A0A3B3ULD3_9TELE Loading...

Upstream binding transcription factor

AlphaFold DB , UniProt , Accession A0A3B3ULD3, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 738 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	Very low	39.7	Very low	240 Å²	240	146.7 Å²	146.7	100%	1.182	84%	0.842	S	S	*	*				0	128.8	0	-84.2	172.3	163.4	0	0	106.5
2	N	37.8	Very low	41.7	Very low	153 Å²	153	142.1 Å²	142.1	82%	0.818	81%	0.807	S	S	*	*			trans	-78	151.1	-167.9	-57.9	8.5	0	0	0	110.3
3	G	32.4	Very low	44.3	Very low	75 Å²	75	141.5 Å²	141.5	77%	0.773	81%	0.808	S	S	*	*			trans	-131.6	88.9	166.2	0	0	0	0	0	107.5	M5	G3-M5 PolarHBondContact O-N 2.73Å
4	D	42.7	Very low	47.3	Very low	141 Å²	141	133.9 Å²	133.9	75%	0.754	76%	0.759	S	S	*	*			trans	-62.4	132.6	174.5	-65.7	-75	0	0	0	110.2
5	M	38.1	Very low	50	Low	185 Å²	185	128.1 Å²	128.1	91%	0.911	74%	0.735	S	S	*	*			trans	-128	86.8	159.6	-84.9	-166.2	167.5	0	0	108	G3 A7	G3-M5 PolarHBondContact O-N 2.73Å; M5-A7 PolarHBondContact O-N 3.28Å
6	E	40.8	Very low	52.2	Low	181 Å²	181	126.6 Å²	126.6	85%	0.846	72%	0.719	S	S	*	*			trans	-55.2	108.6	155.1	-69	-176.3	110.9	0	0	107.7	V8	E6-V8 VanDerWaalsContact C-N 3.26Å; E6-V8 PolarHBondContact O-N 2.74Å
7	A	39.4	Very low	54.3	Low	98 Å²	98	126.5 Å²	126.5	81%	0.81	72%	0.716	S	S	*	*			trans	-70.9	88.3	174.7	0	0	0	0	0	108.4	M5 A9	M5-A7 PolarHBondContact O-N 3.28Å; A7-A9 PolarHBondContact O-N 3.07Å
8	V	37.2	Very low	56.3	Low	117 Å²	117	121.1 Å²	121.1	71%	0.709	69%	0.685	S	S	*	*			trans	-45.1	115.5	-179.1	177.5	0	0	0	0	110	E6 Q10	E6-V8 VanDerWaalsContact C-N 3.26Å; E6-V8 PolarHBondContact O-N 2.74Å; V8-Q10 HydrophobicContact CG1-CG 4.34Å; V8-Q10 PolarHBondContact O-N 3.27Å
9	A	41.3	Very low	58	Low	102 Å²	102	116.1 Å²	116.1	84%	0.843	66%	0.656	S	S	*	*			trans	-68.3	82.4	174.2	0	0	0	0	0	109.6	A7 D11	A7-A9 PolarHBondContact O-N 3.07Å; A9-D11 PolarHBondContact O-N 2.83Å
10	Q	41.5	Very low	59.7	Low	160 Å²	160	111.4 Å²	111.4	75%	0.748	63%	0.629	S	S	*	*			trans	-62.9	127.9	171.2	-69.3	-175	-18.7	0	0	108.5	V8 Q12	V8-Q10 HydrophobicContact CG1-CG 4.34Å; V8-Q10 PolarHBondContact O-N 3.27Å; Q10-Q12 PolarHBondContact O-N 2.64Å
11	D	50.6	Low	61.2	Low	162 Å²	162	110.3 Å²	110.3	87%	0.866	62%	0.618	S	S	*	*			trans	-70.3	79.8	178.6	-167.3	10.3	0	0	0	109.4	A9 V13	A9-D11 PolarHBondContact O-N 2.83Å; D11-V13 PolarHBondContact O-N 2.65Å
12	Q	63.8	Low	63.9	Low	91 Å²	91	99 Å²	99	43%	0.425	56%	0.562	S	S	.	*			trans	-75.9	101.8	-164.5	-170.2	164.9	12.7	0	0	110.1	Q10 W14	Q10-Q12 PolarHBondContact O-N 2.64Å; Q12-W14 VanDerWaalsContact O-CD1 3.23Å; Q12-W14 PolarHBondContact O-N 2.83Å
13	V	76.1	Confident	66.5	Low	134 Å²	134	91.8 Å²	91.8	81%	0.812	52%	0.523	S	S	*	.			trans	-56.3	108.1	-176.1	-176.8	0	0	0	0	111	D11 A15	D11-V13 PolarHBondContact O-N 2.65Å; V13-A15 PolarHBondContact O-N 3.38Å
14	W	85.5	Confident	69.3	Low	35 Å²	35	91.7 Å²	91.7	13%	0.133	51%	0.505	C	S	.	.			trans	-67.8	119.8	175.9	-78.6	69.4	0	0	0	110.9	Q12 D18 L19 L22 F52 Y55 M59 K63	Q12-W14 VanDerWaalsContact O-CD1 3.23Å; Q12-W14 PolarHBondContact O-N 2.83Å; W14-D18 HydrophobicContact CE3-CB 4.02Å; W14-D18 HydrophobicContact CZ3-CB 4.46Å; W14-L19 HydrophobicContact CB-CD2 4Å; W14-L19 HydrophobicContact CB-CG 4.09Å; W14-L19 HydrophobicContact CD2-CD2 4.14Å; W14-L19 HydrophobicContact CE3-CD2 3.72Å; W14-L19 HydrophobicContact CE3-CG 4.25Å; W14-L19 HydrophobicContact CG-CD2 4.3Å; W14-L22 HydrophobicContact CH2-CD2 4.1Å; W14-L22 HydrophobicContact CZ3-CB 4.04Å; W14-L22 HydrophobicContact CZ3-CD2 3.92Å; W14-L22 HydrophobicContact CZ3-CG 4.49Å; W14-F52 HydrophobicContact CH2-CE1 4.22Å; W14-F52 HydrophobicContact CH2-CZ 4.31Å; W14-F52 HydrophobicContact CZ3-CE1 4.04Å; W14-F52 AromaticContact CZ3-CZ 3.78Å; W14-F52 HydrophobicContact CZ3-CZ 3.78Å; W14-Y55 HydrophobicContact CD2-CD1 4.24Å; W14-Y55 AromaticContact CD2-CE1 3.87Å; W14-Y55 HydrophobicContact CD2-CE1 3.87Å; W14-Y55 AromaticContact CE2-CD1 3.6Å; W14-Y55 AromaticContact CE2-CE1 3.62Å; W14-Y55 HydrophobicContact CE3-CE1 4.36Å; W14-Y55 HydrophobicContact CG-CE1 4.26Å; W14-Y55 AromaticContact CH2-CD1 3.9Å; W14-Y55 HydrophobicContact CH2-CD1 3.9Å; W14-Y55 HydrophobicContact CH2-CD2 4.18Å; W14-Y55 HydrophobicContact CH2-CE1 4.43Å; W14-Y55 AromaticContact CH2-CG 3.74Å; W14-Y55 HydrophobicContact CH2-CG 3.74Å; W14-Y55 AromaticContact CZ2-CD1 3.43Å; W14-Y55 HydrophobicContact CZ2-CD1 3.43Å; W14-Y55 VanDerWaalsContact CZ2-CD1 3.43Å; W14-Y55 AromaticContact CZ2-CE1 3.95Å; W14-Y55 HydrophobicContact CZ2-CE1 3.95Å; W14-Y55 AromaticContact CZ2-CG 3.76Å; W14-Y55 HydrophobicContact CZ2-CG 3.76Å; W14-Y55 HydrophobicContact CZ3-CD1 4.46Å; W14-Y55 HydrophobicContact CZ3-CD2 4.3Å; W14-Y55 HydrophobicContact CZ3-CE2 4.47Å; W14-Y55 HydrophobicContact CZ3-CG 4.28Å; W14-Y55 AromaticContact NE1-CD1 3.99Å; W14-Y55 AromaticContact NE1-CE1 3.8Å; W14-M59 HydrophobicContact CZ2-CB 4.22Å; W14-K63 HydrophobicContact CB-CD 4.5Å; W14-K63 HydrophobicContact CD2-CB 4.3Å; W14-K63 HydrophobicContact CD2-CD 4.04Å; W14-K63 HydrophobicContact CD2-CG 3.71Å; W14-K63 HydrophobicContact CE3-CG 4.08Å; W14-K63 HydrophobicContact CG-CD 3.84Å; W14-K63 HydrophobicContact CG-CG 4.03Å; W14-K63 HydrophobicContact CH2-CB 4.16Å; W14-K63 HydrophobicContact CH2-CG 4.49Å; W14-K63 HydrophobicContact CZ2-CB 3.79Å; W14-K63 HydrophobicContact CZ2-CG 4.15Å; W14-K63 HydrophobicContact CZ3-CG 4.45Å
15	A	87.9	Confident	71.6	Confident	47 Å²	47	86.2 Å²	86.2	39%	0.388	48%	0.478	S	S	.	.			trans	-70.3	155.9	172.7	0	0	0	0	0	111.6	V13 D17 D18 L19	V13-A15 PolarHBondContact O-N 3.38Å; A15-D17 PolarHBondContact O-N 2.95Å; A15-D18 HydrophobicContact CB-CB 4.5Å; A15-D18 PolarHBondContact O-N 3.3Å; A15-D18 VanDerWaalsContact O-N 3.11Å; A15-L19 WeakPolarHBondContact O-CG 3.42Å; A15-L19 PolarHBondContact O-N 3.49Å
16	Q	86	Confident	74.1	Confident	104 Å²	104	77.4 Å²	77.4	49%	0.486	44%	0.435	S	S	.	.	H	α-helix	trans	-56.9	-38.6	176.6	-174.7	177.7	-8.6	0	0	112.2	L19 L20 I88	Q16-L19 PolarHBondContact O-N 2.98Å; Q16-L20 WeakPolarHBondContact O-CG 3.44Å; Q16-L20 PolarHBondContact O-N 2.88Å; Q16-I88 HydrophobicContact CG-CG2 3.84Å; Q16-I88 PolarHBondContact NE2-O 3.04Å
17	D	87	Confident	76.4	Confident	125 Å²	125	72 Å²	72	67%	0.668	41%	0.408	S	S	*	.	H	α-helix	trans	-70.3	-34.5	177.6	-67.3	-37.6	0	0	0	112.7	A15 L20 K21	A15-D17 PolarHBondContact O-N 2.95Å; D17-L20 PolarHBondContact O-N 3.47Å; D17-K21 VanDerWaalsContact O-CB 3.23Å; D17-K21 WeakPolarHBondContact O-CB 3.43Å; D17-K21 PolarHBondContact O-N 2.89Å
18	D	90.6	Very high	78.7	Confident	30 Å²	30	73.4 Å²	73.4	16%	0.16	41%	0.406	C	S	.	.	H	α-helix	trans	-68	-38.5	172.8	-72.2	-44.6	0	0	0	111.2	W14 A15 L20 K21 L22 F52 N53 Y55	W14-D18 HydrophobicContact CE3-CB 4.02Å; W14-D18 HydrophobicContact CZ3-CB 4.46Å; A15-D18 HydrophobicContact CB-CB 4.5Å; A15-D18 PolarHBondContact O-N 3.3Å; A15-D18 VanDerWaalsContact O-N 3.11Å; D18-L20 VanDerWaalsContact C-N 3.34Å; D18-L20 PolarHBondContact O-N 3.5Å; D18-K21 PolarHBondContact O-N 3.43Å; D18-L22 WeakPolarHBondContact O-CB 3.46Å; D18-L22 PolarHBondContact O-N 3.39Å; D18-F52 HydrophobicContact CB-CE2 4.19Å; D18-F52 HydrophobicContact CB-CZ 4.13Å; D18-F52 VanDerWaalsContact O-CZ 3.24Å; D18-F52 WeakPolarHBondContact O-CZ 3.47Å; D18-N53 PolarHBondContact OD1-ND2 3.37Å; D18-Y55 HydrophobicContact CB-CE2 3.82Å; D18-Y55 VanDerWaalsContact CG-CE2 3.47Å; D18-Y55 PolarHBondContact OD2-OH 3.26Å
19	L	89.3	Confident	81.1	Confident	25 Å²	25	69.6 Å²	69.6	13%	0.131	39%	0.387	C	S	.	.	H	α-helix	trans	-64.2	-37.2	173.4	-67.7	171.6	0	0	0	112.2	W14 A15 Q16 L23 K63 V67 I88	W14-L19 HydrophobicContact CB-CD2 4Å; W14-L19 HydrophobicContact CB-CG 4.09Å; W14-L19 HydrophobicContact CD2-CD2 4.14Å; W14-L19 HydrophobicContact CE3-CD2 3.72Å; W14-L19 HydrophobicContact CE3-CG 4.25Å; W14-L19 HydrophobicContact CG-CD2 4.3Å; A15-L19 WeakPolarHBondContact O-CG 3.42Å; A15-L19 PolarHBondContact O-N 3.49Å; Q16-L19 PolarHBondContact O-N 2.98Å; L19-L23 WeakPolarHBondContact O-CG 3.36Å; L19-L23 PolarHBondContact O-N 3.39Å; L19-K63 HydrophobicContact CD2-CD 4.27Å; L19-K63 HydrophobicContact CD2-CG 3.53Å; L19-V67 HydrophobicContact CD2-CG2 4.43Å; L19-I88 HydrophobicContact CB-CD1 3.89Å; L19-I88 HydrophobicContact CB-CG1 4.31Å; L19-I88 HydrophobicContact CB-CG2 3.99Å; L19-I88 HydrophobicContact CD1-CG1 4.42Å
20	L	90.5	Very high	83.2	Confident	22 Å²	22	65.4 Å²	65.4	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-71.5	-38.5	173.5	-69.2	174.8	0	0	0	112.1	Q16 D17 D18 L23 D24 Q85 I88 K89	Q16-L20 WeakPolarHBondContact O-CG 3.44Å; Q16-L20 PolarHBondContact O-N 2.88Å; D17-L20 PolarHBondContact O-N 3.47Å; D18-L20 VanDerWaalsContact C-N 3.34Å; D18-L20 PolarHBondContact O-N 3.5Å; L20-L23 PolarHBondContact O-N 3.44Å; L20-D24 PolarHBondContact O-N 3.47Å; L20-Q85 HydrophobicContact CD2-CB 4.26Å; L20-Q85 HydrophobicContact CD2-CG 4.1Å; L20-I88 HydrophobicContact CD2-CB 4.34Å; L20-I88 HydrophobicContact CD2-CG2 3.87Å; L20-I88 HydrophobicContact CG-CG2 3.91Å; L20-K89 HydrophobicContact CD1-CD 4.46Å; L20-K89 VanDerWaalsContact CD1-CE 3.41Å; L20-K89 HydrophobicContact CD1-CG 4.14Å; L20-K89 HydrophobicContact CD2-CD 4.41Å; L20-K89 HydrophobicContact CD2-CG 4.21Å
21	K	91.6	Very high	85.1	Confident	90 Å²	90	62.1 Å²	62.1	39%	0.391	34%	0.343	S	S	.	.	H	α-helix	trans	-64.8	-40.3	176.1	-173.6	170.3	176.9	-177.8	0	111.9	D17 D18 L23 D24 S25 F52 N53	D17-K21 VanDerWaalsContact O-CB 3.23Å; D17-K21 WeakPolarHBondContact O-CB 3.43Å; D17-K21 PolarHBondContact O-N 2.89Å; D18-K21 PolarHBondContact O-N 3.43Å; K21-L23 VanDerWaalsContact C-N 3.33Å; K21-L23 PolarHBondContact O-N 3.2Å; K21-D24 PolarHBondContact O-N 3.13Å; K21-S25 WeakPolarHBondContact O-CB 3.34Å; K21-S25 PolarHBondContact O-N 3.13Å; K21-S25 PolarHBondContact O-OG 3.13Å; K21-F52 HydrophobicContact CB-CD2 4.44Å; K21-F52 HydrophobicContact CB-CE2 3.98Å; K21-F52 HydrophobicContact CB-CZ 4.21Å; K21-F52 HydrophobicContact CD-CD2 3.47Å; K21-F52 VanDerWaalsContact CD-CD2 3.47Å; K21-F52 HydrophobicContact CD-CE2 3.65Å; K21-F52 HydrophobicContact CD-CG 4.32Å; K21-F52 VanDerWaalsContact CE-CD2 3.5Å; K21-F52 HydrophobicContact CG-CD2 3.76Å; K21-F52 HydrophobicContact CG-CE2 3.8Å; K21-F52 HydrophobicContact CG-CG 4.26Å; K21-F52 HydrophobicContact CG-CZ 4.33Å; K21-N53 PolarHBondContact NZ-OD1 3.37Å
22	L	92.8	Very high	86.1	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-52.6	-51.1	168.7	171.8	59.7	0	0	0	111	W14 D18 S25 M26 V50 F52 C60 K63	W14-L22 HydrophobicContact CH2-CD2 4.1Å; W14-L22 HydrophobicContact CZ3-CB 4.04Å; W14-L22 HydrophobicContact CZ3-CD2 3.92Å; W14-L22 HydrophobicContact CZ3-CG 4.49Å; D18-L22 WeakPolarHBondContact O-CB 3.46Å; D18-L22 PolarHBondContact O-N 3.39Å; L22-S25 WeakPolarHBondContact O-CB 3.42Å; L22-S25 PolarHBondContact O-N 3.47Å; L22-M26 HydrophobicContact CD1-CG 4.24Å; L22-M26 HydrophobicContact CD1-SD 4.38Å; L22-M26 HydrophobicContact CG-SD 4.39Å; L22-M26 WeakPolarHBondContact O-CG 3.3Å; L22-M26 PolarHBondContact O-N 3.3Å; L22-V50 HydrophobicContact CD1-CG1 3.57Å; L22-F52 HydrophobicContact CB-CE1 3.82Å; L22-F52 HydrophobicContact CB-CZ 4.25Å; L22-F52 HydrophobicContact CD1-CE1 4.38Å; L22-C60 HydrophobicContact CD1-CB 3.58Å; L22-K63 HydrophobicContact CD2-CB 4.11Å; L22-K63 HydrophobicContact CD2-CG 4.49Å
23	L	92	Very high	86.7	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-68	-38	-176.4	-71	178.7	0	0	0	113.5	L19 L20 K21 M26 K27 W64 I81 A84 Q85 I88	L19-L23 WeakPolarHBondContact O-CG 3.36Å; L19-L23 PolarHBondContact O-N 3.39Å; L20-L23 PolarHBondContact O-N 3.44Å; K21-L23 VanDerWaalsContact C-N 3.33Å; K21-L23 PolarHBondContact O-N 3.2Å; L23-M26 HydrophobicContact CD2-SD 4.14Å; L23-K27 VanDerWaalsContact O-CB 3.24Å; L23-K27 WeakPolarHBondContact O-CB 3.27Å; L23-K27 PolarHBondContact O-N 3.32Å; L23-K27 VanDerWaalsContact O-N 3.09Å; L23-W64 HydrophobicContact CD2-CE3 3.58Å; L23-W64 HydrophobicContact CD2-CZ3 3.47Å; L23-W64 VanDerWaalsContact CD2-CZ3 3.47Å; L23-I81 HydrophobicContact CB-CG2 4.11Å; L23-I81 HydrophobicContact CD2-CG1 4.3Å; L23-I81 HydrophobicContact CD2-CG2 4.35Å; L23-A84 HydrophobicContact CD1-CB 3.58Å; L23-A84 HydrophobicContact CD2-CB 3.92Å; L23-A84 HydrophobicContact CG-CB 4.45Å; L23-Q85 HydrophobicContact CB-CG 3.83Å; L23-Q85 HydrophobicContact CD1-CB 4.38Å; L23-Q85 HydrophobicContact CD1-CG 3.62Å; L23-Q85 HydrophobicContact CG-CG 4.39Å; L23-I88 HydrophobicContact CD1-CD1 3.53Å; L23-I88 HydrophobicContact CG-CD1 4.49Å
24	D	91.1	Very high	86.9	Confident	72 Å²	72	61.1 Å²	61.1	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-71.8	-32.6	172	-78.6	-40.4	0	0	0	112.1	L20 K21 K27 V28 Q85	L20-D24 PolarHBondContact O-N 3.47Å; K21-D24 PolarHBondContact O-N 3.13Å; D24-K27 WeakPolarHBondContact O-CB 3.41Å; D24-K27 PolarHBondContact O-N 3.44Å; D24-K27 WeakPolarHBondContact OD1-CD 3.44Å; D24-K27 IonicContact OD1-NZ 3.87Å; D24-K27 PolarHBondContact OD1-NZ 3.43Å; D24-V28 WeakPolarHBondContact O-CG2 3.5Å; D24-V28 PolarHBondContact O-N 3.03Å; D24-Q85 PolarHBondContact OD1-NE2 2.94Å; D24-Q85 PolarHBondContact OD2-NE2 3.36Å
25	S	89.7	Confident	86.6	Confident	27 Å²	27	66.5 Å²	66.5	19%	0.189	35%	0.353	C	S	.	.	H	α-helix	trans	-64	-46.2	171.2	-65.4	0	0	0	0	112.1	K21 L22 K27 V28 A29	K21-S25 WeakPolarHBondContact O-CB 3.34Å; K21-S25 PolarHBondContact O-N 3.13Å; K21-S25 PolarHBondContact O-OG 3.13Å; L22-S25 WeakPolarHBondContact O-CB 3.42Å; L22-S25 PolarHBondContact O-N 3.47Å; S25-K27 VanDerWaalsContact C-N 3.27Å; S25-K27 PolarHBondContact O-N 3.38Å; S25-V28 PolarHBondContact O-N 3.49Å; S25-A29 WeakPolarHBondContact O-CB 3.44Å; S25-A29 PolarHBondContact O-N 3.3Å
26	M	90.8	Very high	86.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-55.6	-42.3	172.3	-71.2	-178.1	69.3	0	0	112.1	L22 L23 A29 L30 L45 W47 V50 W64 L77 I81	L22-M26 HydrophobicContact CD1-CG 4.24Å; L22-M26 HydrophobicContact CD1-SD 4.38Å; L22-M26 HydrophobicContact CG-SD 4.39Å; L22-M26 WeakPolarHBondContact O-CG 3.3Å; L22-M26 PolarHBondContact O-N 3.3Å; L23-M26 HydrophobicContact CD2-SD 4.14Å; M26-A29 PolarHBondContact O-N 3.23Å; M26-L30 VanDerWaalsContact O-CG 3.32Å; M26-L30 WeakPolarHBondContact O-CG 3.26Å; M26-L30 PolarHBondContact O-N 3.4Å; M26-L30 VanDerWaalsContact O-N 3.07Å; M26-L45 HydrophobicContact CB-CD2 4.22Å; M26-L45 HydrophobicContact CE-CD2 3.51Å; M26-L45 HydrophobicContact CG-CD2 3.98Å; M26-W47 HydrophobicContact CE-CH2 3.63Å; M26-W47 HydrophobicContact CE-CZ2 4.44Å; M26-W47 HydrophobicContact CE-CZ3 4.21Å; M26-W47 HydrophobicContact CG-CZ3 4.24Å; M26-W47 HydrophobicContact SD-CH2 4.07Å; M26-W47 HydrophobicContact SD-CZ3 4.1Å; M26-V50 HydrophobicContact CG-CG1 3.59Å; M26-V50 HydrophobicContact CG-CG2 4.15Å; M26-W64 HydrophobicContact CE-CB 4.34Å; M26-W64 HydrophobicContact CE-CD2 3.45Å; M26-W64 VanDerWaalsContact CE-CD2 3.45Å; M26-W64 HydrophobicContact CE-CE3 3.75Å; M26-W64 HydrophobicContact CE-CG 3.67Å; M26-W64 HydrophobicContact CE-CZ2 4.39Å; M26-W64 HydrophobicContact CE-CZ3 4.31Å; M26-W64 HydrophobicContact SD-CB 3.98Å; M26-W64 HydrophobicContact SD-CD2 3.74Å; M26-W64 HydrophobicContact SD-CE3 3.59Å; M26-W64 VanDerWaalsContact SD-CE3 3.59Å; M26-W64 HydrophobicContact SD-CG 3.88Å; M26-W64 HydrophobicContact SD-CZ3 4.37Å; M26-L77 HydrophobicContact CE-CD1 4.41Å; M26-L77 HydrophobicContact CE-CD2 4.37Å; M26-I81 HydrophobicContact CB-CD1 3.78Å; M26-I81 HydrophobicContact CE-CD1 4.3Å; M26-I81 HydrophobicContact CE-CG1 4.48Å
27	K	89.1	Confident	86.2	Confident	68 Å²	68	70.8 Å²	70.8	30%	0.296	37%	0.367	S	S	.	.	H	α-helix	trans	-70.8	-28.1	179.8	-179.2	176.4	163.8	-163.7	0	113.6	L23 D24 S25 I81	L23-K27 VanDerWaalsContact O-CB 3.24Å; L23-K27 WeakPolarHBondContact O-CB 3.27Å; L23-K27 PolarHBondContact O-N 3.32Å; L23-K27 VanDerWaalsContact O-N 3.09Å; D24-K27 WeakPolarHBondContact O-CB 3.41Å; D24-K27 PolarHBondContact O-N 3.44Å; D24-K27 WeakPolarHBondContact OD1-CD 3.44Å; D24-K27 IonicContact OD1-NZ 3.87Å; D24-K27 PolarHBondContact OD1-NZ 3.43Å; S25-K27 VanDerWaalsContact C-N 3.27Å; S25-K27 PolarHBondContact O-N 3.38Å; K27-I81 HydrophobicContact CB-CD1 4.45Å; K27-I81 HydrophobicContact CB-CG2 4.28Å; K27-I81 HydrophobicContact CD-CG2 4.25Å
28	V	89.2	Confident	86.2	Confident	126 Å²	126	66.4 Å²	66.4	76%	0.764	34%	0.341	S	S	*	.	H	α-helix	trans	-77.3	-36.4	171	168.5	0	0	0	0	111.4	D24 S25 L30	D24-V28 WeakPolarHBondContact O-CG2 3.5Å; D24-V28 PolarHBondContact O-N 3.03Å; S25-V28 PolarHBondContact O-N 3.49Å; V28-L30 PolarHBondContact O-N 3.06Å
29	A	87.3	Confident	86	Confident	37 Å²	37	71.5 Å²	71.5	31%	0.306	36%	0.362	S	S	.	.	H	α-helix	trans	-70.7	-16.6	174.2	0	0	0	0	0	113.4	S25 M26 L45 V50	S25-A29 WeakPolarHBondContact O-CB 3.44Å; S25-A29 PolarHBondContact O-N 3.3Å; M26-A29 PolarHBondContact O-N 3.23Å; A29-L45 HydrophobicContact CB-CD1 3.73Å; A29-V50 HydrophobicContact CB-CG2 3.75Å
30	L	85.5	Confident	85.8	Confident	15 Å²	15	73.2 Å²	73.2	8%	0.079	37%	0.374	C	S	.	.	S	Bend	trans	-84.4	149.2	178.2	-81	169.2	0	0	0	114.2	M26 V28 Q32 L45 L77 I81	M26-L30 VanDerWaalsContact O-CG 3.32Å; M26-L30 WeakPolarHBondContact O-CG 3.26Å; M26-L30 PolarHBondContact O-N 3.4Å; M26-L30 VanDerWaalsContact O-N 3.07Å; V28-L30 PolarHBondContact O-N 3.06Å; L30-Q32 PolarHBondContact O-N 2.81Å; L30-L45 HydrophobicContact CD2-CD1 4.04Å; L30-L45 HydrophobicContact CG-CD1 3.93Å; L30-L77 HydrophobicContact CD1-CB 4.23Å; L30-L77 HydrophobicContact CD1-CD2 3.95Å; L30-L77 HydrophobicContact CD1-CG 3.89Å; L30-L77 HydrophobicContact CD2-CD2 4.16Å; L30-I81 HydrophobicContact CD1-CD1 3.53Å
31	P	80.6	Confident	85.6	Confident	90 Å²	90	72.6 Å²	72.6	58%	0.584	37%	0.371	S	S	*	.			trans	-58.3	132.6	170.4	-22.5	33.4	0	0	0	111.6	K33 D34	P31-K33 CarbonylContact O-C 3.59Å; P31-K33 PolarHBondContact O-N 2.95Å; P31-D34 PolarHBondContact O-N 3.22Å; P31-D34 VanDerWaalsContact O-N 3.12Å
32	Q	71.7	Confident	85.4	Confident	198 Å²	198	70 Å²	70	93%	0.925	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-3.6	-176.9	-153.5	-177.9	26.7	0	0	115.7	L30	L30-Q32 PolarHBondContact O-N 2.81Å
33	K	76.7	Confident	85.1	Confident	153 Å²	153	74 Å²	74	67%	0.665	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.5	73.8	168.7	-66.6	-176.4	178.1	157	0	109.3	P31 L35	P31-K33 CarbonylContact O-C 3.59Å; P31-K33 PolarHBondContact O-N 2.95Å; K33-L35 PolarHBondContact O-N 3.32Å
34	D	80.9	Confident	84.8	Confident	16 Å²	16	81.1 Å²	81.1	9%	0.086	42%	0.421	C	S	.	.			trans	-58.2	124.2	166.3	-173.7	11.2	0	0	0	109.7	P31 T36 S41 L77 T78	P31-D34 PolarHBondContact O-N 3.22Å; P31-D34 VanDerWaalsContact O-N 3.12Å; D34-T36 PolarHBondContact OD1-N 2.95Å; D34-T36 PolarHBondContact OD1-OG1 3.42Å; D34-S41 PolarHBondContact OD1-OG 2.74Å; D34-L77 WeakPolarHBondContact OD2-CA 3.34Å; D34-L77 PolarHBondContact OD2-N 2.85Å; D34-T78 WeakPolarHBondContact CB-OG1 3.37Å; D34-T78 PolarHBondContact OD2-N 3Å; D34-T78 PolarHBondContact OD2-OG1 3.41Å
35	L	78.5	Confident	84.6	Confident	148 Å²	148	78.2 Å²	78.2	78%	0.775	41%	0.406	S	S	*	.			trans	-137.7	8.6	-177.6	-66.9	173.9	0	0	0	111.1	K33	K33-L35 PolarHBondContact O-N 3.32Å
36	T	81.8	Confident	84.6	Confident	70 Å²	70	79.7 Å²	79.7	43%	0.429	41%	0.412	S	S	.	.	S	Bend	trans	-100.1	159.7	-178.6	20.3	0	0	0	0	110.3	D34 T40 S41	D34-T36 PolarHBondContact OD1-N 2.95Å; D34-T36 PolarHBondContact OD1-OG1 3.42Å; T36-T40 HydrophobicContact CG2-CG2 4.18Å; T36-S41 WeakPolarHBondContact CB-OG 3.49Å; T36-S41 PolarHBondContact OG1-OG 2.66Å
37	K	84.3	Confident	84.6	Confident	170 Å²	170	81.3 Å²	81.3	74%	0.739	42%	0.418	S	S	*	.			trans	-63	140.8	171.4	-66.2	-174.3	175.7	-171.6	0	108.4	K39 T40 S41	K37-K39 VanDerWaalsContact C-N 3.3Å; K37-K39 PolarHBondContact O-N 3.33Å; K37-K39 VanDerWaalsContact O-N 3.11Å; K37-T40 WeakPolarHBondContact O-CA 3.38Å; K37-T40 WeakPolarHBondContact O-CB 3.37Å; K37-T40 PolarHBondContact O-N 3.13Å; K37-S41 PolarHBondContact O-N 3.17Å
38	Y	86.9	Confident	84.7	Confident	33 Å²	33	85 Å²	85	13%	0.129	44%	0.436	C	S	.	.	H	α-helix	trans	-48.9	-46.3	-172.4	76.8	-85.4	0	0	0	113.7	T40 S41 E42 K73 R75 L80	Y38-T40 PolarHBondContact O-N 3.2Å; Y38-T40 VanDerWaalsContact O-N 3.08Å; Y38-S41 CarbonylContact O-C 3.58Å; Y38-S41 WeakPolarHBondContact O-CA 3.46Å; Y38-S41 PolarHBondContact O-N 3.26Å; Y38-E42 WeakPolarHBondContact CD2-OE2 3.46Å; Y38-E42 WeakPolarHBondContact O-CB 3.42Å; Y38-E42 PolarHBondContact O-N 3.07Å; Y38-K73 HydrophobicContact CE1-CB 3.91Å; Y38-K73 WeakPolarHBondContact CE1-O 3.43Å; Y38-K73 HydrophobicContact CE2-CD 4.39Å; Y38-R75 PolarHBondContact N-O 2.98Å; Y38-R75 VanDerWaalsContact N-O 3.17Å; Y38-L80 HydrophobicContact CD1-CD2 4.07Å; Y38-L80 HydrophobicContact CD2-CD2 3.75Å; Y38-L80 HydrophobicContact CE2-CD2 4.33Å; Y38-L80 HydrophobicContact CG-CD2 3.61Å
39	K	85.9	Confident	84.6	Confident	138 Å²	138	86.2 Å²	86.2	60%	0.6	43%	0.431	S	S	*	.	H	α-helix	trans	-52.5	-34.1	177.4	-67.4	-163	175.8	-169.4	0	113.8	K37 S43	K37-K39 VanDerWaalsContact C-N 3.3Å; K37-K39 PolarHBondContact O-N 3.33Å; K37-K39 VanDerWaalsContact O-N 3.11Å; K39-S43 WeakPolarHBondContact O-CB 3.44Å; K39-S43 PolarHBondContact O-N 3.01Å; K39-S43 PolarHBondContact O-OG 2.84Å
40	T	86	Confident	84.7	Confident	61 Å²	61	84.5 Å²	84.5	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-82.9	-25.9	178.9	-48.5	0	0	0	0	112.4	T36 K37 Y38 S43 H44	T36-T40 HydrophobicContact CG2-CG2 4.18Å; K37-T40 WeakPolarHBondContact O-CA 3.38Å; K37-T40 WeakPolarHBondContact O-CB 3.37Å; K37-T40 PolarHBondContact O-N 3.13Å; Y38-T40 PolarHBondContact O-N 3.2Å; Y38-T40 VanDerWaalsContact O-N 3.08Å; T40-S43 PolarHBondContact O-OG 3.08Å; T40-H44 PolarHBondContact O-ND1 3.36Å
41	S	85.4	Confident	84.9	Confident	8 Å²	8	85.4 Å²	85.4	6%	0.056	43%	0.426	C	S	.	.	H	α-helix	trans	-81.1	-29.4	171.5	-52.6	0	0	0	0	111.2	D34 T36 K37 Y38 L45	D34-S41 PolarHBondContact OD1-OG 2.74Å; T36-S41 WeakPolarHBondContact CB-OG 3.49Å; T36-S41 PolarHBondContact OG1-OG 2.66Å; K37-S41 PolarHBondContact O-N 3.17Å; Y38-S41 CarbonylContact O-C 3.58Å; Y38-S41 WeakPolarHBondContact O-CA 3.46Å; Y38-S41 PolarHBondContact O-N 3.26Å; S41-L45 PolarHBondContact O-N 2.91Å
42	E	87.4	Confident	85.3	Confident	36 Å²	36	82 Å²	82	17%	0.168	40%	0.403	C	S	.	.	H	α-helix	trans	-73.8	-42	177.3	-179	174.2	-138.4	0	0	112.2	Y38 H44 L45 W64 L77	Y38-E42 WeakPolarHBondContact CD2-OE2 3.46Å; Y38-E42 WeakPolarHBondContact O-CB 3.42Å; Y38-E42 PolarHBondContact O-N 3.07Å; E42-H44 VanDerWaalsContact C-N 3.26Å; E42-H44 PolarHBondContact O-N 2.87Å; E42-L45 WeakPolarHBondContact O-CB 3.44Å; E42-L45 PolarHBondContact O-N 2.97Å; E42-W64 PolarHBondContact OE1-NE1 3.18Å; E42-L77 HydrophobicContact CB-CD2 4.02Å
43	S	86.4	Confident	85.9	Confident	85 Å²	85	77.7 Å²	77.7	59%	0.594	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-20.4	177.6	68.9	0	0	0	0	114.4	K39 T40	K39-S43 WeakPolarHBondContact O-CB 3.44Å; K39-S43 PolarHBondContact O-N 3.01Å; K39-S43 PolarHBondContact O-OG 2.84Å; T40-S43 PolarHBondContact O-OG 3.08Å
44	H	85.1	Confident	86.4	Confident	152 Å²	152	74 Å²	74	70%	0.704	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	15.1	175.8	-55.8	106.4	0	0	0	112	T40 E42	T40-H44 PolarHBondContact O-ND1 3.36Å; E42-H44 VanDerWaalsContact C-N 3.26Å; E42-H44 PolarHBondContact O-N 2.87Å
45	L	88.1	Confident	86.8	Confident	11 Å²	11	73.9 Å²	73.9	6%	0.058	38%	0.378	C	S	.	.			trans	-79.9	122.7	175.5	-168.3	63.2	0	0	0	109.4	M26 A29 L30 S41 E42 W47 V50 L77	M26-L45 HydrophobicContact CB-CD2 4.22Å; M26-L45 HydrophobicContact CE-CD2 3.51Å; M26-L45 HydrophobicContact CG-CD2 3.98Å; A29-L45 HydrophobicContact CB-CD1 3.73Å; L30-L45 HydrophobicContact CD2-CD1 4.04Å; L30-L45 HydrophobicContact CG-CD1 3.93Å; S41-L45 PolarHBondContact O-N 2.91Å; E42-L45 WeakPolarHBondContact O-CB 3.44Å; E42-L45 PolarHBondContact O-N 2.97Å; L45-W47 HydrophobicContact CB-CZ2 4.5Å; L45-W47 HydrophobicContact CD2-CD2 4.43Å; L45-W47 HydrophobicContact CD2-CE3 4.47Å; L45-W47 HydrophobicContact CD2-CH2 3.84Å; L45-W47 HydrophobicContact CD2-CZ2 3.78Å; L45-W47 HydrophobicContact CD2-CZ3 4.19Å; L45-W47 PolarHBondContact O-N 3.35Å; L45-W47 PolarHBondContact O-NE1 2.87Å; L45-V50 HydrophobicContact CD1-CG2 4.34Å; L45-V50 HydrophobicContact CD2-CG2 4.11Å; L45-V50 HydrophobicContact CG-CG2 4.06Å; L45-L77 HydrophobicContact CD2-CD2 4.45Å
46	D	89.4	Confident	87.5	Confident	59 Å²	59	70.6 Å²	70.6	32%	0.316	36%	0.364	S	S	.	.			trans	-75	96.6	175.4	-177.4	-27.3	0	0	0	109.8	Q48 K49 V50	D46-Q48 PolarHBondContact O-N 2.65Å; D46-Q48 WeakPolarHBondContact OD1-CA 3.3Å; D46-Q48 WeakPolarHBondContact OD1-CB 3.24Å; D46-Q48 PolarHBondContact OD1-N 2.71Å; D46-K49 HydrophobicContact CB-CB 4.18Å; D46-K49 HydrophobicContact CB-CD 4.21Å; D46-K49 HydrophobicContact CB-CG 4.33Å; D46-K49 PolarHBondContact O-N 3.3Å; D46-K49 VanDerWaalsContact O-N 3.13Å; D46-K49 PolarHBondContact OD1-N 3.2Å; D46-K49 VanDerWaalsContact OD2-CD 3.26Å; D46-K49 WeakPolarHBondContact OD2-CD 3.17Å; D46-K49 WeakPolarHBondContact OD2-CE 3.36Å; D46-K49 WeakPolarHBondContact OD2-CG 2.97Å; D46-K49 IonicContact OD2-NZ 2.89Å; D46-K49 PolarHBondContact OD2-NZ 2.94Å; D46-V50 WeakPolarHBondContact O-CG2 3.19Å; D46-V50 PolarHBondContact O-N 2.57Å
47	W	91.3	Very high	87.8	Confident	34 Å²	34	67.7 Å²	67.7	13%	0.129	35%	0.347	C	S	.	.	S	Bend	trans	-68	-20.2	-178.1	-66.4	96.3	0	0	0	113.6	M26 L45 V50 A51 A57 C60 K61 W64	M26-W47 HydrophobicContact CE-CH2 3.63Å; M26-W47 HydrophobicContact CE-CZ2 4.44Å; M26-W47 HydrophobicContact CE-CZ3 4.21Å; M26-W47 HydrophobicContact CG-CZ3 4.24Å; M26-W47 HydrophobicContact SD-CH2 4.07Å; M26-W47 HydrophobicContact SD-CZ3 4.1Å; L45-W47 HydrophobicContact CB-CZ2 4.5Å; L45-W47 HydrophobicContact CD2-CD2 4.43Å; L45-W47 HydrophobicContact CD2-CE3 4.47Å; L45-W47 HydrophobicContact CD2-CH2 3.84Å; L45-W47 HydrophobicContact CD2-CZ2 3.78Å; L45-W47 HydrophobicContact CD2-CZ3 4.19Å; L45-W47 PolarHBondContact O-N 3.35Å; L45-W47 PolarHBondContact O-NE1 2.87Å; W47-V50 HydrophobicContact CE3-CB 4.14Å; W47-V50 HydrophobicContact CE3-CG1 3.96Å; W47-V50 HydrophobicContact CE3-CG2 4.47Å; W47-V50 HydrophobicContact CZ3-CG1 4.08Å; W47-V50 PolarHBondContact O-N 2.89Å; W47-A51 PolarHBondContact O-N 3.41Å; W47-A57 HydrophobicContact CB-CB 3.85Å; W47-A57 WeakPolarHBondContact O-CA 3.41Å; W47-A57 WeakPolarHBondContact O-CB 3.31Å; W47-C60 HydrophobicContact CE3-CB 4.22Å; W47-C60 HydrophobicContact CZ3-CB 4.5Å; W47-K61 HydrophobicContact CD2-CB 3.7Å; W47-K61 HydrophobicContact CD2-CD 4.26Å; W47-K61 HydrophobicContact CD2-CG 4.21Å; W47-K61 HydrophobicContact CE3-CB 3.79Å; W47-K61 HydrophobicContact CG-CB 4.16Å; W47-K61 HydrophobicContact CG-CD 4.11Å; W47-K61 HydrophobicContact CH2-CB 4.42Å; W47-K61 HydrophobicContact CZ2-CB 4.34Å; W47-K61 HydrophobicContact CZ2-CG 4.31Å; W47-K61 HydrophobicContact CZ3-CB 4.16Å; W47-W64 HydrophobicContact CH2-CB 3.64Å; W47-W64 AromaticContact CH2-CD1 3.6Å; W47-W64 AromaticContact CH2-CG 3.7Å; W47-W64 HydrophobicContact CH2-CG 3.7Å; W47-W64 HydrophobicContact CZ3-CB 4.01Å; W47-W64 HydrophobicContact CZ3-CG 4.5Å
48	Q	89.4	Confident	88.1	Confident	144 Å²	144	64.5 Å²	64.5	67%	0.673	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-34.4	172.3	-58.2	-65.7	-3.8	0	0	110.9	D46 V50 A57	D46-Q48 PolarHBondContact O-N 2.65Å; D46-Q48 WeakPolarHBondContact OD1-CA 3.3Å; D46-Q48 WeakPolarHBondContact OD1-CB 3.24Å; D46-Q48 PolarHBondContact OD1-N 2.71Å; Q48-V50 VanDerWaalsContact C-N 3.26Å; Q48-V50 PolarHBondContact O-N 2.82Å; Q48-A57 HydrophobicContact CG-CB 4.35Å
49	K	88.3	Confident	88.3	Confident	153 Å²	153	65.4 Å²	65.4	67%	0.665	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-9.8	170.2	-68	178.7	-179.4	63.4	0	113.9	D46	D46-K49 HydrophobicContact CB-CB 4.18Å; D46-K49 HydrophobicContact CB-CD 4.21Å; D46-K49 HydrophobicContact CB-CG 4.33Å; D46-K49 PolarHBondContact O-N 3.3Å; D46-K49 VanDerWaalsContact O-N 3.13Å; D46-K49 PolarHBondContact OD1-N 3.2Å; D46-K49 VanDerWaalsContact OD2-CD 3.26Å; D46-K49 WeakPolarHBondContact OD2-CD 3.17Å; D46-K49 WeakPolarHBondContact OD2-CE 3.36Å; D46-K49 WeakPolarHBondContact OD2-CG 2.97Å; D46-K49 IonicContact OD2-NZ 2.89Å; D46-K49 PolarHBondContact OD2-NZ 2.94Å
50	V	88.4	Confident	88.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-25.9	173.5	175.8	0	0	0	0	112.3	L22 M26 A29 L45 D46 W47 Q48 F52 C60	L22-V50 HydrophobicContact CD1-CG1 3.57Å; M26-V50 HydrophobicContact CG-CG1 3.59Å; M26-V50 HydrophobicContact CG-CG2 4.15Å; A29-V50 HydrophobicContact CB-CG2 3.75Å; L45-V50 HydrophobicContact CD1-CG2 4.34Å; L45-V50 HydrophobicContact CD2-CG2 4.11Å; L45-V50 HydrophobicContact CG-CG2 4.06Å; D46-V50 WeakPolarHBondContact O-CG2 3.19Å; D46-V50 PolarHBondContact O-N 2.57Å; W47-V50 HydrophobicContact CE3-CB 4.14Å; W47-V50 HydrophobicContact CE3-CG1 3.96Å; W47-V50 HydrophobicContact CE3-CG2 4.47Å; W47-V50 HydrophobicContact CZ3-CG1 4.08Å; W47-V50 PolarHBondContact O-N 2.89Å; Q48-V50 VanDerWaalsContact C-N 3.26Å; Q48-V50 PolarHBondContact O-N 2.82Å; V50-F52 WeakPolarHBondContact O-CD1 3.49Å; V50-C60 HydrophobicContact CG1-CB 4.16Å
51	A	89.3	Confident	88.8	Confident	34 Å²	34	58.9 Å²	58.9	28%	0.281	31%	0.307	S	S	.	.			trans	-56.3	141.7	176.7	0	0	0	0	0	112.5	W47 A57	W47-A51 PolarHBondContact O-N 3.41Å; A51-A57 HydrophobicContact CB-CB 4.5Å
