.3 Å²	67.3	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-66.7	-28.2	174.6	0	0	0	0	0	113.8	V325 A326 R327 R333	V325-G329 PolarHBondContact O-N 3.1Å; A326-G329 PolarHBondContact O-N 3.38Å; R327-G329 VanDerWaalsContact C-N 3.3Å; R327-G329 PolarHBondContact O-N 2.99Å; G329-R333 WeakPolarHBondContact O-CG 3.22Å; G329-R333 PolarHBondContact O-N 3.41Å; G329-R333 PolarHBondContact O-NE 3.24Å
330	Q	94.6	Very high	93.6	Very high	99 Å²	99	67.8 Å²	67.8	46%	0.463	37%	0.371	S	S	.	.	H	α-helix	trans	-66.1	-45.5	171.8	-177.8	178.2	-16.5	0	0	111.4	A326 R327 A328 V332 R333 E334	A326-Q330 PolarHBondContact O-N 2.93Å; R327-Q330 WeakPolarHBondContact O-CB 3.24Å; R327-Q330 PolarHBondContact O-N 2.88Å; R327-Q330 VanDerWaalsContact O-N 3.09Å; A328-Q330 VanDerWaalsContact C-N 3.31Å; A328-Q330 PolarHBondContact O-N 3.41Å; Q330-V332 VanDerWaalsContact C-N 3.28Å; Q330-V332 PolarHBondContact O-N 3.31Å; Q330-R333 PolarHBondContact O-N 2.85Å; Q330-R333 VanDerWaalsContact O-N 3.1Å; Q330-E334 HydrophobicContact CG-CG 4.43Å; Q330-E334 WeakPolarHBondContact CG-OE1 3.09Å; Q330-E334 PolarHBondContact NE2-OE1 3.48Å; Q330-E334 WeakPolarHBondContact O-CG 3.48Å; Q330-E334 PolarHBondContact O-N 3.49Å
331	V	94.8	Very high	93.9	Very high	20 Å²	20	68.9 Å²	68.9	12%	0.121	38%	0.382	C	S	.	.	H	α-helix	trans	-54.9	-45.6	175.8	175	0	0	0	0	111	R327 A328 E334 A335 R354	R327-V331 PolarHBondContact O-N 2.84Å; R327-V331 VanDerWaalsContact O-N 3.17Å; A328-V331 PolarHBondContact O-N 3.21Å; V331-E334 PolarHBondContact O-N 3.12Å; V331-A335 WeakPolarHBondContact O-CB 3.29Å; V331-A335 PolarHBondContact O-N 3.21Å; V331-R354 HydrophobicContact CG1-CB 4.42Å; V331-R354 HydrophobicContact CG1-CG 4.15Å; V331-R354 HydrophobicContact CG2-CG 4.45Å
332	V	96.1	Very high	94.1	Very high	59 Å²	59	69.4 Å²	69.4	36%	0.358	39%	0.386	S	S	.	.	H	α-helix	trans	-63.3	-44.4	177	176.6	0	0	0	0	111.8	A328 Q330 E334 A335 V336 Y355	A328-V332 PolarHBondContact O-N 2.96Å; Q330-V332 VanDerWaalsContact C-N 3.28Å; Q330-V332 PolarHBondContact O-N 3.31Å; V332-E334 VanDerWaalsContact C-N 3.33Å; V332-E334 PolarHBondContact O-N 2.89Å; V332-A335 PolarHBondContact O-N 2.68Å; V332-V336 HydrophobicContact CG1-CG2 4.04Å; V332-V336 WeakPolarHBondContact O-CB 3.14Å; V332-V336 VanDerWaalsContact O-CG2 3.31Å; V332-V336 WeakPolarHBondContact O-CG2 3.07Å; V332-V336 PolarHBondContact O-N 2.73Å; V332-Y355 HydrophobicContact CG2-CD2 3.75Å; V332-Y355 HydrophobicContact CG2-CE2 3.49Å; V332-Y355 VanDerWaalsContact CG2-CE2 3.49Å
333	R	94.3	Very high	94.4	Very high	169 Å²	169	72 Å²	72	64%	0.638	39%	0.39	S	S	*	.	H	α-helix	trans	-62.8	-39.4	178.7	-77.1	-179	-67.5	-160.1	1.6	112.2	G329 Q330 G337	G329-R333 WeakPolarHBondContact O-CG 3.22Å; G329-R333 PolarHBondContact O-N 3.41Å; G329-R333 PolarHBondContact O-NE 3.24Å; Q330-R333 PolarHBondContact O-N 2.85Å; Q330-R333 VanDerWaalsContact O-N 3.1Å; R333-G337 WeakPolarHBondContact O-CA 3.23Å; R333-G337 PolarHBondContact O-N 3.32Å
334	E	94	Very high	94.6	Very high	89 Å²	89	72.5 Å²	72.5	42%	0.416	40%	0.399	S	S	.	.	H	α-helix	trans	-66.2	-49.1	175.2	-71.9	173.1	-167.2	0	0	111.5	Q330 V331 V332 G338 R354	Q330-E334 HydrophobicContact CG-CG 4.43Å; Q330-E334 WeakPolarHBondContact CG-OE1 3.09Å; Q330-E334 PolarHBondContact NE2-OE1 3.48Å; Q330-E334 WeakPolarHBondContact O-CG 3.48Å; Q330-E334 PolarHBondContact O-N 3.49Å; V331-E334 PolarHBondContact O-N 3.12Å; V332-E334 VanDerWaalsContact C-N 3.33Å; V332-E334 PolarHBondContact O-N 2.89Å; E334-G338 PolarHBondContact O-N 3.1Å; E334-R354 IonicContact OE2-CZ 3.12Å; E334-R354 IonicContact OE2-NH1 3Å; E334-R354 PolarHBondContact OE2-NH1 3.28Å; E334-R354 IonicContact OE2-NH2 2.74Å; E334-R354 PolarHBondContact OE2-NH2 3.42Å
335	A	93.8	Very high	94.8	Very high	19 Å²	19	80.1 Å²	80.1	16%	0.157	43%	0.433	C	S	.	.	H	α-helix	trans	-65.9	-43.2	-177.9	0	0	0	0	0	112.6	V331 V332 G338 L339 E351	V331-A335 WeakPolarHBondContact O-CB 3.29Å; V331-A335 PolarHBondContact O-N 3.21Å; V332-A335 PolarHBondContact O-N 2.68Å; A335-G338 CarbonylContact O-C 3.56Å; A335-L339 VanDerWaalsContact O-CA 3.3Å; A335-L339 WeakPolarHBondContact O-CA 3.33Å; A335-L339 PolarHBondContact O-N 3.02Å; A335-E351 HydrophobicContact CB-CB 4.38Å; A335-E351 HydrophobicContact CB-CG 4.22Å
336	V	94.2	Very high	94.8	Very high	97 Å²	97	79.4 Å²	79.4	59%	0.588	44%	0.439	S	S	*	.	H	α-helix	trans	-74.8	-40.3	178.6	176.6	0	0	0	0	111.2	V332 G338 L339	V332-V336 HydrophobicContact CG1-CG2 4.04Å; V332-V336 WeakPolarHBondContact O-CB 3.14Å; V332-V336 VanDerWaalsContact O-CG2 3.31Å; V332-V336 WeakPolarHBondContact O-CG2 3.07Å; V332-V336 PolarHBondContact O-N 2.73Å; V336-G338 VanDerWaalsContact C-N 3.25Å; V336-G338 PolarHBondContact O-N 3.4Å; V336-L339 VanDerWaalsContact O-CB 3.32Å; V336-L339 WeakPolarHBondContact O-CB 3.44Å; V336-L339 PolarHBondContact O-N 3.48Å
337	G	93.1	Very high	95	Very high	71 Å²	71	78.3 Å²	78.3	73%	0.732	43%	0.429	S	S	*	.	H	α-helix	trans	-63.7	-33.2	175.2	0	0	0	0	0	112.5	R333	R333-G337 WeakPolarHBondContact O-CA 3.23Å; R333-G337 PolarHBondContact O-N 3.32Å
338	G	93.9	Very high	95.2	Very high	23 Å²	23	76.9 Å²	76.9	24%	0.237	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	22.8	175	0	0	0	0	0	114.2	E334 A335 V336 Q340 T341 V342	E334-G338 PolarHBondContact O-N 3.1Å; A335-G338 CarbonylContact O-C 3.56Å; V336-G338 VanDerWaalsContact C-N 3.25Å; V336-G338 PolarHBondContact O-N 3.4Å; G338-Q340 PolarHBondContact O-N 2.91Å; G338-Q340 VanDerWaalsContact O-N 3.12Å; G338-T341 WeakPolarHBondContact O-CA 3.34Å; G338-T341 VanDerWaalsContact O-CB 3.28Å; G338-T341 WeakPolarHBondContact O-CB 3.15Å; G338-T341 PolarHBondContact O-N 2.92Å; G338-V342 PolarHBondContact O-N 2.87Å
339	L	95.2	Very high	95.3	Very high	78 Å²	78	83.9 Å²	83.9	41%	0.408	46%	0.46	S	S	.	.	H	α-helix	trans	-57.1	-35.1	-170	-176.7	63.7	0	0	0	113.1	A335 V336 T341 V342 R343	A335-L339 VanDerWaalsContact O-CA 3.3Å; A335-L339 WeakPolarHBondContact O-CA 3.33Å; A335-L339 PolarHBondContact O-N 3.02Å; V336-L339 VanDerWaalsContact O-CB 3.32Å; V336-L339 WeakPolarHBondContact O-CB 3.44Å; V336-L339 PolarHBondContact O-N 3.48Å; L339-T341 VanDerWaalsContact C-N 3.33Å; L339-T341 PolarHBondContact O-N 3.46Å; L339-V342 PolarHBondContact O-N 3.39Å; L339-R343 HydrophobicContact CD1-CG 4.43Å; L339-R343 WeakPolarHBondContact O-CB 3.11Å; L339-R343 WeakPolarHBondContact O-CG 3.41Å; L339-R343 PolarHBondContact O-N 3.39Å
340	Q	95.6	Very high	95.4	Very high	170 Å²	170	88.5 Å²	88.5	79%	0.794	47%	0.474	S	S	*	.	H	α-helix	trans	-60.6	-43.2	174.2	-175.5	177.2	2.2	0	0	111.6	G338 S344	G338-Q340 PolarHBondContact O-N 2.91Å; G338-Q340 VanDerWaalsContact O-N 3.12Å; Q340-S344 WeakPolarHBondContact O-CB 2.94Å; Q340-S344 PolarHBondContact O-N 3.19Å; Q340-S344 PolarHBondContact O-OG 3.49Å
341	T	96.8	Very high	95.4	Very high	82 Å²	82	85.5 Å²	85.5	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-66.4	-46.4	176.2	-50.6	0	0	0	0	111.1	G338 L339 R343 S344 F345	G338-T341 WeakPolarHBondContact O-CA 3.34Å; G338-T341 VanDerWaalsContact O-CB 3.28Å; G338-T341 WeakPolarHBondContact O-CB 3.15Å; G338-T341 PolarHBondContact O-N 2.92Å; L339-T341 VanDerWaalsContact C-N 3.33Å; L339-T341 PolarHBondContact O-N 3.46Å; T341-R343 VanDerWaalsContact C-N 3.27Å; T341-R343 PolarHBondContact O-N 3.43Å; T341-S344 WeakPolarHBondContact CA-OG 3.33Å; T341-S344 PolarHBondContact O-N 3.21Å; T341-S344 PolarHBondContact O-OG 2.97Å; T341-F345 HydrophobicContact CG2-CD2 3.74Å; T341-F345 HydrophobicContact CG2-CE2 3.88Å; T341-F345 VanDerWaalsContact O-CD2 3.3Å; T341-F345 WeakPolarHBondContact O-CD2 3.24Å; T341-F345 PolarHBondContact O-N 2.93Å
342	V	97.1	Very high	95.5	Very high	17 Å²	17	88.7 Å²	88.7	10%	0.103	48%	0.479	C	S	.	.	H	α-helix	trans	-56.6	-45.6	178.2	177.2	0	0	0	0	110.4	G338 L339 G346 A347 E348 E351	G338-V342 PolarHBondContact O-N 2.87Å; L339-V342 PolarHBondContact O-N 3.39Å; V342-G346 PolarHBondContact O-N 2.81Å; V342-G346 VanDerWaalsContact O-N 3.09Å; V342-A347 HydrophobicContact CG1-CB 4.4Å; V342-A347 PolarHBondContact O-N 3.47Å; V342-E348 HydrophobicContact CG1-CG 4.2Å; V342-E351 HydrophobicContact CG1-CG 4.12Å; V342-E351 HydrophobicContact CG2-CG 4.1Å
343	R	96.3	Very high	95.5	Very high	175 Å²	175	88.8 Å²	88.8	66%	0.66	48%	0.482	S	S	*	.	H	α-helix	trans	-69.1	-39	177	-73.5	-171.8	173.4	-167.4	-0.8	113.4	L339 T341 F345 G346	L339-R343 HydrophobicContact CD1-CG 4.43Å; L339-R343 WeakPolarHBondContact O-CB 3.11Å; L339-R343 WeakPolarHBondContact O-CG 3.41Å; L339-R343 PolarHBondContact O-N 3.39Å; T341-R343 VanDerWaalsContact C-N 3.27Å; T341-R343 PolarHBondContact O-N 3.43Å; R343-F345 PolarHBondContact O-N 3.21Å; R343-G346 PolarHBondContact O-N 3.4Å
344	S	96.6	Very high	95.6	Very high	83 Å²	83	84.3 Å²	84.3	58%	0.58	47%	0.465	S	S	*	.	H	α-helix	trans	-66.7	-26.6	-179.7	67.4	0	0	0	0	112.7	Q340 T341	Q340-S344 WeakPolarHBondContact O-CB 2.94Å; Q340-S344 PolarHBondContact O-N 3.19Å; Q340-S344 PolarHBondContact O-OG 3.49Å; T341-S344 WeakPolarHBondContact CA-OG 3.33Å; T341-S344 PolarHBondContact O-N 3.21Å; T341-S344 PolarHBondContact O-OG 2.97Å
345	F	96.1	Very high	95.7	Very high	163 Å²	163	84.4 Å²	84.4	72%	0.715	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.6	177.2	-74.3	-83.6	0	0	0	113.8	T341 R343 A347	T341-F345 HydrophobicContact CG2-CD2 3.74Å; T341-F345 HydrophobicContact CG2-CE2 3.88Å; T341-F345 VanDerWaalsContact O-CD2 3.3Å; T341-F345 WeakPolarHBondContact O-CD2 3.24Å; T341-F345 PolarHBondContact O-N 2.93Å; R343-F345 PolarHBondContact O-N 3.21Å; F345-A347 VanDerWaalsContact C-N 3.25Å; F345-A347 HydrophobicContact CB-CB 4.46Å; F345-A347 PolarHBondContact O-N 3.44Å
346	G	95.5	Very high	95.9	Very high	53 Å²	53	90.5 Å²	90.5	55%	0.546	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	34.6	-177.5	0	0	0	0	0	113.6	V342 R343 E348	V342-G346 PolarHBondContact O-N 2.81Å; V342-G346 VanDerWaalsContact O-N 3.09Å; R343-G346 PolarHBondContact O-N 3.4Å; G346-E348 VanDerWaalsContact CA-OE2 3.26Å; G346-E348 WeakPolarHBondContact CA-OE2 3.29Å
347	A	96	Very high	96	Very high	28 Å²	28	91.7 Å²	91.7	23%	0.231	48%	0.484	C	S	.	.			trans	-94.8	16.6	-170.5	0	0	0	0	0	113.7	V342 F345 E349 H350 E351	V342-A347 HydrophobicContact CG1-CB 4.4Å; V342-A347 PolarHBondContact O-N 3.47Å; F345-A347 VanDerWaalsContact C-N 3.25Å; F345-A347 HydrophobicContact CB-CB 4.46Å; F345-A347 PolarHBondContact O-N 3.44Å; A347-E349 PolarHBondContact O-N 3.33Å; A347-H350 WeakPolarHBondContact O-CB 3.31Å; A347-H350 PolarHBondContact O-N 2.75Å; A347-H350 VanDerWaalsContact O-N 3.15Å; A347-E351 PolarHBondContact O-N 3.1Å; A347-E351 VanDerWaalsContact O-N 3.11Å
348	E	96.2	Very high	96	Very high	86 Å²	86	89 Å²	89	40%	0.402	45%	0.454	S	S	.	.	H	α-helix	trans	-57.4	-46.9	-174.3	-65.8	88.3	164.7	0	0	112.5	V342 G346 H350 E351 V352	V342-E348 HydrophobicContact CG1-CG 4.2Å; G346-E348 VanDerWaalsContact CA-OE2 3.26Å; G346-E348 WeakPolarHBondContact CA-OE2 3.29Å; E348-H350 VanDerWaalsContact C-N 3.3Å; E348-H350 PolarHBondContact O-N 3.3Å; E348-E351 PolarHBondContact O-N 2.84Å; E348-V352 WeakPolarHBondContact O-CG2 3.38Å; E348-V352 PolarHBondContact O-N 3.39Å
349	E	96.8	Very high	96.1	Very high	152 Å²	152	91.5 Å²	91.5	71%	0.71	46%	0.462	S	S	*	.	H	α-helix	trans	-65	-33.8	179	-72.8	-62.6	154	0	0	112.6	A347 V352 C353	A347-E349 PolarHBondContact O-N 3.33Å; E349-V352 PolarHBondContact O-N 2.95Å; E349-C353 PolarHBondContact O-N 2.95Å
350	H	95.9	Very high	96.2	Very high	126 Å²	126	90.7 Å²	90.7	58%	0.583	46%	0.456	S	S	*	.	H	α-helix	trans	-65.4	-44.9	176.6	-175.7	74	0	0	0	111.1	A347 E348 C353 R354	A347-H350 WeakPolarHBondContact O-CB 3.31Å; A347-H350 PolarHBondContact O-N 2.75Å; A347-H350 VanDerWaalsContact O-N 3.15Å; E348-H350 VanDerWaalsContact C-N 3.3Å; E348-H350 PolarHBondContact O-N 3.3Å; H350-C353 PolarHBondContact O-N 2.87Å; H350-R354 PolarHBondContact O-N 3.17Å
351	E	96.2	Very high	96.1	Very high	36 Å²	36	87.1 Å²	87.1	17%	0.168	44%	0.44	C	S	.	.	H	α-helix	trans	-66.3	-36.7	176.8	-71.4	-60.1	153.9	0	0	112.4	A335 V342 A347 E348 R354 Y355	A335-E351 HydrophobicContact CB-CB 4.38Å; A335-E351 HydrophobicContact CB-CG 4.22Å; V342-E351 HydrophobicContact CG1-CG 4.12Å; V342-E351 HydrophobicContact CG2-CG 4.1Å; A347-E351 PolarHBondContact O-N 3.1Å; A347-E351 VanDerWaalsContact O-N 3.11Å; E348-E351 PolarHBondContact O-N 2.84Å; E351-R354 PolarHBondContact O-N 2.77Å; E351-R354 IonicContact OE1-CZ 3.34Å; E351-R354 IonicContact OE1-NE 3.41Å; E351-R354 IonicContact OE1-NH2 3.43Å; E351-R354 PolarHBondContact OE1-NH2 3.19Å; E351-R354 IonicContact OE2-CZ 3.15Å; E351-R354 IonicContact OE2-NE 3.36Å; E351-R354 PolarHBondContact OE2-NE 3.49Å; E351-R354 IonicContact OE2-NH2 3.77Å; E351-R354 PolarHBondContact OE2-NH2 3.1Å; E351-Y355 WeakPolarHBondContact O-CB 3.34Å; E351-Y355 PolarHBondContact O-N 2.58Å
352	V	96.2	Very high	95.9	Very high	87 Å²	87	83.5 Å²	83.5	53%	0.527	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-43.3	172.9	171.6	0	0	0	0	111	E348 E349 Y355 K356	E348-V352 WeakPolarHBondContact O-CG2 3.38Å; E348-V352 PolarHBondContact O-N 3.39Å; E349-V352 PolarHBondContact O-N 2.95Å; V352-Y355 PolarHBondContact O-N 2.73Å; V352-K356 WeakPolarHBondContact O-CB 3.43Å; V352-K356 PolarHBondContact O-N 3.25Å
353	C	96.8	Very high	95.9	Very high	61 Å²	61	90.2 Å²	90.2	41%	0.412	44%	0.441	S	S	.	.	H	α-helix	trans	-63.2	-46.2	176.6	-164	0	0	0	0	111.6	E349 H350 Y355 K356 E357	E349-C353 PolarHBondContact O-N 2.95Å; H350-C353 PolarHBondContact O-N 2.87Å; C353-Y355 VanDerWaalsContact C-N 3.29Å; C353-Y355 PolarHBondContact O-N 3.48Å; C353-K356 WeakPolarHBondContact O-CB 3.48Å; C353-K356 PolarHBondContact O-N 3.36Å; C353-K356 VanDerWaalsContact O-N 3.08Å; C353-E357 PolarHBondContact O-N 3.42Å
354	R	95.8	Very high	95.8	Very high	74 Å²	74	87.8 Å²	87.8	28%	0.279	44%	0.437	S	S	.	.	H	α-helix	trans	-57.2	-41.5	175.9	-167.1	169.7	73.8	133.5	4	111.8	V331 E334 H350 E351 A358	V331-R354 HydrophobicContact CG1-CB 4.42Å; V331-R354 HydrophobicContact CG1-CG 4.15Å; V331-R354 HydrophobicContact CG2-CG 4.45Å; E334-R354 IonicContact OE2-CZ 3.12Å; E334-R354 IonicContact OE2-NH1 3Å; E334-R354 PolarHBondContact OE2-NH1 3.28Å; E334-R354 IonicContact OE2-NH2 2.74Å; E334-R354 PolarHBondContact OE2-NH2 3.42Å; H350-R354 PolarHBondContact O-N 3.17Å; E351-R354 PolarHBondContact O-N 2.77Å; E351-R354 IonicContact OE1-CZ 3.34Å; E351-R354 IonicContact OE1-NE 3.41Å; E351-R354 IonicContact OE1-NH2 3.43Å; E351-R354 PolarHBondContact OE1-NH2 3.19Å; E351-R354 IonicContact OE2-CZ 3.15Å; E351-R354 IonicContact OE2-NE 3.36Å; E351-R354 PolarHBondContact OE2-NE 3.49Å; E351-R354 IonicContact OE2-NH2 3.77Å; E351-R354 PolarHBondContact OE2-NH2 3.1Å; R354-A358 PolarHBondContact O-N 3.47Å
355	Y	96.4	Very high	95.7	Very high	91 Å²	91	85.1 Å²	85.1	36%	0.357	42%	0.416	S	S	.	.	H	α-helix	trans	-68.4	-40.4	174.9	-176	-120.1	0	0	0	112.6	A328 V332 E351 V352 C353 E357 A358 L359	A328-Y355 HydrophobicContact CB-CE2 4.17Å; V332-Y355 HydrophobicContact CG2-CD2 3.75Å; V332-Y355 HydrophobicContact CG2-CE2 3.49Å; V332-Y355 VanDerWaalsContact CG2-CE2 3.49Å; E351-Y355 WeakPolarHBondContact O-CB 3.34Å; E351-Y355 PolarHBondContact O-N 2.58Å; V352-Y355 PolarHBondContact O-N 2.73Å; C353-Y355 VanDerWaalsContact C-N 3.29Å; C353-Y355 PolarHBondContact O-N 3.48Å; Y355-E357 PolarHBondContact O-N 3.01Å; Y355-A358 PolarHBondContact O-N 3.03Å; Y355-L359 HydrophobicContact CD1-CD1 3.85Å; Y355-L359 HydrophobicContact CD1-CG 4.36Å; Y355-L359 HydrophobicContact CE1-CD1 3.44Å; Y355-L359 VanDerWaalsContact CE1-CD1 3.44Å; Y355-L359 HydrophobicContact CE1-CD2 4.47Å; Y355-L359 HydrophobicContact CE1-CG 4.02Å; Y355-L359 HydrophobicContact CE2-CD2 4.38Å; Y355-L359 HydrophobicContact CE2-CG 4.24Å; Y355-L359 WeakPolarHBondContact O-CG 3.45Å; Y355-L359 PolarHBondContact O-N 3Å
356	K	97.1	Very high	95.6	Very high	147 Å²	147	81.4 Å²	81.4	64%	0.639	40%	0.398	S	S	*	.	H	α-helix	trans	-60.9	-41.8	176.8	-173.5	-178.5	178.4	-177.2	0	112.1	V352 C353 L359 E360	V352-K356 WeakPolarHBondContact O-CB 3.43Å; V352-K356 PolarHBondContact O-N 3.25Å; C353-K356 WeakPolarHBondContact O-CB 3.48Å; C353-K356 PolarHBondContact O-N 3.36Å; C353-K356 VanDerWaalsContact O-N 3.08Å; K356-L359 PolarHBondContact O-N 3.37Å; K356-E360 PolarHBondContact O-N 3.32Å
357	E	96.1	Very high	95.6	Very high	123 Å²	123	87.6 Å²	87.6	58%	0.575	41%	0.405	S	S	*	.	H	α-helix	trans	-62.4	-42.3	175	-71.9	178	-176.2	0	0	112.1	C353 Y355 L359 E360 Q361	C353-E357 PolarHBondContact O-N 3.42Å; Y355-E357 PolarHBondContact O-N 3.01Å; E357-L359 VanDerWaalsContact C-N 3.32Å; E357-L359 PolarHBondContact O-N 3.07Å; E357-E360 PolarHBondContact O-N 3.01Å; E357-Q361 PolarHBondContact O-N 3.39Å
358	A	94.3	Very high	95.5	Very high	13 Å²	13	91.6 Å²	91.6	11%	0.107	41%	0.414	C	S	.	.	H	α-helix	trans	-63.7	-37.9	174.9	0	0	0	0	0	112.2	A328 R354 Y355 C362	A328-A358 HydrophobicContact CB-CB 3.98Å; R354-A358 PolarHBondContact O-N 3.47Å; Y355-A358 PolarHBondContact O-N 3.03Å; A358-C362 PolarHBondContact O-N 2.87Å; A358-C362 PolarHBondContact O-SG 3.38Å; A358-C362 VanDerWaalsContact O-SG 3.33Å
359	L	96.1	Very high	95.4	Very high	76 Å²	76	90.1 Å²	90.1	40%	0.398	41%	0.405	S	S	.	.	H	α-helix	trans	-67.9	-34.5	174.5	-75	178.6	0	0	0	112.9	Y355 K356 E357 Q361 C362 R363	Y355-L359 HydrophobicContact CD1-CD1 3.85Å; Y355-L359 HydrophobicContact CD1-CG 4.36Å; Y355-L359 HydrophobicContact CE1-CD1 3.44Å; Y355-L359 VanDerWaalsContact CE1-CD1 3.44Å; Y355-L359 HydrophobicContact CE1-CD2 4.47Å; Y355-L359 HydrophobicContact CE1-CG 4.02Å; Y355-L359 HydrophobicContact CE2-CD2 4.38Å; Y355-L359 HydrophobicContact CE2-CG 4.24Å; Y355-L359 WeakPolarHBondContact O-CG 3.45Å; Y355-L359 PolarHBondContact O-N 3Å; K356-L359 PolarHBondContact O-N 3.37Å; E357-L359 VanDerWaalsContact C-N 3.32Å; E357-L359 PolarHBondContact O-N 3.07Å; L359-Q361 VanDerWaalsContact C-N 3.33Å; L359-Q361 PolarHBondContact O-N 3.26Å; L359-C362 WeakPolarHBondContact O-CB 3.49Å; L359-C362 PolarHBondContact O-N 3.4Å; L359-C362 VanDerWaalsContact O-N 3.16Å; L359-R363 PolarHBondContact O-N 3.05Å
360	E	96.2	Very high	95.2	Very high	62 Å²	62	85.9 Å²	85.9	29%	0.29	39%	0.387	S	S	.	.	H	α-helix	trans	-63.3	-40.2	177.7	-173.3	55.7	-134.9	0	0	111.4	K356 E357 C362 R363 Q364	K356-E360 PolarHBondContact O-N 3.32Å; E357-E360 PolarHBondContact O-N 3.01Å; E360-C362 VanDerWaalsContact C-N 3.33Å; E360-C362 PolarHBondContact O-N 2.9Å; E360-R363 VanDerWaalsContact CD-NE 3.33Å; E360-R363 WeakPolarHBondContact O-CB 3.34Å; E360-R363 PolarHBondContact O-N 3.4Å; E360-R363 IonicContact OE1-CZ 3.32Å; E360-R363 IonicContact OE1-NE 2.77Å; E360-R363 PolarHBondContact OE1-NE 3.49Å; E360-R363 IonicContact OE1-NH2 2.67Å; E360-R363 PolarHBondContact OE1-NH2 2.97Å; E360-R363 IonicContact OE2-CZ 2.6Å; E360-R363 IonicContact OE2-NE 3.5Å; E360-R363 PolarHBondContact OE2-NE 2.86Å; E360-R363 VanDerWaalsContact OE2-NE 3.07Å; E360-R363 IonicContact OE2-NH1 3.7Å; E360-R363 IonicContact OE2-NH2 3.58Å; E360-R363 PolarHBondContact OE2-NH2 3.18Å; E360-Q364 WeakPolarHBondContact O-CG 3.32Å; E360-Q364 PolarHBondContact O-N 2.88Å; E360-Q364 VanDerWaalsContact O-N 3.07Å
361	Q	93.1	Very high	95.1	Very high	95 Å²	95	84.8 Å²	84.8	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-61.1	-42.8	172.3	-63.9	178.2	12.9	0	0	111.5	E357 L359 R363 Q364 L365	E357-Q361 PolarHBondContact O-N 3.39Å; L359-Q361 VanDerWaalsContact C-N 3.33Å; L359-Q361 PolarHBondContact O-N 3.26Å; Q361-R363 VanDerWaalsContact C-N 3.33Å; Q361-R363 PolarHBondContact O-N 2.94Å; Q361-Q364 PolarHBondContact O-N 3.45Å; Q361-L365 WeakPolarHBondContact O-CG 3.31Å; Q361-L365 PolarHBondContact O-N 2.87Å
362	C	94.4	Very high	94.8	Very high	6 Å²	6	85.4 Å²	85.4	4%	0.041	39%	0.388	C	S	.	.	H	α-helix	trans	-60.8	-44.6	175.1	-63.2	0	0	0	0	110.9	A358 L359 E360 Q364 L365 Y366	A358-C362 PolarHBondContact O-N 2.87Å; A358-C362 PolarHBondContact O-SG 3.38Å; A358-C362 VanDerWaalsContact O-SG 3.33Å; L359-C362 WeakPolarHBondContact O-CB 3.49Å; L359-C362 PolarHBondContact O-N 3.4Å; L359-C362 VanDerWaalsContact O-N 3.16Å; E360-C362 VanDerWaalsContact C-N 3.33Å; E360-C362 PolarHBondContact O-N 2.9Å; C362-Q364 VanDerWaalsContact C-N 3.35Å; C362-Q364 PolarHBondContact O-N 2.94Å; C362-L365 PolarHBondContact O-N 3.28Å; C362-Y366 HydrophobicContact CB-CD2 4.3Å; C362-Y366 HydrophobicContact CB-CE2 4.22Å; C362-Y366 WeakPolarHBondContact O-CD2 3.28Å; C362-Y366 PolarHBondContact O-N 3.06Å
363	R	96.1	Very high	94.6	Very high	157 Å²	157	87.4 Å²	87.4	59%	0.592	39%	0.386	S	S	*	.	H	α-helix	trans	-57.7	-45.2	-179.8	-173.8	176.6	77.2	157.8	2.7	112	L359 E360 Q361 L365 Y366 W367	L359-R363 PolarHBondContact O-N 3.05Å; E360-R363 VanDerWaalsContact CD-NE 3.33Å; E360-R363 WeakPolarHBondContact O-CB 3.34Å; E360-R363 PolarHBondContact O-N 3.4Å; E360-R363 IonicContact OE1-CZ 3.32Å; E360-R363 IonicContact OE1-NE 2.77Å; E360-R363 PolarHBondContact OE1-NE 3.49Å; E360-R363 IonicContact OE1-NH2 2.67Å; E360-R363 PolarHBondContact OE1-NH2 2.97Å; E360-R363 IonicContact OE2-CZ 2.6Å; E360-R363 IonicContact OE2-NE 3.5Å; E360-R363 PolarHBondContact OE2-NE 2.86Å; E360-R363 VanDerWaalsContact OE2-NE 3.07Å; E360-R363 IonicContact OE2-NH1 3.7Å; E360-R363 IonicContact OE2-NH2 3.58Å; E360-R363 PolarHBondContact OE2-NH2 3.18Å; Q361-R363 VanDerWaalsContact C-N 3.33Å; Q361-R363 PolarHBondContact O-N 2.94Å; R363-L365 VanDerWaalsContact C-N 3.33Å; R363-L365 PolarHBondContact O-N 3.33Å; R363-Y366 PolarHBondContact O-N 2.93Å; R363-W367 WeakPolarHBondContact O-CB 3.33Å; R363-W367 PolarHBondContact O-N 3.43Å
364	Q	94.9	Very high	94.5	Very high	124 Å²	124	87.1 Å²	87.1	58%	0.579	39%	0.388	S	S	*	.	H	α-helix	trans	-61.4	-41.3	178.6	-69.1	175.9	8.4	0	0	112.1	E360 Q361 C362 W367 R368	E360-Q364 WeakPolarHBondContact O-CG 3.32Å; E360-Q364 PolarHBondContact O-N 2.88Å; E360-Q364 VanDerWaalsContact O-N 3.07Å; Q361-Q364 PolarHBondContact O-N 3.45Å; C362-Q364 VanDerWaalsContact C-N 3.35Å; C362-Q364 PolarHBondContact O-N 2.94Å; Q364-W367 PolarHBondContact O-N 3.44Å; Q364-R368 PolarHBondContact O-N 3.25Å
365	L	93.8	Very high	94.3	Very high	27 Å²	27	88.8 Å²	88.8	14%	0.141	40%	0.402	C	S	.	.	H	α-helix	trans	-69.1	-41.7	177	-65.7	172.1	0	0	0	112.2	E320 I321 A324 Q361 C362 R363 W367 R368 R369	E320-L365 HydrophobicContact CB-CD1 4.18Å; E320-L365 HydrophobicContact CB-CD2 4.15Å; E320-L365 WeakPolarHBondContact OE2-CD2 3.41Å; I321-L365 HydrophobicContact CG1-CB 3.68Å; I321-L365 HydrophobicContact CG1-CD1 4.46Å; A324-L365 HydrophobicContact CB-CD1 3.67Å; Q361-L365 WeakPolarHBondContact O-CG 3.31Å; Q361-L365 PolarHBondContact O-N 2.87Å; C362-L365 PolarHBondContact O-N 3.28Å; R363-L365 VanDerWaalsContact C-N 3.33Å; R363-L365 PolarHBondContact O-N 3.33Å; L365-W367 VanDerWaalsContact C-N 3.34Å; L365-W367 PolarHBondContact O-N 3.32Å; L365-R368 PolarHBondContact O-N 2.99Å; L365-R369 WeakPolarHBondContact O-CB 3.38Å; L365-R369 PolarHBondContact O-N 3.09Å
366	Y	94.4	Very high	94	Very high	86 Å²	86	85.8 Å²	85.8	34%	0.337	39%	0.39	S	S	.	.	H	α-helix	trans	-59.5	-45.7	173.5	-81.6	-61.4	0	0	0	111.6	I321 C362 R363 R368 R369 D370	I321-Y366 HydrophobicContact CD1-CD1 4.17Å; I321-Y366 HydrophobicContact CD1-CE1 4.31Å; I321-Y366 HydrophobicContact CG2-CE1 3.97Å; I321-Y366 HydrophobicContact CG2-CE2 4.37Å; C362-Y366 HydrophobicContact CB-CD2 4.3Å; C362-Y366 HydrophobicContact CB-CE2 4.22Å; C362-Y366 WeakPolarHBondContact O-CD2 3.28Å; C362-Y366 PolarHBondContact O-N 3.06Å; R363-Y366 PolarHBondContact O-N 2.93Å; Y366-R368 PolarHBondContact O-N 3.31Å; Y366-R369 WeakPolarHBondContact O-CB 3.36Å; Y366-R369 PolarHBondContact O-N 3.2Å; Y366-D370 WeakPolarHBondContact O-CB 3.3Å; Y366-D370 VanDerWaalsContact O-CG 3.22Å; Y366-D370 PolarHBondContact O-N 3.49Å
367	W	95.4	Very high	93.6	Very high	182 Å²	182	81.8 Å²	81.8	69%	0.689	38%	0.375	S	S	*	.	H	α-helix	trans	-59.5	-45.9	177.1	-178	-105.7	0	0	0	112	R363 Q364 L365 R369 D370 L371	R363-W367 WeakPolarHBondContact O-CB 3.33Å; R363-W367 PolarHBondContact O-N 3.43Å; Q364-W367 PolarHBondContact O-N 3.44Å; L365-W367 VanDerWaalsContact C-N 3.34Å; L365-W367 PolarHBondContact O-N 3.32Å; W367-R369 PolarHBondContact O-N 3.15Å; W367-D370 PolarHBondContact O-N 3.41Å; W367-L371 WeakPolarHBondContact O-CB 3.46Å; W367-L371 PolarHBondContact O-N 3.36Å
368	R	92.9	Very high	93.4	Very high	112 Å²	112	80.9 Å²	80.9	42%	0.423	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-47.6	176.2	-172.7	-178.9	-174	-178.2	7.6	111.8	E320 Q364 L365 Y366 D370 L371 E372	E320-R368 IonicContact OE2-NH1 2.62Å; Q364-R368 PolarHBondContact O-N 3.25Å; L365-R368 PolarHBondContact O-N 2.99Å; Y366-R368 PolarHBondContact O-N 3.31Å; R368-D370 VanDerWaalsContact C-N 3.33Å; R368-D370 PolarHBondContact O-N 3.31Å; R368-L371 PolarHBondContact O-N 3.16Å; R368-E372 IonicContact NE-OE1 3.1Å; R368-E372 PolarHBondContact NE-OE1 3.24Å; R368-E372 WeakPolarHBondContact O-CB 3.39Å; R368-E372 VanDerWaalsContact O-CG 3.31Å; R368-E372 WeakPolarHBondContact O-CG 3.31Å; R368-E372 PolarHBondContact O-N 2.89Å
369	R	94.1	Very high	93.1	Very high	55 Å²	55	84 Å²	84	21%	0.208	39%	0.391	C	S	.	.	H	α-helix	trans	-57.6	-46.2	176.2	-177.5	-158.5	70	-175.4	-5.1	111.5	V317 I321 L365 Y366 W367 E372 R373	V317-R369 HydrophobicContact CG1-CB 3.85Å; V317-R369 HydrophobicContact CG1-CG 4.43Å; I321-R369 HydrophobicContact CD1-CB 4.08Å; I321-R369 HydrophobicContact CD1-CG 4.36Å; L365-R369 WeakPolarHBondContact O-CB 3.38Å; L365-R369 PolarHBondContact O-N 3.09Å; Y366-R369 WeakPolarHBondContact O-CB 3.36Å; Y366-R369 PolarHBondContact O-N 3.2Å; W367-R369 PolarHBondContact O-N 3.15Å; R369-E372 PolarHBondContact O-N 2.95Å; R369-R373 VanDerWaalsContact O-CB 3.28Å; R369-R373 WeakPolarHBondContact O-CB 3.33Å; R369-R373 PolarHBondContact O-N 3.03Å
370	D	93.4	Very high	92.7	Very high	64 Å²	64	84.8 Å²	84.8	34%	0.342	39%	0.389	S	S	.	.	H	α-helix	trans	-71.9	-36.6	-174.6	-69.4	-16.6	0	0	0	111.6	Y366 W367 R368 R373 A374	Y366-D370 WeakPolarHBondContact O-CB 3.3Å; Y366-D370 VanDerWaalsContact O-CG 3.22Å; Y366-D370 PolarHBondContact O-N 3.49Å; W367-D370 PolarHBondContact O-N 3.41Å; R368-D370 VanDerWaalsContact C-N 3.33Å; R368-D370 PolarHBondContact O-N 3.31Å; D370-R373 PolarHBondContact O-N 3.38Å; D370-A374 VanDerWaalsContact O-CB 3.27Å; D370-A374 WeakPolarHBondContact O-CB 3.43Å; D370-A374 PolarHBondContact O-N 3.01Å
371	L	93.8	Very high	92.4	Very high	103 Å²	103	89.9 Å²	89.9	54%	0.539	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-48.8	171.7	-176.1	67.4	0	0	0	111.7	W367 R368 R373 A374 L375	W367-L371 WeakPolarHBondContact O-CB 3.46Å; W367-L371 PolarHBondContact O-N 3.36Å; R368-L371 PolarHBondContact O-N 3.16Å; L371-R373 VanDerWaalsContact C-N 3.29Å; L371-R373 PolarHBondContact O-N 2.9Å; L371-A374 PolarHBondContact O-N 3.01Å; L371-L375 WeakPolarHBondContact O-CB 3.34Å; L371-L375 PolarHBondContact O-N 3.47Å
372	E	90.3	Very high	92.2	Very high	48 Å²	48	90 Å²	90	22%	0.224	41%	0.412	C	S	.	.	H	α-helix	trans	-59.7	-40.8	177	-73.6	178.3	-172.8	0	0	111.2	R313 R368 R369 Y376	R313-E372 WeakPolarHBondContact CG-OE2 3.19Å; R313-E372 IonicContact CZ-OE1 2.85Å; R313-E372 IonicContact NE-OE1 2.58Å; R313-E372 IonicContact NE-OE2 3.77Å; R313-E372 IonicContact NH2-OE1 3.39Å; R313-E372 PolarHBondContact NH2-OE1 2.83Å; R313-E372 IonicContact NH2-OE2 3.96Å; R368-E372 IonicContact NE-OE1 3.1Å; R368-E372 PolarHBondContact NE-OE1 3.24Å; R368-E372 WeakPolarHBondContact O-CB 3.39Å; R368-E372 VanDerWaalsContact O-CG 3.31Å; R368-E372 WeakPolarHBondContact O-CG 3.31Å; R368-E372 PolarHBondContact O-N 2.89Å; R369-E372 PolarHBondContact O-N 2.95Å; E372-Y376 WeakPolarHBondContact O-CB 3.3Å; E372-Y376 PolarHBondContact O-N 2.84Å
373	R	91.8	Very high	91.8	Very high	130 Å²	130	91.6 Å²	91.6	49%	0.491	42%	0.42	S	S	.	.	H	α-helix	trans	-65.1	-45.9	174.3	-178.1	177.7	-178.8	-168.3	1.4	112.3	Y310 R369 D370 L371 L375 Y376 L377	Y310-R373 HydrophobicContact CE2-CB 4.35Å; Y310-R373 WeakPolarHBondContact OH-CB 3.06Å; Y310-R373 WeakPolarHBondContact OH-CG 3.01Å; R369-R373 VanDerWaalsContact O-CB 3.28Å; R369-R373 WeakPolarHBondContact O-CB 3.33Å; R369-R373 PolarHBondContact O-N 3.03Å; D370-R373 PolarHBondContact O-N 3.38Å; L371-R373 VanDerWaalsContact C-N 3.29Å; L371-R373 PolarHBondContact O-N 2.9Å; R373-L375 VanDerWaalsContact C-N 3.33Å; R373-L375 PolarHBondContact O-N 3.32Å; R373-Y376 PolarHBondContact O-N 3.37Å; R373-L377 HydrophobicContact CG-CD1 3.98Å; R373-L377 HydrophobicContact CG-CG 4.32Å; R373-L377 WeakPolarHBondContact O-CB 3.24Å; R373-L377 VanDerWaalsContact O-CG 3.28Å; R373-L377 WeakPolarHBondContact O-CG 3.29Å; R373-L377 PolarHBondContact O-N 3.45Å