52	F	90.1	Very high	89.1	Confident	20 Å²	20	64.6 Å²	64.6	9%	0.088	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-159.6	159.1	-176.1	71.8	-82.2	0	0	0	112.2	W14 D18 K21 L22 V50 S54 Y55	W14-F52 HydrophobicContact CH2-CE1 4.22Å; W14-F52 HydrophobicContact CH2-CZ 4.31Å; W14-F52 HydrophobicContact CZ3-CE1 4.04Å; W14-F52 AromaticContact CZ3-CZ 3.78Å; W14-F52 HydrophobicContact CZ3-CZ 3.78Å; D18-F52 HydrophobicContact CB-CE2 4.19Å; D18-F52 HydrophobicContact CB-CZ 4.13Å; D18-F52 VanDerWaalsContact O-CZ 3.24Å; D18-F52 WeakPolarHBondContact O-CZ 3.47Å; K21-F52 HydrophobicContact CB-CD2 4.44Å; K21-F52 HydrophobicContact CB-CE2 3.98Å; K21-F52 HydrophobicContact CB-CZ 4.21Å; K21-F52 HydrophobicContact CD-CD2 3.47Å; K21-F52 VanDerWaalsContact CD-CD2 3.47Å; K21-F52 HydrophobicContact CD-CE2 3.65Å; K21-F52 HydrophobicContact CD-CG 4.32Å; K21-F52 VanDerWaalsContact CE-CD2 3.5Å; K21-F52 HydrophobicContact CG-CD2 3.76Å; K21-F52 HydrophobicContact CG-CE2 3.8Å; K21-F52 HydrophobicContact CG-CG 4.26Å; K21-F52 HydrophobicContact CG-CZ 4.33Å; L22-F52 HydrophobicContact CB-CE1 3.82Å; L22-F52 HydrophobicContact CB-CZ 4.25Å; L22-F52 HydrophobicContact CD1-CE1 4.38Å; V50-F52 WeakPolarHBondContact O-CD1 3.49Å; F52-S54 PolarHBondContact O-N 2.87Å; F52-Y55 HydrophobicContact CD2-CD2 4.24Å; F52-Y55 HydrophobicContact CE1-CD2 4.23Å; F52-Y55 AromaticContact CE2-CD2 3.64Å; F52-Y55 HydrophobicContact CE2-CD2 3.64Å; F52-Y55 AromaticContact CE2-CE2 3.95Å; F52-Y55 HydrophobicContact CE2-CE2 3.95Å; F52-Y55 AromaticContact CZ-CD2 3.63Å; F52-Y55 HydrophobicContact CZ-CD2 3.63Å; F52-Y55 HydrophobicContact CZ-CE2 4.08Å; F52-Y55 PolarHBondContact N-O 2.89Å; F52-Y55 WeakPolarHBondContact O-CB 3.44Å; F52-Y55 PolarHBondContact O-N 3.39Å
53	N	84.1	Confident	89.4	Confident	107 Å²	107	64.7 Å²	64.7	57%	0.572	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	-122.6	-174.2	-60	-8.3	0	0	0	110.3	D18 K21 Y55	D18-N53 PolarHBondContact OD1-ND2 3.37Å; K21-N53 PolarHBondContact NZ-OD1 3.37Å; N53-Y55 HydrophobicContact CB-CD2 4.23Å; N53-Y55 HydrophobicContact CB-CE2 4.49Å
54	S	86.9	Confident	89.6	Confident	76 Å²	76	60.7 Å²	60.7	53%	0.531	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	3.7	173	55.7	0	0	0	0	113.5	F52	F52-S54 PolarHBondContact O-N 2.87Å
55	Y	90.4	Very high	89.9	Confident	12 Å²	12	58 Å²	58	5%	0.047	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-87.4	119.5	-178	-55.8	-72.2	0	0	0	110.4	W14 D18 F52 N53 M59	W14-Y55 HydrophobicContact CD2-CD1 4.24Å; W14-Y55 AromaticContact CD2-CE1 3.87Å; W14-Y55 HydrophobicContact CD2-CE1 3.87Å; W14-Y55 AromaticContact CE2-CD1 3.6Å; W14-Y55 AromaticContact CE2-CE1 3.62Å; W14-Y55 HydrophobicContact CE3-CE1 4.36Å; W14-Y55 HydrophobicContact CG-CE1 4.26Å; W14-Y55 AromaticContact CH2-CD1 3.9Å; W14-Y55 HydrophobicContact CH2-CD1 3.9Å; W14-Y55 HydrophobicContact CH2-CD2 4.18Å; W14-Y55 HydrophobicContact CH2-CE1 4.43Å; W14-Y55 AromaticContact CH2-CG 3.74Å; W14-Y55 HydrophobicContact CH2-CG 3.74Å; W14-Y55 AromaticContact CZ2-CD1 3.43Å; W14-Y55 HydrophobicContact CZ2-CD1 3.43Å; W14-Y55 VanDerWaalsContact CZ2-CD1 3.43Å; W14-Y55 AromaticContact CZ2-CE1 3.95Å; W14-Y55 HydrophobicContact CZ2-CE1 3.95Å; W14-Y55 AromaticContact CZ2-CG 3.76Å; W14-Y55 HydrophobicContact CZ2-CG 3.76Å; W14-Y55 HydrophobicContact CZ3-CD1 4.46Å; W14-Y55 HydrophobicContact CZ3-CD2 4.3Å; W14-Y55 HydrophobicContact CZ3-CE2 4.47Å; W14-Y55 HydrophobicContact CZ3-CG 4.28Å; W14-Y55 AromaticContact NE1-CD1 3.99Å; W14-Y55 AromaticContact NE1-CE1 3.8Å; D18-Y55 HydrophobicContact CB-CE2 3.82Å; D18-Y55 VanDerWaalsContact CG-CE2 3.47Å; D18-Y55 PolarHBondContact OD2-OH 3.26Å; F52-Y55 HydrophobicContact CD2-CD2 4.24Å; F52-Y55 HydrophobicContact CE1-CD2 4.23Å; F52-Y55 AromaticContact CE2-CD2 3.64Å; F52-Y55 HydrophobicContact CE2-CD2 3.64Å; F52-Y55 AromaticContact CE2-CE2 3.95Å; F52-Y55 HydrophobicContact CE2-CE2 3.95Å; F52-Y55 AromaticContact CZ-CD2 3.63Å; F52-Y55 HydrophobicContact CZ-CD2 3.63Å; F52-Y55 HydrophobicContact CZ-CE2 4.08Å; F52-Y55 PolarHBondContact N-O 2.89Å; F52-Y55 WeakPolarHBondContact O-CB 3.44Å; F52-Y55 PolarHBondContact O-N 3.39Å; N53-Y55 HydrophobicContact CB-CD2 4.23Å; N53-Y55 HydrophobicContact CB-CE2 4.49Å; Y55-M59 HydrophobicContact CD1-CE 4.03Å
56	T	91.8	Very high	90	Very high	79 Å²	79	62 Å²	62	49%	0.485	31%	0.311	S	S	.	.			trans	-73.8	163	178.2	70.2	0	0	0	0	111.6	E58 M59 C60	T56-E58 PolarHBondContact O-N 3.49Å; T56-M59 HydrophobicContact CG2-SD 4.3Å; T56-M59 PolarHBondContact O-N 2.95Å; T56-M59 VanDerWaalsContact O-N 3.08Å; T56-M59 WeakPolarHBondContact OG1-CG 3.43Å; T56-M59 PolarHBondContact OG1-N 2.99Å; T56-C60 PolarHBondContact O-N 3.08Å; T56-C60 PolarHBondContact O-SG 3.45Å; T56-C60 VanDerWaalsContact O-SG 3.41Å
57	A	89.8	Confident	90	Very high	9 Å²	9	59.7 Å²	59.7	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-49.6	-41.4	176.4	0	0	0	0	0	113.3	W47 Q48 A51 C60 K61	W47-A57 HydrophobicContact CB-CB 3.85Å; W47-A57 WeakPolarHBondContact O-CA 3.41Å; W47-A57 WeakPolarHBondContact O-CB 3.31Å; Q48-A57 HydrophobicContact CG-CB 4.35Å; A51-A57 HydrophobicContact CB-CB 4.5Å; A57-C60 PolarHBondContact O-N 3.44Å; A57-K61 VanDerWaalsContact O-CB 3.3Å; A57-K61 WeakPolarHBondContact O-CB 3.38Å; A57-K61 PolarHBondContact O-N 2.93Å
58	E	89.8	Confident	89.9	Confident	103 Å²	103	58.2 Å²	58.2	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-74.4	-36.7	-179.5	-163.3	57.7	-144.3	0	0	112.3	T56 C60 K61 Q62	T56-E58 PolarHBondContact O-N 3.49Å; E58-C60 VanDerWaalsContact C-N 3.35Å; E58-C60 PolarHBondContact O-N 2.7Å; E58-K61 PolarHBondContact O-N 3.09Å; E58-K61 IonicContact OE1-NZ 2.73Å; E58-K61 PolarHBondContact OE1-NZ 2.94Å; E58-K61 IonicContact OE2-NZ 3.16Å; E58-K61 PolarHBondContact OE2-NZ 2.87Å; E58-Q62 WeakPolarHBondContact O-CB 3.36Å; E58-Q62 PolarHBondContact O-N 3.24Å
59	M	90.3	Very high	89.8	Confident	53 Å²	53	58.5 Å²	58.5	26%	0.261	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-43.1	172.1	-64.4	171.8	85.3	0	0	111.2	W14 Y55 T56 K63	W14-M59 HydrophobicContact CZ2-CB 4.22Å; Y55-M59 HydrophobicContact CD1-CE 4.03Å; T56-M59 HydrophobicContact CG2-SD 4.3Å; T56-M59 PolarHBondContact O-N 2.95Å; T56-M59 VanDerWaalsContact O-N 3.08Å; T56-M59 WeakPolarHBondContact OG1-CG 3.43Å; T56-M59 PolarHBondContact OG1-N 2.99Å; M59-K63 WeakPolarHBondContact O-CB 3.41Å; M59-K63 PolarHBondContact O-N 3.05Å
60	C	91.3	Very high	89.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-43.4	174.7	-69.3	0	0	0	0	112.1	L22 W47 V50 T56 A57 E58 W64	L22-C60 HydrophobicContact CD1-CB 3.58Å; W47-C60 HydrophobicContact CE3-CB 4.22Å; W47-C60 HydrophobicContact CZ3-CB 4.5Å; V50-C60 HydrophobicContact CG1-CB 4.16Å; T56-C60 PolarHBondContact O-N 3.08Å; T56-C60 PolarHBondContact O-SG 3.45Å; T56-C60 VanDerWaalsContact O-SG 3.41Å; A57-C60 PolarHBondContact O-N 3.44Å; E58-C60 VanDerWaalsContact C-N 3.35Å; E58-C60 PolarHBondContact O-N 2.7Å; C60-W64 WeakPolarHBondContact O-CB 3.49Å; C60-W64 PolarHBondContact O-N 3.09Å
61	K	91.8	Very high	89.5	Confident	61 Å²	61	56.9 Å²	56.9	27%	0.265	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-47.3	177.3	174.4	164.7	157.1	-99.8	0	112.3	W47 A57 E58 W64 Q65	W47-K61 HydrophobicContact CD2-CB 3.7Å; W47-K61 HydrophobicContact CD2-CD 4.26Å; W47-K61 HydrophobicContact CD2-CG 4.21Å; W47-K61 HydrophobicContact CE3-CB 3.79Å; W47-K61 HydrophobicContact CG-CB 4.16Å; W47-K61 HydrophobicContact CG-CD 4.11Å; W47-K61 HydrophobicContact CH2-CB 4.42Å; W47-K61 HydrophobicContact CZ2-CB 4.34Å; W47-K61 HydrophobicContact CZ2-CG 4.31Å; W47-K61 HydrophobicContact CZ3-CB 4.16Å; A57-K61 VanDerWaalsContact O-CB 3.3Å; A57-K61 WeakPolarHBondContact O-CB 3.38Å; A57-K61 PolarHBondContact O-N 2.93Å; E58-K61 PolarHBondContact O-N 3.09Å; E58-K61 IonicContact OE1-NZ 2.73Å; E58-K61 PolarHBondContact OE1-NZ 2.94Å; E58-K61 IonicContact OE2-NZ 3.16Å; E58-K61 PolarHBondContact OE2-NZ 2.87Å; K61-W64 PolarHBondContact O-N 2.8Å; K61-Q65 WeakPolarHBondContact O-CG 3.21Å; K61-Q65 PolarHBondContact O-N 3.41Å
62	Q	92.6	Very high	89.1	Confident	129 Å²	129	63.5 Å²	63.5	60%	0.603	31%	0.306	S	S	*	.	H	α-helix	trans	-61.4	-45.7	176	-172	-176.9	14.3	0	0	111.5	E58 Q65 E66	E58-Q62 WeakPolarHBondContact O-CB 3.36Å; E58-Q62 PolarHBondContact O-N 3.24Å; Q62-Q65 WeakPolarHBondContact O-CB 3.48Å; Q62-Q65 PolarHBondContact O-N 2.86Å; Q62-E66 PolarHBondContact O-N 2.92Å
63	K	92.3	Very high	88.6	Confident	38 Å²	38	66 Å²	66	17%	0.165	32%	0.317	C	S	.	.	H	α-helix	trans	-69.7	-35.2	-179.8	-156.7	74.2	-168	167.3	0	112.6	W14 L19 L22 M59 E66 V67	W14-K63 HydrophobicContact CB-CD 4.5Å; W14-K63 HydrophobicContact CD2-CB 4.3Å; W14-K63 HydrophobicContact CD2-CD 4.04Å; W14-K63 HydrophobicContact CD2-CG 3.71Å; W14-K63 HydrophobicContact CE3-CG 4.08Å; W14-K63 HydrophobicContact CG-CD 3.84Å; W14-K63 HydrophobicContact CG-CG 4.03Å; W14-K63 HydrophobicContact CH2-CB 4.16Å; W14-K63 HydrophobicContact CH2-CG 4.49Å; W14-K63 HydrophobicContact CZ2-CB 3.79Å; W14-K63 HydrophobicContact CZ2-CG 4.15Å; W14-K63 HydrophobicContact CZ3-CG 4.45Å; L19-K63 HydrophobicContact CD2-CD 4.27Å; L19-K63 HydrophobicContact CD2-CG 3.53Å; L22-K63 HydrophobicContact CD2-CB 4.11Å; L22-K63 HydrophobicContact CD2-CG 4.49Å; M59-K63 WeakPolarHBondContact O-CB 3.41Å; M59-K63 PolarHBondContact O-N 3.05Å; K63-E66 WeakPolarHBondContact CD-OE2 3.48Å; K63-E66 WeakPolarHBondContact CE-OE1 3.44Å; K63-E66 WeakPolarHBondContact CE-OE2 3.12Å; K63-E66 IonicContact NZ-OE1 2.6Å; K63-E66 PolarHBondContact NZ-OE1 2.88Å; K63-E66 IonicContact NZ-OE2 3.74Å; K63-E66 PolarHBondContact NZ-OE2 2.74Å; K63-E66 PolarHBondContact O-N 3.43Å; K63-V67 WeakPolarHBondContact O-CG2 3.33Å; K63-V67 PolarHBondContact O-N 2.86Å
64	W	92.1	Very high	87.3	Confident	1 Å²	1	68.9 Å²	68.9	0%	0.004	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-47.1	167.3	165.9	-105.3	0	0	0	111.7	L23 M26 E42 W47 C60 K61 E66 V67 S68 I71 L77 L80 I81 A84	L23-W64 HydrophobicContact CD2-CE3 3.58Å; L23-W64 HydrophobicContact CD2-CZ3 3.47Å; L23-W64 VanDerWaalsContact CD2-CZ3 3.47Å; M26-W64 HydrophobicContact CE-CB 4.34Å; M26-W64 HydrophobicContact CE-CD2 3.45Å; M26-W64 VanDerWaalsContact CE-CD2 3.45Å; M26-W64 HydrophobicContact CE-CE3 3.75Å; M26-W64 HydrophobicContact CE-CG 3.67Å; M26-W64 HydrophobicContact CE-CZ2 4.39Å; M26-W64 HydrophobicContact CE-CZ3 4.31Å; M26-W64 HydrophobicContact SD-CB 3.98Å; M26-W64 HydrophobicContact SD-CD2 3.74Å; M26-W64 HydrophobicContact SD-CE3 3.59Å; M26-W64 VanDerWaalsContact SD-CE3 3.59Å; M26-W64 HydrophobicContact SD-CG 3.88Å; M26-W64 HydrophobicContact SD-CZ3 4.37Å; E42-W64 PolarHBondContact OE1-NE1 3.18Å; W47-W64 HydrophobicContact CH2-CB 3.64Å; W47-W64 AromaticContact CH2-CD1 3.6Å; W47-W64 AromaticContact CH2-CG 3.7Å; W47-W64 HydrophobicContact CH2-CG 3.7Å; W47-W64 HydrophobicContact CZ3-CB 4.01Å; W47-W64 HydrophobicContact CZ3-CG 4.5Å; C60-W64 WeakPolarHBondContact O-CB 3.49Å; C60-W64 PolarHBondContact O-N 3.09Å; K61-W64 PolarHBondContact O-N 2.8Å; W64-E66 VanDerWaalsContact C-N 3.28Å; W64-E66 PolarHBondContact O-N 3.39Å; W64-V67 PolarHBondContact O-N 3.22Å; W64-S68 VanDerWaalsContact O-CB 3.28Å; W64-S68 WeakPolarHBondContact O-CB 3.16Å; W64-S68 PolarHBondContact O-N 3.47Å; W64-I71 HydrophobicContact CH2-CD1 4.34Å; W64-L77 HydrophobicContact CH2-CD1 3.81Å; W64-L77 HydrophobicContact CZ2-CD1 3.3Å; W64-L80 HydrophobicContact CH2-CB 4.06Å; W64-L80 HydrophobicContact CZ2-CB 4.48Å; W64-I81 HydrophobicContact CH2-CG1 4.22Å; W64-I81 HydrophobicContact CZ3-CG1 4.14Å; W64-A84 HydrophobicContact CZ3-CB 3.94Å
65	Q	90.8	Very high	86.9	Confident	96 Å²	96	71.8 Å²	71.8	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-59.2	-39.8	179.4	-76.1	-175.5	8.3	0	0	112.1	K61 Q62 S68 K69	K61-Q65 WeakPolarHBondContact O-CG 3.21Å; K61-Q65 PolarHBondContact O-N 3.41Å; Q62-Q65 WeakPolarHBondContact O-CB 3.48Å; Q62-Q65 PolarHBondContact O-N 2.86Å; Q65-S68 PolarHBondContact O-OG 3.13Å; Q65-K69 WeakPolarHBondContact O-CG 3.3Å; Q65-K69 PolarHBondContact O-N 3.4Å
66	E	90.6	Very high	86.8	Confident	95 Å²	95	72.4 Å²	72.4	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-58.8	172.2	-173.8	-169.3	132.7	0	0	111.7	Q62 K63 W64 S68 K69	Q62-E66 PolarHBondContact O-N 2.92Å; K63-E66 WeakPolarHBondContact CD-OE2 3.48Å; K63-E66 WeakPolarHBondContact CE-OE1 3.44Å; K63-E66 WeakPolarHBondContact CE-OE2 3.12Å; K63-E66 IonicContact NZ-OE1 2.6Å; K63-E66 PolarHBondContact NZ-OE1 2.88Å; K63-E66 IonicContact NZ-OE2 3.74Å; K63-E66 PolarHBondContact NZ-OE2 2.74Å; K63-E66 PolarHBondContact O-N 3.43Å; W64-E66 VanDerWaalsContact C-N 3.28Å; W64-E66 PolarHBondContact O-N 3.39Å; E66-S68 PolarHBondContact O-N 3.24Å; E66-K69 WeakPolarHBondContact O-CB 3.4Å; E66-K69 PolarHBondContact O-N 2.86Å
67	V	89.3	Confident	86.6	Confident	10 Å²	10	68.6 Å²	68.6	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-35.9	179.8	173.3	0	0	0	0	111.7	L19 K63 W64 K69 E70 A84 Y87 I88	L19-V67 HydrophobicContact CD2-CG2 4.43Å; K63-V67 WeakPolarHBondContact O-CG2 3.33Å; K63-V67 PolarHBondContact O-N 2.86Å; W64-V67 PolarHBondContact O-N 3.22Å; V67-K69 VanDerWaalsContact C-N 3.25Å; V67-K69 PolarHBondContact O-N 2.93Å; V67-E70 PolarHBondContact O-N 3.5Å; V67-A84 HydrophobicContact CG1-CB 3.75Å; V67-Y87 HydrophobicContact CG1-CD1 4.49Å; V67-I88 HydrophobicContact CG1-CD1 3.76Å; V67-I88 HydrophobicContact CG1-CG1 4.44Å; V67-I88 HydrophobicContact CG2-CD1 4.07Å
68	S	88.6	Confident	86.5	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-28.4	179.1	83.2	0	0	0	0	113.3	W64 Q65 E66 E70 I71 K73	W64-S68 VanDerWaalsContact O-CB 3.28Å; W64-S68 WeakPolarHBondContact O-CB 3.16Å; W64-S68 PolarHBondContact O-N 3.47Å; Q65-S68 PolarHBondContact O-OG 3.13Å; E66-S68 PolarHBondContact O-N 3.24Å; S68-E70 PolarHBondContact O-N 3.29Å; S68-I71 WeakPolarHBondContact O-CG1 3.18Å; S68-K73 WeakPolarHBondContact O-CE 3.45Å; S68-K73 WeakPolarHBondContact OG-CE 3.47Å; S68-K73 PolarHBondContact OG-NZ 2.89Å
69	K	88.1	Confident	86.3	Confident	151 Å²	151	68.4 Å²	68.4	66%	0.657	31%	0.305	S	S	*	.	H	α-helix	trans	-66	-27.9	180	-69.1	167.4	-175.8	178.1	0	111.7	Q65 E66 V67	Q65-K69 WeakPolarHBondContact O-CG 3.3Å; Q65-K69 PolarHBondContact O-N 3.4Å; E66-K69 WeakPolarHBondContact O-CB 3.4Å; E66-K69 PolarHBondContact O-N 2.86Å; V67-K69 VanDerWaalsContact C-N 3.25Å; V67-K69 PolarHBondContact O-N 2.93Å
70	E	84.5	Confident	86.3	Confident	97 Å²	97	65.9 Å²	65.9	45%	0.453	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.2	-172.7	-64.1	-58.2	136	0	0	114.4	V67 S68 Y87 K96	V67-E70 PolarHBondContact O-N 3.5Å; S68-E70 PolarHBondContact O-N 3.29Å; E70-Y87 HydrophobicContact CB-CD1 3.89Å; E70-Y87 HydrophobicContact CB-CE1 3.4Å; E70-Y87 VanDerWaalsContact CB-CE1 3.4Å; E70-Y87 HydrophobicContact CB-CE2 4.41Å; E70-Y87 HydrophobicContact CG-CE1 3.8Å; E70-K96 WeakPolarHBondContact OE2-CE 3.21Å; E70-K96 IonicContact OE2-NZ 2.65Å; E70-K96 PolarHBondContact OE2-NZ 2.92Å
71	I	85.2	Confident	86.2	Confident	22 Å²	22	65.9 Å²	65.9	11%	0.113	29%	0.293	C	S	.	.	S	Bend	trans	-125.9	153.7	-177.8	60.4	169	0	0	0	112.7	W64 S68 K73 L80 D83 A84 Y87	W64-I71 HydrophobicContact CH2-CD1 4.34Å; S68-I71 WeakPolarHBondContact O-CG1 3.18Å; I71-K73 PolarHBondContact O-N 3.18Å; I71-K73 VanDerWaalsContact O-N 3.15Å; I71-L80 HydrophobicContact CD1-CB 4.01Å; I71-L80 HydrophobicContact CD1-CD2 4.41Å; I71-L80 HydrophobicContact CD1-CG 3.95Å; I71-L80 VanDerWaalsContact CD1-O 3.25Å; I71-L80 WeakPolarHBondContact CD1-O 2.83Å; I71-D83 HydrophobicContact CB-CB 4.48Å; I71-D83 HydrophobicContact CD1-CB 4.45Å; I71-D83 HydrophobicContact CG2-CB 4.39Å; I71-A84 HydrophobicContact CD1-CB 4.16Å; I71-Y87 HydrophobicContact CG2-CG 4.48Å
72	R	80	Confident	86	Confident	172 Å²	172	68 Å²	68	65%	0.649	30%	0.302	S	S	*	.			trans	-77.2	103.5	-174.2	-163	172.6	-167.3	-178.7	6	110.9	F74 D701	R72-F74 HydrophobicContact CG-CD2 3.92Å; R72-F74 PolarHBondContact O-N 2.92Å; R72-D701 IonicContact NH2-OD2 2.83Å; R72-D701 PolarHBondContact NH2-OD2 3.22Å; R72-D701 VanDerWaalsContact NH2-OD2 3.1Å
73	K	79.8	Confident	85.6	Confident	74 Å²	74	64.9 Å²	64.9	32%	0.322	29%	0.29	S	S	.	.			trans	-69.8	51.1	-171.7	-59.2	-168.7	173.9	-167.1	0	116.5	Y38 S68 I71	Y38-K73 HydrophobicContact CE1-CB 3.91Å; Y38-K73 WeakPolarHBondContact CE1-O 3.43Å; Y38-K73 HydrophobicContact CE2-CD 4.39Å; S68-K73 WeakPolarHBondContact O-CE 3.45Å; S68-K73 WeakPolarHBondContact OG-CE 3.47Å; S68-K73 PolarHBondContact OG-NZ 2.89Å; I71-K73 PolarHBondContact O-N 3.18Å; I71-K73 VanDerWaalsContact O-N 3.15Å
74	F	57.8	Low	85.4	Confident	166 Å²	166	63.1 Å²	63.1	73%	0.728	28%	0.282	S	S	*	.			trans	-127.2	51.2	-171.8	-81.6	-97	0	0	0	113.5	R72	R72-F74 HydrophobicContact CG-CD2 3.92Å; R72-F74 PolarHBondContact O-N 2.92Å
75	R	77.7	Confident	85.2	Confident	137 Å²	137	63.9 Å²	63.9	52%	0.517	29%	0.286	S	S	.	.	S	Bend	trans	-161.1	-171.6	-173.8	-105	157.5	-145.6	-118.9	23	114.2	Y38 E79 L80	Y38-R75 PolarHBondContact N-O 2.98Å; Y38-R75 VanDerWaalsContact N-O 3.17Å; R75-E79 HydrophobicContact CB-CB 3.95Å; R75-E79 VanDerWaalsContact CD-OE2 3.31Å; R75-E79 WeakPolarHBondContact CD-OE2 3.44Å; R75-E79 HydrophobicContact CG-CB 4Å; R75-E79 HydrophobicContact CG-CG 4.48Å; R75-E79 WeakPolarHBondContact CG-OE2 3.35Å; R75-E79 IonicContact CZ-OE2 2.81Å; R75-E79 IonicContact NE-OE2 2.85Å; R75-E79 IonicContact NH1-OE2 2.68Å; R75-E79 PolarHBondContact NH1-OE2 3.36Å; R75-L80 HydrophobicContact CB-CD1 3.43Å; R75-L80 VanDerWaalsContact CB-CD1 3.43Å
76	T	88.8	Confident	84.9	Confident	25 Å²	25	62.2 Å²	62.2	15%	0.153	28%	0.28	C	S	.	.			trans	-68.4	159.8	163	61.2	0	0	0	0	110.8	T78 E79 L80	T76-T78 VanDerWaalsContact C-N 3.32Å; T76-E79 PolarHBondContact O-N 3.32Å; T76-E79 WeakPolarHBondContact OG1-CB 3.35Å; T76-E79 WeakPolarHBondContact OG1-CG 3.42Å; T76-E79 PolarHBondContact OG1-N 3.28Å; T76-E79 PolarHBondContact OG1-OE1 3.31Å; T76-L80 WeakPolarHBondContact O-CD1 3.38Å; T76-L80 PolarHBondContact O-N 3.35Å; T76-L80 VanDerWaalsContact O-N 3.1Å
77	L	87.1	Confident	84.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-69.5	-34.5	178.7	-178.1	57.2	0	0	0	111.3	M26 L30 D34 E42 L45 W64 E79 L80 I81	M26-L77 HydrophobicContact CE-CD1 4.41Å; M26-L77 HydrophobicContact CE-CD2 4.37Å; L30-L77 HydrophobicContact CD1-CB 4.23Å; L30-L77 HydrophobicContact CD1-CD2 3.95Å; L30-L77 HydrophobicContact CD1-CG 3.89Å; L30-L77 HydrophobicContact CD2-CD2 4.16Å; D34-L77 WeakPolarHBondContact OD2-CA 3.34Å; D34-L77 PolarHBondContact OD2-N 2.85Å; E42-L77 HydrophobicContact CB-CD2 4.02Å; L45-L77 HydrophobicContact CD2-CD2 4.45Å; W64-L77 HydrophobicContact CH2-CD1 3.81Å; W64-L77 HydrophobicContact CZ2-CD1 3.3Å; L77-E79 VanDerWaalsContact C-N 3.3Å; L77-E79 PolarHBondContact O-N 3.11Å; L77-L80 HydrophobicContact CD1-CB 4.38Å; L77-L80 PolarHBondContact O-N 3.5Å; L77-I81 HydrophobicContact CD1-CG1 4.43Å; L77-I81 HydrophobicContact CG-CD1 4.1Å; L77-I81 HydrophobicContact CG-CG1 4.47Å; L77-I81 WeakPolarHBondContact O-CG1 3.34Å; L77-I81 PolarHBondContact O-N 2.93Å
78	T	87.3	Confident	84.5	Confident	36 Å²	36	61 Å²	61	22%	0.221	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-39.5	174.5	-62.8	0	0	0	0	112.2	D34 T76 F82	D34-T78 WeakPolarHBondContact CB-OG1 3.37Å; D34-T78 PolarHBondContact OD2-N 3Å; D34-T78 PolarHBondContact OD2-OG1 3.41Å; T76-T78 VanDerWaalsContact C-N 3.32Å; T78-F82 HydrophobicContact CG2-CD2 4.37Å; T78-F82 HydrophobicContact CG2-CE2 3.96Å; T78-F82 WeakPolarHBondContact O-CD2 3.5Å; T78-F82 PolarHBondContact O-N 3.29Å
79	E	87.6	Confident	84.3	Confident	71 Å²	71	66.2 Å²	66.2	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-72.8	-39.9	174.2	-74.7	173.3	-90.7	0	0	112.6	R75 T76 L77 I81 F82 D83	R75-E79 HydrophobicContact CB-CB 3.95Å; R75-E79 VanDerWaalsContact CD-OE2 3.31Å; R75-E79 WeakPolarHBondContact CD-OE2 3.44Å; R75-E79 HydrophobicContact CG-CB 4Å; R75-E79 HydrophobicContact CG-CG 4.48Å; R75-E79 WeakPolarHBondContact CG-OE2 3.35Å; R75-E79 IonicContact CZ-OE2 2.81Å; R75-E79 IonicContact NE-OE2 2.85Å; R75-E79 IonicContact NH1-OE2 2.68Å; R75-E79 PolarHBondContact NH1-OE2 3.36Å; T76-E79 PolarHBondContact O-N 3.32Å; T76-E79 WeakPolarHBondContact OG1-CB 3.35Å; T76-E79 WeakPolarHBondContact OG1-CG 3.42Å; T76-E79 PolarHBondContact OG1-N 3.28Å; T76-E79 PolarHBondContact OG1-OE1 3.31Å; L77-E79 VanDerWaalsContact C-N 3.3Å; L77-E79 PolarHBondContact O-N 3.11Å; E79-I81 PolarHBondContact O-N 3.48Å; E79-F82 PolarHBondContact O-N 2.81Å; E79-F82 VanDerWaalsContact O-N 3.08Å; E79-D83 PolarHBondContact O-N 2.89Å
80	L	88.4	Confident	84.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-34.1	173	-96.4	69.3	0	0	0	111.9	Y38 W64 I71 R75 T76 L77 D83 A84	Y38-L80 HydrophobicContact CD1-CD2 4.07Å; Y38-L80 HydrophobicContact CD2-CD2 3.75Å; Y38-L80 HydrophobicContact CE2-CD2 4.33Å; Y38-L80 HydrophobicContact CG-CD2 3.61Å; W64-L80 HydrophobicContact CH2-CB 4.06Å; W64-L80 HydrophobicContact CZ2-CB 4.48Å; I71-L80 HydrophobicContact CD1-CB 4.01Å; I71-L80 HydrophobicContact CD1-CD2 4.41Å; I71-L80 HydrophobicContact CD1-CG 3.95Å; I71-L80 VanDerWaalsContact CD1-O 3.25Å; I71-L80 WeakPolarHBondContact CD1-O 2.83Å; R75-L80 HydrophobicContact CB-CD1 3.43Å; R75-L80 VanDerWaalsContact CB-CD1 3.43Å; T76-L80 WeakPolarHBondContact O-CD1 3.38Å; T76-L80 PolarHBondContact O-N 3.35Å; T76-L80 VanDerWaalsContact O-N 3.1Å; L77-L80 HydrophobicContact CD1-CB 4.38Å; L77-L80 PolarHBondContact O-N 3.5Å; L80-D83 PolarHBondContact O-N 2.86Å; L80-A84 VanDerWaalsContact O-CB 3.28Å; L80-A84 WeakPolarHBondContact O-CB 3.22Å; L80-A84 PolarHBondContact O-N 3.22Å
81	I	89.3	Confident	83.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.6	-39.6	173.6	-73.8	165.3	0	0	0	111.3	L23 M26 K27 L30 W64 L77 E79 A84 Q85	L23-I81 HydrophobicContact CB-CG2 4.11Å; L23-I81 HydrophobicContact CD2-CG1 4.3Å; L23-I81 HydrophobicContact CD2-CG2 4.35Å; M26-I81 HydrophobicContact CB-CD1 3.78Å; M26-I81 HydrophobicContact CE-CD1 4.3Å; M26-I81 HydrophobicContact CE-CG1 4.48Å; K27-I81 HydrophobicContact CB-CD1 4.45Å; K27-I81 HydrophobicContact CB-CG2 4.28Å; K27-I81 HydrophobicContact CD-CG2 4.25Å; L30-I81 HydrophobicContact CD1-CD1 3.53Å; W64-I81 HydrophobicContact CH2-CG1 4.22Å; W64-I81 HydrophobicContact CZ3-CG1 4.14Å; L77-I81 HydrophobicContact CD1-CG1 4.43Å; L77-I81 HydrophobicContact CG-CD1 4.1Å; L77-I81 HydrophobicContact CG-CG1 4.47Å; L77-I81 WeakPolarHBondContact O-CG1 3.34Å; L77-I81 PolarHBondContact O-N 2.93Å; E79-I81 PolarHBondContact O-N 3.48Å; I81-A84 PolarHBondContact O-N 3.14Å; I81-Q85 WeakPolarHBondContact O-CB 3.46Å; I81-Q85 WeakPolarHBondContact O-CG 3.34Å; I81-Q85 PolarHBondContact O-N 3.12Å
82	F	87.5	Confident	83.7	Confident	105 Å²	105	61.2 Å²	61.2	46%	0.461	28%	0.275	S	S	.	.	H	α-helix	trans	-66.7	-42.1	174.2	-75.2	-63.7	0	0	0	112.2	T78 E79 A84 Q85 D86	T78-F82 HydrophobicContact CG2-CD2 4.37Å; T78-F82 HydrophobicContact CG2-CE2 3.96Å; T78-F82 WeakPolarHBondContact O-CD2 3.5Å; T78-F82 PolarHBondContact O-N 3.29Å; E79-F82 PolarHBondContact O-N 2.81Å; E79-F82 VanDerWaalsContact O-N 3.08Å; F82-A84 VanDerWaalsContact C-N 3.3Å; F82-A84 PolarHBondContact O-N 3.15Å; F82-Q85 PolarHBondContact O-N 2.88Å; F82-D86 PolarHBondContact O-N 3.26Å
83	D	85	Confident	83.4	Confident	65 Å²	65	56.1 Å²	56.1	35%	0.348	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-37.3	174.7	-72.4	-15.7	0	0	0	111.2	I71 E79 L80 D86 Y87	I71-D83 HydrophobicContact CB-CB 4.48Å; I71-D83 HydrophobicContact CD1-CB 4.45Å; I71-D83 HydrophobicContact CG2-CB 4.39Å; E79-D83 PolarHBondContact O-N 2.89Å; L80-D83 PolarHBondContact O-N 2.86Å; D83-D86 PolarHBondContact O-N 3.16Å; D83-Y87 WeakPolarHBondContact O-CB 3.48Å; D83-Y87 PolarHBondContact O-N 3.31Å
84	A	88.4	Confident	83	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.4	-41.8	172.7	0	0	0	0	0	112.6	L23 W64 V67 I71 L80 I81 F82 D86 Y87 I88	L23-A84 HydrophobicContact CD1-CB 3.58Å; L23-A84 HydrophobicContact CD2-CB 3.92Å; L23-A84 HydrophobicContact CG-CB 4.45Å; W64-A84 HydrophobicContact CZ3-CB 3.94Å; V67-A84 HydrophobicContact CG1-CB 3.75Å; I71-A84 HydrophobicContact CD1-CB 4.16Å; L80-A84 VanDerWaalsContact O-CB 3.28Å; L80-A84 WeakPolarHBondContact O-CB 3.22Å; L80-A84 PolarHBondContact O-N 3.22Å; I81-A84 PolarHBondContact O-N 3.14Å; F82-A84 VanDerWaalsContact C-N 3.3Å; F82-A84 PolarHBondContact O-N 3.15Å; A84-D86 VanDerWaalsContact C-N 3.31Å; A84-D86 PolarHBondContact O-N 3.38Å; A84-Y87 PolarHBondContact O-N 2.89Å; A84-I88 WeakPolarHBondContact O-CB 3.32Å; A84-I88 PolarHBondContact O-N 3.21Å
85	Q	87.9	Confident	83.4	Confident	18 Å²	18	57.2 Å²	57.2	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-35.5	176	-76.3	-173.6	-26.3	0	0	111.8	L20 L23 D24 I81 F82 K89	L20-Q85 HydrophobicContact CD2-CB 4.26Å; L20-Q85 HydrophobicContact CD2-CG 4.1Å; L23-Q85 HydrophobicContact CB-CG 3.83Å; L23-Q85 HydrophobicContact CD1-CB 4.38Å; L23-Q85 HydrophobicContact CD1-CG 3.62Å; L23-Q85 HydrophobicContact CG-CG 4.39Å; D24-Q85 PolarHBondContact OD1-NE2 2.94Å; D24-Q85 PolarHBondContact OD2-NE2 3.36Å; I81-Q85 WeakPolarHBondContact O-CB 3.46Å; I81-Q85 WeakPolarHBondContact O-CG 3.34Å; I81-Q85 PolarHBondContact O-N 3.12Å; F82-Q85 PolarHBondContact O-N 2.88Å; Q85-K89 WeakPolarHBondContact O-CB 3.38Å; Q85-K89 WeakPolarHBondContact O-CD 3.46Å; Q85-K89 VanDerWaalsContact O-CG 3.28Å; Q85-K89 WeakPolarHBondContact O-CG 3.23Å; Q85-K89 PolarHBondContact O-N 3.21Å
86	D	83.9	Confident	83.3	Confident	61 Å²	61	53.1 Å²	53.1	33%	0.326	26%	0.261	S	S	.	.	H	α-helix	trans	-73.2	-38.6	172.9	-169.7	31.5	0	0	0	112.1	F82 D83 A84 K89 N90 K93	F82-D86 PolarHBondContact O-N 3.26Å; D83-D86 PolarHBondContact O-N 3.16Å; A84-D86 VanDerWaalsContact C-N 3.31Å; A84-D86 PolarHBondContact O-N 3.38Å; D86-K89 PolarHBondContact O-N 2.98Å; D86-N90 WeakPolarHBondContact O-CB 3.4Å; D86-N90 PolarHBondContact O-N 3.04Å; D86-N90 PolarHBondContact OD1-ND2 2.95Å; D86-K93 IonicContact OD1-NZ 2.62Å; D86-K93 PolarHBondContact OD1-NZ 3.29Å; D86-K93 VanDerWaalsContact OD2-CD 3.3Å; D86-K93 WeakPolarHBondContact OD2-CD 3.3Å; D86-K93 IonicContact OD2-NZ 2.74Å; D86-K93 PolarHBondContact OD2-NZ 2.87Å
87	Y	85.5	Confident	82.8	Confident	63 Å²	63	52.3 Å²	52.3	25%	0.247	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-45.5	175.4	173.3	-121	0	0	0	112.7	V67 E70 I71 D83 A84 K89 N90 P91 K96	V67-Y87 HydrophobicContact CG1-CD1 4.49Å; E70-Y87 HydrophobicContact CB-CD1 3.89Å; E70-Y87 HydrophobicContact CB-CE1 3.4Å; E70-Y87 VanDerWaalsContact CB-CE1 3.4Å; E70-Y87 HydrophobicContact CB-CE2 4.41Å; E70-Y87 HydrophobicContact CG-CE1 3.8Å; I71-Y87 HydrophobicContact CG2-CG 4.48Å; D83-Y87 WeakPolarHBondContact O-CB 3.48Å; D83-Y87 PolarHBondContact O-N 3.31Å; A84-Y87 PolarHBondContact O-N 2.89Å; Y87-K89 VanDerWaalsContact C-N 3.3Å; Y87-K89 PolarHBondContact O-N 2.86Å; Y87-N90 CarbonylContact O-C 3.54Å; Y87-N90 PolarHBondContact O-N 3.1Å; Y87-P91 HydrophobicContact CE2-CB 4.06Å; Y87-P91 WeakPolarHBondContact CE2-O 3.47Å; Y87-P91 WeakPolarHBondContact O-CA 3.33Å; Y87-P91 WeakPolarHBondContact O-CD 3.14Å; Y87-P91 WeakPolarHBondContact O-CG 3.27Å; Y87-K96 HydrophobicContact CE2-CD 4.16Å; Y87-K96 VanDerWaalsContact CE2-NZ 3.25Å
88	I	86.8	Confident	82.2	Confident	15 Å²	15	60.4 Å²	60.4	8%	0.077	29%	0.291	C	S	.	.	H	α-helix	trans	-66.8	-30.8	178.1	-77.9	151.6	0	0	0	112.1	Q16 L19 L20 L23 V67 A84	Q16-I88 HydrophobicContact CG-CG2 3.84Å; Q16-I88 PolarHBondContact NE2-O 3.04Å; L19-I88 HydrophobicContact CB-CD1 3.89Å; L19-I88 HydrophobicContact CB-CG1 4.31Å; L19-I88 HydrophobicContact CB-CG2 3.99Å; L19-I88 HydrophobicContact CD1-CG1 4.42Å; L20-I88 HydrophobicContact CD2-CB 4.34Å; L20-I88 HydrophobicContact CD2-CG2 3.87Å; L20-I88 HydrophobicContact CG-CG2 3.91Å; L23-I88 HydrophobicContact CD1-CD1 3.53Å; L23-I88 HydrophobicContact CG-CD1 4.49Å; V67-I88 HydrophobicContact CG1-CD1 3.76Å; V67-I88 HydrophobicContact CG1-CG1 4.44Å; V67-I88 HydrophobicContact CG2-CD1 4.07Å; A84-I88 WeakPolarHBondContact O-CB 3.32Å; A84-I88 PolarHBondContact O-N 3.21Å
89	K	84.9	Confident	81.9	Confident	113 Å²	113	66.5 Å²	66.5	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-78.3	-34.3	173.4	-72.6	172.3	-177.7	176.3	0	112.9	L20 Q85 D86 Y87	L20-K89 HydrophobicContact CD1-CD 4.46Å; L20-K89 VanDerWaalsContact CD1-CE 3.41Å; L20-K89 HydrophobicContact CD1-CG 4.14Å; L20-K89 HydrophobicContact CD2-CD 4.41Å; L20-K89 HydrophobicContact CD2-CG 4.21Å; Q85-K89 WeakPolarHBondContact O-CB 3.38Å; Q85-K89 WeakPolarHBondContact O-CD 3.46Å; Q85-K89 VanDerWaalsContact O-CG 3.28Å; Q85-K89 WeakPolarHBondContact O-CG 3.23Å; Q85-K89 PolarHBondContact O-N 3.21Å; D86-K89 PolarHBondContact O-N 2.98Å; Y87-K89 VanDerWaalsContact C-N 3.3Å; Y87-K89 PolarHBondContact O-N 2.86Å
90	N	82.1	Confident	81.6	Confident	31 Å²	31	64.2 Å²	64.2	17%	0.166	30%	0.304	C	S	.	.			trans	-132.2	69.9	-175.8	-62.1	-65.7	0	0	0	111.8	D86 Y87 Y92 K93 L178	D86-N90 WeakPolarHBondContact O-CB 3.4Å; D86-N90 PolarHBondContact O-N 3.04Å; D86-N90 PolarHBondContact OD1-ND2 2.95Å; Y87-N90 CarbonylContact O-C 3.54Å; Y87-N90 PolarHBondContact O-N 3.1Å; N90-Y92 PolarHBondContact O-N 2.96Å; N90-K93 HydrophobicContact CB-CB 4.02Å; N90-K93 HydrophobicContact CB-CD 3.99Å; N90-K93 HydrophobicContact CB-CG 4.33Å; N90-K93 WeakPolarHBondContact O-CB 3.43Å; N90-K93 PolarHBondContact O-N 3.25Å; N90-L178 HydrophobicContact CB-CD2 4.18Å
91	P	81.3	Confident	81.4	Confident	52 Å²	52	68.6 Å²	68.6	34%	0.338	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.9	-172.3	-27.2	36.2	0	0	0	115	Y87 K96	Y87-P91 HydrophobicContact CE2-CB 4.06Å; Y87-P91 WeakPolarHBondContact CE2-O 3.47Å; Y87-P91 WeakPolarHBondContact O-CA 3.33Å; Y87-P91 WeakPolarHBondContact O-CD 3.14Å; Y87-P91 WeakPolarHBondContact O-CG 3.27Å; P91-K96 VanDerWaalsContact O-CD 3.25Å; P91-K96 WeakPolarHBondContact O-CD 3.47Å
92	Y	80.1	Confident	81.1	Confident	82 Å²	82	73.3 Å²	73.3	32%	0.322	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	12.5	-178.1	-58.3	-77.1	0	0	0	114.1	N90 K96 L97 K99 H100	N90-Y92 PolarHBondContact O-N 2.96Å; Y92-K96 CarbonylContact O-C 3.59Å; Y92-L97 WeakPolarHBondContact O-CA 2.78Å; Y92-L97 WeakPolarHBondContact O-CB 3.3Å; Y92-L97 PolarHBondContact O-N 3.25Å; Y92-K99 WeakPolarHBondContact CE1-O 3.34Å; Y92-H100 VanDerWaalsContact CD1-CA 3.47Å; Y92-H100 HydrophobicContact CD1-CB 3.92Å; Y92-H100 HydrophobicContact CD2-CB 4.36Å; Y92-H100 AromaticContact CD2-CD2 3.31Å; Y92-H100 WeakPolarHBondContact CD2-CD2 3.22Å; Y92-H100 AromaticContact CE2-CD2 3.96Å; Y92-H100 HydrophobicContact CG-CB 3.83Å; Y92-H100 AromaticContact CG-CD2 3.57Å
93	K	74.1	Confident	80.9	Confident	64 Å²	64	70.2 Å²	70.2	28%	0.278	34%	0.344	S	S	.	.			trans	-64.8	149.6	-179.5	-146.1	174.2	-164.2	172.5	0	112.4	D86 N90 K95 K96	D86-K93 IonicContact OD1-NZ 2.62Å; D86-K93 PolarHBondContact OD1-NZ 3.29Å; D86-K93 VanDerWaalsContact OD2-CD 3.3Å; D86-K93 WeakPolarHBondContact OD2-CD 3.3Å; D86-K93 IonicContact OD2-NZ 2.74Å; D86-K93 PolarHBondContact OD2-NZ 2.87Å; N90-K93 HydrophobicContact CB-CB 4.02Å; N90-K93 HydrophobicContact CB-CD 3.99Å; N90-K93 HydrophobicContact CB-CG 4.33Å; N90-K93 WeakPolarHBondContact O-CB 3.43Å; N90-K93 PolarHBondContact O-N 3.25Å; K93-K95 PolarHBondContact O-N 3.11Å; K93-K96 PolarHBondContact O-N 3.48Å
94	G	72.2	Confident	81	Confident	45 Å²	45	67.8 Å²	67.8	46%	0.464	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	59.3	-126.8	172.9	0	0	0	0	0	114	K96 L97	G94-K96 PolarHBondContact O-N 2.9Å; G94-L97 VanDerWaalsContact O-CB 3.29Å; G94-L97 WeakPolarHBondContact O-CB 3.48Å; G94-L97 PolarHBondContact O-N 2.78Å
95	K	66.4	Low	80.9	Confident	219 Å²	219	76.6 Å²	76.6	95%	0.952	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-58	-21.9	-176.1	-69.8	-165.8	177.5	-169.8	0	113.6	K93	K93-K95 PolarHBondContact O-N 3.11Å
96	K	73.8	Confident	80.8	Confident	51 Å²	51	84 Å²	84	22%	0.222	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-84.6	-5.8	178.5	-68.8	173.4	178.6	168.7	0	114.1	E70 Y87 P91 Y92 K93 G94 K98 K99	E70-K96 WeakPolarHBondContact OE2-CE 3.21Å; E70-K96 IonicContact OE2-NZ 2.65Å; E70-K96 PolarHBondContact OE2-NZ 2.92Å; Y87-K96 HydrophobicContact CE2-CD 4.16Å; Y87-K96 VanDerWaalsContact CE2-NZ 3.25Å; P91-K96 VanDerWaalsContact O-CD 3.25Å; P91-K96 WeakPolarHBondContact O-CD 3.47Å; Y92-K96 CarbonylContact O-C 3.59Å; K93-K96 PolarHBondContact O-N 3.48Å; G94-K96 PolarHBondContact O-N 2.9Å; K96-K98 VanDerWaalsContact C-N 3.34Å; K96-K98 PolarHBondContact O-N 3.13Å; K96-K99 WeakPolarHBondContact O-CA 3.38Å; K96-K99 WeakPolarHBondContact O-CB 3.45Å; K96-K99 PolarHBondContact O-N 3.15Å
97	L	78.9	Confident	81	Confident	7 Å²	7	82.4 Å²	82.4	4%	0.037	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-62	-38.5	-173.4	-173.9	58.4	0	0	0	113.4	Y92 G94 K99 H100 F103 F171 L178 M182	Y92-L97 WeakPolarHBondContact O-CA 2.78Å; Y92-L97 WeakPolarHBondContact O-CB 3.3Å; Y92-L97 PolarHBondContact O-N 3.25Å; G94-L97 VanDerWaalsContact O-CB 3.29Å; G94-L97 WeakPolarHBondContact O-CB 3.48Å; G94-L97 PolarHBondContact O-N 2.78Å; L97-K99 PolarHBondContact O-N 2.65Å; L97-H100 PolarHBondContact O-N 3.43Å; L97-H100 VanDerWaalsContact O-N 3.1Å; L97-F103 HydrophobicContact CD1-CD2 4.33Å; L97-F103 HydrophobicContact CD2-CE2 4.29Å; L97-F103 HydrophobicContact CG-CD2 3.96Å; L97-F103 HydrophobicContact CG-CE2 3.95Å; L97-F171 HydrophobicContact CD1-CE1 4.05Å; L97-F171 HydrophobicContact CD1-CZ 3.82Å; L97-L178 HydrophobicContact CD1-CB 3.83Å; L97-L178 HydrophobicContact CD1-CD1 4.09Å; L97-L178 HydrophobicContact CD1-CG 4.45Å; L97-M182 HydrophobicContact CD2-CG 3.7Å
98	K	75.9	Confident	81.2	Confident	170 Å²	170	83.5 Å²	83.5	74%	0.739	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-64.1	-5.3	174.2	-61.7	177.7	-178.3	174.6	0	113.5	K96 F103	K96-K98 VanDerWaalsContact C-N 3.34Å; K96-K98 PolarHBondContact O-N 3.13Å; K98-F103 HydrophobicContact CG-CE1 4.39Å
99	K	80.3	Confident	81.3	Confident	165 Å²	165	85.3 Å²	85.3	72%	0.717	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-107.7	-1.5	176	-57.6	-173.5	176.1	-174.4	0	114	Y92 K96 L97	Y92-K99 WeakPolarHBondContact CE1-O 3.34Å; K96-K99 WeakPolarHBondContact O-CA 3.38Å; K96-K99 WeakPolarHBondContact O-CB 3.45Å; K96-K99 PolarHBondContact O-N 3.15Å; L97-K99 PolarHBondContact O-N 2.65Å
100	H	81.8	Confident	81.7	Confident	23 Å²	23	81 Å²	81	11%	0.106	40%	0.399	C	S	.	.	S	Bend	trans	-63.1	136.9	174.7	-171.3	-75.2	0	0	0	109.6	Y92 L97 D102 F103 F171 H175 L178	Y92-H100 VanDerWaalsContact CD1-CA 3.47Å; Y92-H100 HydrophobicContact CD1-CB 3.92Å; Y92-H100 HydrophobicContact CD2-CB 4.36Å; Y92-H100 AromaticContact CD2-CD2 3.31Å; Y92-H100 WeakPolarHBondContact CD2-CD2 3.22Å; Y92-H100 AromaticContact CE2-CD2 3.96Å; Y92-H100 HydrophobicContact CG-CB 3.83Å; Y92-H100 AromaticContact CG-CD2 3.57Å; L97-H100 PolarHBondContact O-N 3.43Å; L97-H100 VanDerWaalsContact O-N 3.1Å; H100-D102 VanDerWaalsContact C-N 3.28Å; H100-D102 IonicContact CE1-OD2 2.76Å; H100-D102 PolarHBondContact CE1-OD2 2.81Å; H100-D102 PolarHBondContact ND1-N 2.94Å; H100-D102 IonicContact ND1-OD2 2.83Å; H100-D102 PolarHBondContact ND1-OD2 2.89Å; H100-D102 PolarHBondContact O-N 2.93Å; H100-F103 HydrophobicContact CB-CB 4.07Å; H100-F103 WeakPolarHBondContact O-CB 3.42Å; H100-F103 PolarHBondContact O-N 2.84Å; H100-F171 HydrophobicContact CB-CE2 4.43Å; H100-F171 HydrophobicContact CB-CZ 4.46Å; H100-F171 AromaticContact ND1-CE2 3.67Å; H100-H175 AromaticContact CE1-CE1 3.35Å; H100-H175 PolarHBondContact CE1-CE1 3.15Å; H100-H175 AromaticContact CE1-ND1 3.95Å; H100-H175 AromaticContact CE1-NE2 3.44Å; H100-H175 PolarHBondContact CE1-NE2 3.25Å; H100-H175 AromaticContact NE2-CE1 3.51Å; H100-H175 AromaticContact NE2-ND1 3.74Å; H100-H175 AromaticContact NE2-NE2 4Å; H100-L178 VanDerWaalsContact CD2-CD1 3.43Å; H100-L178 WeakPolarHBondContact CD2-CD1 3.47Å
101	P	83.5	Confident	82.1	Confident	92 Å²	92	81.7 Å²	81.7	60%	0.597	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-46.1	-175.5	-28.3	35.4	0	0	0	113	F103	P101-F103 VanDerWaalsContact C-N 3.34Å; P101-F103 PolarHBondContact O-N 2.69Å
102	D	83.3	Confident	82.4	Confident	98 Å²	98	83.9 Å²	83.9	52%	0.524	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	0.5	-177.2	-44.8	-79.3	0	0	0	114.2	H100 P104 F171	H100-D102 VanDerWaalsContact C-N 3.28Å; H100-D102 IonicContact CE1-OD2 2.76Å; H100-D102 PolarHBondContact CE1-OD2 2.81Å; H100-D102 PolarHBondContact ND1-N 2.94Å; H100-D102 IonicContact ND1-OD2 2.83Å; H100-D102 PolarHBondContact ND1-OD2 2.89Å; H100-D102 PolarHBondContact O-N 2.93Å; D102-P104 VanDerWaalsContact O-CD 3.22Å; D102-P104 WeakPolarHBondContact O-CD 3.48Å; D102-F171 HydrophobicContact CB-CD2 4.26Å; D102-F171 HydrophobicContact CB-CE2 4.44Å; D102-F171 WeakPolarHBondContact O-CD2 3.49Å
103	F	83.8	Confident	82.9	Confident	41 Å²	41	82.6 Å²	82.6	18%	0.18	40%	0.399	C	S	.	.	S	Bend	trans	-66.9	119.5	177.7	-172.7	-90	0	0	0	110.2	L97 K98 H100 P101 K105 M168 F171	L97-F103 HydrophobicContact CD1-CD2 4.33Å; L97-F103 HydrophobicContact CD2-CE2 4.29Å; L97-F103 HydrophobicContact CG-CD2 3.96Å; L97-F103 HydrophobicContact CG-CE2 3.95Å; K98-F103 HydrophobicContact CG-CE1 4.39Å; H100-F103 HydrophobicContact CB-CB 4.07Å; H100-F103 WeakPolarHBondContact O-CB 3.42Å; H100-F103 PolarHBondContact O-N 2.84Å; P101-F103 VanDerWaalsContact C-N 3.34Å; P101-F103 PolarHBondContact O-N 2.69Å; F103-K105 PolarHBondContact O-N 3.01Å; F103-M168 HydrophobicContact CE2-CE 4.27Å; F103-F171 HydrophobicContact CB-CE2 4.24Å; F103-F171 HydrophobicContact CB-CZ 4.36Å; F103-F171 HydrophobicContact CD2-CD1 4.29Å; F103-F171 AromaticContact CD2-CE1 3.75Å; F103-F171 HydrophobicContact CD2-CE1 3.75Å; F103-F171 HydrophobicContact CD2-CE2 4.44Å; F103-F171 AromaticContact CD2-CZ 3.85Å; F103-F171 HydrophobicContact CD2-CZ 3.85Å; F103-F171 HydrophobicContact CE2-CE1 4.3Å
104	P	87.3	Confident	83.7	Confident	14 Å²	14	80 Å²	80	9%	0.091	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-62	129.8	-176.9	-25.5	37.1	0	0	0	112	D102 F164 M168 F171	D102-P104 VanDerWaalsContact O-CD 3.22Å; D102-P104 WeakPolarHBondContact O-CD 3.48Å; P104-F164 HydrophobicContact CB-CD2 3.71Å; P104-F164 HydrophobicContact CB-CE2 3.8Å; P104-F164 WeakPolarHBondContact O-CE2 3.21Å; P104-M168 HydrophobicContact CG-CB 4.28Å; P104-M168 HydrophobicContact CG-SD 4.21Å; P104-F171 HydrophobicContact CG-CB 4.24Å
105	K	85.4	Confident	84.6	Confident	185 Å²	185	78.7 Å²	78.7	80%	0.804	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-81.8	136.2	177.4	-63.9	176.9	-176.4	173.8	0	109.5	F103 F164	F103-K105 PolarHBondContact O-N 3.01Å; K105-F164 WeakPolarHBondContact O-CD2 3.44Å
106	K	85	Confident	85.6	Confident	173 Å²	173	72.7 Å²	72.7	75%	0.752	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-51.5	136.3	176.6	-75.1	-174.1	177.1	-177.6	0	109.8
107	P	88.7	Confident	86.4	Confident	27 Å²	27	73.6 Å²	73.6	18%	0.175	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-65.6	139.1	177.3	29.4	-37.5	0	0	0	111.1	T109 F157 D160 K161 F164	P107-T109 PolarHBondContact O-N 3.44Å; P107-F157 HydrophobicContact CB-CD2 4.14Å; P107-F157 HydrophobicContact CB-CE2 4.22Å; P107-F157 HydrophobicContact CG-CD2 4.29Å; P107-F157 HydrophobicContact CG-CE2 3.9Å; P107-D160 HydrophobicContact CB-CB 3.78Å; P107-K161 HydrophobicContact CG-CB 4.11Å; P107-F164 HydrophobicContact CG-CB 4.44Å
108	L	88.9	Confident	86.9	Confident	86 Å²	86	75.6 Å²	75.6	45%	0.45	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.7	127.4	178.3	-66.2	178.5	0	0	0	111.1	F112 R113 M116 F157	L108-F112 HydrophobicContact CD2-CB 4.43Å; L108-R113 HydrophobicContact CB-CB 4.29Å; L108-M116 HydrophobicContact CD1-CG 4.27Å; L108-F157 VanDerWaalsContact O-CD2 3.24Å; L108-F157 WeakPolarHBondContact O-CD2 3.49Å
109	T	90.4	Very high	87.4	Confident	54 Å²	54	71.2 Å²	71.2	33%	0.331	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-58.7	158.1	176.5	78.1	0	0	0	0	111.2	P107 Y111 F112 R113	P107-T109 PolarHBondContact O-N 3.44Å; T109-Y111 PolarHBondContact O-N 3.08Å; T109-Y111 VanDerWaalsContact O-N 3.12Å; T109-F112 HydrophobicContact CG2-CD2 4.38Å; T109-F112 PolarHBondContact O-N 3.21Å; T109-F112 VanDerWaalsContact O-N 3.08Å; T109-F112 WeakPolarHBondContact OG1-CD2 3.37Å; T109-F112 PolarHBondContact OG1-N 3.48Å; T109-R113 WeakPolarHBondContact O-CB 3.44Å; T109-R113 PolarHBondContact O-N 3.25Å
110	P	91.7	Very high	87.7	Confident	21 Å²	21	66.4 Å²	66.4	14%	0.136	33%	0.329	C	S	.	.	H	α-helix	trans	-54.4	-35.3	-177.4	-29.9	38.6	0	0	0	114	F114 Y142 V154 F157	P110-F114 PolarHBondContact O-N 2.8Å; P110-Y142 WeakPolarHBondContact CB-OH 3.49Å; P110-V154 HydrophobicContact CB-CG2 4.04Å; P110-V154 HydrophobicContact CG-CB 4.41Å; P110-V154 HydrophobicContact CG-CG2 3.93Å; P110-F157 HydrophobicContact CG-CB 3.87Å; P110-F157 HydrophobicContact CG-CD1 4.05Å; P110-F157 HydrophobicContact CG-CG 4.08Å
111	Y	90.5	Very high	88	Confident	47 Å²	47	70.7 Å²	70.7	18%	0.184	35%	0.347	C	S	.	.	H	α-helix	trans	-70.1	-53.5	172.8	172.1	-125.8	0	0	0	112.1	T109 R113 F114 F115 S139 Y142	T109-Y111 PolarHBondContact O-N 3.08Å; T109-Y111 VanDerWaalsContact O-N 3.12Å; Y111-R113 PolarHBondContact O-N 3.37Å; Y111-F114 HydrophobicContact CD2-CD1 4.48Å; Y111-F114 WeakPolarHBondContact O-CB 3.34Å; Y111-F114 PolarHBondContact O-N 3.02Å; Y111-F115 HydrophobicContact CE2-CB 4.24Å; Y111-F115 WeakPolarHBondContact O-CB 3.48Å; Y111-F115 PolarHBondContact O-N 3.35Å; Y111-S139 WeakPolarHBondContact OH-CB 3.2Å; Y111-S139 PolarHBondContact OH-N 2.97Å; Y111-Y142 AromaticContact CD2-CD1 3.71Å; Y111-Y142 HydrophobicContact CD2-CD1 3.71Å; Y111-Y142 HydrophobicContact CD2-CD2 4.16Å; Y111-Y142 HydrophobicContact CD2-CE1 4.43Å; Y111-Y142 AromaticContact CD2-CG 3.57Å; Y111-Y142 HydrophobicContact CD2-CG 3.57Å; Y111-Y142 HydrophobicContact CE2-CG 4.35Å; Y111-Y142 HydrophobicContact CG-CD1 4.18Å; Y111-Y142 HydrophobicContact CG-CG 4.42Å
112	F	88.7	Confident	88.1	Confident	97 Å²	97	69.5 Å²	69.5	43%	0.425	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-32	-179.1	-81.9	-63.4	0	0	0	112.8	L108 T109 F115 M116	L108-F112 HydrophobicContact CD2-CB 4.43Å; T109-F112 HydrophobicContact CG2-CD2 4.38Å; T109-F112 PolarHBondContact O-N 3.21Å; T109-F112 VanDerWaalsContact O-N 3.08Å; T109-F112 WeakPolarHBondContact OG1-CD2 3.37Å; T109-F112 PolarHBondContact OG1-N 3.48Å; F112-F115 HydrophobicContact CD1-CD1 4.27Å; F112-F115 PolarHBondContact O-N 3.41Å; F112-M116 WeakPolarHBondContact O-CB 3.44Å; F112-M116 WeakPolarHBondContact O-CG 3.32Å; F112-M116 PolarHBondContact O-N 2.9Å
113	R	90.1	Very high	88.3	Confident	55 Å²	55	66.8 Å²	66.8	21%	0.208	32%	0.323	C	S	.	.	H	α-helix	trans	-64.6	-44.5	173.1	-159.7	-175	-159.6	96.5	-1.1	112	L108 T109 Y111 E117 Y153 D156 D160	L108-R113 HydrophobicContact CB-CB 4.29Å; T109-R113 WeakPolarHBondContact O-CB 3.44Å; T109-R113 PolarHBondContact O-N 3.25Å; Y111-R113 PolarHBondContact O-N 3.37Å; R113-E117 PolarHBondContact O-N 3.07Å; R113-Y153 HydrophobicContact CB-CD1 4.43Å; R113-Y153 HydrophobicContact CG-CD1 4.38Å; R113-D156 IonicContact NE-OD2 3.71Å; R113-D160 IonicContact CZ-OD2 2.82Å; R113-D160 IonicContact NH1-OD2 2.75Å; R113-D160 PolarHBondContact NH1-OD2 3.06Å; R113-D160 IonicContact NH2-OD1 2.7Å; R113-D160 PolarHBondContact NH2-OD1 3.49Å; R113-D160 IonicContact NH2-OD2 3.27Å; R113-D160 PolarHBondContact NH2-OD2 3.37Å
114	F	92	Very high	88.5	Confident	10 Å²	10	73.2 Å²	73.2	4%	0.044	35%	0.351	C	S	.	.	H	α-helix	trans	-64.2	-46.5	172.2	166.7	-94.1	0	0	0	111.7	P110 Y111 M116 E117 K118 L138 K141 Y142 L145 Y153	P110-F114 PolarHBondContact O-N 2.8Å; Y111-F114 HydrophobicContact CD2-CD1 4.48Å; Y111-F114 WeakPolarHBondContact O-CB 3.34Å; Y111-F114 PolarHBondContact O-N 3.02Å; F114-M116 PolarHBondContact O-N 3.38Å; F114-E117 PolarHBondContact O-N 3.05Å; F114-E117 VanDerWaalsContact O-N 3.15Å; F114-K118 HydrophobicContact CD2-CG 3.81Å; F114-K118 HydrophobicContact CE1-CG 4.23Å; F114-K118 HydrophobicContact CE2-CD 4.19Å; F114-K118 HydrophobicContact CE2-CG 3.45Å; F114-K118 VanDerWaalsContact CE2-CG 3.45Å; F114-K118 HydrophobicContact CG-CG 4.35Å; F114-K118 HydrophobicContact CZ-CB 4.48Å; F114-K118 HydrophobicContact CZ-CG 3.69Å; F114-K118 WeakPolarHBondContact O-CG 3.28Å; F114-K118 PolarHBondContact O-N 3.1Å; F114-L138 HydrophobicContact CE1-CD2 4.11Å; F114-L138 HydrophobicContact CZ-CD2 4.43Å; F114-K141 HydrophobicContact CZ-CB 4.36Å; F114-Y142 HydrophobicContact CB-CD2 3.71Å; F114-Y142 HydrophobicContact CB-CE2 4Å; F114-Y142 AromaticContact CD1-CD2 3.66Å; F114-Y142 HydrophobicContact CD1-CD2 3.66Å; F114-Y142 HydrophobicContact CD1-CG 4.13Å; F114-Y142 HydrophobicContact CD2-CD2 4.31Å; F114-Y142 HydrophobicContact CE1-CD2 4.35Å; F114-Y142 AromaticContact CG-CD2 3.63Å; F114-Y142 HydrophobicContact CG-CD2 3.63Å; F114-Y142 HydrophobicContact CG-CE2 4.37Å; F114-L145 HydrophobicContact CD2-CD1 3.8Å; F114-L145 HydrophobicContact CE2-CD1 3.72Å; F114-L145 HydrophobicContact CE2-CG 4.44Å; F114-L145 HydrophobicContact CG-CD1 4.44Å; F114-L145 HydrophobicContact CZ-CD1 4.32Å; F114-Y153 HydrophobicContact CB-CD1 4.25Å; F114-Y153 HydrophobicContact CB-CE1 4.11Å; F114-Y153 HydrophobicContact CB-CE2 4.41Å; F114-Y153 HydrophobicContact CB-CG 4.47Å; F114-Y153 HydrophobicContact CD2-CE1 4.48Å; F114-Y153 HydrophobicContact CD2-CE2 4.12Å; F114-Y153 AromaticContact CD2-CZ 3.85Å
115	F	91.1	Very high	88.4	Confident	17 Å²	17	78.4 Å²	78.4	8%	0.075	38%	0.377	C	S	.	.	H	α-helix	trans	-55.4	-51.3	178.8	176	-110.7	0	0	0	110.7	Y111 F112 E117 K118 R119 T135 L138	Y111-F115 HydrophobicContact CE2-CB 4.24Å; Y111-F115 WeakPolarHBondContact O-CB 3.48Å; Y111-F115 PolarHBondContact O-N 3.35Å; F112-F115 HydrophobicContact CD1-CD1 4.27Å; F112-F115 PolarHBondContact O-N 3.41Å; F115-E117 PolarHBondContact O-N 3.11Å; F115-K118 PolarHBondContact O-N 2.91Å; F115-R119 WeakPolarHBondContact O-CA 3.39Å; F115-R119 WeakPolarHBondContact O-CB 3.36Å; F115-R119 PolarHBondContact O-N 3.43Å; F115-T135 HydrophobicContact CE2-CG2 3.93Å; F115-T135 HydrophobicContact CZ-CG2 4.17Å; F115-T135 WeakPolarHBondContact CZ-OG1 3.37Å; F115-L138 HydrophobicContact CD2-CB 3.86Å; F115-L138 HydrophobicContact CD2-CD1 3.56Å; F115-L138 HydrophobicContact CD2-CG 4.36Å; F115-L138 HydrophobicContact CE2-CB 4.37Å; F115-L138 HydrophobicContact CE2-CD1 3.76Å
116	M	87.5	Confident	88.1	Confident	93 Å²	93	73.4 Å²	73.4	46%	0.458	36%	0.356	S	S	.	.	H	α-helix	trans	-58.3	-42.4	175.6	-73.3	-67.8	107.5	0	0	113.1	L108 F112 F114 K118	L108-M116 HydrophobicContact CD1-CG 4.27Å; F112-M116 WeakPolarHBondContact O-CB 3.44Å; F112-M116 WeakPolarHBondContact O-CG 3.32Å; F112-M116 PolarHBondContact O-N 2.9Å; F114-M116 PolarHBondContact O-N 3.38Å; M116-K118 VanDerWaalsContact C-N 3.33Å; M116-K118 PolarHBondContact O-N 2.74Å
117	E	89.4	Confident	88.1	Confident	71 Å²	71	70.3 Å²	70.3	33%	0.332	35%	0.354	S	S	.	.	H	α-helix	trans	-71.2	-23.9	-177.9	-156	-119	104.1	0	0	113.9	R113 F114 F115 K121	R113-E117 PolarHBondContact O-N 3.07Å; F114-E117 PolarHBondContact O-N 3.05Å; F114-E117 VanDerWaalsContact O-N 3.15Å; F115-E117 PolarHBondContact O-N 3.11Å; E117-K121 PolarHBondContact O-NZ 2.91Å; E117-K121 IonicContact OE1-NZ 3.99Å; E117-K121 PolarHBondContact OE1-NZ 2.89Å
118	K	89.4	Confident	87.9	Confident	48 Å²	48	78.4 Å²	78.4	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-104.9	-32.1	-179.4	-54.8	-44.6	174.2	-163.9	0	114	F114 F115 M116 A120 K121 Y122 L138	F114-K118 HydrophobicContact CD2-CG 3.81Å; F114-K118 HydrophobicContact CE1-CG 4.23Å; F114-K118 HydrophobicContact CE2-CD 4.19Å; F114-K118 HydrophobicContact CE2-CG 3.45Å; F114-K118 VanDerWaalsContact CE2-CG 3.45Å; F114-K118 HydrophobicContact CG-CG 4.35Å; F114-K118 HydrophobicContact CZ-CB 4.48Å; F114-K118 HydrophobicContact CZ-CG 3.69Å; F114-K118 WeakPolarHBondContact O-CG 3.28Å; F114-K118 PolarHBondContact O-N 3.1Å; F115-K118 PolarHBondContact O-N 2.91Å; M116-K118 VanDerWaalsContact C-N 3.33Å; M116-K118 PolarHBondContact O-N 2.74Å; K118-A120 PolarHBondContact O-N 3.29Å; K118-K121 WeakPolarHBondContact O-CA 3.23Å; K118-K121 WeakPolarHBondContact O-CB 3.38Å; K118-K121 PolarHBondContact O-N 2.93Å; K118-Y122 HydrophobicContact CB-CD2 4.05Å; K118-Y122 HydrophobicContact CB-CE2 4.25Å; K118-Y122 PolarHBondContact O-N 3.13Å; K118-L138 HydrophobicContact CB-CD2 3.68Å
119	R	87.6	Confident	87.6	Confident	78 Å²	78	77.9 Å²	77.9	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-45.4	-55.3	179.7	172.9	-172.1	174.2	71.3	9.6	112.2	F115 K121 Y122 A123 N131 L134 L138	F115-R119 WeakPolarHBondContact O-CA 3.39Å; F115-R119 WeakPolarHBondContact O-CB 3.36Å; F115-R119 PolarHBondContact O-N 3.43Å; R119-K121 PolarHBondContact O-N 2.79Å; R119-K121 VanDerWaalsContact O-N 3.13Å; R119-Y122 PolarHBondContact O-N 3.29Å; R119-A123 VanDerWaalsContact O-CB 3.29Å; R119-A123 WeakPolarHBondContact O-CB 3.32Å; R119-A123 PolarHBondContact O-N 3.28Å; R119-N131 PolarHBondContact NH1-OD1 3.24Å; R119-N131 PolarHBondContact NH2-OD1 3.17Å; R119-L134 HydrophobicContact CG-CD2 4.15Å; R119-L138 HydrophobicContact CB-CD1 4.18Å
120	A	86.4	Confident	87.5	Confident	65 Å²	65	77.9 Å²	77.9	54%	0.537	39%	0.387	S	S	.	.	H	α-helix	trans	-66.2	-14.7	-177.2	0	0	0	0	0	114.3	K118 K124	K118-A120 PolarHBondContact O-N 3.29Å; A120-K124 WeakPolarHBondContact O-CG 3.04Å
121	K	87.1	Confident	87.1	Confident	112 Å²	112	81.4 Å²	81.4	49%	0.487	41%	0.405	S	S	.	.	H	α-helix	trans	-91.8	-48	175	-62.4	166.1	-174.5	161.6	0	110.2	E117 K118 R119 K124 L125	E117-K121 PolarHBondContact O-NZ 2.91Å; E117-K121 IonicContact OE1-NZ 3.99Å; E117-K121 PolarHBondContact OE1-NZ 2.89Å; K118-K121 WeakPolarHBondContact O-CA 3.23Å; K118-K121 WeakPolarHBondContact O-CB 3.38Å; K118-K121 PolarHBondContact O-N 2.93Å; R119-K121 PolarHBondContact O-N 2.79Å; R119-K121 VanDerWaalsContact O-N 3.13Å; K121-K124 PolarHBondContact O-N 3.42Å; K121-K124 VanDerWaalsContact O-N 3.15Å; K121-L125 WeakPolarHBondContact O-CG 3.42Å; K121-L125 PolarHBondContact O-N 3.22Å; K121-L125 VanDerWaalsContact O-N 3.09Å
122	Y	85.3	Confident	86.9	Confident	67 Å²	67	83.8 Å²	83.8	26%	0.263	42%	0.421	S	S	.	.	H	α-helix	trans	-66	-36.9	177.7	-84.2	-101.9	0	0	0	112.9	K118 R119 K124 L125 H126 L134 I137 L138	K118-Y122 HydrophobicContact CB-CD2 4.05Å; K118-Y122 HydrophobicContact CB-CE2 4.25Å; K118-Y122 PolarHBondContact O-N 3.13Å; R119-Y122 PolarHBondContact O-N 3.29Å; Y122-K124 PolarHBondContact O-N 2.99Å; Y122-L125 CarbonylContact O-C 3.6Å; Y122-L125 PolarHBondContact O-N 2.92Å; Y122-L125 VanDerWaalsContact O-N 3.1Å; Y122-H126 PolarHBondContact O-N 3.19Å; Y122-L134 HydrophobicContact CG-CD1 4.39Å; Y122-I137 HydrophobicContact CE1-CG2 4.42Å; Y122-L138 HydrophobicContact CD2-CD2 3.91Å; Y122-L138 HydrophobicContact CE2-CD2 4.1Å; Y122-L138 HydrophobicContact CG-CD2 4.2Å
123	A	87.5	Confident	86.8	Confident	41 Å²	41	82.3 Å²	82.3	34%	0.339	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-24.8	172.9	0	0	0	0	0	113.5	R119 P127 L134	R119-A123 VanDerWaalsContact O-CB 3.29Å; R119-A123 WeakPolarHBondContact O-CB 3.32Å; R119-A123 PolarHBondContact O-N 3.28Å; A123-P127 WeakPolarHBondContact O-CA 3.45Å; A123-L134 HydrophobicContact CB-CD2 3.89Å
124	K	87.9	Confident	86.6	Confident	177 Å²	177	80.3 Å²	80.3	77%	0.77	41%	0.41	S	S	*	.	H	α-helix	trans	-86.4	-24.1	173.3	-70.1	-175.1	177.2	-168.1	0	113.2	A120 K121 Y122	A120-K124 WeakPolarHBondContact O-CG 3.04Å; K121-K124 PolarHBondContact O-N 3.42Å; K121-K124 VanDerWaalsContact O-N 3.15Å; Y122-K124 PolarHBondContact O-N 2.99Å
125	L	85.4	Confident	86.4	Confident	122 Å²	122	81.2 Å²	81.2	64%	0.639	42%	0.417	S	S	*	.	H	α-helix	trans	-83.8	-22.7	174.7	-68.2	168.6	0	0	0	112.4	K121 Y122	K121-L125 WeakPolarHBondContact O-CG 3.42Å; K121-L125 PolarHBondContact O-N 3.22Å; K121-L125 VanDerWaalsContact O-N 3.09Å; Y122-L125 CarbonylContact O-C 3.6Å; Y122-L125 PolarHBondContact O-N 2.92Å; Y122-L125 VanDerWaalsContact O-N 3.1Å
126	H	80.3	Confident	86.4	Confident	81 Å²	81	82.8 Å²	82.8	38%	0.375	42%	0.424	S	S	.	.			trans	-135.2	68.9	178	-53.3	-74.7	0	0	0	111.2	Y122 E128 M129	Y122-H126 PolarHBondContact O-N 3.19Å; H126-E128 PolarHBondContact O-N 2.9Å; H126-M129 HydrophobicContact CB-CB 4.12Å; H126-M129 HydrophobicContact CB-CE 3.59Å; H126-M129 HydrophobicContact CB-CG 4.19Å; H126-M129 VanDerWaalsContact CG-CE 3.45Å; H126-M129 PolarHBondContact O-N 3.46Å
127	P	83.8	Confident	86.5	Confident	108 Å²	108	81 Å²	81	70%	0.701	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.9	-177.2	-21.5	34.9	0	0	0	114.2	A123	A123-P127 WeakPolarHBondContact O-CA 3.45Å
128	E	85.5	Confident	86.5	Confident	196 Å²	196	77.7 Å²	77.7	92%	0.916	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.5	-178.8	-60.4	178.9	137.3	0	0	113.8	H126	H126-E128 PolarHBondContact O-N 2.9Å
129	M	82.7	Confident	86.5	Confident	76 Å²	76	76.9 Å²	76.9	37%	0.374	40%	0.401	S	S	.	.	S	Bend	trans	-85.2	144.6	-179.9	-74.7	-152.6	-64.2	0	0	112	H126 I137	H126-M129 HydrophobicContact CB-CB 4.12Å; H126-M129 HydrophobicContact CB-CE 3.59Å; H126-M129 HydrophobicContact CB-CG 4.19Å; H126-M129 VanDerWaalsContact CG-CE 3.45Å; H126-M129 PolarHBondContact O-N 3.46Å; M129-I137 HydrophobicContact CE-CD1 3.47Å; M129-I137 VanDerWaalsContact CE-CD1 3.47Å; M129-I137 HydrophobicContact SD-CD1 4.13Å
130	S	88.5	Confident	86.6	Confident	53 Å²	53	79.3 Å²	79.3	37%	0.371	41%	0.413	S	S	.	.			trans	-69	161.4	-175	86.3	0	0	0	0	112.4	L132 D133 L134	S130-L132 PolarHBondContact O-N 2.65Å; S130-L132 PolarHBondContact OG-N 2.92Å; S130-D133 WeakPolarHBondContact CB-OD2 3.33Å; S130-D133 PolarHBondContact N-OD2 3.42Å; S130-D133 PolarHBondContact O-N 3.38Å; S130-D133 PolarHBondContact OG-N 3.14Å; S130-D133 PolarHBondContact OG-OD2 3Å; S130-L134 WeakPolarHBondContact O-CB 3.32Å; S130-L134 PolarHBondContact O-N 2.69Å
131	N	82.7	Confident	86.8	Confident	96 Å²	96	80.2 Å²	80.2	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-26.9	174	-170.5	62.6	0	0	0	113.1	R119 T135	R119-N131 PolarHBondContact NH1-OD1 3.24Å; R119-N131 PolarHBondContact NH2-OD1 3.17Å; N131-T135 PolarHBondContact O-N 3.31Å; N131-T135 PolarHBondContact O-OG1 3.18Å
132	L	85.3	Confident	86.9	Confident	96 Å²	96	76.7 Å²	76.7	50%	0.503	39%	0.389	S	S	.	.	H	α-helix	trans	-75.2	-51.6	177.8	-163.2	78.8	0	0	0	110.4	S130 L134 T135 K136	S130-L132 PolarHBondContact O-N 2.65Å; S130-L132 PolarHBondContact OG-N 2.92Å; L132-L134 VanDerWaalsContact C-N 3.31Å; L132-L134 PolarHBondContact O-N 2.91Å; L132-T135 CarbonylContact O-C 3.54Å; L132-T135 WeakPolarHBondContact O-CA 3.24Å; L132-T135 WeakPolarHBondContact O-CB 3.38Å; L132-T135 PolarHBondContact O-N 3.4Å; L132-K136 PolarHBondContact O-N 2.91Å
133	D	87.4	Confident	87.1	Confident	67 Å²	67	82.5 Å²	82.5	36%	0.358	41%	0.41	S	S	.	.	H	α-helix	trans	-60.1	-42.8	-179.5	-51.8	-51.8	0	0	0	111.4	S130 T135 K136 I137	S130-D133 WeakPolarHBondContact CB-OD2 3.33Å; S130-D133 PolarHBondContact N-OD2 3.42Å; S130-D133 PolarHBondContact O-N 3.38Å; S130-D133 PolarHBondContact OG-N 3.14Å; S130-D133 PolarHBondContact OG-OD2 3Å; D133-T135 PolarHBondContact O-N 3.44Å; D133-K136 PolarHBondContact O-N 3.28Å; D133-I137 WeakPolarHBondContact O-CB 3.42Å; D133-I137 VanDerWaalsContact O-CG1 3.25Å; D133-I137 WeakPolarHBondContact O-CG1 3.41Å; D133-I137 PolarHBondContact O-N 2.91Å
134	L	86.4	Confident	87.3	Confident	12 Å²	12	85.2 Å²	85.2	6%	0.063	42%	0.416	C	S	.	.	H	α-helix	trans	-55.1	-37.2	172.2	175.6	58.9	0	0	0	112.2	R119 Y122 A123 S130 L132 L138	R119-L134 HydrophobicContact CG-CD2 4.15Å; Y122-L134 HydrophobicContact CG-CD1 4.39Å; A123-L134 HydrophobicContact CB-CD2 3.89Å; S130-L134 WeakPolarHBondContact O-CB 3.32Å; S130-L134 PolarHBondContact O-N 2.69Å; L132-L134 VanDerWaalsContact C-N 3.31Å; L132-L134 PolarHBondContact O-N 2.91Å; L134-L138 HydrophobicContact CD1-CD1 3.79Å; L134-L138 HydrophobicContact CD1-CG 4.28Å; L134-L138 HydrophobicContact CG-CD1 4.14Å; L134-L138 WeakPolarHBondContact O-CB 3.29Å; L134-L138 VanDerWaalsContact O-CG 3.22Å; L134-L138 WeakPolarHBondContact O-CG 3.4Å; L134-L138 PolarHBondContact O-N 3.48Å
135	T	87.9	Confident	87.4	Confident	29 Å²	29	78.1 Å²	78.1	18%	0.178	39%	0.387	C	S	.	.	H	α-helix	trans	-76.8	-43.2	179.8	-55.2	0	0	0	0	111.4	F115 N131 L132 D133 I137 L138 S139	F115-T135 HydrophobicContact CE2-CG2 3.93Å; F115-T135 HydrophobicContact CZ-CG2 4.17Å; F115-T135 WeakPolarHBondContact CZ-OG1 3.37Å; N131-T135 PolarHBondContact O-N 3.31Å; N131-T135 PolarHBondContact O-OG1 3.18Å; L132-T135 CarbonylContact O-C 3.54Å; L132-T135 WeakPolarHBondContact O-CA 3.24Å; L132-T135 WeakPolarHBondContact O-CB 3.38Å; L132-T135 PolarHBondContact O-N 3.4Å; D133-T135 PolarHBondContact O-N 3.44Å; T135-I137 VanDerWaalsContact C-N 3.34Å; T135-I137 PolarHBondContact O-N 2.87Å; T135-L138 PolarHBondContact O-N 3.06Å; T135-S139 PolarHBondContact O-N 2.92Å
136	K	91.3	Very high	87.8	Confident	50 Å²	50	76 Å²	76	22%	0.217	38%	0.38	C	S	.	.	H	α-helix	trans	-60.5	-40.6	173.2	-63.5	-169.3	179.4	-143.8	0	112.2	L132 D133 S139 K140 D713	L132-K136 PolarHBondContact O-N 2.91Å; D133-K136 PolarHBondContact O-N 3.28Å; K136-S139 PolarHBondContact O-OG 2.72Å; K136-S139 VanDerWaalsContact O-OG 3.14Å; K136-K140 WeakPolarHBondContact O-CB 3.39Å; K136-K140 PolarHBondContact O-N 3.31Å; K136-K140 VanDerWaalsContact O-N 3.14Å; K136-D713 WeakPolarHBondContact CD-OD2 3.35Å; K136-D713 WeakPolarHBondContact CE-OD2 3.14Å; K136-D713 IonicContact NZ-OD1 3.22Å; K136-D713 PolarHBondContact NZ-OD1 2.86Å; K136-D713 IonicContact NZ-OD2 3.84Å; K136-D713 PolarHBondContact NZ-OD2 2.67Å
137	I	87.8	Confident	88.1	Confident	57 Å²	57	77.6 Å²	77.6	29%	0.292	39%	0.391	S	S	.	.	H	α-helix	trans	-65.5	-43.7	175	-70.5	167.6	0	0	0	111.2	Y122 M129 D133 T135 K140 K141	Y122-I137 HydrophobicContact CE1-CG2 4.42Å; M129-I137 HydrophobicContact CE-CD1 3.47Å; M129-I137 VanDerWaalsContact CE-CD1 3.47Å; M129-I137 HydrophobicContact SD-CD1 4.13Å; D133-I137 WeakPolarHBondContact O-CB 3.42Å; D133-I137 VanDerWaalsContact O-CG1 3.25Å; D133-I137 WeakPolarHBondContact O-CG1 3.41Å; D133-I137 PolarHBondContact O-N 2.91Å; T135-I137 VanDerWaalsContact C-N 3.34Å; T135-I137 PolarHBondContact O-N 2.87Å; I137-K140 PolarHBondContact O-N 3.21Å; I137-K141 HydrophobicContact CG2-CG 4.37Å; I137-K141 WeakPolarHBondContact O-CB 3.23Å; I137-K141 VanDerWaalsContact O-CG 3.26Å; I137-K141 WeakPolarHBondContact O-CG 3.46Å; I137-K141 PolarHBondContact O-N 3.29Å
138	L	89.8	Confident	88.4	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-72.1	-33.3	-179.7	-73.6	171.9	0	0	0	113	F114 F115 K118 R119 Y122 L134 T135 K141 Y142	F114-L138 HydrophobicContact CE1-CD2 4.11Å; F114-L138 HydrophobicContact CZ-CD2 4.43Å; F115-L138 HydrophobicContact CD2-CB 3.86Å; F115-L138 HydrophobicContact CD2-CD1 3.56Å; F115-L138 HydrophobicContact CD2-CG 4.36Å; F115-L138 HydrophobicContact CE2-CB 4.37Å; F115-L138 HydrophobicContact CE2-CD1 3.76Å; K118-L138 HydrophobicContact CB-CD2 3.68Å; R119-L138 HydrophobicContact CB-CD1 4.18Å; Y122-L138 HydrophobicContact CD2-CD2 3.91Å; Y122-L138 HydrophobicContact CE2-CD2 4.1Å; Y122-L138 HydrophobicContact CG-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CD1 3.79Å; L134-L138 HydrophobicContact CD1-CG 4.28Å; L134-L138 HydrophobicContact CG-CD1 4.14Å; L134-L138 WeakPolarHBondContact O-CB 3.29Å; L134-L138 VanDerWaalsContact O-CG 3.22Å; L134-L138 WeakPolarHBondContact O-CG 3.4Å; L134-L138 PolarHBondContact O-N 3.48Å; T135-L138 PolarHBondContact O-N 3.06Å; L138-K141 PolarHBondContact O-N 3.36Å; L138-Y142 WeakPolarHBondContact O-CB 3.47Å; L138-Y142 PolarHBondContact O-N 3.15Å