374	A	93.6	Very high	91.4	Very high	54 Å²	54	87.2 Å²	87.2	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-61.2	-44.2	-179.9	0	0	0	0	0	111	D370 L371 L377 L378	D370-A374 VanDerWaalsContact O-CB 3.27Å; D370-A374 WeakPolarHBondContact O-CB 3.43Å; D370-A374 PolarHBondContact O-N 3.01Å; L371-A374 PolarHBondContact O-N 3.01Å; A374-L377 PolarHBondContact O-N 3.47Å; A374-L378 WeakPolarHBondContact O-CB 3.5Å; A374-L378 PolarHBondContact O-N 3.17Å
375	L	92.1	Very high	91.1	Very high	109 Å²	109	85.1 Å²	85.1	57%	0.571	40%	0.399	S	S	*	.	H	α-helix	trans	-62.1	-46.4	175.8	-177.6	62.7	0	0	0	111.8	L371 R373 L377 L378 V379	L371-L375 WeakPolarHBondContact O-CB 3.34Å; L371-L375 PolarHBondContact O-N 3.47Å; R373-L375 VanDerWaalsContact C-N 3.33Å; R373-L375 PolarHBondContact O-N 3.32Å; L375-L377 PolarHBondContact O-N 3.34Å; L375-L378 PolarHBondContact O-N 3.32Å; L375-V379 HydrophobicContact CD1-CG2 4.47Å; L375-V379 WeakPolarHBondContact O-CG2 3.35Å; L375-V379 PolarHBondContact O-N 3.23Å
376	Y	89.7	Confident	90.8	Very high	29 Å²	29	85.8 Å²	85.8	11%	0.114	41%	0.412	C	S	.	.	H	α-helix	trans	-59.7	-46	175.8	167.6	-103.5	0	0	0	112.2	Y310 E372 R373 L378 V379 R380	Y310-Y376 AromaticContact CD1-CD1 3.83Å; Y310-Y376 HydrophobicContact CD1-CD1 3.83Å; Y310-Y376 HydrophobicContact CD1-CD2 4.34Å; Y310-Y376 AromaticContact CD1-CE1 3.87Å; Y310-Y376 HydrophobicContact CD1-CE1 3.87Å; Y310-Y376 HydrophobicContact CD1-CE2 4.37Å; Y310-Y376 HydrophobicContact CD1-CG 4.07Å; Y310-Y376 HydrophobicContact CD2-CD1 4.03Å; Y310-Y376 HydrophobicContact CD2-CD2 4.1Å; Y310-Y376 AromaticContact CD2-CG 3.62Å; Y310-Y376 HydrophobicContact CD2-CG 3.62Å; Y310-Y376 AromaticContact CE1-CD1 3.98Å; Y310-Y376 HydrophobicContact CE1-CD1 3.98Å; Y310-Y376 HydrophobicContact CE1-CE1 4.18Å; Y310-Y376 HydrophobicContact CE2-CD1 4.19Å; Y310-Y376 HydrophobicContact CE2-CG 4.13Å; Y310-Y376 AromaticContact CG-CD1 3.84Å; Y310-Y376 HydrophobicContact CG-CD1 3.84Å; Y310-Y376 AromaticContact CG-CD2 3.73Å; Y310-Y376 HydrophobicContact CG-CD2 3.73Å; Y310-Y376 HydrophobicContact CG-CE1 4.21Å; Y310-Y376 HydrophobicContact CG-CE2 4.09Å; Y310-Y376 AromaticContact CG-CG 3.58Å; Y310-Y376 HydrophobicContact CG-CG 3.58Å; E372-Y376 WeakPolarHBondContact O-CB 3.3Å; E372-Y376 PolarHBondContact O-N 2.84Å; R373-Y376 PolarHBondContact O-N 3.37Å; Y376-L378 VanDerWaalsContact C-N 3.3Å; Y376-L378 PolarHBondContact O-N 2.92Å; Y376-V379 PolarHBondContact O-N 3.42Å; Y376-R380 VanDerWaalsContact O-CB 3.25Å; Y376-R380 WeakPolarHBondContact O-CB 3.19Å; Y376-R380 PolarHBondContact O-N 2.79Å
377	L	89.8	Confident	90.4	Very high	63 Å²	63	82.8 Å²	82.8	33%	0.33	40%	0.403	S	S	.	.	H	α-helix	trans	-61.4	-39.2	178.3	-74	174.3	0	0	0	111.9	R373 A374 L375 R381	R373-L377 HydrophobicContact CG-CD1 3.98Å; R373-L377 HydrophobicContact CG-CG 4.32Å; R373-L377 WeakPolarHBondContact O-CB 3.24Å; R373-L377 VanDerWaalsContact O-CG 3.28Å; R373-L377 WeakPolarHBondContact O-CG 3.29Å; R373-L377 PolarHBondContact O-N 3.45Å; A374-L377 PolarHBondContact O-N 3.47Å; L375-L377 PolarHBondContact O-N 3.34Å; L377-R381 VanDerWaalsContact O-CB 3.25Å; L377-R381 WeakPolarHBondContact O-CB 3.2Å; L377-R381 PolarHBondContact O-N 3.39Å
378	L	92.1	Very high	90	Very high	104 Å²	104	77.9 Å²	77.9	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-63.8	-52.8	175.5	-179.9	66	0	0	0	111.1	A374 L375 Y376 R380 R381 V382	A374-L378 WeakPolarHBondContact O-CB 3.5Å; A374-L378 PolarHBondContact O-N 3.17Å; L375-L378 PolarHBondContact O-N 3.32Å; Y376-L378 VanDerWaalsContact C-N 3.3Å; Y376-L378 PolarHBondContact O-N 2.92Å; L378-R380 VanDerWaalsContact C-N 3.33Å; L378-R380 PolarHBondContact O-N 3.2Å; L378-R381 PolarHBondContact O-N 3.25Å; L378-R381 VanDerWaalsContact O-N 3.16Å; L378-V382 HydrophobicContact CD1-CG2 4.4Å; L378-V382 WeakPolarHBondContact O-CG2 3.26Å; L378-V382 PolarHBondContact O-N 3.2Å
379	V	88.3	Confident	89.8	Confident	77 Å²	77	78.7 Å²	78.7	47%	0.467	40%	0.398	S	S	.	.	H	α-helix	trans	-58.7	-45.5	179.4	171.3	0	0	0	0	110.9	L375 Y376 R381 V382 L383	L375-V379 HydrophobicContact CD1-CG2 4.47Å; L375-V379 WeakPolarHBondContact O-CG2 3.35Å; L375-V379 PolarHBondContact O-N 3.23Å; Y376-V379 PolarHBondContact O-N 3.42Å; V379-R381 VanDerWaalsContact C-N 3.34Å; V379-R381 PolarHBondContact O-N 3.28Å; V379-V382 PolarHBondContact O-N 3.24Å; V379-L383 WeakPolarHBondContact O-CB 3.48Å; V379-L383 PolarHBondContact O-N 2.62Å
380	R	87.1	Confident	89.5	Confident	94 Å²	94	80 Å²	80	36%	0.355	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-42.9	177	-174.4	178.3	70.5	153.9	5	111.8	Y376 L378 H384	Y376-R380 VanDerWaalsContact O-CB 3.25Å; Y376-R380 WeakPolarHBondContact O-CB 3.19Å; Y376-R380 PolarHBondContact O-N 2.79Å; L378-R380 VanDerWaalsContact C-N 3.33Å; L378-R380 PolarHBondContact O-N 3.2Å; R380-H384 VanDerWaalsContact O-CB 3.31Å; R380-H384 WeakPolarHBondContact O-CB 3.44Å; R380-H384 PolarHBondContact O-N 3.2Å
381	R	88.9	Confident	89.2	Confident	169 Å²	169	77 Å²	77	64%	0.638	39%	0.392	S	S	*	.	H	α-helix	trans	-64.8	-47.5	178.3	-178.5	178.5	-63.4	-82.9	2.7	111.4	L377 L378 V379 L383 H384 L385	L377-R381 VanDerWaalsContact O-CB 3.25Å; L377-R381 WeakPolarHBondContact O-CB 3.2Å; L377-R381 PolarHBondContact O-N 3.39Å; L378-R381 PolarHBondContact O-N 3.25Å; L378-R381 VanDerWaalsContact O-N 3.16Å; V379-R381 VanDerWaalsContact C-N 3.34Å; V379-R381 PolarHBondContact O-N 3.28Å; R381-L383 PolarHBondContact O-N 3.47Å; R381-H384 PolarHBondContact O-N 3.4Å; R381-L385 HydrophobicContact CG-CD1 3.84Å; R381-L385 VanDerWaalsContact O-CD1 3.24Å; R381-L385 WeakPolarHBondContact O-CD1 3.34Å; R381-L385 PolarHBondContact O-N 2.77Å
382	V	89.8	Confident	88.9	Confident	96 Å²	96	75.9 Å²	75.9	58%	0.582	39%	0.387	S	S	*	.	H	α-helix	trans	-60.8	-45.7	179	171.7	0	0	0	0	111	L378 V379 H384 L385 G386	L378-V382 HydrophobicContact CD1-CG2 4.4Å; L378-V382 WeakPolarHBondContact O-CG2 3.26Å; L378-V382 PolarHBondContact O-N 3.2Å; V379-V382 PolarHBondContact O-N 3.24Å; V382-H384 PolarHBondContact O-N 3Å; V382-L385 PolarHBondContact O-N 3.27Å; V382-G386 PolarHBondContact O-N 2.96Å
383	L	86.6	Confident	88.8	Confident	40 Å²	40	76.8 Å²	76.8	21%	0.209	40%	0.398	C	S	.	.	H	α-helix	trans	-60.2	-46	176.1	179.6	80.5	0	0	0	111.8	F302 T303 V379 R381 G386 V387	F302-L383 HydrophobicContact CD1-CD1 3.58Å; F302-L383 HydrophobicContact CD1-CD2 3.19Å; F302-L383 HydrophobicContact CD1-CG 3.97Å; F302-L383 HydrophobicContact CE1-CD1 3.39Å; F302-L383 HydrophobicContact CE1-CD2 3.45Å; F302-L383 VanDerWaalsContact CE1-CD2 3.45Å; F302-L383 HydrophobicContact CE1-CG 3.94Å; F302-L383 HydrophobicContact CG-CD1 4.33Å; F302-L383 HydrophobicContact CG-CD2 4.32Å; F302-L383 HydrophobicContact CZ-CD1 4.03Å; T303-L383 HydrophobicContact CG2-CD2 3.75Å; V379-L383 WeakPolarHBondContact O-CB 3.48Å; V379-L383 PolarHBondContact O-N 2.62Å; R381-L383 PolarHBondContact O-N 3.47Å; L383-G386 PolarHBondContact O-N 3.24Å; L383-V387 PolarHBondContact O-N 3.25Å
384	H	85.9	Confident	88.6	Confident	65 Å²	65	72.4 Å²	72.4	30%	0.301	39%	0.387	S	S	.	.	H	α-helix	trans	-61.1	-47.9	179.4	-179.7	69.8	0	0	0	111.6	R380 R381 V382 G386 V387 Q388	R380-H384 VanDerWaalsContact O-CB 3.31Å; R380-H384 WeakPolarHBondContact O-CB 3.44Å; R380-H384 PolarHBondContact O-N 3.2Å; R381-H384 PolarHBondContact O-N 3.4Å; V382-H384 PolarHBondContact O-N 3Å; H384-G386 VanDerWaalsContact C-N 3.33Å; H384-G386 PolarHBondContact O-N 2.97Å; H384-V387 PolarHBondContact O-N 2.84Å; H384-Q388 WeakPolarHBondContact O-CB 3.14Å; H384-Q388 PolarHBondContact O-N 3.27Å
385	L	89	Confident	88.3	Confident	80 Å²	80	69.9 Å²	69.9	42%	0.419	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-41.3	175.1	-93.4	74.7	0	0	0	111.7	R381 V382 V387 Q388 M389	R381-L385 HydrophobicContact CG-CD1 3.84Å; R381-L385 VanDerWaalsContact O-CD1 3.24Å; R381-L385 WeakPolarHBondContact O-CD1 3.34Å; R381-L385 PolarHBondContact O-N 2.77Å; V382-L385 PolarHBondContact O-N 3.27Å; L385-V387 VanDerWaalsContact C-N 3.34Å; L385-V387 PolarHBondContact O-N 2.66Å; L385-Q388 PolarHBondContact O-N 3.07Å; L385-M389 WeakPolarHBondContact O-CB 2.96Å; L385-M389 VanDerWaalsContact O-CG 3.29Å; L385-M389 WeakPolarHBondContact O-CG 3.19Å; L385-M389 PolarHBondContact O-N 2.96Å
386	G	88.6	Confident	88.1	Confident	42 Å²	42	69 Å²	69	43%	0.433	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-43.5	177.7	0	0	0	0	0	112.4	V382 L383 H384 M389 L390	V382-G386 PolarHBondContact O-N 2.96Å; L383-G386 PolarHBondContact O-N 3.24Å; H384-G386 VanDerWaalsContact C-N 3.33Å; H384-G386 PolarHBondContact O-N 2.97Å; G386-M389 PolarHBondContact O-N 2.97Å; G386-L390 WeakPolarHBondContact O-CB 3.45Å; G386-L390 PolarHBondContact O-N 2.77Å
387	V	86.1	Confident	88	Confident	22 Å²	22	73.2 Å²	73.2	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-69.7	-39	175.8	173.1	0	0	0	0	111.9	H299 L383 H384 L385 M389 L390 M391	H299-V387 HydrophobicContact CB-CG1 4.05Å; H299-V387 HydrophobicContact CB-CG2 4.18Å; H299-V387 VanDerWaalsContact ND1-CG2 3.32Å; H299-V387 WeakPolarHBondContact ND1-CG2 2.98Å; L383-V387 PolarHBondContact O-N 3.25Å; H384-V387 PolarHBondContact O-N 2.84Å; L385-V387 VanDerWaalsContact C-N 3.34Å; L385-V387 PolarHBondContact O-N 2.66Å; V387-M389 VanDerWaalsContact C-N 3.33Å; V387-M389 PolarHBondContact O-N 3Å; V387-L390 PolarHBondContact O-N 3.45Å; V387-M391 WeakPolarHBondContact O-CB 3.26Å; V387-M391 PolarHBondContact O-N 3.07Å
388	Q	86.9	Confident	87.8	Confident	80 Å²	80	70.9 Å²	70.9	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-42.8	175.4	-170.3	178.6	8.8	0	0	111.7	H384 L385 M391 L392	H384-Q388 WeakPolarHBondContact O-CB 3.14Å; H384-Q388 PolarHBondContact O-N 3.27Å; L385-Q388 PolarHBondContact O-N 3.07Å; Q388-M391 PolarHBondContact O-N 3.42Å; Q388-L392 WeakPolarHBondContact O-CB 3.5Å; Q388-L392 PolarHBondContact O-N 3.49Å
389	M	89.3	Confident	87.6	Confident	128 Å²	128	68.8 Å²	68.8	63%	0.631	36%	0.358	S	S	*	.	H	α-helix	trans	-64.5	-43.1	176	-71.2	-66	178.7	0	0	112.1	L385 G386 V387 M391 L392 S393	L385-M389 WeakPolarHBondContact O-CB 2.96Å; L385-M389 VanDerWaalsContact O-CG 3.29Å; L385-M389 WeakPolarHBondContact O-CG 3.19Å; L385-M389 PolarHBondContact O-N 2.96Å; G386-M389 PolarHBondContact O-N 2.97Å; V387-M389 VanDerWaalsContact C-N 3.33Å; V387-M389 PolarHBondContact O-N 3Å; M389-M391 VanDerWaalsContact C-N 3.29Å; M389-M391 PolarHBondContact O-N 3.03Å; M389-L392 PolarHBondContact O-N 2.9Å; M389-S393 PolarHBondContact O-N 3.34Å; M389-S393 PolarHBondContact O-OG 3.02Å
390	L	86.6	Confident	87.5	Confident	83 Å²	83	72 Å²	72	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-63.7	-37	175.3	-177.3	61.8	0	0	0	111.8	L295 G386 V387 S393 C394	L295-L390 HydrophobicContact CD1-CD2 3.8Å; L295-L390 HydrophobicContact CD1-CG 4.45Å; L295-L390 HydrophobicContact CD2-CD2 4.24Å; L295-L390 HydrophobicContact CD2-CG 4.01Å; G386-L390 WeakPolarHBondContact O-CB 3.45Å; G386-L390 PolarHBondContact O-N 2.77Å; V387-L390 PolarHBondContact O-N 3.45Å; L390-S393 PolarHBondContact O-OG 3.46Å; L390-C394 WeakPolarHBondContact O-CB 3.42Å; L390-C394 PolarHBondContact O-N 3.27Å; L390-C394 PolarHBondContact O-SG 2.86Å
391	M	86.7	Confident	87.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-71.5	-37.9	178.6	-156.9	171.5	93.7	0	0	112	L292 L295 V387 Q388 M389 G395 F412 M413 Q416	L292-M391 HydrophobicContact CD2-CG 4.12Å; L295-M391 HydrophobicContact CD2-CB 4.38Å; L295-M391 HydrophobicContact CD2-CG 4.39Å; V387-M391 WeakPolarHBondContact O-CB 3.26Å; V387-M391 PolarHBondContact O-N 3.07Å; Q388-M391 PolarHBondContact O-N 3.42Å; M389-M391 VanDerWaalsContact C-N 3.29Å; M389-M391 PolarHBondContact O-N 3.03Å; M391-G395 PolarHBondContact O-N 3.29Å; M391-F412 HydrophobicContact CE-CD1 3.23Å; M391-F412 HydrophobicContact CE-CE1 3.47Å; M391-F412 VanDerWaalsContact CE-CE1 3.47Å; M391-F412 HydrophobicContact CE-CG 4.49Å; M391-F412 HydrophobicContact CG-CE1 4.47Å; M391-F412 HydrophobicContact SD-CD1 3.87Å; M391-F412 HydrophobicContact SD-CE1 3.43Å; M391-F412 WeakPolarHBondContact SD-CE1 3.48Å; M391-M413 HydrophobicContact CE-CG 3.93Å; M391-Q416 HydrophobicContact CE-CB 4.12Å; M391-Q416 HydrophobicContact CE-CG 4.29Å; M391-Q416 HydrophobicContact SD-CB 4.49Å; M391-Q416 VanDerWaalsContact SD-CD 3.56Å; M391-Q416 HydrophobicContact SD-CG 4.11Å; M391-Q416 PolarHBondContact SD-OE1 3.36Å
392	L	88.8	Confident	86.9	Confident	81 Å²	81	67.4 Å²	67.4	42%	0.424	38%	0.378	S	S	.	.	H	α-helix	trans	-64.8	-40.6	174.1	-179.2	59.8	0	0	0	111.5	Q388 M389 G395 L396 L409 M413	Q388-L392 WeakPolarHBondContact O-CB 3.5Å; Q388-L392 PolarHBondContact O-N 3.49Å; M389-L392 PolarHBondContact O-N 2.9Å; L392-G395 PolarHBondContact O-N 3.4Å; L392-L396 WeakPolarHBondContact O-CB 3.43Å; L392-L396 PolarHBondContact O-N 3.32Å; L392-L409 HydrophobicContact CD1-CD2 4.1Å; L392-M413 HydrophobicContact CB-CE 3.75Å; L392-M413 HydrophobicContact CD1-CE 3.53Å; L392-M413 HydrophobicContact CG-CE 4.14Å
393	S	87.4	Confident	86.5	Confident	66 Å²	66	67.9 Å²	67.9	46%	0.462	37%	0.374	S	S	.	.	H	α-helix	trans	-68.2	-43.7	177.7	65	0	0	0	0	112.5	M389 L390 G395 L396 Q397	M389-S393 PolarHBondContact O-N 3.34Å; M389-S393 PolarHBondContact O-OG 3.02Å; L390-S393 PolarHBondContact O-OG 3.46Å; S393-G395 VanDerWaalsContact C-N 3.32Å; S393-G395 PolarHBondContact O-N 3.41Å; S393-L396 PolarHBondContact O-N 3.1Å; S393-Q397 PolarHBondContact O-N 2.9Å; S393-Q397 VanDerWaalsContact O-N 3.15Å
394	C	87.1	Confident	86.5	Confident	39 Å²	39	66.7 Å²	66.7	26%	0.264	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-35.4	172.7	-71.4	0	0	0	0	112.5	L292 L390 Q397 Q398	L292-C394 HydrophobicContact CD2-CB 3.78Å; L390-C394 WeakPolarHBondContact O-CB 3.42Å; L390-C394 PolarHBondContact O-N 3.27Å; L390-C394 PolarHBondContact O-SG 2.86Å; C394-Q397 PolarHBondContact O-N 2.91Å; C394-Q398 PolarHBondContact O-N 3.09Å; C394-Q398 VanDerWaalsContact O-N 3.16Å
395	G	88.3	Confident	86.5	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-64.5	-43.8	174.8	0	0	0	0	0	111.9	M391 L392 S393 Q397 Q398 M399	M391-G395 PolarHBondContact O-N 3.29Å; L392-G395 PolarHBondContact O-N 3.4Å; S393-G395 VanDerWaalsContact C-N 3.32Å; S393-G395 PolarHBondContact O-N 3.41Å; G395-Q397 VanDerWaalsContact C-N 3.33Å; G395-Q397 PolarHBondContact O-N 3.31Å; G395-Q398 PolarHBondContact O-N 3.47Å; G395-M399 VanDerWaalsContact O-CG 3.32Å; G395-M399 WeakPolarHBondContact O-CG 3.24Å; G395-M399 PolarHBondContact O-N 3.04Å
396	L	87.6	Confident	86.4	Confident	92 Å²	92	68.6 Å²	68.6	48%	0.482	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-42.3	175.2	179.8	64.3	0	0	0	112	L392 S393 M399 Q400	L392-L396 WeakPolarHBondContact O-CB 3.43Å; L392-L396 PolarHBondContact O-N 3.32Å; S393-L396 PolarHBondContact O-N 3.1Å; L396-M399 WeakPolarHBondContact O-CB 3.43Å; L396-M399 PolarHBondContact O-N 2.87Å; L396-Q400 WeakPolarHBondContact O-CG 3.32Å; L396-Q400 PolarHBondContact O-N 3.33Å
397	Q	86.8	Confident	86.3	Confident	116 Å²	116	66.6 Å²	66.6	54%	0.542	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-45.3	175.9	-172.4	-179.1	-10.8	0	0	111.4	S393 C394 G395 M399 Q400 D401	S393-Q397 PolarHBondContact O-N 2.9Å; S393-Q397 VanDerWaalsContact O-N 3.15Å; C394-Q397 PolarHBondContact O-N 2.91Å; G395-Q397 VanDerWaalsContact C-N 3.33Å; G395-Q397 PolarHBondContact O-N 3.31Å; Q397-M399 VanDerWaalsContact C-N 3.31Å; Q397-M399 PolarHBondContact O-N 3.29Å; Q397-Q400 WeakPolarHBondContact O-CB 3.29Å; Q397-Q400 PolarHBondContact O-N 2.72Å; Q397-D401 PolarHBondContact O-N 3.45Å
398	Q	85.9	Confident	86.4	Confident	15 Å²	15	66.5 Å²	66.5	7%	0.07	36%	0.359	C	S	.	.	H	α-helix	trans	-66.6	-30.7	176.9	-73.6	169.7	40.4	0	0	113.2	C394 G395 D401 G402 E403 L404	C394-Q398 PolarHBondContact O-N 3.09Å; C394-Q398 VanDerWaalsContact O-N 3.16Å; G395-Q398 PolarHBondContact O-N 3.47Å; Q398-D401 PolarHBondContact O-N 3.43Å; Q398-G402 PolarHBondContact O-N 2.93Å; Q398-E403 HydrophobicContact CB-CB 4.47Å; Q398-E403 PolarHBondContact O-N 3.4Å; Q398-L404 HydrophobicContact CB-CB 4.05Å; Q398-L404 PolarHBondContact O-N 3.35Å
399	M	88.1	Confident	86.5	Confident	59 Å²	59	63.3 Å²	63.3	29%	0.291	35%	0.345	S	S	.	.	H	α-helix	trans	-67.7	-40.2	172.1	-70.2	175	67.1	0	0	111.7	G395 L396 Q397 D401 G402 L404 Q406 L409	G395-M399 VanDerWaalsContact O-CG 3.32Å; G395-M399 WeakPolarHBondContact O-CG 3.24Å; G395-M399 PolarHBondContact O-N 3.04Å; L396-M399 WeakPolarHBondContact O-CB 3.43Å; L396-M399 PolarHBondContact O-N 2.87Å; Q397-M399 VanDerWaalsContact C-N 3.31Å; Q397-M399 PolarHBondContact O-N 3.29Å; M399-D401 VanDerWaalsContact C-N 3.3Å; M399-D401 PolarHBondContact O-N 3.3Å; M399-G402 PolarHBondContact O-N 3.37Å; M399-G402 VanDerWaalsContact O-N 3.14Å; M399-L404 WeakPolarHBondContact CA-O 3.35Å; M399-L404 HydrophobicContact CG-CB 4.24Å; M399-L404 WeakPolarHBondContact CG-O 3.37Å; M399-Q406 HydrophobicContact CE-CB 3.8Å; M399-Q406 HydrophobicContact CE-CG 4.3Å; M399-L409 HydrophobicContact SD-CB 4.43Å; M399-L409 HydrophobicContact SD-CD2 3.56Å; M399-L409 VanDerWaalsContact SD-CD2 3.56Å
400	Q	85.6	Confident	86.5	Confident	146 Å²	146	60 Å²	60	68%	0.682	33%	0.33	S	S	*	.	H	α-helix	trans	-65.4	-35.1	175.9	-71.6	175.1	-11	0	0	112.1	L396 Q397 G402	L396-Q400 WeakPolarHBondContact O-CG 3.32Å; L396-Q400 PolarHBondContact O-N 3.33Å; Q397-Q400 WeakPolarHBondContact O-CB 3.29Å; Q397-Q400 PolarHBondContact O-N 2.72Å; Q400-G402 PolarHBondContact O-N 3.31Å
401	D	84.8	Confident	86.7	Confident	100 Å²	100	56.2 Å²	56.2	54%	0.535	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-4	175.4	-64.5	-27.8	0	0	0	113.1	Q397 Q398 M399 E403	Q397-D401 PolarHBondContact O-N 3.45Å; Q398-D401 PolarHBondContact O-N 3.43Å; M399-D401 VanDerWaalsContact C-N 3.3Å; M399-D401 PolarHBondContact O-N 3.3Å; D401-E403 HydrophobicContact CB-CG 4.25Å; D401-E403 PolarHBondContact O-N 3Å
402	G	80.3	Confident	86.9	Confident	66 Å²	66	56.2 Å²	56.2	68%	0.68	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	9	-179.2	0	0	0	0	0	114.8	Q398 M399 Q400	Q398-G402 PolarHBondContact O-N 2.93Å; M399-G402 PolarHBondContact O-N 3.37Å; M399-G402 VanDerWaalsContact O-N 3.14Å; Q400-G402 PolarHBondContact O-N 3.31Å
403	E	79.6	Confident	86.9	Confident	106 Å²	106	54.1 Å²	54.1	50%	0.495	30%	0.298	S	S	.	.	S	Bend	trans	-79.4	-20.2	-179.5	-64.9	-176.1	171.3	0	0	112.7	R291 Q398 D401	R291-E403 IonicContact CZ-OE1 2.83Å; R291-E403 IonicContact CZ-OE2 2.66Å; R291-E403 IonicContact NH1-OE1 2.64Å; R291-E403 PolarHBondContact NH1-OE1 3.11Å; R291-E403 IonicContact NH1-OE2 3.88Å; R291-E403 PolarHBondContact NH1-OE2 3.15Å; R291-E403 IonicContact NH2-OE1 3.73Å; Q398-E403 HydrophobicContact CB-CB 4.47Å; Q398-E403 PolarHBondContact O-N 3.4Å; D401-E403 HydrophobicContact CB-CG 4.25Å; D401-E403 PolarHBondContact O-N 3Å
404	L	86.9	Confident	87.1	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.073	29%	0.29	C	S	.	.			trans	-140	138.3	-171.5	-162.7	72.7	0	0	0	112.2	I288 L292 Q398 M399 S408 L409	I288-L404 HydrophobicContact CG2-CD1 3.67Å; L292-L404 HydrophobicContact CD1-CD2 3.93Å; Q398-L404 HydrophobicContact CB-CB 4.05Å; Q398-L404 PolarHBondContact O-N 3.35Å; M399-L404 WeakPolarHBondContact CA-O 3.35Å; M399-L404 HydrophobicContact CG-CB 4.24Å; M399-L404 WeakPolarHBondContact CG-O 3.37Å; L404-S408 WeakPolarHBondContact CD1-OG 3.47Å; L404-S408 WeakPolarHBondContact CG-OG 3.44Å; L404-L409 HydrophobicContact CD2-CB 3.93Å; L404-L409 HydrophobicContact CD2-CD1 4.01Å; L404-L409 HydrophobicContact CD2-CG 4.48Å
405	T	87.2	Confident	87.3	Confident	67 Å²	67	51.8 Å²	51.8	41%	0.411	28%	0.277	S	S	.	.			trans	-89	161.6	174.1	68.6	0	0	0	0	112.3	D178 G407 S408 L409	D178-T405 VanDerWaalsContact CG-OG1 3.3Å; D178-T405 VanDerWaalsContact OD1-CB 3.23Å; D178-T405 WeakPolarHBondContact OD1-CB 3.36Å; D178-T405 PolarHBondContact OD1-OG1 3.13Å; D178-T405 WeakPolarHBondContact OD2-CB 3.36Å; D178-T405 PolarHBondContact OD2-OG1 3.19Å; T405-G407 VanDerWaalsContact C-N 3.31Å; T405-G407 PolarHBondContact O-N 3.44Å; T405-S408 PolarHBondContact N-OG 3.46Å; T405-S408 PolarHBondContact O-N 3.23Å; T405-S408 PolarHBondContact O-OG 3.33Å; T405-S408 VanDerWaalsContact OG1-CB 3.29Å; T405-S408 WeakPolarHBondContact OG1-CB 3.39Å; T405-S408 PolarHBondContact OG1-N 3.43Å; T405-S408 VanDerWaalsContact OG1-N 3.1Å; T405-S408 PolarHBondContact OG1-OG 2.64Å; T405-L409 PolarHBondContact O-N 3.18Å; T405-L409 VanDerWaalsContact O-N 3.1Å
406	Q	86.1	Confident	87.3	Confident	118 Å²	118	52.4 Å²	52.4	55%	0.551	28%	0.28	S	S	*	.	H	α-helix	trans	-61.4	-40.3	177.7	-175.3	177.2	-10.4	0	0	112.3	I177 D178 M399 L409 L410	I177-Q406 HydrophobicContact CG2-CG 4.2Å; D178-Q406 PolarHBondContact OD1-N 3.13Å; M399-Q406 HydrophobicContact CE-CB 3.8Å; M399-Q406 HydrophobicContact CE-CG 4.3Å; Q406-L409 PolarHBondContact O-N 2.9Å; Q406-L410 PolarHBondContact O-N 3.36Å
407	G	86.6	Confident	87.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68	-42	177.2	0	0	0	0	0	112.9	G174 D178 T405 L409 L410 S411	G174-G407 WeakPolarHBondContact CA-O 3.3Å; G174-G407 WeakPolarHBondContact O-CA 3.33Å; D178-G407 VanDerWaalsContact OD1-CA 3.25Å; D178-G407 WeakPolarHBondContact OD1-CA 3.27Å; D178-G407 PolarHBondContact OD1-N 3.19Å; T405-G407 VanDerWaalsContact C-N 3.31Å; T405-G407 PolarHBondContact O-N 3.44Å; G407-L409 VanDerWaalsContact C-N 3.32Å; G407-L409 PolarHBondContact O-N 3.14Å; G407-L410 PolarHBondContact O-N 3.39Å; G407-S411 PolarHBondContact O-N 3.43Å; G407-S411 PolarHBondContact O-OG 3.18Å
408	S	88	Confident	87.4	Confident	21 Å²	21	50.9 Å²	50.9	15%	0.147	28%	0.275	C	S	.	.	H	α-helix	trans	-65.4	-33.8	176	63.3	0	0	0	0	112.8	L404 T405 S411 F412	L404-S408 WeakPolarHBondContact CD1-OG 3.47Å; L404-S408 WeakPolarHBondContact CG-OG 3.44Å; T405-S408 PolarHBondContact N-OG 3.46Å; T405-S408 PolarHBondContact O-N 3.23Å; T405-S408 PolarHBondContact O-OG 3.33Å; T405-S408 VanDerWaalsContact OG1-CB 3.29Å; T405-S408 WeakPolarHBondContact OG1-CB 3.39Å; T405-S408 PolarHBondContact OG1-N 3.43Å; T405-S408 VanDerWaalsContact OG1-N 3.1Å; T405-S408 PolarHBondContact OG1-OG 2.64Å; S408-S411 PolarHBondContact O-N 3.02Å; S408-F412 VanDerWaalsContact O-CB 3.29Å; S408-F412 WeakPolarHBondContact O-CB 3.33Å; S408-F412 PolarHBondContact O-N 3.3Å
409	L	89.4	Confident	87.5	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-43.1	170.4	-177.8	60.4	0	0	0	111.8	L292 L392 M399 L404 T405 Q406 G407 F412 M413	L292-L409 HydrophobicContact CD1-CD1 4.18Å; L392-L409 HydrophobicContact CD1-CD2 4.1Å; M399-L409 HydrophobicContact SD-CB 4.43Å; M399-L409 HydrophobicContact SD-CD2 3.56Å; M399-L409 VanDerWaalsContact SD-CD2 3.56Å; L404-L409 HydrophobicContact CD2-CB 3.93Å; L404-L409 HydrophobicContact CD2-CD1 4.01Å; L404-L409 HydrophobicContact CD2-CG 4.48Å; T405-L409 PolarHBondContact O-N 3.18Å; T405-L409 VanDerWaalsContact O-N 3.1Å; Q406-L409 PolarHBondContact O-N 2.9Å; G407-L409 VanDerWaalsContact C-N 3.32Å; G407-L409 PolarHBondContact O-N 3.14Å; L409-F412 PolarHBondContact O-N 2.92Å; L409-M413 HydrophobicContact CD1-CE 4.3Å; L409-M413 HydrophobicContact CG-CE 4.33Å; L409-M413 WeakPolarHBondContact O-CG 3.26Å; L409-M413 PolarHBondContact O-N 3.14Å
410	L	89.8	Confident	87.3	Confident	60 Å²	60	48.2 Å²	48.2	31%	0.314	27%	0.266	S	S	.	.	H	α-helix	trans	-61.7	-49.6	174.4	178.1	67.6	0	0	0	111.3	I177 Q406 G407 F412 M413 I414	I177-L410 HydrophobicContact CD1-CB 4.47Å; I177-L410 HydrophobicContact CD1-CD2 3.13Å; I177-L410 HydrophobicContact CD1-CG 4.33Å; I177-L410 HydrophobicContact CG1-CD2 4.18Å; Q406-L410 PolarHBondContact O-N 3.36Å; G407-L410 PolarHBondContact O-N 3.39Å; L410-F412 PolarHBondContact O-N 3.48Å; L410-M413 PolarHBondContact O-N 3.05Å; L410-M413 VanDerWaalsContact O-N 3.1Å; L410-I414 HydrophobicContact CD1-CD1 4.16Å; L410-I414 HydrophobicContact CD1-CG1 4.32Å; L410-I414 HydrophobicContact CD2-CD1 4.27Å; L410-I414 HydrophobicContact CG-CD1 3.91Å; L410-I414 HydrophobicContact CG-CG1 4.45Å; L410-I414 WeakPolarHBondContact O-CG1 3.27Å; L410-I414 PolarHBondContact O-N 3.17Å
411	S	90.6	Very high	87.3	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-53.7	-43.9	177.3	-62.9	0	0	0	0	110.7	P170 G174 G407 S408 M413 I414 Y415	P170-S411 WeakPolarHBondContact O-CB 3.33Å; P170-S411 PolarHBondContact O-OG 2.68Å; G174-S411 VanDerWaalsContact CA-OG 3.29Å; G174-S411 WeakPolarHBondContact CA-OG 3.16Å; G174-S411 PolarHBondContact N-OG 2.86Å; G407-S411 PolarHBondContact O-N 3.43Å; G407-S411 PolarHBondContact O-OG 3.18Å; S408-S411 PolarHBondContact O-N 3.02Å; S411-M413 PolarHBondContact O-N 3.08Å; S411-I414 PolarHBondContact O-N 3.44Å; S411-Y415 WeakPolarHBondContact O-CD2 3.37Å; S411-Y415 VanDerWaalsContact O-CG 3.26Å; S411-Y415 PolarHBondContact O-N 3.44Å
412	F	90.8	Very high	87.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-42.3	178.8	-165.8	-74.8	0	0	0	112.3	M285 I288 L292 T293 M391 S408 L409 L410 Y415 Q416	M285-F412 HydrophobicContact CB-CD2 4.38Å; M285-F412 HydrophobicContact CB-CE2 3.8Å; M285-F412 HydrophobicContact CB-CZ 4.33Å; M285-F412 HydrophobicContact CE-CD1 4.31Å; M285-F412 HydrophobicContact CE-CE1 3.54Å; M285-F412 HydrophobicContact CE-CE2 3.92Å; M285-F412 HydrophobicContact CE-CZ 3.3Å; M285-F412 HydrophobicContact CG-CD2 4.43Å; M285-F412 HydrophobicContact CG-CE2 4.14Å; M285-F412 HydrophobicContact CG-CZ 4.47Å; I288-F412 HydrophobicContact CB-CD2 4.29Å; I288-F412 HydrophobicContact CG2-CD2 4.14Å; L292-F412 VanDerWaalsContact C-CZ 3.4Å; L292-F412 HydrophobicContact CB-CD1 4.25Å; L292-F412 HydrophobicContact CB-CD2 4.4Å; L292-F412 HydrophobicContact CB-CE1 3.63Å; L292-F412 HydrophobicContact CB-CE2 3.78Å; L292-F412 HydrophobicContact CB-CZ 3.36Å; L292-F412 HydrophobicContact CD1-CD1 4.32Å; L292-F412 HydrophobicContact CD1-CG 4.36Å; T293-F412 WeakPolarHBondContact OG1-CE2 3.11Å; M391-F412 HydrophobicContact CE-CD1 3.23Å; M391-F412 HydrophobicContact CE-CE1 3.47Å; M391-F412 VanDerWaalsContact CE-CE1 3.47Å; M391-F412 HydrophobicContact CE-CG 4.49Å; M391-F412 HydrophobicContact CG-CE1 4.47Å; M391-F412 HydrophobicContact SD-CD1 3.87Å; M391-F412 HydrophobicContact SD-CE1 3.43Å; M391-F412 WeakPolarHBondContact SD-CE1 3.48Å; S408-F412 VanDerWaalsContact O-CB 3.29Å; S408-F412 WeakPolarHBondContact O-CB 3.33Å; S408-F412 PolarHBondContact O-N 3.3Å; L409-F412 PolarHBondContact O-N 2.92Å; L410-F412 PolarHBondContact O-N 3.48Å; F412-Y415 PolarHBondContact O-N 3.38Å; F412-Q416 WeakPolarHBondContact O-CB 3.07Å; F412-Q416 PolarHBondContact O-N 3.5Å
413	M	89	Confident	87.8	Confident	37 Å²	37	39.4 Å²	39.4	18%	0.182	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-43.8	175.9	-71.5	-171	172.7	0	0	112.4	M391 L392 L409 L410 S411 Y415 Q416 E417	M391-M413 HydrophobicContact CE-CG 3.93Å; L392-M413 HydrophobicContact CB-CE 3.75Å; L392-M413 HydrophobicContact CD1-CE 3.53Å; L392-M413 HydrophobicContact CG-CE 4.14Å; L409-M413 HydrophobicContact CD1-CE 4.3Å; L409-M413 HydrophobicContact CG-CE 4.33Å; L409-M413 WeakPolarHBondContact O-CG 3.26Å; L409-M413 PolarHBondContact O-N 3.14Å; L410-M413 PolarHBondContact O-N 3.05Å; L410-M413 VanDerWaalsContact O-N 3.1Å; S411-M413 PolarHBondContact O-N 3.08Å; M413-Y415 VanDerWaalsContact C-N 3.33Å; M413-Y415 PolarHBondContact O-N 2.94Å; M413-Q416 PolarHBondContact O-N 3.1Å; M413-E417 PolarHBondContact O-N 3.44Å; M413-E417 VanDerWaalsContact O-N 3.16Å
414	I	91	Very high	87.8	Confident	56 Å²	56	36.6 Å²	36.6	29%	0.287	20%	0.197	S	C	.	.	H	α-helix	trans	-64.8	-39.6	177.7	-62.2	169.1	0	0	0	110.8	P170 L410 S411 S418	P170-I414 HydrophobicContact CB-CB 4.01Å; P170-I414 HydrophobicContact CB-CD1 4.38Å; P170-I414 HydrophobicContact CB-CG2 3.72Å; P170-I414 HydrophobicContact CG-CB 4.45Å; P170-I414 HydrophobicContact CG-CG2 3.63Å; L410-I414 HydrophobicContact CD1-CD1 4.16Å; L410-I414 HydrophobicContact CD1-CG1 4.32Å; L410-I414 HydrophobicContact CD2-CD1 4.27Å; L410-I414 HydrophobicContact CG-CD1 3.91Å; L410-I414 HydrophobicContact CG-CG1 4.45Å; L410-I414 WeakPolarHBondContact O-CG1 3.27Å; L410-I414 PolarHBondContact O-N 3.17Å; S411-I414 PolarHBondContact O-N 3.44Å; I414-S418 WeakPolarHBondContact O-CB 3.31Å; I414-S418 PolarHBondContact O-N 2.96Å; I414-S418 PolarHBondContact O-OG 3.06Å
415	Y	90.9	Very high	87.8	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-44	175	-68.6	-41.4	0	0	0	112.3	T167 P170 H171 L281 F284 M285 I288 S411 F412 M413 E417 S418 V419	T167-Y415 VanDerWaalsContact O-CE1 3.26Å; T167-Y415 WeakPolarHBondContact O-CE1 3.35Å; T167-Y415 PolarHBondContact O-OH 2.73Å; P170-Y415 HydrophobicContact CB-CD1 4.01Å; P170-Y415 HydrophobicContact CB-CE1 3.55Å; P170-Y415 HydrophobicContact CB-CE2 4.4Å; P170-Y415 HydrophobicContact CG-CD1 3.95Å; P170-Y415 HydrophobicContact CG-CE1 3.51Å; H171-Y415 WeakPolarHBondContact CB-OH 3.41Å; H171-Y415 PolarHBondContact N-OH 3.22Å; L281-Y415 HydrophobicContact CD2-CD1 3.45Å; L281-Y415 VanDerWaalsContact CD2-CD1 3.45Å; L281-Y415 HydrophobicContact CD2-CE1 3.89Å; L281-Y415 HydrophobicContact CD2-CG 4.34Å; F284-Y415 HydrophobicContact CB-CE2 4.32Å; M285-Y415 HydrophobicContact CG-CD2 4.41Å; M285-Y415 HydrophobicContact CG-CG 4.39Å; I288-Y415 HydrophobicContact CD1-CD2 4.03Å; I288-Y415 HydrophobicContact CD1-CE2 3.82Å; S411-Y415 WeakPolarHBondContact O-CD2 3.37Å; S411-Y415 VanDerWaalsContact O-CG 3.26Å; S411-Y415 PolarHBondContact O-N 3.44Å; F412-Y415 PolarHBondContact O-N 3.38Å; M413-Y415 VanDerWaalsContact C-N 3.33Å; M413-Y415 PolarHBondContact O-N 2.94Å; Y415-E417 PolarHBondContact O-N 3.23Å; Y415-S418 PolarHBondContact O-N 3.34Å; Y415-V419 VanDerWaalsContact O-CG2 3.3Å; Y415-V419 WeakPolarHBondContact O-CG2 3.06Å; Y415-V419 PolarHBondContact O-N 3Å