139	S	89.6	Confident	88.5	Confident	32 Å²	32	78.8 Å²	78.8	22%	0.224	38%	0.382	C	S	.	.	H	α-helix	trans	-65.5	-43.3	173.2	84	0	0	0	0	111.1	Y111 T135 K136 Y142 R143	Y111-S139 WeakPolarHBondContact OH-CB 3.2Å; Y111-S139 PolarHBondContact OH-N 2.97Å; T135-S139 PolarHBondContact O-N 2.92Å; K136-S139 PolarHBondContact O-OG 2.72Å; K136-S139 VanDerWaalsContact O-OG 3.14Å; S139-Y142 PolarHBondContact O-N 2.89Å; S139-R143 PolarHBondContact O-N 2.89Å
140	K	90.8	Very high	88.9	Confident	128 Å²	128	77.2 Å²	77.2	56%	0.557	37%	0.374	S	S	*	.	H	α-helix	trans	-61.2	-48.1	172.4	-176.1	169.4	-178.3	173.3	0	111.7	K136 I137 Y142 R143 E144	K136-K140 WeakPolarHBondContact O-CB 3.39Å; K136-K140 PolarHBondContact O-N 3.31Å; K136-K140 VanDerWaalsContact O-N 3.14Å; I137-K140 PolarHBondContact O-N 3.21Å; K140-Y142 VanDerWaalsContact C-N 3.31Å; K140-Y142 PolarHBondContact O-N 3.23Å; K140-R143 VanDerWaalsContact O-CB 3.32Å; K140-R143 WeakPolarHBondContact O-CB 3.39Å; K140-R143 PolarHBondContact O-N 2.86Å; K140-R143 VanDerWaalsContact O-N 3.14Å; K140-E144 WeakPolarHBondContact CE-OE1 3.38Å; K140-E144 WeakPolarHBondContact CG-OE1 3.14Å; K140-E144 WeakPolarHBondContact O-CG 3.28Å; K140-E144 PolarHBondContact O-N 3.32Å
141	K	89.2	Confident	89	Confident	84 Å²	84	80.5 Å²	80.5	37%	0.365	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-31.2	178.2	-71.3	-71	159.3	-147.2	0	113.4	F114 I137 L138 E144 L145	F114-K141 HydrophobicContact CZ-CB 4.36Å; I137-K141 HydrophobicContact CG2-CG 4.37Å; I137-K141 WeakPolarHBondContact O-CB 3.23Å; I137-K141 VanDerWaalsContact O-CG 3.26Å; I137-K141 WeakPolarHBondContact O-CG 3.46Å; I137-K141 PolarHBondContact O-N 3.29Å; L138-K141 PolarHBondContact O-N 3.36Å; K141-E144 WeakPolarHBondContact CD-OE2 3.14Å; K141-E144 WeakPolarHBondContact CE-OE2 3.05Å; K141-E144 IonicContact NZ-OE1 3.96Å; K141-E144 IonicContact NZ-OE2 2.8Å; K141-E144 PolarHBondContact NZ-OE2 2.95Å; K141-L145 PolarHBondContact O-N 3.33Å
142	Y	90.5	Very high	89.5	Confident	39 Å²	39	81.1 Å²	81.1	15%	0.153	38%	0.379	C	S	.	.	H	α-helix	trans	-69.4	-42.1	172.1	-176.1	-103.8	0	0	0	112	P110 Y111 F114 L138 S139 K140 E144 L145 K150	P110-Y142 WeakPolarHBondContact CB-OH 3.49Å; Y111-Y142 AromaticContact CD2-CD1 3.71Å; Y111-Y142 HydrophobicContact CD2-CD1 3.71Å; Y111-Y142 HydrophobicContact CD2-CD2 4.16Å; Y111-Y142 HydrophobicContact CD2-CE1 4.43Å; Y111-Y142 AromaticContact CD2-CG 3.57Å; Y111-Y142 HydrophobicContact CD2-CG 3.57Å; Y111-Y142 HydrophobicContact CE2-CG 4.35Å; Y111-Y142 HydrophobicContact CG-CD1 4.18Å; Y111-Y142 HydrophobicContact CG-CG 4.42Å; F114-Y142 HydrophobicContact CB-CD2 3.71Å; F114-Y142 HydrophobicContact CB-CE2 4Å; F114-Y142 AromaticContact CD1-CD2 3.66Å; F114-Y142 HydrophobicContact CD1-CD2 3.66Å; F114-Y142 HydrophobicContact CD1-CG 4.13Å; F114-Y142 HydrophobicContact CD2-CD2 4.31Å; F114-Y142 HydrophobicContact CE1-CD2 4.35Å; F114-Y142 AromaticContact CG-CD2 3.63Å; F114-Y142 HydrophobicContact CG-CD2 3.63Å; F114-Y142 HydrophobicContact CG-CE2 4.37Å; L138-Y142 WeakPolarHBondContact O-CB 3.47Å; L138-Y142 PolarHBondContact O-N 3.15Å; S139-Y142 PolarHBondContact O-N 2.89Å; K140-Y142 VanDerWaalsContact C-N 3.31Å; K140-Y142 PolarHBondContact O-N 3.23Å; Y142-E144 VanDerWaalsContact C-N 3.31Å; Y142-E144 PolarHBondContact O-N 3.11Å; Y142-L145 HydrophobicContact CD2-CD1 3.81Å; Y142-L145 HydrophobicContact CE2-CD1 4.27Å; Y142-L145 WeakPolarHBondContact O-CB 3.47Å; Y142-L145 PolarHBondContact O-N 3.39Å; Y142-L145 VanDerWaalsContact O-N 3.13Å; Y142-K150 HydrophobicContact CE2-CG 4.5Å; Y142-K150 WeakPolarHBondContact O-CE 3.23Å
143	R	89.8	Confident	89.8	Confident	188 Å²	188	77.4 Å²	77.4	71%	0.709	36%	0.358	S	S	*	.	H	α-helix	trans	-57.1	-45.7	175.4	-147	178.6	-55.7	-152.6	3.5	111.2	S139 K140 L145 K150	S139-R143 PolarHBondContact O-N 2.89Å; K140-R143 VanDerWaalsContact O-CB 3.32Å; K140-R143 WeakPolarHBondContact O-CB 3.39Å; K140-R143 PolarHBondContact O-N 2.86Å; K140-R143 VanDerWaalsContact O-N 3.14Å; R143-L145 VanDerWaalsContact C-N 3.28Å; R143-L145 PolarHBondContact O-N 2.95Å; R143-K150 WeakPolarHBondContact O-CE 3.45Å; R143-K150 PolarHBondContact O-NZ 2.57Å
144	E	91.3	Very high	89.8	Confident	98 Å²	98	76.8 Å²	76.8	46%	0.458	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.5	177.1	-69.1	171.3	-175.7	0	0	115	K140 K141 Y142	K140-E144 WeakPolarHBondContact CE-OE1 3.38Å; K140-E144 WeakPolarHBondContact CG-OE1 3.14Å; K140-E144 WeakPolarHBondContact O-CG 3.28Å; K140-E144 PolarHBondContact O-N 3.32Å; K141-E144 WeakPolarHBondContact CD-OE2 3.14Å; K141-E144 WeakPolarHBondContact CE-OE2 3.05Å; K141-E144 IonicContact NZ-OE1 3.96Å; K141-E144 IonicContact NZ-OE2 2.8Å; K141-E144 PolarHBondContact NZ-OE2 2.95Å; Y142-E144 VanDerWaalsContact C-N 3.31Å; Y142-E144 PolarHBondContact O-N 3.11Å
145	L	90.3	Very high	90	Very high	29 Å²	29	79.5 Å²	79.5	15%	0.152	37%	0.372	C	S	.	.	S	Bend	trans	-66.9	135.5	179.5	-81.4	174.1	0	0	0	112	F114 K141 Y142 R143 K149 K150 Y153	F114-L145 HydrophobicContact CD2-CD1 3.8Å; F114-L145 HydrophobicContact CE2-CD1 3.72Å; F114-L145 HydrophobicContact CE2-CG 4.44Å; F114-L145 HydrophobicContact CG-CD1 4.44Å; F114-L145 HydrophobicContact CZ-CD1 4.32Å; K141-L145 PolarHBondContact O-N 3.33Å; Y142-L145 HydrophobicContact CD2-CD1 3.81Å; Y142-L145 HydrophobicContact CE2-CD1 4.27Å; Y142-L145 WeakPolarHBondContact O-CB 3.47Å; Y142-L145 PolarHBondContact O-N 3.39Å; Y142-L145 VanDerWaalsContact O-N 3.13Å; R143-L145 VanDerWaalsContact C-N 3.28Å; R143-L145 PolarHBondContact O-N 2.95Å; L145-K149 HydrophobicContact CD2-CB 4.17Å; L145-K149 HydrophobicContact CD2-CD 4.09Å; L145-K150 HydrophobicContact CB-CD 4.49Å; L145-K150 HydrophobicContact CB-CG 3.75Å; L145-K150 WeakPolarHBondContact O-CE 3.4Å; L145-K150 PolarHBondContact O-NZ 2.88Å; L145-Y153 HydrophobicContact CD1-CE2 4.22Å
146	P	92.6	Very high	90.1	Very high	77 Å²	77	79.5 Å²	79.5	50%	0.5	37%	0.371	S	S	.	.			trans	-58.1	143.4	167.1	-24.7	33.9	0	0	0	111.8	K148 K149 K150	P146-K148 PolarHBondContact O-N 3.29Å; P146-K148 VanDerWaalsContact O-N 3.15Å; P146-K149 WeakPolarHBondContact O-CA 3.49Å; P146-K149 WeakPolarHBondContact O-CB 3.44Å; P146-K149 PolarHBondContact O-N 3.42Å; P146-K150 PolarHBondContact O-N 2.69Å; P146-K150 VanDerWaalsContact O-N 3.09Å
147	D	87.1	Confident	90.1	Very high	114 Å²	114	79.3 Å²	79.3	61%	0.61	37%	0.37	S	S	*	.	H	α-helix	trans	-66.1	-26	-170.7	-50.1	-52.6	0	0	0	113.1	K149 K150 K151	D147-K149 PolarHBondContact O-N 3.41Å; D147-K150 PolarHBondContact O-N 2.73Å; D147-K150 IonicContact OD1-NZ 3.73Å; D147-K150 PolarHBondContact OD1-NZ 2.95Å; D147-K151 VanDerWaalsContact O-CB 3.27Å; D147-K151 WeakPolarHBondContact O-CB 3.41Å; D147-K151 PolarHBondContact O-N 3.18Å
148	K	89.3	Confident	90.1	Very high	199 Å²	199	81 Å²	81	87%	0.865	38%	0.379	S	S	*	.	H	α-helix	trans	-58.7	-30.3	168.6	-66.8	-176.5	179.1	179.4	0	113.1	P146	P146-K148 PolarHBondContact O-N 3.29Å; P146-K148 VanDerWaalsContact O-N 3.15Å
149	K	89	Confident	90.2	Very high	130 Å²	130	88.5 Å²	88.5	57%	0.565	41%	0.407	S	S	*	.	H	α-helix	trans	-87.1	-37.8	174.6	-66.5	-175.9	-179.9	176	0	111.9	L145 P146 D147 K151 K152 Y153	L145-K149 HydrophobicContact CD2-CB 4.17Å; L145-K149 HydrophobicContact CD2-CD 4.09Å; P146-K149 WeakPolarHBondContact O-CA 3.49Å; P146-K149 WeakPolarHBondContact O-CB 3.44Å; P146-K149 PolarHBondContact O-N 3.42Å; D147-K149 PolarHBondContact O-N 3.41Å; K149-K151 VanDerWaalsContact C-N 3.34Å; K149-K152 PolarHBondContact O-N 3.05Å; K149-Y153 VanDerWaalsContact O-CD2 3.25Å; K149-Y153 WeakPolarHBondContact O-CD2 3.44Å; K149-Y153 WeakPolarHBondContact O-CE2 3.26Å
150	K	90.2	Very high	90.2	Very high	44 Å²	44	89.3 Å²	89.3	19%	0.191	41%	0.409	C	S	.	.	H	α-helix	trans	-59.7	-44.4	172.4	-66.8	177.4	177.7	132.7	0	111.3	Y142 R143 L145 P146 D147 K152 Y153 V154	Y142-K150 HydrophobicContact CE2-CG 4.5Å; Y142-K150 WeakPolarHBondContact O-CE 3.23Å; R143-K150 WeakPolarHBondContact O-CE 3.45Å; R143-K150 PolarHBondContact O-NZ 2.57Å; L145-K150 HydrophobicContact CB-CD 4.49Å; L145-K150 HydrophobicContact CB-CG 3.75Å; L145-K150 WeakPolarHBondContact O-CE 3.4Å; L145-K150 PolarHBondContact O-NZ 2.88Å; P146-K150 PolarHBondContact O-N 2.69Å; P146-K150 VanDerWaalsContact O-N 3.09Å; D147-K150 PolarHBondContact O-N 2.73Å; D147-K150 IonicContact OD1-NZ 3.73Å; D147-K150 PolarHBondContact OD1-NZ 2.95Å; K150-K152 PolarHBondContact O-N 2.81Å; K150-K152 VanDerWaalsContact O-N 3.14Å; K150-Y153 PolarHBondContact O-N 3.44Å; K150-V154 PolarHBondContact O-N 2.93Å
151	K	90.8	Very high	90	Very high	122 Å²	122	88.4 Å²	88.4	53%	0.53	41%	0.405	S	S	.	.	H	α-helix	trans	-51.8	-38.6	-179.6	178.2	166.9	178.4	172.5	0	112.9	D147 K149 Y153 V154 D155	D147-K151 VanDerWaalsContact O-CB 3.27Å; D147-K151 WeakPolarHBondContact O-CB 3.41Å; D147-K151 PolarHBondContact O-N 3.18Å; K149-K151 VanDerWaalsContact C-N 3.34Å; K151-Y153 VanDerWaalsContact C-N 3.33Å; K151-Y153 PolarHBondContact O-N 3.37Å; K151-V154 CarbonylContact O-C 3.59Å; K151-V154 WeakPolarHBondContact O-CA 3.24Å; K151-V154 WeakPolarHBondContact O-CB 3.4Å; K151-V154 PolarHBondContact O-N 3.39Å; K151-D155 VanDerWaalsContact CE-OD1 3.25Å; K151-D155 WeakPolarHBondContact CE-OD1 3.32Å; K151-D155 WeakPolarHBondContact CE-OD2 2.92Å; K151-D155 WeakPolarHBondContact CG-OD2 3.36Å; K151-D155 PolarHBondContact O-N 3.23Å
152	K	93.3	Very high	89.9	Confident	108 Å²	108	90.2 Å²	90.2	47%	0.47	42%	0.415	S	S	.	.	H	α-helix	trans	-55.2	-46.5	175.6	-170.7	-118.7	172	-151.6	0	112.3	K149 K150 V154 D156	K149-K152 PolarHBondContact O-N 3.05Å; K150-K152 PolarHBondContact O-N 2.81Å; K150-K152 VanDerWaalsContact O-N 3.14Å; K152-V154 VanDerWaalsContact C-N 3.32Å; K152-V154 PolarHBondContact O-N 3.25Å; K152-D156 WeakPolarHBondContact CE-OD2 3.36Å; K152-D156 IonicContact NZ-OD2 2.67Å; K152-D156 PolarHBondContact NZ-OD2 2.91Å; K152-D156 VanDerWaalsContact O-CB 3.28Å; K152-D156 WeakPolarHBondContact O-CB 3.3Å; K152-D156 PolarHBondContact O-N 3.34Å
153	Y	91.6	Very high	89.8	Confident	18 Å²	18	91.4 Å²	91.4	7%	0.071	43%	0.427	C	S	.	.	H	α-helix	trans	-73	-24	178.1	-50.6	-83.6	0	0	0	112.8	R113 F114 L145 K149 K150 K151 F157	R113-Y153 HydrophobicContact CB-CD1 4.43Å; R113-Y153 HydrophobicContact CG-CD1 4.38Å; F114-Y153 HydrophobicContact CB-CD1 4.25Å; F114-Y153 HydrophobicContact CB-CE1 4.11Å; F114-Y153 HydrophobicContact CB-CE2 4.41Å; F114-Y153 HydrophobicContact CB-CG 4.47Å; F114-Y153 HydrophobicContact CD2-CE1 4.48Å; F114-Y153 HydrophobicContact CD2-CE2 4.12Å; F114-Y153 AromaticContact CD2-CZ 3.85Å; L145-Y153 HydrophobicContact CD1-CE2 4.22Å; K149-Y153 VanDerWaalsContact O-CD2 3.25Å; K149-Y153 WeakPolarHBondContact O-CD2 3.44Å; K149-Y153 WeakPolarHBondContact O-CE2 3.26Å; K150-Y153 PolarHBondContact O-N 3.44Å; K151-Y153 VanDerWaalsContact C-N 3.33Å; K151-Y153 PolarHBondContact O-N 3.37Å; Y153-F157 VanDerWaalsContact O-CB 3.26Å; Y153-F157 WeakPolarHBondContact O-CB 3.32Å; Y153-F157 PolarHBondContact O-N 2.83Å
154	V	87.9	Confident	89.7	Confident	54 Å²	54	84.9 Å²	84.9	33%	0.327	40%	0.403	S	S	.	.	H	α-helix	trans	-72.2	-49.7	171.8	179.1	0	0	0	0	111	P110 K150 K151 K152 D156 F157 L158	P110-V154 HydrophobicContact CB-CG2 4.04Å; P110-V154 HydrophobicContact CG-CB 4.41Å; P110-V154 HydrophobicContact CG-CG2 3.93Å; K150-V154 PolarHBondContact O-N 2.93Å; K151-V154 CarbonylContact O-C 3.59Å; K151-V154 WeakPolarHBondContact O-CA 3.24Å; K151-V154 WeakPolarHBondContact O-CB 3.4Å; K151-V154 PolarHBondContact O-N 3.39Å; K152-V154 VanDerWaalsContact C-N 3.32Å; K152-V154 PolarHBondContact O-N 3.25Å; V154-D156 VanDerWaalsContact C-N 3.34Å; V154-D156 PolarHBondContact O-N 2.86Å; V154-F157 PolarHBondContact O-N 3Å; V154-L158 HydrophobicContact CG1-CD1 4.23Å; V154-L158 WeakPolarHBondContact O-CG 3.4Å; V154-L158 PolarHBondContact O-N 3.27Å
155	D	90.5	Very high	89.3	Confident	70 Å²	70	83.3 Å²	83.3	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-40.4	177.6	-63.3	-15	0	0	0	110.8	K151 L158 R159	K151-D155 VanDerWaalsContact CE-OD1 3.25Å; K151-D155 WeakPolarHBondContact CE-OD1 3.32Å; K151-D155 WeakPolarHBondContact CE-OD2 2.92Å; K151-D155 WeakPolarHBondContact CG-OD2 3.36Å; K151-D155 PolarHBondContact O-N 3.23Å; D155-L158 PolarHBondContact O-N 3.08Å; D155-R159 PolarHBondContact O-N 3.32Å; D155-R159 VanDerWaalsContact O-N 3.14Å
156	D	90.1	Very high	89.1	Confident	28 Å²	28	87 Å²	87	15%	0.15	42%	0.417	C	S	.	.	H	α-helix	trans	-61.4	-42.2	172.2	-72.1	-18.4	0	0	0	111.5	R113 K152 V154 D160	R113-D156 IonicContact NE-OD2 3.71Å; K152-D156 WeakPolarHBondContact CE-OD2 3.36Å; K152-D156 IonicContact NZ-OD2 2.67Å; K152-D156 PolarHBondContact NZ-OD2 2.91Å; K152-D156 VanDerWaalsContact O-CB 3.28Å; K152-D156 WeakPolarHBondContact O-CB 3.3Å; K152-D156 PolarHBondContact O-N 3.34Å; V154-D156 VanDerWaalsContact C-N 3.34Å; V154-D156 PolarHBondContact O-N 2.86Å; D156-D160 PolarHBondContact O-N 2.99Å; D156-D160 VanDerWaalsContact O-N 3.08Å
157	F	91.4	Very high	88.9	Confident	47 Å²	47	86.1 Å²	86.1	21%	0.206	41%	0.412	C	S	.	.	H	α-helix	trans	-67.5	-39.2	176.8	166.7	-110.6	0	0	0	112.9	P107 L108 P110 Y153 V154 R159 D160 K161	P107-F157 HydrophobicContact CB-CD2 4.14Å; P107-F157 HydrophobicContact CB-CE2 4.22Å; P107-F157 HydrophobicContact CG-CD2 4.29Å; P107-F157 HydrophobicContact CG-CE2 3.9Å; L108-F157 VanDerWaalsContact O-CD2 3.24Å; L108-F157 WeakPolarHBondContact O-CD2 3.49Å; P110-F157 HydrophobicContact CG-CB 3.87Å; P110-F157 HydrophobicContact CG-CD1 4.05Å; P110-F157 HydrophobicContact CG-CG 4.08Å; Y153-F157 VanDerWaalsContact O-CB 3.26Å; Y153-F157 WeakPolarHBondContact O-CB 3.32Å; Y153-F157 PolarHBondContact O-N 2.83Å; V154-F157 PolarHBondContact O-N 3Å; F157-R159 VanDerWaalsContact C-N 3.33Å; F157-R159 PolarHBondContact O-N 3.44Å; F157-D160 PolarHBondContact O-N 3.13Å; F157-K161 VanDerWaalsContact O-CB 3.24Å; F157-K161 WeakPolarHBondContact O-CB 3.42Å; F157-K161 PolarHBondContact O-N 3.43Å
158	L	87.1	Confident	88.7	Confident	93 Å²	93	81.8 Å²	81.8	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-39.9	177.1	-71.8	172.3	0	0	0	111.4	V154 D155 K161 E162	V154-L158 HydrophobicContact CG1-CD1 4.23Å; V154-L158 WeakPolarHBondContact O-CG 3.4Å; V154-L158 PolarHBondContact O-N 3.27Å; D155-L158 PolarHBondContact O-N 3.08Å; L158-K161 PolarHBondContact O-N 2.96Å; L158-E162 PolarHBondContact O-N 3.29Å
159	R	92.1	Very high	88.4	Confident	157 Å²	157	77.5 Å²	77.5	59%	0.592	37%	0.373	S	S	*	.	H	α-helix	trans	-64	-48.3	174	-171.5	-174.9	-55.7	171.6	7.9	112.1	D155 F157 K161 E162 T163	D155-R159 PolarHBondContact O-N 3.32Å; D155-R159 VanDerWaalsContact O-N 3.14Å; F157-R159 VanDerWaalsContact C-N 3.33Å; F157-R159 PolarHBondContact O-N 3.44Å; R159-K161 PolarHBondContact O-N 3.1Å; R159-E162 WeakPolarHBondContact O-CB 3.38Å; R159-E162 PolarHBondContact O-N 3.02Å; R159-E162 VanDerWaalsContact O-N 3.12Å; R159-T163 PolarHBondContact O-N 3.09Å; R159-T163 PolarHBondContact O-OG1 3.18Å
160	D	89.8	Confident	88.3	Confident	49 Å²	49	77 Å²	77	26%	0.262	37%	0.371	S	S	.	.	H	α-helix	trans	-67.5	-25.5	179	-73.5	15.7	0	0	0	112.2	P107 R113 D156 F157 T163 F164	P107-D160 HydrophobicContact CB-CB 3.78Å; R113-D160 IonicContact CZ-OD2 2.82Å; R113-D160 IonicContact NH1-OD2 2.75Å; R113-D160 PolarHBondContact NH1-OD2 3.06Å; R113-D160 IonicContact NH2-OD1 2.7Å; R113-D160 PolarHBondContact NH2-OD1 3.49Å; R113-D160 IonicContact NH2-OD2 3.27Å; R113-D160 PolarHBondContact NH2-OD2 3.37Å; D156-D160 PolarHBondContact O-N 2.99Å; D156-D160 VanDerWaalsContact O-N 3.08Å; F157-D160 PolarHBondContact O-N 3.13Å; D160-T163 WeakPolarHBondContact CA-OG1 3.47Å; D160-T163 PolarHBondContact O-OG1 3.37Å; D160-F164 WeakPolarHBondContact O-CB 3.48Å; D160-F164 PolarHBondContact O-N 3.23Å
161	K	85.3	Confident	88.1	Confident	109 Å²	109	75 Å²	75	47%	0.474	36%	0.363	S	S	.	.	H	α-helix	trans	-71	-37.8	170.8	-178.3	179.7	176.8	-179.8	0	112.1	P107 F157 L158 R159 V165	P107-K161 HydrophobicContact CG-CB 4.11Å; F157-K161 VanDerWaalsContact O-CB 3.24Å; F157-K161 WeakPolarHBondContact O-CB 3.42Å; F157-K161 PolarHBondContact O-N 3.43Å; L158-K161 PolarHBondContact O-N 2.96Å; R159-K161 PolarHBondContact O-N 3.1Å; K161-V165 WeakPolarHBondContact O-CG2 3.14Å; K161-V165 PolarHBondContact O-N 3.44Å
162	E	87.7	Confident	87.6	Confident	121 Å²	121	75.8 Å²	75.8	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-66.4	-47.9	173.7	-177.5	173.3	-158.5	0	0	111.4	L158 R159 F164 V165 Q166	L158-E162 PolarHBondContact O-N 3.29Å; R159-E162 WeakPolarHBondContact O-CB 3.38Å; R159-E162 PolarHBondContact O-N 3.02Å; R159-E162 VanDerWaalsContact O-N 3.12Å; E162-F164 PolarHBondContact O-N 2.92Å; E162-V165 PolarHBondContact O-N 2.87Å; E162-V165 VanDerWaalsContact O-N 3.16Å; E162-Q166 WeakPolarHBondContact O-CG 3.5Å; E162-Q166 PolarHBondContact O-N 2.83Å
163	T	89.2	Confident	87.1	Confident	65 Å²	65	77.9 Å²	77.9	40%	0.399	37%	0.373	S	S	.	.	H	α-helix	trans	-65.8	-37.2	176.5	59.8	0	0	0	0	112	R159 D160 V165 Q166 S167	R159-T163 PolarHBondContact O-N 3.09Å; R159-T163 PolarHBondContact O-OG1 3.18Å; D160-T163 WeakPolarHBondContact CA-OG1 3.47Å; D160-T163 PolarHBondContact O-OG1 3.37Å; T163-V165 VanDerWaalsContact C-N 3.34Å; T163-V165 PolarHBondContact O-N 3.05Å; T163-Q166 PolarHBondContact O-N 3.47Å; T163-S167 PolarHBondContact O-N 3.06Å; T163-S167 PolarHBondContact O-OG 3.01Å
164	F	87.9	Confident	86.7	Confident	50 Å²	50	82.7 Å²	82.7	22%	0.219	40%	0.397	C	S	.	.	H	α-helix	trans	-57.9	-43.7	170.3	169.6	-98.6	0	0	0	112.2	P104 K105 P107 D160 E162 M168	P104-F164 HydrophobicContact CB-CD2 3.71Å; P104-F164 HydrophobicContact CB-CE2 3.8Å; P104-F164 WeakPolarHBondContact O-CE2 3.21Å; K105-F164 WeakPolarHBondContact O-CD2 3.44Å; P107-F164 HydrophobicContact CG-CB 4.44Å; D160-F164 WeakPolarHBondContact O-CB 3.48Å; D160-F164 PolarHBondContact O-N 3.23Å; E162-F164 PolarHBondContact O-N 2.92Å; F164-M168 WeakPolarHBondContact O-CB 3.32Å; F164-M168 PolarHBondContact O-N 3.23Å
165	V	82.3	Confident	86.4	Confident	66 Å²	66	82.2 Å²	82.2	40%	0.4	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-42.9	176.2	167	0	0	0	0	111.3	K161 E162 T163 M168 M169	K161-V165 WeakPolarHBondContact O-CG2 3.14Å; K161-V165 PolarHBondContact O-N 3.44Å; E162-V165 PolarHBondContact O-N 2.87Å; E162-V165 VanDerWaalsContact O-N 3.16Å; T163-V165 VanDerWaalsContact C-N 3.34Å; T163-V165 PolarHBondContact O-N 3.05Å; V165-M168 PolarHBondContact O-N 3.44Å; V165-M169 HydrophobicContact CG1-CE 3.95Å; V165-M169 HydrophobicContact CG1-SD 4.41Å; V165-M169 WeakPolarHBondContact O-CG 3.48Å; V165-M169 PolarHBondContact O-N 3.44Å
166	Q	86.4	Confident	85.8	Confident	105 Å²	105	82.4 Å²	82.4	49%	0.491	40%	0.396	S	S	.	.	H	α-helix	trans	-64.7	-46.3	177.7	-67.4	175.3	13.4	0	0	112.1	E162 T163 M168 M169 K170	E162-Q166 WeakPolarHBondContact O-CG 3.5Å; E162-Q166 PolarHBondContact O-N 2.83Å; T163-Q166 PolarHBondContact O-N 3.47Å; Q166-M168 VanDerWaalsContact C-N 3.3Å; Q166-M168 PolarHBondContact O-N 3.37Å; Q166-M169 WeakPolarHBondContact O-CB 3.47Å; Q166-M169 PolarHBondContact O-N 3.04Å; Q166-M169 VanDerWaalsContact O-N 3.16Å; Q166-K170 PolarHBondContact O-N 2.82Å
167	S	87.9	Confident	84.9	Confident	59 Å²	59	86.3 Å²	86.3	41%	0.413	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-33.3	174.8	-60.9	0	0	0	0	112.3	T163 M169 K170 F171	T163-S167 PolarHBondContact O-N 3.06Å; T163-S167 PolarHBondContact O-OG 3.01Å; S167-M169 VanDerWaalsContact C-N 3.32Å; S167-K170 PolarHBondContact O-N 2.88Å; S167-F171 WeakPolarHBondContact O-CB 3.45Å; S167-F171 PolarHBondContact O-N 2.97Å
168	M	82.9	Confident	84	Confident	24 Å²	24	84.7 Å²	84.7	12%	0.118	41%	0.41	C	S	.	.	H	α-helix	trans	-73.4	-22.5	174.9	-167	72.4	-124.5	0	0	112.6	F103 P104 F164 V165 Q166 F171 R172 M179	F103-M168 HydrophobicContact CE2-CE 4.27Å; P104-M168 HydrophobicContact CG-CB 4.28Å; P104-M168 HydrophobicContact CG-SD 4.21Å; F164-M168 WeakPolarHBondContact O-CB 3.32Å; F164-M168 PolarHBondContact O-N 3.23Å; V165-M168 PolarHBondContact O-N 3.44Å; Q166-M168 VanDerWaalsContact C-N 3.3Å; Q166-M168 PolarHBondContact O-N 3.37Å; M168-F171 HydrophobicContact CE-CD1 3.66Å; M168-F171 HydrophobicContact CE-CE1 4.41Å; M168-F171 HydrophobicContact CE-CG 4.45Å; M168-R172 HydrophobicContact CE-CG 4.25Å; M168-R172 WeakPolarHBondContact O-CD 3.3Å; M168-R172 WeakPolarHBondContact O-CG 3.29Å; M168-R172 PolarHBondContact O-NE 3.47Å; M168-M179 HydrophobicContact CE-SD 4.07Å
169	M	83.3	Confident	83.1	Confident	108 Å²	108	81.2 Å²	81.2	53%	0.532	39%	0.392	S	S	.	.	H	α-helix	trans	-72.3	-50.7	167	-72.8	173.2	173.9	0	0	110.5	V165 Q166 S167 F171 R172 E173	V165-M169 HydrophobicContact CG1-CE 3.95Å; V165-M169 HydrophobicContact CG1-SD 4.41Å; V165-M169 WeakPolarHBondContact O-CG 3.48Å; V165-M169 PolarHBondContact O-N 3.44Å; Q166-M169 WeakPolarHBondContact O-CB 3.47Å; Q166-M169 PolarHBondContact O-N 3.04Å; Q166-M169 VanDerWaalsContact O-N 3.16Å; S167-M169 VanDerWaalsContact C-N 3.32Å; M169-F171 PolarHBondContact O-N 3.15Å; M169-R172 WeakPolarHBondContact O-CA 3.31Å; M169-R172 WeakPolarHBondContact O-CB 3.45Å; M169-R172 PolarHBondContact O-N 3.43Å; M169-E173 PolarHBondContact O-N 3.49Å
170	K	86.6	Confident	81.6	Confident	121 Å²	121	79 Å²	79	53%	0.526	39%	0.388	S	S	.	.	H	α-helix	trans	-55.7	-47.9	176	-69.7	-168.5	173.7	-163.5	0	113.1	Q166 S167 R172 E173 E174	Q166-K170 PolarHBondContact O-N 2.82Å; S167-K170 PolarHBondContact O-N 2.88Å; K170-R172 PolarHBondContact O-N 3.15Å; K170-R172 VanDerWaalsContact O-N 3.08Å; K170-E173 CarbonylContact O-C 3.52Å; K170-E173 WeakPolarHBondContact O-CA 3.19Å; K170-E173 WeakPolarHBondContact O-CB 3.36Å; K170-E173 PolarHBondContact O-N 2.89Å; K170-E174 WeakPolarHBondContact O-CB 3.4Å; K170-E174 WeakPolarHBondContact O-CG 3.38Å; K170-E174 PolarHBondContact O-N 2.92Å
171	F	85.4	Confident	79.8	Confident	2 Å²	2	78.3 Å²	78.3	1%	0.009	39%	0.387	C	S	.	.	H	α-helix	trans	-57.4	-27.9	176.4	-174.9	-91.2	0	0	0	113.3	L97 H100 D102 F103 P104 S167 M168 M169 H175 L178	L97-F171 HydrophobicContact CD1-CE1 4.05Å; L97-F171 HydrophobicContact CD1-CZ 3.82Å; H100-F171 HydrophobicContact CB-CE2 4.43Å; H100-F171 HydrophobicContact CB-CZ 4.46Å; H100-F171 AromaticContact ND1-CE2 3.67Å; D102-F171 HydrophobicContact CB-CD2 4.26Å; D102-F171 HydrophobicContact CB-CE2 4.44Å; D102-F171 WeakPolarHBondContact O-CD2 3.49Å; F103-F171 HydrophobicContact CB-CE2 4.24Å; F103-F171 HydrophobicContact CB-CZ 4.36Å; F103-F171 HydrophobicContact CD2-CD1 4.29Å; F103-F171 AromaticContact CD2-CE1 3.75Å; F103-F171 HydrophobicContact CD2-CE1 3.75Å; F103-F171 HydrophobicContact CD2-CE2 4.44Å; F103-F171 AromaticContact CD2-CZ 3.85Å; F103-F171 HydrophobicContact CD2-CZ 3.85Å; F103-F171 HydrophobicContact CE2-CE1 4.3Å; P104-F171 HydrophobicContact CG-CB 4.24Å; S167-F171 WeakPolarHBondContact O-CB 3.45Å; S167-F171 PolarHBondContact O-N 2.97Å; M168-F171 HydrophobicContact CE-CD1 3.66Å; M168-F171 HydrophobicContact CE-CE1 4.41Å; M168-F171 HydrophobicContact CE-CG 4.45Å; M169-F171 PolarHBondContact O-N 3.15Å; F171-H175 AromaticContact CD2-CD2 3.43Å; F171-H175 VanDerWaalsContact CD2-CD2 3.43Å; F171-H175 WeakPolarHBondContact CD2-CD2 3.42Å; F171-H175 HydrophobicContact CE1-CB 4.45Å; F171-H175 HydrophobicContact CE2-CB 4.39Å; F171-H175 AromaticContact CE2-CD2 3.39Å; F171-H175 WeakPolarHBondContact CE2-CD2 3.28Å; F171-H175 HydrophobicContact CZ-CB 4.22Å; F171-H175 WeakPolarHBondContact O-CB 3.14Å; F171-H175 PolarHBondContact O-N 3.4Å; F171-H175 VanDerWaalsContact O-N 3.09Å; F171-L178 HydrophobicContact CZ-CD1 4.47Å
172	R	80.3	Confident	78.2	Confident	138 Å²	138	78.4 Å²	78.4	52%	0.521	39%	0.391	S	S	.	.	H	α-helix	trans	-78.2	-29.4	174.6	-69.2	163.5	178.2	-146.9	-3.1	113.4	M168 M169 K170 M179	M168-R172 HydrophobicContact CE-CG 4.25Å; M168-R172 WeakPolarHBondContact O-CD 3.3Å; M168-R172 WeakPolarHBondContact O-CG 3.29Å; M168-R172 PolarHBondContact O-NE 3.47Å; M169-R172 WeakPolarHBondContact O-CA 3.31Å; M169-R172 WeakPolarHBondContact O-CB 3.45Å; M169-R172 PolarHBondContact O-N 3.43Å; K170-R172 PolarHBondContact O-N 3.15Å; K170-R172 VanDerWaalsContact O-N 3.08Å; R172-M179 HydrophobicContact CB-CG 4.26Å; R172-M179 HydrophobicContact CG-CE 3.95Å; R172-M179 HydrophobicContact CG-CG 3.77Å; R172-M179 HydrophobicContact CG-SD 3.9Å
173	E	82.4	Confident	76.3	Confident	151 Å²	151	74.5 Å²	74.5	71%	0.706	38%	0.375	S	S	*	.	H	α-helix	trans	-80.7	-38.4	177.3	-66.2	168.3	176.5	0	0	110.9	M169 K170	M169-E173 PolarHBondContact O-N 3.49Å; K170-E173 CarbonylContact O-C 3.52Å; K170-E173 WeakPolarHBondContact O-CA 3.19Å; K170-E173 WeakPolarHBondContact O-CB 3.36Å; K170-E173 PolarHBondContact O-N 2.89Å
174	E	84.4	Confident	74.4	Confident	119 Å²	119	78.5 Å²	78.5	56%	0.556	39%	0.387	S	S	*	.	H	α-helix	trans	-83	-28.9	-177.2	-67.7	161.6	169.7	0	0	112.8	K170 P176	K170-E174 WeakPolarHBondContact O-CB 3.4Å; K170-E174 WeakPolarHBondContact O-CG 3.38Å; K170-E174 PolarHBondContact O-N 2.92Å; E174-P176 VanDerWaalsContact C-CD 3.48Å
175	H	81.9	Confident	72.5	Confident	45 Å²	45	84.3 Å²	84.3	21%	0.208	41%	0.412	C	S	.	.			trans	-128.1	61.3	-179.6	-54.4	-77.9	0	0	0	113.9	H100 F171 D177 L178 M179	H100-H175 AromaticContact CE1-CE1 3.35Å; H100-H175 PolarHBondContact CE1-CE1 3.15Å; H100-H175 AromaticContact CE1-ND1 3.95Å; H100-H175 AromaticContact CE1-NE2 3.44Å; H100-H175 PolarHBondContact CE1-NE2 3.25Å; H100-H175 AromaticContact NE2-CE1 3.51Å; H100-H175 AromaticContact NE2-ND1 3.74Å; H100-H175 AromaticContact NE2-NE2 4Å; F171-H175 AromaticContact CD2-CD2 3.43Å; F171-H175 VanDerWaalsContact CD2-CD2 3.43Å; F171-H175 WeakPolarHBondContact CD2-CD2 3.42Å; F171-H175 HydrophobicContact CE1-CB 4.45Å; F171-H175 HydrophobicContact CE2-CB 4.39Å; F171-H175 AromaticContact CE2-CD2 3.39Å; F171-H175 WeakPolarHBondContact CE2-CD2 3.28Å; F171-H175 HydrophobicContact CZ-CB 4.22Å; F171-H175 WeakPolarHBondContact O-CB 3.14Å; F171-H175 PolarHBondContact O-N 3.4Å; F171-H175 VanDerWaalsContact O-N 3.09Å; H175-D177 PolarHBondContact O-N 2.98Å; H175-L178 HydrophobicContact CB-CB 4.23Å; H175-L178 HydrophobicContact CB-CD1 4.13Å; H175-L178 HydrophobicContact CB-CG 4.4Å; H175-L178 PolarHBondContact O-N 3.22Å; H175-M179 PolarHBondContact O-N 3.26Å; H175-M179 VanDerWaalsContact O-N 3.13Å
176	P	77.5	Confident	70.9	Confident	74 Å²	74	83.5 Å²	83.5	48%	0.481	42%	0.417	S	S	.	.	H	α-helix	trans	-60.1	-41.6	-177	24.3	-34.1	0	0	0	113.2	E174 L178 M179 E180	E174-P176 VanDerWaalsContact C-CD 3.48Å; P176-L178 PolarHBondContact O-N 3.16Å; P176-M179 CarbonylContact O-C 3.59Å; P176-M179 WeakPolarHBondContact O-CA 3.41Å; P176-M179 WeakPolarHBondContact O-CB 3.17Å; P176-M179 PolarHBondContact O-N 3.37Å; P176-M179 VanDerWaalsContact O-N 3.12Å; P176-E180 PolarHBondContact O-N 2.82Å
177	D	71.1	Confident	69.2	Low	110 Å²	110	81.8 Å²	81.8	59%	0.588	42%	0.416	S	S	*	.	H	α-helix	trans	-66	-35.9	-177.3	-62.1	-29.8	0	0	0	113.1	H175	H175-D177 PolarHBondContact O-N 2.98Å
178	L	72.7	Confident	67.7	Low	13 Å²	13	85.2 Å²	85.2	7%	0.068	43%	0.43	C	S	.	.	H	α-helix	trans	-69.1	-39.7	173.4	-66	-176.2	0	0	0	110.6	N90 L97 H100 F171 H175 P176 S181	N90-L178 HydrophobicContact CB-CD2 4.18Å; L97-L178 HydrophobicContact CD1-CB 3.83Å; L97-L178 HydrophobicContact CD1-CD1 4.09Å; L97-L178 HydrophobicContact CD1-CG 4.45Å; H100-L178 VanDerWaalsContact CD2-CD1 3.43Å; H100-L178 WeakPolarHBondContact CD2-CD1 3.47Å; F171-L178 HydrophobicContact CZ-CD1 4.47Å; H175-L178 HydrophobicContact CB-CB 4.23Å; H175-L178 HydrophobicContact CB-CD1 4.13Å; H175-L178 HydrophobicContact CB-CG 4.4Å; H175-L178 PolarHBondContact O-N 3.22Å; P176-L178 PolarHBondContact O-N 3.16Å; L178-S181 WeakPolarHBondContact O-CB 3.41Å; L178-S181 PolarHBondContact O-N 3.47Å; L178-S181 PolarHBondContact O-OG 2.66Å
179	M	68.1	Low	66.9	Low	20 Å²	20	87.1 Å²	87.1	10%	0.099	44%	0.443	C	S	.	.	H	α-helix	trans	-68.8	-33.4	175.1	-90.4	-61.9	-53.4	0	0	113.6	M168 R172 H175 P176 S181 M182 T183	M168-M179 HydrophobicContact CE-SD 4.07Å; R172-M179 HydrophobicContact CB-CG 4.26Å; R172-M179 HydrophobicContact CG-CE 3.95Å; R172-M179 HydrophobicContact CG-CG 3.77Å; R172-M179 HydrophobicContact CG-SD 3.9Å; H175-M179 PolarHBondContact O-N 3.26Å; H175-M179 VanDerWaalsContact O-N 3.13Å; P176-M179 CarbonylContact O-C 3.59Å; P176-M179 WeakPolarHBondContact O-CA 3.41Å; P176-M179 WeakPolarHBondContact O-CB 3.17Å; P176-M179 PolarHBondContact O-N 3.37Å; P176-M179 VanDerWaalsContact O-N 3.12Å; M179-S181 PolarHBondContact O-N 2.96Å; M179-M182 CarbonylContact O-C 3.6Å; M179-M182 WeakPolarHBondContact O-CA 3.24Å; M179-M182 WeakPolarHBondContact O-CB 3.39Å; M179-M182 PolarHBondContact O-N 3.46Å; M179-T183 HydrophobicContact CE-CG2 3.96Å; M179-T183 PolarHBondContact O-N 2.86Å
180	E	60.2	Low	66.4	Low	109 Å²	109	83.3 Å²	83.3	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-63	-30.8	176.4	-161.9	-171.6	-130.4	0	0	111.4	P176 M182 T183 K184	P176-E180 PolarHBondContact O-N 2.82Å; E180-M182 PolarHBondContact O-N 2.83Å; E180-T183 WeakPolarHBondContact CA-OG1 3.48Å; E180-T183 PolarHBondContact O-N 3.48Å; E180-K184 PolarHBondContact O-N 3.01Å
181	S	52.4	Low	65.9	Low	35 Å²	35	84 Å²	84	25%	0.245	43%	0.431	C	S	.	.	H	α-helix	trans	-61.9	-29.5	172.3	82.9	0	0	0	0	113.3	L178 M179	L178-S181 WeakPolarHBondContact O-CB 3.41Å; L178-S181 PolarHBondContact O-N 3.47Å; L178-S181 PolarHBondContact O-OG 2.66Å; M179-S181 PolarHBondContact O-N 2.96Å
182	M	51.5	Low	65.6	Low	112 Å²	112	92 Å²	92	55%	0.552	47%	0.466	S	S	*	.	H	α-helix	trans	-81.6	-42.8	170	-78.2	-97.4	-75.9	0	0	112	L97 M179 E180 K184 K185	L97-M182 HydrophobicContact CD2-CG 3.7Å; M179-M182 CarbonylContact O-C 3.6Å; M179-M182 WeakPolarHBondContact O-CA 3.24Å; M179-M182 WeakPolarHBondContact O-CB 3.39Å; M179-M182 PolarHBondContact O-N 3.46Å; E180-M182 PolarHBondContact O-N 2.83Å; M182-K184 PolarHBondContact O-N 3.25Å; M182-K185 PolarHBondContact O-N 2.94Å; M182-K185 VanDerWaalsContact O-N 3.09Å
183	T	47.4	Very low	65.8	Low	39 Å²	39	86.7 Å²	86.7	24%	0.239	45%	0.449	C	S	.	.	H	α-helix	trans	-77.3	2	-177	71.7	0	0	0	0	114.6	M179 E180 K185 G186 S187	M179-T183 HydrophobicContact CE-CG2 3.96Å; M179-T183 PolarHBondContact O-N 2.86Å; E180-T183 WeakPolarHBondContact CA-OG1 3.48Å; E180-T183 PolarHBondContact O-N 3.48Å; T183-K185 PolarHBondContact O-N 2.89Å; T183-G186 CarbonylContact O-C 3.55Å; T183-G186 VanDerWaalsContact O-C 3.29Å; T183-G186 WeakPolarHBondContact O-CA 3.44Å; T183-G186 PolarHBondContact O-N 3.34Å; T183-S187 WeakPolarHBondContact CB-OG 3.42Å; T183-S187 PolarHBondContact O-N 3.18Å; T183-S187 PolarHBondContact OG1-OG 2.91Å
184	K	49.4	Very low	66.1	Low	148 Å²	148	83 Å²	83	64%	0.643	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.7	157.5	-79	176.8	-178	176.4	0	113.9	E180 M182	E180-K184 PolarHBondContact O-N 3.01Å; M182-K184 PolarHBondContact O-N 3.25Å
185	K	49.1	Very low	66.5	Low	173 Å²	173	79.3 Å²	79.3	75%	0.752	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.6	161.8	-102	-172.6	176.6	-175.6	0	113.6	M182 T183 D705	M182-K185 PolarHBondContact O-N 2.94Å; M182-K185 VanDerWaalsContact O-N 3.09Å; T183-K185 PolarHBondContact O-N 2.89Å; K185-D705 IonicContact NZ-OD1 3.24Å; K185-D705 PolarHBondContact NZ-OD1 2.9Å
186	G	48.4	Very low	67	Low	48 Å²	48	77.2 Å²	77.2	50%	0.495	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	159.7	81.8	168.1	0	0	0	0	0	119	T183	T183-G186 CarbonylContact O-C 3.55Å; T183-G186 VanDerWaalsContact O-C 3.29Å; T183-G186 WeakPolarHBondContact O-CA 3.44Å; T183-G186 PolarHBondContact O-N 3.34Å
187	S	51.1	Low	67.7	Low	69 Å²	69	78 Å²	78	48%	0.483	40%	0.404	S	S	.	.	S	Bend	trans	-135.4	8.5	158.5	68.1	0	0	0	0	116.3	T183	T183-S187 WeakPolarHBondContact CB-OG 3.42Å; T183-S187 PolarHBondContact O-N 3.18Å; T183-S187 PolarHBondContact OG1-OG 2.91Å
188	N	55.3	Low	68.6	Low	132 Å²	132	77.1 Å²	77.1	71%	0.706	40%	0.397	S	S	*	.	S	Bend	trans	-168.3	-25.4	163.9	-103.3	-25.6	0	0	0	112.8	P190 Y257	N188-P190 WeakPolarHBondContact O-CD 3.04Å; N188-Y257 HydrophobicContact CB-CE2 4.18Å
189	V	65.7	Low	69.5	Low	63 Å²	63	77.4 Å²	77.4	38%	0.382	40%	0.398	S	S	.	.	S	Bend	trans	-67.4	127.3	169	-174.2	0	0	0	0	109.4	M254 Y257	V189-M254 HydrophobicContact CG1-SD 4.3Å; V189-Y257 HydrophobicContact CG2-CE1 3.95Å
190	P	72.9	Confident	70.8	Confident	29 Å²	29	76.8 Å²	76.8	19%	0.188	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-54.3	140.9	173.8	-28.9	35.3	0	0	0	114.2	N188 Y250 A253 M254	N188-P190 WeakPolarHBondContact O-CD 3.04Å; P190-Y250 HydrophobicContact CB-CD2 3.85Å; P190-Y250 HydrophobicContact CB-CE2 4.12Å; P190-A253 HydrophobicContact CB-CB 4.07Å; P190-A253 HydrophobicContact CG-CB 3.72Å; P190-M254 HydrophobicContact CB-CG 4.28Å; P190-M254 HydrophobicContact CB-SD 4.05Å; P190-M254 HydrophobicContact CG-CG 4.24Å; P190-M254 HydrophobicContact CG-SD 3.83Å
191	E	77.1	Confident	72.4	Confident	135 Å²	135	74.1 Å²	74.1	63%	0.631	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-63.5	135.7	174.1	-84.7	-164.7	-179.4	0	0	112	K194 Y250	E191-K194 IonicContact OE1-NZ 3.37Å; E191-K194 IonicContact OE2-NZ 3.1Å; E191-K194 PolarHBondContact OE2-NZ 3.33Å; E191-Y250 WeakPolarHBondContact O-CD2 3.46Å
192	K	78.7	Confident	74.2	Confident	171 Å²	171	76.4 Å²	76.4	74%	0.743	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-57.8	137.5	171.9	-67	173.8	-174.7	165	0	110.9
193	P	84.9	Confident	76.1	Confident	25 Å²	25	75.8 Å²	75.8	16%	0.162	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-70.2	137.1	-175.9	28.8	-34.4	0	0	0	111.3	Q246 Q247 Y250 T275	P193-Q246 HydrophobicContact CB-CB 4.26Å; P193-Q247 HydrophobicContact CB-CB 4.17Å; P193-Q247 HydrophobicContact CG-CB 4.13Å; P193-Q247 HydrophobicContact CG-CG 4.1Å; P193-Y250 HydrophobicContact CG-CD1 3.97Å; P193-Y250 HydrophobicContact CG-CG 4.17Å; P193-T275 HydrophobicContact CB-CG2 3.89Å; P193-T275 HydrophobicContact CG-CG2 3.61Å
194	K	89.1	Confident	78.3	Confident	73 Å²	73	76.2 Å²	76.2	32%	0.317	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-82.4	143	-173.1	-75	147	-179.5	159.1	0	111.2	E191 Q198 L199 S243	E191-K194 IonicContact OE1-NZ 3.37Å; E191-K194 IonicContact OE2-NZ 3.1Å; E191-K194 PolarHBondContact OE2-NZ 3.33Å; K194-Q198 HydrophobicContact CB-CB 4.21Å; K194-L199 HydrophobicContact CB-CD2 3.9Å; K194-L199 HydrophobicContact CB-CG 3.94Å; K194-S243 WeakPolarHBondContact O-CB 3.47Å; K194-S243 PolarHBondContact O-OG 2.94Å
195	T	91.1	Very high	80.2	Confident	43 Å²	43	71.9 Å²	71.9	26%	0.264	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-66.9	162.1	-179.1	73.3	0	0	0	0	111.5	Q197 Q198 L199	T195-Q197 VanDerWaalsContact C-N 3.28Å; T195-Q197 PolarHBondContact O-N 2.97Å; T195-Q198 PolarHBondContact O-N 3.49Å; T195-Q198 VanDerWaalsContact O-N 3.14Å; T195-Q198 WeakPolarHBondContact OG1-CB 3.48Å; T195-Q198 VanDerWaalsContact OG1-CG 3.29Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.48Å; T195-Q198 PolarHBondContact OG1-N 3.32Å; T195-Q198 VanDerWaalsContact OG1-N 3.15Å; T195-L199 WeakPolarHBondContact O-CG 3.48Å; T195-L199 PolarHBondContact O-N 2.6Å
196	P	92.6	Very high	82.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-58.8	-41.4	178.6	-22.4	33.9	0	0	0	112.2	L199 W200 W228 W239 I240 L276 E280	P196-L199 PolarHBondContact O-N 2.66Å; P196-W200 WeakPolarHBondContact O-CB 3.27Å; P196-W200 PolarHBondContact O-N 2.83Å; P196-W228 HydrophobicContact CB-CH2 4.02Å; P196-W228 HydrophobicContact CB-CZ2 4.43Å; P196-W239 HydrophobicContact CB-CB 4Å; P196-I240 HydrophobicContact CB-CG1 3.97Å; P196-I240 HydrophobicContact CG-CB 4.44Å; P196-I240 HydrophobicContact CG-CG1 3.9Å; P196-L276 HydrophobicContact CG-CD2 3.41Å; P196-L276 VanDerWaalsContact CG-CD2 3.41Å; P196-E280 VanDerWaalsContact CB-OE1 3.28Å; P196-E280 WeakPolarHBondContact CB-OE1 3.37Å; P196-E280 WeakPolarHBondContact CD-OE1 3.47Å; P196-E280 VanDerWaalsContact CG-OE1 3.25Å; P196-E280 WeakPolarHBondContact CG-OE1 3.41Å
197	Q	92.3	Very high	84.1	Confident	90 Å²	90	71.5 Å²	71.5	42%	0.421	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-44.7	174.1	-174.2	173	0.4	0	0	112.1	T195 L199 W200 Y201 W228	T195-Q197 VanDerWaalsContact C-N 3.28Å; T195-Q197 PolarHBondContact O-N 2.97Å; Q197-L199 PolarHBondContact O-N 3.29Å; Q197-W200 PolarHBondContact O-N 2.85Å; Q197-Y201 WeakPolarHBondContact O-CB 3.29Å; Q197-Y201 PolarHBondContact O-N 2.71Å; Q197-W228 HydrophobicContact CB-CD2 4.09Å; Q197-W228 HydrophobicContact CB-CH2 4.29Å; Q197-W228 HydrophobicContact CB-CZ2 3.68Å; Q197-W228 HydrophobicContact CG-CD2 3.83Å; Q197-W228 HydrophobicContact CG-CG 3.85Å; Q197-W228 HydrophobicContact CG-CZ2 4.34Å
198	Q	90.9	Very high	85.8	Confident	93 Å²	93	70.1 Å²	70.1	44%	0.435	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-39.4	176.8	-75.2	169.7	-14.4	0	0	112	K194 T195 N202	K194-Q198 HydrophobicContact CB-CB 4.21Å; T195-Q198 PolarHBondContact O-N 3.49Å; T195-Q198 VanDerWaalsContact O-N 3.14Å; T195-Q198 WeakPolarHBondContact OG1-CB 3.48Å; T195-Q198 VanDerWaalsContact OG1-CG 3.29Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.48Å; T195-Q198 PolarHBondContact OG1-N 3.32Å; T195-Q198 VanDerWaalsContact OG1-N 3.15Å; Q198-N202 VanDerWaalsContact O-CB 3.31Å; Q198-N202 WeakPolarHBondContact O-CB 3.47Å; Q198-N202 PolarHBondContact O-N 2.93Å; Q198-N202 PolarHBondContact O-ND2 2.83Å
199	L	92.1	Very high	87.4	Confident	18 Å²	18	67.6 Å²	67.6	9%	0.094	33%	0.331	C	S	.	.	H	α-helix	trans	-68.5	-39	178.8	-73.9	175.2	0	0	0	112.7	K194 T195 P196 Q197 H203 W239 K242	K194-L199 HydrophobicContact CB-CD2 3.9Å; K194-L199 HydrophobicContact CB-CG 3.94Å; T195-L199 WeakPolarHBondContact O-CG 3.48Å; T195-L199 PolarHBondContact O-N 2.6Å; P196-L199 PolarHBondContact O-N 2.66Å; Q197-L199 PolarHBondContact O-N 3.29Å; L199-H203 PolarHBondContact O-N 3.45Å; L199-W239 HydrophobicContact CB-CE3 3.84Å; L199-W239 HydrophobicContact CB-CZ3 4.25Å; L199-W239 WeakPolarHBondContact O-CZ3 3.33Å; L199-K242 HydrophobicContact CD1-CB 4.39Å; L199-K242 HydrophobicContact CD1-CG 4.23Å
200	W	94.5	Very high	88.5	Confident	7 Å²	7	73.3 Å²	73.3	3%	0.027	35%	0.35	C	S	.	.	H	α-helix	trans	-68.5	-47.8	172.4	174.9	69.8	0	0	0	111.7	P196 Q197 N202 H203 E204 L224 Q227 W228 L231 W239	P196-W200 WeakPolarHBondContact O-CB 3.27Å; P196-W200 PolarHBondContact O-N 2.83Å; Q197-W200 PolarHBondContact O-N 2.85Å; W200-N202 VanDerWaalsContact C-N 3.34Å; W200-N202 PolarHBondContact O-N 3.23Å; W200-H203 WeakPolarHBondContact O-CA 3.16Å; W200-H203 WeakPolarHBondContact O-CB 3.31Å; W200-H203 PolarHBondContact O-N 3.1Å; W200-E204 HydrophobicContact CD2-CG 4.01Å; W200-E204 HydrophobicContact CG-CG 4.3Å; W200-E204 HydrophobicContact CH2-CG 4.26Å; W200-E204 HydrophobicContact CZ2-CB 4.27Å; W200-E204 HydrophobicContact CZ2-CG 3.48Å; W200-E204 VanDerWaalsContact CZ2-CG 3.48Å; W200-E204 PolarHBondContact NE1-OE1 3.24Å; W200-E204 PolarHBondContact O-N 2.78Å; W200-L224 HydrophobicContact CH2-CB 3.8Å; W200-L224 HydrophobicContact CH2-CD2 4.01Å; W200-L224 HydrophobicContact CH2-CG 4.48Å; W200-L224 WeakPolarHBondContact CH2-O 3.29Å; W200-L224 HydrophobicContact CZ2-CD2 4.48Å; W200-L224 HydrophobicContact CZ3-CB 3.93Å; W200-L224 WeakPolarHBondContact CZ3-O 3.42Å; W200-Q227 HydrophobicContact CH2-CB 3.68Å; W200-Q227 HydrophobicContact CZ2-CB 3.88Å; W200-W228 HydrophobicContact CB-CE3 3.98Å; W200-W228 HydrophobicContact CB-CZ3 3.61Å; W200-W228 AromaticContact CD2-CE3 3.56Å; W200-W228 HydrophobicContact CD2-CE3 3.56Å; W200-W228 HydrophobicContact CD2-CZ3 4.08Å; W200-W228 HydrophobicContact CE3-CB 3.99Å; W200-W228 HydrophobicContact CE3-CD2 4.14Å; W200-W228 AromaticContact CE3-CE3 3.48Å; W200-W228 HydrophobicContact CE3-CE3 3.48Å; W200-W228 VanDerWaalsContact CE3-CE3 3.48Å; W200-W228 HydrophobicContact CE3-CG 4.37Å; W200-W228 HydrophobicContact CE3-CZ3 4.31Å; W200-W228 AromaticContact CG-CE3 3.8Å; W200-W228 HydrophobicContact CG-CE3 3.8Å; W200-W228 AromaticContact CG-CZ3 3.79Å; W200-W228 HydrophobicContact CG-CZ3 3.79Å; W200-W228 HydrophobicContact CH2-CB 4.22Å; W200-W228 HydrophobicContact CZ3-CB 3.64Å; W200-W228 HydrophobicContact CZ3-CE3 4.31Å; W200-W228 HydrophobicContact CZ3-CG 4.48Å; W200-L231 HydrophobicContact CD2-CD1 4.09Å; W200-L231 HydrophobicContact CG-CD1 4.12Å; W200-L231 HydrophobicContact CZ2-CD2 4.46Å; W200-W239 HydrophobicContact CB-CD2 3.79Å; W200-W239 HydrophobicContact CB-CE3 4.35Å; W200-W239 HydrophobicContact CB-CG 3.85Å; W200-W239 HydrophobicContact CB-CZ2 4.42Å; W200-W239 AromaticContact CD1-CD1 3.93Å; W200-W239 AromaticContact CD1-CE2 3.58Å; W200-W239 AromaticContact CD1-CZ2 3.86Å; W200-W239 AromaticContact CD1-NE1 3.25Å; W200-W239 AromaticContact CG-NE1 3.84Å
201	Y	93.1	Very high	89.3	Confident	54 Å²	54	76.4 Å²	76.4	21%	0.212	37%	0.369	C	S	.	.	H	α-helix	trans	-59.3	-42.4	179.1	179	-98.5	0	0	0	112.1	Q197 H203 E204 K205 I220 L224	Q197-Y201 WeakPolarHBondContact O-CB 3.29Å; Q197-Y201 PolarHBondContact O-N 2.71Å; Y201-H203 PolarHBondContact O-N 2.81Å; Y201-E204 PolarHBondContact O-N 3.3Å; Y201-K205 HydrophobicContact CE1-CD 3.97Å; Y201-K205 WeakPolarHBondContact O-CB 3.39Å; Y201-K205 PolarHBondContact O-N 3.03Å; Y201-I220 HydrophobicContact CE2-CG2 4.34Å; Y201-L224 HydrophobicContact CD2-CB 3.72Å; Y201-L224 HydrophobicContact CD2-CD1 3.7Å; Y201-L224 HydrophobicContact CD2-CG 4.37Å; Y201-L224 HydrophobicContact CE2-CB 3.86Å; Y201-L224 HydrophobicContact CE2-CD1 3.68Å; Y201-L224 HydrophobicContact CE2-CG 4.34Å
202	N	90.9	Very high	89.5	Confident	83 Å²	83	74.5 Å²	74.5	44%	0.444	36%	0.36	S	S	.	.	H	α-helix	trans	-68.9	-20.2	175.2	-79.6	-66.6	0	0	0	114	Q198 W200 K206	Q198-N202 VanDerWaalsContact O-CB 3.31Å; Q198-N202 WeakPolarHBondContact O-CB 3.47Å; Q198-N202 PolarHBondContact O-N 2.93Å; Q198-N202 PolarHBondContact O-ND2 2.83Å; W200-N202 VanDerWaalsContact C-N 3.34Å; W200-N202 PolarHBondContact O-N 3.23Å; N202-K206 WeakPolarHBondContact O-CG 3.47Å
203	H	92.4	Very high	89.8	Confident	98 Å²	98	70.5 Å²	70.5	45%	0.454	35%	0.351	S	S	.	.	H	α-helix	trans	-80.3	-54.4	172.1	179.5	-95.8	0	0	0	110.5	L199 W200 Y201 K205 K206 A207 W239	L199-H203 PolarHBondContact O-N 3.45Å; W200-H203 WeakPolarHBondContact O-CA 3.16Å; W200-H203 WeakPolarHBondContact O-CB 3.31Å; W200-H203 PolarHBondContact O-N 3.1Å; Y201-H203 PolarHBondContact O-N 2.81Å; H203-K205 PolarHBondContact O-N 3.17Å; H203-K206 PolarHBondContact O-N 3.31Å; H203-A207 PolarHBondContact O-N 3.42Å; H203-W239 HydrophobicContact CB-CH2 3.52Å; H203-W239 HydrophobicContact CB-CZ2 4.16Å; H203-W239 HydrophobicContact CB-CZ3 4.23Å; H203-W239 AromaticContact CD2-CH2 3.91Å; H203-W239 AromaticContact CG-CH2 3.54Å; H203-W239 AromaticContact ND1-CH2 3.96Å; H203-W239 AromaticContact ND1-CZ2 3.99Å
204	E	92.2	Very high	89.7	Confident	48 Å²	48	76.8 Å²	76.8	22%	0.224	38%	0.384	C	S	.	.	H	α-helix	trans	-70.4	-32.8	-178.1	-51.2	-44.5	142.1	0	0	112.7	W200 Y201 K206 A207 F208 L224	W200-E204 HydrophobicContact CD2-CG 4.01Å; W200-E204 HydrophobicContact CG-CG 4.3Å; W200-E204 HydrophobicContact CH2-CG 4.26Å; W200-E204 HydrophobicContact CZ2-CB 4.27Å; W200-E204 HydrophobicContact CZ2-CG 3.48Å; W200-E204 VanDerWaalsContact CZ2-CG 3.48Å; W200-E204 PolarHBondContact NE1-OE1 3.24Å; W200-E204 PolarHBondContact O-N 2.78Å; Y201-E204 PolarHBondContact O-N 3.3Å; E204-K206 PolarHBondContact O-N 2.91Å; E204-A207 CarbonylContact O-C 3.58Å; E204-A207 PolarHBondContact O-N 2.86Å; E204-F208 VanDerWaalsContact O-CB 3.27Å; E204-F208 WeakPolarHBondContact O-CB 3.33Å; E204-F208 PolarHBondContact O-N 2.94Å; E204-L224 HydrophobicContact CB-CD1 4.07Å; E204-L224 HydrophobicContact CB-CD2 3.65Å
205	K	90.6	Very high	89.5	Confident	57 Å²	57	74.5 Å²	74.5	25%	0.248	38%	0.378	C	S	.	.	H	α-helix	trans	-57	-35.1	173	176.2	161.2	-176.1	170.9	0	111.6	Y201 H203 L209 I220 L224	Y201-K205 HydrophobicContact CE1-CD 3.97Å; Y201-K205 WeakPolarHBondContact O-CB 3.39Å; Y201-K205 PolarHBondContact O-N 3.03Å; H203-K205 PolarHBondContact O-N 3.17Å; K205-L209 WeakPolarHBondContact O-CB 3.37Å; K205-L209 PolarHBondContact O-N 3.18Å; K205-I220 HydrophobicContact CB-CG2 4.16Å; K205-I220 HydrophobicContact CD-CG2 3.91Å; K205-I220 HydrophobicContact CG-CG2 3.85Å; K205-L224 HydrophobicContact CB-CD1 4.06Å
206	K	89.8	Confident	89.2	Confident	167 Å²	167	76.6 Å²	76.6	73%	0.726	39%	0.391	S	S	*	.	H	α-helix	trans	-73.9	-30.1	175.3	-69.6	-177.8	178.8	-170.8	0	113.2	N202 H203 E204	N202-K206 WeakPolarHBondContact O-CG 3.47Å; H203-K206 PolarHBondContact O-N 3.31Å; E204-K206 PolarHBondContact O-N 2.91Å
207	A	89.1	Confident	88.6	Confident	47 Å²	47	81 Å²	81	39%	0.388	42%	0.418	S	S	.	.	H	α-helix	trans	-75.9	-45.9	173.5	0	0	0	0	0	111.4	H203 E204 K210 T211	H203-A207 PolarHBondContact O-N 3.42Å; E204-A207 CarbonylContact O-C 3.58Å; E204-A207 PolarHBondContact O-N 2.86Å; A207-K210 WeakPolarHBondContact O-CB 3.37Å; A207-K210 PolarHBondContact O-N 2.71Å; A207-K210 VanDerWaalsContact O-N 3.11Å; A207-T211 PolarHBondContact O-N 2.88Å
208	F	87.6	Confident	88.2	Confident	40 Å²	40	83.6 Å²	83.6	18%	0.175	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-45.9	-179.4	-165.9	-76.7	0	0	0	111.9	E204 K210 T211 H212 A215 I220 S223 L224	E204-F208 VanDerWaalsContact O-CB 3.27Å; E204-F208 WeakPolarHBondContact O-CB 3.33Å; E204-F208 PolarHBondContact O-N 2.94Å; F208-K210 PolarHBondContact O-N 2.88Å; F208-T211 PolarHBondContact O-N 3.04Å; F208-T211 PolarHBondContact O-OG1 3.22Å; F208-T211 VanDerWaalsContact O-OG1 3.12Å; F208-H212 HydrophobicContact CD1-CB 4.28Å; F208-H212 AromaticContact CD1-CD2 3.87Å; F208-H212 HydrophobicContact CE1-CB 4.04Å; F208-H212 AromaticContact CE1-CD2 3.65Å; F208-H212 AromaticContact CZ-CD2 3.73Å; F208-H212 PolarHBondContact O-N 3.3Å; F208-A215 HydrophobicContact CD1-CB 4.37Å; F208-A215 HydrophobicContact CE1-CB 3.75Å; F208-I220 HydrophobicContact CD1-CD1 4.48Å; F208-I220 HydrophobicContact CD1-CG1 3.76Å; F208-I220 HydrophobicContact CE1-CG1 3.86Å; F208-S223 WeakPolarHBondContact CE2-OG 3.13Å; F208-L224 HydrophobicContact CD2-CD2 4.34Å
209	L	87.7	Confident	88.1	Confident	79 Å²	79	83 Å²	83	41%	0.414	43%	0.428	S	S	.	.	H	α-helix	trans	-66.4	-17.5	175.3	-165.8	62.8	0	0	0	112.8	K205 P213 I220	K205-L209 WeakPolarHBondContact O-CB 3.37Å; K205-L209 PolarHBondContact O-N 3.18Å; L209-P213 WeakPolarHBondContact O-CA 3.5Å; L209-I220 HydrophobicContact CD1-CD1 4.19Å
210	K	89.4	Confident	87.9	Confident	182 Å²	182	82.3 Å²	82.3	79%	0.791	42%	0.424	S	S	*	.	H	α-helix	trans	-82.6	-27.2	172.3	-172.1	-179.1	176.4	-174.3	0	112.5	A207 F208	A207-K210 WeakPolarHBondContact O-CB 3.37Å; A207-K210 PolarHBondContact O-N 2.71Å; A207-K210 VanDerWaalsContact O-N 3.11Å; F208-K210 PolarHBondContact O-N 2.88Å
211	T	88.9	Confident	87.5	Confident	95 Å²	95	88.7 Å²	88.7	58%	0.583	45%	0.452	S	S	*	.	H	α-helix	trans	-93.8	-23.4	175.4	58	0	0	0	0	113.2	A207 F208	A207-T211 PolarHBondContact O-N 2.88Å; F208-T211 PolarHBondContact O-N 3.04Å; F208-T211 PolarHBondContact O-OG1 3.22Å; F208-T211 VanDerWaalsContact O-OG1 3.12Å
212	H	81.3	Confident	87.3	Confident	94 Å²	94	89.8 Å²	89.8	44%	0.435	46%	0.462	S	S	.	.			trans	-134.2	80.8	177.2	-49.2	-66.1	0	0	0	109.4	F208 D214 A215	F208-H212 HydrophobicContact CD1-CB 4.28Å; F208-H212 AromaticContact CD1-CD2 3.87Å; F208-H212 HydrophobicContact CE1-CB 4.04Å; F208-H212 AromaticContact CE1-CD2 3.65Å; F208-H212 AromaticContact CZ-CD2 3.73Å; F208-H212 PolarHBondContact O-N 3.3Å; H212-D214 PolarHBondContact O-N 3.41Å; H212-A215 HydrophobicContact CB-CB 3.75Å; H212-A215 PolarHBondContact O-N 3.31Å
213	P	85.1	Confident	87.2	Confident	87 Å²	87	87.3 Å²	87.3	57%	0.565	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.5	-179.5	-24	35.8	0	0	0	113.2	L209	L209-P213 WeakPolarHBondContact O-CA 3.5Å
214	D	83.4	Confident	87.1	Confident	158 Å²	158	82.7 Å²	82.7	85%	0.845	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	10.2	-174.7	-43.3	-66.6	0	0	0	113.3	H212	H212-D214 PolarHBondContact O-N 3.41Å
215	A	84.2	Confident	87	Confident	24 Å²	24	81.8 Å²	81.8	20%	0.198	43%	0.433	C	S	.	.			trans	-79.3	129.8	-177.3	0	0	0	0	0	112.9	F208 H212 I220	F208-A215 HydrophobicContact CD1-CB 4.37Å; F208-A215 HydrophobicContact CE1-CB 3.75Å; H212-A215 HydrophobicContact CB-CB 3.75Å; H212-A215 PolarHBondContact O-N 3.31Å; A215-I220 HydrophobicContact CB-CD1 4.34Å; A215-I220 HydrophobicContact CB-CG1 4.15Å; A215-I220 WeakPolarHBondContact O-CD1 3.39Å
216	T	86.3	Confident	86.9	Confident	87 Å²	87	85.4 Å²	85.4	53%	0.534	45%	0.449	S	S	.	.			trans	-62.3	147.9	179.9	-26.9	0	0	0	0	111.8	K218 D219 I220	T216-K218 PolarHBondContact O-N 3.46Å; T216-K218 VanDerWaalsContact O-N 3.09Å; T216-D219 WeakPolarHBondContact CB-OD2 3.45Å; T216-D219 PolarHBondContact N-OD2 3.01Å; T216-D219 PolarHBondContact O-N 2.88Å; T216-D219 PolarHBondContact OG1-OD2 3.37Å; T216-I220 WeakPolarHBondContact O-CG1 3.29Å; T216-I220 PolarHBondContact O-N 3.02Å; T216-I220 VanDerWaalsContact O-N 3.07Å
217	T	79.2	Confident	87	Confident	92 Å²	92	81.6 Å²	81.6	56%	0.564	43%	0.433	S	S	*	.	H	α-helix	trans	-53.6	-32.4	173.7	-69.3	0	0	0	0	112.6	K221	T217-K221 WeakPolarHBondContact O-CB 3.45Å; T217-K221 PolarHBondContact O-N 3.38Å
218	K	84.6	Confident	87.1	Confident	146 Å²	146	80.4 Å²	80.4	64%	0.635	42%	0.419	S	S	*	.	H	α-helix	trans	-64.4	-50.6	173.9	-170.3	176.9	-178.3	175	0	112.7	T216 I220 K221 D222	T216-K218 PolarHBondContact O-N 3.46Å; T216-K218 VanDerWaalsContact O-N 3.09Å; K218-I220 VanDerWaalsContact C-N 3.27Å; K218-I220 PolarHBondContact O-N 3.18Å; K218-K221 WeakPolarHBondContact O-CB 3.48Å; K218-K221 PolarHBondContact O-N 3.03Å; K218-D222 PolarHBondContact O-N 3.28Å
219	D	86.9	Confident	87.2	Confident	81 Å²	81	83.3 Å²	83.3	43%	0.433	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-37.8	179.7	-53.9	-49	0	0	0	111.5	T216 S223	T216-D219 WeakPolarHBondContact CB-OD2 3.45Å; T216-D219 PolarHBondContact N-OD2 3.01Å; T216-D219 PolarHBondContact O-N 2.88Å; T216-D219 PolarHBondContact OG1-OD2 3.37Å; D219-S223 WeakPolarHBondContact O-CB 3.24Å; D219-S223 PolarHBondContact O-N 2.96Å; D219-S223 PolarHBondContact O-OG 3.07Å
220	I	88.1	Confident	87.3	Confident	2 Å²	2	87 Å²	87	1%	0.01	46%	0.455	C	S	.	.	H	α-helix	trans	-65	-42.4	173.5	-62.1	169.9	0	0	0	111	Y201 K205 F208 L209 A215 T216 K218 S223 L224	Y201-I220 HydrophobicContact CE2-CG2 4.34Å; K205-I220 HydrophobicContact CB-CG2 4.16Å; K205-I220 HydrophobicContact CD-CG2 3.91Å; K205-I220 HydrophobicContact CG-CG2 3.85Å; F208-I220 HydrophobicContact CD1-CD1 4.48Å; F208-I220 HydrophobicContact CD1-CG1 3.76Å; F208-I220 HydrophobicContact CE1-CG1 3.86Å; L209-I220 HydrophobicContact CD1-CD1 4.19Å; A215-I220 HydrophobicContact CB-CD1 4.34Å; A215-I220 HydrophobicContact CB-CG1 4.15Å; A215-I220 WeakPolarHBondContact O-CD1 3.39Å; T216-I220 WeakPolarHBondContact O-CG1 3.29Å; T216-I220 PolarHBondContact O-N 3.02Å; T216-I220 VanDerWaalsContact O-N 3.07Å; K218-I220 VanDerWaalsContact C-N 3.27Å; K218-I220 PolarHBondContact O-N 3.18Å; I220-S223 PolarHBondContact O-OG 3.24Å; I220-L224 HydrophobicContact CG2-CD1 3.79Å; I220-L224 HydrophobicContact CG2-CG 4.46Å; I220-L224 VanDerWaalsContact O-CB 3.26Å; I220-L224 WeakPolarHBondContact O-CB 3.16Å; I220-L224 VanDerWaalsContact O-CG 3.28Å; I220-L224 WeakPolarHBondContact O-CG 3.44Å; I220-L224 PolarHBondContact O-N 3.01Å
221	K	86.9	Confident	87.4	Confident	141 Å²	141	79.3 Å²	79.3	61%	0.613	42%	0.422	S	S	*	.	H	α-helix	trans	-63.2	-46.8	177.6	-169.8	176.8	-179.5	179	0	111	T217 K218 G225	T217-K221 WeakPolarHBondContact O-CB 3.45Å; T217-K221 PolarHBondContact O-N 3.38Å; K218-K221 WeakPolarHBondContact O-CB 3.48Å; K218-K221 PolarHBondContact O-N 3.03Å; K221-G225 WeakPolarHBondContact O-CA 3.43Å; K221-G225 PolarHBondContact O-N 3.47Å
222	D	88.9	Confident	87.6	Confident	77 Å²	77	77.9 Å²	77.9	41%	0.412	42%	0.417	S	S	.	.	H	α-helix	trans	-75.6	-42.2	-175.5	-74.1	-4.6	0	0	0	113.2	K218 K226	K218-D222 PolarHBondContact O-N 3.28Å; D222-K226 WeakPolarHBondContact O-CD 3.24Å; D222-K226 VanDerWaalsContact O-CG 3.28Å; D222-K226 WeakPolarHBondContact O-CG 3.41Å; D222-K226 PolarHBondContact O-N 3.33Å; D222-K226 VanDerWaalsContact O-N 3.09Å
223	S	88.4	Confident	88.1	Confident	32 Å²	32	77.3 Å²	77.3	22%	0.224	42%	0.417	C	S	.	.	H	α-helix	trans	-65.7	-47.3	177.8	59.5	0	0	0	0	111.7	F208 D219 I220 K226 Q227	F208-S223 WeakPolarHBondContact CE2-OG 3.13Å; D219-S223 WeakPolarHBondContact O-CB 3.24Å; D219-S223 PolarHBondContact O-N 2.96Å; D219-S223 PolarHBondContact O-OG 3.07Å; I220-S223 PolarHBondContact O-OG 3.24Å; S223-K226 PolarHBondContact O-N 2.97Å; S223-Q227 WeakPolarHBondContact O-CG 3.1Å; S223-Q227 PolarHBondContact O-N 3.38Å
224	L	91.2	Very high	88.4	Confident	1 Å²	1	81.9 Å²	81.9	1%	0.005	43%	0.428	C	S	.	.	H	α-helix	trans	-72.1	-33.1	177.5	-60.7	-178.8	0	0	0	111.7	W200 Y201 E204 K205 F208 I220 K226 Q227 W228	W200-L224 HydrophobicContact CH2-CB 3.8Å; W200-L224 HydrophobicContact CH2-CD2 4.01Å; W200-L224 HydrophobicContact CH2-CG 4.48Å; W200-L224 WeakPolarHBondContact CH2-O 3.29Å; W200-L224 HydrophobicContact CZ2-CD2 4.48Å; W200-L224 HydrophobicContact CZ3-CB 3.93Å; W200-L224 WeakPolarHBondContact CZ3-O 3.42Å; Y201-L224 HydrophobicContact CD2-CB 3.72Å; Y201-L224 HydrophobicContact CD2-CD1 3.7Å; Y201-L224 HydrophobicContact CD2-CG 4.37Å; Y201-L224 HydrophobicContact CE2-CB 3.86Å; Y201-L224 HydrophobicContact CE2-CD1 3.68Å; Y201-L224 HydrophobicContact CE2-CG 4.34Å; E204-L224 HydrophobicContact CB-CD1 4.07Å; E204-L224 HydrophobicContact CB-CD2 3.65Å; K205-L224 HydrophobicContact CB-CD1 4.06Å; F208-L224 HydrophobicContact CD2-CD2 4.34Å; I220-L224 HydrophobicContact CG2-CD1 3.79Å; I220-L224 HydrophobicContact CG2-CG 4.46Å; I220-L224 VanDerWaalsContact O-CB 3.26Å; I220-L224 WeakPolarHBondContact O-CB 3.16Å; I220-L224 VanDerWaalsContact O-CG 3.28Å; I220-L224 WeakPolarHBondContact O-CG 3.44Å; I220-L224 PolarHBondContact O-N 3.01Å; L224-K226 VanDerWaalsContact C-N 3.34Å; L224-K226 PolarHBondContact O-N 3.36Å; L224-Q227 PolarHBondContact O-N 3.42Å; L224-W228 PolarHBondContact O-N 2.95Å
225	G	88.9	Confident	88.8	Confident	28 Å²	28	80.5 Å²	80.5	29%	0.289	41%	0.414	S	S	.	.	H	α-helix	trans	-56.4	-46.6	171.6	0	0	0	0	0	112.5	K221 W228 T229	K221-G225 WeakPolarHBondContact O-CA 3.43Å; K221-G225 PolarHBondContact O-N 3.47Å; G225-W228 PolarHBondContact O-N 3.46Å; G225-T229 PolarHBondContact O-N 3.24Å
226	K	90	Very high	89.2	Confident	134 Å²	134	82 Å²	82	58%	0.583	42%	0.415	S	S	*	.	H	α-helix	trans	-66	-38.6	175.2	-68.9	163.7	-172.6	169.6	0	112.4	D222 S223 L224 T229 Q230	D222-K226 WeakPolarHBondContact O-CD 3.24Å; D222-K226 VanDerWaalsContact O-CG 3.28Å; D222-K226 WeakPolarHBondContact O-CG 3.41Å; D222-K226 PolarHBondContact O-N 3.33Å; D222-K226 VanDerWaalsContact O-N 3.09Å; S223-K226 PolarHBondContact O-N 2.97Å; L224-K226 VanDerWaalsContact C-N 3.34Å; L224-K226 PolarHBondContact O-N 3.36Å; K226-T229 PolarHBondContact O-OG1 3.09Å; K226-Q230 VanDerWaalsContact O-CG 3.31Å; K226-Q230 WeakPolarHBondContact O-CG 3.47Å; K226-Q230 PolarHBondContact O-N 2.74Å
227	Q	91.6	Very high	89.5	Confident	86 Å²	86	79.6 Å²	79.6	40%	0.402	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-36.3	175.7	-73	179.6	21.8	0	0	112.8	W200 S223 L224 T229 Q230 L231	W200-Q227 HydrophobicContact CH2-CB 3.68Å; W200-Q227 HydrophobicContact CZ2-CB 3.88Å; S223-Q227 WeakPolarHBondContact O-CG 3.1Å; S223-Q227 PolarHBondContact O-N 3.38Å; L224-Q227 PolarHBondContact O-N 3.42Å; Q227-T229 PolarHBondContact O-N 3.37Å; Q227-Q230 CarbonylContact O-C 3.52Å; Q227-Q230 PolarHBondContact O-N 3.44Å; Q227-L231 WeakPolarHBondContact O-CG 3.47Å; Q227-L231 PolarHBondContact O-N 2.88Å
228	W	90.9	Very high	90.2	Very high	22 Å²	22	81.9 Å²	81.9	8%	0.083	40%	0.4	C	S	.	.	H	α-helix	trans	-61.6	-42.6	177.5	-179.7	-113.1	0	0	0	112.7	P196 Q197 W200 L224 G225 Q230 L231 R236	P196-W228 HydrophobicContact CB-CH2 4.02Å; P196-W228 HydrophobicContact CB-CZ2 4.43Å; Q197-W228 HydrophobicContact CB-CD2 4.09Å; Q197-W228 HydrophobicContact CB-CH2 4.29Å; Q197-W228 HydrophobicContact CB-CZ2 3.68Å; Q197-W228 HydrophobicContact CG-CD2 3.83Å; Q197-W228 HydrophobicContact CG-CG 3.85Å; Q197-W228 HydrophobicContact CG-CZ2 4.34Å; W200-W228 HydrophobicContact CB-CE3 3.98Å; W200-W228 HydrophobicContact CB-CZ3 3.61Å; W200-W228 AromaticContact CD2-CE3 3.56Å; W200-W228 HydrophobicContact CD2-CE3 3.56Å; W200-W228 HydrophobicContact CD2-CZ3 4.08Å; W200-W228 HydrophobicContact CE3-CB 3.99Å; W200-W228 HydrophobicContact CE3-CD2 4.14Å; W200-W228 AromaticContact CE3-CE3 3.48Å; W200-W228 HydrophobicContact CE3-CE3 3.48Å; W200-W228 VanDerWaalsContact CE3-CE3 3.48Å; W200-W228 HydrophobicContact CE3-CG 4.37Å; W200-W228 HydrophobicContact CE3-CZ3 4.31Å; W200-W228 AromaticContact CG-CE3 3.8Å; W200-W228 HydrophobicContact CG-CE3 3.8Å; W200-W228 AromaticContact CG-CZ3 3.79Å; W200-W228 HydrophobicContact CG-CZ3 3.79Å; W200-W228 HydrophobicContact CH2-CB 4.22Å; W200-W228 HydrophobicContact CZ3-CB 3.64Å; W200-W228 HydrophobicContact CZ3-CE3 4.31Å; W200-W228 HydrophobicContact CZ3-CG 4.48Å; L224-W228 PolarHBondContact O-N 2.95Å; G225-W228 PolarHBondContact O-N 3.46Å; W228-Q230 VanDerWaalsContact C-N 3.26Å; W228-Q230 PolarHBondContact O-N 3.19Å; W228-L231 HydrophobicContact CD2-CD1 4.48Å; W228-L231 HydrophobicContact CE3-CD1 3.44Å; W228-L231 VanDerWaalsContact CE3-CD1 3.44Å; W228-L231 HydrophobicContact CE3-CG 4.3Å; W228-L231 HydrophobicContact CZ3-CD1 3.61Å; W228-L231 PolarHBondContact O-N 2.78Å; W228-R236 HydrophobicContact CH2-CG 4.43Å; W228-R236 PolarHBondContact O-NH2 3.35Å
229	T	88.3	Confident	90.7	Very high	102 Å²	102	75.6 Å²	75.6	63%	0.626	37%	0.373	S	S	*	.	H	α-helix	trans	-69.8	-24.4	177.8	57.6	0	0	0	0	112.5	G225 K226 Q227 R236	G225-T229 PolarHBondContact O-N 3.24Å; K226-T229 PolarHBondContact O-OG1 3.09Å; Q227-T229 PolarHBondContact O-N 3.37Å; T229-R236 PolarHBondContact O-NH2 3.38Å
230	Q	90.9	Very high	90.9	Very high	157 Å²	157	71.7 Å²	71.7	73%	0.734	35%	0.352	S	S	*	.	H	α-helix	trans	-91.6	-8.1	175.4	-64.5	174.8	10.9	0	0	114.6	K226 Q227 W228 S232	K226-Q230 VanDerWaalsContact O-CG 3.31Å; K226-Q230 WeakPolarHBondContact O-CG 3.47Å; K226-Q230 PolarHBondContact O-N 2.74Å; Q227-Q230 CarbonylContact O-C 3.52Å; Q227-Q230 PolarHBondContact O-N 3.44Å; W228-Q230 VanDerWaalsContact C-N 3.26Å; W228-Q230 PolarHBondContact O-N 3.19Å; Q230-S232 PolarHBondContact O-N 3.09Å
231	L	91.5	Very high	91.1	Very high	19 Å²	19	74.3 Å²	74.3	10%	0.099	37%	0.37	C	S	.	.			trans	-59.8	132.8	177.3	-74.6	-166.5	0	0	0	112	W200 Q227 W228 K235 R236	W200-L231 HydrophobicContact CD2-CD1 4.09Å; W200-L231 HydrophobicContact CG-CD1 4.12Å; W200-L231 HydrophobicContact CZ2-CD2 4.46Å; Q227-L231 WeakPolarHBondContact O-CG 3.47Å; Q227-L231 PolarHBondContact O-N 2.88Å; W228-L231 HydrophobicContact CD2-CD1 4.48Å; W228-L231 HydrophobicContact CE3-CD1 3.44Å; W228-L231 VanDerWaalsContact CE3-CD1 3.44Å; W228-L231 HydrophobicContact CE3-CG 4.3Å; W228-L231 HydrophobicContact CZ3-CD1 3.61Å; W228-L231 PolarHBondContact O-N 2.78Å; L231-K235 HydrophobicContact CB-CB 4.48Å; L231-K235 HydrophobicContact CD1-CB 4.4Å; L231-K235 HydrophobicContact CD2-CB 4.41Å; L231-K235 HydrophobicContact CD2-CD 3.91Å; L231-R236 HydrophobicContact CB-CG 3.95Å; L231-R236 HydrophobicContact CD1-CG 4.48Å; L231-R236 PolarHBondContact O-NE 2.98Å; L231-R236 PolarHBondContact O-NH1 2.8Å; L231-R236 VanDerWaalsContact O-NH1 3.17Å; L231-R236 PolarHBondContact O-NH2 3.26Å