416	Q	88.9	Confident	87.6	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.065	20%	0.199	C	C	.	.	H	α-helix	trans	-57.4	-46.8	178.7	-174.6	-147.7	-14.9	0	0	111.7	M285 M391 F412 M413 G420	M285-Q416 HydrophobicContact CE-CB 4.16Å; M391-Q416 HydrophobicContact CE-CB 4.12Å; M391-Q416 HydrophobicContact CE-CG 4.29Å; M391-Q416 HydrophobicContact SD-CB 4.49Å; M391-Q416 VanDerWaalsContact SD-CD 3.56Å; M391-Q416 HydrophobicContact SD-CG 4.11Å; M391-Q416 PolarHBondContact SD-OE1 3.36Å; F412-Q416 WeakPolarHBondContact O-CB 3.07Å; F412-Q416 PolarHBondContact O-N 3.5Å; M413-Q416 PolarHBondContact O-N 3.1Å; Q416-G420 PolarHBondContact O-N 2.95Å; Q416-G420 VanDerWaalsContact O-N 3.15Å
417	E	86.8	Confident	87.2	Confident	137 Å²	137	34.3 Å²	34.3	64%	0.64	19%	0.19	S	C	*	.	H	α-helix	trans	-61.1	-46.6	177.7	-174.7	178.2	-173.5	0	0	111.2	M413 Y415 V419 G420 S421	M413-E417 PolarHBondContact O-N 3.44Å; M413-E417 VanDerWaalsContact O-N 3.16Å; Y415-E417 PolarHBondContact O-N 3.23Å; E417-V419 PolarHBondContact O-N 3.32Å; E417-G420 PolarHBondContact O-N 3.48Å; E417-S421 PolarHBondContact O-N 3.17Å
418	S	89	Confident	86.7	Confident	39 Å²	39	40.8 Å²	40.8	27%	0.273	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-48.3	179.4	-64.5	0	0	0	0	112.1	I414 Y415 G420 S421 Y422	I414-S418 WeakPolarHBondContact O-CB 3.31Å; I414-S418 PolarHBondContact O-N 2.96Å; I414-S418 PolarHBondContact O-OG 3.06Å; Y415-S418 PolarHBondContact O-N 3.34Å; S418-G420 VanDerWaalsContact C-N 3.34Å; S418-G420 PolarHBondContact O-N 3.33Å; S418-S421 PolarHBondContact O-N 2.9Å; S418-Y422 WeakPolarHBondContact O-CD2 3.28Å; S418-Y422 WeakPolarHBondContact O-CE2 3.35Å; S418-Y422 PolarHBondContact O-N 3.34Å
419	V	88.6	Confident	86.2	Confident	2 Å²	2	40 Å²	40	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-42.3	-179	175	0	0	0	0	111.4	L281 Y282 M285 M300 Y415 E417 S421 Y422 V423	L281-V419 HydrophobicContact CB-CG2 3.23Å; L281-V419 HydrophobicContact CD1-CG2 3.57Å; L281-V419 HydrophobicContact CG-CG2 3.98Å; Y282-V419 HydrophobicContact CD2-CG1 4.03Å; Y282-V419 HydrophobicContact CE1-CG1 4.09Å; Y282-V419 HydrophobicContact CE2-CG1 3.44Å; Y282-V419 VanDerWaalsContact CE2-CG1 3.44Å; Y282-V419 VanDerWaalsContact CZ-CG1 3.47Å; M285-V419 HydrophobicContact SD-CG2 3.84Å; M300-V419 HydrophobicContact CE-CG1 4.02Å; Y415-V419 VanDerWaalsContact O-CG2 3.3Å; Y415-V419 WeakPolarHBondContact O-CG2 3.06Å; Y415-V419 PolarHBondContact O-N 3Å; E417-V419 PolarHBondContact O-N 3.32Å; V419-S421 VanDerWaalsContact C-N 3.27Å; V419-S421 PolarHBondContact O-N 3.27Å; V419-Y422 PolarHBondContact O-N 2.94Å; V419-V423 HydrophobicContact CG1-CG2 3.93Å; V419-V423 WeakPolarHBondContact O-CG2 3.47Å; V419-V423 PolarHBondContact O-N 3.5Å
420	G	83.8	Confident	85.3	Confident	16 Å²	16	47.1 Å²	47.1	17%	0.165	24%	0.237	C	C	.	.	H	α-helix	trans	-54.1	-44.5	177.3	0	0	0	0	0	112.6	Q416 E417 S418 Q424	Q416-G420 PolarHBondContact O-N 2.95Å; Q416-G420 VanDerWaalsContact O-N 3.15Å; E417-G420 PolarHBondContact O-N 3.48Å; S418-G420 VanDerWaalsContact C-N 3.34Å; S418-G420 PolarHBondContact O-N 3.33Å; G420-Q424 VanDerWaalsContact O-CG 3.28Å; G420-Q424 WeakPolarHBondContact O-CG 3.3Å; G420-Q424 PolarHBondContact O-N 3.32Å; G420-Q424 VanDerWaalsContact O-N 3.14Å
421	S	86.1	Confident	84.1	Confident	62 Å²	62	46.3 Å²	46.3	43%	0.434	24%	0.242	S	C	.	.	H	α-helix	trans	-65.3	-42.9	177.9	-175.6	0	0	0	0	113	E417 S418 V419 Q424 T425	E417-S421 PolarHBondContact O-N 3.17Å; S418-S421 PolarHBondContact O-N 2.9Å; V419-S421 VanDerWaalsContact C-N 3.27Å; V419-S421 PolarHBondContact O-N 3.27Å; S421-Q424 PolarHBondContact O-N 3.18Å; S421-T425 WeakPolarHBondContact O-CB 3.29Å; S421-T425 PolarHBondContact O-N 3.44Å; S421-T425 PolarHBondContact O-OG1 3.5Å
422	Y	88.9	Confident	83	Confident	47 Å²	47	47.7 Å²	47.7	18%	0.184	25%	0.25	C	C	.	.	H	α-helix	trans	-72.1	-35.1	-179.5	-65	-63.1	0	0	0	113.2	K277 L281 S418 V419 T425 L426	K277-Y422 HydrophobicContact CB-CD1 4.42Å; K277-Y422 HydrophobicContact CB-CD2 4.03Å; K277-Y422 HydrophobicContact CB-CE2 4.48Å; K277-Y422 HydrophobicContact CB-CG 4.07Å; K277-Y422 HydrophobicContact CD-CD1 3.8Å; K277-Y422 HydrophobicContact CD-CD2 3.78Å; K277-Y422 HydrophobicContact CD-CE1 3.4Å; K277-Y422 VanDerWaalsContact CD-CE1 3.4Å; K277-Y422 HydrophobicContact CD-CE2 3.43Å; K277-Y422 VanDerWaalsContact CD-CE2 3.43Å; K277-Y422 HydrophobicContact CD-CG 4.01Å; K277-Y422 PolarHBondContact NZ-OH 2.95Å; L281-Y422 HydrophobicContact CD1-CD2 3.94Å; L281-Y422 HydrophobicContact CD1-CE2 4.28Å; S418-Y422 WeakPolarHBondContact O-CD2 3.28Å; S418-Y422 WeakPolarHBondContact O-CE2 3.35Å; S418-Y422 PolarHBondContact O-N 3.34Å; V419-Y422 PolarHBondContact O-N 2.94Å; Y422-T425 PolarHBondContact O-N 2.88Å; Y422-L426 PolarHBondContact O-N 3.41Å
423	V	85.4	Confident	81.8	Confident	18 Å²	18	49.3 Å²	49.3	11%	0.109	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-46	173.6	172.3	0	0	0	0	110.4	V278 Y282 M300 I304 V419 T425 L426 V427	V278-V423 HydrophobicContact CG1-CG2 4.13Å; V278-V423 HydrophobicContact CG2-CG2 3.81Å; Y282-V423 HydrophobicContact CE2-CG2 4.38Å; M300-V423 HydrophobicContact CE-CG2 4.39Å; M300-V423 HydrophobicContact SD-CB 4.34Å; M300-V423 HydrophobicContact SD-CG1 4.19Å; I304-V423 HydrophobicContact CD1-CG1 4.12Å; V419-V423 HydrophobicContact CG1-CG2 3.93Å; V419-V423 WeakPolarHBondContact O-CG2 3.47Å; V419-V423 PolarHBondContact O-N 3.5Å; V423-T425 VanDerWaalsContact C-N 3.33Å; V423-T425 PolarHBondContact O-N 2.88Å; V423-L426 WeakPolarHBondContact O-CB 3.22Å; V423-L426 PolarHBondContact O-N 3.23Å; V423-L426 VanDerWaalsContact O-N 3.17Å; V423-V427 WeakPolarHBondContact O-CG2 3.48Å; V423-V427 PolarHBondContact O-N 3.48Å
424	Q	81.1	Confident	80.5	Confident	46 Å²	46	50.3 Å²	50.3	22%	0.215	26%	0.263	C	S	.	.	H	α-helix	trans	-58.4	-45.6	174.9	-73.5	174.8	-11.1	0	0	111.7	E307 G420 S421 L426 V427 Y428	E307-Q424 WeakPolarHBondContact OE2-CG 3.49Å; G420-Q424 VanDerWaalsContact O-CG 3.28Å; G420-Q424 WeakPolarHBondContact O-CG 3.3Å; G420-Q424 PolarHBondContact O-N 3.32Å; G420-Q424 VanDerWaalsContact O-N 3.14Å; S421-Q424 PolarHBondContact O-N 3.18Å; Q424-L426 VanDerWaalsContact C-N 3.28Å; Q424-L426 PolarHBondContact O-N 3.26Å; Q424-V427 PolarHBondContact O-N 3.27Å; Q424-Y428 WeakPolarHBondContact O-CB 3.49Å; Q424-Y428 PolarHBondContact O-N 3.4Å
425	T	85.8	Confident	78.9	Confident	43 Å²	43	51.2 Å²	51.2	26%	0.264	28%	0.275	S	S	.	.	H	α-helix	trans	-58.2	-41.3	176.7	-54.7	0	0	0	0	111.5	V270 S421 Y422 V423 Y428 I429	V270-T425 HydrophobicContact CG1-CG2 3.56Å; S421-T425 WeakPolarHBondContact O-CB 3.29Å; S421-T425 PolarHBondContact O-N 3.44Å; S421-T425 PolarHBondContact O-OG1 3.5Å; Y422-T425 PolarHBondContact O-N 2.88Å; V423-T425 VanDerWaalsContact C-N 3.33Å; V423-T425 PolarHBondContact O-N 2.88Å; T425-Y428 PolarHBondContact O-N 3.41Å; T425-I429 HydrophobicContact CG2-CD1 3.86Å; T425-I429 WeakPolarHBondContact O-CD1 3.25Å; T425-I429 VanDerWaalsContact O-CG1 3.26Å; T425-I429 WeakPolarHBondContact O-CG1 3.28Å; T425-I429 PolarHBondContact O-N 3.15Å
426	L	83.5	Confident	77.4	Confident	49 Å²	49	54.6 Å²	54.6	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-42.3	178.6	-167.6	69.9	0	0	0	112.3	L271 Y422 V423 Q424 Y428 Y430	L271-L426 HydrophobicContact CD1-CD1 3.65Å; L271-L426 HydrophobicContact CG-CD1 4.32Å; Y422-L426 PolarHBondContact O-N 3.41Å; V423-L426 WeakPolarHBondContact O-CB 3.22Å; V423-L426 PolarHBondContact O-N 3.23Å; V423-L426 VanDerWaalsContact O-N 3.17Å; Q424-L426 VanDerWaalsContact C-N 3.28Å; Q424-L426 PolarHBondContact O-N 3.26Å; L426-Y428 VanDerWaalsContact C-N 3.34Å; L426-Y430 PolarHBondContact O-N 2.7Å
427	V	78.4	Confident	76.4	Confident	59 Å²	59	54.1 Å²	54.1	36%	0.358	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176	172.9	0	0	0	0	110.9	I304 V423 Q424 G431	I304-V427 HydrophobicContact CD1-CG2 4.09Å; I304-V427 HydrophobicContact CG1-CG2 4.17Å; I304-V427 HydrophobicContact CG2-CG1 4.43Å; I304-V427 HydrophobicContact CG2-CG2 4.45Å; V423-V427 WeakPolarHBondContact O-CG2 3.48Å; V423-V427 PolarHBondContact O-N 3.48Å; Q424-V427 PolarHBondContact O-N 3.27Å; V427-G431 PolarHBondContact O-N 2.87Å
428	Y	76	Confident	75.4	Confident	136 Å²	136	49.1 Å²	49.1	53%	0.533	28%	0.276	S	S	.	.	H	α-helix	trans	-63.2	-49.6	177.9	178.4	-97.2	0	0	0	112.2	Q424 T425 L426 Y430 G431 D432	Q424-Y428 WeakPolarHBondContact O-CB 3.49Å; Q424-Y428 PolarHBondContact O-N 3.4Å; T425-Y428 PolarHBondContact O-N 3.41Å; L426-Y428 VanDerWaalsContact C-N 3.34Å; Y428-Y430 VanDerWaalsContact C-N 3.3Å; Y428-Y430 PolarHBondContact O-N 2.93Å; Y428-G431 PolarHBondContact O-N 3.2Å; Y428-G431 VanDerWaalsContact O-N 3.08Å; Y428-D432 HydrophobicContact CE1-CB 4.35Å; Y428-D432 PolarHBondContact O-N 3Å
429	I	77	Confident	74.4	Confident	6 Å²	6	48.6 Å²	48.6	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-39.6	-178.8	-68.9	163.2	0	0	0	111.4	N267 V270 L271 T425 G431 D432 M433	N267-I429 HydrophobicContact CB-CG2 4.47Å; V270-I429 HydrophobicContact CB-CD1 3.61Å; V270-I429 HydrophobicContact CG1-CD1 3.36Å; L271-I429 HydrophobicContact CB-CG2 4.33Å; L271-I429 HydrophobicContact CD1-CG2 3.89Å; T425-I429 HydrophobicContact CG2-CD1 3.86Å; T425-I429 WeakPolarHBondContact O-CD1 3.25Å; T425-I429 VanDerWaalsContact O-CG1 3.26Å; T425-I429 WeakPolarHBondContact O-CG1 3.28Å; T425-I429 PolarHBondContact O-N 3.15Å; I429-G431 PolarHBondContact O-N 3.14Å; I429-D432 PolarHBondContact O-N 3.39Å; I429-M433 WeakPolarHBondContact O-CB 3.47Å; I429-M433 PolarHBondContact O-N 3.47Å
430	Y	69.3	Low	73.9	Confident	161 Å²	161	48.9 Å²	48.9	63%	0.631	28%	0.277	S	S	*	.	H	α-helix	trans	-59.8	-37.7	177.8	-174.9	-94.7	0	0	0	112	L426 Y428 L434	L426-Y430 PolarHBondContact O-N 2.7Å; Y428-Y430 VanDerWaalsContact C-N 3.3Å; Y428-Y430 PolarHBondContact O-N 2.93Å; Y430-L434 WeakPolarHBondContact O-CD1 3.49Å
431	G	65.6	Low	73.8	Confident	42 Å²	42	52.3 Å²	52.3	43%	0.433	29%	0.289	S	S	.	.	H	α-helix	trans	-68.6	-47.1	173.5	0	0	0	0	0	112.8	V427 Y428 I429 M433 L434 S435	V427-G431 PolarHBondContact O-N 2.87Å; Y428-G431 PolarHBondContact O-N 3.2Å; Y428-G431 VanDerWaalsContact O-N 3.08Å; I429-G431 PolarHBondContact O-N 3.14Å; G431-M433 VanDerWaalsContact C-N 3.35Å; G431-M433 PolarHBondContact O-N 3.37Å; G431-L434 PolarHBondContact O-N 2.98Å; G431-S435 PolarHBondContact O-N 3.32Å
432	D	67.3	Low	73.5	Confident	32 Å²	32	54.1 Å²	54.1	17%	0.171	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-35.5	-178.3	-167.2	74.2	0	0	0	112.9	Y428 I429 L434 S435 N436	Y428-D432 HydrophobicContact CE1-CB 4.35Å; Y428-D432 PolarHBondContact O-N 3Å; I429-D432 PolarHBondContact O-N 3.39Å; D432-L434 PolarHBondContact O-N 3.36Å; D432-S435 PolarHBondContact O-N 3.06Å; D432-S435 PolarHBondContact O-OG 3.18Å; D432-N436 PolarHBondContact O-N 2.93Å; D432-N436 PolarHBondContact OD1-ND2 3.42Å; D432-N436 PolarHBondContact OD2-ND2 3.46Å
433	M	65.9	Low	73.4	Confident	33 Å²	33	52 Å²	52	16%	0.163	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-27.1	178.7	-160.3	-178.6	-152.6	0	0	112	M138 W263 I429 G431	M138-M433 HydrophobicContact CE-CE 3.21Å; M138-M433 HydrophobicContact CE-CG 4.11Å; M138-M433 HydrophobicContact CE-SD 3.7Å; M138-M433 HydrophobicContact SD-CG 4.41Å; W263-M433 HydrophobicContact CH2-CG 3.71Å; W263-M433 VanDerWaalsContact CH2-O 3.23Å; W263-M433 WeakPolarHBondContact CH2-O 3.36Å; W263-M433 VanDerWaalsContact CZ2-CA 3.46Å; W263-M433 HydrophobicContact CZ2-CB 4.3Å; W263-M433 HydrophobicContact CZ2-CG 3.94Å; W263-M433 WeakPolarHBondContact CZ2-O 3.28Å; I429-M433 WeakPolarHBondContact O-CB 3.47Å; I429-M433 PolarHBondContact O-N 3.47Å; G431-M433 VanDerWaalsContact C-N 3.35Å; G431-M433 PolarHBondContact O-N 3.37Å
434	L	60.9	Low	73.5	Confident	58 Å²	58	51.3 Å²	51.3	30%	0.304	28%	0.276	S	S	.	.	H	α-helix	trans	-86.8	-28.1	176.8	-96.3	75.2	0	0	0	113.1	Q131 N134 Y430 G431 D432	Q131-L434 HydrophobicContact CG-CD2 3.95Å; N134-L434 PolarHBondContact ND2-O 2.65Å; N134-L434 VanDerWaalsContact ND2-O 3.16Å; Y430-L434 WeakPolarHBondContact O-CD1 3.49Å; G431-L434 PolarHBondContact O-N 2.98Å; D432-L434 PolarHBondContact O-N 3.36Å
435	S	56.8	Low	73.9	Confident	76 Å²	76	52.4 Å²	52.4	53%	0.531	29%	0.289	S	S	.	.	H	α-helix	trans	-88.4	-24.8	-172.9	56.4	0	0	0	0	114.4	G431 D432	G431-S435 PolarHBondContact O-N 3.32Å; D432-S435 PolarHBondContact O-N 3.06Å; D432-S435 PolarHBondContact O-OG 3.18Å
436	N	60.6	Low	74	Confident	70 Å²	70	51.9 Å²	51.9	37%	0.374	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	12.4	-168.7	-74.4	-19.4	0	0	0	115.1	W263 D432 G438	W263-N436 HydrophobicContact CZ2-CB 4.1Å; D432-N436 PolarHBondContact O-N 2.93Å; D432-N436 PolarHBondContact OD1-ND2 3.42Å; D432-N436 PolarHBondContact OD2-ND2 3.46Å; N436-G438 VanDerWaalsContact C-N 3.28Å; N436-G438 PolarHBondContact O-N 3.44Å
437	V	66.7	Low	74.2	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.024	28%	0.275	C	S	.	.	H	α-helix	trans	-73.6	-18.5	-179.7	-177.2	0	0	0	0	113	N134 L137 W263 A439 A440 E441	N134-V437 HydrophobicContact CB-CB 4.28Å; N134-V437 HydrophobicContact CB-CG1 4.15Å; N134-V437 HydrophobicContact CB-CG2 3.98Å; N134-V437 VanDerWaalsContact OD1-CB 3.3Å; N134-V437 WeakPolarHBondContact OD1-CB 3.43Å; N134-V437 WeakPolarHBondContact OD1-CG1 3.22Å; L137-V437 HydrophobicContact CB-CG1 3.78Å; L137-V437 HydrophobicContact CD1-CG1 3.49Å; L137-V437 VanDerWaalsContact CD1-CG1 3.49Å; L137-V437 HydrophobicContact CG-CG1 4.25Å; W263-V437 HydrophobicContact CH2-CG2 3.88Å; W263-V437 HydrophobicContact CZ2-CG2 4.26Å; V437-A439 VanDerWaalsContact C-N 3.28Å; V437-A439 PolarHBondContact O-N 2.89Å; V437-A440 WeakPolarHBondContact O-CB 3.46Å; V437-A440 PolarHBondContact O-N 3.41Å; V437-E441 PolarHBondContact O-N 3.24Å
438	G	66.6	Low	74.8	Confident	33 Å²	33	51.4 Å²	51.4	34%	0.34	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-26.6	-177.4	0	0	0	0	0	115.2	N436 K442	N436-G438 VanDerWaalsContact C-N 3.28Å; N436-G438 PolarHBondContact O-N 3.44Å; G438-K442 PolarHBondContact O-N 3Å
439	A	68.9	Low	75.4	Confident	28 Å²	28	48.5 Å²	48.5	23%	0.231	27%	0.265	C	S	.	.	H	α-helix	trans	-71.4	-41	173.1	0	0	0	0	0	111.5	V437 K442 V443	V437-A439 VanDerWaalsContact C-N 3.28Å; V437-A439 PolarHBondContact O-N 2.89Å; A439-K442 PolarHBondContact O-N 3.31Å; A439-V443 WeakPolarHBondContact O-CG2 3.42Å; A439-V443 PolarHBondContact O-N 3.33Å; A439-V443 VanDerWaalsContact O-N 3.15Å
440	A	77.8	Confident	75.8	Confident	7 Å²	7	56.4 Å²	56.4	6%	0.058	30%	0.302	C	S	.	.	H	α-helix	trans	-66.9	-39.2	176.4	0	0	0	0	0	111.5	M260 V437 K442 V443 F444	M260-A440 HydrophobicContact CE-CB 4.21Å; M260-A440 HydrophobicContact CG-CB 3.97Å; M260-A440 HydrophobicContact SD-CB 4.24Å; V437-A440 WeakPolarHBondContact O-CB 3.46Å; V437-A440 PolarHBondContact O-N 3.41Å; A440-K442 PolarHBondContact O-N 3.24Å; A440-V443 PolarHBondContact O-N 2.87Å; A440-F444 HydrophobicContact CB-CD2 4.45Å; A440-F444 HydrophobicContact CB-CE2 4.47Å; A440-F444 WeakPolarHBondContact O-CB 3.3Å; A440-F444 WeakPolarHBondContact O-CD2 3.46Å; A440-F444 PolarHBondContact O-N 3.46Å
441	E	81.8	Confident	76.6	Confident	89 Å²	89	51 Å²	51	42%	0.416	29%	0.287	S	S	.	.	H	α-helix	trans	-56	-48.4	175.7	-174.3	178.7	-163.3	0	0	111.7	L137 V437 F444 S445	L137-E441 HydrophobicContact CD1-CB 3.9Å; L137-E441 HydrophobicContact CD1-CG 4.19Å; V437-E441 PolarHBondContact O-N 3.24Å; E441-F444 PolarHBondContact O-N 3.26Å; E441-S445 WeakPolarHBondContact O-CB 3.27Å; E441-S445 PolarHBondContact O-N 3.46Å
442	K	80	Confident	77.3	Confident	100 Å²	100	55.4 Å²	55.4	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-65	-46.4	178.4	-68.2	-179.1	-173.4	177.6	0	111.9	R252 G438 A439 A440 F444 S445 Y446	R252-K442 VanDerWaalsContact NH1-CD 3.3Å; G438-K442 PolarHBondContact O-N 3Å; A439-K442 PolarHBondContact O-N 3.31Å; A440-K442 PolarHBondContact O-N 3.24Å; K442-F444 VanDerWaalsContact C-N 3.29Å; K442-F444 PolarHBondContact O-N 2.93Å; K442-S445 PolarHBondContact O-N 2.9Å; K442-S445 VanDerWaalsContact O-N 3.15Å; K442-S445 PolarHBondContact O-OG 3.17Å; K442-Y446 WeakPolarHBondContact O-CD2 3.12Å; K442-Y446 PolarHBondContact O-N 3.08Å; K442-Y446 VanDerWaalsContact O-N 3.1Å
443	V	86.3	Confident	77.7	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-60.3	-42.3	178.7	172.2	0	0	0	0	111.1	I225 L229 D256 M260 A439 A440 Y446 M447	I225-V443 HydrophobicContact CG2-CG1 4.05Å; L229-V443 HydrophobicContact CD2-CG1 4.29Å; D256-V443 HydrophobicContact CB-CG2 3.77Å; M260-V443 HydrophobicContact CE-CB 4.46Å; M260-V443 HydrophobicContact CE-CG1 4.23Å; M260-V443 HydrophobicContact SD-CB 3.51Å; M260-V443 VanDerWaalsContact SD-CB 3.51Å; M260-V443 HydrophobicContact SD-CG1 3.46Å; M260-V443 WeakPolarHBondContact SD-CG1 3.36Å; M260-V443 HydrophobicContact SD-CG2 3.98Å; A439-V443 WeakPolarHBondContact O-CG2 3.42Å; A439-V443 PolarHBondContact O-N 3.33Å; A439-V443 VanDerWaalsContact O-N 3.15Å; A440-V443 PolarHBondContact O-N 2.87Å; V443-Y446 PolarHBondContact O-N 3.36Å; V443-M447 HydrophobicContact CG1-CE 4.39Å; V443-M447 WeakPolarHBondContact O-CB 3.35Å; V443-M447 PolarHBondContact O-N 3.33Å
444	F	88	Confident	78.2	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-67.5	-36.2	175.6	-75.2	-51.9	0	0	0	112.6	L137 R140 L141 L144 M260 A440 E441 K442 Y446 M447 D448	L137-F444 HydrophobicContact CD2-CB 4.31Å; L137-F444 HydrophobicContact CD2-CD2 3.47Å; L137-F444 VanDerWaalsContact CD2-CD2 3.47Å; L137-F444 HydrophobicContact CD2-CE2 4.19Å; L137-F444 HydrophobicContact CD2-CG 4.3Å; R140-F444 HydrophobicContact CB-CE2 4.41Å; R140-F444 HydrophobicContact CB-CZ 4.24Å; R140-F444 HydrophobicContact CG-CE1 3.98Å; R140-F444 HydrophobicContact CG-CE2 4.31Å; R140-F444 HydrophobicContact CG-CZ 3.76Å; L141-F444 HydrophobicContact CD1-CE2 4.03Å; L141-F444 HydrophobicContact CD1-CZ 3.87Å; L144-F444 HydrophobicContact CD1-CE1 4.41Å; M260-F444 HydrophobicContact CE-CD1 4.06Å; M260-F444 HydrophobicContact CE-CD2 3.71Å; M260-F444 HydrophobicContact CE-CE1 3.59Å; M260-F444 HydrophobicContact CE-CE2 3.25Å; M260-F444 HydrophobicContact CE-CG 4.12Å; M260-F444 HydrophobicContact CE-CZ 3.17Å; A440-F444 HydrophobicContact CB-CD2 4.45Å; A440-F444 HydrophobicContact CB-CE2 4.47Å; A440-F444 WeakPolarHBondContact O-CB 3.3Å; A440-F444 WeakPolarHBondContact O-CD2 3.46Å; A440-F444 PolarHBondContact O-N 3.46Å; E441-F444 PolarHBondContact O-N 3.26Å; K442-F444 VanDerWaalsContact C-N 3.29Å; K442-F444 PolarHBondContact O-N 2.93Å; F444-Y446 VanDerWaalsContact C-N 3.32Å; F444-Y446 PolarHBondContact O-N 2.86Å; F444-M447 HydrophobicContact CD1-SD 4.3Å; F444-M447 HydrophobicContact CE1-SD 4.48Å; F444-M447 PolarHBondContact O-N 3.4Å; F444-M447 VanDerWaalsContact O-N 3.13Å; F444-D448 VanDerWaalsContact O-CB 3.29Å; F444-D448 WeakPolarHBondContact O-CB 3.46Å; F444-D448 VanDerWaalsContact O-CG 3.25Å; F444-D448 PolarHBondContact O-N 3.27Å
445	S	88.3	Confident	78.9	Confident	69 Å²	69	60.4 Å²	60.4	48%	0.483	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.6	75.9	0	0	0	0	112.4	E441 K442 R449	E441-S445 WeakPolarHBondContact O-CB 3.27Å; E441-S445 PolarHBondContact O-N 3.46Å; K442-S445 PolarHBondContact O-N 2.9Å; K442-S445 VanDerWaalsContact O-N 3.15Å; K442-S445 PolarHBondContact O-OG 3.17Å; S445-R449 WeakPolarHBondContact O-CB 3.46Å; S445-R449 PolarHBondContact O-N 2.98Å; S445-R449 VanDerWaalsContact O-N 3.09Å
446	Y	87.6	Confident	79.9	Confident	33 Å²	33	61.3 Å²	61.3	13%	0.129	34%	0.344	C	S	.	.	H	α-helix	trans	-69.8	-38.5	171.8	-77.2	-81.6	0	0	0	112.4	S232 L233 F240 E248 L249 R252 K442 V443 F444 D448	S232-Y446 PolarHBondContact OG-O 2.85Å; L233-Y446 HydrophobicContact CD2-CD1 3.99Å; F240-Y446 AromaticContact CE2-CD1 3.68Å; F240-Y446 HydrophobicContact CE2-CD1 3.68Å; F240-Y446 AromaticContact CE2-CE1 3.41Å; F240-Y446 HydrophobicContact CE2-CE1 3.41Å; F240-Y446 VanDerWaalsContact CE2-CE1 3.41Å; F240-Y446 AromaticContact CZ-CD1 3.46Å; F240-Y446 HydrophobicContact CZ-CD1 3.46Å; F240-Y446 VanDerWaalsContact CZ-CD1 3.46Å; F240-Y446 AromaticContact CZ-CE1 3.34Å; F240-Y446 HydrophobicContact CZ-CE1 3.34Å; E248-Y446 PolarHBondContact OE1-OH 2.93Å; E248-Y446 VanDerWaalsContact OE1-OH 3.09Å; L249-Y446 HydrophobicContact CD2-CE1 4.34Å; R252-Y446 HydrophobicContact CG-CD2 4.4Å; R252-Y446 HydrophobicContact CG-CE2 4Å; K442-Y446 WeakPolarHBondContact O-CD2 3.12Å; K442-Y446 PolarHBondContact O-N 3.08Å; K442-Y446 VanDerWaalsContact O-N 3.1Å; V443-Y446 PolarHBondContact O-N 3.36Å; F444-Y446 VanDerWaalsContact C-N 3.32Å; F444-Y446 PolarHBondContact O-N 2.86Å; Y446-D448 VanDerWaalsContact C-N 3.35Å
447	M	89.3	Confident	81	Confident	23 Å²	23	58.9 Å²	58.9	11%	0.113	34%	0.335	C	S	.	.	H	α-helix	trans	-67.7	-35.7	-179.8	-169.3	176.7	-66.7	0	0	112.4	I225 Q228 L229 S232 V443 F444	I225-M447 HydrophobicContact CG2-CE 4.33Å; Q228-M447 HydrophobicContact CB-CE 3.82Å; Q228-M447 HydrophobicContact CB-SD 4.11Å; L229-M447 HydrophobicContact CB-CE 4.21Å; S232-M447 PolarHBondContact OG-O 2.95Å; V443-M447 HydrophobicContact CG1-CE 4.39Å; V443-M447 WeakPolarHBondContact O-CB 3.35Å; V443-M447 PolarHBondContact O-N 3.33Å; F444-M447 HydrophobicContact CD1-SD 4.3Å; F444-M447 HydrophobicContact CE1-SD 4.48Å; F444-M447 PolarHBondContact O-N 3.4Å; F444-M447 VanDerWaalsContact O-N 3.13Å
448	D	89.9	Confident	82.2	Confident	75 Å²	75	65.1 Å²	65.1	40%	0.401	37%	0.374	S	S	.	.	H	α-helix	trans	-90.4	-12.9	-178.2	-68.2	-32.5	0	0	0	114.8	R140 F444 Y446 Q450	R140-D448 IonicContact CZ-OD1 3.98Å; R140-D448 IonicContact CZ-OD2 3.82Å; R140-D448 VanDerWaalsContact NH1-CG 3.33Å; R140-D448 IonicContact NH1-OD1 2.98Å; R140-D448 PolarHBondContact NH1-OD1 3.47Å; R140-D448 IonicContact NH1-OD2 3.9Å; R140-D448 PolarHBondContact NH1-OD2 3.35Å; R140-D448 IonicContact NH2-OD1 2.93Å; R140-D448 PolarHBondContact NH2-OD1 3.03Å; R140-D448 IonicContact NH2-OD2 2.75Å; R140-D448 PolarHBondContact NH2-OD2 3.04Å; F444-D448 VanDerWaalsContact O-CB 3.29Å; F444-D448 WeakPolarHBondContact O-CB 3.46Å; F444-D448 VanDerWaalsContact O-CG 3.25Å; F444-D448 PolarHBondContact O-N 3.27Å; Y446-D448 VanDerWaalsContact C-N 3.35Å; D448-Q450 PolarHBondContact O-N 3.37Å; D448-Q450 VanDerWaalsContact O-N 3.09Å
449	R	88.7	Confident	83.4	Confident	74 Å²	74	65.5 Å²	65.5	28%	0.279	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-55.3	121.5	179.1	-172.3	-178.9	-178.3	-84.4	1.5	108.7	Q236 D237 S445	Q236-R449 PolarHBondContact NE2-O 3.43Å; Q236-R449 VanDerWaalsContact OE1-CG 3.31Å; Q236-R449 PolarHBondContact OE1-O 3.37Å; D237-R449 IonicContact OD1-CZ 2.73Å; D237-R449 IonicContact OD1-NH1 3.28Å; D237-R449 PolarHBondContact OD1-NH1 2.74Å; D237-R449 IonicContact OD1-NH2 3.48Å; D237-R449 PolarHBondContact OD1-NH2 3.34Å; D237-R449 VanDerWaalsContact OD1-NH2 3.15Å; D237-R449 IonicContact OD2-NH2 3.57Å; S445-R449 WeakPolarHBondContact O-CB 3.46Å; S445-R449 PolarHBondContact O-N 2.98Å; S445-R449 VanDerWaalsContact O-N 3.09Å
450	Q	86.8	Confident	84.5	Confident	172 Å²	172	66.3 Å²	66.3	80%	0.804	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-84.7	133.2	170.7	-66.2	-173.7	-2.4	0	0	108.6	D448	D448-Q450 PolarHBondContact O-N 3.37Å; D448-Q450 VanDerWaalsContact O-N 3.09Å
451	P	85.6	Confident	85.1	Confident	48 Å²	48	67.8 Å²	67.8	31%	0.312	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-61.1	143.8	176.1	24.3	-32.2	0	0	0	110.2	R235 L453	R235-P451 WeakPolarHBondContact O-CB 3.35Å; P451-L453 HydrophobicContact CB-CB 4.5Å; P451-L453 PolarHBondContact O-N 3Å
452	N	80.6	Confident	85.3	Confident	134 Å²	134	70.5 Å²	70.5	72%	0.717	41%	0.406	S	S	*	.	S	Bend	trans	-81	50.6	174.3	-162.2	12.4	0	0	0	111.3	D237	D237-N452 PolarHBondContact OD1-N 3.37Å
453	L	75.6	Confident	85.6	Confident	58 Å²	58	71.2 Å²	71.2	30%	0.304	42%	0.419	S	S	.	.	S	Bend	trans	-130.5	144	178.2	-77.7	157.4	0	0	0	107.8	D237 P451 Q521	D237-L453 HydrophobicContact CB-CD1 3.75Å; D237-L453 HydrophobicContact CB-CG 4.11Å; P451-L453 HydrophobicContact CB-CB 4.5Å; P451-L453 PolarHBondContact O-N 3Å; L453-Q521 HydrophobicContact CD2-CG 4.38Å
454	P	74.9	Confident	85.8	Confident	64 Å²	64	71.7 Å²	71.7	42%	0.416	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-57.7	150.1	172.1	25.3	-32.4	0	0	0	109.6	Q521	P454-Q521 HydrophobicContact CG-CG 4.08Å
455	S	76.4	Confident	85.9	Confident	107 Å²	107	78.2 Å²	78.2	75%	0.748	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-53.8	137.4	172.7	-63.1	0	0	0	0	109.2	G457	S455-G457 PolarHBondContact O-N 3.19Å
456	P	76.8	Confident	85.9	Confident	94 Å²	94	74.9 Å²	74.9	61%	0.61	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-55.8	133.7	-178.9	22.9	-32.2	0	0	0	109	H539	P456-H539 HydrophobicContact CB-CB 4.3Å
457	G	85.3	Confident	86.3	Confident	19 Å²	19	74.5 Å²	74.5	20%	0.196	43%	0.43	C	S	.	.			trans	-68.4	174.6	175.2	0	0	0	0	0	111.8	S455 Q536 Y537 E538	S455-G457 PolarHBondContact O-N 3.19Å; G457-Q536 CarbonylContact C-O 3.16Å; G457-Q536 VanDerWaalsContact CA-O 3.26Å; G457-Q536 WeakPolarHBondContact CA-O 3.27Å; G457-Y537 PolarHBondContact N-O 3.41Å; G457-E538 WeakPolarHBondContact O-CA 3.41Å; G457-E538 PolarHBondContact O-N 3.01Å
458	T	91.8	Very high	86.6	Confident	136 Å²	136	73.4 Å²	73.4	83%	0.834	43%	0.425	S	S	*	.			trans	-107.8	2.9	-177.2	51.4	0	0	0	0	112.8	A460 Q536	T458-A460 PolarHBondContact O-N 3.4Å; T458-Q536 PolarHBondContact N-O 3.48Å
459	L	91.2	Very high	86.9	Confident	40 Å²	40	72.4 Å²	72.4	21%	0.209	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-81.1	115.5	-172	-161.6	119.6	0	0	0	111.4	P461 K532 Q536 Y537 E538	L459-P461 HydrophobicContact CD2-CG 4.1Å; L459-K532 HydrophobicContact CD1-CD 3.68Å; L459-K532 HydrophobicContact CD2-CD 3.74Å; L459-K532 HydrophobicContact CG-CD 4.38Å; L459-Q536 WeakPolarHBondContact CB-O 3.4Å; L459-Q536 PolarHBondContact N-O 3.16Å; L459-Y537 HydrophobicContact CD2-CD1 3.55Å; L459-Y537 HydrophobicContact CD2-CD2 4.29Å; L459-Y537 HydrophobicContact CD2-CE1 3.22Å; L459-Y537 HydrophobicContact CD2-CE2 4.03Å; L459-Y537 HydrophobicContact CD2-CG 4.09Å; L459-Y537 VanDerWaalsContact CD2-CZ 3.48Å; L459-Y537 WeakPolarHBondContact O-CA 3.44Å; L459-E538 PolarHBondContact O-N 2.89Å
460	A	91.6	Very high	87.3	Confident	46 Å²	46	69 Å²	69	38%	0.38	40%	0.404	S	S	.	.			trans	-138.2	73.9	176.5	0	0	0	0	0	110.4	T458 E538 Y541	T458-A460 PolarHBondContact O-N 3.4Å; A460-E538 HydrophobicContact CB-CB 4.47Å; A460-Y541 HydrophobicContact CB-CD1 4.36Å; A460-Y541 HydrophobicContact CB-CD2 3.69Å; A460-Y541 HydrophobicContact CB-CE2 4.31Å; A460-Y541 HydrophobicContact CB-CG 3.71Å
461	P	91.5	Very high	87.7	Confident	38 Å²	38	64.1 Å²	64.1	25%	0.247	38%	0.381	C	S	.	.			trans	-66.3	144.9	-177.7	25.2	-31.5	0	0	0	111.8	L459 T463 L464 Y537 Y541	L459-P461 HydrophobicContact CD2-CG 4.1Å; P461-T463 PolarHBondContact O-N 2.86Å; P461-L464 HydrophobicContact CG-CD1 4.24Å; P461-Y537 HydrophobicContact CG-CE1 4.14Å; P461-Y541 HydrophobicContact CG-CE1 4.2Å; P461-Y541 WeakPolarHBondContact CG-OH 3.46Å; P461-Y541 WeakPolarHBondContact O-CE2 3.43Å; P461-Y541 PolarHBondContact O-OH 3.1Å
462	T	85.5	Confident	88.2	Confident	145 Å²	145	66.7 Å²	66.7	89%	0.89	39%	0.392	S	S	*	.	S	Bend	trans	-66	-28.7	178.6	48.9	0	0	0	0	112.8
463	T	85.8	Confident	88.9	Confident	116 Å²	116	60.3 Å²	60.3	71%	0.712	36%	0.358	S	S	*	.			trans	-128.6	130.8	179.2	53.3	0	0	0	0	109.7	P461	P461-T463 PolarHBondContact O-N 2.86Å
464	L	90.7	Very high	89.8	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.052	36%	0.356	C	S	.	.			trans	-124.9	129.4	178	-168.8	82.1	0	0	0	108.1	P461 L529 D530 Y537 Q545 R626	P461-L464 HydrophobicContact CG-CD1 4.24Å; L464-L529 HydrophobicContact CD1-CD2 4.12Å; L464-L529 HydrophobicContact CD1-CG 4.12Å; L464-L529 HydrophobicContact CD2-CD1 4.3Å; L464-L529 HydrophobicContact CD2-CD2 4.02Å; L464-L529 HydrophobicContact CD2-CG 4.39Å; L464-D530 HydrophobicContact CD1-CB 4.5Å; L464-D530 WeakPolarHBondContact CD1-OD2 3.01Å; L464-D530 WeakPolarHBondContact CG-OD2 3.17Å; L464-Y537 HydrophobicContact CD1-CE1 3.99Å; L464-Q545 HydrophobicContact CD2-CB 3.8Å; L464-Q545 HydrophobicContact CD2-CG 4.06Å; L464-R626 HydrophobicContact CB-CG 4.22Å; L464-R626 HydrophobicContact CD2-CB 3.88Å; L464-R626 HydrophobicContact CD2-CG 4.09Å; L464-R626 WeakPolarHBondContact O-CD 3.43Å