232	S	93.6	Very high	91.3	Very high	66 Å²	66	72.1 Å²	72.1	46%	0.462	36%	0.361	S	S	.	.			trans	-65.6	149.4	171	63.9	0	0	0	0	112.1	Q230 K234 K235 R236	Q230-S232 PolarHBondContact O-N 3.09Å; S232-K234 PolarHBondContact O-N 2.61Å; S232-K234 VanDerWaalsContact O-N 3.15Å; S232-K235 WeakPolarHBondContact O-CA 3.35Å; S232-K235 WeakPolarHBondContact O-CB 3.49Å; S232-K235 PolarHBondContact O-N 2.89Å; S232-R236 PolarHBondContact O-N 2.92Å
233	D	91.9	Very high	91.4	Very high	81 Å²	81	68.4 Å²	68.4	43%	0.433	34%	0.341	S	S	.	.	H	α-helix	trans	-51.9	-39.1	-178.7	-76.5	-2.1	0	0	0	113.3	K235 R236 L237 L283	D233-K235 VanDerWaalsContact C-N 3.32Å; D233-K235 PolarHBondContact O-N 3.32Å; D233-R236 PolarHBondContact O-N 3.48Å; D233-R236 IonicContact OD1-NH1 2.79Å; D233-L237 WeakPolarHBondContact O-CB 3.36Å; D233-L237 VanDerWaalsContact O-CG 3.31Å; D233-L237 WeakPolarHBondContact O-CG 3.43Å; D233-L237 PolarHBondContact O-N 3.09Å; D233-L283 HydrophobicContact CB-CD1 3.72Å; D233-L283 HydrophobicContact CB-CD2 4.13Å
234	K	91.3	Very high	91.5	Very high	184 Å²	184	69.3 Å²	69.3	80%	0.8	34%	0.343	S	S	*	.	H	α-helix	trans	-63.1	-34	175.1	-171.2	173.9	-178.4	177	0	113	S232	S232-K234 PolarHBondContact O-N 2.61Å; S232-K234 VanDerWaalsContact O-N 3.15Å
235	K	92.1	Very high	91.4	Very high	128 Å²	128	75.1 Å²	75.1	56%	0.557	37%	0.37	S	S	*	.	H	α-helix	trans	-73.8	-42.4	172.8	-71.9	-174.9	177.4	-177.6	0	111	L231 S232 D233 K238	L231-K235 HydrophobicContact CB-CB 4.48Å; L231-K235 HydrophobicContact CD1-CB 4.4Å; L231-K235 HydrophobicContact CD2-CB 4.41Å; L231-K235 HydrophobicContact CD2-CD 3.91Å; S232-K235 WeakPolarHBondContact O-CA 3.35Å; S232-K235 WeakPolarHBondContact O-CB 3.49Å; S232-K235 PolarHBondContact O-N 2.89Å; D233-K235 VanDerWaalsContact C-N 3.32Å; D233-K235 PolarHBondContact O-N 3.32Å; K235-K238 WeakPolarHBondContact O-CB 3.3Å; K235-K238 PolarHBondContact O-N 3.33Å
236	R	91.7	Very high	91.4	Very high	56 Å²	56	76.6 Å²	76.6	21%	0.211	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-45.5	176.3	-70.3	-179.9	173.2	136.9	3.9	112.4	W228 T229 L231 S232 D233 K238 W239 I240 L283	W228-R236 HydrophobicContact CH2-CG 4.43Å; W228-R236 PolarHBondContact O-NH2 3.35Å; T229-R236 PolarHBondContact O-NH2 3.38Å; L231-R236 HydrophobicContact CB-CG 3.95Å; L231-R236 HydrophobicContact CD1-CG 4.48Å; L231-R236 PolarHBondContact O-NE 2.98Å; L231-R236 PolarHBondContact O-NH1 2.8Å; L231-R236 VanDerWaalsContact O-NH1 3.17Å; L231-R236 PolarHBondContact O-NH2 3.26Å; S232-R236 PolarHBondContact O-N 2.92Å; D233-R236 PolarHBondContact O-N 3.48Å; D233-R236 IonicContact OD1-NH1 2.79Å; R236-K238 VanDerWaalsContact C-N 3.26Å; R236-K238 PolarHBondContact O-N 3.24Å; R236-W239 PolarHBondContact O-N 2.84Å; R236-I240 HydrophobicContact CB-CD1 4.32Å; R236-I240 WeakPolarHBondContact O-CG1 3.43Å; R236-I240 PolarHBondContact O-N 2.72Å; R236-L283 HydrophobicContact CB-CD2 3.84Å
237	L	92.5	Very high	91.2	Very high	37 Å²	37	71.5 Å²	71.5	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-56.4	-35.2	179.6	-78	168.3	0	0	0	113.5	D233 W239 I240 S241 L283 K284 S287	D233-L237 WeakPolarHBondContact O-CB 3.36Å; D233-L237 VanDerWaalsContact O-CG 3.31Å; D233-L237 WeakPolarHBondContact O-CG 3.43Å; D233-L237 PolarHBondContact O-N 3.09Å; L237-W239 VanDerWaalsContact C-N 3.31Å; L237-W239 PolarHBondContact O-N 3.2Å; L237-I240 HydrophobicContact CD2-CD1 4.36Å; L237-I240 PolarHBondContact O-N 2.94Å; L237-S241 PolarHBondContact O-N 3.15Å; L237-S241 PolarHBondContact O-OG 3.21Å; L237-L283 HydrophobicContact CD1-CD1 4.18Å; L237-L283 HydrophobicContact CD2-CD1 4.36Å; L237-L283 HydrophobicContact CD2-CG 3.88Å; L237-L283 HydrophobicContact CG-CD1 4.19Å; L237-L283 HydrophobicContact CG-CD2 4.26Å; L237-L283 HydrophobicContact CG-CG 3.98Å; L237-K284 HydrophobicContact CD2-CD 4.43Å; L237-S287 VanDerWaalsContact CD2-OG 3.26Å; L237-S287 WeakPolarHBondContact CD2-OG 3.37Å
238	K	94	Very high	90.9	Very high	139 Å²	139	73.3 Å²	73.3	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-57.4	-44.1	173.5	-176.3	-174.8	176.1	-174.6	0	111.8	K235 R236 K242	K235-K238 WeakPolarHBondContact O-CB 3.3Å; K235-K238 PolarHBondContact O-N 3.33Å; R236-K238 VanDerWaalsContact C-N 3.26Å; R236-K238 PolarHBondContact O-N 3.24Å; K238-K242 PolarHBondContact O-N 3.5Å
239	W	94.4	Very high	90.7	Very high	14 Å²	14	77.2 Å²	77.2	5%	0.053	38%	0.376	C	S	.	.	H	α-helix	trans	-78.8	-32.2	-178.7	-60.1	109.4	0	0	0	112.6	P196 L199 W200 H203 R236 L237 K242 S243	P196-W239 HydrophobicContact CB-CB 4Å; L199-W239 HydrophobicContact CB-CE3 3.84Å; L199-W239 HydrophobicContact CB-CZ3 4.25Å; L199-W239 WeakPolarHBondContact O-CZ3 3.33Å; W200-W239 HydrophobicContact CB-CD2 3.79Å; W200-W239 HydrophobicContact CB-CE3 4.35Å; W200-W239 HydrophobicContact CB-CG 3.85Å; W200-W239 HydrophobicContact CB-CZ2 4.42Å; W200-W239 AromaticContact CD1-CD1 3.93Å; W200-W239 AromaticContact CD1-CE2 3.58Å; W200-W239 AromaticContact CD1-CZ2 3.86Å; W200-W239 AromaticContact CD1-NE1 3.25Å; W200-W239 AromaticContact CG-NE1 3.84Å; H203-W239 HydrophobicContact CB-CH2 3.52Å; H203-W239 HydrophobicContact CB-CZ2 4.16Å; H203-W239 HydrophobicContact CB-CZ3 4.23Å; H203-W239 AromaticContact CD2-CH2 3.91Å; H203-W239 AromaticContact CG-CH2 3.54Å; H203-W239 AromaticContact ND1-CH2 3.96Å; H203-W239 AromaticContact ND1-CZ2 3.99Å; R236-W239 PolarHBondContact O-N 2.84Å; L237-W239 VanDerWaalsContact C-N 3.31Å; L237-W239 PolarHBondContact O-N 3.2Å; W239-K242 HydrophobicContact CE3-CD 4.33Å; W239-K242 HydrophobicContact CZ3-CD 4.2Å; W239-K242 PolarHBondContact O-N 3.14Å; W239-S243 WeakPolarHBondContact O-CB 3.41Å; W239-S243 PolarHBondContact O-N 2.82Å
240	I	92.3	Very high	90.6	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-61.7	-50.8	172.7	-68.4	166	0	0	0	110.3	P196 R236 L237 K242 S243 L244 L276 E280 L283 K284	P196-I240 HydrophobicContact CB-CG1 3.97Å; P196-I240 HydrophobicContact CG-CB 4.44Å; P196-I240 HydrophobicContact CG-CG1 3.9Å; R236-I240 HydrophobicContact CB-CD1 4.32Å; R236-I240 WeakPolarHBondContact O-CG1 3.43Å; R236-I240 PolarHBondContact O-N 2.72Å; L237-I240 HydrophobicContact CD2-CD1 4.36Å; L237-I240 PolarHBondContact O-N 2.94Å; I240-K242 VanDerWaalsContact C-N 3.32Å; I240-K242 PolarHBondContact O-N 3.01Å; I240-S243 PolarHBondContact O-N 2.88Å; I240-L244 HydrophobicContact CG2-CD1 4.3Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.27Å; I240-L276 HydrophobicContact CB-CD2 4.47Å; I240-L276 HydrophobicContact CG1-CD2 4.49Å; I240-L276 HydrophobicContact CG2-CD1 3.81Å; I240-L276 HydrophobicContact CG2-CD2 3.88Å; I240-E280 HydrophobicContact CD1-CB 3.8Å; I240-E280 HydrophobicContact CD1-CG 4.01Å; I240-E280 HydrophobicContact CG1-CB 4.02Å; I240-E280 HydrophobicContact CG1-CG 4.16Å; I240-L283 HydrophobicContact CD1-CD2 3.94Å; I240-L283 HydrophobicContact CD1-CG 4.31Å; I240-K284 HydrophobicContact CG2-CB 3.95Å; I240-K284 HydrophobicContact CG2-CD 4.18Å; I240-K284 HydrophobicContact CG2-CG 4.1Å
241	S	91	Very high	90.2	Very high	56 Å²	56	68.4 Å²	68.4	39%	0.392	33%	0.327	S	S	.	.	H	α-helix	trans	-59.3	-41.8	175.7	-64	0	0	0	0	112.2	L237 S243 L244 E245	L237-S241 PolarHBondContact O-N 3.15Å; L237-S241 PolarHBondContact O-OG 3.21Å; S241-S243 PolarHBondContact O-N 2.98Å; S241-L244 PolarHBondContact O-N 3.18Å; S241-E245 WeakPolarHBondContact O-CB 3.48Å; S241-E245 PolarHBondContact O-N 3.07Å
242	K	91.8	Very high	89.9	Confident	95 Å²	95	71 Å²	71	41%	0.413	34%	0.338	S	S	.	.	H	α-helix	trans	-67.2	-33.6	177.8	-166.4	174.7	-176.8	175.6	0	113.4	L199 K238 W239 I240 Q246	L199-K242 HydrophobicContact CD1-CB 4.39Å; L199-K242 HydrophobicContact CD1-CG 4.23Å; K238-K242 PolarHBondContact O-N 3.5Å; W239-K242 HydrophobicContact CE3-CD 4.33Å; W239-K242 HydrophobicContact CZ3-CD 4.2Å; W239-K242 PolarHBondContact O-N 3.14Å; I240-K242 VanDerWaalsContact C-N 3.32Å; I240-K242 PolarHBondContact O-N 3.01Å; K242-Q246 WeakPolarHBondContact O-CG 3.26Å; K242-Q246 PolarHBondContact O-N 3.46Å; K242-Q246 VanDerWaalsContact O-N 3.11Å
243	S	92.1	Very high	89.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-69.4	-41.2	173.9	-174	0	0	0	0	111.6	K194 W239 I240 S241 Q246 Q247 T275	K194-S243 WeakPolarHBondContact O-CB 3.47Å; K194-S243 PolarHBondContact O-OG 2.94Å; W239-S243 WeakPolarHBondContact O-CB 3.41Å; W239-S243 PolarHBondContact O-N 2.82Å; I240-S243 PolarHBondContact O-N 2.88Å; S241-S243 PolarHBondContact O-N 2.98Å; S243-Q246 PolarHBondContact O-N 3.4Å; S243-Q247 WeakPolarHBondContact O-CB 2.91Å; S243-Q247 PolarHBondContact O-N 3.32Å; S243-T275 WeakPolarHBondContact OG-CB 3.48Å; S243-T275 PolarHBondContact OG-OG1 3.13Å
244	L	89.6	Confident	89	Confident	51 Å²	51	66.2 Å²	66.2	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-38.8	174.8	-70.8	172.7	0	0	0	112.5	I240 S241 Q247 K248 L276 K284	I240-L244 HydrophobicContact CG2-CD1 4.3Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.27Å; S241-L244 PolarHBondContact O-N 3.18Å; L244-Q247 PolarHBondContact O-N 3.47Å; L244-K248 PolarHBondContact O-N 2.81Å; L244-L276 HydrophobicContact CD1-CD1 4.11Å; L244-L276 HydrophobicContact CD2-CD1 3.88Å; L244-L276 HydrophobicContact CD2-CG 4.11Å; L244-L276 HydrophobicContact CG-CD1 4.09Å; L244-L276 HydrophobicContact CG-CG 4.46Å; L244-K284 HydrophobicContact CD1-CD 4.39Å; L244-K284 HydrophobicContact CD1-CG 4.17Å
245	E	89.3	Confident	88.5	Confident	122 Å²	122	64.7 Å²	64.7	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-60.8	-46.9	173.4	-178.5	176.9	-142.3	0	0	111.4	S241 Q247 K248 L249	S241-E245 WeakPolarHBondContact O-CB 3.48Å; S241-E245 PolarHBondContact O-N 3.07Å; E245-Q247 PolarHBondContact O-N 3.04Å; E245-K248 PolarHBondContact O-N 3.36Å; E245-L249 WeakPolarHBondContact O-CG 3.33Å; E245-L249 PolarHBondContact O-N 3.25Å; E245-L249 VanDerWaalsContact O-N 3.08Å
246	Q	88.4	Confident	88.1	Confident	60 Å²	60	64.1 Å²	64.1	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-37.5	173.3	-73.2	-171.2	-6.2	0	0	113.1	P193 K242 S243 K248 L249 Y250	P193-Q246 HydrophobicContact CB-CB 4.26Å; K242-Q246 WeakPolarHBondContact O-CG 3.26Å; K242-Q246 PolarHBondContact O-N 3.46Å; K242-Q246 VanDerWaalsContact O-N 3.11Å; S243-Q246 PolarHBondContact O-N 3.4Å; Q246-K248 VanDerWaalsContact C-N 3.34Å; Q246-K248 PolarHBondContact O-N 3.25Å; Q246-L249 PolarHBondContact O-N 2.89Å; Q246-Y250 WeakPolarHBondContact O-CB 3.32Å; Q246-Y250 PolarHBondContact O-N 2.94Å
247	Q	85.4	Confident	87.6	Confident	27 Å²	27	63.1 Å²	63.1	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-42.7	175.1	-170.6	-172.8	-45.2	0	0	110.9	P193 S243 L244 E245 Y250 E251 T275	P193-Q247 HydrophobicContact CB-CB 4.17Å; P193-Q247 HydrophobicContact CG-CB 4.13Å; P193-Q247 HydrophobicContact CG-CG 4.1Å; S243-Q247 WeakPolarHBondContact O-CB 2.91Å; S243-Q247 PolarHBondContact O-N 3.32Å; L244-Q247 PolarHBondContact O-N 3.47Å; E245-Q247 PolarHBondContact O-N 3.04Å; Q247-Y250 PolarHBondContact O-N 3.13Å; Q247-E251 PolarHBondContact NE2-OE1 2.91Å; Q247-E251 WeakPolarHBondContact O-CB 2.85Å; Q247-E251 WeakPolarHBondContact O-CG 3.12Å; Q247-E251 PolarHBondContact O-N 3.43Å; Q247-T275 HydrophobicContact CB-CG2 4.28Å; Q247-T275 HydrophobicContact CG-CG2 4.37Å
248	K	86	Confident	86.8	Confident	123 Å²	123	64 Å²	64	54%	0.535	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-49	175.3	-176.3	-169.9	165.6	-170.6	0	111.7	L244 E245 Q246 Y250 E251 E252	L244-K248 PolarHBondContact O-N 2.81Å; E245-K248 PolarHBondContact O-N 3.36Å; Q246-K248 VanDerWaalsContact C-N 3.34Å; Q246-K248 PolarHBondContact O-N 3.25Å; K248-Y250 VanDerWaalsContact C-N 3.3Å; K248-Y250 PolarHBondContact O-N 3.41Å; K248-E251 PolarHBondContact O-N 3.25Å; K248-E251 VanDerWaalsContact O-N 3.16Å; K248-E252 VanDerWaalsContact CE-CD 3.47Å; K248-E252 WeakPolarHBondContact CE-OE1 3.49Å; K248-E252 IonicContact NZ-OE1 2.67Å; K248-E252 WeakPolarHBondContact O-CG 3.42Å; K248-E252 PolarHBondContact O-N 3.18Å
249	L	86.8	Confident	86.1	Confident	105 Å²	105	65.5 Å²	65.5	55%	0.55	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-39.3	179.2	-68.3	170.9	0	0	0	111.8	E245 Q246 E252 A253	E245-L249 WeakPolarHBondContact O-CG 3.33Å; E245-L249 PolarHBondContact O-N 3.25Å; E245-L249 VanDerWaalsContact O-N 3.08Å; Q246-L249 PolarHBondContact O-N 2.89Å; L249-E252 PolarHBondContact O-N 3.48Å; L249-A253 WeakPolarHBondContact O-CB 3.45Å; L249-A253 PolarHBondContact O-N 3.41Å
250	Y	85.6	Confident	85.2	Confident	28 Å²	28	70.6 Å²	70.6	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-65.1	-43.6	172.3	170	-100.9	0	0	0	112.7	P190 E191 P193 Q246 Q247 K248 E252 A253 M254 I271	P190-Y250 HydrophobicContact CB-CD2 3.85Å; P190-Y250 HydrophobicContact CB-CE2 4.12Å; E191-Y250 WeakPolarHBondContact O-CD2 3.46Å; P193-Y250 HydrophobicContact CG-CD1 3.97Å; P193-Y250 HydrophobicContact CG-CG 4.17Å; Q246-Y250 WeakPolarHBondContact O-CB 3.32Å; Q246-Y250 PolarHBondContact O-N 2.94Å; Q247-Y250 PolarHBondContact O-N 3.13Å; K248-Y250 VanDerWaalsContact C-N 3.3Å; K248-Y250 PolarHBondContact O-N 3.41Å; Y250-E252 PolarHBondContact O-N 3.12Å; Y250-A253 PolarHBondContact O-N 3.26Å; Y250-M254 HydrophobicContact CD1-CG 4.19Å; Y250-M254 HydrophobicContact CD2-CG 3.76Å; Y250-M254 HydrophobicContact CE1-CG 3.88Å; Y250-M254 HydrophobicContact CE2-CG 3.41Å; Y250-M254 VanDerWaalsContact CE2-CG 3.41Å; Y250-M254 HydrophobicContact CE2-SD 3.82Å; Y250-M254 HydrophobicContact CG-CG 4.15Å; Y250-M254 VanDerWaalsContact CZ-CG 3.5Å; Y250-M254 VanDerWaalsContact O-CB 3.22Å; Y250-M254 WeakPolarHBondContact O-CB 3.48Å; Y250-M254 VanDerWaalsContact O-CG 3.26Å; Y250-M254 WeakPolarHBondContact O-CG 3.48Å; Y250-M254 PolarHBondContact O-N 3.19Å; Y250-I271 HydrophobicContact CE1-CG2 4.09Å
251	E	83.7	Confident	84.1	Confident	46 Å²	46	73.2 Å²	73.2	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-28.3	176.7	-77	179.1	-158.1	0	0	112.9	Q247 K248 R255	Q247-E251 PolarHBondContact NE2-OE1 2.91Å; Q247-E251 WeakPolarHBondContact O-CB 2.85Å; Q247-E251 WeakPolarHBondContact O-CG 3.12Å; Q247-E251 PolarHBondContact O-N 3.43Å; K248-E251 PolarHBondContact O-N 3.25Å; K248-E251 VanDerWaalsContact O-N 3.16Å; E251-R255 WeakPolarHBondContact O-CB 3.25Å; E251-R255 PolarHBondContact O-N 3.48Å
252	E	84.6	Confident	83	Confident	72 Å²	72	75.4 Å²	75.4	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-77.7	-49.2	173.8	-72.9	171.8	166.8	0	0	111.1	K248 L249 Y250 M254 R255 E256	K248-E252 VanDerWaalsContact CE-CD 3.47Å; K248-E252 WeakPolarHBondContact CE-OE1 3.49Å; K248-E252 IonicContact NZ-OE1 2.67Å; K248-E252 WeakPolarHBondContact O-CG 3.42Å; K248-E252 PolarHBondContact O-N 3.18Å; L249-E252 PolarHBondContact O-N 3.48Å; Y250-E252 PolarHBondContact O-N 3.12Å; E252-M254 PolarHBondContact O-N 3.37Å; E252-R255 WeakPolarHBondContact O-CB 3.42Å; E252-R255 PolarHBondContact O-N 3.36Å; E252-R255 VanDerWaalsContact O-N 3.14Å; E252-E256 PolarHBondContact O-N 3.24Å; E252-E256 VanDerWaalsContact O-N 3.12Å
253	A	85.4	Confident	81.2	Confident	41 Å²	41	77.1 Å²	77.1	34%	0.339	37%	0.371	S	S	.	.	H	α-helix	trans	-61.5	-40.5	175.9	0	0	0	0	0	112.9	P190 L249 Y250 R255 E256 Y257	P190-A253 HydrophobicContact CB-CB 4.07Å; P190-A253 HydrophobicContact CG-CB 3.72Å; L249-A253 WeakPolarHBondContact O-CB 3.45Å; L249-A253 PolarHBondContact O-N 3.41Å; Y250-A253 PolarHBondContact O-N 3.26Å; A253-R255 VanDerWaalsContact C-N 3.31Å; A253-R255 PolarHBondContact O-N 3.45Å; A253-E256 PolarHBondContact O-N 3.24Å; A253-Y257 WeakPolarHBondContact O-CB 3.49Å; A253-Y257 PolarHBondContact O-N 3.4Å
254	M	80.3	Confident	79.6	Confident	6 Å²	6	81.3 Å²	81.3	3%	0.03	39%	0.393	C	S	.	.	H	α-helix	trans	-66.5	-31	175.5	-76.8	-62.7	-62.3	0	0	112.6	V189 P190 Y250 E252 T258 M266 I271	V189-M254 HydrophobicContact CG1-SD 4.3Å; P190-M254 HydrophobicContact CB-CG 4.28Å; P190-M254 HydrophobicContact CB-SD 4.05Å; P190-M254 HydrophobicContact CG-CG 4.24Å; P190-M254 HydrophobicContact CG-SD 3.83Å; Y250-M254 HydrophobicContact CD1-CG 4.19Å; Y250-M254 HydrophobicContact CD2-CG 3.76Å; Y250-M254 HydrophobicContact CE1-CG 3.88Å; Y250-M254 HydrophobicContact CE2-CG 3.41Å; Y250-M254 VanDerWaalsContact CE2-CG 3.41Å; Y250-M254 HydrophobicContact CE2-SD 3.82Å; Y250-M254 HydrophobicContact CG-CG 4.15Å; Y250-M254 VanDerWaalsContact CZ-CG 3.5Å; Y250-M254 VanDerWaalsContact O-CB 3.22Å; Y250-M254 WeakPolarHBondContact O-CB 3.48Å; Y250-M254 VanDerWaalsContact O-CG 3.26Å; Y250-M254 WeakPolarHBondContact O-CG 3.48Å; Y250-M254 PolarHBondContact O-N 3.19Å; E252-M254 PolarHBondContact O-N 3.37Å; M254-T258 VanDerWaalsContact O-CB 3.29Å; M254-T258 WeakPolarHBondContact O-CB 3.38Å; M254-T258 PolarHBondContact O-N 3.49Å; M254-T258 PolarHBondContact O-OG1 2.76Å; M254-M266 HydrophobicContact CE-CG 4.4Å; M254-I271 HydrophobicContact CB-CD1 4.47Å; M254-I271 HydrophobicContact CB-CG2 3.92Å; M254-I271 HydrophobicContact CE-CD1 4.02Å; M254-I271 HydrophobicContact CE-CG1 4.05Å; M254-I271 HydrophobicContact CG-CG2 4.2Å
255	R	81.6	Confident	77.6	Confident	153 Å²	153	86 Å²	86	58%	0.577	42%	0.418	S	S	*	.	H	α-helix	trans	-69.3	-40.1	175.3	-171.8	-171.6	-51.6	133.4	14	111.2	E251 E252 A253 K259	E251-R255 WeakPolarHBondContact O-CB 3.25Å; E251-R255 PolarHBondContact O-N 3.48Å; E252-R255 WeakPolarHBondContact O-CB 3.42Å; E252-R255 PolarHBondContact O-N 3.36Å; E252-R255 VanDerWaalsContact O-N 3.14Å; A253-R255 VanDerWaalsContact C-N 3.31Å; A253-R255 PolarHBondContact O-N 3.45Å; R255-K259 WeakPolarHBondContact O-CB 3.29Å; R255-K259 PolarHBondContact O-N 2.93Å
256	E	82.9	Confident	76.1	Confident	115 Å²	115	84.3 Å²	84.3	54%	0.537	41%	0.411	S	S	.	.	H	α-helix	trans	-66.5	-48.7	173.2	-178.6	130.3	-121.5	0	0	111.4	E252 A253 T258 K259 Q260	E252-E256 PolarHBondContact O-N 3.24Å; E252-E256 VanDerWaalsContact O-N 3.12Å; A253-E256 PolarHBondContact O-N 3.24Å; E256-T258 VanDerWaalsContact C-N 3.35Å; E256-T258 PolarHBondContact O-N 3.19Å; E256-K259 WeakPolarHBondContact O-CA 3.37Å; E256-K259 WeakPolarHBondContact O-CB 3.44Å; E256-K259 PolarHBondContact O-N 3.47Å; E256-Q260 VanDerWaalsContact CG-NE2 3.32Å; E256-Q260 WeakPolarHBondContact O-CG 3.39Å; E256-Q260 PolarHBondContact O-N 2.95Å
257	Y	81.1	Confident	74.3	Confident	36 Å²	36	84.9 Å²	84.9	14%	0.141	42%	0.422	C	S	.	.	H	α-helix	trans	-56.8	-44.4	175.8	-174.7	-103.2	0	0	0	112.5	N188 V189 A253 K259 Q260 H261 L264	N188-Y257 HydrophobicContact CB-CE2 4.18Å; V189-Y257 HydrophobicContact CG2-CE1 3.95Å; A253-Y257 WeakPolarHBondContact O-CB 3.49Å; A253-Y257 PolarHBondContact O-N 3.4Å; Y257-K259 VanDerWaalsContact C-N 3.26Å; Y257-K259 PolarHBondContact O-N 3.08Å; Y257-Q260 PolarHBondContact O-N 2.86Å; Y257-Q260 VanDerWaalsContact O-N 3.13Å; Y257-H261 AromaticContact CD2-CD2 3.69Å; Y257-H261 AromaticContact CE2-CD2 3.23Å; Y257-H261 WeakPolarHBondContact CE2-CD2 3.38Å; Y257-H261 AromaticContact CE2-NE2 3.61Å; Y257-H261 AromaticContact CZ-CD2 3.56Å; Y257-H261 PolarHBondContact O-N 3.35Å; Y257-L264 HydrophobicContact CE1-CD1 3.84Å; Y257-L264 VanDerWaalsContact OH-CD1 3.27Å; Y257-L264 WeakPolarHBondContact OH-CD1 3.23Å
258	T	76.8	Confident	72.8	Confident	55 Å²	55	90.9 Å²	90.9	34%	0.337	45%	0.45	S	S	.	.	H	α-helix	trans	-66.4	-26.6	176.7	-52.2	0	0	0	0	112.7	M254 E256	M254-T258 VanDerWaalsContact O-CB 3.29Å; M254-T258 WeakPolarHBondContact O-CB 3.38Å; M254-T258 PolarHBondContact O-N 3.49Å; M254-T258 PolarHBondContact O-OG1 2.76Å; E256-T258 VanDerWaalsContact C-N 3.35Å; E256-T258 PolarHBondContact O-N 3.19Å
259	K	78.4	Confident	71.1	Confident	170 Å²	170	87.8 Å²	87.8	74%	0.739	45%	0.453	S	S	*	.	H	α-helix	trans	-76.5	-31.7	173.4	-177.4	-167.8	170.5	-161.4	0	111.7	R255 E256 Y257	R255-K259 WeakPolarHBondContact O-CB 3.29Å; R255-K259 PolarHBondContact O-N 2.93Å; E256-K259 WeakPolarHBondContact O-CA 3.37Å; E256-K259 WeakPolarHBondContact O-CB 3.44Å; E256-K259 PolarHBondContact O-N 3.47Å; Y257-K259 VanDerWaalsContact C-N 3.26Å; Y257-K259 PolarHBondContact O-N 3.08Å
260	Q	76.6	Confident	69.4	Low	122 Å²	122	86.9 Å²	86.9	57%	0.57	45%	0.449	S	S	*	.	H	α-helix	trans	-80.7	-26.1	178.2	-66.7	178.4	18	0	0	112.9	E256 Y257 P262	E256-Q260 VanDerWaalsContact CG-NE2 3.32Å; E256-Q260 WeakPolarHBondContact O-CG 3.39Å; E256-Q260 PolarHBondContact O-N 2.95Å; Y257-Q260 PolarHBondContact O-N 2.86Å; Y257-Q260 VanDerWaalsContact O-N 3.13Å; Q260-P262 WeakPolarHBondContact O-CD 3.18Å
261	H	69.1	Low	68	Low	55 Å²	55	86.6 Å²	86.6	26%	0.255	45%	0.449	S	S	.	.			trans	-123.7	74.6	179.8	-67.4	-72.7	0	0	0	113.8	Y257 E263 L264	Y257-H261 AromaticContact CD2-CD2 3.69Å; Y257-H261 AromaticContact CE2-CD2 3.23Å; Y257-H261 WeakPolarHBondContact CE2-CD2 3.38Å; Y257-H261 AromaticContact CE2-NE2 3.61Å; Y257-H261 AromaticContact CZ-CD2 3.56Å; Y257-H261 PolarHBondContact O-N 3.35Å; H261-E263 WeakPolarHBondContact CA-OE1 3.45Å; H261-E263 WeakPolarHBondContact CB-OE1 3.34Å; H261-E263 IonicContact CG-OE1 2.68Å; H261-E263 IonicContact ND1-OE1 2.83Å; H261-E263 PolarHBondContact ND1-OE1 3.33Å; H261-E263 PolarHBondContact O-N 3.44Å; H261-L264 HydrophobicContact CB-CD1 3.87Å; H261-L264 HydrophobicContact CB-CG 4.28Å; H261-L264 PolarHBondContact O-N 3.09Å
262	P	68.3	Low	66.7	Low	101 Å²	101	90 Å²	90	66%	0.656	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-58.5	-32.1	178.3	-24.1	34.9	0	0	0	114.2	Q260 L264	Q260-P262 WeakPolarHBondContact O-CD 3.18Å; P262-L264 VanDerWaalsContact C-N 3.3Å; P262-L264 PolarHBondContact O-N 3.17Å
263	E	54	Low	65.7	Low	132 Å²	132	93 Å²	93	62%	0.617	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-65.1	-24.3	-177.4	60.6	-73.7	163.2	0	0	114.6	H261 N265	H261-E263 WeakPolarHBondContact CA-OE1 3.45Å; H261-E263 WeakPolarHBondContact CB-OE1 3.34Å; H261-E263 IonicContact CG-OE1 2.68Å; H261-E263 IonicContact ND1-OE1 2.83Å; H261-E263 PolarHBondContact ND1-OE1 3.33Å; H261-E263 PolarHBondContact O-N 3.44Å; E263-N265 VanDerWaalsContact C-N 3.31Å; E263-N265 PolarHBondContact O-N 3.25Å
264	L	57.6	Low	65.2	Low	87 Å²	87	94.1 Å²	94.1	46%	0.455	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-78.2	-7.6	-173.9	-77.1	175.5	0	0	0	115.1	Y257 H261 P262 M266	Y257-L264 HydrophobicContact CE1-CD1 3.84Å; Y257-L264 VanDerWaalsContact OH-CD1 3.27Å; Y257-L264 WeakPolarHBondContact OH-CD1 3.23Å; H261-L264 HydrophobicContact CB-CD1 3.87Å; H261-L264 HydrophobicContact CB-CG 4.28Å; H261-L264 PolarHBondContact O-N 3.09Å; P262-L264 VanDerWaalsContact C-N 3.3Å; P262-L264 PolarHBondContact O-N 3.17Å; L264-M266 PolarHBondContact O-N 3.06Å
265	N	47.8	Very low	65.3	Low	151 Å²	151	94.6 Å²	94.6	81%	0.807	49%	0.487	S	S	*	.			trans	43.4	39.6	171.4	-159.5	4.9	0	0	0	115.1	E263 S267	E263-N265 VanDerWaalsContact C-N 3.31Å; E263-N265 PolarHBondContact O-N 3.25Å; N265-S267 PolarHBondContact O-N 3.44Å; N265-S267 VanDerWaalsContact O-N 3.14Å
266	M	57.2	Low	65.5	Low	86 Å²	86	88.2 Å²	88.2	42%	0.424	46%	0.464	S	S	.	.			trans	-74.9	104.5	-171.2	-172.3	61.1	63.2	0	0	111.2	M254 L264 Q268 I271	M254-M266 HydrophobicContact CE-CG 4.4Å; L264-M266 PolarHBondContact O-N 3.06Å; M266-Q268 PolarHBondContact O-N 3.09Å; M266-I271 HydrophobicContact CG-CD1 4.21Å; M266-I271 HydrophobicContact CG-CG1 4.27Å
267	S	52	Low	65.7	Low	72 Å²	72	86.5 Å²	86.5	50%	0.503	46%	0.461	S	S	.	.			trans	-61.7	133.3	-176.7	77.8	0	0	0	0	112.8	N265 G269 N270	N265-S267 PolarHBondContact O-N 3.44Å; N265-S267 VanDerWaalsContact O-N 3.14Å; S267-G269 PolarHBondContact O-N 2.78Å; S267-N270 PolarHBondContact O-N 3.37Å
268	Q	52.3	Low	65.8	Low	152 Å²	152	94.2 Å²	94.2	71%	0.71	50%	0.495	S	S	*	.	H	α-helix	trans	-53.7	-28.1	-178.8	-70	-177.6	-18.1	0	0	113.6	M266 N270 I271 M272	M266-Q268 PolarHBondContact O-N 3.09Å; Q268-N270 PolarHBondContact O-N 3.35Å; Q268-I271 PolarHBondContact O-N 3.08Å; Q268-M272 PolarHBondContact O-N 3.33Å; Q268-M272 VanDerWaalsContact O-N 3.11Å
269	G	50.1	Low	66.2	Low	58 Å²	58	95 Å²	95	60%	0.598	51%	0.508	S	S	*	.	H	α-helix	trans	-64.7	-20.3	178	0	0	0	0	0	115.1	S267	S267-G269 PolarHBondContact O-N 2.78Å
270	N	51.8	Low	66.8	Low	87 Å²	87	87.7 Å²	87.7	47%	0.465	48%	0.476	S	S	.	.	H	α-helix	trans	-86.5	-23.1	170.8	-93.6	-22.8	0	0	0	113.2	S267 Q268 K273	S267-N270 PolarHBondContact O-N 3.37Å; Q268-N270 PolarHBondContact O-N 3.35Å; N270-K273 VanDerWaalsContact OD1-CE 3.3Å; N270-K273 WeakPolarHBondContact OD1-CE 3.27Å; N270-K273 PolarHBondContact OD1-NZ 2.91Å
271	I	55.8	Low	67.3	Low	22 Å²	22	85.2 Å²	85.2	11%	0.113	46%	0.462	C	S	.	.	H	α-helix	trans	-80.3	-43.6	-179.1	-54.2	177.4	0	0	0	110.3	Y250 M254 M266 Q268 K273	Y250-I271 HydrophobicContact CE1-CG2 4.09Å; M254-I271 HydrophobicContact CB-CD1 4.47Å; M254-I271 HydrophobicContact CB-CG2 3.92Å; M254-I271 HydrophobicContact CE-CD1 4.02Å; M254-I271 HydrophobicContact CE-CG1 4.05Å; M254-I271 HydrophobicContact CG-CG2 4.2Å; M266-I271 HydrophobicContact CG-CD1 4.21Å; M266-I271 HydrophobicContact CG-CG1 4.27Å; Q268-I271 PolarHBondContact O-N 3.08Å; I271-K273 VanDerWaalsContact C-N 3.29Å; I271-K273 PolarHBondContact O-N 3.39Å; I271-K273 VanDerWaalsContact O-N 3.09Å
272	M	56.8	Low	68.1	Low	117 Å²	117	86.9 Å²	86.9	58%	0.576	47%	0.469	S	S	*	.			trans	-85.5	36.2	-172.4	-57.5	-174.7	76.3	0	0	115	Q268 S274	Q268-M272 PolarHBondContact O-N 3.33Å; Q268-M272 VanDerWaalsContact O-N 3.11Å; M272-S274 PolarHBondContact O-N 3.27Å
273	K	64.1	Low	69.1	Low	136 Å²	136	83.1 Å²	83.1	59%	0.591	44%	0.444	S	S	*	.			trans	-83.9	102.3	177.3	-70.8	-179.9	-177.4	168.7	0	110.4	N270 I271 T275	N270-K273 VanDerWaalsContact OD1-CE 3.3Å; N270-K273 WeakPolarHBondContact OD1-CE 3.27Å; N270-K273 PolarHBondContact OD1-NZ 2.91Å; I271-K273 VanDerWaalsContact C-N 3.29Å; I271-K273 PolarHBondContact O-N 3.39Å; I271-K273 VanDerWaalsContact O-N 3.09Å; K273-T275 PolarHBondContact O-N 3.34Å
274	S	74.6	Confident	70.8	Confident	64 Å²	64	78.7 Å²	78.7	45%	0.448	42%	0.422	S	S	.	.			trans	-43.6	125.4	176.1	170.7	0	0	0	0	113.3	M272 L276	M272-S274 PolarHBondContact O-N 3.27Å; S274-L276 VanDerWaalsContact C-N 3.31Å; S274-L276 PolarHBondContact O-N 2.94Å; S274-L276 PolarHBondContact OG-N 2.98Å; S274-L276 PolarHBondContact OG-O 3.33Å
275	T	81.3	Confident	72.3	Confident	16 Å²	16	76 Å²	76	10%	0.098	41%	0.409	C	S	.	.			trans	-73.5	-20.1	176.3	61.5	0	0	0	0	114.1	P193 S243 Q247 K273	P193-T275 HydrophobicContact CB-CG2 3.89Å; P193-T275 HydrophobicContact CG-CG2 3.61Å; S243-T275 WeakPolarHBondContact OG-CB 3.48Å; S243-T275 PolarHBondContact OG-OG1 3.13Å; Q247-T275 HydrophobicContact CB-CG2 4.28Å; Q247-T275 HydrophobicContact CG-CG2 4.37Å; K273-T275 PolarHBondContact O-N 3.34Å
276	L	86.9	Confident	74.2	Confident	19 Å²	19	75.1 Å²	75.1	10%	0.099	40%	0.397	C	S	.	.	S	Bend	trans	-85.7	136.5	-175.9	-54.9	-171.3	0	0	0	112.6	P196 I240 L244 S274 E280	P196-L276 HydrophobicContact CG-CD2 3.41Å; P196-L276 VanDerWaalsContact CG-CD2 3.41Å; I240-L276 HydrophobicContact CB-CD2 4.47Å; I240-L276 HydrophobicContact CG1-CD2 4.49Å; I240-L276 HydrophobicContact CG2-CD1 3.81Å; I240-L276 HydrophobicContact CG2-CD2 3.88Å; L244-L276 HydrophobicContact CD1-CD1 4.11Å; L244-L276 HydrophobicContact CD2-CD1 3.88Å; L244-L276 HydrophobicContact CD2-CG 4.11Å; L244-L276 HydrophobicContact CG-CD1 4.09Å; L244-L276 HydrophobicContact CG-CG 4.46Å; S274-L276 VanDerWaalsContact C-N 3.31Å; S274-L276 PolarHBondContact O-N 2.94Å; S274-L276 PolarHBondContact OG-N 2.98Å; S274-L276 PolarHBondContact OG-O 3.33Å; L276-E280 HydrophobicContact CB-CB 4.25Å; L276-E280 HydrophobicContact CD2-CB 4.42Å
277	T	86.8	Confident	75.7	Confident	78 Å²	78	73.7 Å²	73.7	48%	0.479	40%	0.396	S	S	.	.			trans	-67.9	167.3	164.4	65	0	0	0	0	111.8	A279 E280 R281	T277-A279 VanDerWaalsContact C-N 3.26Å; T277-A279 PolarHBondContact O-N 3.17Å; T277-E280 VanDerWaalsContact CB-OE2 3.26Å; T277-E280 WeakPolarHBondContact CB-OE2 2.89Å; T277-E280 VanDerWaalsContact CG2-OE2 3.27Å; T277-E280 WeakPolarHBondContact CG2-OE2 3.42Å; T277-E280 PolarHBondContact N-OE2 3.12Å; T277-E280 PolarHBondContact O-N 3.01Å; T277-E280 VanDerWaalsContact OG1-CD 3.26Å; T277-E280 WeakPolarHBondContact OG1-CG 3.37Å; T277-E280 PolarHBondContact OG1-N 2.91Å; T277-E280 PolarHBondContact OG1-OE2 3.44Å; T277-R281 WeakPolarHBondContact O-CB 3.38Å; T277-R281 PolarHBondContact O-N 2.66Å
278	K	83.8	Confident	77.3	Confident	198 Å²	198	73.9 Å²	73.9	86%	0.861	39%	0.391	S	S	*	.	H	α-helix	trans	-59	-35.1	176.4	-172.2	-179.1	178.6	-174.4	0	113	H282	K278-H282 PolarHBondContact O-N 3.36Å; K278-H282 VanDerWaalsContact O-N 3.11Å
279	A	85.5	Confident	78.8	Confident	73 Å²	73	68.9 Å²	68.9	60%	0.603	38%	0.381	S	S	*	.	H	α-helix	trans	-73.8	-46.1	179.3	0	0	0	0	0	111.6	T277 R281 H282 L283	T277-A279 VanDerWaalsContact C-N 3.26Å; T277-A279 PolarHBondContact O-N 3.17Å; A279-R281 VanDerWaalsContact C-N 3.34Å; A279-R281 PolarHBondContact O-N 3.14Å; A279-H282 PolarHBondContact O-N 3.19Å; A279-L283 WeakPolarHBondContact O-CB 3.28Å; A279-L283 PolarHBondContact O-N 3.41Å
280	E	90	Very high	80.6	Confident	15 Å²	15	67.3 Å²	67.3	7%	0.07	36%	0.357	C	S	.	.	H	α-helix	trans	-63	-39.8	176.2	-68.9	161.9	136.4	0	0	111.9	P196 I240 L276 T277 L283 K284	P196-E280 VanDerWaalsContact CB-OE1 3.28Å; P196-E280 WeakPolarHBondContact CB-OE1 3.37Å; P196-E280 WeakPolarHBondContact CD-OE1 3.47Å; P196-E280 VanDerWaalsContact CG-OE1 3.25Å; P196-E280 WeakPolarHBondContact CG-OE1 3.41Å; I240-E280 HydrophobicContact CD1-CB 3.8Å; I240-E280 HydrophobicContact CD1-CG 4.01Å; I240-E280 HydrophobicContact CG1-CB 4.02Å; I240-E280 HydrophobicContact CG1-CG 4.16Å; L276-E280 HydrophobicContact CB-CB 4.25Å; L276-E280 HydrophobicContact CD2-CB 4.42Å; T277-E280 VanDerWaalsContact CB-OE2 3.26Å; T277-E280 WeakPolarHBondContact CB-OE2 2.89Å; T277-E280 VanDerWaalsContact CG2-OE2 3.27Å; T277-E280 WeakPolarHBondContact CG2-OE2 3.42Å; T277-E280 PolarHBondContact N-OE2 3.12Å; T277-E280 PolarHBondContact O-N 3.01Å; T277-E280 VanDerWaalsContact OG1-CD 3.26Å; T277-E280 WeakPolarHBondContact OG1-CG 3.37Å; T277-E280 PolarHBondContact OG1-N 2.91Å; T277-E280 PolarHBondContact OG1-OE2 3.44Å; E280-L283 PolarHBondContact O-N 2.86Å; E280-K284 WeakPolarHBondContact O-CB 3.18Å; E280-K284 PolarHBondContact O-N 3.32Å
281	R	87.9	Confident	82.2	Confident	70 Å²	70	64.3 Å²	64.3	26%	0.264	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-49.8	172	168.6	165.4	-81.1	-89.1	7	112	T277 A279 L283 K284 D285 E370	T277-R281 WeakPolarHBondContact O-CB 3.38Å; T277-R281 PolarHBondContact O-N 2.66Å; A279-R281 VanDerWaalsContact C-N 3.34Å; A279-R281 PolarHBondContact O-N 3.14Å; R281-L283 VanDerWaalsContact C-N 3.31Å; R281-L283 PolarHBondContact O-N 2.92Å; R281-K284 WeakPolarHBondContact O-CB 3.38Å; R281-K284 PolarHBondContact O-N 3.37Å; R281-K284 VanDerWaalsContact O-N 3.13Å; R281-D285 WeakPolarHBondContact CG-OD2 3.37Å; R281-D285 IonicContact NH1-OD1 2.81Å; R281-D285 IonicContact NH1-OD2 3.2Å; R281-D285 WeakPolarHBondContact O-CB 3.45Å; R281-D285 PolarHBondContact O-N 2.89Å; R281-E370 IonicContact CZ-OE1 3.75Å; R281-E370 IonicContact CZ-OE2 2.64Å; R281-E370 IonicContact NH1-OE1 3.31Å; R281-E370 IonicContact NH1-OE2 2.69Å; R281-E370 PolarHBondContact NH1-OE2 3.5Å; R281-E370 IonicContact NH2-OE1 3.86Å; R281-E370 PolarHBondContact NH2-OE1 3.37Å; R281-E370 IonicContact NH2-OE2 2.71Å; R281-E370 PolarHBondContact NH2-OE2 3.11Å
282	H	85.9	Confident	83.6	Confident	90 Å²	90	67.8 Å²	67.8	42%	0.417	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-39.1	178.5	174	57.4	0	0	0	112.1	K278 A279 K284 K286 D292	K278-H282 PolarHBondContact O-N 3.36Å; K278-H282 VanDerWaalsContact O-N 3.11Å; A279-H282 PolarHBondContact O-N 3.19Å; H282-K284 VanDerWaalsContact C-N 3.35Å; H282-K286 WeakPolarHBondContact O-CB 3.46Å; H282-K286 PolarHBondContact O-N 3.39Å; H282-D292 IonicContact CE1-OD1 3.04Å; H282-D292 PolarHBondContact CE1-OD1 3.05Å; H282-D292 VanDerWaalsContact CE1-OD1 3.31Å; H282-D292 IonicContact CE1-OD2 3.65Å; H282-D292 IonicContact ND1-OD1 2.91Å
283	L	89	Confident	85	Confident	22 Å²	22	68 Å²	68	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-62	-41.2	173.4	174.3	55.9	0	0	0	111.9	D233 R236 L237 I240 A279 E280 R281 S287	D233-L283 HydrophobicContact CB-CD1 3.72Å; D233-L283 HydrophobicContact CB-CD2 4.13Å; R236-L283 HydrophobicContact CB-CD2 3.84Å; L237-L283 HydrophobicContact CD1-CD1 4.18Å; L237-L283 HydrophobicContact CD2-CD1 4.36Å; L237-L283 HydrophobicContact CD2-CG 3.88Å; L237-L283 HydrophobicContact CG-CD1 4.19Å; L237-L283 HydrophobicContact CG-CD2 4.26Å; L237-L283 HydrophobicContact CG-CG 3.98Å; I240-L283 HydrophobicContact CD1-CD2 3.94Å; I240-L283 HydrophobicContact CD1-CG 4.31Å; A279-L283 WeakPolarHBondContact O-CB 3.28Å; A279-L283 PolarHBondContact O-N 3.41Å; E280-L283 PolarHBondContact O-N 2.86Å; R281-L283 VanDerWaalsContact C-N 3.31Å; R281-L283 PolarHBondContact O-N 2.92Å; L283-S287 WeakPolarHBondContact O-CB 3.5Å; L283-S287 PolarHBondContact O-N 3.06Å; L283-S287 PolarHBondContact O-OG 3.46Å
284	K	89.6	Confident	86.2	Confident	39 Å²	39	62.5 Å²	62.5	17%	0.17	34%	0.337	C	S	.	.	H	α-helix	trans	-65.8	-54.9	175.8	-176.3	50	175.1	145.2	0	112.1	L237 I240 L244 E280 R281 H282 K286 S287 D288	L237-K284 HydrophobicContact CD2-CD 4.43Å; I240-K284 HydrophobicContact CG2-CB 3.95Å; I240-K284 HydrophobicContact CG2-CD 4.18Å; I240-K284 HydrophobicContact CG2-CG 4.1Å; L244-K284 HydrophobicContact CD1-CD 4.39Å; L244-K284 HydrophobicContact CD1-CG 4.17Å; E280-K284 WeakPolarHBondContact O-CB 3.18Å; E280-K284 PolarHBondContact O-N 3.32Å; R281-K284 WeakPolarHBondContact O-CB 3.38Å; R281-K284 PolarHBondContact O-N 3.37Å; R281-K284 VanDerWaalsContact O-N 3.13Å; H282-K284 VanDerWaalsContact C-N 3.35Å; K284-K286 PolarHBondContact O-N 2.76Å; K284-S287 WeakPolarHBondContact O-CA 3.5Å; K284-S287 PolarHBondContact O-N 3.15Å; K284-S287 PolarHBondContact O-OG 3.25Å; K284-D288 VanDerWaalsContact CD-OD2 3.22Å; K284-D288 WeakPolarHBondContact CD-OD2 3.47Å; K284-D288 WeakPolarHBondContact CE-OD2 3.3Å; K284-D288 IonicContact NZ-OD1 3.98Å; K284-D288 PolarHBondContact NZ-OD1 3.22Å; K284-D288 IonicContact NZ-OD2 3.72Å; K284-D288 PolarHBondContact NZ-OD2 3.35Å; K284-D288 PolarHBondContact O-N 2.9Å
285	D	88.3	Confident	86.8	Confident	32 Å²	32	60.5 Å²	60.5	17%	0.171	32%	0.322	C	S	.	.	H	α-helix	trans	-49.1	-47.9	175.5	-76.3	-44.4	0	0	0	110.2	R281 S287 D288 G289 R290	R281-D285 WeakPolarHBondContact CG-OD2 3.37Å; R281-D285 IonicContact NH1-OD1 2.81Å; R281-D285 IonicContact NH1-OD2 3.2Å; R281-D285 WeakPolarHBondContact O-CB 3.45Å; R281-D285 PolarHBondContact O-N 2.89Å; D285-S287 PolarHBondContact O-N 3.37Å; D285-D288 PolarHBondContact O-N 3.18Å; D285-G289 PolarHBondContact O-N 2.98Å; D285-R290 HydrophobicContact CB-CB 4.01Å; D285-R290 HydrophobicContact CB-CG 4.47Å; D285-R290 WeakPolarHBondContact O-CB 3.42Å; D285-R290 PolarHBondContact O-N 2.82Å; D285-R290 WeakPolarHBondContact OD1-CD 3.38Å; D285-R290 IonicContact OD1-CZ 3.13Å; D285-R290 IonicContact OD1-NE 3.69Å; D285-R290 IonicContact OD1-NH1 2.78Å; D285-R290 PolarHBondContact OD1-NH1 3.03Å; D285-R290 IonicContact OD2-NH1 3.68Å
286	K	88.4	Confident	87	Confident	131 Å²	131	64 Å²	64	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-64.1	-38.1	176.4	-176.6	179.7	178.9	-175.9	0	113.5	H282 K284 D288 G289	H282-K286 WeakPolarHBondContact O-CB 3.46Å; H282-K286 PolarHBondContact O-N 3.39Å; K284-K286 PolarHBondContact O-N 2.76Å; K286-D288 VanDerWaalsContact C-N 3.34Å; K286-G289 PolarHBondContact O-N 3.08Å
287	S	88.4	Confident	87.2	Confident	57 Å²	57	65.9 Å²	65.9	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-71	-28.8	177.9	73.3	0	0	0	0	113.7	L237 L283 K284 D285 G289	L237-S287 VanDerWaalsContact CD2-OG 3.26Å; L237-S287 WeakPolarHBondContact CD2-OG 3.37Å; L283-S287 WeakPolarHBondContact O-CB 3.5Å; L283-S287 PolarHBondContact O-N 3.06Å; L283-S287 PolarHBondContact O-OG 3.46Å; K284-S287 WeakPolarHBondContact O-CA 3.5Å; K284-S287 PolarHBondContact O-N 3.15Å; K284-S287 PolarHBondContact O-OG 3.25Å; D285-S287 PolarHBondContact O-N 3.37Å; S287-G289 VanDerWaalsContact C-N 3.27Å
288	D	85.7	Confident	87.3	Confident	75 Å²	75	62.2 Å²	62.2	40%	0.401	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-4	176.6	-64.3	-34.5	0	0	0	112.3	K284 D285 K286 F355	K284-D288 VanDerWaalsContact CD-OD2 3.22Å; K284-D288 WeakPolarHBondContact CD-OD2 3.47Å; K284-D288 WeakPolarHBondContact CE-OD2 3.3Å; K284-D288 IonicContact NZ-OD1 3.98Å; K284-D288 PolarHBondContact NZ-OD1 3.22Å; K284-D288 IonicContact NZ-OD2 3.72Å; K284-D288 PolarHBondContact NZ-OD2 3.35Å; K284-D288 PolarHBondContact O-N 2.9Å; D285-D288 PolarHBondContact O-N 3.18Å; K286-D288 VanDerWaalsContact C-N 3.34Å; D288-F355 HydrophobicContact CB-CE2 4.26Å; D288-F355 VanDerWaalsContact O-CE2 3.31Å; D288-F355 WeakPolarHBondContact O-CE2 3.46Å
289	G	83.9	Confident	87.7	Confident	48 Å²	48	56 Å²	56	50%	0.495	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	14.8	-177.7	0	0	0	0	0	114.5	D285 K286 S287 P291	D285-G289 PolarHBondContact O-N 2.98Å; K286-G289 PolarHBondContact O-N 3.08Å; S287-G289 VanDerWaalsContact C-N 3.27Å; G289-P291 WeakPolarHBondContact O-CD 3.4Å
290	R	87.5	Confident	88	Confident	24 Å²	24	54.1 Å²	54.1	9%	0.091	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-63.2	124.4	175.4	-171.4	178	-170.6	163.6	2.3	109.8	D285 M352 F355 E370 D371	D285-R290 HydrophobicContact CB-CB 4.01Å; D285-R290 HydrophobicContact CB-CG 4.47Å; D285-R290 WeakPolarHBondContact O-CB 3.42Å; D285-R290 PolarHBondContact O-N 2.82Å; D285-R290 WeakPolarHBondContact OD1-CD 3.38Å; D285-R290 IonicContact OD1-CZ 3.13Å; D285-R290 IonicContact OD1-NE 3.69Å; D285-R290 IonicContact OD1-NH1 2.78Å; D285-R290 PolarHBondContact OD1-NH1 3.03Å; D285-R290 IonicContact OD2-NH1 3.68Å; R290-M352 HydrophobicContact CG-CE 3.83Å; R290-F355 HydrophobicContact CB-CD1 4.19Å; R290-F355 HydrophobicContact CB-CD2 4.49Å; R290-F355 HydrophobicContact CB-CE1 3.66Å; R290-F355 HydrophobicContact CB-CE2 4.01Å; R290-F355 HydrophobicContact CB-CZ 3.55Å; R290-F355 HydrophobicContact CG-CD1 3.96Å; R290-F355 HydrophobicContact CG-CE1 3.5Å; R290-F355 VanDerWaalsContact CG-CE1 3.5Å; R290-F355 HydrophobicContact CG-CZ 3.94Å; R290-E370 IonicContact NH1-OE2 2.73Å; R290-E370 PolarHBondContact NH1-OE2 3.37Å; R290-D371 IonicContact CZ-OD2 3.23Å; R290-D371 IonicContact NH2-OD1 2.81Å; R290-D371 IonicContact NH2-OD2 3.65Å; R290-D371 PolarHBondContact NH2-OD2 3.37Å
291	P	86.7	Confident	88	Confident	24 Å²	24	54.1 Å²	54.1	16%	0.156	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-64.8	142.3	-177.7	-28.5	38.8	0	0	0	114.1	G289 Y348 E351 M352 F355	G289-P291 WeakPolarHBondContact O-CD 3.4Å; P291-Y348 HydrophobicContact CB-CD2 3.9Å; P291-Y348 HydrophobicContact CB-CE2 4.09Å; P291-Y348 WeakPolarHBondContact O-CE2 3.24Å; P291-E351 HydrophobicContact CB-CB 4.33Å; P291-E351 HydrophobicContact CB-CG 4.3Å; P291-E351 HydrophobicContact CG-CB 3.78Å; P291-E351 HydrophobicContact CG-CG 3.53Å; P291-M352 HydrophobicContact CB-CE 4.37Å; P291-M352 HydrophobicContact CG-CE 4.44Å; P291-F355 HydrophobicContact CG-CB 4.49Å
292	D	85.3	Confident	88.3	Confident	95 Å²	95	51.7 Å²	51.7	51%	0.508	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-76.9	131.2	175.7	-91	-43.8	0	0	0	112.5	H282 Y348	H282-D292 IonicContact CE1-OD1 3.04Å; H282-D292 PolarHBondContact CE1-OD1 3.05Å; H282-D292 VanDerWaalsContact CE1-OD1 3.31Å; H282-D292 IonicContact CE1-OD2 3.65Å; H282-D292 IonicContact ND1-OD1 2.91Å; D292-Y348 WeakPolarHBondContact O-CD2 3.33Å
293	K	86.2	Confident	88.5	Confident	123 Å²	123	47.6 Å²	47.6	54%	0.535	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-62.1	127.4	-177	-77.9	170.7	-176.6	169.5	0	111.9	Y348 D371	K293-Y348 HydrophobicContact CB-CE2 4.34Å; K293-Y348 VanDerWaalsContact CE-OH 3.28Å; K293-Y348 WeakPolarHBondContact CE-OH 3.4Å; K293-Y348 HydrophobicContact CG-CE1 4.46Å; K293-Y348 HydrophobicContact CG-CE2 3.71Å; K293-Y348 VanDerWaalsContact CG-OH 3.27Å; K293-Y348 WeakPolarHBondContact CG-OH 3.09Å; K293-D371 IonicContact NZ-OD1 2.75Å; K293-D371 PolarHBondContact NZ-OD1 3.34Å
294	P	87.8	Confident	88.5	Confident	19 Å²	19	48.6 Å²	48.6	12%	0.123	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-69.6	148.4	178.9	27	-33.8	0	0	0	111.7	R344 K345 Y348	P294-R344 HydrophobicContact CB-CB 4.14Å; P294-K345 HydrophobicContact CB-CG 4.43Å; P294-K345 HydrophobicContact CG-CB 4.46Å; P294-K345 HydrophobicContact CG-CG 3.77Å; P294-Y348 HydrophobicContact CG-CD1 4.41Å; P294-Y348 HydrophobicContact CG-CG 4.07Å
295	P	87.6	Confident	88.5	Confident	22 Å²	22	50.1 Å²	50.1	14%	0.143	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-50.4	140.6	171.6	-28.8	34.4	0	0	0	112.9	N297 M301 A304 C341	P295-N297 VanDerWaalsContact C-N 3.34Å; P295-N297 PolarHBondContact O-N 2.67Å; P295-M301 HydrophobicContact CB-CG 4.09Å; P295-M301 HydrophobicContact CB-SD 3.99Å; P295-M301 HydrophobicContact CG-CG 4.39Å; P295-M301 HydrophobicContact CG-SD 3.69Å; P295-A304 HydrophobicContact CG-CB 4.06Å; P295-C341 PolarHBondContact O-SG 2.65Å
296	P	85.3	Confident	88.5	Confident	89 Å²	89	49.2 Å²	49.2	58%	0.578	27%	0.274	S	S	*	.	S	Bend	trans	-74.1	-15.9	-163.7	27	-36.6	0	0	0	115.5	K345	P296-K345 WeakPolarHBondContact O-CE 3.46Å; P296-K345 PolarHBondContact O-NZ 2.88Å
297	N	91.3	Very high	88.3	Confident	60 Å²	60	45.5 Å²	45.5	32%	0.321	26%	0.26	S	S	.	.	S	Bend	trans	-154.8	171.8	-179.7	61.2	64.8	0	0	0	111.1	P295 Y299 S300 M301 C341	P295-N297 VanDerWaalsContact C-N 3.34Å; P295-N297 PolarHBondContact O-N 2.67Å; N297-Y299 VanDerWaalsContact C-N 3.35Å; N297-Y299 PolarHBondContact O-N 2.84Å; N297-Y299 WeakPolarHBondContact OD1-CA 3.43Å; N297-Y299 WeakPolarHBondContact OD1-CB 3.26Å; N297-Y299 PolarHBondContact OD1-N 2.96Å; N297-S300 PolarHBondContact ND2-OG 2.73Å; N297-S300 PolarHBondContact O-N 3.32Å; N297-S300 PolarHBondContact OD1-N 3.22Å; N297-S300 PolarHBondContact OD1-OG 2.92Å; N297-M301 PolarHBondContact O-N 3.43Å; N297-C341 VanDerWaalsContact C-SG 3.51Å; N297-C341 WeakPolarHBondContact CA-SG 3.44Å; N297-C341 PolarHBondContact N-SG 3.41Å
298	G	90.1	Very high	88.1	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-57.5	-38.2	179.7	0	0	0	0	0	114.9	M301 F302	G298-M301 WeakPolarHBondContact O-CB 3.42Å; G298-M301 PolarHBondContact O-N 2.99Å; G298-F302 PolarHBondContact O-N 3.34Å
299	Y	91.8	Very high	88	Confident	68 Å²	68	46.8 Å²	46.8	27%	0.267	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-45.8	175	172.1	-123.2	0	0	0	111.1	N297 M301 F302 C303 S323 W326	N297-Y299 VanDerWaalsContact C-N 3.35Å; N297-Y299 PolarHBondContact O-N 2.84Å; N297-Y299 WeakPolarHBondContact OD1-CA 3.43Å; N297-Y299 WeakPolarHBondContact OD1-CB 3.26Å; N297-Y299 PolarHBondContact OD1-N 2.96Å; Y299-M301 VanDerWaalsContact C-N 3.3Å; Y299-M301 PolarHBondContact O-N 2.88Å; Y299-F302 WeakPolarHBondContact O-CB 3.26Å; Y299-F302 PolarHBondContact O-N 2.6Å; Y299-C303 WeakPolarHBondContact CE2-SG 3.49Å; Y299-C303 PolarHBondContact O-N 2.92Å; Y299-C303 PolarHBondContact O-SG 2.65Å; Y299-S323 WeakPolarHBondContact OH-CA 3.48Å; Y299-S323 WeakPolarHBondContact OH-CB 3.37Å; Y299-S323 PolarHBondContact OH-N 3.37Å; Y299-W326 HydrophobicContact CD2-CB 3.61Å; Y299-W326 AromaticContact CD2-CD1 3.63Å; Y299-W326 AromaticContact CD2-CD2 3.49Å; Y299-W326 HydrophobicContact CD2-CD2 3.49Å; Y299-W326 VanDerWaalsContact CD2-CD2 3.49Å; Y299-W326 AromaticContact CD2-CE2 3.96Å; Y299-W326 HydrophobicContact CD2-CE3 4.01Å; Y299-W326 AromaticContact CD2-CG 3.28Å; Y299-W326 HydrophobicContact CD2-CG 3.28Å; Y299-W326 HydrophobicContact CE2-CB 3.58Å; Y299-W326 HydrophobicContact CE2-CD2 4.39Å; Y299-W326 AromaticContact CE2-CG 3.75Å; Y299-W326 HydrophobicContact CE2-CG 3.75Å; Y299-W326 HydrophobicContact CG-CD2 4.19Å; Y299-W326 HydrophobicContact CG-CG 4.22Å
300	S	91.8	Very high	87.8	Confident	33 Å²	33	45.8 Å²	45.8	23%	0.231	26%	0.258	C	S	.	.	H	α-helix	trans	-66.8	-28.5	177.4	-54.6	0	0	0	0	113.3	N297 A304	N297-S300 PolarHBondContact ND2-OG 2.73Å; N297-S300 PolarHBondContact O-N 3.32Å; N297-S300 PolarHBondContact OD1-N 3.22Å; N297-S300 PolarHBondContact OD1-OG 2.92Å; S300-A304 WeakPolarHBondContact O-CB 3.14Å; S300-A304 PolarHBondContact O-N 3Å
301	M	90.6	Very high	87.6	Confident	15 Å²	15	52.1 Å²	52.1	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-49.5	168.6	-81.6	-65.6	-65.2	0	0	111.3	P295 N297 G298 Y299 C303 A304 E305 R340 C341 R344	P295-M301 HydrophobicContact CB-CG 4.09Å; P295-M301 HydrophobicContact CB-SD 3.99Å; P295-M301 HydrophobicContact CG-CG 4.39Å; P295-M301 HydrophobicContact CG-SD 3.69Å; N297-M301 PolarHBondContact O-N 3.43Å; G298-M301 WeakPolarHBondContact O-CB 3.42Å; G298-M301 PolarHBondContact O-N 2.99Å; Y299-M301 VanDerWaalsContact C-N 3.3Å; Y299-M301 PolarHBondContact O-N 2.88Å; M301-C303 VanDerWaalsContact C-N 3.33Å; M301-C303 PolarHBondContact O-N 3.4Å; M301-A304 PolarHBondContact O-N 3.18Å; M301-A304 VanDerWaalsContact O-N 3.15Å; M301-E305 PolarHBondContact O-N 3.32Å; M301-R340 HydrophobicContact CE-CG 4.21Å; M301-C341 HydrophobicContact CG-CB 3.57Å; M301-R344 HydrophobicContact CE-CG 4.3Å
302	F	92.9	Very high	87.5	Confident	18 Å²	18	58.4 Å²	58.4	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-58.1	-44	175.8	172.9	-104.8	0	0	0	112	G298 Y299 A304 E305 L306 R325 W326 L329 Y337	G298-F302 PolarHBondContact O-N 3.34Å; Y299-F302 WeakPolarHBondContact O-CB 3.26Å; Y299-F302 PolarHBondContact O-N 2.6Å; F302-A304 PolarHBondContact O-N 2.94Å; F302-E305 PolarHBondContact O-N 2.72Å; F302-L306 HydrophobicContact CE1-CD2 3.77Å; F302-L306 HydrophobicContact CE2-CD2 4.36Å; F302-L306 HydrophobicContact CZ-CD2 3.61Å; F302-L306 VanDerWaalsContact O-CB 3.24Å; F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 3.34Å; F302-R325 HydrophobicContact CE1-CB 4.08Å; F302-R325 HydrophobicContact CZ-CB 3.74Å; F302-W326 HydrophobicContact CB-CE3 3.79Å; F302-W326 HydrophobicContact CB-CZ3 3.84Å; F302-W326 HydrophobicContact CD1-CB 4.04Å; F302-W326 HydrophobicContact CD1-CD2 4.48Å; F302-W326 AromaticContact CD1-CE3 3.73Å; F302-W326 HydrophobicContact CD1-CE3 3.73Å; F302-W326 HydrophobicContact CE1-CB 3.96Å; F302-W326 HydrophobicContact CE1-CE3 4.49Å; F302-W326 AromaticContact CG-CE3 3.8Å; F302-W326 HydrophobicContact CG-CE3 3.8Å; F302-W326 HydrophobicContact CG-CZ3 4.26Å; F302-L329 HydrophobicContact CD2-CD1 4.06Å; F302-L329 HydrophobicContact CE1-CD1 4.46Å; F302-L329 HydrophobicContact CE2-CD1 3.9Å; F302-L329 HydrophobicContact CG-CD1 4.4Å; F302-L329 HydrophobicContact CZ-CD1 4.1Å; F302-Y337 HydrophobicContact CB-CD1 4.05Å; F302-Y337 HydrophobicContact CB-CD2 4.45Å; F302-Y337 HydrophobicContact CB-CE1 4.23Å; F302-Y337 HydrophobicContact CB-CG 4.19Å; F302-Y337 HydrophobicContact CD2-CD2 4.43Å; F302-Y337 AromaticContact CD2-CE1 3.95Å; F302-Y337 HydrophobicContact CD2-CE1 3.95Å; F302-Y337 AromaticContact CD2-CE2 3.85Å; F302-Y337 HydrophobicContact CD2-CE2 3.85Å; F302-Y337 AromaticContact CD2-CZ 3.59Å
303	C	90.3	Very high	87.4	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.034	31%	0.308	C	S	.	.	H	α-helix	trans	-57.8	-46	173.1	-68.1	0	0	0	0	112.4	Y299 M301 M307 C322	Y299-C303 WeakPolarHBondContact CE2-SG 3.49Å; Y299-C303 PolarHBondContact O-N 2.92Å; Y299-C303 PolarHBondContact O-SG 2.65Å; M301-C303 VanDerWaalsContact C-N 3.33Å; M301-C303 PolarHBondContact O-N 3.4Å; C303-M307 HydrophobicContact CB-CE 4.19Å; C303-M307 VanDerWaalsContact O-CB 3.24Å; C303-M307 WeakPolarHBondContact O-CB 3.48Å; C303-M307 WeakPolarHBondContact O-CE 3.11Å; C303-M307 WeakPolarHBondContact O-CG 3.47Å; C303-M307 PolarHBondContact O-N 2.76Å; C303-C322 HydrophobicContact CB-CB 4.36Å
304	A	89.4	Confident	87.5	Confident	43 Å²	43	53.5 Å²	53.5	36%	0.355	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-41.9	-178.3	0	0	0	0	0	112	P295 S300 M301 F302 S308	P295-A304 HydrophobicContact CG-CB 4.06Å; S300-A304 WeakPolarHBondContact O-CB 3.14Å; S300-A304 PolarHBondContact O-N 3Å; M301-A304 PolarHBondContact O-N 3.18Å; M301-A304 VanDerWaalsContact O-N 3.15Å; F302-A304 PolarHBondContact O-N 2.94Å; A304-S308 PolarHBondContact O-N 3.33Å
305	E	90.2	Very high	87.1	Confident	70 Å²	70	55.7 Å²	55.7	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-66.6	-47.5	177.3	-169.1	157.8	-137.4	0	0	111.3	M301 F302 M307 S308 S309 R340	M301-E305 PolarHBondContact O-N 3.32Å; F302-E305 PolarHBondContact O-N 2.72Å; E305-M307 PolarHBondContact O-N 3.12Å; E305-S308 WeakPolarHBondContact O-CB 3.37Å; E305-S308 PolarHBondContact O-N 2.74Å; E305-S308 VanDerWaalsContact O-N 3.11Å; E305-S308 PolarHBondContact O-OG 3.09Å; E305-S309 PolarHBondContact O-N 3.24Å; E305-R340 IonicContact OE1-CZ 3.53Å; E305-R340 VanDerWaalsContact OE1-CZ 3.23Å; E305-R340 IonicContact OE1-NH1 3.93Å; E305-R340 PolarHBondContact OE1-NH1 2.91Å; E305-R340 IonicContact OE1-NH2 3.71Å; E305-R340 PolarHBondContact OE1-NH2 2.78Å; E305-R340 IonicContact OE2-CZ 2.68Å; E305-R340 IonicContact OE2-NH1 3.71Å; E305-R340 PolarHBondContact OE2-NH1 2.87Å; E305-R340 IonicContact OE2-NH2 3.46Å
306	L	87	Confident	86.9	Confident	13 Å²	13	59.9 Å²	59.9	7%	0.068	34%	0.344	C	S	.	.	H	α-helix	trans	-70	-29.7	179.1	179.9	56.3	0	0	0	113.8	F302 S308 S309 M310 C322 R325	F302-L306 HydrophobicContact CE1-CD2 3.77Å; F302-L306 HydrophobicContact CE2-CD2 4.36Å; F302-L306 HydrophobicContact CZ-CD2 3.61Å; F302-L306 VanDerWaalsContact O-CB 3.24Å; F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 3.34Å; L306-S308 VanDerWaalsContact C-N 3.31Å; L306-S309 PolarHBondContact O-OG 3.07Å; L306-M310 HydrophobicContact CD1-CE 3.77Å; L306-M310 HydrophobicContact CD1-CG 4.17Å; L306-M310 HydrophobicContact CD1-SD 3.7Å; L306-M310 HydrophobicContact CD2-CE 4.49Å; L306-M310 HydrophobicContact CG-CE 3.79Å; L306-M310 HydrophobicContact CG-SD 4.4Å; L306-C322 HydrophobicContact CD2-CB 4.29Å; L306-R325 HydrophobicContact CD2-CB 4.39Å
307	M	85.6	Confident	87.1	Confident	54 Å²	54	60.4 Å²	60.4	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-71	-27.1	169.9	-75.6	-172.8	-64.6	0	0	112.4	C303 E305 S309 R318 M319	C303-M307 HydrophobicContact CB-CE 4.19Å; C303-M307 VanDerWaalsContact O-CB 3.24Å; C303-M307 WeakPolarHBondContact O-CB 3.48Å; C303-M307 WeakPolarHBondContact O-CE 3.11Å; C303-M307 WeakPolarHBondContact O-CG 3.47Å; C303-M307 PolarHBondContact O-N 2.76Å; E305-M307 PolarHBondContact O-N 3.12Å; M307-S309 VanDerWaalsContact C-N 3.34Å; M307-R318 HydrophobicContact CG-CB 4.11Å; M307-M319 HydrophobicContact CE-CE 4.02Å; M307-M319 HydrophobicContact SD-CE 3.7Å
308	S	84.4	Confident	86.9	Confident	73 Å²	73	60 Å²	60	51%	0.51	33%	0.332	S	S	.	.	H	α-helix	trans	-74.2	-24.2	179.7	77.9	0	0	0	0	113.8	A304 E305 L306 K311	A304-S308 PolarHBondContact O-N 3.33Å; E305-S308 WeakPolarHBondContact O-CB 3.37Å; E305-S308 PolarHBondContact O-N 2.74Å; E305-S308 VanDerWaalsContact O-N 3.11Å; E305-S308 PolarHBondContact O-OG 3.09Å; L306-S308 VanDerWaalsContact C-N 3.31Å; S308-K311 WeakPolarHBondContact O-CE 2.88Å
309	S	83.5	Confident	86.8	Confident	85 Å²	85	63.9 Å²	63.9	59%	0.594	35%	0.352	S	S	*	.	H	α-helix	trans	-97.6	-11.6	-178.7	56.9	0	0	0	0	115.2	E305 L306 M307	E305-S309 PolarHBondContact O-N 3.24Å; L306-S309 PolarHBondContact O-OG 3.07Å; M307-S309 VanDerWaalsContact C-N 3.34Å
310	M	79.3	Confident	86.8	Confident	28 Å²	28	64.3 Å²	64.3	14%	0.138	36%	0.361	C	S	.	.			trans	-118	59.4	179.3	-57.2	-172.6	-48	0	0	110.7	L306 D312 R318 M321	L306-M310 HydrophobicContact CD1-CE 3.77Å; L306-M310 HydrophobicContact CD1-CG 4.17Å; L306-M310 HydrophobicContact CD1-SD 3.7Å; L306-M310 HydrophobicContact CD2-CE 4.49Å; L306-M310 HydrophobicContact CG-CE 3.79Å; L306-M310 HydrophobicContact CG-SD 4.4Å; M310-D312 VanDerWaalsContact C-N 3.28Å; M310-D312 PolarHBondContact O-N 3.38Å; M310-R318 HydrophobicContact CE-CG 4.43Å; M310-R318 WeakPolarHBondContact O-CD 3.26Å; M310-M321 HydrophobicContact CE-CB 4.09Å
311	K	82	Confident	86.6	Confident	156 Å²	156	66 Å²	66	68%	0.678	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-31.5	-169.5	-67.8	179.8	-177.3	172	0	113.5	S308 R318	S308-K311 WeakPolarHBondContact O-CE 2.88Å; K311-R318 PolarHBondContact O-NH1 2.96Å
312	D	84.8	Confident	86.6	Confident	156 Å²	156	65.2 Å²	65.2	83%	0.834	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-12.3	-167.8	-38.1	-79.5	0	0	0	112.8	M310	M310-D312 VanDerWaalsContact C-N 3.28Å; M310-D312 PolarHBondContact O-N 3.38Å
313	V	84.2	Confident	86.5	Confident	50 Å²	50	66.1 Å²	66.1	30%	0.303	37%	0.371	S	S	.	.	S	Bend	trans	-86.6	136.4	175.8	177.5	0	0	0	0	110.1	E317 R318	V313-E317 HydrophobicContact CG1-CB 3.69Å; V313-R318 HydrophobicContact CB-CG 3.83Å; V313-R318 HydrophobicContact CG1-CG 3.84Å; V313-R318 WeakPolarHBondContact O-CD 3.22Å; V313-R318 WeakPolarHBondContact O-CG 3.37Å; V313-R318 PolarHBondContact O-NE 2.72Å; V313-R318 PolarHBondContact O-NH1 3.25Å
314	P	88.6	Confident	86.6	Confident	65 Å²	65	70.6 Å²	70.6	42%	0.422	39%	0.391	S	S	.	.			trans	-53.9	144.2	177.4	-30.4	37.9	0	0	0	114.6	T316 E317 R318	P314-T316 PolarHBondContact O-N 2.88Å; P314-T316 VanDerWaalsContact O-N 3.13Å; P314-E317 WeakPolarHBondContact CG-OE1 3.23Å; P314-E317 PolarHBondContact O-N 3.12Å; P314-E317 VanDerWaalsContact O-N 3.08Å; P314-R318 WeakPolarHBondContact O-CG 3.35Å; P314-R318 PolarHBondContact O-N 3.31Å
315	S	78.1	Confident	86.7	Confident	66 Å²	66	74.3 Å²	74.3	46%	0.462	40%	0.396	S	S	.	.	H	α-helix	trans	-67	-22.5	-167.4	-154.2	0	0	0	0	115.4	R318 M319	S315-R318 PolarHBondContact OG-NH2 2.95Å; S315-M319 PolarHBondContact O-N 2.83Å
316	T	83.9	Confident	86.8	Confident	109 Å²	109	73.5 Å²	73.5	67%	0.669	39%	0.39	S	S	*	.	H	α-helix	trans	-67.1	-53.7	170.4	39.7	0	0	0	0	110.7	P314 R318 M319 V320	P314-T316 PolarHBondContact O-N 2.88Å; P314-T316 VanDerWaalsContact O-N 3.13Å; T316-R318 PolarHBondContact O-N 3.25Å; T316-M319 WeakPolarHBondContact O-CB 3.37Å; T316-M319 PolarHBondContact O-N 3.14Å; T316-M319 VanDerWaalsContact O-N 3.13Å; T316-V320 PolarHBondContact O-N 3.27Å
317	E	89.3	Confident	87.1	Confident	100 Å²	100	80.5 Å²	80.5	47%	0.467	42%	0.42	S	S	.	.	H	α-helix	trans	-61.3	-41.5	177.6	-69.9	164.4	-130.2	0	0	112.3	V313 P314 M319 V320 M321	V313-E317 HydrophobicContact CG1-CB 3.69Å; P314-E317 WeakPolarHBondContact CG-OE1 3.23Å; P314-E317 PolarHBondContact O-N 3.12Å; P314-E317 VanDerWaalsContact O-N 3.08Å; E317-M319 PolarHBondContact O-N 3.39Å; E317-V320 WeakPolarHBondContact O-CB 3.37Å; E317-V320 PolarHBondContact O-N 3.11Å; E317-M321 WeakPolarHBondContact O-CG 3.27Å; E317-M321 PolarHBondContact O-N 2.7Å
318	R	87.4	Confident	87.5	Confident	51 Å²	51	85 Å²	85	19%	0.192	44%	0.444	C	S	.	.	H	α-helix	trans	-53.8	-40.7	174	-66.8	-172.4	-58.7	-128.5	9.7	111.9	M307 M310 K311 V313 P314 S315 T316 M321 C322	M307-R318 HydrophobicContact CG-CB 4.11Å; M310-R318 HydrophobicContact CE-CG 4.43Å; M310-R318 WeakPolarHBondContact O-CD 3.26Å; K311-R318 PolarHBondContact O-NH1 2.96Å; V313-R318 HydrophobicContact CB-CG 3.83Å; V313-R318 HydrophobicContact CG1-CG 3.84Å; V313-R318 WeakPolarHBondContact O-CD 3.22Å; V313-R318 WeakPolarHBondContact O-CG 3.37Å; V313-R318 PolarHBondContact O-NE 2.72Å; V313-R318 PolarHBondContact O-NH1 3.25Å; P314-R318 WeakPolarHBondContact O-CG 3.35Å; P314-R318 PolarHBondContact O-N 3.31Å; S315-R318 PolarHBondContact OG-NH2 2.95Å; T316-R318 PolarHBondContact O-N 3.25Å; R318-M321 PolarHBondContact O-N 2.8Å; R318-C322 PolarHBondContact O-N 3.43Å; R318-C322 PolarHBondContact O-SG 3.02Å
319	M	87.3	Confident	87.9	Confident	84 Å²	84	83 Å²	83	41%	0.414	43%	0.428	S	S	.	.	H	α-helix	trans	-70.2	-38.6	178.6	-165.3	59.4	60.8	0	0	112.1	M307 S315 T316 E317 C322 S323	M307-M319 HydrophobicContact CE-CE 4.02Å; M307-M319 HydrophobicContact SD-CE 3.7Å; S315-M319 PolarHBondContact O-N 2.83Å; T316-M319 WeakPolarHBondContact O-CB 3.37Å; T316-M319 PolarHBondContact O-N 3.14Å; T316-M319 VanDerWaalsContact O-N 3.13Å; E317-M319 PolarHBondContact O-N 3.39Å; M319-C322 PolarHBondContact O-N 3Å; M319-S323 PolarHBondContact O-N 3Å
320	V	91.5	Very high	88.4	Confident	76 Å²	76	86.4 Å²	86.4	46%	0.461	43%	0.432	S	S	.	.	H	α-helix	trans	-60.4	-49.5	172.5	176.4	0	0	0	0	110.3	T316 E317 C322 S323 Q324	T316-V320 PolarHBondContact O-N 3.27Å; E317-V320 WeakPolarHBondContact O-CB 3.37Å; E317-V320 PolarHBondContact O-N 3.11Å; V320-C322 VanDerWaalsContact C-N 3.33Å; V320-C322 PolarHBondContact O-N 3.05Å; V320-S323 WeakPolarHBondContact O-CB 3.36Å; V320-S323 PolarHBondContact O-N 3.2Å; V320-S323 PolarHBondContact O-OG 3.37Å; V320-Q324 HydrophobicContact CG1-CG 4.49Å; V320-Q324 WeakPolarHBondContact O-CG 3.48Å; V320-Q324 PolarHBondContact O-N 3.44Å
321	M	87.9	Confident	89	Confident	68 Å²	68	90.4 Å²	90.4	34%	0.335	45%	0.45	S	S	.	.	H	α-helix	trans	-59.6	-40	177.8	-69	-68.3	-91.6	0	0	112.3	M310 E317 R318 Q324 R325	M310-M321 HydrophobicContact CE-CB 4.09Å; E317-M321 WeakPolarHBondContact O-CG 3.27Å; E317-M321 PolarHBondContact O-N 2.7Å; R318-M321 PolarHBondContact O-N 2.8Å; M321-Q324 PolarHBondContact O-N 2.82Å; M321-R325 WeakPolarHBondContact O-CG 3.39Å; M321-R325 PolarHBondContact O-N 2.92Å
322	C	91.3	Very high	89.6	Confident	0 Å²	0	89.4 Å²	89.4	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-60.9	-43.9	172.1	-67.1	0	0	0	0	112.1	C303 L306 R318 M319 V320 Q324 W326	C303-C322 HydrophobicContact CB-CB 4.36Å; L306-C322 HydrophobicContact CD2-CB 4.29Å; R318-C322 PolarHBondContact O-N 3.43Å; R318-C322 PolarHBondContact O-SG 3.02Å; M319-C322 PolarHBondContact O-N 3Å; V320-C322 VanDerWaalsContact C-N 3.33Å; V320-C322 PolarHBondContact O-N 3.05Å; C322-Q324 VanDerWaalsContact C-N 3.34Å; C322-Q324 PolarHBondContact O-N 3.09Å; C322-W326 VanDerWaalsContact O-CB 3.26Å; C322-W326 WeakPolarHBondContact O-CB 3.32Å; C322-W326 PolarHBondContact O-N 3.09Å
323	S	90.6	Very high	90	Very high	37 Å²	37	85.8 Å²	85.8	26%	0.259	43%	0.43	S	S	.	.	H	α-helix	trans	-65.7	-35.7	179.3	82.9	0	0	0	0	112.9	Y299 M319 V320 K327	Y299-S323 WeakPolarHBondContact OH-CA 3.48Å; Y299-S323 WeakPolarHBondContact OH-CB 3.37Å; Y299-S323 PolarHBondContact OH-N 3.37Å; M319-S323 PolarHBondContact O-N 3Å; V320-S323 WeakPolarHBondContact O-CB 3.36Å; V320-S323 PolarHBondContact O-N 3.2Å; V320-S323 PolarHBondContact O-OG 3.37Å; S323-K327 WeakPolarHBondContact O-CG 3.25Å; S323-K327 PolarHBondContact O-N 2.88Å
324	Q	93.1	Very high	90.4	Very high	98 Å²	98	85.1 Å²	85.1	46%	0.458	42%	0.423	S	S	.	.	H	α-helix	trans	-70.3	-53.6	177.3	-69.5	176.8	1.7	0	0	111	V320 M321 C322 W326 K327 L328	V320-Q324 HydrophobicContact CG1-CG 4.49Å; V320-Q324 WeakPolarHBondContact O-CG 3.48Å; V320-Q324 PolarHBondContact O-N 3.44Å; M321-Q324 PolarHBondContact O-N 2.82Å; C322-Q324 VanDerWaalsContact C-N 3.34Å; C322-Q324 PolarHBondContact O-N 3.09Å; Q324-W326 VanDerWaalsContact C-N 3.31Å; Q324-W326 PolarHBondContact O-N 3.34Å; Q324-K327 WeakPolarHBondContact O-CB 3.11Å; Q324-K327 PolarHBondContact O-N 3.16Å; Q324-K327 VanDerWaalsContact O-N 3.11Å; Q324-L328 PolarHBondContact O-N 3.39Å
325	R	90.1	Very high	90.6	Very high	122 Å²	122	85 Å²	85	46%	0.46	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-37.5	179.8	-67.5	-173.1	-178.4	-179.5	1.7	112	F302 L306 M321 K327 L328 L329	F302-R325 HydrophobicContact CE1-CB 4.08Å; F302-R325 HydrophobicContact CZ-CB 3.74Å; L306-R325 HydrophobicContact CD2-CB 4.39Å; M321-R325 WeakPolarHBondContact O-CG 3.39Å; M321-R325 PolarHBondContact O-N 2.92Å; R325-K327 VanDerWaalsContact C-N 3.34Å; R325-K327 PolarHBondContact O-N 2.87Å; R325-L328 PolarHBondContact O-N 3.4Å; R325-L329 PolarHBondContact O-N 2.76Å