465	Q	89.2	Confident	90.8	Very high	141 Å²	141	56.6 Å²	56.6	66%	0.659	34%	0.338	S	S	*	.			trans	-75.7	-36.3	176.7	-64.2	-175.4	-2.8	0	0	110.6	V467 P495 D530	Q465-V467 HydrophobicContact CB-CG2 4.33Å; Q465-P495 WeakPolarHBondContact O-CG 3.34Å; Q465-D530 PolarHBondContact N-OD2 3.33Å
466	G	90.2	Very high	91.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.308	C	S	.	.			trans	90.8	22.6	177.5	0	0	0	0	0	113.7	D530 T655	G466-D530 PolarHBondContact N-OD1 3.5Å; G466-D530 PolarHBondContact N-OD2 3.44Å; G466-T655 WeakPolarHBondContact O-CB 3.18Å; G466-T655 PolarHBondContact O-OG1 2.96Å
467	V	95	Very high	92.1	Very high	25 Å²	25	50.5 Å²	50.5	15%	0.152	29%	0.29	C	S	.	.			trans	-80	122	175.6	-178.3	0	0	0	0	109	Q465 K469 T492 P495 L529 D530	Q465-V467 HydrophobicContact CB-CG2 4.33Å; V467-K469 HydrophobicContact CG1-CG 4.41Å; V467-T492 HydrophobicContact CG1-CG2 4.1Å; V467-P495 HydrophobicContact CG2-CG 3.91Å; V467-L529 WeakPolarHBondContact O-CA 3.24Å; V467-D530 PolarHBondContact N-OD1 2.95Å; V467-D530 PolarHBondContact O-N 2.97Å
468	V	96.1	Very high	92.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.4	179.3	178.2	0	0	0	0	109.6	F470 T492 L493 L516 V527 L528 L529 V627	V468-F470 HydrophobicContact CG1-CD2 4.09Å; V468-F470 HydrophobicContact CG1-CE2 3.86Å; V468-T492 CarbonylContact O-C 3.51Å; V468-T492 VanDerWaalsContact O-CA 3.26Å; V468-T492 WeakPolarHBondContact O-CA 3.43Å; V468-L493 HydrophobicContact CB-CB 4.04Å; V468-L493 HydrophobicContact CB-CD1 4.05Å; V468-L493 HydrophobicContact CB-CG 4.21Å; V468-L493 HydrophobicContact CG1-CD1 4.2Å; V468-L493 HydrophobicContact CG2-CD1 4.46Å; V468-L493 PolarHBondContact N-O 3.5Å; V468-L493 PolarHBondContact O-N 3.27Å; V468-L516 HydrophobicContact CB-CD1 4.28Å; V468-L516 HydrophobicContact CG1-CD1 3.36Å; V468-L516 HydrophobicContact CG1-CD2 4.49Å; V468-L516 HydrophobicContact CG2-CD1 3.89Å; V468-V527 HydrophobicContact CG1-CG1 4.42Å; V468-L528 CarbonylContact C-O 3.47Å; V468-L528 WeakPolarHBondContact CA-O 3.49Å; V468-L529 HydrophobicContact CG2-CD1 3.91Å; V468-V627 HydrophobicContact CG2-CG1 4.3Å; V468-V627 HydrophobicContact CG2-CG2 4.05Å
469	K	96.4	Very high	91.6	Very high	54 Å²	54	49.2 Å²	49.2	24%	0.235	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.7	176.3	-63.9	179.3	177.3	174.8	0	111.1	V467 T492 V527 L528 E531	V467-K469 HydrophobicContact CG1-CG 4.41Å; K469-T492 HydrophobicContact CG-CG2 3.82Å; K469-V527 WeakPolarHBondContact O-CA 3.4Å; K469-L528 HydrophobicContact CB-CB 4.26Å; K469-L528 PolarHBondContact N-O 3.29Å; K469-L528 PolarHBondContact O-N 3.14Å; K469-E531 WeakPolarHBondContact CD-OE1 3.23Å; K469-E531 WeakPolarHBondContact CE-OE1 3.47Å; K469-E531 IonicContact NZ-OE1 3.88Å; K469-E531 PolarHBondContact NZ-OE1 3.27Å; K469-E531 IonicContact NZ-OE2 2.8Å; K469-E531 PolarHBondContact NZ-OE2 3.36Å
470	F	96.6	Very high	91.4	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126	164.6	-79.4	-113.9	0	0	0	107.9	V468 V473 T490 F491 V512 L515 L516 V527	V468-F470 HydrophobicContact CG1-CD2 4.09Å; V468-F470 HydrophobicContact CG1-CE2 3.86Å; F470-V473 HydrophobicContact CB-CG2 4.03Å; F470-V473 HydrophobicContact CD1-CB 3.89Å; F470-V473 HydrophobicContact CD1-CG1 4.08Å; F470-V473 HydrophobicContact CD1-CG2 3.69Å; F470-V473 HydrophobicContact CE1-CG1 4.38Å; F470-V473 HydrophobicContact CG-CG2 4.22Å; F470-T490 VanDerWaalsContact O-CA 3.27Å; F470-T490 WeakPolarHBondContact O-CA 3.4Å; F470-F491 HydrophobicContact CB-CD1 3.75Å; F470-F491 HydrophobicContact CB-CE1 3.64Å; F470-F491 HydrophobicContact CB-CG 4.38Å; F470-F491 HydrophobicContact CB-CZ 4.15Å; F470-F491 AromaticContact CD1-CE1 3.78Å; F470-F491 HydrophobicContact CD1-CE1 3.78Å; F470-F491 HydrophobicContact CD1-CZ 4.04Å; F470-F491 HydrophobicContact CD2-CD1 4.44Å; F470-F491 HydrophobicContact CD2-CD2 4.5Å; F470-F491 AromaticContact CD2-CE1 3.72Å; F470-F491 HydrophobicContact CD2-CE1 3.72Å; F470-F491 AromaticContact CD2-CE2 3.76Å; F470-F491 HydrophobicContact CD2-CE2 3.76Å; F470-F491 AromaticContact CD2-CZ 3.32Å; F470-F491 HydrophobicContact CD2-CZ 3.32Å; F470-F491 HydrophobicContact CE1-CE1 4.4Å; F470-F491 HydrophobicContact CE1-CZ 4.31Å; F470-F491 HydrophobicContact CE2-CE1 4.34Å; F470-F491 HydrophobicContact CE2-CE2 4.16Å; F470-F491 AromaticContact CE2-CZ 3.64Å; F470-F491 HydrophobicContact CE2-CZ 3.64Å; F470-F491 HydrophobicContact CG-CD1 4.07Å; F470-F491 AromaticContact CG-CE1 3.42Å; F470-F491 HydrophobicContact CG-CE1 3.42Å; F470-F491 VanDerWaalsContact CG-CE1 3.42Å; F470-F491 HydrophobicContact CG-CE2 4.32Å; F470-F491 AromaticContact CG-CZ 3.57Å; F470-F491 HydrophobicContact CG-CZ 3.57Å; F470-F491 HydrophobicContact CZ-CZ 4.14Å; F470-F491 PolarHBondContact N-O 2.85Å; F470-F491 PolarHBondContact O-N 3Å; F470-V512 HydrophobicContact CE1-CG1 4.15Å; F470-V512 HydrophobicContact CE2-CG1 4.39Å; F470-V512 HydrophobicContact CZ-CG1 3.81Å; F470-L515 HydrophobicContact CE1-CB 4.38Å; F470-L515 HydrophobicContact CE1-CD1 4.43Å; F470-L516 HydrophobicContact CE2-CD1 4.45Å; F470-L516 HydrophobicContact CZ-CB 4.39Å; F470-V527 HydrophobicContact CD1-CG2 3.97Å; F470-V527 HydrophobicContact CD2-CG1 3.94Å; F470-V527 HydrophobicContact CE1-CG1 4.26Å; F470-V527 HydrophobicContact CE1-CG2 3.72Å; F470-V527 HydrophobicContact CE2-CG1 3.61Å; F470-V527 HydrophobicContact CG-CG1 4.39Å; F470-V527 HydrophobicContact CG-CG2 4.47Å; F470-V527 HydrophobicContact CZ-CG1 3.78Å; F470-V527 HydrophobicContact CZ-CG2 4.02Å
471	Q	95.8	Very high	91	Very high	70 Å²	70	57.5 Å²	57.5	33%	0.327	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	106.4	179.3	-66.8	-178.3	-11.4	0	0	110.1	V473 G525 Q526 L528	Q471-V473 PolarHBondContact O-N 3.1Å; Q471-G525 VanDerWaalsContact O-CA 3.24Å; Q471-G525 WeakPolarHBondContact O-CA 3.33Å; Q471-Q526 HydrophobicContact CB-CG 4.12Å; Q471-Q526 PolarHBondContact N-O 3.36Å; Q471-Q526 PolarHBondContact O-N 2.6Å; Q471-L528 HydrophobicContact CG-CD1 4.42Å
472	D	94.8	Very high	90.8	Very high	103 Å²	103	62.9 Å²	62.9	55%	0.551	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.2	41.1	179.7	-163.7	32.3	0	0	0	114.3	S474 G488 L489 T490 G525	D472-S474 PolarHBondContact O-N 3.22Å; D472-G488 WeakPolarHBondContact OD1-CA 3.48Å; D472-L489 PolarHBondContact N-O 3.16Å; D472-T490 PolarHBondContact N-OG1 3.17Å; D472-G525 WeakPolarHBondContact O-CA 3.5Å
473	V	95.9	Very high	91	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	120.7	-170.3	176.1	0	0	0	0	111	F470 Q471 G488 L489 L515 P522 G524 Q526 V527	F470-V473 HydrophobicContact CB-CG2 4.03Å; F470-V473 HydrophobicContact CD1-CB 3.89Å; F470-V473 HydrophobicContact CD1-CG1 4.08Å; F470-V473 HydrophobicContact CD1-CG2 3.69Å; F470-V473 HydrophobicContact CE1-CG1 4.38Å; F470-V473 HydrophobicContact CG-CG2 4.22Å; Q471-V473 PolarHBondContact O-N 3.1Å; V473-G488 WeakPolarHBondContact O-CA 3.25Å; V473-G488 PolarHBondContact O-N 2.79Å; V473-G488 VanDerWaalsContact O-N 3.08Å; V473-L489 HydrophobicContact CB-CB 4.47Å; V473-L489 PolarHBondContact N-O 3.43Å; V473-L489 PolarHBondContact O-N 3.31Å; V473-L515 HydrophobicContact CG1-CD1 3.84Å; V473-P522 HydrophobicContact CG1-CB 3.89Å; V473-G524 WeakPolarHBondContact CA-O 3.41Å; V473-Q526 VanDerWaalsContact CG2-O 3.25Å; V473-Q526 WeakPolarHBondContact CG2-O 3.07Å; V473-V527 HydrophobicContact CG1-CG2 4.41Å; V473-V527 HydrophobicContact CG2-CG2 3.97Å
474	S	94.8	Very high	91.1	Very high	37 Å²	37	62.7 Å²	62.7	26%	0.259	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.4	173.1	-62.1	0	0	0	0	110.1	D472 L486 G488 T523 G524	D472-S474 PolarHBondContact O-N 3.22Å; S474-L486 VanDerWaalsContact CA-O 3.29Å; S474-L486 WeakPolarHBondContact CA-O 3.29Å; S474-G488 PolarHBondContact OG-N 3.24Å; S474-T523 WeakPolarHBondContact O-CA 3.23Å; S474-T523 PolarHBondContact O-N 3.38Å; S474-G524 PolarHBondContact N-O 3.41Å; S474-G524 PolarHBondContact O-N 3.29Å
475	F	94.6	Very high	91.3	Very high	6 Å²	6	64 Å²	64	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	137.2	-176.5	179.4	-99.7	0	0	0	112.8	Y477 P484 V485 L486 T511 L515 Y520 Q521 T523	F475-Y477 AromaticContact CE1-CD1 3.83Å; F475-Y477 HydrophobicContact CE1-CD1 3.83Å; F475-Y477 AromaticContact CE1-CD2 3.92Å; F475-Y477 HydrophobicContact CE1-CD2 3.92Å; F475-Y477 AromaticContact CE1-CE1 3.89Å; F475-Y477 HydrophobicContact CE1-CE1 3.89Å; F475-Y477 AromaticContact CE1-CE2 3.98Å; F475-Y477 HydrophobicContact CE1-CE2 3.98Å; F475-Y477 AromaticContact CE1-CG 3.84Å; F475-Y477 HydrophobicContact CE1-CG 3.84Å; F475-Y477 AromaticContact CE1-CZ 3.96Å; F475-Y477 HydrophobicContact CZ-CD1 4.03Å; F475-Y477 HydrophobicContact CZ-CE1 4.27Å; F475-Y477 HydrophobicContact CZ-CG 4.3Å; F475-P484 CarbonylContact O-C 3.39Å; F475-V485 PolarHBondContact O-N 3.03Å; F475-L486 HydrophobicContact CB-CB 4.05Å; F475-L486 HydrophobicContact CB-CD1 4.18Å; F475-L486 HydrophobicContact CB-CG 4.33Å; F475-L486 PolarHBondContact N-O 2.78Å; F475-L486 PolarHBondContact O-N 3.13Å; F475-L486 VanDerWaalsContact O-N 3.1Å; F475-T511 HydrophobicContact CD1-CG2 3.3Å; F475-T511 HydrophobicContact CE1-CG2 3.6Å; F475-T511 HydrophobicContact CG-CG2 4.22Å; F475-L515 HydrophobicContact CB-CD1 4.11Å; F475-L515 HydrophobicContact CD2-CD2 3.89Å; F475-L515 HydrophobicContact CE2-CD2 4.2Å; F475-L515 HydrophobicContact CG-CD1 4.33Å; F475-L515 HydrophobicContact CG-CD2 4.26Å; F475-Y520 HydrophobicContact CE2-CD1 4.38Å; F475-Y520 HydrophobicContact CE2-CG 4.14Å; F475-Y520 AromaticContact CZ-CD1 3.9Å; F475-Y520 HydrophobicContact CZ-CD1 3.9Å; F475-Y520 HydrophobicContact CZ-CD2 4.3Å; F475-Y520 AromaticContact CZ-CG 3.69Å; F475-Y520 HydrophobicContact CZ-CG 3.69Å; F475-Q521 WeakPolarHBondContact CD2-O 3.41Å; F475-Q521 VanDerWaalsContact CE2-O 3.26Å; F475-Q521 WeakPolarHBondContact CE2-O 3.45Å; F475-T523 WeakPolarHBondContact CA-OG1 3.4Å
476	A	92	Very high	91.5	Very high	15 Å²	15	57.2 Å²	57.2	12%	0.124	29%	0.288	C	S	.	.			trans	-126.6	141.2	166.2	0	0	0	0	0	109.5	P481 T523	A476-P481 WeakPolarHBondContact CB-O 3.32Å; A476-T523 PolarHBondContact N-OG1 3.3Å
477	Y	89.4	Confident	91.7	Very high	59 Å²	59	61.2 Å²	61.2	23%	0.231	31%	0.306	C	S	.	.			trans	-66.6	142.5	174.6	-76.6	-82.1	0	0	0	110.2	F475 N479 R480 V485 T511 Y520	F475-Y477 AromaticContact CE1-CD1 3.83Å; F475-Y477 HydrophobicContact CE1-CD1 3.83Å; F475-Y477 AromaticContact CE1-CD2 3.92Å; F475-Y477 HydrophobicContact CE1-CD2 3.92Å; F475-Y477 AromaticContact CE1-CE1 3.89Å; F475-Y477 HydrophobicContact CE1-CE1 3.89Å; F475-Y477 AromaticContact CE1-CE2 3.98Å; F475-Y477 HydrophobicContact CE1-CE2 3.98Å; F475-Y477 AromaticContact CE1-CG 3.84Å; F475-Y477 HydrophobicContact CE1-CG 3.84Å; F475-Y477 AromaticContact CE1-CZ 3.96Å; F475-Y477 HydrophobicContact CZ-CD1 4.03Å; F475-Y477 HydrophobicContact CZ-CE1 4.27Å; F475-Y477 HydrophobicContact CZ-CG 4.3Å; Y477-N479 PolarHBondContact O-N 3.35Å; Y477-N479 VanDerWaalsContact O-N 3.11Å; Y477-R480 CarbonylContact O-C 3.37Å; Y477-R480 PolarHBondContact O-N 2.92Å; Y477-V485 HydrophobicContact CD2-CG2 3.82Å; Y477-V485 HydrophobicContact CE2-CG2 4.01Å; Y477-T511 HydrophobicContact CE2-CG2 4.29Å; Y477-T511 PolarHBondContact OH-OG1 3.32Å; Y477-Y520 HydrophobicContact CD1-CE1 4.21Å; Y477-Y520 HydrophobicContact CD1-CE2 4.36Å; Y477-Y520 AromaticContact CD1-CZ 4Å; Y477-Y520 HydrophobicContact CE1-CD2 4.3Å; Y477-Y520 HydrophobicContact CE1-CE1 4.42Å; Y477-Y520 AromaticContact CE1-CE2 3.76Å; Y477-Y520 HydrophobicContact CE1-CE2 3.76Å; Y477-Y520 AromaticContact CE1-CZ 3.82Å
478	P	84.4	Confident	91.6	Very high	63 Å²	63	61.3 Å²	61.3	41%	0.409	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-37.1	-178.3	-28.3	35.2	0	0	0	114	R480 P481	P478-R480 PolarHBondContact O-N 3.27Å; P478-P481 WeakPolarHBondContact O-CD 3.29Å
479	N	82.4	Confident	91.5	Very high	64 Å²	64	61.3 Å²	61.3	34%	0.342	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-10.2	-178	-54.3	16.9	0	0	0	112.8	E243 Y477	E243-N479 WeakPolarHBondContact CG-ND2 3.36Å; E243-N479 PolarHBondContact OE1-OD1 3.36Å; Y477-N479 PolarHBondContact O-N 3.35Å; Y477-N479 VanDerWaalsContact O-N 3.11Å
480	R	86	Confident	91.4	Very high	176 Å²	176	63 Å²	63	66%	0.664	33%	0.327	S	S	*	.			trans	-146.1	64.4	-178.8	-64.1	-174.7	-177.5	145.4	0.9	110.8	Y477 P478 D482 R483	Y477-R480 CarbonylContact O-C 3.37Å; Y477-R480 PolarHBondContact O-N 2.92Å; P478-R480 PolarHBondContact O-N 3.27Å; R480-D482 PolarHBondContact O-N 3.36Å; R480-R483 PolarHBondContact O-N 3.49Å
481	P	84.4	Confident	91.3	Very high	85 Å²	85	63.6 Å²	63.6	55%	0.552	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-30.7	-175.7	27.5	-33.7	0	0	0	112.2	A476 P478 R483	A476-P481 WeakPolarHBondContact CB-O 3.32Å; P478-P481 WeakPolarHBondContact O-CD 3.29Å; P481-R483 PolarHBondContact O-N 3.37Å
482	D	87.4	Confident	91.3	Very high	151 Å²	151	62.3 Å²	62.3	81%	0.807	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-8.7	-178.4	-52.5	-47.3	0	0	0	114.1	R480 P484	R480-D482 PolarHBondContact O-N 3.36Å; D482-P484 WeakPolarHBondContact O-CD 3.42Å
483	R	88.4	Confident	91.3	Very high	190 Å²	190	57.4 Å²	57.4	72%	0.717	30%	0.3	S	S	*	.	S	Bend	trans	-119.6	85.4	-178.2	-68.9	-170.8	178.4	-170.8	0.3	110.3	R480 P481 V485	R480-R483 PolarHBondContact O-N 3.49Å; P481-R483 PolarHBondContact O-N 3.37Å; R483-V485 PolarHBondContact O-N 3.46Å
484	P	89.4	Confident	91.1	Very high	66 Å²	66	64 Å²	64	43%	0.429	33%	0.325	S	S	.	.			trans	-63.8	122.8	176.1	26.1	-33.4	0	0	0	110.4	F475 D482 K487	F475-P484 CarbonylContact O-C 3.39Å; D482-P484 WeakPolarHBondContact O-CD 3.42Å; P484-K487 HydrophobicContact CB-CG 4.38Å
485	V	93.4	Very high	91	Very high	37 Å²	37	64.2 Å²	64.2	22%	0.224	33%	0.325	C	S	.	.	S	Bend	trans	-83.7	-36.9	178.4	178.5	0	0	0	0	110.6	F475 Y477 R483 T511 G678	F475-V485 PolarHBondContact O-N 3.03Å; Y477-V485 HydrophobicContact CD2-CG2 3.82Å; Y477-V485 HydrophobicContact CE2-CG2 4.01Å; R483-V485 PolarHBondContact O-N 3.46Å; V485-T511 HydrophobicContact CG1-CG2 4.45Å; V485-G678 WeakPolarHBondContact O-CA 3.47Å
486	L	94.7	Very high	90.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.3	177.5	-61.6	-176.4	0	0	0	109.3	S474 F475 L489 T511 V512 L515 L675	S474-L486 VanDerWaalsContact CA-O 3.29Å; S474-L486 WeakPolarHBondContact CA-O 3.29Å; F475-L486 HydrophobicContact CB-CB 4.05Å; F475-L486 HydrophobicContact CB-CD1 4.18Å; F475-L486 HydrophobicContact CB-CG 4.33Å; F475-L486 PolarHBondContact N-O 2.78Å; F475-L486 PolarHBondContact O-N 3.13Å; F475-L486 VanDerWaalsContact O-N 3.1Å; L486-L489 HydrophobicContact CB-CD1 3.71Å; L486-L489 HydrophobicContact CD2-CD1 3.96Å; L486-L489 HydrophobicContact CD2-CD2 3.95Å; L486-L489 HydrophobicContact CG-CD1 4.31Å; L486-T511 HydrophobicContact CD1-CG2 3.8Å; L486-T511 HydrophobicContact CG-CG2 4.07Å; L486-V512 HydrophobicContact CD1-CG2 4.22Å; L486-V512 HydrophobicContact CD2-CG2 4.26Å; L486-L515 HydrophobicContact CD1-CD1 3.49Å; L486-L515 VanDerWaalsContact CD1-CD1 3.49Å; L486-L675 HydrophobicContact CD2-CD2 4.41Å
487	K	93.8	Very high	90.4	Very high	84 Å²	84	67 Å²	67	37%	0.365	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	82	-170.2	-60.4	171.2	-172	154.5	0	110.2	P484 E677 G678 K679	P484-K487 HydrophobicContact CB-CG 4.38Å; K487-E677 PolarHBondContact NZ-O 3.28Å; K487-G678 PolarHBondContact N-O 3.23Å; K487-K679 HydrophobicContact CB-CG 3.86Å; K487-K679 HydrophobicContact CD-CG 4.37Å
488	G	92.4	Very high	90.3	Very high	26 Å²	26	65.3 Å²	65.3	27%	0.268	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	69	49.5	174.7	0	0	0	0	0	114.7	D472 V473 S474	D472-G488 WeakPolarHBondContact OD1-CA 3.48Å; V473-G488 WeakPolarHBondContact O-CA 3.25Å; V473-G488 PolarHBondContact O-N 2.79Å; V473-G488 VanDerWaalsContact O-N 3.08Å; S474-G488 PolarHBondContact OG-N 3.24Å
489	L	93.8	Very high	90.6	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	128.7	178.5	-79.4	70.4	0	0	0	111.1	D472 V473 L486 F491 V512 L675 G678 L680	D472-L489 PolarHBondContact N-O 3.16Å; V473-L489 HydrophobicContact CB-CB 4.47Å; V473-L489 PolarHBondContact N-O 3.43Å; V473-L489 PolarHBondContact O-N 3.31Å; L486-L489 HydrophobicContact CB-CD1 3.71Å; L486-L489 HydrophobicContact CD2-CD1 3.96Å; L486-L489 HydrophobicContact CD2-CD2 3.95Å; L486-L489 HydrophobicContact CG-CD1 4.31Å; L489-F491 HydrophobicContact CB-CD1 4.46Å; L489-F491 HydrophobicContact CB-CE1 4.37Å; L489-F491 HydrophobicContact CD2-CE1 4.18Å; L489-V512 HydrophobicContact CD2-CG2 3.91Å; L489-L675 HydrophobicContact CD2-CD1 3.76Å; L489-L675 HydrophobicContact CG-CD1 4.22Å; L489-G678 WeakPolarHBondContact CD1-O 3.48Å; L489-L680 HydrophobicContact CB-CD1 4.46Å; L489-L680 HydrophobicContact CG-CD1 4.43Å; L489-L680 HydrophobicContact CG-CG 4.41Å
490	T	94.8	Very high	90.9	Very high	90 Å²	90	59.3 Å²	59.3	55%	0.552	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	116.6	173.1	-57.2	0	0	0	0	110.4	F470 D472	F470-T490 VanDerWaalsContact O-CA 3.27Å; F470-T490 WeakPolarHBondContact O-CA 3.4Å; D472-T490 PolarHBondContact N-OG1 3.17Å
491	F	94.7	Very high	91.1	Very high	13 Å²	13	51 Å²	51	6%	0.057	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	169.8	175.6	65.1	-83.3	0	0	0	110.7	F470 L489 L493 V512 L673 L680	F470-F491 HydrophobicContact CB-CD1 3.75Å; F470-F491 HydrophobicContact CB-CE1 3.64Å; F470-F491 HydrophobicContact CB-CG 4.38Å; F470-F491 HydrophobicContact CB-CZ 4.15Å; F470-F491 AromaticContact CD1-CE1 3.78Å; F470-F491 HydrophobicContact CD1-CE1 3.78Å; F470-F491 HydrophobicContact CD1-CZ 4.04Å; F470-F491 HydrophobicContact CD2-CD1 4.44Å; F470-F491 HydrophobicContact CD2-CD2 4.5Å; F470-F491 AromaticContact CD2-CE1 3.72Å; F470-F491 HydrophobicContact CD2-CE1 3.72Å; F470-F491 AromaticContact CD2-CE2 3.76Å; F470-F491 HydrophobicContact CD2-CE2 3.76Å; F470-F491 AromaticContact CD2-CZ 3.32Å; F470-F491 HydrophobicContact CD2-CZ 3.32Å; F470-F491 HydrophobicContact CE1-CE1 4.4Å; F470-F491 HydrophobicContact CE1-CZ 4.31Å; F470-F491 HydrophobicContact CE2-CE1 4.34Å; F470-F491 HydrophobicContact CE2-CE2 4.16Å; F470-F491 AromaticContact CE2-CZ 3.64Å; F470-F491 HydrophobicContact CE2-CZ 3.64Å; F470-F491 HydrophobicContact CG-CD1 4.07Å; F470-F491 AromaticContact CG-CE1 3.42Å; F470-F491 HydrophobicContact CG-CE1 3.42Å; F470-F491 VanDerWaalsContact CG-CE1 3.42Å; F470-F491 HydrophobicContact CG-CE2 4.32Å; F470-F491 AromaticContact CG-CZ 3.57Å; F470-F491 HydrophobicContact CG-CZ 3.57Å; F470-F491 HydrophobicContact CZ-CZ 4.14Å; F470-F491 PolarHBondContact N-O 2.85Å; F470-F491 PolarHBondContact O-N 3Å; L489-F491 HydrophobicContact CB-CD1 4.46Å; L489-F491 HydrophobicContact CB-CE1 4.37Å; L489-F491 HydrophobicContact CD2-CE1 4.18Å; F491-L493 HydrophobicContact CD2-CD2 3.91Å; F491-L493 HydrophobicContact CD2-CG 4.24Å; F491-L493 HydrophobicContact CE2-CD1 4.34Å; F491-L493 HydrophobicContact CE2-CD2 3.77Å; F491-L493 HydrophobicContact CE2-CG 3.93Å; F491-V512 HydrophobicContact CZ-CG1 3.82Å; F491-L673 HydrophobicContact CB-CD1 4.08Å; F491-L673 HydrophobicContact CB-CD2 4.32Å; F491-L673 HydrophobicContact CD1-CD1 4.47Å; F491-L673 HydrophobicContact CD2-CD1 3.46Å; F491-L673 VanDerWaalsContact CD2-CD1 3.46Å; F491-L673 HydrophobicContact CE2-CD1 3.96Å; F491-L673 HydrophobicContact CG-CD1 3.76Å; F491-L680 HydrophobicContact CB-CD1 3.97Å; F491-L680 HydrophobicContact CD1-CD1 3.59Å; F491-L680 HydrophobicContact CE1-CD1 4.48Å; F491-L680 HydrophobicContact CG-CD1 4.15Å
492	T	95.1	Very high	91.2	Very high	42 Å²	42	47.5 Å²	47.5	26%	0.258	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	135.7	179.1	-56.6	0	0	0	0	109.5	V467 V468 K469 R494 Q671	V467-T492 HydrophobicContact CG1-CG2 4.1Å; V468-T492 CarbonylContact O-C 3.51Å; V468-T492 VanDerWaalsContact O-CA 3.26Å; V468-T492 WeakPolarHBondContact O-CA 3.43Å; K469-T492 HydrophobicContact CG-CG2 3.82Å; T492-R494 HydrophobicContact CG2-CG 4.27Å; T492-Q671 PolarHBondContact O-OE1 2.92Å
493	L	94.3	Very high	91.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.8	169.2	-47.7	175.1	0	0	0	108.1	V468 F491 T499 L516 T655 L657	V468-L493 HydrophobicContact CB-CB 4.04Å; V468-L493 HydrophobicContact CB-CD1 4.05Å; V468-L493 HydrophobicContact CB-CG 4.21Å; V468-L493 HydrophobicContact CG1-CD1 4.2Å; V468-L493 HydrophobicContact CG2-CD1 4.46Å; V468-L493 PolarHBondContact N-O 3.5Å; V468-L493 PolarHBondContact O-N 3.27Å; F491-L493 HydrophobicContact CD2-CD2 3.91Å; F491-L493 HydrophobicContact CD2-CG 4.24Å; F491-L493 HydrophobicContact CE2-CD1 4.34Å; F491-L493 HydrophobicContact CE2-CD2 3.77Å; F491-L493 HydrophobicContact CE2-CG 3.93Å; L493-T499 HydrophobicContact CD2-CG2 3.62Å; L493-L516 HydrophobicContact CD1-CD2 4.19Å; L493-T655 HydrophobicContact CB-CG2 3.52Å; L493-T655 HydrophobicContact CD1-CG2 4.49Å; L493-L657 HydrophobicContact CD1-CB 4.14Å; L493-L657 HydrophobicContact CD1-CD1 4.39Å; L493-L657 HydrophobicContact CD1-CD2 4.3Å; L493-L657 HydrophobicContact CD2-CD1 4.17Å
494	R	93	Very high	90.8	Very high	139 Å²	139	34.2 Å²	34.2	53%	0.525	20%	0.195	S	C	.	.			trans	-114.1	147.9	-174.2	-60.8	176.1	178.4	-121.7	0.5	111.4	T492 E497 T655	T492-R494 HydrophobicContact CG2-CG 4.27Å; R494-E497 HydrophobicContact CB-CB 4.4Å; R494-E497 HydrophobicContact CB-CG 4.21Å; R494-E497 WeakPolarHBondContact CB-OE2 3.43Å; R494-E497 WeakPolarHBondContact CD-OE1 3.48Å; R494-E497 WeakPolarHBondContact CD-OE2 3.45Å; R494-E497 PolarHBondContact O-N 3.45Å; R494-T655 PolarHBondContact O-OG1 3.42Å
495	P	91.7	Very high	90.4	Very high	41 Å²	41	37.4 Å²	37.4	27%	0.266	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	142.9	171	-22.8	34.3	0	0	0	111.6	Q465 V467 E497 T655	Q465-P495 WeakPolarHBondContact O-CG 3.34Å; V467-P495 HydrophobicContact CG2-CG 3.91Å; P495-E497 PolarHBondContact O-N 3.43Å; P495-T655 WeakPolarHBondContact CA-OG1 3.26Å
496	G	86.7	Confident	89.8	Confident	21 Å²	21	39.4 Å²	39.4	22%	0.216	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-15.1	-174.8	0	0	0	0	0	114.1	N649 G652 R654	G496-N649 PolarHBondContact O-ND2 2.98Å; G496-G652 PolarHBondContact N-O 3.47Å; G496-R654 WeakPolarHBondContact CA-O 3.35Å; G496-R654 PolarHBondContact N-O 3.42Å
497	E	87.8	Confident	89.4	Confident	58 Å²	58	39.5 Å²	39.5	27%	0.271	24%	0.238	S	C	.	.			trans	-98.6	135.7	-176	-66.5	178.1	-170.8	0	0	112.1	R494 P495 V656 H670	R494-E497 HydrophobicContact CB-CB 4.4Å; R494-E497 HydrophobicContact CB-CG 4.21Å; R494-E497 WeakPolarHBondContact CB-OE2 3.43Å; R494-E497 WeakPolarHBondContact CD-OE1 3.48Å; R494-E497 WeakPolarHBondContact CD-OE2 3.45Å; R494-E497 PolarHBondContact O-N 3.45Å; P495-E497 PolarHBondContact O-N 3.43Å; E497-V656 PolarHBondContact O-N 3.09Å; E497-H670 HydrophobicContact CB-CB 4.14Å; E497-H670 HydrophobicContact CG-CB 4.25Å
498	V	88.4	Confident	89.1	Confident	25 Å²	25	35.8 Å²	35.8	15%	0.152	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.6	167.2	-176.1	0	0	0	0	108.4	N649 V656 V658 A669 H670 Q671	V498-N649 VanDerWaalsContact CG2-ND2 3.33Å; V498-N649 WeakPolarHBondContact CG2-ND2 3.12Å; V498-V656 HydrophobicContact CG1-CB 4.44Å; V498-V656 HydrophobicContact CG1-CG1 4.3Å; V498-V656 HydrophobicContact CG2-CB 4.31Å; V498-V658 HydrophobicContact CG1-CG2 3.86Å; V498-A669 CarbonylContact O-C 3.53Å; V498-H670 PolarHBondContact N-ND1 3.29Å; V498-H670 VanDerWaalsContact N-ND1 3.15Å; V498-H670 PolarHBondContact O-N 3.01Å; V498-Q671 PolarHBondContact O-N 2.97Å
499	T	90.3	Very high	89	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.1	176	-56.3	0	0	0	0	110.5	L493 V656 L657 V658 Q671 L673	L493-T499 HydrophobicContact CD2-CG2 3.62Å; T499-V656 PolarHBondContact N-O 3.45Å; T499-L657 HydrophobicContact CG2-CD1 4.37Å; T499-V658 PolarHBondContact O-N 3.08Å; T499-Q671 CarbonylContact C-O 3.59Å; T499-Q671 VanDerWaalsContact CA-O 3.32Å; T499-Q671 WeakPolarHBondContact CA-O 3.31Å; T499-Q671 HydrophobicContact CG2-CB 4.12Å; T499-Q671 HydrophobicContact CG2-CG 4.17Å; T499-L673 HydrophobicContact CG2-CD1 3.68Å; T499-L673 HydrophobicContact CG2-CG 3.89Å
500	A	88.9	Confident	88.7	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126	173.4	0	0	0	0	0	111.2	V502 V658 V666 A669 Q671 I672 L673	A500-V502 HydrophobicContact CB-CG2 4.44Å; A500-V658 CarbonylContact C-O 3.57Å; A500-V658 VanDerWaalsContact CA-O 3.31Å; A500-V658 WeakPolarHBondContact CA-O 3.47Å; A500-V666 HydrophobicContact CB-CG2 4.38Å; A500-A669 HydrophobicContact CB-CB 3.54Å; A500-Q671 PolarHBondContact N-O 3.06Å; A500-I672 WeakPolarHBondContact O-CA 3.31Å; A500-L673 PolarHBondContact O-N 2.88Å
501	L	89.6	Confident	88.6	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.3	172	-175.6	65.9	0	0	0	109.7	K509 V512 L657 V658 I659 A660 L673 L675	L501-K509 HydrophobicContact CD2-CB 4.07Å; L501-K509 HydrophobicContact CD2-CG 4.38Å; L501-K509 HydrophobicContact CG-CG 4.37Å; L501-V512 HydrophobicContact CD2-CB 4.05Å; L501-V512 HydrophobicContact CD2-CG1 4.23Å; L501-V512 HydrophobicContact CD2-CG2 4.1Å; L501-L657 HydrophobicContact CB-CD1 4.13Å; L501-V658 PolarHBondContact N-O 3.28Å; L501-I659 HydrophobicContact CB-CG1 4.39Å; L501-I659 HydrophobicContact CD2-CG1 4.34Å; L501-I659 WeakPolarHBondContact O-CA 3.31Å; L501-A660 PolarHBondContact O-N 3.49Å; L501-L673 WeakPolarHBondContact CA-O 3.39Å; L501-L673 HydrophobicContact CD1-CB 3.73Å; L501-L675 HydrophobicContact CD1-CB 4.03Å
502	V	87.1	Confident	88.6	Confident	12 Å²	12	33.5 Å²	33.5	7%	0.073	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	146.1	-172.1	-170.1	0	0	0	0	110.4	A500 V666 I672 L673 V674 L675 L695	A500-V502 HydrophobicContact CB-CG2 4.44Å; V502-V666 HydrophobicContact CG2-CB 4.48Å; V502-V666 HydrophobicContact CG2-CG1 4.12Å; V502-V666 HydrophobicContact CG2-CG2 3.47Å; V502-V666 VanDerWaalsContact CG2-CG2 3.47Å; V502-I672 HydrophobicContact CG2-CG2 4.36Å; V502-L673 PolarHBondContact N-O 3.21Å; V502-V674 CarbonylContact O-C 3.5Å; V502-V674 WeakPolarHBondContact O-CA 3.43Å; V502-L675 PolarHBondContact O-N 3.45Å; V502-L695 HydrophobicContact CG1-CD2 3.84Å
503	G	84.8	Confident	88.4	Confident	8 Å²	8	31.6 Å²	31.6	8%	0.082	20%	0.196	C	C	.	.			trans	167.3	167.9	175.1	0	0	0	0	0	112.6	K509 H661 L675	G503-K509 PolarHBondContact O-NZ 3.47Å; G503-H661 PolarHBondContact O-CE1 3.34Å; G503-L675 WeakPolarHBondContact CA-O 3.43Å
504	P	81.5	Confident	88.4	Confident	54 Å²	54	32.2 Å²	32.2	35%	0.351	20%	0.201	S	C	.	.			trans	-63.6	166.2	179.9	27	-34.2	0	0	0	112.3	G506 S507 K509	P504-G506 PolarHBondContact O-N 2.9Å; P504-S507 WeakPolarHBondContact O-CB 3.43Å; P504-S507 PolarHBondContact O-N 2.95Å; P504-S507 PolarHBondContact O-OG 3.5Å; P504-S507 VanDerWaalsContact O-OG 3.06Å; P504-K509 PolarHBondContact O-NZ 3.21Å; P504-K509 VanDerWaalsContact O-NZ 3.07Å
505	N	82	Confident	88.4	Confident	133 Å²	133	25.8 Å²	25.8	71%	0.711	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	137.9	174.2	-70.9	-11.6	0	0	0	110.2	S507 H661	N505-S507 VanDerWaalsContact C-N 3.32Å; N505-S507 PolarHBondContact O-N 3.34Å; N505-H661 PolarHBondContact OD1-CE1 2.84Å
506	G	81	Confident	88.5	Confident	79 Å²	79	23.8 Å²	23.8	81%	0.814	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	4.4	-176.1	0	0	0	0	0	115.8	P504 G508	P504-G506 PolarHBondContact O-N 2.9Å; G506-G508 PolarHBondContact O-N 2.9Å
507	S	84.9	Confident	88.7	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.021	16%	0.161	C	C	.	.	S	Bend	trans	-71.4	-13.1	177.2	69.9	0	0	0	0	115	P504 N505 K509 L675 G678	P504-S507 WeakPolarHBondContact O-CB 3.43Å; P504-S507 PolarHBondContact O-N 2.95Å; P504-S507 PolarHBondContact O-OG 3.5Å; P504-S507 VanDerWaalsContact O-OG 3.06Å; N505-S507 VanDerWaalsContact C-N 3.32Å; N505-S507 PolarHBondContact O-N 3.34Å; S507-K509 WeakPolarHBondContact OG-CG 3.31Å; S507-L675 VanDerWaalsContact CB-O 3.25Å; S507-L675 WeakPolarHBondContact CB-O 3.4Å; S507-L675 WeakPolarHBondContact O-CD2 3.46Å; S507-L675 WeakPolarHBondContact O-CG 3.3Å; S507-L675 PolarHBondContact OG-O 3.04Å; S507-G678 PolarHBondContact O-N 2.98Å
508	G	87.9	Confident	88.9	Confident	6 Å²	6	23 Å²	23	6%	0.062	16%	0.155	C	C	.	.	S	Bend	trans	107.1	13.5	177.5	0	0	0	0	0	115.8	G506 T511 V512	G506-G508 PolarHBondContact O-N 2.9Å; G508-T511 VanDerWaalsContact O-CB 3.22Å; G508-T511 WeakPolarHBondContact O-CB 3.28Å; G508-T511 PolarHBondContact O-N 3.46Å; G508-V512 PolarHBondContact O-N 3.45Å; G508-V512 VanDerWaalsContact O-N 3.15Å
509	K	89.9	Confident	89	Confident	11 Å²	11	24.3 Å²	24.3	5%	0.048	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-53.1	-175.8	-49.7	-176.1	-59.4	-84	0	113.3	L501 G503 P504 S507 T511 V512 A513 I659 H661 L675	L501-K509 HydrophobicContact CD2-CB 4.07Å; L501-K509 HydrophobicContact CD2-CG 4.38Å; L501-K509 HydrophobicContact CG-CG 4.37Å; G503-K509 PolarHBondContact O-NZ 3.47Å; P504-K509 PolarHBondContact O-NZ 3.21Å; P504-K509 VanDerWaalsContact O-NZ 3.07Å; S507-K509 WeakPolarHBondContact OG-CG 3.31Å; K509-T511 PolarHBondContact O-N 3.48Å; K509-V512 WeakPolarHBondContact O-CB 3.47Å; K509-V512 PolarHBondContact O-N 3.07Å; K509-A513 PolarHBondContact O-N 3.31Å; K509-I659 HydrophobicContact CB-CD1 4.29Å; K509-I659 HydrophobicContact CB-CG1 4.44Å; K509-I659 HydrophobicContact CB-CG2 3.59Å; K509-I659 HydrophobicContact CD-CG2 3.76Å; K509-I659 HydrophobicContact CG-CG2 4.26Å; K509-H661 WeakPolarHBondContact CE-NE2 3.43Å; K509-H661 PolarHBondContact NZ-CE1 2.84Å; K509-H661 VanDerWaalsContact NZ-CE1 3.31Å; K509-H661 PolarHBondContact NZ-NE2 3.41Å; K509-L675 HydrophobicContact CG-CD2 4.16Å
510	S	89.1	Confident	89.1	Confident	63 Å²	63	25.3 Å²	25.3	44%	0.441	17%	0.165	S	C	.	.	H	α-helix	trans	-64.3	-25.6	176.6	-48.8	0	0	0	0	112.5	A513 A514 D631	S510-A513 PolarHBondContact O-N 3.26Å; S510-A514 PolarHBondContact O-N 3.27Å; S510-D631 WeakPolarHBondContact CB-OD2 3.33Å; S510-D631 PolarHBondContact OG-OD2 3.46Å
511	T	92.3	Very high	89.1	Confident	7 Å²	7	27.9 Å²	27.9	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-37.8	172.1	-49	0	0	0	0	111.6	F475 Y477 V485 L486 G508 K509 A514 L515	F475-T511 HydrophobicContact CD1-CG2 3.3Å; F475-T511 HydrophobicContact CE1-CG2 3.6Å; F475-T511 HydrophobicContact CG-CG2 4.22Å; Y477-T511 HydrophobicContact CE2-CG2 4.29Å; Y477-T511 PolarHBondContact OH-OG1 3.32Å; V485-T511 HydrophobicContact CG1-CG2 4.45Å; L486-T511 HydrophobicContact CD1-CG2 3.8Å; L486-T511 HydrophobicContact CG-CG2 4.07Å; G508-T511 VanDerWaalsContact O-CB 3.22Å; G508-T511 WeakPolarHBondContact O-CB 3.28Å; G508-T511 PolarHBondContact O-N 3.46Å; K509-T511 PolarHBondContact O-N 3.48Å; T511-A514 PolarHBondContact O-N 3.16Å; T511-L515 WeakPolarHBondContact O-CG 3.28Å; T511-L515 PolarHBondContact O-N 3.24Å
512	V	93.6	Very high	89.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.7	-44.8	174	174.8	0	0	0	0	110.6	F470 L486 L489 F491 L501 G508 K509 A514 L515 L516 L657	F470-V512 HydrophobicContact CE1-CG1 4.15Å; F470-V512 HydrophobicContact CE2-CG1 4.39Å; F470-V512 HydrophobicContact CZ-CG1 3.81Å; L486-V512 HydrophobicContact CD1-CG2 4.22Å; L486-V512 HydrophobicContact CD2-CG2 4.26Å; L489-V512 HydrophobicContact CD2-CG2 3.91Å; F491-V512 HydrophobicContact CZ-CG1 3.82Å; L501-V512 HydrophobicContact CD2-CB 4.05Å; L501-V512 HydrophobicContact CD2-CG1 4.23Å; L501-V512 HydrophobicContact CD2-CG2 4.1Å; G508-V512 PolarHBondContact O-N 3.45Å; G508-V512 VanDerWaalsContact O-N 3.15Å; K509-V512 WeakPolarHBondContact O-CB 3.47Å; K509-V512 PolarHBondContact O-N 3.07Å; V512-A514 PolarHBondContact O-N 3.47Å; V512-L515 PolarHBondContact O-N 2.93Å; V512-L516 WeakPolarHBondContact O-CB 3.48Å; V512-L516 PolarHBondContact O-N 2.7Å; V512-L657 HydrophobicContact CG1-CD2 4.34Å
513	A	92.8	Very high	89.5	Confident	3 Å²	3	33.6 Å²	33.6	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-45.3	175.1	0	0	0	0	0	111.8	K509 S510 L515 L516 Q517 I629 I659	K509-A513 PolarHBondContact O-N 3.31Å; S510-A513 PolarHBondContact O-N 3.26Å; A513-L515 PolarHBondContact O-N 2.96Å; A513-L516 PolarHBondContact O-N 3.49Å; A513-Q517 WeakPolarHBondContact O-CG 3.38Å; A513-Q517 PolarHBondContact O-N 3.46Å; A513-I629 HydrophobicContact CB-CG2 3.82Å; A513-I659 HydrophobicContact CB-CD1 4.02Å
514	A	92.3	Very high	89.8	Confident	13 Å²	13	34.6 Å²	34.6	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-39.7	179.8	0	0	0	0	0	113	S510 T511 V512 Q517 N518 L519 Y520	S510-A514 PolarHBondContact O-N 3.27Å; T511-A514 PolarHBondContact O-N 3.16Å; V512-A514 PolarHBondContact O-N 3.47Å; A514-Q517 PolarHBondContact O-N 3.46Å; A514-N518 PolarHBondContact O-N 3.29Å; A514-L519 HydrophobicContact CB-CB 4.36Å; A514-L519 WeakPolarHBondContact O-CB 3.49Å; A514-L519 PolarHBondContact O-N 3.2Å; A514-Y520 HydrophobicContact CB-CD2 3.9Å; A514-Y520 HydrophobicContact CB-CE2 4.29Å
515	L	93.6	Very high	90.4	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-40	174.3	-71	177.4	0	0	0	112.1	F470 V473 F475 L486 T511 V512 A513 Q517 N518 Y520 V527	F470-L515 HydrophobicContact CE1-CB 4.38Å; F470-L515 HydrophobicContact CE1-CD1 4.43Å; V473-L515 HydrophobicContact CG1-CD1 3.84Å; F475-L515 HydrophobicContact CB-CD1 4.11Å; F475-L515 HydrophobicContact CD2-CD2 3.89Å; F475-L515 HydrophobicContact CE2-CD2 4.2Å; F475-L515 HydrophobicContact CG-CD1 4.33Å; F475-L515 HydrophobicContact CG-CD2 4.26Å; L486-L515 HydrophobicContact CD1-CD1 3.49Å; L486-L515 VanDerWaalsContact CD1-CD1 3.49Å; T511-L515 WeakPolarHBondContact O-CG 3.28Å; T511-L515 PolarHBondContact O-N 3.24Å; V512-L515 PolarHBondContact O-N 2.93Å; A513-L515 PolarHBondContact O-N 2.96Å; L515-Q517 VanDerWaalsContact C-N 3.25Å; L515-Q517 PolarHBondContact O-N 3.02Å; L515-N518 PolarHBondContact O-N 3.02Å; L515-Y520 WeakPolarHBondContact CD2-O 3.44Å; L515-V527 HydrophobicContact CB-CG2 4.49Å
516	L	93.9	Very high	91	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-32.8	177.7	-174.8	52.2	0	0	0	112.1	V468 F470 L493 V512 A513 N518 V527 I534 V546 V627 I629 L657	V468-L516 HydrophobicContact CB-CD1 4.28Å; V468-L516 HydrophobicContact CG1-CD1 3.36Å; V468-L516 HydrophobicContact CG1-CD2 4.49Å; V468-L516 HydrophobicContact CG2-CD1 3.89Å; F470-L516 HydrophobicContact CE2-CD1 4.45Å; F470-L516 HydrophobicContact CZ-CB 4.39Å; L493-L516 HydrophobicContact CD1-CD2 4.19Å; V512-L516 WeakPolarHBondContact O-CB 3.48Å; V512-L516 PolarHBondContact O-N 2.7Å; A513-L516 PolarHBondContact O-N 3.49Å; L516-N518 PolarHBondContact O-N 3.3Å; L516-V527 HydrophobicContact CD1-CG1 4.49Å; L516-I534 HydrophobicContact CD1-CD1 3.73Å; L516-V546 HydrophobicContact CG-CG1 4.04Å; L516-V627 HydrophobicContact CD2-CG1 4.16Å; L516-I629 HydrophobicContact CB-CD1 4.06Å; L516-I629 HydrophobicContact CD2-CD1 3.62Å; L516-I629 HydrophobicContact CD2-CG1 3.91Å; L516-I629 HydrophobicContact CG-CD1 3.86Å; L516-L657 HydrophobicContact CD2-CD2 4.16Å
517	Q	92	Very high	91.7	Very high	33 Å²	33	28.4 Å²	28.4	15%	0.154	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	4.7	172.5	-67.1	-171.8	-61	0	0	113.8	A513 A514 L515 L519 H543 V546 S548 I629	A513-Q517 WeakPolarHBondContact O-CG 3.38Å; A513-Q517 PolarHBondContact O-N 3.46Å; A514-Q517 PolarHBondContact O-N 3.46Å; L515-Q517 VanDerWaalsContact C-N 3.25Å; L515-Q517 PolarHBondContact O-N 3.02Å; Q517-L519 HydrophobicContact CB-CD1 4.14Å; Q517-L519 HydrophobicContact CB-CG 3.78Å; Q517-L519 PolarHBondContact O-N 3.42Å; Q517-L519 VanDerWaalsContact O-N 3.11Å; Q517-H543 PolarHBondContact O-CE1 2.82Å; Q517-H543 PolarHBondContact O-NE2 2.91Å; Q517-V546 HydrophobicContact CG-CG1 4.43Å; Q517-S548 VanDerWaalsContact CD-CB 3.4Å; Q517-I629 HydrophobicContact CG-CD1 3.92Å
518	N	92.1	Very high	92.2	Very high	28 Å²	28	28.7 Å²	28.7	15%	0.15	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	24.4	-176.1	-154.5	39.3	0	0	0	114.3	A514 L515 L516 Y520 Q521 I534 L542	A514-N518 PolarHBondContact O-N 3.29Å; L515-N518 PolarHBondContact O-N 3.02Å; L516-N518 PolarHBondContact O-N 3.3Å; N518-Y520 VanDerWaalsContact C-N 3.26Å; N518-Q521 PolarHBondContact OD1-NE2 3.49Å; N518-I534 HydrophobicContact CB-CG2 3.62Å; N518-L542 HydrophobicContact CB-CD2 3.5Å
519	L	90.5	Very high	92.6	Very high	54 Å²	54	28.4 Å²	28.4	28%	0.283	18%	0.175	S	C	.	.	S	Bend	trans	-73.2	-25.2	177.1	-67	-176.1	0	0	0	111.6	L238 A514 Q517	L238-L519 HydrophobicContact CD1-CB 3.58Å; L238-L519 HydrophobicContact CD1-CD1 4Å; L238-L519 HydrophobicContact CD1-CD2 3.91Å; L238-L519 HydrophobicContact CD1-CG 4.01Å; A514-L519 HydrophobicContact CB-CB 4.36Å; A514-L519 WeakPolarHBondContact O-CB 3.49Å; A514-L519 PolarHBondContact O-N 3.2Å; Q517-L519 HydrophobicContact CB-CD1 4.14Å; Q517-L519 HydrophobicContact CB-CG 3.78Å; Q517-L519 PolarHBondContact O-N 3.42Å; Q517-L519 VanDerWaalsContact O-N 3.11Å
520	Y	90.6	Very high	92.8	Very high	20 Å²	20	29.4 Å²	29.4	8%	0.078	18%	0.18	C	C	.	.	S	Bend	trans	-134.2	154.6	169.7	-64.7	-81	0	0	0	109.9	L238 Q242 F475 Y477 A514 L515 N518	L238-Y520 HydrophobicContact CB-CE1 4.21Å; L238-Y520 HydrophobicContact CB-CE2 4.45Å; L238-Y520 WeakPolarHBondContact CB-OH 3.38Å; L238-Y520 HydrophobicContact CD1-CE2 4.4Å; Q242-Y520 VanDerWaalsContact CD-OH 3.31Å; Q242-Y520 PolarHBondContact NE2-OH 2.68Å; Q242-Y520 PolarHBondContact OE1-OH 2.92Å; F475-Y520 HydrophobicContact CE2-CD1 4.38Å; F475-Y520 HydrophobicContact CE2-CG 4.14Å; F475-Y520 AromaticContact CZ-CD1 3.9Å; F475-Y520 HydrophobicContact CZ-CD1 3.9Å; F475-Y520 HydrophobicContact CZ-CD2 4.3Å; F475-Y520 AromaticContact CZ-CG 3.69Å; F475-Y520 HydrophobicContact CZ-CG 3.69Å; Y477-Y520 HydrophobicContact CD1-CE1 4.21Å; Y477-Y520 HydrophobicContact CD1-CE2 4.36Å; Y477-Y520 AromaticContact CD1-CZ 4Å; Y477-Y520 HydrophobicContact CE1-CD2 4.3Å; Y477-Y520 HydrophobicContact CE1-CE1 4.42Å; Y477-Y520 AromaticContact CE1-CE2 3.76Å; Y477-Y520 HydrophobicContact CE1-CE2 3.76Å; Y477-Y520 AromaticContact CE1-CZ 3.82Å; A514-Y520 HydrophobicContact CB-CD2 3.9Å; A514-Y520 HydrophobicContact CB-CE2 4.29Å; L515-Y520 WeakPolarHBondContact CD2-O 3.44Å; N518-Y520 VanDerWaalsContact C-N 3.26Å
521	Q	90.3	Very high	93	Very high	55 Å²	55	31.5 Å²	31.5	26%	0.257	18%	0.183	S	C	.	.			trans	-91.3	142.2	169.1	-66.8	-58.8	-48.8	0	0	110.5	L453 P454 F475 N518	L453-Q521 HydrophobicContact CD2-CG 4.38Å; P454-Q521 HydrophobicContact CG-CG 4.08Å; F475-Q521 WeakPolarHBondContact CD2-O 3.41Å; F475-Q521 VanDerWaalsContact CE2-O 3.26Å; F475-Q521 WeakPolarHBondContact CE2-O 3.45Å; N518-Q521 PolarHBondContact OD1-NE2 3.49Å
522	P	92.9	Very high	93.1	Very high	32 Å²	32	35.4 Å²	35.4	21%	0.208	20%	0.2	C	C	.	.			trans	-63	143.5	171.3	29.5	-34.8	0	0	0	110.6	V473	V473-P522 HydrophobicContact CG1-CB 3.89Å
523	T	91.6	Very high	93.1	Very high	101 Å²	101	36.8 Å²	36.8	62%	0.62	21%	0.209	S	C	*	.	S	Bend	trans	-77.9	-26.5	176.1	-44.9	0	0	0	0	111.5	S474 F475 A476	S474-T523 WeakPolarHBondContact O-CA 3.23Å; S474-T523 PolarHBondContact O-N 3.38Å; F475-T523 WeakPolarHBondContact CA-OG1 3.4Å; A476-T523 PolarHBondContact N-OG1 3.3Å
524	G	91.9	Very high	93.1	Very high	28 Å²	28	36.9 Å²	36.9	29%	0.289	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	158.5	173	0	0	0	0	0	110.8	V473 S474	V473-G524 WeakPolarHBondContact CA-O 3.41Å; S474-G524 PolarHBondContact N-O 3.41Å; S474-G524 PolarHBondContact O-N 3.29Å
525	G	93.9	Very high	93	Very high	45 Å²	45	38 Å²	38	46%	0.464	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	71	-163.9	-172	0	0	0	0	0	112.8	Q471 D472	Q471-G525 VanDerWaalsContact O-CA 3.24Å; Q471-G525 WeakPolarHBondContact O-CA 3.33Å; D472-G525 WeakPolarHBondContact O-CA 3.5Å
526	Q	94.5	Very high	92.9	Very high	83 Å²	83	42.4 Å²	42.4	39%	0.388	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.6	-179.2	59.6	-172.7	3.8	0	0	113	Q471 V473 L528	Q471-Q526 HydrophobicContact CB-CG 4.12Å; Q471-Q526 PolarHBondContact N-O 3.36Å; Q471-Q526 PolarHBondContact O-N 2.6Å; V473-Q526 VanDerWaalsContact CG2-O 3.25Å; V473-Q526 WeakPolarHBondContact CG2-O 3.07Å; Q526-L528 HydrophobicContact CG-CD2 4.11Å; Q526-L528 HydrophobicContact CG-CG 4.28Å
527	V	95.8	Very high	92.9	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.3	170.3	-166.7	0	0	0	0	108.2	V468 K469 F470 V473 L515 L516 P533 I534	V468-V527 HydrophobicContact CG1-CG1 4.42Å; K469-V527 WeakPolarHBondContact O-CA 3.4Å; F470-V527 HydrophobicContact CD1-CG2 3.97Å; F470-V527 HydrophobicContact CD2-CG1 3.94Å; F470-V527 HydrophobicContact CE1-CG1 4.26Å; F470-V527 HydrophobicContact CE1-CG2 3.72Å; F470-V527 HydrophobicContact CE2-CG1 3.61Å; F470-V527 HydrophobicContact CG-CG1 4.39Å; F470-V527 HydrophobicContact CG-CG2 4.47Å; F470-V527 HydrophobicContact CZ-CG1 3.78Å; F470-V527 HydrophobicContact CZ-CG2 4.02Å; V473-V527 HydrophobicContact CG1-CG2 4.41Å; V473-V527 HydrophobicContact CG2-CG2 3.97Å; L515-V527 HydrophobicContact CB-CG2 4.49Å; L516-V527 HydrophobicContact CD1-CG1 4.49Å; V527-P533 WeakPolarHBondContact O-CA 3.37Å; V527-I534 HydrophobicContact CB-CD1 4.01Å; V527-I534 HydrophobicContact CB-CG1 4.4Å; V527-I534 HydrophobicContact CG1-CD1 3.37Å; V527-I534 HydrophobicContact CG1-CG1 4.15Å; V527-I534 PolarHBondContact O-N 3.24Å
528	L	95.8	Very high	92.9	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.3	-177.7	-51.8	172.5	0	0	0	110.2	V468 K469 Q471 Q526 K532 P533	V468-L528 CarbonylContact C-O 3.47Å; V468-L528 WeakPolarHBondContact CA-O 3.49Å; K469-L528 HydrophobicContact CB-CB 4.26Å; K469-L528 PolarHBondContact N-O 3.29Å; K469-L528 PolarHBondContact O-N 3.14Å; Q471-L528 HydrophobicContact CG-CD1 4.42Å; Q526-L528 HydrophobicContact CG-CD2 4.11Å; Q526-L528 HydrophobicContact CG-CG 4.28Å; L528-K532 CarbonylContact C-O 3.58Å; L528-K532 VanDerWaalsContact CA-O 3.28Å; L528-K532 WeakPolarHBondContact CA-O 3.49Å; L528-P533 HydrophobicContact CD2-CB 4.29Å; L528-P533 HydrophobicContact CD2-CG 3.85Å
529	L	95.1	Very high	92.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	119.1	166.9	176.6	66.8	0	0	0	107.1	L464 V467 V468 E531 K532 I534 Y537 L542 V546 V627	L464-L529 HydrophobicContact CD1-CD2 4.12Å; L464-L529 HydrophobicContact CD1-CG 4.12Å; L464-L529 HydrophobicContact CD2-CD1 4.3Å; L464-L529 HydrophobicContact CD2-CD2 4.02Å; L464-L529 HydrophobicContact CD2-CG 4.39Å; V467-L529 WeakPolarHBondContact O-CA 3.24Å; V468-L529 HydrophobicContact CG2-CD1 3.91Å; L529-E531 PolarHBondContact O-N 3.38Å; L529-K532 PolarHBondContact N-O 3.24Å; L529-K532 PolarHBondContact O-N 2.89Å; L529-I534 HydrophobicContact CB-CD1 4.44Å; L529-I534 HydrophobicContact CB-CG1 3.88Å; L529-Y537 HydrophobicContact CB-CE2 3.91Å; L529-Y537 HydrophobicContact CD2-CD1 4.45Å; L529-Y537 HydrophobicContact CD2-CE1 4.06Å; L529-Y537 HydrophobicContact CD2-CE2 4.18Å; L529-Y537 HydrophobicContact CG-CE2 4.34Å; L529-Y537 PolarHBondContact O-OH 3.48Å; L529-L542 HydrophobicContact CD2-CD1 3.84Å; L529-V546 HydrophobicContact CD2-CG2 4.23Å; L529-V627 HydrophobicContact CD1-CG2 4.23Å
530	D	93.9	Very high	92.8	Very high	32 Å²	32	50 Å²	50	17%	0.171	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	53.7	-173.7	-64.8	-8	0	0	0	112.8	L464 Q465 G466 V467 K532	L464-D530 HydrophobicContact CD1-CB 4.5Å; L464-D530 WeakPolarHBondContact CD1-OD2 3.01Å; L464-D530 WeakPolarHBondContact CG-OD2 3.17Å; Q465-D530 PolarHBondContact N-OD2 3.33Å; G466-D530 PolarHBondContact N-OD1 3.5Å; G466-D530 PolarHBondContact N-OD2 3.44Å; V467-D530 PolarHBondContact N-OD1 2.95Å; V467-D530 PolarHBondContact O-N 2.97Å; D530-K532 PolarHBondContact O-N 3.37Å; D530-K532 VanDerWaalsContact O-N 3.08Å
531	E	93.1	Very high	92.8	Very high	107 Å²	107	50.5 Å²	50.5	50%	0.5	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	-0.2	-176.2	-51.7	-50.7	112.4	0	0	116.8	K469 L529	K469-E531 WeakPolarHBondContact CD-OE1 3.23Å; K469-E531 WeakPolarHBondContact CE-OE1 3.47Å; K469-E531 IonicContact NZ-OE1 3.88Å; K469-E531 PolarHBondContact NZ-OE1 3.27Å; K469-E531 IonicContact NZ-OE2 2.8Å; K469-E531 PolarHBondContact NZ-OE2 3.36Å; L529-E531 PolarHBondContact O-N 3.38Å
532	K	93.9	Very high	93	Very high	89 Å²	89	47.9 Å²	47.9	39%	0.387	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.2	179.4	-64.3	-178.9	-175.2	174.7	0	111.1	L459 L528 L529 D530 I534 Y537	L459-K532 HydrophobicContact CD1-CD 3.68Å; L459-K532 HydrophobicContact CD2-CD 3.74Å; L459-K532 HydrophobicContact CG-CD 4.38Å; L528-K532 CarbonylContact C-O 3.58Å; L528-K532 VanDerWaalsContact CA-O 3.28Å; L528-K532 WeakPolarHBondContact CA-O 3.49Å; L529-K532 PolarHBondContact N-O 3.24Å; L529-K532 PolarHBondContact O-N 2.89Å; D530-K532 PolarHBondContact O-N 3.37Å; D530-K532 VanDerWaalsContact O-N 3.08Å; K532-I534 PolarHBondContact O-N 3Å; K532-Y537 HydrophobicContact CB-CE2 3.84Å
533	P	93.8	Very high	93	Very high	30 Å²	30	48.5 Å²	48.5	20%	0.195	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	134	174.7	-24.9	33.4	0	0	0	111.8	V527 L528 S535 Q536	V527-P533 WeakPolarHBondContact O-CA 3.37Å; L528-P533 HydrophobicContact CD2-CB 4.29Å; L528-P533 HydrophobicContact CD2-CG 3.85Å; P533-S535 PolarHBondContact O-N 3.26Å; P533-S535 VanDerWaalsContact O-N 3.14Å; P533-Q536 HydrophobicContact CB-CG 4.24Å; P533-Q536 HydrophobicContact CG-CG 4.5Å; P533-Q536 WeakPolarHBondContact O-CB 3.42Å; P533-Q536 PolarHBondContact O-N 3.2Å
534	I	92.6	Very high	93	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-58.2	-31.7	-177.9	-67.4	-174	0	0	0	111.7	L516 N518 V527 L529 K532 Q536 Y537 L542	L516-I534 HydrophobicContact CD1-CD1 3.73Å; N518-I534 HydrophobicContact CB-CG2 3.62Å; V527-I534 HydrophobicContact CB-CD1 4.01Å; V527-I534 HydrophobicContact CB-CG1 4.4Å; V527-I534 HydrophobicContact CG1-CD1 3.37Å; V527-I534 HydrophobicContact CG1-CG1 4.15Å; V527-I534 PolarHBondContact O-N 3.24Å; L529-I534 HydrophobicContact CB-CD1 4.44Å; L529-I534 HydrophobicContact CB-CG1 3.88Å; K532-I534 PolarHBondContact O-N 3Å; I534-Q536 PolarHBondContact O-N 2.99Å; I534-Y537 PolarHBondContact O-N 3.4Å; I534-Y537 VanDerWaalsContact O-N 3.16Å; I534-L542 HydrophobicContact CG2-CD1 3.94Å; I534-L542 HydrophobicContact CG2-CD2 3.44Å; I534-L542 VanDerWaalsContact CG2-CD2 3.44Å; I534-L542 HydrophobicContact CG2-CG 4.35Å
535	S	90.3	Very high	93.1	Very high	36 Å²	36	45.7 Å²	45.7	25%	0.252	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-63.5	-17.8	176.8	55.3	0	0	0	0	114.7	P533	P533-S535 PolarHBondContact O-N 3.26Å; P533-S535 VanDerWaalsContact O-N 3.14Å
536	Q	92.3	Very high	93.1	Very high	96 Å²	96	43.6 Å²	43.6	45%	0.449	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-85	-10.6	177.2	-64	-179	3.8	0	0	113.7	G457 T458 L459 P533 I534	G457-Q536 CarbonylContact C-O 3.16Å; G457-Q536 VanDerWaalsContact CA-O 3.26Å; G457-Q536 WeakPolarHBondContact CA-O 3.27Å; T458-Q536 PolarHBondContact N-O 3.48Å; L459-Q536 WeakPolarHBondContact CB-O 3.4Å; L459-Q536 PolarHBondContact N-O 3.16Å; P533-Q536 HydrophobicContact CB-CG 4.24Å; P533-Q536 HydrophobicContact CG-CG 4.5Å; P533-Q536 WeakPolarHBondContact O-CB 3.42Å; P533-Q536 PolarHBondContact O-N 3.2Å; I534-Q536 PolarHBondContact O-N 2.99Å
537	Y	93.1	Very high	93	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.016	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-78.1	147.8	177.4	-72.3	-99.3	0	0	0	111.5	G457 L459 P461 L464 L529 K532 I534 H539 Y541	G457-Y537 PolarHBondContact N-O 3.41Å; L459-Y537 HydrophobicContact CD2-CD1 3.55Å; L459-Y537 HydrophobicContact CD2-CD2 4.29Å; L459-Y537 HydrophobicContact CD2-CE1 3.22Å; L459-Y537 HydrophobicContact CD2-CE2 4.03Å; L459-Y537 HydrophobicContact CD2-CG 4.09Å; L459-Y537 VanDerWaalsContact CD2-CZ 3.48Å; L459-Y537 WeakPolarHBondContact O-CA 3.44Å; P461-Y537 HydrophobicContact CG-CE1 4.14Å; L464-Y537 HydrophobicContact CD1-CE1 3.99Å; L529-Y537 HydrophobicContact CB-CE2 3.91Å; L529-Y537 HydrophobicContact CD2-CD1 4.45Å; L529-Y537 HydrophobicContact CD2-CE1 4.06Å; L529-Y537 HydrophobicContact CD2-CE2 4.18Å; L529-Y537 HydrophobicContact CG-CE2 4.34Å; L529-Y537 PolarHBondContact O-OH 3.48Å; K532-Y537 HydrophobicContact CB-CE2 3.84Å; I534-Y537 PolarHBondContact O-N 3.4Å; I534-Y537 VanDerWaalsContact O-N 3.16Å; Y537-H539 PolarHBondContact O-N 2.97Å; Y537-Y541 AromaticContact CD1-CD1 3.94Å; Y537-Y541 HydrophobicContact CD1-CD1 3.94Å; Y537-Y541 AromaticContact CD1-CE1 3.84Å; Y537-Y541 HydrophobicContact CD1-CE1 3.84Å; Y537-Y541 HydrophobicContact CE1-CE1 4.14Å
538	E	93.2	Very high	92.9	Very high	82 Å²	82	41.3 Å²	41.3	38%	0.383	22%	0.215	S	C	.	.			trans	-63.8	132.5	169.4	-170.5	-155.7	151	0	0	109.6	G457 L459 A460 C540 Y541 L542	G457-E538 WeakPolarHBondContact O-CA 3.41Å; G457-E538 PolarHBondContact O-N 3.01Å; L459-E538 PolarHBondContact O-N 2.89Å; A460-E538 HydrophobicContact CB-CB 4.47Å; E538-C540 PolarHBondContact O-N 3.12Å; E538-Y541 PolarHBondContact O-N 3.42Å; E538-L542 WeakPolarHBondContact O-CB 3.49Å; E538-L542 PolarHBondContact O-N 3.4Å
539	H	89.5	Confident	92.6	Very high	102 Å²	102	41.1 Å²	41.1	47%	0.472	21%	0.214	S	C	.	.	H	α-helix	trans	-55	-51.2	-174	177.9	75.9	0	0	0	112.9	P456 Y537 Y541 L542 H543	P456-H539 HydrophobicContact CB-CB 4.3Å; Y537-H539 PolarHBondContact O-N 2.97Å; H539-Y541 PolarHBondContact O-N 3.01Å; H539-L542 PolarHBondContact O-N 3.26Å; H539-H543 AromaticContact CE1-CD2 3.17Å; H539-H543 PolarHBondContact CE1-CD2 3.43Å; H539-H543 AromaticContact CE1-NE2 3.07Å; H539-H543 PolarHBondContact CE1-NE2 3.23Å; H539-H543 AromaticContact CG-CD2 3.87Å; H539-H543 AromaticContact ND1-CD2 3.31Å; H539-H543 PolarHBondContact ND1-CD2 3.22Å; H539-H543 VanDerWaalsContact ND1-CD2 3.31Å; H539-H543 AromaticContact ND1-NE2 3.3Å; H539-H543 PolarHBondContact ND1-NE2 3.11Å; H539-H543 AromaticContact NE2-CD2 3.66Å; H539-H543 AromaticContact NE2-NE2 3.96Å; H539-H543 PolarHBondContact O-CD2 2.92Å; H539-H543 PolarHBondContact O-N 3.49Å
540	C	89.8	Confident	92.2	Very high	87 Å²	87	42.5 Å²	42.5	59%	0.588	23%	0.228	S	C	*	.	H	α-helix	trans	-63	-42.6	-179.7	-65.5	0	0	0	0	111.9	E538 S544	E538-C540 PolarHBondContact O-N 3.12Å; C540-S544 PolarHBondContact O-N 3.49Å; C540-S544 VanDerWaalsContact O-N 3.09Å
541	Y	92.3	Very high	91.6	Very high	31 Å²	31	45.7 Å²	45.7	12%	0.122	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-50.7	176.2	175.9	-91.1	0	0	0	111.3	A460 P461 Y537 E538 H539 H543 S544 Q545	A460-Y541 HydrophobicContact CB-CD1 4.36Å; A460-Y541 HydrophobicContact CB-CD2 3.69Å; A460-Y541 HydrophobicContact CB-CE2 4.31Å; A460-Y541 HydrophobicContact CB-CG 3.71Å; P461-Y541 HydrophobicContact CG-CE1 4.2Å; P461-Y541 WeakPolarHBondContact CG-OH 3.46Å; P461-Y541 WeakPolarHBondContact O-CE2 3.43Å; P461-Y541 PolarHBondContact O-OH 3.1Å; Y537-Y541 AromaticContact CD1-CD1 3.94Å; Y537-Y541 HydrophobicContact CD1-CD1 3.94Å; Y537-Y541 AromaticContact CD1-CE1 3.84Å; Y537-Y541 HydrophobicContact CD1-CE1 3.84Å; Y537-Y541 HydrophobicContact CE1-CE1 4.14Å; E538-Y541 PolarHBondContact O-N 3.42Å; H539-Y541 PolarHBondContact O-N 3.01Å; Y541-H543 VanDerWaalsContact C-N 3.34Å; Y541-H543 PolarHBondContact O-N 2.79Å; Y541-S544 WeakPolarHBondContact O-CB 3.43Å; Y541-S544 PolarHBondContact O-N 3.31Å; Y541-S544 PolarHBondContact O-OG 3.44Å; Y541-Q545 HydrophobicContact CD1-CG 4.32Å; Y541-Q545 HydrophobicContact CE1-CG 3.82Å; Y541-Q545 HydrophobicContact CE2-CG 4.12Å; Y541-Q545 WeakPolarHBondContact O-CG 3.49Å; Y541-Q545 PolarHBondContact O-N 3.49Å; Y541-Q545 VanDerWaalsContact O-N 3.15Å
542	L	93.6	Very high	91.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.1	-48.2	180	179.2	69.1	0	0	0	111.2	N518 L529 I534 E538 H539 S544 Q545 V546	N518-L542 HydrophobicContact CB-CD2 3.5Å; L529-L542 HydrophobicContact CD2-CD1 3.84Å; I534-L542 HydrophobicContact CG2-CD1 3.94Å; I534-L542 HydrophobicContact CG2-CD2 3.44Å; I534-L542 VanDerWaalsContact CG2-CD2 3.44Å; I534-L542 HydrophobicContact CG2-CG 4.35Å; E538-L542 WeakPolarHBondContact O-CB 3.49Å; E538-L542 PolarHBondContact O-N 3.4Å; H539-L542 PolarHBondContact O-N 3.26Å; L542-S544 PolarHBondContact O-N 3.28Å; L542-Q545 PolarHBondContact O-N 2.8Å; L542-V546 HydrophobicContact CD1-CB 4.38Å; L542-V546 HydrophobicContact CD1-CG2 3.71Å; L542-V546 HydrophobicContact CG-CG2 4.48Å; L542-V546 PolarHBondContact O-N 2.92Å
543	H	92.4	Very high	90.7	Very high	45 Å²	45	45.6 Å²	45.6	21%	0.208	25%	0.245	C	C	.	.	H	α-helix	trans	-73.7	-10.7	-180	-71.7	-69.3	0	0	0	114.3	Q517 H539 Y541	Q517-H543 PolarHBondContact O-CE1 2.82Å; Q517-H543 PolarHBondContact O-NE2 2.91Å; H539-H543 AromaticContact CE1-CD2 3.17Å; H539-H543 PolarHBondContact CE1-CD2 3.43Å; H539-H543 AromaticContact CE1-NE2 3.07Å; H539-H543 PolarHBondContact CE1-NE2 3.23Å; H539-H543 AromaticContact CG-CD2 3.87Å; H539-H543 AromaticContact ND1-CD2 3.31Å; H539-H543 PolarHBondContact ND1-CD2 3.22Å; H539-H543 VanDerWaalsContact ND1-CD2 3.31Å; H539-H543 AromaticContact ND1-NE2 3.3Å; H539-H543 PolarHBondContact ND1-NE2 3.11Å; H539-H543 AromaticContact NE2-CD2 3.66Å; H539-H543 AromaticContact NE2-NE2 3.96Å; H539-H543 PolarHBondContact O-CD2 2.92Å; H539-H543 PolarHBondContact O-N 3.49Å; Y541-H543 VanDerWaalsContact C-N 3.34Å; Y541-H543 PolarHBondContact O-N 2.79Å
544	S	91.9	Very high	90.4	Very high	35 Å²	35	48.3 Å²	48.3	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-79.8	-32.2	165.8	79.7	0	0	0	0	112.1	C540 Y541 L542	C540-S544 PolarHBondContact O-N 3.49Å; C540-S544 VanDerWaalsContact O-N 3.09Å; Y541-S544 WeakPolarHBondContact O-CB 3.43Å; Y541-S544 PolarHBondContact O-N 3.31Å; Y541-S544 PolarHBondContact O-OG 3.44Å; L542-S544 PolarHBondContact O-N 3.28Å
545	Q	93.3	Very high	90.3	Very high	34 Å²	34	48.2 Å²	48.2	16%	0.159	26%	0.261	C	S	.	.	H	α-helix	trans	-94.7	-29.9	-175.6	-59.8	-53.9	-53.8	0	0	113.4	L464 Y541 L542 P625 R626 V627	L464-Q545 HydrophobicContact CD2-CB 3.8Å; L464-Q545 HydrophobicContact CD2-CG 4.06Å; Y541-Q545 HydrophobicContact CD1-CG 4.32Å; Y541-Q545 HydrophobicContact CE1-CG 3.82Å; Y541-Q545 HydrophobicContact CE2-CG 4.12Å; Y541-Q545 WeakPolarHBondContact O-CG 3.49Å; Y541-Q545 PolarHBondContact O-N 3.49Å; Y541-Q545 VanDerWaalsContact O-N 3.15Å; L542-Q545 PolarHBondContact O-N 2.8Å; Q545-P625 CarbonylContact O-C 3.51Å; Q545-P625 WeakPolarHBondContact O-CB 3.32Å; Q545-R626 PolarHBondContact O-N 3.32Å; Q545-V627 PolarHBondContact O-N 2.98Å
546	V	94.5	Very high	90.4	Very high	1 Å²	1	51 Å²	51	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	101.5	-178.7	-175	0	0	0	0	108.7	L516 Q517 L529 L542 V627 I629	L516-V546 HydrophobicContact CG-CG1 4.04Å; Q517-V546 HydrophobicContact CG-CG1 4.43Å; L529-V546 HydrophobicContact CD2-CG2 4.23Å; L542-V546 HydrophobicContact CD1-CB 4.38Å; L542-V546 HydrophobicContact CD1-CG2 3.71Å; L542-V546 HydrophobicContact CG-CG2 4.48Å; L542-V546 PolarHBondContact O-N 2.92Å; V546-V627 WeakPolarHBondContact CA-O 3.47Å; V546-V627 HydrophobicContact CB-CB 4.45Å; V546-V627 HydrophobicContact CG1-CB 4.29Å; V546-V627 HydrophobicContact CG1-CG1 4.32Å; V546-V627 HydrophobicContact CG2-CB 4.1Å; V546-V627 HydrophobicContact CG2-CG2 4.27Å; V546-I629 HydrophobicContact CG1-CD1 4.05Å
547	V	93.6	Very high	90.3	Very high	11 Å²	11	50.5 Å²	50.5	7%	0.067	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.3	-173.8	179.1	0	0	0	0	109.9	A620 R623 P625 V627 I629	V547-A620 HydrophobicContact CG1-CB 3.52Å; V547-R623 HydrophobicContact CG2-CB 4.45Å; V547-P625 HydrophobicContact CB-CB 4.01Å; V547-P625 HydrophobicContact CB-CG 4.12Å; V547-P625 HydrophobicContact CG2-CB 3.7Å; V547-P625 HydrophobicContact CG2-CG 4.14Å; V547-V627 PolarHBondContact N-O 3.05Å; V547-I629 PolarHBondContact O-N 3.1Å
548	S	92	Very high	90.3	Very high	33 Å²	33	51.1 Å²	51.1	23%	0.231	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141	175.8	-172.6	0	0	0	0	111.2	Q517 I629	Q517-S548 VanDerWaalsContact CD-CB 3.4Å; S548-I629 CarbonylContact C-O 3.59Å; S548-I629 VanDerWaalsContact CA-O 3.3Å; S548-I629 WeakPolarHBondContact CA-O 3.33Å
549	V	90.8	Very high	90.3	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.4	166.4	-175.4	0	0	0	0	107.1	A616 I617 A620 I629 L630 D631 A633	V549-A616 HydrophobicContact CG1-CB 4.08Å; V549-I617 HydrophobicContact CG1-CG1 4.04Å; V549-I617 HydrophobicContact CG2-CG1 4.26Å; V549-A620 HydrophobicContact CG2-CB 3.68Å; V549-I629 PolarHBondContact N-O 3.19Å; V549-L630 HydrophobicContact CB-CD2 3.93Å; V549-L630 HydrophobicContact CG2-CD2 3.92Å; V549-D631 PolarHBondContact O-N 3.04Å; V549-A633 HydrophobicContact CB-CB 4.11Å; V549-A633 HydrophobicContact CG1-CB 3.72Å
550	G	87	Confident	90.6	Very high	29 Å²	29	43 Å²	43	30%	0.299	25%	0.247	S	C	.	.			trans	-77.6	166.7	179.4	0	0	0	0	0	113.5	D631	G550-D631 CarbonylContact C-O 3.59Å
551	Q	81.6	Confident	90.8	Very high	100 Å²	100	41.5 Å²	41.5	47%	0.467	23%	0.229	S	C	.	.	S	Bend	trans	-58.5	-49.6	178.8	-173.9	-175.1	20.6	0	0	111.9	P553 D631 E632	Q551-P553 VanDerWaalsContact O-CD 3.3Å; Q551-P553 WeakPolarHBondContact O-CD 3.34Å; Q551-D631 VanDerWaalsContact CA-O 3.24Å; Q551-D631 WeakPolarHBondContact CA-O 3.3Å; Q551-D631 PolarHBondContact N-O 3.13Å; Q551-E632 HydrophobicContact CB-CB 4.12Å; Q551-E632 HydrophobicContact CG-CB 3.86Å; Q551-E632 PolarHBondContact NE2-OE2 3.38Å
552	E	81.4	Confident	90.9	Very high	169 Å²	169	44.3 Å²	44.3	79%	0.79	25%	0.246	S	C	*	.	S	Bend	trans	-111.8	89.1	174	-69.1	-173.6	174.8	0	0	109.9	V554	E552-V554 PolarHBondContact O-N 2.92Å
553	P	85	Confident	90.9	Very high	25 Å²	25	44.4 Å²	44.4	16%	0.162	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-68.7	128.5	-178	22.4	-27.7	0	0	0	111.2	Q551 K612 Q613 A616	Q551-P553 VanDerWaalsContact O-CD 3.3Å; Q551-P553 WeakPolarHBondContact O-CD 3.34Å; P553-K612 HydrophobicContact CG-CB 4.44Å; P553-Q613 HydrophobicContact CG-CB 4.43Å; P553-A616 HydrophobicContact CB-CB 3.3Å; P553-A616 HydrophobicContact CG-CB 3.73Å
554	V	88.3	Confident	91.1	Very high	87 Å²	87	42.3 Å²	42.3	53%	0.527	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-83.9	123.6	174.9	-176.5	0	0	0	0	109.5	E552 R619	E552-V554 PolarHBondContact O-N 2.92Å; V554-R619 PolarHBondContact O-NH1 2.92Å
555	L	91.4	Very high	91.2	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-98.3	151.3	169	-59	-179.4	0	0	0	109.9	N563 V600 K603 L607 K612 L615 R619	L555-N563 HydrophobicContact CD2-CB 4.49Å; L555-V600 HydrophobicContact CB-CG2 4.33Å; L555-K603 WeakPolarHBondContact O-CA 3.29Å; L555-L607 HydrophobicContact CD1-CD1 3.58Å; L555-K612 HydrophobicContact CD1-CB 4.1Å; L555-K612 HydrophobicContact CD1-CG 3.9Å; L555-L615 HydrophobicContact CD1-CD2 3.75Å; L555-L615 HydrophobicContact CD2-CD2 3.94Å; L555-L615 HydrophobicContact CD2-CG 4.37Å; L555-R619 VanDerWaalsContact CD2-NH2 3.26Å
556	F	91.8	Very high	91.2	Very high	95 Å²	95	44.7 Å²	44.7	42%	0.417	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-102.1	150.5	176.5	-65.1	-81.3	0	0	0	109.6	N563 Y566 V600	F556-N563 PolarHBondContact N-OD1 3.32Å; F556-N563 PolarHBondContact O-ND2 3.04Å; F556-N563 PolarHBondContact O-OD1 2.73Å; F556-Y566 AromaticContact CD2-CD2 3.84Å; F556-Y566 HydrophobicContact CD2-CD2 3.84Å; F556-Y566 HydrophobicContact CD2-CE1 4.35Å; F556-Y566 AromaticContact CD2-CE2 3.42Å; F556-Y566 HydrophobicContact CD2-CE2 3.42Å; F556-Y566 VanDerWaalsContact CD2-CE2 3.42Å; F556-Y566 HydrophobicContact CD2-CG 4.47Å; F556-Y566 AromaticContact CD2-CZ 3.71Å; F556-Y566 HydrophobicContact CE2-CD1 4.4Å; F556-Y566 HydrophobicContact CE2-CD2 4.26Å; F556-Y566 AromaticContact CE2-CE1 3.8Å; F556-Y566 HydrophobicContact CE2-CE1 3.8Å; F556-Y566 AromaticContact CE2-CE2 3.64Å; F556-Y566 HydrophobicContact CE2-CE2 3.64Å; F556-Y566 AromaticContact CE2-CZ 3.37Å; F556-Y566 HydrophobicContact CG-CE2 4.01Å; F556-Y566 HydrophobicContact CZ-CE1 4.46Å; F556-Y566 HydrophobicContact CZ-CE2 4.38Å; F556-Y566 AromaticContact CZ-CZ 3.89Å; F556-V600 WeakPolarHBondContact O-CG2 3.17Å
557	S	90.3	Very high	90.8	Very high	84 Å²	84	48.2 Å²	48.2	59%	0.587	28%	0.278	S	S	*	.	S	Bend	trans	-57.7	140.1	173.6	-48.9	0	0	0	0	110.5	E602	S557-E602 WeakPolarHBondContact OG-CA 3.32Å
558	G	91.9	Very high	90.6	Very high	17 Å²	17	50.5 Å²	50.5	18%	0.175	29%	0.29	C	S	.	.	S	Bend	trans	123.3	-176	-172.9	0	0	0	0	0	112.1	D599 V600	G558-D599 WeakPolarHBondContact CA-OD1 3.4Å; G558-D599 PolarHBondContact N-OD1 3.25Å; G558-D599 VanDerWaalsContact O-OD1 3.1Å; G558-V600 WeakPolarHBondContact O-CG2 3.21Å; G558-V600 PolarHBondContact O-N 2.93Å
559	S	94.1	Very high	90.2	Very high	14 Å²	14	57.8 Å²	57.8	10%	0.098	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-69	159.1	-171.4	66.2	0	0	0	0	114.3	R561 N562 N563 Y597 T598	S559-R561 PolarHBondContact O-N 3.44Å; S559-N562 PolarHBondContact O-N 3.44Å; S559-N562 VanDerWaalsContact O-N 3.15Å; S559-N562 PolarHBondContact OG-N 3.16Å; S559-N562 PolarHBondContact OG-ND2 2.87Å; S559-N562 PolarHBondContact OG-OD1 3.4Å; S559-N563 PolarHBondContact O-N 3.35Å; S559-N563 PolarHBondContact O-ND2 3.44Å; S559-Y597 WeakPolarHBondContact CB-O 3.24Å; S559-T598 CarbonylContact C-O 3.59Å; S559-T598 WeakPolarHBondContact CA-O 3.47Å
560	V	95	Very high	89.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-49.7	-47.4	167.5	168.7	0	0	0	0	110.5	N562 N563 I564 I589 M592 I596 T598 V600 L615	V560-N562 PolarHBondContact O-N 2.97Å; V560-N563 WeakPolarHBondContact O-CB 3.5Å; V560-N563 PolarHBondContact O-N 2.93Å; V560-N563 VanDerWaalsContact O-N 3.15Å; V560-I564 HydrophobicContact CG1-CD1 4.01Å; V560-I564 WeakPolarHBondContact O-CG1 3.48Å; V560-I564 PolarHBondContact O-N 3.3Å; V560-I589 HydrophobicContact CG1-CD1 3.6Å; V560-I589 HydrophobicContact CG1-CG1 3.91Å; V560-M592 HydrophobicContact CG2-SD 4.03Å; V560-I596 WeakPolarHBondContact CB-O 3.44Å; V560-I596 PolarHBondContact N-O 3.48Å; V560-T598 PolarHBondContact N-O 2.96Å; V560-V600 HydrophobicContact CG2-CG1 3.62Å; V560-L615 HydrophobicContact CG1-CD1 3.69Å
561	R	94.8	Very high	89.7	Confident	56 Å²	56	62.9 Å²	62.9	21%	0.211	35%	0.351	C	S	.	.	H	α-helix	trans	-54.7	-49.9	176.1	-176.3	-167.7	-176.1	-71	-10.3	112.2	S559 N563 I564 A565 C571 D573 V576 I596	S559-R561 PolarHBondContact O-N 3.44Å; R561-N563 PolarHBondContact O-N 2.97Å; R561-I564 PolarHBondContact O-N 3.48Å; R561-A565 WeakPolarHBondContact O-CB 3.31Å; R561-A565 PolarHBondContact O-N 3.29Å; R561-C571 PolarHBondContact NH2-O 2.96Å; R561-D573 IonicContact CZ-OD1 3.64Å; R561-D573 IonicContact NE-OD1 3.14Å; R561-D573 PolarHBondContact NE-OD1 2.82Å; R561-D573 IonicContact NE-OD2 2.93Å; R561-D573 IonicContact NH2-OD1 3.31Å; R561-D573 PolarHBondContact NH2-OD1 3.48Å; R561-V576 HydrophobicContact CG-CG1 4.41Å; R561-V576 HydrophobicContact CG-CG2 4.48Å; R561-I596 HydrophobicContact CB-CB 4.19Å; R561-I596 HydrophobicContact CB-CG1 4.5Å; R561-I596 VanDerWaalsContact CB-O 3.27Å; R561-I596 WeakPolarHBondContact CB-O 3.48Å; R561-I596 HydrophobicContact CG-CD1 4.48Å; R561-I596 PolarHBondContact N-O 3.27Å
562	N	93.9	Very high	90.3	Very high	90 Å²	90	64.8 Å²	64.8	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-65.9	-31.5	-178.9	-69.6	-10	0	0	0	111.8	S559 V560 Y566	S559-N562 PolarHBondContact O-N 3.44Å; S559-N562 VanDerWaalsContact O-N 3.15Å; S559-N562 PolarHBondContact OG-N 3.16Å; S559-N562 PolarHBondContact OG-ND2 2.87Å; S559-N562 PolarHBondContact OG-OD1 3.4Å; V560-N562 PolarHBondContact O-N 2.97Å; N562-Y566 WeakPolarHBondContact O-CA 3.24Å; N562-Y566 PolarHBondContact O-N 2.97Å
563	N	94.8	Very high	90.9	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.011	33%	0.334	C	S	.	.	H	α-helix	trans	-72	-40	174.3	-85.8	-82.4	0	0	0	112.5	L555 F556 S559 V560 R561 Y566 V600 L615 R619	L555-N563 HydrophobicContact CD2-CB 4.49Å; F556-N563 PolarHBondContact N-OD1 3.32Å; F556-N563 PolarHBondContact O-ND2 3.04Å; F556-N563 PolarHBondContact O-OD1 2.73Å; S559-N563 PolarHBondContact O-N 3.35Å; S559-N563 PolarHBondContact O-ND2 3.44Å; V560-N563 WeakPolarHBondContact O-CB 3.5Å; V560-N563 PolarHBondContact O-N 2.93Å; V560-N563 VanDerWaalsContact O-N 3.15Å; R561-N563 PolarHBondContact O-N 2.97Å; N563-Y566 WeakPolarHBondContact O-CB 3.25Å; N563-V600 WeakPolarHBondContact ND2-CG2 3.26Å; N563-L615 HydrophobicContact CB-CD2 4.06Å; N563-R619 PolarHBondContact O-NE 3.4Å; N563-R619 PolarHBondContact O-NH2 3.08Å; N563-R619 PolarHBondContact OD1-NH2 3.42Å
564	I	94.9	Very high	91.2	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-68.1	-51.7	176.2	-64.9	169.9	0	0	0	110	V560 R561 Y566 V576 A580 L615 A618 V622	V560-I564 HydrophobicContact CG1-CD1 4.01Å; V560-I564 WeakPolarHBondContact O-CG1 3.48Å; V560-I564 PolarHBondContact O-N 3.3Å; R561-I564 PolarHBondContact O-N 3.48Å; I564-Y566 PolarHBondContact O-N 3.48Å; I564-Y566 VanDerWaalsContact O-N 3.1Å; I564-V576 HydrophobicContact CB-CG1 3.96Å; I564-V576 HydrophobicContact CD1-CG1 3.71Å; I564-V576 HydrophobicContact CG1-CG1 4.42Å; I564-V576 HydrophobicContact CG2-CB 4.48Å; I564-V576 HydrophobicContact CG2-CG1 3.93Å; I564-V576 HydrophobicContact CG2-CG2 4.45Å; I564-A580 HydrophobicContact CD1-CB 4.2Å; I564-L615 HydrophobicContact CD1-CD1 3.58Å; I564-L615 HydrophobicContact CG1-CD1 3.38Å; I564-L615 HydrophobicContact CG1-CG 4.27Å; I564-A618 HydrophobicContact CD1-CB 4.16Å; I564-A618 HydrophobicContact CG1-CB 4.09Å; I564-A618 HydrophobicContact CG2-CB 4.41Å; I564-V622 HydrophobicContact CG2-CB 4.03Å; I564-V622 HydrophobicContact CG2-CG1 4.01Å; I564-V622 HydrophobicContact CG2-CG2 4.29Å; I564-V622 WeakPolarHBondContact O-CG1 3.3Å
565	A	94.5	Very high	91.5	Very high	10 Å²	10	64.4 Å²	64.4	8%	0.083	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	17.2	-178.2	0	0	0	0	0	114.2	R561 G567 L568 C571 V576	R561-A565 WeakPolarHBondContact O-CB 3.31Å; R561-A565 PolarHBondContact O-N 3.29Å; A565-G567 PolarHBondContact O-N 3.49Å; A565-L568 WeakPolarHBondContact O-CB 3.44Å; A565-L568 PolarHBondContact O-N 3.37Å; A565-C571 HydrophobicContact CB-CB 3.81Å; A565-V576 HydrophobicContact CB-CG2 4.17Å
566	Y	93.4	Very high	91.6	Very high	110 Å²	110	64.3 Å²	64.3	43%	0.431	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	122.8	-172	-174.1	-100	0	0	0	112.2	F556 N562 N563 I564 L568 R623	F556-Y566 AromaticContact CD2-CD2 3.84Å; F556-Y566 HydrophobicContact CD2-CD2 3.84Å; F556-Y566 HydrophobicContact CD2-CE1 4.35Å; F556-Y566 AromaticContact CD2-CE2 3.42Å; F556-Y566 HydrophobicContact CD2-CE2 3.42Å; F556-Y566 VanDerWaalsContact CD2-CE2 3.42Å; F556-Y566 HydrophobicContact CD2-CG 4.47Å; F556-Y566 AromaticContact CD2-CZ 3.71Å; F556-Y566 HydrophobicContact CE2-CD1 4.4Å; F556-Y566 HydrophobicContact CE2-CD2 4.26Å; F556-Y566 AromaticContact CE2-CE1 3.8Å; F556-Y566 HydrophobicContact CE2-CE1 3.8Å; F556-Y566 AromaticContact CE2-CE2 3.64Å; F556-Y566 HydrophobicContact CE2-CE2 3.64Å; F556-Y566 AromaticContact CE2-CZ 3.37Å; F556-Y566 HydrophobicContact CG-CE2 4.01Å; F556-Y566 HydrophobicContact CZ-CE1 4.46Å; F556-Y566 HydrophobicContact CZ-CE2 4.38Å; F556-Y566 AromaticContact CZ-CZ 3.89Å; N562-Y566 WeakPolarHBondContact O-CA 3.24Å; N562-Y566 PolarHBondContact O-N 2.97Å; N563-Y566 WeakPolarHBondContact O-CB 3.25Å; I564-Y566 PolarHBondContact O-N 3.48Å; I564-Y566 VanDerWaalsContact O-N 3.1Å; Y566-L568 PolarHBondContact O-N 2.88Å; Y566-R623 PolarHBondContact O-NH2 3.25Å
567	G	87.3	Confident	91.6	Very high	75 Å²	75	62 Å²	62	77%	0.773	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	3.8	179.6	0	0	0	0	0	115.9	A565	A565-G567 PolarHBondContact O-N 3.49Å
568	L	89.1	Confident	91.7	Very high	58 Å²	58	60.5 Å²	60.5	30%	0.304	34%	0.338	S	S	.	.			trans	-90.2	135.8	169.5	-68.8	176.2	0	0	0	110.4	A565 Y566 C571 V622 R623	A565-L568 WeakPolarHBondContact O-CB 3.44Å; A565-L568 PolarHBondContact O-N 3.37Å; Y566-L568 PolarHBondContact O-N 2.88Å; L568-C571 HydrophobicContact CB-CB 4.37Å; L568-V622 HydrophobicContact CD1-CG1 3.79Å; L568-V622 HydrophobicContact CD1-CG2 4.39Å; L568-R623 HydrophobicContact CD1-CG 4.2Å; L568-R623 HydrophobicContact CD2-CG 4.22Å; L568-R623 HydrophobicContact CG-CG 4.45Å
569	Q	83.2	Confident	91.6	Very high	186 Å²	186	60 Å²	60	87%	0.869	33%	0.332	S	S	*	.	S	Bend	trans	-81.1	129.6	171.9	-64.8	-176.4	0.6	0	0	109.4	C571	Q569-C571 PolarHBondContact O-N 3.48Å
570	S	78.7	Confident	91.5	Very high	126 Å²	126	59.4 Å²	59.4	88%	0.881	33%	0.327	S	S	*	.	S	Bend	trans	50.3	54.2	170.9	-54.4	0	0	0	0	114.9
571	C	89.3	Confident	91.3	Very high	14 Å²	14	64.2 Å²	64.2	10%	0.095	35%	0.35	C	S	.	.			trans	-79.4	126.8	173.7	-164.3	0	0	0	0	110.8	R561 A565 L568 Q569	R561-C571 PolarHBondContact NH2-O 2.96Å; A565-C571 HydrophobicContact CB-CB 3.81Å; L568-C571 HydrophobicContact CB-CB 4.37Å; Q569-C571 PolarHBondContact O-N 3.48Å
572	E	92.8	Very high	90.8	Very high	140 Å²	140	63.6 Å²	63.6	65%	0.654	36%	0.357	S	S	*	.			trans	-69.5	146.1	174.6	-67.1	179.7	169.8	0	0	111.7	D574 K575 V576	E572-D574 VanDerWaalsContact C-N 3.26Å; E572-D574 PolarHBondContact O-N 3.4Å; E572-K575 WeakPolarHBondContact O-CB 3.31Å; E572-K575 PolarHBondContact O-N 3.47Å; E572-K575 VanDerWaalsContact O-N 3.14Å; E572-V576 PolarHBondContact O-N 3.24Å
573	D	93.4	Very high	90.4	Very high	45 Å²	45	59.4 Å²	59.4	24%	0.241	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-34.3	-178.6	-73.2	17.3	0	0	0	111.9	R561 K575 V576 M577 I596 Y597	R561-D573 IonicContact CZ-OD1 3.64Å; R561-D573 IonicContact NE-OD1 3.14Å; R561-D573 PolarHBondContact NE-OD1 2.82Å; R561-D573 IonicContact NE-OD2 2.93Å; R561-D573 IonicContact NH2-OD1 3.31Å; R561-D573 PolarHBondContact NH2-OD1 3.48Å; D573-K575 VanDerWaalsContact C-N 3.28Å; D573-K575 PolarHBondContact O-N 2.98Å; D573-V576 WeakPolarHBondContact O-CB 3.43Å; D573-V576 PolarHBondContact O-N 3.5Å; D573-V576 VanDerWaalsContact O-N 3.12Å; D573-M577 PolarHBondContact O-N 3.21Å; D573-I596 HydrophobicContact CB-CD1 4.21Å; D573-Y597 PolarHBondContact OD2-OH 3.17Å
574	D	93.2	Very high	90	Very high	127 Å²	127	62.2 Å²	62.2	68%	0.679	35%	0.348	S	S	*	.	H	α-helix	trans	-61.1	-39.5	176.5	-64.9	-19.2	0	0	0	111.3	E572 M577 A578	E572-D574 VanDerWaalsContact C-N 3.26Å; E572-D574 PolarHBondContact O-N 3.4Å; D574-M577 PolarHBondContact O-N 3.45Å; D574-A578 VanDerWaalsContact O-CB 3.31Å; D574-A578 WeakPolarHBondContact O-CB 3.43Å; D574-A578 PolarHBondContact O-N 2.9Å
575	K	92.8	Very high	89.8	Confident	102 Å²	102	62.2 Å²	62.2	44%	0.443	35%	0.348	S	S	.	.	H	α-helix	trans	-69.1	-37.5	176.2	-163.6	-178.1	-177.8	-172.3	0	111.5	E572 D573 A579 V622	E572-K575 WeakPolarHBondContact O-CB 3.31Å; E572-K575 PolarHBondContact O-N 3.47Å; E572-K575 VanDerWaalsContact O-N 3.14Å; D573-K575 VanDerWaalsContact C-N 3.28Å; D573-K575 PolarHBondContact O-N 2.98Å; K575-A579 WeakPolarHBondContact O-CB 3.41Å; K575-A579 PolarHBondContact O-N 3.46Å; K575-V622 HydrophobicContact CD-CG2 4.29Å; K575-V622 WeakPolarHBondContact CE-O 3.25Å; K575-V622 HydrophobicContact CG-CG2 4.02Å; K575-V622 PolarHBondContact NZ-O 2.89Å; K575-V622 VanDerWaalsContact NZ-O 3.11Å
576	V	94.2	Very high	89.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-45.3	174.6	172.4	0	0	0	0	110.6	R561 I564 A565 E572 D573 A579 A580	R561-V576 HydrophobicContact CG-CG1 4.41Å; R561-V576 HydrophobicContact CG-CG2 4.48Å; I564-V576 HydrophobicContact CB-CG1 3.96Å; I564-V576 HydrophobicContact CD1-CG1 3.71Å; I564-V576 HydrophobicContact CG1-CG1 4.42Å; I564-V576 HydrophobicContact CG2-CB 4.48Å; I564-V576 HydrophobicContact CG2-CG1 3.93Å; I564-V576 HydrophobicContact CG2-CG2 4.45Å; A565-V576 HydrophobicContact CB-CG2 4.17Å; E572-V576 PolarHBondContact O-N 3.24Å; D573-V576 WeakPolarHBondContact O-CB 3.43Å; D573-V576 PolarHBondContact O-N 3.5Å; D573-V576 VanDerWaalsContact O-N 3.12Å; V576-A579 PolarHBondContact O-N 2.66Å; V576-A580 WeakPolarHBondContact O-CB 3.47Å; V576-A580 PolarHBondContact O-N 3.04Å
577	M	92.8	Very high	89.3	Confident	47 Å²	47	61.4 Å²	61.4	23%	0.232	35%	0.349	C	S	.	.	H	α-helix	trans	-66.7	-42.6	177.9	-76.7	-57	-58.4	0	0	112.3	D573 D574 A579 A580 Q581 I596	D573-M577 PolarHBondContact O-N 3.21Å; D574-M577 PolarHBondContact O-N 3.45Å; M577-A579 VanDerWaalsContact C-N 3.29Å; M577-A579 PolarHBondContact O-N 3.07Å; M577-A580 WeakPolarHBondContact O-CB 3.49Å; M577-A580 PolarHBondContact O-N 3.32Å; M577-A580 VanDerWaalsContact O-N 3.15Å; M577-Q581 WeakPolarHBondContact O-CB 3.27Å; M577-Q581 WeakPolarHBondContact O-CG 3.35Å; M577-Q581 PolarHBondContact O-N 3.45Å; M577-I596 HydrophobicContact CG-CG2 4.45Å; M577-I596 HydrophobicContact SD-CG2 3.31Å; M577-I596 WeakPolarHBondContact SD-CG2 2.98Å
578	A	90.8	Very high	89.4	Confident	52 Å²	52	58.1 Å²	58.1	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-40	175.3	0	0	0	0	0	111.7	D574 A582	D574-A578 VanDerWaalsContact O-CB 3.31Å; D574-A578 WeakPolarHBondContact O-CB 3.43Å; D574-A578 PolarHBondContact O-N 2.9Å; A578-A582 WeakPolarHBondContact O-CB 3.43Å; A578-A582 PolarHBondContact O-N 3Å
579	A	91.3	Very high	89.6	Confident	7 Å²	7	55.5 Å²	55.5	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-69.2	-36.1	174.9	0	0	0	0	0	112.7	K575 V576 M577 A583 V622	K575-A579 WeakPolarHBondContact O-CB 3.41Å; K575-A579 PolarHBondContact O-N 3.46Å; V576-A579 PolarHBondContact O-N 2.66Å; M577-A579 VanDerWaalsContact C-N 3.29Å; M577-A579 PolarHBondContact O-N 3.07Å; A579-A583 WeakPolarHBondContact O-CB 3.36Å; A579-A583 PolarHBondContact O-N 2.88Å; A579-A583 VanDerWaalsContact O-N 3.11Å; A579-V622 HydrophobicContact CB-CB 3.64Å; A579-V622 HydrophobicContact CB-CG2 4.04Å
580	A	91.9	Very high	90	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-44.5	174.4	0	0	0	0	0	111.6	I564 V576 M577 A583 H584 A585 I589	I564-A580 HydrophobicContact CD1-CB 4.2Å; V576-A580 WeakPolarHBondContact O-CB 3.47Å; V576-A580 PolarHBondContact O-N 3.04Å; M577-A580 WeakPolarHBondContact O-CB 3.49Å; M577-A580 PolarHBondContact O-N 3.32Å; M577-A580 VanDerWaalsContact O-N 3.15Å; A580-A583 CarbonylContact O-C 3.59Å; A580-A583 PolarHBondContact O-N 2.97Å; A580-A583 VanDerWaalsContact O-N 3.14Å; A580-H584 PolarHBondContact O-N 3.48Å; A580-H584 VanDerWaalsContact O-N 3.09Å; A580-A585 HydrophobicContact CB-CB 4.36Å; A580-A585 PolarHBondContact O-N 3.47Å; A580-I589 HydrophobicContact CB-CD1 3.97Å
581	Q	89.4	Confident	90.6	Very high	101 Å²	101	54.9 Å²	54.9	47%	0.472	28%	0.283	S	S	.	.	H	α-helix	trans	-61.5	-45.2	174.6	-73.3	174.2	-15.1	0	0	111.7	M577 A583 H584 D586	M577-Q581 WeakPolarHBondContact O-CB 3.27Å; M577-Q581 WeakPolarHBondContact O-CG 3.35Å; M577-Q581 PolarHBondContact O-N 3.45Å; Q581-A583 PolarHBondContact O-N 3.37Å; Q581-H584 PolarHBondContact O-N 3.38Å; Q581-D586 HydrophobicContact CG-CB 3.76Å
582	A	84.6	Confident	90.8	Very high	43 Å²	43	56 Å²	56	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-21.3	176	0	0	0	0	0	113.3	A578 L621 A644	A578-A582 WeakPolarHBondContact O-CB 3.43Å; A578-A582 PolarHBondContact O-N 3Å; A582-L621 HydrophobicContact CB-CD1 3.9Å; A582-A644 WeakPolarHBondContact O-CB 3.31Å
583	A	86.4	Confident	90.6	Very high	2 Å²	2	57.6 Å²	57.6	2%	0.017	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	7.5	174.2	0	0	0	0	0	113.2	A579 A580 Q581 A585 R614 I617 A618 L621 C641	A579-A583 WeakPolarHBondContact O-CB 3.36Å; A579-A583 PolarHBondContact O-N 2.88Å; A579-A583 VanDerWaalsContact O-N 3.11Å; A580-A583 CarbonylContact O-C 3.59Å; A580-A583 PolarHBondContact O-N 2.97Å; A580-A583 VanDerWaalsContact O-N 3.14Å; Q581-A583 PolarHBondContact O-N 3.37Å; A583-A585 PolarHBondContact O-N 3.01Å; A583-R614 WeakPolarHBondContact CB-O 3.29Å; A583-I617 HydrophobicContact CB-CB 4.16Å; A583-I617 HydrophobicContact CB-CG2 3.93Å; A583-A618 HydrophobicContact CB-CB 3.77Å; A583-L621 HydrophobicContact CB-CD1 4.43Å; A583-C641 PolarHBondContact O-SG 3.18Å
584	H	86.8	Confident	90.5	Very high	61 Å²	61	61.1 Å²	61.1	28%	0.282	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	42.8	-170.7	-62.8	-79.8	0	0	0	112.9	A580 Q581 R614 Q640	A580-H584 PolarHBondContact O-N 3.48Å; A580-H584 VanDerWaalsContact O-N 3.09Å; Q581-H584 PolarHBondContact O-N 3.38Å; H584-R614 WeakPolarHBondContact O-CD 3.41Å; H584-R614 PolarHBondContact O-NH1 2.82Å; H584-Q640 VanDerWaalsContact CD2-C 3.5Å; H584-Q640 PolarHBondContact CD2-O 2.85Å; H584-Q640 PolarHBondContact NE2-O 3.45Å
585	A	88.8	Confident	90.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.288	C	S	.	.			trans	-97.9	-10.7	173.1	0	0	0	0	0	112	A580 A583 D587 F588 I589 R614	A580-A585 HydrophobicContact CB-CB 4.36Å; A580-A585 PolarHBondContact O-N 3.47Å; A583-A585 PolarHBondContact O-N 3.01Å; A585-D587 VanDerWaalsContact C-N 3.29Å; A585-D587 PolarHBondContact O-N 3.25Å; A585-F588 VanDerWaalsContact CA-CE1 3.5Å; A585-F588 HydrophobicContact CB-CD1 4.48Å; A585-F588 HydrophobicContact CB-CE1 3.6Å; A585-F588 HydrophobicContact CB-CZ 4Å; A585-F588 WeakPolarHBondContact O-CD1 3.11Å; A585-F588 WeakPolarHBondContact O-CE1 3.38Å; A585-I589 HydrophobicContact CB-CD1 3.9Å; A585-I589 VanDerWaalsContact O-CB 3.3Å; A585-I589 WeakPolarHBondContact O-CB 3.46Å; A585-I589 WeakPolarHBondContact O-CD1 3.38Å; A585-I589 WeakPolarHBondContact O-CG1 3.36Å; A585-I589 PolarHBondContact O-N 2.94Å; A585-R614 HydrophobicContact CB-CB 4.15Å
586	D	90.1	Very high	90.5	Very high	34 Å²	34	52 Å²	52	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-30.4	-176.9	62.2	-54	0	0	0	113.1	Q581 Q590	Q581-D586 HydrophobicContact CG-CB 3.76Å; D586-Q590 WeakPolarHBondContact O-CB 3.16Å; D586-Q590 WeakPolarHBondContact O-CG 3.27Å; D586-Q590 PolarHBondContact O-N 3.31Å
587	D	88.9	Confident	90.6	Very high	69 Å²	69	58.5 Å²	58.5	37%	0.369	30%	0.296	S	S	.	.	H	α-helix	trans	-54.6	-62.4	176.2	61.7	-27.8	0	0	0	112	A585 I589 Q590 E591 R614	A585-D587 VanDerWaalsContact C-N 3.29Å; A585-D587 PolarHBondContact O-N 3.25Å; D587-I589 VanDerWaalsContact C-N 3.34Å; D587-I589 PolarHBondContact O-N 3.4Å; D587-Q590 PolarHBondContact O-N 3.13Å; D587-E591 PolarHBondContact O-N 2.94Å; D587-R614 IonicContact OD1-NH1 2.7Å; D587-R614 PolarHBondContact OD1-NH1 3.41Å; D587-R614 IonicContact OD2-CZ 2.86Å; D587-R614 IonicContact OD2-NH1 3.76Å; D587-R614 PolarHBondContact OD2-NH1 2.91Å; D587-R614 IonicContact OD2-NH2 3.59Å
588	F	89.7	Confident	90.7	Very high	7 Å²	7	57.1 Å²	57.1	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-75.9	-26.5	-177.7	75.7	-95.7	0	0	0	111.7	A585 Q590 E591 M592 L607 Q611 R614	A585-F588 VanDerWaalsContact CA-CE1 3.5Å; A585-F588 HydrophobicContact CB-CD1 4.48Å; A585-F588 HydrophobicContact CB-CE1 3.6Å; A585-F588 HydrophobicContact CB-CZ 4Å; A585-F588 WeakPolarHBondContact O-CD1 3.11Å; A585-F588 WeakPolarHBondContact O-CE1 3.38Å; F588-Q590 VanDerWaalsContact C-N 3.33Å; F588-E591 PolarHBondContact O-N 3.12Å; F588-M592 HydrophobicContact CD2-CE 4.31Å; F588-M592 HydrophobicContact CD2-SD 4.47Å; F588-M592 HydrophobicContact CE2-CE 4.42Å; F588-M592 WeakPolarHBondContact O-CG 3.48Å; F588-M592 PolarHBondContact O-N 3.48Å; F588-L607 HydrophobicContact CD2-CD2 4.35Å; F588-L607 HydrophobicContact CE2-CD2 3.89Å; F588-Q611 HydrophobicContact CD1-CB 4.4Å; F588-Q611 HydrophobicContact CD1-CG 3.91Å; F588-Q611 HydrophobicContact CD2-CB 4.42Å; F588-Q611 HydrophobicContact CD2-CG 4.12Å; F588-Q611 HydrophobicContact CE1-CB 4.01Å; F588-Q611 HydrophobicContact CE1-CG 4.03Å; F588-Q611 HydrophobicContact CE2-CB 4.07Å; F588-Q611 HydrophobicContact CE2-CG 4.27Å; F588-Q611 HydrophobicContact CG-CG 3.94Å; F588-Q611 HydrophobicContact CZ-CB 3.85Å; F588-Q611 HydrophobicContact CZ-CG 4.22Å; F588-R614 HydrophobicContact CE1-CB 4.39Å
589	I	93.2	Very high	90.8	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-40.4	174.9	-71.5	168.3	0	0	0	110	V560 A580 A585 D587 E591 M592 G595 I596	V560-I589 HydrophobicContact CG1-CD1 3.6Å; V560-I589 HydrophobicContact CG1-CG1 3.91Å; A580-I589 HydrophobicContact CB-CD1 3.97Å; A585-I589 HydrophobicContact CB-CD1 3.9Å; A585-I589 VanDerWaalsContact O-CB 3.3Å; A585-I589 WeakPolarHBondContact O-CB 3.46Å; A585-I589 WeakPolarHBondContact O-CD1 3.38Å; A585-I589 WeakPolarHBondContact O-CG1 3.36Å; A585-I589 PolarHBondContact O-N 2.94Å; D587-I589 VanDerWaalsContact C-N 3.34Å; D587-I589 PolarHBondContact O-N 3.4Å; I589-E591 VanDerWaalsContact C-N 3.29Å; I589-E591 PolarHBondContact O-N 3.3Å; I589-M592 WeakPolarHBondContact O-CB 3.27Å; I589-M592 PolarHBondContact O-N 3.17Å; I589-G595 WeakPolarHBondContact O-CA 3.38Å; I589-I596 HydrophobicContact CG2-CG2 3.71Å
590	Q	91.2	Very high	90.8	Very high	130 Å²	130	58.2 Å²	58.2	61%	0.607	29%	0.288	S	S	*	.	H	α-helix	trans	-67.1	-29.3	177.5	-74.8	171.9	32.3	0	0	113	D586 D587 F588 M592	D586-Q590 WeakPolarHBondContact O-CB 3.16Å; D586-Q590 WeakPolarHBondContact O-CG 3.27Å; D586-Q590 PolarHBondContact O-N 3.31Å; D587-Q590 PolarHBondContact O-N 3.13Å; F588-Q590 VanDerWaalsContact C-N 3.33Å; Q590-M592 VanDerWaalsContact C-N 3.27Å; Q590-M592 PolarHBondContact O-N 3.2Å
591	E	91.8	Very high	90.7	Very high	169 Å²	169	58.7 Å²	58.7	79%	0.79	29%	0.293	S	S	*	.	H	α-helix	trans	-74.7	-16.1	175.9	-67.1	177.5	177.1	0	0	113.3	D587 F588 I589	D587-E591 PolarHBondContact O-N 2.94Å; F588-E591 PolarHBondContact O-N 3.12Å; I589-E591 VanDerWaalsContact C-N 3.29Å; I589-E591 PolarHBondContact O-N 3.3Å
592	M	92.4	Very high	90.6	Very high	38 Å²	38	60.5 Å²	60.5	19%	0.187	30%	0.302	C	S	.	.	S	Bend	trans	-75.8	145.2	177.8	-68.2	177.2	146.6	0	0	112.3	V560 F588 I589 Q590 H594 G595 T598 L607	V560-M592 HydrophobicContact CG2-SD 4.03Å; F588-M592 HydrophobicContact CD2-CE 4.31Å; F588-M592 HydrophobicContact CD2-SD 4.47Å; F588-M592 HydrophobicContact CE2-CE 4.42Å; F588-M592 WeakPolarHBondContact O-CG 3.48Å; F588-M592 PolarHBondContact O-N 3.48Å; I589-M592 WeakPolarHBondContact O-CB 3.27Å; I589-M592 PolarHBondContact O-N 3.17Å; Q590-M592 VanDerWaalsContact C-N 3.27Å; Q590-M592 PolarHBondContact O-N 3.2Å; M592-H594 PolarHBondContact O-N 3.35Å; M592-G595 PolarHBondContact O-N 3.49Å; M592-G595 VanDerWaalsContact O-N 3.12Å; M592-T598 HydrophobicContact CB-CG2 4.06Å; M592-T598 VanDerWaalsContact CB-OG1 3.3Å; M592-T598 WeakPolarHBondContact CB-OG1 3.36Å; M592-T598 HydrophobicContact CE-CG2 4.27Å; M592-T598 HydrophobicContact CG-CG2 4.25Å; M592-T598 HydrophobicContact SD-CG2 3.86Å; M592-L607 HydrophobicContact CE-CD2 3.39Å
593	E	88.3	Confident	90.5	Very high	173 Å²	173	65.3 Å²	65.3	81%	0.808	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-33	-175.7	-167.9	178.2	179.2	0	0	114.4
594	H	92.3	Very high	90.4	Very high	120 Å²	120	65.2 Å²	65.2	56%	0.556	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	20.4	-179.2	-60.7	-32.1	0	0	0	113.3	M592 I596 Y597 T598	M592-H594 PolarHBondContact O-N 3.35Å; H594-I596 PolarHBondContact O-N 2.71Å; H594-Y597 WeakPolarHBondContact O-CA 3.08Å; H594-Y597 WeakPolarHBondContact O-CB 3.49Å; H594-Y597 PolarHBondContact O-N 3.15Å; H594-T598 VanDerWaalsContact C-OG1 3.31Å; H594-T598 PolarHBondContact N-OG1 3.26Å
595	G	92.6	Very high	90.4	Very high	22 Å²	22	66.4 Å²	66.4	23%	0.227	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	55.2	-131.3	179.1	0	0	0	0	0	112.5	I589 M592 Y597 T598	I589-G595 WeakPolarHBondContact O-CA 3.38Å; M592-G595 PolarHBondContact O-N 3.49Å; M592-G595 VanDerWaalsContact O-N 3.12Å; G595-Y597 PolarHBondContact O-N 2.78Å; G595-Y597 VanDerWaalsContact O-N 3.14Å; G595-T598 PolarHBondContact N-OG1 2.87Å; G595-T598 WeakPolarHBondContact O-CB 3.49Å; G595-T598 PolarHBondContact O-N 3.19Å; G595-T598 VanDerWaalsContact O-N 3.15Å; G595-T598 PolarHBondContact O-OG1 2.85Å
596	I	93.8	Very high	90.3	Very high	15 Å²	15	72.4 Å²	72.4	8%	0.077	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-63.6	-14.6	175.9	60.7	173.1	0	0	0	114.3	V560 R561 D573 M577 I589 H594	V560-I596 WeakPolarHBondContact CB-O 3.44Å; V560-I596 PolarHBondContact N-O 3.48Å; R561-I596 HydrophobicContact CB-CB 4.19Å; R561-I596 HydrophobicContact CB-CG1 4.5Å; R561-I596 VanDerWaalsContact CB-O 3.27Å; R561-I596 WeakPolarHBondContact CB-O 3.48Å; R561-I596 HydrophobicContact CG-CD1 4.48Å; R561-I596 PolarHBondContact N-O 3.27Å; D573-I596 HydrophobicContact CB-CD1 4.21Å; M577-I596 HydrophobicContact CG-CG2 4.45Å; M577-I596 HydrophobicContact SD-CG2 3.31Å; M577-I596 WeakPolarHBondContact SD-CG2 2.98Å; I589-I596 HydrophobicContact CG2-CG2 3.71Å; H594-I596 PolarHBondContact O-N 2.71Å
597	Y	95.4	Very high	90.1	Very high	136 Å²	136	71.3 Å²	71.3	53%	0.533	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-89.5	-5	178.7	-64	-77.7	0	0	0	113.3	S559 D573 H594 G595	S559-Y597 WeakPolarHBondContact CB-O 3.24Å; D573-Y597 PolarHBondContact OD2-OH 3.17Å; H594-Y597 WeakPolarHBondContact O-CA 3.08Å; H594-Y597 WeakPolarHBondContact O-CB 3.49Å; H594-Y597 PolarHBondContact O-N 3.15Å; G595-Y597 PolarHBondContact O-N 2.78Å; G595-Y597 VanDerWaalsContact O-N 3.14Å
598	T	94.8	Very high	90.1	Very high	18 Å²	18	70.8 Å²	70.8	11%	0.11	36%	0.357	C	S	.	.			trans	-63.2	131.9	177.5	-50.1	0	0	0	0	111.2	S559 V560 M592 H594 G595	S559-T598 CarbonylContact C-O 3.59Å; S559-T598 WeakPolarHBondContact CA-O 3.47Å; V560-T598 PolarHBondContact N-O 2.96Å; M592-T598 HydrophobicContact CB-CG2 4.06Å; M592-T598 VanDerWaalsContact CB-OG1 3.3Å; M592-T598 WeakPolarHBondContact CB-OG1 3.36Å; M592-T598 HydrophobicContact CE-CG2 4.27Å; M592-T598 HydrophobicContact CG-CG2 4.25Å; M592-T598 HydrophobicContact SD-CG2 3.86Å; H594-T598 VanDerWaalsContact C-OG1 3.31Å; H594-T598 PolarHBondContact N-OG1 3.26Å; G595-T598 PolarHBondContact N-OG1 2.87Å; G595-T598 WeakPolarHBondContact O-CB 3.49Å; G595-T598 PolarHBondContact O-N 3.19Å; G595-T598 VanDerWaalsContact O-N 3.15Å; G595-T598 PolarHBondContact O-OG1 2.85Å
599	D	93.7	Very high	89.8	Confident	82 Å²	82	74.1 Å²	74.1	44%	0.439	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-73.1	133.4	175.3	-164.1	-24.1	0	0	0	110.3	G558 G601 Q606	G558-D599 WeakPolarHBondContact CA-OD1 3.4Å; G558-D599 PolarHBondContact N-OD1 3.25Å; G558-D599 VanDerWaalsContact O-OD1 3.1Å; D599-G601 PolarHBondContact OD1-N 3.36Å; D599-Q606 PolarHBondContact O-OE1 2.82Å
600	V	91.8	Very high	89.3	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.395	C	S	.	.			trans	-88	-7.9	-179.7	-56	0	0	0	0	113.2	L555 F556 G558 V560 N563 G604 S605 Q606 L607 L615	L555-V600 HydrophobicContact CB-CG2 4.33Å; F556-V600 WeakPolarHBondContact O-CG2 3.17Å; G558-V600 WeakPolarHBondContact O-CG2 3.21Å; G558-V600 PolarHBondContact O-N 2.93Å; V560-V600 HydrophobicContact CG2-CG1 3.62Å; N563-V600 WeakPolarHBondContact ND2-CG2 3.26Å; V600-G604 CarbonylContact O-C 3.16Å; V600-G604 WeakPolarHBondContact O-CA 3.17Å; V600-S605 PolarHBondContact O-N 3.16Å; V600-Q606 WeakPolarHBondContact O-CB 3.4Å; V600-Q606 PolarHBondContact O-N 3.39Å; V600-L607 HydrophobicContact CB-CD1 3.98Å; V600-L607 HydrophobicContact CB-CG 4.41Å; V600-L607 HydrophobicContact CG1-CD1 3.74Å; V600-L607 HydrophobicContact CG1-CG 4.41Å; V600-L615 HydrophobicContact CG1-CD2 4.31Å
601	G	89.4	Confident	89.2	Confident	10 Å²	10	71 Å²	71	10%	0.103	38%	0.376	C	S	.	.			trans	74.6	177.7	-177.1	0	0	0	0	0	114.2	D599 K603 G604	D599-G601 PolarHBondContact OD1-N 3.36Å; G601-K603 PolarHBondContact O-N 2.97Å; G601-G604 PolarHBondContact O-N 3.18Å
602	E	86.7	Confident	89.1	Confident	140 Å²	140	65.2 Å²	65.2	65%	0.654	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-61.4	123.1	-177.6	-167.1	-175.8	167.1	0	0	111.3	S557 G604 S605	S557-E602 WeakPolarHBondContact OG-CA 3.32Å; E602-G604 PolarHBondContact O-N 2.99Å; E602-G604 VanDerWaalsContact O-N 3.11Å; E602-S605 WeakPolarHBondContact O-CB 3.33Å; E602-S605 PolarHBondContact O-N 3.46Å; E602-S605 PolarHBondContact O-OG 3.15Å
603	K	83.4	Confident	88.8	Confident	144 Å²	144	63.7 Å²	63.7	63%	0.626	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	53.6	28.1	-174.6	-58.9	-178.9	-174.6	178.5	0	113.6	L555 G601 S605 K612	L555-K603 WeakPolarHBondContact O-CA 3.29Å; G601-K603 PolarHBondContact O-N 2.97Å; K603-S605 VanDerWaalsContact C-N 3.34Å; K603-K612 PolarHBondContact O-NZ 3.03Å
604	G	84.3	Confident	88.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	67.6	30.4	-176.9	0	0	0	0	0	113.2	V600 G601 E602 Q606 L607 K612	V600-G604 CarbonylContact O-C 3.16Å; V600-G604 WeakPolarHBondContact O-CA 3.17Å; G601-G604 PolarHBondContact O-N 3.18Å; E602-G604 PolarHBondContact O-N 2.99Å; E602-G604 VanDerWaalsContact O-N 3.11Å; G604-Q606 PolarHBondContact O-N 2.88Å; G604-L607 PolarHBondContact O-N 3.5Å; G604-K612 WeakPolarHBondContact O-CE 3.48Å; G604-K612 PolarHBondContact O-NZ 3.31Å
605	S	86.8	Confident	88.8	Confident	86 Å²	86	51.2 Å²	51.2	60%	0.601	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-20.5	-175.4	56.7	0	0	0	0	114.7	V600 E602 K603	V600-S605 PolarHBondContact O-N 3.16Å; E602-S605 WeakPolarHBondContact O-CB 3.33Å; E602-S605 PolarHBondContact O-N 3.46Å; E602-S605 PolarHBondContact O-OG 3.15Å; K603-S605 VanDerWaalsContact C-N 3.34Å
606	Q	85.3	Confident	88.7	Confident	126 Å²	126	50.5 Å²	50.5	59%	0.589	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.3	179.1	-56.9	-173.3	6.9	0	0	114.1	D599 V600 G604	D599-Q606 PolarHBondContact O-OE1 2.82Å; V600-Q606 WeakPolarHBondContact O-CB 3.4Å; V600-Q606 PolarHBondContact O-N 3.39Å; G604-Q606 PolarHBondContact O-N 2.88Å
607	L	87.4	Confident	88.5	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.052	27%	0.27	C	S	.	.	S	Bend	trans	-108.1	139.8	-178.1	-68.4	176.2	0	0	0	111.6	L555 F588 M592 V600 G604 Q611 K612 L615	L555-L607 HydrophobicContact CD1-CD1 3.58Å; F588-L607 HydrophobicContact CD2-CD2 4.35Å; F588-L607 HydrophobicContact CE2-CD2 3.89Å; M592-L607 HydrophobicContact CE-CD2 3.39Å; V600-L607 HydrophobicContact CB-CD1 3.98Å; V600-L607 HydrophobicContact CB-CG 4.41Å; V600-L607 HydrophobicContact CG1-CD1 3.74Å; V600-L607 HydrophobicContact CG1-CG 4.41Å; G604-L607 PolarHBondContact O-N 3.5Å; L607-Q611 HydrophobicContact CB-CB 4.23Å; L607-Q611 HydrophobicContact CD2-CB 4.11Å; L607-K612 HydrophobicContact CB-CG 3.73Å; L607-K612 HydrophobicContact CD1-CG 4.5Å; L607-K612 WeakPolarHBondContact O-CE 3.44Å; L607-L615 HydrophobicContact CD1-CD2 3.98Å
608	A	88.1	Confident	88.3	Confident	59 Å²	59	43.4 Å²	43.4	49%	0.488	25%	0.245	S	C	.	.			trans	-64.1	154.2	168.3	0	0	0	0	0	110.8	G610 Q611 K612	A608-G610 VanDerWaalsContact C-N 3.3Å; A608-G610 PolarHBondContact O-N 3.38Å; A608-Q611 HydrophobicContact CB-CG 4.29Å; A608-Q611 WeakPolarHBondContact O-CB 3.49Å; A608-Q611 PolarHBondContact O-N 3.43Å; A608-K612 WeakPolarHBondContact O-CG 3.48Å; A608-K612 PolarHBondContact O-N 3.42Å
609	A	83.4	Confident	88.3	Confident	77 Å²	77	44.1 Å²	44.1	64%	0.636	25%	0.245	S	C	*	.	H	α-helix	trans	-53.5	-43.4	-176.7	0	0	0	0	0	113.2	K612 Q613	A609-K612 PolarHBondContact O-N 2.85Å; A609-Q613 PolarHBondContact O-N 3.46Å; A609-Q613 VanDerWaalsContact O-N 3.16Å
610	G	82.6	Confident	88.2	Confident	20 Å²	20	40.3 Å²	40.3	21%	0.206	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-37.6	176.3	0	0	0	0	0	113.7	A608 Q613 R614	A608-G610 VanDerWaalsContact C-N 3.3Å; A608-G610 PolarHBondContact O-N 3.38Å; G610-Q613 PolarHBondContact O-N 3.32Å; G610-R614 PolarHBondContact O-N 3.02Å
611	Q	88.4	Confident	88.1	Confident	47 Å²	47	41.1 Å²	41.1	22%	0.22	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-40.1	175.4	-67.3	171.5	-31.9	0	0	111.4	F588 L607 A608 Q613 R614 L615	F588-Q611 HydrophobicContact CD1-CB 4.4Å; F588-Q611 HydrophobicContact CD1-CG 3.91Å; F588-Q611 HydrophobicContact CD2-CB 4.42Å; F588-Q611 HydrophobicContact CD2-CG 4.12Å; F588-Q611 HydrophobicContact CE1-CB 4.01Å; F588-Q611 HydrophobicContact CE1-CG 4.03Å; F588-Q611 HydrophobicContact CE2-CB 4.07Å; F588-Q611 HydrophobicContact CE2-CG 4.27Å; F588-Q611 HydrophobicContact CG-CG 3.94Å; F588-Q611 HydrophobicContact CZ-CB 3.85Å; F588-Q611 HydrophobicContact CZ-CG 4.22Å; L607-Q611 HydrophobicContact CB-CB 4.23Å; L607-Q611 HydrophobicContact CD2-CB 4.11Å; A608-Q611 HydrophobicContact CB-CG 4.29Å; A608-Q611 WeakPolarHBondContact O-CB 3.49Å; A608-Q611 PolarHBondContact O-N 3.43Å; Q611-Q613 PolarHBondContact O-N 3.04Å; Q611-R614 PolarHBondContact O-N 2.91Å; Q611-L615 WeakPolarHBondContact O-CB 3.49Å; Q611-L615 PolarHBondContact O-N 2.88Å
612	K	89.9	Confident	88.3	Confident	46 Å²	46	40.8 Å²	40.8	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-40	174.1	-61.6	-174	-167.7	-156.6	0	111.6	P553 L555 K603 G604 L607 A608 A609 L615 A616	P553-K612 HydrophobicContact CG-CB 4.44Å; L555-K612 HydrophobicContact CD1-CB 4.1Å; L555-K612 HydrophobicContact CD1-CG 3.9Å; K603-K612 PolarHBondContact O-NZ 3.03Å; G604-K612 WeakPolarHBondContact O-CE 3.48Å; G604-K612 PolarHBondContact O-NZ 3.31Å; L607-K612 HydrophobicContact CB-CG 3.73Å; L607-K612 HydrophobicContact CD1-CG 4.5Å; L607-K612 WeakPolarHBondContact O-CE 3.44Å; A608-K612 WeakPolarHBondContact O-CG 3.48Å; A608-K612 PolarHBondContact O-N 3.42Å; A609-K612 PolarHBondContact O-N 2.85Å; K612-L615 PolarHBondContact O-N 3.44Å; K612-A616 WeakPolarHBondContact O-CB 3.38Å; K612-A616 PolarHBondContact O-N 3.03Å
613	Q	86.7	Confident	88.5	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.028	20%	0.203	C	C	.	.	H	α-helix	trans	-68.7	-47.7	180	-166.2	162.7	61.5	0	0	112.3	P553 A609 G610 Q611 L615 A616 I617 A633 A636	P553-Q613 HydrophobicContact CG-CB 4.43Å; A609-Q613 PolarHBondContact O-N 3.46Å; A609-Q613 VanDerWaalsContact O-N 3.16Å; G610-Q613 PolarHBondContact O-N 3.32Å; Q611-Q613 PolarHBondContact O-N 3.04Å; Q613-L615 VanDerWaalsContact C-N 3.28Å; Q613-L615 PolarHBondContact O-N 3.46Å; Q613-A616 WeakPolarHBondContact O-CB 3.39Å; Q613-A616 PolarHBondContact O-N 3.29Å; Q613-A616 VanDerWaalsContact O-N 3.09Å; Q613-I617 HydrophobicContact CG-CD1 4.44Å; Q613-I617 WeakPolarHBondContact O-CG1 3.49Å; Q613-I617 PolarHBondContact O-N 2.89Å; Q613-A633 VanDerWaalsContact NE2-CA 3.28Å; Q613-A633 PolarHBondContact NE2-O 3.35Å; Q613-A633 VanDerWaalsContact NE2-O 3.15Å; Q613-A633 PolarHBondContact OE1-O 2.94Å; Q613-A636 VanDerWaalsContact OE1-C 3.31Å
614	R	88.3	Confident	88.8	Confident	31 Å²	31	32.3 Å²	32.3	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-42.1	172.8	-70.8	-170.2	-107.9	167.9	-8.1	112	A583 H584 A585 D587 F588 G610 Q611 A616 I617 A618 D638	A583-R614 WeakPolarHBondContact CB-O 3.29Å; H584-R614 WeakPolarHBondContact O-CD 3.41Å; H584-R614 PolarHBondContact O-NH1 2.82Å; A585-R614 HydrophobicContact CB-CB 4.15Å; D587-R614 IonicContact OD1-NH1 2.7Å; D587-R614 PolarHBondContact OD1-NH1 3.41Å; D587-R614 IonicContact OD2-CZ 2.86Å; D587-R614 IonicContact OD2-NH1 3.76Å; D587-R614 PolarHBondContact OD2-NH1 2.91Å; D587-R614 IonicContact OD2-NH2 3.59Å; F588-R614 HydrophobicContact CE1-CB 4.39Å; G610-R614 PolarHBondContact O-N 3.02Å; Q611-R614 PolarHBondContact O-N 2.91Å; R614-A616 VanDerWaalsContact C-N 3.34Å; R614-A616 PolarHBondContact O-N 3.04Å; R614-I617 PolarHBondContact O-N 3.49Å; R614-A618 PolarHBondContact O-N 2.98Å; R614-D638 IonicContact NH2-OD2 3.27Å
615	L	91.8	Very high	89.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-36.4	176.3	-166.4	65	0	0	0	112.8	L555 V560 N563 I564 V600 L607 Q611 K612 Q613 I617 A618 R619	L555-L615 HydrophobicContact CD1-CD2 3.75Å; L555-L615 HydrophobicContact CD2-CD2 3.94Å; L555-L615 HydrophobicContact CD2-CG 4.37Å; V560-L615 HydrophobicContact CG1-CD1 3.69Å; N563-L615 HydrophobicContact CB-CD2 4.06Å; I564-L615 HydrophobicContact CD1-CD1 3.58Å; I564-L615 HydrophobicContact CG1-CD1 3.38Å; I564-L615 HydrophobicContact CG1-CG 4.27Å; V600-L615 HydrophobicContact CG1-CD2 4.31Å; L607-L615 HydrophobicContact CD1-CD2 3.98Å; Q611-L615 WeakPolarHBondContact O-CB 3.49Å; Q611-L615 PolarHBondContact O-N 2.88Å; K612-L615 PolarHBondContact O-N 3.44Å; Q613-L615 VanDerWaalsContact C-N 3.28Å; Q613-L615 PolarHBondContact O-N 3.46Å; L615-I617 VanDerWaalsContact C-N 3.33Å; L615-A618 PolarHBondContact O-N 3.39Å; L615-R619 WeakPolarHBondContact O-CB 3.47Å; L615-R619 PolarHBondContact O-N 2.93Å
616	A	91.1	Very high	89.5	Confident	7 Å²	7	31 Å²	31	6%	0.058	17%	0.17	C	C	.	.	H	α-helix	trans	-68.7	-32.3	175	0	0	0	0	0	112.8	V549 P553 K612 Q613 R614 R619 A620	V549-A616 HydrophobicContact CG1-CB 4.08Å; P553-A616 HydrophobicContact CB-CB 3.3Å; P553-A616 HydrophobicContact CG-CB 3.73Å; K612-A616 WeakPolarHBondContact O-CB 3.38Å; K612-A616 PolarHBondContact O-N 3.03Å; Q613-A616 WeakPolarHBondContact O-CB 3.39Å; Q613-A616 PolarHBondContact O-N 3.29Å; Q613-A616 VanDerWaalsContact O-N 3.09Å; R614-A616 VanDerWaalsContact C-N 3.34Å; R614-A616 PolarHBondContact O-N 3.04Å; A616-R619 WeakPolarHBondContact O-CB 3.5Å; A616-R619 PolarHBondContact O-N 2.97Å; A616-A620 PolarHBondContact O-N 3.47Å
617	I	89.7	Confident	90	Very high	2 Å²	2	25 Å²	25	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-71	-45.3	173	-65.2	162.9	0	0	0	110.2	V549 A583 Q613 R614 L615 R619 A620 L621 L637 L645	V549-I617 HydrophobicContact CG1-CG1 4.04Å; V549-I617 HydrophobicContact CG2-CG1 4.26Å; A583-I617 HydrophobicContact CB-CB 4.16Å; A583-I617 HydrophobicContact CB-CG2 3.93Å; Q613-I617 HydrophobicContact CG-CD1 4.44Å; Q613-I617 WeakPolarHBondContact O-CG1 3.49Å; Q613-I617 PolarHBondContact O-N 2.89Å; R614-I617 PolarHBondContact O-N 3.49Å; L615-I617 VanDerWaalsContact C-N 3.33Å; I617-R619 VanDerWaalsContact C-N 3.26Å; I617-R619 PolarHBondContact O-N 3.36Å; I617-A620 CarbonylContact O-C 3.56Å; I617-A620 WeakPolarHBondContact O-CA 3.49Å; I617-A620 WeakPolarHBondContact O-CB 3.41Å; I617-A620 PolarHBondContact O-N 3.3Å; I617-L621 HydrophobicContact CG2-CD1 3.85Å; I617-L621 HydrophobicContact CG2-CG 4.11Å; I617-L621 WeakPolarHBondContact O-CG 3.14Å; I617-L621 PolarHBondContact O-N 3.18Å; I617-L637 HydrophobicContact CD1-CD1 3.64Å; I617-L637 HydrophobicContact CD1-CD2 3.16Å; I617-L637 HydrophobicContact CD1-CG 3.85Å; I617-L645 HydrophobicContact CG2-CD2 4.31Å
618	A	91.8	Very high	90.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-55.4	-44.6	172	0	0	0	0	0	111	I564 A583 R614 L615 A620 L621 V622	I564-A618 HydrophobicContact CD1-CB 4.16Å; I564-A618 HydrophobicContact CG1-CB 4.09Å; I564-A618 HydrophobicContact CG2-CB 4.41Å; A583-A618 HydrophobicContact CB-CB 3.77Å; R614-A618 PolarHBondContact O-N 2.98Å; L615-A618 PolarHBondContact O-N 3.39Å; A618-A620 PolarHBondContact O-N 3.03Å; A618-L621 PolarHBondContact O-N 3.33Å; A618-V622 PolarHBondContact O-N 2.87Å
619	R	93.3	Very high	90.5	Very high	33 Å²	33	21.8 Å²	21.8	13%	0.125	12%	0.117	C	C	.	.	H	α-helix	trans	-56.6	-37.3	172.2	176	-168	-67.1	169.9	-1.2	111.6	V554 L555 N563 L615 A616 I617 V622 R623	V554-R619 PolarHBondContact O-NH1 2.92Å; L555-R619 VanDerWaalsContact CD2-NH2 3.26Å; N563-R619 PolarHBondContact O-NE 3.4Å; N563-R619 PolarHBondContact O-NH2 3.08Å; N563-R619 PolarHBondContact OD1-NH2 3.42Å; L615-R619 WeakPolarHBondContact O-CB 3.47Å; L615-R619 PolarHBondContact O-N 2.93Å; A616-R619 WeakPolarHBondContact O-CB 3.5Å; A616-R619 PolarHBondContact O-N 2.97Å; I617-R619 VanDerWaalsContact C-N 3.26Å; I617-R619 PolarHBondContact O-N 3.36Å; R619-V622 WeakPolarHBondContact O-CG1 3.44Å; R619-R623 PolarHBondContact O-NH1 2.91Å
620	A	91.6	Very high	90.8	Very high	3 Å²	3	18.4 Å²	18.4	3%	0.025	9%	0.088	C	C	.	.	H	α-helix	trans	-73.1	-48	177.3	0	0	0	0	0	112.2	V547 V549 A616 I617 A618 V622 R623 P625 L628	V547-A620 HydrophobicContact CG1-CB 3.52Å; V549-A620 HydrophobicContact CG2-CB 3.68Å; A616-A620 PolarHBondContact O-N 3.47Å; I617-A620 CarbonylContact O-C 3.56Å; I617-A620 WeakPolarHBondContact O-CA 3.49Å; I617-A620 WeakPolarHBondContact O-CB 3.41Å; I617-A620 PolarHBondContact O-N 3.3Å; A618-A620 PolarHBondContact O-N 3.03Å; A620-V622 PolarHBondContact O-N 3.4Å; A620-R623 PolarHBondContact O-N 3.45Å; A620-P625 WeakPolarHBondContact O-CD 3.32Å; A620-L628 HydrophobicContact CB-CD1 3.99Å
621	L	90.4	Very high	91	Very high	16 Å²	16	18.2 Å²	18.2	8%	0.084	8%	0.082	C	C	.	.	H	α-helix	trans	-66.4	-32.7	-174.9	-66.1	178.7	0	0	0	113.3	A582 A583 I617 A618 R623 D624 L645 W648	A582-L621 HydrophobicContact CB-CD1 3.9Å; A583-L621 HydrophobicContact CB-CD1 4.43Å; I617-L621 HydrophobicContact CG2-CD1 3.85Å; I617-L621 HydrophobicContact CG2-CG 4.11Å; I617-L621 WeakPolarHBondContact O-CG 3.14Å; I617-L621 PolarHBondContact O-N 3.18Å; A618-L621 PolarHBondContact O-N 3.33Å; L621-R623 PolarHBondContact O-N 3.04Å; L621-R623 VanDerWaalsContact O-N 3.08Å; L621-D624 PolarHBondContact O-N 3.26Å; L621-L645 HydrophobicContact CD2-CD2 4.35Å; L621-W648 HydrophobicContact CD2-CD2 4.03Å; L621-W648 HydrophobicContact CD2-CG 3.99Å
622	V	92.6	Very high	90.4	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.018	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.3	178.4	77.1	0	0	0	0	113	I564 L568 K575 A579 A618 R619 A620	I564-V622 HydrophobicContact CG2-CB 4.03Å; I564-V622 HydrophobicContact CG2-CG1 4.01Å; I564-V622 HydrophobicContact CG2-CG2 4.29Å; I564-V622 WeakPolarHBondContact O-CG1 3.3Å; L568-V622 HydrophobicContact CD1-CG1 3.79Å; L568-V622 HydrophobicContact CD1-CG2 4.39Å; K575-V622 HydrophobicContact CD-CG2 4.29Å; K575-V622 WeakPolarHBondContact CE-O 3.25Å; K575-V622 HydrophobicContact CG-CG2 4.02Å; K575-V622 PolarHBondContact NZ-O 2.89Å; K575-V622 VanDerWaalsContact NZ-O 3.11Å; A579-V622 HydrophobicContact CB-CB 3.64Å; A579-V622 HydrophobicContact CB-CG2 4.04Å; A618-V622 PolarHBondContact O-N 2.87Å; R619-V622 WeakPolarHBondContact O-CG1 3.44Å; A620-V622 PolarHBondContact O-N 3.4Å
623	R	91.6	Very high	88.9	Confident	49 Å²	49	15.4 Å²	15.4	19%	0.185	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.3	175.4	-62.9	-168.2	-175.6	71.3	14.1	113.7	V547 Y566 L568 R619 A620 L621	V547-R623 HydrophobicContact CG2-CB 4.45Å; Y566-R623 PolarHBondContact O-NH2 3.25Å; L568-R623 HydrophobicContact CD1-CG 4.2Å; L568-R623 HydrophobicContact CD2-CG 4.22Å; L568-R623 HydrophobicContact CG-CG 4.45Å; R619-R623 PolarHBondContact O-NH1 2.91Å; A620-R623 PolarHBondContact O-N 3.45Å; L621-R623 PolarHBondContact O-N 3.04Å; L621-R623 VanDerWaalsContact O-N 3.08Å
624	D	89.9	Confident	87.4	Confident	58 Å²	58	15.4 Å²	15.4	31%	0.31	7%	0.07	S	C	.	.			trans	49	57.5	-172.4	-167.7	44.9	0	0	0	113.3	L621 R651 R654	L621-D624 PolarHBondContact O-N 3.26Å; D624-R651 IonicContact OD1-NH1 3.76Å; D624-R654 VanDerWaalsContact CG-NH2 3.28Å; D624-R654 PolarHBondContact O-NH1 2.93Å; D624-R654 IonicContact OD1-CZ 3.51Å; D624-R654 VanDerWaalsContact OD1-CZ 3.31Å; D624-R654 IonicContact OD1-NH1 3.41Å; D624-R654 PolarHBondContact OD1-NH1 3.33Å; D624-R654 IonicContact OD1-NH2 2.78Å; D624-R654 PolarHBondContact OD1-NH2 2.58Å; D624-R654 VanDerWaalsContact OD1-NH2 3.12Å; D624-R654 IonicContact OD2-CZ 2.72Å; D624-R654 IonicContact OD2-NH1 3.59Å; D624-R654 PolarHBondContact OD2-NH1 2.91Å; D624-R654 IonicContact OD2-NH2 3.45Å; D624-R654 PolarHBondContact OD2-NH2 3.47Å
625	P	93.1	Very high	85.9	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.081	C	C	.	.			trans	-70	153.6	-172.8	30.3	-36.2	0	0	0	113	Q545 V547 A620 L628 W648 R654	Q545-P625 CarbonylContact O-C 3.51Å; Q545-P625 WeakPolarHBondContact O-CB 3.32Å; V547-P625 HydrophobicContact CB-CB 4.01Å; V547-P625 HydrophobicContact CB-CG 4.12Å; V547-P625 HydrophobicContact CG2-CB 3.7Å; V547-P625 HydrophobicContact CG2-CG 4.14Å; A620-P625 WeakPolarHBondContact O-CD 3.32Å; P625-L628 HydrophobicContact CG-CD1 4.38Å; P625-W648 HydrophobicContact CG-CH2 4.18Å; P625-W648 HydrophobicContact CG-CZ2 3.96Å; P625-W648 WeakPolarHBondContact O-CH2 3.36Å; P625-W648 WeakPolarHBondContact O-CZ2 3.1Å; P625-R654 VanDerWaalsContact C-NH1 3.34Å; P625-R654 WeakPolarHBondContact O-CD 3.27Å; P625-R654 PolarHBondContact O-NH1 3.16Å
626	R	93.4	Very high	84	Confident	58 Å²	58	18.2 Å²	18.2	22%	0.219	10%	0.097	C	C	.	.	S	Bend	trans	-83.4	-28.4	173.5	-68.3	-76.5	176.4	-168.7	-3.3	112.5	L464 Q545 D653 T655	L464-R626 HydrophobicContact CB-CG 4.22Å; L464-R626 HydrophobicContact CD2-CB 3.88Å; L464-R626 HydrophobicContact CD2-CG 4.09Å; L464-R626 WeakPolarHBondContact O-CD 3.43Å; Q545-R626 PolarHBondContact O-N 3.32Å; R626-D653 IonicContact CZ-OD2 3.66Å; R626-D653 PolarHBondContact NH1-O 3.05Å; R626-D653 IonicContact NH1-OD1 3.93Å; R626-D653 IonicContact NH1-OD2 2.65Å; R626-D653 PolarHBondContact NH1-OD2 3.05Å; R626-D653 IonicContact NH2-OD2 3.86Å; R626-T655 PolarHBondContact O-N 2.83Å
627	V	94.3	Very high	82.4	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.8	177.4	-174	0	0	0	0	108.5	V468 L516 L529 Q545 V546 V547 T655	V468-V627 HydrophobicContact CG2-CG1 4.3Å; V468-V627 HydrophobicContact CG2-CG2 4.05Å; L516-V627 HydrophobicContact CD2-CG1 4.16Å; L529-V627 HydrophobicContact CD1-CG2 4.23Å; Q545-V627 PolarHBondContact O-N 2.98Å; V546-V627 WeakPolarHBondContact CA-O 3.47Å; V546-V627 HydrophobicContact CB-CB 4.45Å; V546-V627 HydrophobicContact CG1-CB 4.29Å; V546-V627 HydrophobicContact CG1-CG1 4.32Å; V546-V627 HydrophobicContact CG2-CB 4.1Å; V546-V627 HydrophobicContact CG2-CG2 4.27Å; V547-V627 PolarHBondContact N-O 3.05Å; V627-T655 CarbonylContact C-O 3.43Å; V627-T655 WeakPolarHBondContact CA-O 3.36Å
628	L	93.4	Very high	81.1	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.4	177.1	-176.4	63.9	0	0	0	110	A620 P625 L630 L645 W648 T655 V656 L657	A620-L628 HydrophobicContact CB-CD1 3.99Å; P625-L628 HydrophobicContact CG-CD1 4.38Å; L628-L630 HydrophobicContact CD1-CD2 4.37Å; L628-L630 HydrophobicContact CD2-CD2 4.17Å; L628-L630 HydrophobicContact CD2-CG 4.42Å; L628-L630 HydrophobicContact CG-CD2 4.09Å; L628-L630 HydrophobicContact CG-CG 4.28Å; L628-L645 HydrophobicContact CD2-CD2 3.69Å; L628-W648 HydrophobicContact CB-CH2 3.81Å; L628-W648 HydrophobicContact CB-CZ3 3.82Å; L628-W648 HydrophobicContact CD2-CE3 4.18Å; L628-W648 HydrophobicContact CD2-CH2 4.25Å; L628-W648 HydrophobicContact CD2-CZ3 3.81Å; L628-W648 HydrophobicContact CG-CZ3 4.48Å; L628-T655 PolarHBondContact N-O 2.64Å; L628-V656 HydrophobicContact CB-CG2 4.44Å; L628-V656 WeakPolarHBondContact O-CA 3.41Å; L628-L657 PolarHBondContact O-N 2.97Å
629	I	93.1	Very high	79.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.4	176.9	-50.5	164.1	0	0	0	108	A513 L516 Q517 V546 V547 S548 V549 L657	A513-I629 HydrophobicContact CB-CG2 3.82Å; L516-I629 HydrophobicContact CB-CD1 4.06Å; L516-I629 HydrophobicContact CD2-CD1 3.62Å; L516-I629 HydrophobicContact CD2-CG1 3.91Å; L516-I629 HydrophobicContact CG-CD1 3.86Å; Q517-I629 HydrophobicContact CG-CD1 3.92Å; V546-I629 HydrophobicContact CG1-CD1 4.05Å; V547-I629 PolarHBondContact O-N 3.1Å; S548-I629 CarbonylContact C-O 3.59Å; S548-I629 VanDerWaalsContact CA-O 3.3Å; S548-I629 WeakPolarHBondContact CA-O 3.33Å; V549-I629 PolarHBondContact N-O 3.19Å; I629-L657 CarbonylContact C-O 3.38Å; I629-L657 WeakPolarHBondContact CA-O 3.44Å; I629-L657 HydrophobicContact CG1-CB 4.49Å; I629-L657 HydrophobicContact CG2-CD2 4.21Å; I629-L657 HydrophobicContact CG2-CG 4.49Å
630	L	89.5	Confident	78.4	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.026	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	100.9	177.9	-61.6	178.2	0	0	0	108.2	V549 L628 E632 A633 L645 V656 L657 V658 I659	V549-L630 HydrophobicContact CB-CD2 3.93Å; V549-L630 HydrophobicContact CG2-CD2 3.92Å; L628-L630 HydrophobicContact CD1-CD2 4.37Å; L628-L630 HydrophobicContact CD2-CD2 4.17Å; L628-L630 HydrophobicContact CD2-CG 4.42Å; L628-L630 HydrophobicContact CG-CD2 4.09Å; L628-L630 HydrophobicContact CG-CG 4.28Å; L630-E632 PolarHBondContact O-N 3.48Å; L630-A633 HydrophobicContact CB-CB 4.28Å; L630-A633 HydrophobicContact CD2-CB 4.32Å; L630-L645 HydrophobicContact CD1-CD1 3.82Å; L630-L645 HydrophobicContact CD1-CD2 4.43Å; L630-V656 HydrophobicContact CD1-CG1 4.41Å; L630-L657 PolarHBondContact N-O 3.38Å; L630-V658 HydrophobicContact CB-CG1 4.27Å; L630-V658 HydrophobicContact CD1-CG2 4.3Å; L630-I659 PolarHBondContact O-N 3.49Å
631	D	87.3	Confident	77.1	Confident	17 Å²	17	30.5 Å²	30.5	9%	0.091	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	96.4	-179.8	-164.4	3.5	0	0	0	110.8	S510 V549 G550 Q551 A633 I659	S510-D631 WeakPolarHBondContact CB-OD2 3.33Å; S510-D631 PolarHBondContact OG-OD2 3.46Å; V549-D631 PolarHBondContact O-N 3.04Å; G550-D631 CarbonylContact C-O 3.59Å; Q551-D631 VanDerWaalsContact CA-O 3.24Å; Q551-D631 WeakPolarHBondContact CA-O 3.3Å; Q551-D631 PolarHBondContact N-O 3.13Å; D631-A633 PolarHBondContact O-N 2.67Å; D631-I659 HydrophobicContact CB-CD1 3.98Å; D631-I659 WeakPolarHBondContact OD1-CB 3.41Å; D631-I659 WeakPolarHBondContact OD1-CD1 3.28Å; D631-I659 WeakPolarHBondContact OD1-CG2 3.48Å
632	E	74.9	Confident	76.2	Confident	33 Å²	33	30.7 Å²	30.7	15%	0.154	16%	0.164	C	C	.	.	S	Bend	trans	52.5	15.4	-174.4	-68.2	-173.3	-151.2	0	0	114.9	Q551 L630 T634 S635 I659 H661	Q551-E632 HydrophobicContact CB-CB 4.12Å; Q551-E632 HydrophobicContact CG-CB 3.86Å; Q551-E632 PolarHBondContact NE2-OE2 3.38Å; L630-E632 PolarHBondContact O-N 3.48Å; E632-T634 PolarHBondContact O-N 3.16Å; E632-S635 WeakPolarHBondContact O-CB 3.39Å; E632-S635 PolarHBondContact O-N 3.17Å; E632-S635 VanDerWaalsContact O-N 3.09Å; E632-S635 PolarHBondContact O-OG 3.17Å; E632-I659 WeakPolarHBondContact CA-O 3.3Å; E632-I659 PolarHBondContact N-O 2.86Å; E632-H661 VanDerWaalsContact CD-CD2 3.42Å; E632-H661 IonicContact OE1-CD2 3.73Å; E632-H661 PolarHBondContact OE1-CD2 2.99Å; E632-H661 IonicContact OE1-NE2 3.95Å; E632-H661 PolarHBondContact OE1-NE2 3.43Å; E632-H661 VanDerWaalsContact OE1-NE2 3.1Å
633	A	58.9	Low	75.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.6	-178.4	0	0	0	0	0	112.2	V549 Q613 L630 D631 S635 L637	V549-A633 HydrophobicContact CB-CB 4.11Å; V549-A633 HydrophobicContact CG1-CB 3.72Å; Q613-A633 VanDerWaalsContact NE2-CA 3.28Å; Q613-A633 PolarHBondContact NE2-O 3.35Å; Q613-A633 VanDerWaalsContact NE2-O 3.15Å; Q613-A633 PolarHBondContact OE1-O 2.94Å; L630-A633 HydrophobicContact CB-CB 4.28Å; L630-A633 HydrophobicContact CD2-CB 4.32Å; D631-A633 PolarHBondContact O-N 2.67Å; A633-S635 VanDerWaalsContact C-N 3.32Å; A633-L637 WeakPolarHBondContact O-CD1 3.28Å; A633-L637 WeakPolarHBondContact O-CG 3.37Å
634	T	56.6	Low	74	Confident	7 Å²	7	33.8 Å²	33.8	4%	0.043	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	0.7	177.1	61.5	0	0	0	0	114.4	E632 L637 V658 R662 T665	E632-T634 PolarHBondContact O-N 3.16Å; T634-L637 HydrophobicContact CG2-CD1 3.9Å; T634-V658 HydrophobicContact CG2-CG1 4.39Å; T634-R662 PolarHBondContact O-NH1 3.36Å; T634-T665 HydrophobicContact CG2-CG2 4.09Å
635	S	55.9	Low	73.2	Confident	48 Å²	48	31.9 Å²	31.9	34%	0.336	17%	0.173	S	C	.	.	S	Bend	trans	-74.7	-29.9	179.5	60.1	0	0	0	0	113.8	E632 A633 R662	E632-S635 WeakPolarHBondContact O-CB 3.39Å; E632-S635 PolarHBondContact O-N 3.17Å; E632-S635 VanDerWaalsContact O-N 3.09Å; E632-S635 PolarHBondContact O-OG 3.17Å; A633-S635 VanDerWaalsContact C-N 3.32Å; S635-R662 VanDerWaalsContact CA-CZ 3.47Å; S635-R662 PolarHBondContact O-NH1 3.13Å; S635-R662 PolarHBondContact O-NH2 3.48Å
636	A	51.8	Low	72.3	Confident	42 Å²	42	35.9 Å²	35.9	35%	0.347	19%	0.192	S	C	.	.	S	Bend	trans	-116.5	15.6	171.6	0	0	0	0	0	113	Q613	Q613-A636 VanDerWaalsContact OE1-C 3.31Å
637	L	58.3	Low	71.5	Confident	11 Å²	11	38.4 Å²	38.4	6%	0.058	21%	0.209	C	C	.	.			trans	-79.2	125.4	171.3	-76.2	171.6	0	0	0	110.6	I617 A633 T634 C641 L645	I617-L637 HydrophobicContact CD1-CD1 3.64Å; I617-L637 HydrophobicContact CD1-CD2 3.16Å; I617-L637 HydrophobicContact CD1-CG 3.85Å; A633-L637 WeakPolarHBondContact O-CD1 3.28Å; A633-L637 WeakPolarHBondContact O-CG 3.37Å; T634-L637 HydrophobicContact CG2-CD1 3.9Å; L637-C641 HydrophobicContact CB-CB 4.13Å; L637-C641 HydrophobicContact CD2-CB 3.21Å; L637-C641 HydrophobicContact CG-CB 4.14Å; L637-L645 HydrophobicContact CD1-CD1 3.98Å
638	D	61.8	Low	70.8	Confident	83 Å²	83	39.4 Å²	39.4	44%	0.444	21%	0.213	S	C	.	.			trans	-64	153.8	164.7	-76.3	-44.5	0	0	0	110.2	R614 Q640 C641 E642	R614-D638 IonicContact NH2-OD2 3.27Å; D638-Q640 PolarHBondContact O-N 2.96Å; D638-C641 PolarHBondContact O-N 3.03Å; D638-E642 PolarHBondContact O-N 3.42Å
639	V	65.4	Low	70.1	Confident	93 Å²	93	39.9 Å²	39.9	56%	0.564	22%	0.215	S	C	*	.	H	α-helix	trans	-49.9	-32.4	179.1	177	0	0	0	0	112.3	E642 Q643	V639-E642 PolarHBondContact O-N 2.78Å; V639-Q643 PolarHBondContact O-N 3.15Å
640	Q	62.8	Low	69.4	Low	112 Å²	112	44.2 Å²	44.2	52%	0.523	25%	0.246	S	C	.	.	H	α-helix	trans	-67.6	-41.3	179.4	-66.2	156.6	-13.9	0	0	112.1	H584 D638 E642 Q643 A644	H584-Q640 VanDerWaalsContact CD2-C 3.5Å; H584-Q640 PolarHBondContact CD2-O 2.85Å; H584-Q640 PolarHBondContact NE2-O 3.45Å; D638-Q640 PolarHBondContact O-N 2.96Å; Q640-E642 VanDerWaalsContact C-N 3.34Å; Q640-E642 PolarHBondContact O-N 3.05Å; Q640-Q643 WeakPolarHBondContact O-CB 3.43Å; Q640-Q643 PolarHBondContact O-N 3.03Å; Q640-A644 PolarHBondContact O-N 3Å; Q640-A644 VanDerWaalsContact O-N 3.08Å
641	C	64.3	Low	68.7	Low	4 Å²	4	51.3 Å²	51.3	3%	0.027	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-33.7	176.4	-68.6	0	0	0	0	113.2	A583 L637 D638 Q643 A644 L645	A583-C641 PolarHBondContact O-SG 3.18Å; L637-C641 HydrophobicContact CB-CB 4.13Å; L637-C641 HydrophobicContact CD2-CB 3.21Å; L637-C641 HydrophobicContact CG-CB 4.14Å; D638-C641 PolarHBondContact O-N 3.03Å; C641-Q643 VanDerWaalsContact C-N 3.3Å; C641-A644 PolarHBondContact O-N 3.45Å; C641-L645 PolarHBondContact O-N 3.21Å; C641-L645 VanDerWaalsContact O-N 3.12Å
642	E	70.4	Confident	68.2	Low	20 Å²	20	52.5 Å²	52.5	9%	0.093	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-38.6	172.9	-67.7	-165.8	158	0	0	111.5	D638 V639 Q640 L645 Q646 R668	D638-E642 PolarHBondContact O-N 3.42Å; V639-E642 PolarHBondContact O-N 2.78Å; Q640-E642 VanDerWaalsContact C-N 3.34Å; Q640-E642 PolarHBondContact O-N 3.05Å; E642-L645 PolarHBondContact O-N 2.93Å; E642-Q646 WeakPolarHBondContact O-CG 3.21Å; E642-Q646 PolarHBondContact O-N 3.42Å; E642-R668 IonicContact OE2-NH1 3.12Å; E642-R668 PolarHBondContact OE2-NH1 2.83Å
643	Q	70.1	Confident	68.6	Low	102 Å²	102	53.6 Å²	53.6	48%	0.477	30%	0.296	S	S	.	.	H	α-helix	trans	-65	-46.1	176.3	-71.9	174.6	-21	0	0	111.7	V639 Q640 C641 L645 Q646 D647	V639-Q643 PolarHBondContact O-N 3.15Å; Q640-Q643 WeakPolarHBondContact O-CB 3.43Å; Q640-Q643 PolarHBondContact O-N 3.03Å; C641-Q643 VanDerWaalsContact C-N 3.3Å; Q643-L645 VanDerWaalsContact C-N 3.3Å; Q643-L645 PolarHBondContact O-N 2.96Å; Q643-Q646 CarbonylContact O-C 3.54Å; Q643-Q646 WeakPolarHBondContact O-CA 3.41Å; Q643-Q646 WeakPolarHBondContact O-CB 3.31Å; Q643-Q646 PolarHBondContact O-N 3.41Å; Q643-D647 PolarHBondContact O-N 3.46Å
644	A	68.6	Low	70	Confident	15 Å²	15	53.9 Å²	53.9	12%	0.124	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-34.9	178.9	0	0	0	0	0	113.1	A582 Q640 C641 D647 W648	A582-A644 WeakPolarHBondContact O-CB 3.31Å; Q640-A644 PolarHBondContact O-N 3Å; Q640-A644 VanDerWaalsContact O-N 3.08Å; C641-A644 PolarHBondContact O-N 3.45Å; A644-D647 PolarHBondContact O-N 3.43Å; A644-W648 WeakPolarHBondContact O-CB 2.99Å; A644-W648 PolarHBondContact O-N 3.32Å
645	L	74.3	Confident	71.7	Confident	17 Å²	17	53.6 Å²	53.6	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-35.3	171.6	-79.6	166.3	0	0	0	112.4	I617 L621 L628 L630 L637 C641 E642 Q643 N649	I617-L645 HydrophobicContact CG2-CD2 4.31Å; L621-L645 HydrophobicContact CD2-CD2 4.35Å; L628-L645 HydrophobicContact CD2-CD2 3.69Å; L630-L645 HydrophobicContact CD1-CD1 3.82Å; L630-L645 HydrophobicContact CD1-CD2 4.43Å; L637-L645 HydrophobicContact CD1-CD1 3.98Å; C641-L645 PolarHBondContact O-N 3.21Å; C641-L645 VanDerWaalsContact O-N 3.12Å; E642-L645 PolarHBondContact O-N 2.93Å; Q643-L645 VanDerWaalsContact C-N 3.3Å; Q643-L645 PolarHBondContact O-N 2.96Å; L645-N649 WeakPolarHBondContact O-CB 3.4Å; L645-N649 PolarHBondContact O-N 2.81Å
646	Q	73.4	Confident	73.4	Confident	85 Å²	85	51.7 Å²	51.7	40%	0.397	28%	0.282	S	S	.	.	H	α-helix	trans	-66.2	-44.6	172.5	-75.1	178	-15.7	0	0	111.5	E642 Q643 W648 N649 S650	E642-Q646 WeakPolarHBondContact O-CG 3.21Å; E642-Q646 PolarHBondContact O-N 3.42Å; Q643-Q646 CarbonylContact O-C 3.54Å; Q643-Q646 WeakPolarHBondContact O-CA 3.41Å; Q643-Q646 WeakPolarHBondContact O-CB 3.31Å; Q643-Q646 PolarHBondContact O-N 3.41Å; Q646-W648 VanDerWaalsContact C-N 3.29Å; Q646-W648 PolarHBondContact O-N 2.84Å; Q646-N649 CarbonylContact O-C 3.54Å; Q646-N649 PolarHBondContact O-N 3.42Å; Q646-N649 VanDerWaalsContact O-N 3.1Å; Q646-S650 PolarHBondContact O-N 3.41Å
647	D	75.4	Confident	75.3	Confident	110 Å²	110	49.8 Å²	49.8	59%	0.588	27%	0.265	S	S	*	.	H	α-helix	trans	-61.4	-39.9	176.7	-69	-19.1	0	0	0	111	Q643 A644 S650	Q643-D647 PolarHBondContact O-N 3.46Å; A644-D647 PolarHBondContact O-N 3.43Å; D647-S650 WeakPolarHBondContact O-CB 3.37Å; D647-S650 PolarHBondContact O-N 2.83Å; D647-S650 PolarHBondContact O-OG 2.85Å
648	W	80.1	Confident	76.8	Confident	22 Å²	22	49.6 Å²	49.6	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-42.4	172.6	-179.6	82.3	0	0	0	112.4	L621 P625 L628 A644 Q646 S650 R654 V656	L621-W648 HydrophobicContact CD2-CD2 4.03Å; L621-W648 HydrophobicContact CD2-CG 3.99Å; P625-W648 HydrophobicContact CG-CH2 4.18Å; P625-W648 HydrophobicContact CG-CZ2 3.96Å; P625-W648 WeakPolarHBondContact O-CH2 3.36Å; P625-W648 WeakPolarHBondContact O-CZ2 3.1Å; L628-W648 HydrophobicContact CB-CH2 3.81Å; L628-W648 HydrophobicContact CB-CZ3 3.82Å; L628-W648 HydrophobicContact CD2-CE3 4.18Å; L628-W648 HydrophobicContact CD2-CH2 4.25Å; L628-W648 HydrophobicContact CD2-CZ3 3.81Å; L628-W648 HydrophobicContact CG-CZ3 4.48Å; A644-W648 WeakPolarHBondContact O-CB 2.99Å; A644-W648 PolarHBondContact O-N 3.32Å; Q646-W648 VanDerWaalsContact C-N 3.29Å; Q646-W648 PolarHBondContact O-N 2.84Å; W648-S650 VanDerWaalsContact C-N 3.33Å; W648-S650 PolarHBondContact O-N 3.48Å; W648-R654 HydrophobicContact CD2-CG 4.47Å; W648-R654 HydrophobicContact CE3-CB 4.35Å; W648-R654 HydrophobicContact CE3-CG 4.4Å; W648-R654 HydrophobicContact CH2-CB 3.78Å; W648-R654 HydrophobicContact CH2-CG 3.85Å; W648-R654 HydrophobicContact CZ2-CB 4.37Å; W648-R654 HydrophobicContact CZ2-CG 3.93Å; W648-R654 HydrophobicContact CZ3-CB 3.75Å; W648-R654 HydrophobicContact CZ3-CG 4.09Å; W648-V656 HydrophobicContact CE3-CG2 4.41Å; W648-V656 HydrophobicContact CZ3-CG2 3.82Å
649	N	79.6	Confident	78.1	Confident	11 Å²	11	45.6 Å²	45.6	6%	0.059	24%	0.243	C	C	.	.	H	α-helix	trans	-71.7	-24.5	177.5	-170.9	63	0	0	0	113.5	G496 V498 L645 Q646 R651 G652 R654 V656	G496-N649 PolarHBondContact O-ND2 2.98Å; V498-N649 VanDerWaalsContact CG2-ND2 3.33Å; V498-N649 WeakPolarHBondContact CG2-ND2 3.12Å; L645-N649 WeakPolarHBondContact O-CB 3.4Å; L645-N649 PolarHBondContact O-N 2.81Å; Q646-N649 CarbonylContact O-C 3.54Å; Q646-N649 PolarHBondContact O-N 3.42Å; Q646-N649 VanDerWaalsContact O-N 3.1Å; N649-R651 PolarHBondContact O-N 2.98Å; N649-G652 PolarHBondContact O-N 3.12Å; N649-R654 PolarHBondContact OD1-O 2.89Å; N649-V656 HydrophobicContact CB-CG2 4.19Å; N649-V656 VanDerWaalsContact OD1-CG2 3.31Å; N649-V656 WeakPolarHBondContact OD1-CG2 3.28Å
650	S	77	Confident	78.6	Confident	92 Å²	92	41.2 Å²	41.2	64%	0.643	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14	-177.6	76.5	0	0	0	0	114.3	Q646 D647 W648 G652	Q646-S650 PolarHBondContact O-N 3.41Å; D647-S650 WeakPolarHBondContact O-CB 3.37Å; D647-S650 PolarHBondContact O-N 2.83Å; D647-S650 PolarHBondContact O-OG 2.85Å; W648-S650 VanDerWaalsContact C-N 3.33Å; W648-S650 PolarHBondContact O-N 3.48Å; S650-G652 PolarHBondContact O-N 2.99Å; S650-G652 VanDerWaalsContact O-N 3.15Å
651	R	76.7	Confident	78.9	Confident	153 Å²	153	38.9 Å²	38.9	58%	0.577	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-14.8	174.7	-62.8	178.9	-179.7	-175.4	-0.6	113.6	D624 N649 D653	D624-R651 IonicContact OD1-NH1 3.76Å; N649-R651 PolarHBondContact O-N 2.98Å; R651-D653 VanDerWaalsContact CB-OD1 3.32Å; R651-D653 WeakPolarHBondContact CB-OD1 3.46Å; R651-D653 PolarHBondContact O-N 3.48Å; R651-D653 VanDerWaalsContact O-N 3.11Å
652	G	76.3	Confident	78.9	Confident	43 Å²	43	43.6 Å²	43.6	44%	0.443	22%	0.223	S	C	.	.	S	Bend	trans	75.1	-5.9	173.3	0	0	0	0	0	115.1	G496 N649 S650	G496-G652 PolarHBondContact N-O 3.47Å; N649-G652 PolarHBondContact O-N 3.12Å; S650-G652 PolarHBondContact O-N 2.99Å; S650-G652 VanDerWaalsContact O-N 3.15Å
653	D	81.9	Confident	78.6	Confident	55 Å²	55	44.5 Å²	44.5	29%	0.294	23%	0.228	S	C	.	.	S	Bend	trans	-110.1	16.2	-177.4	71.2	-16.7	0	0	0	113.2	R626 R651	R626-D653 IonicContact CZ-OD2 3.66Å; R626-D653 PolarHBondContact NH1-O 3.05Å; R626-D653 IonicContact NH1-OD1 3.93Å; R626-D653 IonicContact NH1-OD2 2.65Å; R626-D653 PolarHBondContact NH1-OD2 3.05Å; R626-D653 IonicContact NH2-OD2 3.86Å; R651-D653 VanDerWaalsContact CB-OD1 3.32Å; R651-D653 WeakPolarHBondContact CB-OD1 3.46Å; R651-D653 PolarHBondContact O-N 3.48Å; R651-D653 VanDerWaalsContact O-N 3.11Å
654	R	89.8	Confident	78.4	Confident	7 Å²	7	45.6 Å²	45.6	3%	0.026	23%	0.233	C	C	.	.			trans	-125.3	139.2	-175.7	-52.1	-59.4	162.7	154.1	4.5	111.3	G496 D624 P625 W648 N649	G496-R654 WeakPolarHBondContact CA-O 3.35Å; G496-R654 PolarHBondContact N-O 3.42Å; D624-R654 VanDerWaalsContact CG-NH2 3.28Å; D624-R654 PolarHBondContact O-NH1 2.93Å; D624-R654 IonicContact OD1-CZ 3.51Å; D624-R654 VanDerWaalsContact OD1-CZ 3.31Å; D624-R654 IonicContact OD1-NH1 3.41Å; D624-R654 PolarHBondContact OD1-NH1 3.33Å; D624-R654 IonicContact OD1-NH2 2.78Å; D624-R654 PolarHBondContact OD1-NH2 2.58Å; D624-R654 VanDerWaalsContact OD1-NH2 3.12Å; D624-R654 IonicContact OD2-CZ 2.72Å; D624-R654 IonicContact OD2-NH1 3.59Å; D624-R654 PolarHBondContact OD2-NH1 2.91Å; D624-R654 IonicContact OD2-NH2 3.45Å; D624-R654 PolarHBondContact OD2-NH2 3.47Å; P625-R654 VanDerWaalsContact C-NH1 3.34Å; P625-R654 WeakPolarHBondContact O-CD 3.27Å; P625-R654 PolarHBondContact O-NH1 3.16Å; W648-R654 HydrophobicContact CD2-CG 4.47Å; W648-R654 HydrophobicContact CE3-CB 4.35Å; W648-R654 HydrophobicContact CE3-CG 4.4Å; W648-R654 HydrophobicContact CH2-CB 3.78Å; W648-R654 HydrophobicContact CH2-CG 3.85Å; W648-R654 HydrophobicContact CZ2-CB 4.37Å; W648-R654 HydrophobicContact CZ2-CG 3.93Å; W648-R654 HydrophobicContact CZ3-CB 3.75Å; W648-R654 HydrophobicContact CZ3-CG 4.09Å; N649-R654 PolarHBondContact OD1-O 2.89Å
655	T	92.6	Very high	78.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.6	177.3	-58.7	0	0	0	0	108.9	G466 L493 R494 P495 R626 V627 L628	G466-T655 WeakPolarHBondContact O-CB 3.18Å; G466-T655 PolarHBondContact O-OG1 2.96Å; L493-T655 HydrophobicContact CB-CG2 3.52Å; L493-T655 HydrophobicContact CD1-CG2 4.49Å; R494-T655 PolarHBondContact O-OG1 3.42Å; P495-T655 WeakPolarHBondContact CA-OG1 3.26Å; R626-T655 PolarHBondContact O-N 2.83Å; V627-T655 CarbonylContact C-O 3.43Å; V627-T655 WeakPolarHBondContact CA-O 3.36Å; L628-T655 PolarHBondContact N-O 2.64Å
656	V	91.4	Very high	78.3	Confident	9 Å²	9	45.5 Å²	45.5	6%	0.055	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.3	-179.7	-177.9	0	0	0	0	110.6	E497 V498 T499 L628 L630 W648 N649 V658	E497-V656 PolarHBondContact O-N 3.09Å; V498-V656 HydrophobicContact CG1-CB 4.44Å; V498-V656 HydrophobicContact CG1-CG1 4.3Å; V498-V656 HydrophobicContact CG2-CB 4.31Å; T499-V656 PolarHBondContact N-O 3.45Å; L628-V656 HydrophobicContact CB-CG2 4.44Å; L628-V656 WeakPolarHBondContact O-CA 3.41Å; L630-V656 HydrophobicContact CD1-CG1 4.41Å; W648-V656 HydrophobicContact CE3-CG2 4.41Å; W648-V656 HydrophobicContact CZ3-CG2 3.82Å; N649-V656 HydrophobicContact CB-CG2 4.19Å; N649-V656 VanDerWaalsContact OD1-CG2 3.31Å; N649-V656 WeakPolarHBondContact OD1-CG2 3.28Å; V656-V658 HydrophobicContact CG1-CG2 3.69Å
657	L	91.9	Very high	78.2	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.2	169.8	178.2	64.9	0	0	0	109.2	L493 T499 L501 V512 L516 L628 I629 L630	L493-L657 HydrophobicContact CD1-CB 4.14Å; L493-L657 HydrophobicContact CD1-CD1 4.39Å; L493-L657 HydrophobicContact CD1-CD2 4.3Å; L493-L657 HydrophobicContact CD2-CD1 4.17Å; T499-L657 HydrophobicContact CG2-CD1 4.37Å; L501-L657 HydrophobicContact CB-CD1 4.13Å; V512-L657 HydrophobicContact CG1-CD2 4.34Å; L516-L657 HydrophobicContact CD2-CD2 4.16Å; L628-L657 PolarHBondContact O-N 2.97Å; I629-L657 CarbonylContact C-O 3.38Å; I629-L657 WeakPolarHBondContact CA-O 3.44Å; I629-L657 HydrophobicContact CG1-CB 4.49Å; I629-L657 HydrophobicContact CG2-CD2 4.21Å; I629-L657 HydrophobicContact CG2-CG 4.49Å; L630-L657 PolarHBondContact N-O 3.38Å
658	V	89.4	Confident	78	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.1	176.3	-168.3	0	0	0	0	109.6	V498 T499 A500 L501 L630 T634 V656 A660 T665	V498-V658 HydrophobicContact CG1-CG2 3.86Å; T499-V658 PolarHBondContact O-N 3.08Å; A500-V658 CarbonylContact C-O 3.57Å; A500-V658 VanDerWaalsContact CA-O 3.31Å; A500-V658 WeakPolarHBondContact CA-O 3.47Å; L501-V658 PolarHBondContact N-O 3.28Å; L630-V658 HydrophobicContact CB-CG1 4.27Å; L630-V658 HydrophobicContact CD1-CG2 4.3Å; T634-V658 HydrophobicContact CG2-CG1 4.39Å; V656-V658 HydrophobicContact CG1-CG2 3.69Å; V658-A660 HydrophobicContact CG1-CB 4.13Å; V658-A660 PolarHBondContact O-N 2.95Å; V658-T665 HydrophobicContact CG1-CG2 3.72Å
659	I	88.4	Confident	77.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	104.1	167.9	-57.2	167.5	0	0	0	106.3	L501 K509 A513 L630 D631 E632	L501-I659 HydrophobicContact CB-CG1 4.39Å; L501-I659 HydrophobicContact CD2-CG1 4.34Å; L501-I659 WeakPolarHBondContact O-CA 3.31Å; K509-I659 HydrophobicContact CB-CD1 4.29Å; K509-I659 HydrophobicContact CB-CG1 4.44Å; K509-I659 HydrophobicContact CB-CG2 3.59Å; K509-I659 HydrophobicContact CD-CG2 3.76Å; K509-I659 HydrophobicContact CG-CG2 4.26Å; A513-I659 HydrophobicContact CB-CD1 4.02Å; L630-I659 PolarHBondContact O-N 3.49Å; D631-I659 HydrophobicContact CB-CD1 3.98Å; D631-I659 WeakPolarHBondContact OD1-CB 3.41Å; D631-I659 WeakPolarHBondContact OD1-CD1 3.28Å; D631-I659 WeakPolarHBondContact OD1-CG2 3.48Å; E632-I659 WeakPolarHBondContact CA-O 3.3Å; E632-I659 PolarHBondContact N-O 2.86Å
660	A	75.7	Confident	78.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.262	C	S	.	.			trans	-117.6	134.3	-170.5	0	0	0	0	0	111.4	L501 V658 T665 V666	L501-A660 PolarHBondContact O-N 3.49Å; V658-A660 HydrophobicContact CG1-CB 4.13Å; V658-A660 PolarHBondContact O-N 2.95Å; A660-T665 HydrophobicContact CB-CG2 4.26Å; A660-V666 HydrophobicContact CB-CG2 3.87Å
661	H	69.1	Low	78.7	Confident	63 Å²	63	51.5 Å²	51.5	29%	0.292	24%	0.244	S	C	.	.			trans	-100.5	-6.8	162.5	-77.8	-96.3	0	0	0	112.2	G503 N505 K509 E632 R699	G503-H661 PolarHBondContact O-CE1 3.34Å; N505-H661 PolarHBondContact OD1-CE1 2.84Å; K509-H661 WeakPolarHBondContact CE-NE2 3.43Å; K509-H661 PolarHBondContact NZ-CE1 2.84Å; K509-H661 VanDerWaalsContact NZ-CE1 3.31Å; K509-H661 PolarHBondContact NZ-NE2 3.41Å; E632-H661 VanDerWaalsContact CD-CD2 3.42Å; E632-H661 IonicContact OE1-CD2 3.73Å; E632-H661 PolarHBondContact OE1-CD2 2.99Å; E632-H661 IonicContact OE1-NE2 3.95Å; E632-H661 PolarHBondContact OE1-NE2 3.43Å; E632-H661 VanDerWaalsContact OE1-NE2 3.1Å; H661-R699 PolarHBondContact O-NH2 3.42Å
662	R	64.6	Low	79.2	Confident	103 Å²	103	46.7 Å²	46.7	39%	0.389	23%	0.229	S	C	.	.			trans	-98.3	129.5	-176.3	-71.7	-174.8	167.6	-174.1	-5.3	112.3	T634 S635 Q664 T665 V666	T634-R662 PolarHBondContact O-NH1 3.36Å; S635-R662 VanDerWaalsContact CA-CZ 3.47Å; S635-R662 PolarHBondContact O-NH1 3.13Å; S635-R662 PolarHBondContact O-NH2 3.48Å; R662-Q664 VanDerWaalsContact C-N 3.34Å; R662-Q664 PolarHBondContact O-N 2.91Å; R662-T665 PolarHBondContact O-N 3.24Å; R662-V666 WeakPolarHBondContact O-CG2 3.39Å; R662-V666 PolarHBondContact O-N 2.87Å
663	L	64.4	Low	79.8	Confident	39 Å²	39	45.4 Å²	45.4	20%	0.204	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-40.2	-176.6	-143.5	80.1	0	0	0	113.1	T665 V666 Q667 Y692 V696	L663-T665 PolarHBondContact O-N 2.94Å; L663-V666 PolarHBondContact O-N 3.38Å; L663-Q667 WeakPolarHBondContact O-CG 3.21Å; L663-Q667 PolarHBondContact O-N 2.83Å; L663-Y692 HydrophobicContact CD1-CE2 4.31Å; L663-Y692 HydrophobicContact CD2-CD2 4.25Å; L663-Y692 HydrophobicContact CD2-CE1 4.39Å; L663-Y692 HydrophobicContact CD2-CE2 3.28Å; L663-Y692 WeakPolarHBondContact CD2-OH 3.45Å; L663-Y692 HydrophobicContact CG-CD2 4.45Å; L663-Y692 HydrophobicContact CG-CE2 3.76Å; L663-V696 HydrophobicContact CD1-CG2 4.11Å; L663-V696 HydrophobicContact CD2-CG2 4.18Å
664	Q	65.3	Low	80.1	Confident	126 Å²	126	43.9 Å²	43.9	59%	0.589	21%	0.205	S	C	*	.	H	α-helix	trans	-64	-40.1	-178.4	-69.4	176.4	-10.1	0	0	112.4	R662 V666	R662-Q664 VanDerWaalsContact C-N 3.34Å; R662-Q664 PolarHBondContact O-N 2.91Å; Q664-V666 VanDerWaalsContact C-N 3.32Å
665	T	67	Low	80.1	Confident	17 Å²	17	43.6 Å²	43.6	10%	0.104	20%	0.203	C	C	.	.	H	α-helix	trans	-69.1	-33.5	176.8	-37.7	0	0	0	0	111.5	T634 V658 A660 R662 L663	T634-T665 HydrophobicContact CG2-CG2 4.09Å; V658-T665 HydrophobicContact CG1-CG2 3.72Å; A660-T665 HydrophobicContact CB-CG2 4.26Å; R662-T665 PolarHBondContact O-N 3.24Å; L663-T665 PolarHBondContact O-N 2.94Å
666	V	73.5	Confident	79.8	Confident	12 Å²	12	47.1 Å²	47.1	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-72.7	-41	176.9	177	0	0	0	0	111.8	A500 V502 A660 R662 L663 Q664 R668 A669 I672	A500-V666 HydrophobicContact CB-CG2 4.38Å; V502-V666 HydrophobicContact CG2-CB 4.48Å; V502-V666 HydrophobicContact CG2-CG1 4.12Å; V502-V666 HydrophobicContact CG2-CG2 3.47Å; V502-V666 VanDerWaalsContact CG2-CG2 3.47Å; A660-V666 HydrophobicContact CB-CG2 3.87Å; R662-V666 WeakPolarHBondContact O-CG2 3.39Å; R662-V666 PolarHBondContact O-N 2.87Å; L663-V666 PolarHBondContact O-N 3.38Å; Q664-V666 VanDerWaalsContact C-N 3.32Å; V666-R668 PolarHBondContact O-N 2.82Å; V666-A669 WeakPolarHBondContact O-CB 3.32Å; V666-A669 PolarHBondContact O-N 2.9Å; V666-I672 HydrophobicContact CG1-CD1 3.7Å; V666-I672 HydrophobicContact CG1-CG1 4.04Å; V666-I672 HydrophobicContact CG1-CG2 4.04Å
667	Q	71.5	Confident	79.6	Confident	115 Å²	115	53.6 Å²	53.6	54%	0.537	25%	0.25	S	C	.	.	H	α-helix	trans	-61.3	-28.1	179.5	-80.3	178	-27.1	0	0	113.7	L663 Y692	L663-Q667 WeakPolarHBondContact O-CG 3.21Å; L663-Q667 PolarHBondContact O-N 2.83Å; Q667-Y692 HydrophobicContact CG-CE2 4.39Å; Q667-Y692 PolarHBondContact NE2-OH 3.38Å
668	R	71.3	Confident	79.3	Confident	130 Å²	130	53.6 Å²	53.6	49%	0.491	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-1	-177.6	-67.6	173.8	169.5	171.6	-3.2	113.4	E642 V666	E642-R668 IonicContact OE2-NH1 3.12Å; E642-R668 PolarHBondContact OE2-NH1 2.83Å; V666-R668 PolarHBondContact O-N 2.82Å
669	A	79.3	Confident	79.3	Confident	17 Å²	17	59 Å²	59	14%	0.14	27%	0.272	C	S	.	.			trans	-77.7	143	-180	0	0	0	0	0	111.2	V498 A500 V666 Q671 I672	V498-A669 CarbonylContact O-C 3.53Å; A500-A669 HydrophobicContact CB-CB 3.54Å; V666-A669 WeakPolarHBondContact O-CB 3.32Å; V666-A669 PolarHBondContact O-N 2.9Å; A669-Q671 VanDerWaalsContact C-N 3.33Å; A669-I672 HydrophobicContact CB-CG1 4.22Å
670	H	85.3	Confident	79.3	Confident	129 Å²	129	61.1 Å²	61.1	60%	0.597	28%	0.283	S	S	*	.	S	Bend	trans	-72.9	-33.5	175.2	-60.9	75.6	0	0	0	110.7	E497 V498	E497-H670 HydrophobicContact CB-CB 4.14Å; E497-H670 HydrophobicContact CG-CB 4.25Å; V498-H670 PolarHBondContact N-ND1 3.29Å; V498-H670 VanDerWaalsContact N-ND1 3.15Å; V498-H670 PolarHBondContact O-N 3.01Å
671	Q	87	Confident	79.7	Confident	56 Å²	56	64.2 Å²	64.2	26%	0.262	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136	177.2	-176.4	177.3	-1.4	0	0	110	T492 V498 T499 A500 A669 L673	T492-Q671 PolarHBondContact O-OE1 2.92Å; V498-Q671 PolarHBondContact O-N 2.97Å; T499-Q671 CarbonylContact C-O 3.59Å; T499-Q671 VanDerWaalsContact CA-O 3.32Å; T499-Q671 WeakPolarHBondContact CA-O 3.31Å; T499-Q671 HydrophobicContact CG2-CB 4.12Å; T499-Q671 HydrophobicContact CG2-CG 4.17Å; A500-Q671 PolarHBondContact N-O 3.06Å; A669-Q671 VanDerWaalsContact C-N 3.33Å; Q671-L673 HydrophobicContact CG-CD2 4.41Å; Q671-L673 HydrophobicContact CG-CG 4.5Å
672	I	88.1	Confident	79.4	Confident	51 Å²	51	68.8 Å²	68.8	26%	0.262	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.2	176.1	-57.3	167.5	0	0	0	108.8	A500 V502 V666 A669 V674	A500-I672 WeakPolarHBondContact O-CA 3.31Å; V502-I672 HydrophobicContact CG2-CG2 4.36Å; V666-I672 HydrophobicContact CG1-CD1 3.7Å; V666-I672 HydrophobicContact CG1-CG1 4.04Å; V666-I672 HydrophobicContact CG1-CG2 4.04Å; A669-I672 HydrophobicContact CB-CG1 4.22Å; I672-V674 HydrophobicContact CG2-CG2 4.33Å
673	L	88.8	Confident	79	Confident	17 Å²	17	70.1 Å²	70.1	9%	0.089	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.4	177	-64.4	179.1	0	0	0	109.1	F491 T499 A500 L501 V502 Q671 L680	F491-L673 HydrophobicContact CB-CD1 4.08Å; F491-L673 HydrophobicContact CB-CD2 4.32Å; F491-L673 HydrophobicContact CD1-CD1 4.47Å; F491-L673 HydrophobicContact CD2-CD1 3.46Å; F491-L673 VanDerWaalsContact CD2-CD1 3.46Å; F491-L673 HydrophobicContact CE2-CD1 3.96Å; F491-L673 HydrophobicContact CG-CD1 3.76Å; T499-L673 HydrophobicContact CG2-CD1 3.68Å; T499-L673 HydrophobicContact CG2-CG 3.89Å; A500-L673 PolarHBondContact O-N 2.88Å; L501-L673 WeakPolarHBondContact CA-O 3.39Å; L501-L673 HydrophobicContact CD1-CB 3.73Å; V502-L673 PolarHBondContact N-O 3.21Å; Q671-L673 HydrophobicContact CG-CD2 4.41Å; Q671-L673 HydrophobicContact CG-CG 4.5Å; L673-L680 HydrophobicContact CB-CD2 3.88Å; L673-L680 HydrophobicContact CD2-CD2 4.2Å; L673-L680 HydrophobicContact CG-CD2 4.48Å
674	V	88.4	Confident	78	Confident	23 Å²	23	71.8 Å²	71.8	14%	0.139	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.1	178.1	-175.7	0	0	0	0	109.7	V502 I672 Q681 L691	V502-V674 CarbonylContact O-C 3.5Å; V502-V674 WeakPolarHBondContact O-CA 3.43Å; I672-V674 HydrophobicContact CG2-CG2 4.33Å; V674-Q681 HydrophobicContact CB-CB 4.48Å; V674-Q681 PolarHBondContact O-N 3.38Å; V674-L691 HydrophobicContact CG2-CD1 4.35Å
675	L	88.6	Confident	76.9	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.2	-178.3	-169.3	71.5	0	0	0	110.6	L486 L489 L501 V502 G503 S507 K509 L680	L486-L675 HydrophobicContact CD2-CD2 4.41Å; L489-L675 HydrophobicContact CD2-CD1 3.76Å; L489-L675 HydrophobicContact CG-CD1 4.22Å; L501-L675 HydrophobicContact CD1-CB 4.03Å; V502-L675 PolarHBondContact O-N 3.45Å; G503-L675 WeakPolarHBondContact CA-O 3.43Å; S507-L675 VanDerWaalsContact CB-O 3.25Å; S507-L675 WeakPolarHBondContact CB-O 3.4Å; S507-L675 WeakPolarHBondContact O-CD2 3.46Å; S507-L675 WeakPolarHBondContact O-CG 3.3Å; S507-L675 PolarHBondContact OG-O 3.04Å; K509-L675 HydrophobicContact CG-CD2 4.16Å; L675-L680 HydrophobicContact CD1-CG 4.43Å
676	Q	86.9	Confident	76	Confident	75 Å²	75	72.7 Å²	72.7	35%	0.35	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.7	178.6	-170.9	174.6	9.3	0	0	110.1	G678 K679 Q681	Q676-G678 PolarHBondContact O-N 3.31Å; Q676-K679 PolarHBondContact N-O 3.5Å; Q676-K679 PolarHBondContact O-N 3.04Å; Q676-Q681 HydrophobicContact CB-CG 4.21Å
677	E	86.2	Confident	74.4	Confident	145 Å²	145	79.9 Å²	79.9	68%	0.678	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	33	-180	-62.1	-177.1	-175	0	0	115	K487	K487-E677 PolarHBondContact NZ-O 3.28Å
678	G	85.9	Confident	73.1	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	12.3	-179	0	0	0	0	0	115.4	V485 K487 L489 S507 Q676	V485-G678 WeakPolarHBondContact O-CA 3.47Å; K487-G678 PolarHBondContact N-O 3.23Å; L489-G678 WeakPolarHBondContact CD1-O 3.48Å; S507-G678 PolarHBondContact O-N 2.98Å; Q676-G678 PolarHBondContact O-N 3.31Å
679	K	89.7	Confident	71.8	Confident	121 Å²	121	77.2 Å²	77.2	53%	0.526	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.1	177.3	-65.9	-176.8	178.7	-179.7	0	111.3	K487 Q676	K487-K679 HydrophobicContact CB-CG 3.86Å; K487-K679 HydrophobicContact CD-CG 4.37Å; Q676-K679 PolarHBondContact N-O 3.5Å; Q676-K679 PolarHBondContact O-N 3.04Å
680	L	88.3	Confident	70.6	Confident	44 Å²	44	81.8 Å²	81.8	23%	0.23	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	129	170.8	-80.1	166.1	0	0	0	110.1	L489 F491 L673 L675	L489-L680 HydrophobicContact CB-CD1 4.46Å; L489-L680 HydrophobicContact CG-CD1 4.43Å; L489-L680 HydrophobicContact CG-CG 4.41Å; F491-L680 HydrophobicContact CB-CD1 3.97Å; F491-L680 HydrophobicContact CD1-CD1 3.59Å; F491-L680 HydrophobicContact CE1-CD1 4.48Å; F491-L680 HydrophobicContact CG-CD1 4.15Å; L673-L680 HydrophobicContact CB-CD2 3.88Å; L673-L680 HydrophobicContact CD2-CD2 4.2Å; L673-L680 HydrophobicContact CG-CD2 4.48Å; L675-L680 HydrophobicContact CD1-CG 4.43Å
681	Q	83.8	Confident	69.1	Low	66 Å²	66	77.8 Å²	77.8	31%	0.308	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-78.9	142	174.3	-64.7	-67.3	8.1	0	0	110.8	V674 Q676	V674-Q681 HydrophobicContact CB-CB 4.48Å; V674-Q681 PolarHBondContact O-N 3.38Å; Q676-Q681 HydrophobicContact CB-CG 4.21Å
682	K	64.4	Low	67.4	Low	158 Å²	158	80.2 Å²	80.2	69%	0.687	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-77.1	133.3	176.9	-73.8	-176.8	178.4	179.9	0	110.2	A684 Q685	K682-A684 PolarHBondContact O-N 3.48Å; K682-A684 VanDerWaalsContact O-N 3.16Å; K682-Q685 WeakPolarHBondContact O-CB 3.47Å; K682-Q685 PolarHBondContact O-N 3.25Å
683	L	54.8	Low	65.8	Low	132 Å²	132	79.7 Å²	79.7	69%	0.691	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-52.8	-35.5	176.7	-104.1	117.9	0	0	0	113.5	Q685 L686	L683-Q685 VanDerWaalsContact C-N 3.25Å; L683-Q685 PolarHBondContact O-N 3.02Å; L683-L686 WeakPolarHBondContact O-CA 3.38Å; L683-L686 VanDerWaalsContact O-CB 3.29Å; L683-L686 WeakPolarHBondContact O-CB 3.44Å; L683-L686 PolarHBondContact O-N 2.97Å
684	A	43.3	Very low	64.3	Low	73 Å²	73	84.2 Å²	84.2	60%	0.603	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-65.2	-21.1	177.5	0	0	0	0	0	114.5	K682 L686	K682-A684 PolarHBondContact O-N 3.48Å; K682-A684 VanDerWaalsContact O-N 3.16Å; A684-L686 PolarHBondContact O-N 3.36Å
685	Q	43.5	Very low	62.7	Low	125 Å²	125	84.8 Å²	84.8	58%	0.584	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-78.1	-3.9	172.3	-76.2	174.8	-40.3	0	0	112.9	K682 L683	K682-Q685 WeakPolarHBondContact O-CB 3.47Å; K682-Q685 PolarHBondContact O-N 3.25Å; L683-Q685 VanDerWaalsContact C-N 3.25Å; L683-Q685 PolarHBondContact O-N 3.02Å
686	L	46.8	Very low	60.9	Low	37 Å²	37	87.4 Å²	87.4	19%	0.194	45%	0.447	C	S	.	.	S	Bend	trans	-110.6	-6.1	-174.7	-58.5	155.8	0	0	0	112.1	L683 A684 L691	L683-L686 WeakPolarHBondContact O-CA 3.38Å; L683-L686 VanDerWaalsContact O-CB 3.29Å; L683-L686 WeakPolarHBondContact O-CB 3.44Å; L683-L686 PolarHBondContact O-N 2.97Å; A684-L686 PolarHBondContact O-N 3.36Å; L686-L691 HydrophobicContact CB-CD1 3.58Å; L686-L691 HydrophobicContact CD1-CD1 3.27Å; L686-L691 HydrophobicContact CD2-CD1 3.23Å; L686-L691 HydrophobicContact CG-CD1 3.43Å; L686-L691 VanDerWaalsContact CG-CD1 3.43Å
687	E	40.5	Very low	59.1	Low	163 Å²	163	89.5 Å²	89.5	76%	0.762	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.5	178.4	-70.8	179.2	160.5	0	0	113.5
688	G	43.8	Very low	57.4	Low	74 Å²	74	87.3 Å²	87.3	76%	0.763	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-16.5	-178.3	0	0	0	0	0	115.4
689	Q	44	Very low	55.5	Low	116 Å²	116	93.9 Å²	93.9	54%	0.542	47%	0.472	S	S	.	.	S	Bend	trans	-164.3	121.4	178.1	-101.7	170.5	-3.7	0	0	107.5	L691	Q689-L691 PolarHBondContact O-N 3.29Å
690	D	55.2	Low	52.8	Low	112 Å²	112	94.8 Å²	94.8	60%	0.599	48%	0.481	S	S	*	.			trans	-28.8	111.4	-176.3	-153.4	-1	0	0	0	113.2	Y692 S693 R694	D690-Y692 PolarHBondContact O-N 3.08Å; D690-S693 WeakPolarHBondContact O-CA 3.29Å; D690-S693 WeakPolarHBondContact O-CB 3.47Å; D690-S693 PolarHBondContact O-N 3.03Å; D690-S693 PolarHBondContact O-OG 3.19Å; D690-R694 PolarHBondContact O-N 2.89Å
691	L	53	Low	50.2	Low	46 Å²	46	101 Å²	101	24%	0.241	51%	0.512	C	S	.	.	H	α-helix	trans	-45.4	-36.1	176.5	-172.7	82.8	0	0	0	111.7	V674 L686 Q689 L695	V674-L691 HydrophobicContact CG2-CD1 4.35Å; L686-L691 HydrophobicContact CB-CD1 3.58Å; L686-L691 HydrophobicContact CD1-CD1 3.27Å; L686-L691 HydrophobicContact CD2-CD1 3.23Å; L686-L691 HydrophobicContact CG-CD1 3.43Å; L686-L691 VanDerWaalsContact CG-CD1 3.43Å; Q689-L691 PolarHBondContact O-N 3.29Å; L691-L695 HydrophobicContact CG-CD1 4.31Å; L691-L695 PolarHBondContact O-N 3.26Å
692	Y	51.8	Low	47.8	Very low	106 Å²	106	107.2 Å²	107.2	42%	0.416	55%	0.547	S	S	.	.	H	α-helix	trans	-61.7	-42.8	176.7	-164.3	-104.2	0	0	0	112.8	L663 Q667 D690 V696	L663-Y692 HydrophobicContact CD1-CE2 4.31Å; L663-Y692 HydrophobicContact CD2-CD2 4.25Å; L663-Y692 HydrophobicContact CD2-CE1 4.39Å; L663-Y692 HydrophobicContact CD2-CE2 3.28Å; L663-Y692 WeakPolarHBondContact CD2-OH 3.45Å; L663-Y692 HydrophobicContact CG-CD2 4.45Å; L663-Y692 HydrophobicContact CG-CE2 3.76Å; Q667-Y692 HydrophobicContact CG-CE2 4.39Å; Q667-Y692 PolarHBondContact NE2-OH 3.38Å; D690-Y692 PolarHBondContact O-N 3.08Å; Y692-V696 HydrophobicContact CE1-CG2 4.48Å; Y692-V696 WeakPolarHBondContact O-CB 2.95Å; Y692-V696 WeakPolarHBondContact O-CG2 3.47Å; Y692-V696 PolarHBondContact O-N 3.4Å
693	S	53.9	Low	47	Very low	40 Å²	40	104.7 Å²	104.7	28%	0.28	54%	0.54	S	S	.	.	H	α-helix	trans	-67.9	-37.9	-178.6	69	0	0	0	0	113.1	D690 Q697	D690-S693 WeakPolarHBondContact O-CA 3.29Å; D690-S693 WeakPolarHBondContact O-CB 3.47Å; D690-S693 PolarHBondContact O-N 3.03Å; D690-S693 PolarHBondContact O-OG 3.19Å; S693-Q697 VanDerWaalsContact O-CB 3.27Å; S693-Q697 WeakPolarHBondContact O-CB 3.35Å; S693-Q697 VanDerWaalsContact O-CG 3.26Å; S693-Q697 WeakPolarHBondContact O-CG 3.49Å; S693-Q697 PolarHBondContact O-N 3.41Å
694	R	57.3	Low	46.6	Very low	113 Å²	113	103.3 Å²	103.3	43%	0.426	53%	0.532	S	S	.	.	H	α-helix	trans	-76.1	-38.4	178.3	-75.6	-172.9	-172.2	158.7	6.2	113.1	D690 V696 Q697 Q698	D690-R694 PolarHBondContact O-N 2.89Å; R694-V696 VanDerWaalsContact C-N 3.27Å; R694-V696 PolarHBondContact O-N 3.28Å; R694-Q697 PolarHBondContact O-N 3.03Å; R694-Q698 PolarHBondContact O-N 3.02Å
695	L	55.4	Low	46.8	Very low	34 Å²	34	104.9 Å²	104.9	18%	0.178	53%	0.528	C	S	.	.	H	α-helix	trans	-64.7	-35	173.8	-75.9	168.4	0	0	0	111.4	V502 L691 R699	V502-L695 HydrophobicContact CG1-CD2 3.84Å; L691-L695 HydrophobicContact CG-CD1 4.31Å; L691-L695 PolarHBondContact O-N 3.26Å; L695-R699 PolarHBondContact O-N 3.08Å
696	V	50.6	Low	47	Very low	55 Å²	55	103.8 Å²	103.8	33%	0.333	53%	0.525	S	S	.	.	H	α-helix	trans	-72.7	-39.8	172.6	172.2	0	0	0	0	111.8	L663 Y692 R694 R699 L700	L663-V696 HydrophobicContact CD1-CG2 4.11Å; L663-V696 HydrophobicContact CD2-CG2 4.18Å; Y692-V696 HydrophobicContact CE1-CG2 4.48Å; Y692-V696 WeakPolarHBondContact O-CB 2.95Å; Y692-V696 WeakPolarHBondContact O-CG2 3.47Å; Y692-V696 PolarHBondContact O-N 3.4Å; R694-V696 VanDerWaalsContact C-N 3.27Å; R694-V696 PolarHBondContact O-N 3.28Å; V696-R699 WeakPolarHBondContact O-CB 3.41Å; V696-R699 PolarHBondContact O-N 3.33Å; V696-L700 PolarHBondContact O-N 2.87Å
697	Q	47.8	Very low	47	Very low	120 Å²	120	107.9 Å²	107.9	56%	0.561	55%	0.545	S	S	*	.	H	α-helix	trans	-67.7	-36.9	176.6	-83.3	176.8	-17.1	0	0	113.3	S693 R694 R699 L700	S693-Q697 VanDerWaalsContact O-CB 3.27Å; S693-Q697 WeakPolarHBondContact O-CB 3.35Å; S693-Q697 VanDerWaalsContact O-CG 3.26Å; S693-Q697 WeakPolarHBondContact O-CG 3.49Å; S693-Q697 PolarHBondContact O-N 3.41Å; R694-Q697 PolarHBondContact O-N 3.03Å; Q697-R699 VanDerWaalsContact C-N 3.29Å; Q697-R699 PolarHBondContact O-N 2.72Å; Q697-L700 PolarHBondContact O-N 3.4Å; Q697-L700 VanDerWaalsContact O-N 3.12Å
698	Q	50.6	Low	47.4	Very low	98 Å²	98	104.3 Å²	104.3	46%	0.458	53%	0.531	S	S	.	.	H	α-helix	trans	-64.3	-34.7	174	-86.4	-177.3	-32.1	0	0	112	R694 L700 M701 D702	R694-Q698 PolarHBondContact O-N 3.02Å; Q698-L700 PolarHBondContact O-N 2.93Å; Q698-M701 PolarHBondContact O-N 3.4Å; Q698-D702 PolarHBondContact O-N 3.19Å
699	R	45.8	Very low	47.7	Very low	139 Å²	139	106.4 Å²	106.4	53%	0.525	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-15.2	172.2	-99.9	-175.9	178.4	-152.9	-4.2	115	H661 L695 V696 Q697	H661-R699 PolarHBondContact O-NH2 3.42Å; L695-R699 PolarHBondContact O-N 3.08Å; V696-R699 WeakPolarHBondContact O-CB 3.41Å; V696-R699 PolarHBondContact O-N 3.33Å; Q697-R699 VanDerWaalsContact C-N 3.29Å; Q697-R699 PolarHBondContact O-N 2.72Å
700	L	34.6	Very low	47.9	Very low	139 Å²	139	105.7 Å²	105.7	73%	0.728	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-6.6	176.1	-79.6	159.1	0	0	0	112.2	V696 Q697 Q698	V696-L700 PolarHBondContact O-N 2.87Å; Q697-L700 PolarHBondContact O-N 3.4Å; Q697-L700 VanDerWaalsContact O-N 3.12Å; Q698-L700 PolarHBondContact O-N 2.93Å
701	M	32.8	Very low	47.3	Very low	176 Å²	176	105.2 Å²	105.2	87%	0.867	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-13.1	179.5	-68.3	-150.3	176	0	0	114.6	Q698	Q698-M701 PolarHBondContact O-N 3.4Å
702	D	34.3	Very low	46.8	Very low	196 Å²	196	110.5 Å²	110.5	100%	1.048	53%	0.529	S	S	*	.			trans	-91.7	0	162.4	-70	-23.9	0	0	0	109.4	Q698	Q698-D702 PolarHBondContact O-N 3.19Å

Retrieved 702 of 702 residues in 311.8 ms (Link to these results)

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