326	W	92.9	Very high	91.4	Very high	53 Å²	53	84.5 Å²	84.5	20%	0.201	42%	0.419	C	S	.	.	H	α-helix	trans	-64.1	-33.8	175.2	-178.8	-99.1	0	0	0	113.3	Y299 F302 C322 Q324 L328 L329 K334 Y337	Y299-W326 HydrophobicContact CD2-CB 3.61Å; Y299-W326 AromaticContact CD2-CD1 3.63Å; Y299-W326 AromaticContact CD2-CD2 3.49Å; Y299-W326 HydrophobicContact CD2-CD2 3.49Å; Y299-W326 VanDerWaalsContact CD2-CD2 3.49Å; Y299-W326 AromaticContact CD2-CE2 3.96Å; Y299-W326 HydrophobicContact CD2-CE3 4.01Å; Y299-W326 AromaticContact CD2-CG 3.28Å; Y299-W326 HydrophobicContact CD2-CG 3.28Å; Y299-W326 HydrophobicContact CE2-CB 3.58Å; Y299-W326 HydrophobicContact CE2-CD2 4.39Å; Y299-W326 AromaticContact CE2-CG 3.75Å; Y299-W326 HydrophobicContact CE2-CG 3.75Å; Y299-W326 HydrophobicContact CG-CD2 4.19Å; Y299-W326 HydrophobicContact CG-CG 4.22Å; F302-W326 HydrophobicContact CB-CE3 3.79Å; F302-W326 HydrophobicContact CB-CZ3 3.84Å; F302-W326 HydrophobicContact CD1-CB 4.04Å; F302-W326 HydrophobicContact CD1-CD2 4.48Å; F302-W326 AromaticContact CD1-CE3 3.73Å; F302-W326 HydrophobicContact CD1-CE3 3.73Å; F302-W326 HydrophobicContact CE1-CB 3.96Å; F302-W326 HydrophobicContact CE1-CE3 4.49Å; F302-W326 AromaticContact CG-CE3 3.8Å; F302-W326 HydrophobicContact CG-CE3 3.8Å; F302-W326 HydrophobicContact CG-CZ3 4.26Å; C322-W326 VanDerWaalsContact O-CB 3.26Å; C322-W326 WeakPolarHBondContact O-CB 3.32Å; C322-W326 PolarHBondContact O-N 3.09Å; Q324-W326 VanDerWaalsContact C-N 3.31Å; Q324-W326 PolarHBondContact O-N 3.34Å; W326-L328 VanDerWaalsContact C-N 3.31Å; W326-L328 PolarHBondContact O-N 3.43Å; W326-L329 HydrophobicContact CD2-CD1 4.48Å; W326-L329 HydrophobicContact CE3-CD1 3.69Å; W326-L329 HydrophobicContact CZ3-CD1 4.17Å; W326-K334 HydrophobicContact CD2-CG 4.32Å; W326-K334 HydrophobicContact CE3-CG 4.36Å; W326-K334 HydrophobicContact CH2-CB 3.73Å; W326-K334 HydrophobicContact CH2-CG 3.73Å; W326-K334 HydrophobicContact CZ2-CB 3.86Å; W326-K334 HydrophobicContact CZ2-CD 4.25Å; W326-K334 HydrophobicContact CZ2-CG 3.66Å; W326-K334 HydrophobicContact CZ3-CB 4.41Å; W326-K334 HydrophobicContact CZ3-CG 4.09Å; W326-K334 WeakPolarHBondContact O-CE 3.31Å; W326-K334 PolarHBondContact O-NZ 2.96Å; W326-Y337 AromaticContact CZ3-CD2 3.93Å; W326-Y337 HydrophobicContact CZ3-CD2 3.93Å; W326-Y337 HydrophobicContact CZ3-CG 4.17Å
327	K	93.8	Very high	91.9	Very high	159 Å²	159	82 Å²	82	69%	0.691	40%	0.398	S	S	*	.	H	α-helix	trans	-60.1	-44.9	173.6	-74.5	169.1	-177	178.1	0	110.8	S323 Q324 R325 K334	S323-K327 WeakPolarHBondContact O-CG 3.25Å; S323-K327 PolarHBondContact O-N 2.88Å; Q324-K327 WeakPolarHBondContact O-CB 3.11Å; Q324-K327 PolarHBondContact O-N 3.16Å; Q324-K327 VanDerWaalsContact O-N 3.11Å; R325-K327 VanDerWaalsContact C-N 3.34Å; R325-K327 PolarHBondContact O-N 2.87Å; K327-K334 PolarHBondContact O-NZ 2.66Å; K327-K334 VanDerWaalsContact O-NZ 3.1Å
328	L	93.1	Very high	92	Very high	149 Å²	149	80.2 Å²	80.2	78%	0.78	39%	0.389	S	S	*	.	H	α-helix	trans	-71.3	-24.4	-176.3	-61.7	173.5	0	0	0	114.9	Q324 R325 W326	Q324-L328 PolarHBondContact O-N 3.39Å; R325-L328 PolarHBondContact O-N 3.4Å; W326-L328 VanDerWaalsContact C-N 3.31Å; W326-L328 PolarHBondContact O-N 3.43Å
329	L	92.8	Very high	92.3	Very high	32 Å²	32	84.8 Å²	84.8	17%	0.168	41%	0.411	C	S	.	.	S	Bend	trans	-59.3	142.3	176.6	-73	174.4	0	0	0	112.5	F302 R325 W326 E333 K334 Y337	F302-L329 HydrophobicContact CD2-CD1 4.06Å; F302-L329 HydrophobicContact CE1-CD1 4.46Å; F302-L329 HydrophobicContact CE2-CD1 3.9Å; F302-L329 HydrophobicContact CG-CD1 4.4Å; F302-L329 HydrophobicContact CZ-CD1 4.1Å; R325-L329 PolarHBondContact O-N 2.76Å; W326-L329 HydrophobicContact CD2-CD1 4.48Å; W326-L329 HydrophobicContact CE3-CD1 3.69Å; W326-L329 HydrophobicContact CZ3-CD1 4.17Å; L329-E333 HydrophobicContact CB-CB 4.41Å; L329-E333 HydrophobicContact CD2-CB 4.17Å; L329-K334 HydrophobicContact CB-CG 4.08Å; L329-K334 VanDerWaalsContact O-CE 3.3Å; L329-K334 WeakPolarHBondContact O-CE 3.48Å; L329-K334 PolarHBondContact O-NZ 2.68Å; L329-Y337 HydrophobicContact CD1-CD2 4.23Å; L329-Y337 HydrophobicContact CD1-CE2 3.88Å
330	K	94.3	Very high	92.6	Very high	155 Å²	155	86.7 Å²	86.7	67%	0.674	41%	0.413	S	S	*	.			trans	-71.3	158	173.5	-61.7	169.6	-177.7	170.5	0	110.4	N332 E333 K334	K330-N332 VanDerWaalsContact C-N 3.33Å; K330-N332 PolarHBondContact O-N 3.24Å; K330-E333 HydrophobicContact CB-CG 4.33Å; K330-E333 WeakPolarHBondContact CB-OE2 3.5Å; K330-E333 PolarHBondContact N-OE2 2.8Å; K330-E333 WeakPolarHBondContact O-CB 3.3Å; K330-E333 PolarHBondContact O-N 2.79Å; K330-E333 VanDerWaalsContact O-N 3.11Å; K330-K334 PolarHBondContact O-N 2.59Å; K330-K334 VanDerWaalsContact O-N 3.12Å
331	Q	92.4	Very high	92.6	Very high	112 Å²	112	83 Å²	83	52%	0.523	39%	0.391	S	S	.	.	H	α-helix	trans	-60.2	-42.1	-177.3	-170.2	57.5	39	0	0	112.3	E333 K334 D335	Q331-E333 PolarHBondContact O-N 3.29Å; Q331-K334 WeakPolarHBondContact O-CB 3.44Å; Q331-K334 PolarHBondContact O-N 3.08Å; Q331-K334 VanDerWaalsContact O-N 3.09Å; Q331-D335 PolarHBondContact NE2-OD1 3.5Å; Q331-D335 PolarHBondContact O-N 3.42Å
332	N	94.3	Very high	92.8	Very high	135 Å²	135	84.1 Å²	84.1	72%	0.722	40%	0.395	S	S	*	.	H	α-helix	trans	-57.1	-33.7	177.4	-58	12.6	0	0	0	112.9	K330 A336	K330-N332 VanDerWaalsContact C-N 3.33Å; K330-N332 PolarHBondContact O-N 3.24Å; N332-A336 PolarHBondContact O-N 3.23Å; N332-A336 VanDerWaalsContact O-N 3.1Å
333	E	93.4	Very high	92.9	Very high	80 Å²	80	88.3 Å²	88.3	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-74.9	-44.5	177.8	-59.3	170.8	128.5	0	0	110.2	L329 K330 Q331 D335 A336 Y337	L329-E333 HydrophobicContact CB-CB 4.41Å; L329-E333 HydrophobicContact CD2-CB 4.17Å; K330-E333 HydrophobicContact CB-CG 4.33Å; K330-E333 WeakPolarHBondContact CB-OE2 3.5Å; K330-E333 PolarHBondContact N-OE2 2.8Å; K330-E333 WeakPolarHBondContact O-CB 3.3Å; K330-E333 PolarHBondContact O-N 2.79Å; K330-E333 VanDerWaalsContact O-N 3.11Å; Q331-E333 PolarHBondContact O-N 3.29Å; E333-D335 VanDerWaalsContact C-N 3.28Å; E333-D335 PolarHBondContact O-N 2.82Å; E333-A336 WeakPolarHBondContact O-CB 3.5Å; E333-A336 PolarHBondContact O-N 2.91Å; E333-A336 VanDerWaalsContact O-N 3.1Å; E333-Y337 WeakPolarHBondContact O-CD2 3.46Å; E333-Y337 PolarHBondContact O-N 2.89Å
334	K	92.4	Very high	92.9	Very high	36 Å²	36	90.6 Å²	90.6	16%	0.157	42%	0.418	C	S	.	.	H	α-helix	trans	-57.4	-41.2	173.3	-67.7	167.6	164.8	145.2	0	111.7	W326 K327 L329 K330 Q331 Y337 Q338	W326-K334 HydrophobicContact CD2-CG 4.32Å; W326-K334 HydrophobicContact CE3-CG 4.36Å; W326-K334 HydrophobicContact CH2-CB 3.73Å; W326-K334 HydrophobicContact CH2-CG 3.73Å; W326-K334 HydrophobicContact CZ2-CB 3.86Å; W326-K334 HydrophobicContact CZ2-CD 4.25Å; W326-K334 HydrophobicContact CZ2-CG 3.66Å; W326-K334 HydrophobicContact CZ3-CB 4.41Å; W326-K334 HydrophobicContact CZ3-CG 4.09Å; W326-K334 WeakPolarHBondContact O-CE 3.31Å; W326-K334 PolarHBondContact O-NZ 2.96Å; K327-K334 PolarHBondContact O-NZ 2.66Å; K327-K334 VanDerWaalsContact O-NZ 3.1Å; L329-K334 HydrophobicContact CB-CG 4.08Å; L329-K334 VanDerWaalsContact O-CE 3.3Å; L329-K334 WeakPolarHBondContact O-CE 3.48Å; L329-K334 PolarHBondContact O-NZ 2.68Å; K330-K334 PolarHBondContact O-N 2.59Å; K330-K334 VanDerWaalsContact O-N 3.12Å; Q331-K334 WeakPolarHBondContact O-CB 3.44Å; Q331-K334 PolarHBondContact O-N 3.08Å; Q331-K334 VanDerWaalsContact O-N 3.09Å; K334-Y337 PolarHBondContact O-N 3.29Å; K334-Q338 PolarHBondContact O-N 3.07Å
335	D	93.3	Very high	92.7	Very high	64 Å²	64	89.4 Å²	89.4	34%	0.342	41%	0.411	S	S	.	.	H	α-helix	trans	-68.4	-33.5	176.3	-64.3	-19.6	0	0	0	112.2	Q331 E333 Q338 K339	Q331-D335 PolarHBondContact NE2-OD1 3.5Å; Q331-D335 PolarHBondContact O-N 3.42Å; E333-D335 VanDerWaalsContact C-N 3.28Å; E333-D335 PolarHBondContact O-N 2.82Å; D335-Q338 PolarHBondContact O-N 2.91Å; D335-K339 WeakPolarHBondContact O-CG 3.33Å; D335-K339 PolarHBondContact O-N 3.06Å
336	A	95.1	Very high	92.8	Very high	55 Å²	55	89.2 Å²	89.2	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-66.2	-44.1	172.6	0	0	0	0	0	111.7	N332 E333 Q338 K339 R340	N332-A336 PolarHBondContact O-N 3.23Å; N332-A336 VanDerWaalsContact O-N 3.1Å; E333-A336 WeakPolarHBondContact O-CB 3.5Å; E333-A336 PolarHBondContact O-N 2.91Å; E333-A336 VanDerWaalsContact O-N 3.1Å; A336-Q338 VanDerWaalsContact C-N 3.32Å; A336-Q338 PolarHBondContact O-N 3.01Å; A336-K339 PolarHBondContact O-N 3Å; A336-R340 WeakPolarHBondContact O-CB 3.42Å; A336-R340 PolarHBondContact O-N 2.91Å
337	Y	93.6	Very high	92.6	Very high	55 Å²	55	90.9 Å²	90.9	22%	0.216	42%	0.424	C	S	.	.	H	α-helix	trans	-62.8	-36.5	172.6	-72.9	-71.2	0	0	0	112.5	F302 W326 L329 E333 K334 R340 C341	F302-Y337 HydrophobicContact CB-CD1 4.05Å; F302-Y337 HydrophobicContact CB-CD2 4.45Å; F302-Y337 HydrophobicContact CB-CE1 4.23Å; F302-Y337 HydrophobicContact CB-CG 4.19Å; F302-Y337 HydrophobicContact CD2-CD2 4.43Å; F302-Y337 AromaticContact CD2-CE1 3.95Å; F302-Y337 HydrophobicContact CD2-CE1 3.95Å; F302-Y337 AromaticContact CD2-CE2 3.85Å; F302-Y337 HydrophobicContact CD2-CE2 3.85Å; F302-Y337 AromaticContact CD2-CZ 3.59Å; W326-Y337 AromaticContact CZ3-CD2 3.93Å; W326-Y337 HydrophobicContact CZ3-CD2 3.93Å; W326-Y337 HydrophobicContact CZ3-CG 4.17Å; L329-Y337 HydrophobicContact CD1-CD2 4.23Å; L329-Y337 HydrophobicContact CD1-CE2 3.88Å; E333-Y337 WeakPolarHBondContact O-CD2 3.46Å; E333-Y337 PolarHBondContact O-N 2.89Å; K334-Y337 PolarHBondContact O-N 3.29Å; Y337-R340 PolarHBondContact O-N 3.45Å; Y337-C341 WeakPolarHBondContact O-CB 3.29Å; Y337-C341 PolarHBondContact O-N 3.48Å
338	Q	92	Very high	92.5	Very high	63 Å²	63	85.4 Å²	85.4	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-45	174.5	-178.7	60.6	24.1	0	0	111.9	K334 D335 A336 R340 C341 E342	K334-Q338 PolarHBondContact O-N 3.07Å; D335-Q338 PolarHBondContact O-N 2.91Å; A336-Q338 VanDerWaalsContact C-N 3.32Å; A336-Q338 PolarHBondContact O-N 3.01Å; Q338-R340 VanDerWaalsContact C-N 3.35Å; Q338-R340 PolarHBondContact O-N 3.27Å; Q338-C341 VanDerWaalsContact O-CB 3.32Å; Q338-C341 WeakPolarHBondContact O-CB 3.4Å; Q338-C341 PolarHBondContact O-N 3.16Å; Q338-E342 PolarHBondContact NE2-OE1 3.4Å; Q338-E342 WeakPolarHBondContact O-CG 3.48Å; Q338-E342 PolarHBondContact O-N 3.25Å
339	K	93.8	Very high	92.2	Very high	148 Å²	148	84.2 Å²	84.2	64%	0.643	39%	0.39	S	S	*	.	H	α-helix	trans	-60.1	-42.2	173.4	-73.1	169.1	-177.2	174.7	0	112.1	D335 A336 C341 E342 Q343	D335-K339 WeakPolarHBondContact O-CG 3.33Å; D335-K339 PolarHBondContact O-N 3.06Å; A336-K339 PolarHBondContact O-N 3Å; K339-C341 PolarHBondContact O-N 2.7Å; K339-E342 PolarHBondContact O-N 2.97Å; K339-Q343 WeakPolarHBondContact O-CB 3.32Å; K339-Q343 PolarHBondContact O-N 3.13Å
340	R	92.6	Very high	92.1	Very high	123 Å²	123	87.9 Å²	87.9	46%	0.464	41%	0.408	S	S	.	.	H	α-helix	trans	-65.7	-35.7	176.2	-165.4	175	175.8	-160.1	-3.7	112.2	M301 E305 A336 Y337 Q338 R344	M301-R340 HydrophobicContact CE-CG 4.21Å; E305-R340 IonicContact OE1-CZ 3.53Å; E305-R340 VanDerWaalsContact OE1-CZ 3.23Å; E305-R340 IonicContact OE1-NH1 3.93Å; E305-R340 PolarHBondContact OE1-NH1 2.91Å; E305-R340 IonicContact OE1-NH2 3.71Å; E305-R340 PolarHBondContact OE1-NH2 2.78Å; E305-R340 IonicContact OE2-CZ 2.68Å; E305-R340 IonicContact OE2-NH1 3.71Å; E305-R340 PolarHBondContact OE2-NH1 2.87Å; E305-R340 IonicContact OE2-NH2 3.46Å; A336-R340 WeakPolarHBondContact O-CB 3.42Å; A336-R340 PolarHBondContact O-N 2.91Å; Y337-R340 PolarHBondContact O-N 3.45Å; Q338-R340 VanDerWaalsContact C-N 3.35Å; Q338-R340 PolarHBondContact O-N 3.27Å; R340-R344 WeakPolarHBondContact O-CB 3.47Å; R340-R344 PolarHBondContact O-N 3.01Å
341	C	92.6	Very high	91.8	Very high	0 Å²	0	84 Å²	84	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-61.9	-46.6	170.6	177.1	0	0	0	0	112	P295 N297 M301 Y337 Q338 K339 R344 K345	P295-C341 PolarHBondContact O-SG 2.65Å; N297-C341 VanDerWaalsContact C-SG 3.51Å; N297-C341 WeakPolarHBondContact CA-SG 3.44Å; N297-C341 PolarHBondContact N-SG 3.41Å; M301-C341 HydrophobicContact CG-CB 3.57Å; Y337-C341 WeakPolarHBondContact O-CB 3.29Å; Y337-C341 PolarHBondContact O-N 3.48Å; Q338-C341 VanDerWaalsContact O-CB 3.32Å; Q338-C341 WeakPolarHBondContact O-CB 3.4Å; Q338-C341 PolarHBondContact O-N 3.16Å; K339-C341 PolarHBondContact O-N 2.7Å; C341-R344 PolarHBondContact O-N 3.32Å; C341-K345 WeakPolarHBondContact O-CG 3.44Å; C341-K345 PolarHBondContact O-N 3.22Å; C341-K345 WeakPolarHBondContact SG-CE 3.42Å; C341-K345 PolarHBondContact SG-NZ 3.23Å; C341-K345 VanDerWaalsContact SG-NZ 3.37Å
342	E	91	Very high	91.5	Very high	90 Å²	90	79.6 Å²	79.6	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-67.1	-36.2	179.3	-72.4	170	-163.3	0	0	112.8	Q338 K339 K345 K346	Q338-E342 PolarHBondContact NE2-OE1 3.4Å; Q338-E342 WeakPolarHBondContact O-CG 3.48Å; Q338-E342 PolarHBondContact O-N 3.25Å; K339-E342 PolarHBondContact O-N 2.97Å; E342-K345 PolarHBondContact O-N 2.98Å; E342-K346 WeakPolarHBondContact O-CG 3.37Å; E342-K346 PolarHBondContact O-N 3.43Å
343	Q	93.4	Very high	91.1	Very high	89 Å²	89	77.3 Å²	77.3	42%	0.416	36%	0.36	S	S	.	.	H	α-helix	trans	-64.6	-49.8	172.7	-179.2	56.1	24.5	0	0	111.5	K339 K345 K346 E347	K339-Q343 WeakPolarHBondContact O-CB 3.32Å; K339-Q343 PolarHBondContact O-N 3.13Å; Q343-K345 PolarHBondContact O-N 3.07Å; Q343-K345 VanDerWaalsContact O-N 3.16Å; Q343-K346 WeakPolarHBondContact O-CB 3.24Å; Q343-K346 PolarHBondContact O-N 3.02Å; Q343-E347 VanDerWaalsContact CG-OE1 3.29Å; Q343-E347 WeakPolarHBondContact CG-OE1 3.5Å; Q343-E347 PolarHBondContact NE2-OE1 3.24Å; Q343-E347 WeakPolarHBondContact O-CG 3.49Å; Q343-E347 PolarHBondContact O-N 3.48Å
344	R	90.4	Very high	90.8	Very high	85 Å²	85	80.3 Å²	80.3	32%	0.321	37%	0.368	S	S	.	.	H	α-helix	trans	-59	-25.8	174.9	-100.6	-95.2	-82.6	147.7	-8.2	114.2	P294 M301 R340 C341 E347 Y348	P294-R344 HydrophobicContact CB-CB 4.14Å; M301-R344 HydrophobicContact CE-CG 4.3Å; R340-R344 WeakPolarHBondContact O-CB 3.47Å; R340-R344 PolarHBondContact O-N 3.01Å; C341-R344 PolarHBondContact O-N 3.32Å; R344-E347 WeakPolarHBondContact CA-OE2 3.45Å; R344-Y348 VanDerWaalsContact O-CB 3.25Å; R344-Y348 WeakPolarHBondContact O-CB 3.42Å; R344-Y348 PolarHBondContact O-N 2.73Å
345	K	90	Very high	90.5	Very high	73 Å²	73	79.2 Å²	79.2	32%	0.317	36%	0.363	S	S	.	.	H	α-helix	trans	-72.1	-41.7	172	-75.6	165.7	179.8	166.2	0	112.8	P294 P296 C341 E342 Q343 Y348 E349	P294-K345 HydrophobicContact CB-CG 4.43Å; P294-K345 HydrophobicContact CG-CB 4.46Å; P294-K345 HydrophobicContact CG-CG 3.77Å; P296-K345 WeakPolarHBondContact O-CE 3.46Å; P296-K345 PolarHBondContact O-NZ 2.88Å; C341-K345 WeakPolarHBondContact O-CG 3.44Å; C341-K345 PolarHBondContact O-N 3.22Å; C341-K345 WeakPolarHBondContact SG-CE 3.42Å; C341-K345 PolarHBondContact SG-NZ 3.23Å; C341-K345 VanDerWaalsContact SG-NZ 3.37Å; E342-K345 PolarHBondContact O-N 2.98Å; Q343-K345 PolarHBondContact O-N 3.07Å; Q343-K345 VanDerWaalsContact O-N 3.16Å; K345-Y348 PolarHBondContact O-N 3.39Å; K345-E349 WeakPolarHBondContact O-CB 3.32Å; K345-E349 PolarHBondContact O-N 3.32Å
346	K	90.9	Very high	90.1	Very high	118 Å²	118	77.1 Å²	77.1	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-66.4	-42.6	175.4	-64.1	168.4	-172.7	172	0	111.3	E342 Q343 E349 I350	E342-K346 WeakPolarHBondContact O-CG 3.37Å; E342-K346 PolarHBondContact O-N 3.43Å; Q343-K346 WeakPolarHBondContact O-CB 3.24Å; Q343-K346 PolarHBondContact O-N 3.02Å; K346-E349 PolarHBondContact O-N 3.2Å; K346-I350 VanDerWaalsContact O-CG1 3.3Å; K346-I350 WeakPolarHBondContact O-CG1 3.23Å; K346-I350 PolarHBondContact O-N 3.35Å
347	E	90.3	Very high	89.3	Confident	87 Å²	87	79 Å²	79	41%	0.407	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-47.2	175.2	-70.4	160.8	-179.9	0	0	111.2	Q343 R344 E349 I350 E351	Q343-E347 VanDerWaalsContact CG-OE1 3.29Å; Q343-E347 WeakPolarHBondContact CG-OE1 3.5Å; Q343-E347 PolarHBondContact NE2-OE1 3.24Å; Q343-E347 WeakPolarHBondContact O-CG 3.49Å; Q343-E347 PolarHBondContact O-N 3.48Å; R344-E347 WeakPolarHBondContact CA-OE2 3.45Å; E347-E349 VanDerWaalsContact C-N 3.34Å; E347-E349 PolarHBondContact O-N 2.83Å; E347-I350 PolarHBondContact O-N 3.3Å; E347-E351 WeakPolarHBondContact O-CB 3.48Å; E347-E351 PolarHBondContact O-N 3.48Å
348	Y	90.4	Very high	88.7	Confident	45 Å²	45	81.4 Å²	81.4	18%	0.176	38%	0.382	C	S	.	.	H	α-helix	trans	-59.9	-40.5	173	168.8	-92.1	0	0	0	112.9	P291 D292 K293 P294 R344 K345 E351 M352	P291-Y348 HydrophobicContact CB-CD2 3.9Å; P291-Y348 HydrophobicContact CB-CE2 4.09Å; P291-Y348 WeakPolarHBondContact O-CE2 3.24Å; D292-Y348 WeakPolarHBondContact O-CD2 3.33Å; K293-Y348 HydrophobicContact CB-CE2 4.34Å; K293-Y348 VanDerWaalsContact CE-OH 3.28Å; K293-Y348 WeakPolarHBondContact CE-OH 3.4Å; K293-Y348 HydrophobicContact CG-CE1 4.46Å; K293-Y348 HydrophobicContact CG-CE2 3.71Å; K293-Y348 VanDerWaalsContact CG-OH 3.27Å; K293-Y348 WeakPolarHBondContact CG-OH 3.09Å; P294-Y348 HydrophobicContact CG-CD1 4.41Å; P294-Y348 HydrophobicContact CG-CG 4.07Å; R344-Y348 VanDerWaalsContact O-CB 3.25Å; R344-Y348 WeakPolarHBondContact O-CB 3.42Å; R344-Y348 PolarHBondContact O-N 2.73Å; K345-Y348 PolarHBondContact O-N 3.39Å; Y348-E351 PolarHBondContact O-N 3.11Å; Y348-M352 HydrophobicContact CE2-CE 3.82Å; Y348-M352 WeakPolarHBondContact O-CB 3.33Å; Y348-M352 PolarHBondContact O-N 3.44Å; Y348-M352 WeakPolarHBondContact OH-CE 3.15Å
349	E	87.5	Confident	88.1	Confident	124 Å²	124	80.1 Å²	80.1	58%	0.579	38%	0.377	S	S	*	.	H	α-helix	trans	-66	-41	177.7	-175.2	169.7	-157.9	0	0	111.6	K345 K346 E347 N353	K345-E349 WeakPolarHBondContact O-CB 3.32Å; K345-E349 PolarHBondContact O-N 3.32Å; K346-E349 PolarHBondContact O-N 3.2Å; E347-E349 VanDerWaalsContact C-N 3.34Å; E347-E349 PolarHBondContact O-N 2.83Å; E349-N353 WeakPolarHBondContact O-CB 3.44Å; E349-N353 PolarHBondContact O-N 3.44Å; E349-N353 PolarHBondContact O-ND2 2.69Å
350	I	89.9	Confident	87.3	Confident	108 Å²	108	76.6 Å²	76.6	55%	0.554	37%	0.371	S	S	*	.	H	α-helix	trans	-64	-48.8	174.7	-68.2	162.6	0	0	0	110.7	K346 E347 N353 R354	K346-I350 VanDerWaalsContact O-CG1 3.3Å; K346-I350 WeakPolarHBondContact O-CG1 3.23Å; K346-I350 PolarHBondContact O-N 3.35Å; E347-I350 PolarHBondContact O-N 3.3Å; I350-N353 PolarHBondContact O-N 2.86Å; I350-R354 PolarHBondContact O-N 2.76Å
351	E	88.7	Confident	86.2	Confident	75 Å²	75	78.6 Å²	78.6	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-69	-36.6	-177.8	-159.1	63.2	-124.5	0	0	111.9	P291 E347 Y348 R354 F355	P291-E351 HydrophobicContact CB-CB 4.33Å; P291-E351 HydrophobicContact CB-CG 4.3Å; P291-E351 HydrophobicContact CG-CB 3.78Å; P291-E351 HydrophobicContact CG-CG 3.53Å; E347-E351 WeakPolarHBondContact O-CB 3.48Å; E347-E351 PolarHBondContact O-N 3.48Å; Y348-E351 PolarHBondContact O-N 3.11Å; E351-R354 WeakPolarHBondContact O-CB 3.37Å; E351-R354 PolarHBondContact O-N 3.35Å; E351-R354 WeakPolarHBondContact OE1-CD 3.48Å; E351-R354 IonicContact OE1-CZ 2.66Å; E351-R354 IonicContact OE1-NE 3.23Å; E351-R354 IonicContact OE1-NH1 2.85Å; E351-R354 PolarHBondContact OE1-NH1 3.23Å; E351-R354 IonicContact OE2-CZ 2.6Å; E351-R354 IonicContact OE2-NH1 3.21Å; E351-R354 PolarHBondContact OE2-NH1 2.82Å; E351-R354 IonicContact OE2-NH2 3.07Å; E351-F355 WeakPolarHBondContact O-CB 3.35Å; E351-F355 PolarHBondContact O-N 3.37Å
352	M	86.3	Confident	84.7	Confident	18 Å²	18	86.4 Å²	86.4	9%	0.089	42%	0.422	C	S	.	.	H	α-helix	trans	-66.6	-38.3	175.2	-177.2	57.5	68.4	0	0	111.4	R290 P291 Y348 F355 L356	R290-M352 HydrophobicContact CG-CE 3.83Å; P291-M352 HydrophobicContact CB-CE 4.37Å; P291-M352 HydrophobicContact CG-CE 4.44Å; Y348-M352 HydrophobicContact CE2-CE 3.82Å; Y348-M352 WeakPolarHBondContact O-CB 3.33Å; Y348-M352 PolarHBondContact O-N 3.44Å; Y348-M352 WeakPolarHBondContact OH-CE 3.15Å; M352-F355 PolarHBondContact O-N 2.95Å; M352-F355 HydrophobicContact SD-CD1 3.79Å; M352-F355 HydrophobicContact SD-CE1 4.5Å; M352-L356 HydrophobicContact CG-CD1 4.35Å; M352-L356 WeakPolarHBondContact O-CB 3.45Å; M352-L356 VanDerWaalsContact O-CG 3.3Å; M352-L356 WeakPolarHBondContact O-CG 3.28Å; M352-L356 PolarHBondContact O-N 3.3Å; M352-L356 HydrophobicContact SD-CG 4.48Å
353	N	85.2	Confident	83.5	Confident	88 Å²	88	84.8 Å²	84.8	47%	0.471	42%	0.415	S	S	.	.	H	α-helix	trans	-67.2	-35.2	172.4	-76.8	-56.8	0	0	0	112	E349 I350 S357	E349-N353 WeakPolarHBondContact O-CB 3.44Å; E349-N353 PolarHBondContact O-N 3.44Å; E349-N353 PolarHBondContact O-ND2 2.69Å; I350-N353 PolarHBondContact O-N 2.86Å; N353-S357 WeakPolarHBondContact O-CB 3.49Å; N353-S357 PolarHBondContact O-N 2.86Å; N353-S357 PolarHBondContact O-OG 3.3Å
354	R	87.8	Confident	82.4	Confident	142 Å²	142	83.3 Å²	83.3	54%	0.536	41%	0.408	S	S	.	.	H	α-helix	trans	-63	-49.3	171	-172.1	-171	-65.9	145	0.9	110.9	I350 E351 S357 T358	I350-R354 PolarHBondContact O-N 2.76Å; E351-R354 WeakPolarHBondContact O-CB 3.37Å; E351-R354 PolarHBondContact O-N 3.35Å; E351-R354 WeakPolarHBondContact OE1-CD 3.48Å; E351-R354 IonicContact OE1-CZ 2.66Å; E351-R354 IonicContact OE1-NE 3.23Å; E351-R354 IonicContact OE1-NH1 2.85Å; E351-R354 PolarHBondContact OE1-NH1 3.23Å; E351-R354 IonicContact OE2-CZ 2.6Å; E351-R354 IonicContact OE2-NH1 3.21Å; E351-R354 PolarHBondContact OE2-NH1 2.82Å; E351-R354 IonicContact OE2-NH2 3.07Å; R354-S357 WeakPolarHBondContact O-CA 3.35Å; R354-S357 WeakPolarHBondContact O-CB 3.31Å; R354-S357 PolarHBondContact O-N 3.21Å; R354-S357 VanDerWaalsContact O-N 3.08Å; R354-T358 PolarHBondContact O-N 3.38Å
355	F	86.4	Confident	81.3	Confident	14 Å²	14	85.6 Å²	85.6	6%	0.061	42%	0.422	C	S	.	.	H	α-helix	trans	-57.1	-51.4	177.3	171.3	-109.8	0	0	0	111.4	D288 R290 P291 E351 M352 S357 T358 L359 V367	D288-F355 HydrophobicContact CB-CE2 4.26Å; D288-F355 VanDerWaalsContact O-CE2 3.31Å; D288-F355 WeakPolarHBondContact O-CE2 3.46Å; R290-F355 HydrophobicContact CB-CD1 4.19Å; R290-F355 HydrophobicContact CB-CD2 4.49Å; R290-F355 HydrophobicContact CB-CE1 3.66Å; R290-F355 HydrophobicContact CB-CE2 4.01Å; R290-F355 HydrophobicContact CB-CZ 3.55Å; R290-F355 HydrophobicContact CG-CD1 3.96Å; R290-F355 HydrophobicContact CG-CE1 3.5Å; R290-F355 VanDerWaalsContact CG-CE1 3.5Å; R290-F355 HydrophobicContact CG-CZ 3.94Å; P291-F355 HydrophobicContact CG-CB 4.49Å; E351-F355 WeakPolarHBondContact O-CB 3.35Å; E351-F355 PolarHBondContact O-N 3.37Å; M352-F355 PolarHBondContact O-N 2.95Å; M352-F355 HydrophobicContact SD-CD1 3.79Å; M352-F355 HydrophobicContact SD-CE1 4.5Å; F355-S357 PolarHBondContact O-N 3.37Å; F355-T358 PolarHBondContact O-N 2.89Å; F355-T358 PolarHBondContact O-OG1 3Å; F355-L359 HydrophobicContact CD1-CD1 4.1Å; F355-L359 HydrophobicContact CE1-CD1 3.61Å; F355-L359 HydrophobicContact CE2-CD1 4.21Å; F355-L359 HydrophobicContact CE2-CD2 4.09Å; F355-L359 HydrophobicContact CE2-CG 4.38Å; F355-L359 HydrophobicContact CZ-CD1 3.68Å; F355-L359 HydrophobicContact CZ-CD2 4.17Å; F355-L359 HydrophobicContact CZ-CG 4.32Å; F355-L359 WeakPolarHBondContact O-CG 3.38Å; F355-L359 PolarHBondContact O-N 2.85Å; F355-V367 HydrophobicContact CE1-CG1 4.5Å
356	L	83.3	Confident	80.3	Confident	19 Å²	19	87.4 Å²	87.4	10%	0.099	43%	0.427	C	S	.	.	H	α-helix	trans	-54.3	-39.7	173.8	-71.9	169.5	0	0	0	112.4	M352 T358 L359 Q364 V367 L368	M352-L356 HydrophobicContact CG-CD1 4.35Å; M352-L356 WeakPolarHBondContact O-CB 3.45Å; M352-L356 VanDerWaalsContact O-CG 3.3Å; M352-L356 WeakPolarHBondContact O-CG 3.28Å; M352-L356 PolarHBondContact O-N 3.3Å; M352-L356 HydrophobicContact SD-CG 4.48Å; L356-T358 PolarHBondContact O-N 2.87Å; L356-L359 HydrophobicContact CD2-CD1 4.47Å; L356-L359 PolarHBondContact O-N 3Å; L356-L359 VanDerWaalsContact O-N 3.15Å; L356-Q364 HydrophobicContact CB-CG 4.49Å; L356-Q364 HydrophobicContact CD2-CB 4.37Å; L356-Q364 HydrophobicContact CD2-CG 4.36Å; L356-Q364 VanDerWaalsContact O-CD 3.25Å; L356-Q364 WeakPolarHBondContact O-CG 3.47Å; L356-Q364 PolarHBondContact O-NE2 2.97Å; L356-Q364 VanDerWaalsContact O-NE2 3.14Å; L356-V367 HydrophobicContact CD2-CB 4.27Å; L356-V367 HydrophobicContact CD2-CG1 3.84Å; L356-L368 HydrophobicContact CD1-CD2 4.2Å; L356-L368 HydrophobicContact CD2-CG 4.39Å
357	S	80.3	Confident	79.3	Confident	96 Å²	96	82 Å²	82	67%	0.671	40%	0.404	S	S	*	.	H	α-helix	trans	-68	-14.4	176.7	-54.2	0	0	0	0	114.4	N353 R354 F355	N353-S357 WeakPolarHBondContact O-CB 3.49Å; N353-S357 PolarHBondContact O-N 2.86Å; N353-S357 PolarHBondContact O-OG 3.3Å; R354-S357 WeakPolarHBondContact O-CA 3.35Å; R354-S357 WeakPolarHBondContact O-CB 3.31Å; R354-S357 PolarHBondContact O-N 3.21Å; R354-S357 VanDerWaalsContact O-N 3.08Å; F355-S357 PolarHBondContact O-N 3.37Å
358	T	79.9	Confident	78.3	Confident	105 Å²	105	81.2 Å²	81.2	64%	0.644	40%	0.402	S	S	*	.	H	α-helix	trans	-92.6	-7.7	173.5	57.6	0	0	0	0	113.9	R354 F355 L356	R354-T358 PolarHBondContact O-N 3.38Å; F355-T358 PolarHBondContact O-N 2.89Å; F355-T358 PolarHBondContact O-OG1 3Å; L356-T358 PolarHBondContact O-N 2.87Å
359	L	80.1	Confident	76.9	Confident	35 Å²	35	80.1 Å²	80.1	18%	0.183	41%	0.405	C	S	.	.	S	Bend	trans	-98.5	154.9	179.4	-57.7	172.6	0	0	0	111.1	F355 L356 E363 Q364 V367	F355-L359 HydrophobicContact CD1-CD1 4.1Å; F355-L359 HydrophobicContact CE1-CD1 3.61Å; F355-L359 HydrophobicContact CE2-CD1 4.21Å; F355-L359 HydrophobicContact CE2-CD2 4.09Å; F355-L359 HydrophobicContact CE2-CG 4.38Å; F355-L359 HydrophobicContact CZ-CD1 3.68Å; F355-L359 HydrophobicContact CZ-CD2 4.17Å; F355-L359 HydrophobicContact CZ-CG 4.32Å; F355-L359 WeakPolarHBondContact O-CG 3.38Å; F355-L359 PolarHBondContact O-N 2.85Å; L356-L359 HydrophobicContact CD2-CD1 4.47Å; L356-L359 PolarHBondContact O-N 3Å; L356-L359 VanDerWaalsContact O-N 3.15Å; L359-E363 HydrophobicContact CB-CB 4.12Å; L359-E363 HydrophobicContact CB-CG 3.81Å; L359-E363 HydrophobicContact CD1-CG 4.05Å; L359-E363 HydrophobicContact CD2-CG 3.84Å; L359-E363 HydrophobicContact CG-CG 4.09Å; L359-Q364 HydrophobicContact CB-CG 3.93Å; L359-Q364 PolarHBondContact O-NE2 2.73Å; L359-V367 HydrophobicContact CD1-CG2 4.04Å
360	S	76.5	Confident	75.8	Confident	75 Å²	75	76.2 Å²	76.2	52%	0.524	39%	0.386	S	S	.	.			trans	-68.7	157	171.6	68.6	0	0	0	0	111.6	Q362 E363 Q364	S360-Q362 VanDerWaalsContact C-N 3.25Å; S360-Q362 PolarHBondContact O-N 3.45Å; S360-E363 CarbonylContact O-C 3.16Å; S360-E363 WeakPolarHBondContact O-CA 3.3Å; S360-E363 WeakPolarHBondContact O-CB 3.21Å; S360-E363 PolarHBondContact O-N 2.86Å; S360-E363 WeakPolarHBondContact OG-CB 3.42Å; S360-Q364 WeakPolarHBondContact O-CG 3.5Å; S360-Q364 PolarHBondContact O-N 3.08Å
361	E	68.8	Low	74.3	Confident	165 Å²	165	73.7 Å²	73.7	77%	0.771	37%	0.374	S	S	*	.	H	α-helix	trans	-57.9	-36.4	-177	-61.4	-173.2	143.9	0	0	113.3	E363 Q365	E361-E363 VanDerWaalsContact C-N 3.34Å; E361-Q365 VanDerWaalsContact O-CB 3.3Å; E361-Q365 WeakPolarHBondContact O-CB 3.42Å; E361-Q365 PolarHBondContact O-N 3.24Å
362	Q	61.5	Low	72.6	Confident	164 Å²	164	76.7 Å²	76.7	77%	0.766	39%	0.386	S	S	*	.	H	α-helix	trans	-65.8	-37.4	175.9	-168.5	179.1	25.3	0	0	112.1	S360 R366	S360-Q362 VanDerWaalsContact C-N 3.25Å; S360-Q362 PolarHBondContact O-N 3.45Å; Q362-R366 PolarHBondContact O-N 2.78Å
363	E	66	Low	70.7	Confident	55 Å²	55	81.1 Å²	81.1	26%	0.257	41%	0.409	S	S	.	.	H	α-helix	trans	-72.9	-46.4	177	-178.4	62.5	-136.8	0	0	110.8	L359 S360 E361 Q365 R366 V367	L359-E363 HydrophobicContact CB-CB 4.12Å; L359-E363 HydrophobicContact CB-CG 3.81Å; L359-E363 HydrophobicContact CD1-CG 4.05Å; L359-E363 HydrophobicContact CD2-CG 3.84Å; L359-E363 HydrophobicContact CG-CG 4.09Å; S360-E363 CarbonylContact O-C 3.16Å; S360-E363 WeakPolarHBondContact O-CA 3.3Å; S360-E363 WeakPolarHBondContact O-CB 3.21Å; S360-E363 PolarHBondContact O-N 2.86Å; S360-E363 WeakPolarHBondContact OG-CB 3.42Å; E361-E363 VanDerWaalsContact C-N 3.34Å; E363-Q365 VanDerWaalsContact C-N 3.32Å; E363-Q365 PolarHBondContact O-N 3.39Å; E363-R366 VanDerWaalsContact CD-NH1 3.34Å; E363-R366 PolarHBondContact O-N 3.22Å; E363-R366 VanDerWaalsContact O-N 3.11Å; E363-R366 IonicContact OE1-CZ 2.73Å; E363-R366 IonicContact OE1-NH1 2.81Å; E363-R366 PolarHBondContact OE1-NH1 3.17Å; E363-R366 IonicContact OE1-NH2 2.57Å; E363-R366 PolarHBondContact OE1-NH2 2.86Å; E363-R366 IonicContact OE2-CZ 2.69Å; E363-R366 IonicContact OE2-NH1 3.84Å; E363-R366 PolarHBondContact OE2-NH1 3.3Å; E363-R366 IonicContact OE2-NH2 3.17Å; E363-R366 PolarHBondContact OE2-NH2 3Å; E363-V367 WeakPolarHBondContact O-CG2 3.02Å; E363-V367 PolarHBondContact O-N 3.32Å
364	Q	70.8	Confident	68.7	Low	58 Å²	58	78.5 Å²	78.5	27%	0.271	40%	0.403	S	S	.	.	H	α-helix	trans	-53.4	-48	171.9	-68.3	174.8	35.5	0	0	111.6	L356 L359 S360 R366 V367 L368	L356-Q364 HydrophobicContact CB-CG 4.49Å; L356-Q364 HydrophobicContact CD2-CB 4.37Å; L356-Q364 HydrophobicContact CD2-CG 4.36Å; L356-Q364 VanDerWaalsContact O-CD 3.25Å; L356-Q364 WeakPolarHBondContact O-CG 3.47Å; L356-Q364 PolarHBondContact O-NE2 2.97Å; L356-Q364 VanDerWaalsContact O-NE2 3.14Å; L359-Q364 HydrophobicContact CB-CG 3.93Å; L359-Q364 PolarHBondContact O-NE2 2.73Å; S360-Q364 WeakPolarHBondContact O-CG 3.5Å; S360-Q364 PolarHBondContact O-N 3.08Å; Q364-R366 VanDerWaalsContact C-N 3.29Å; Q364-R366 PolarHBondContact O-N 3.16Å; Q364-V367 PolarHBondContact O-N 2.99Å; Q364-L368 WeakPolarHBondContact O-CB 3.48Å; Q364-L368 VanDerWaalsContact O-CG 3.28Å; Q364-L368 WeakPolarHBondContact O-CG 3.48Å; Q364-L368 PolarHBondContact O-N 3.27Å
365	Q	66.4	Low	66.4	Low	133 Å²	133	78.7 Å²	78.7	62%	0.621	41%	0.414	S	S	*	.	H	α-helix	trans	-65.4	-32.9	-179.5	-168.9	73.9	-39.9	0	0	111.9	E361 E363 G369	E361-Q365 VanDerWaalsContact O-CB 3.3Å; E361-Q365 WeakPolarHBondContact O-CB 3.42Å; E361-Q365 PolarHBondContact O-N 3.24Å; E363-Q365 VanDerWaalsContact C-N 3.32Å; E363-Q365 PolarHBondContact O-N 3.39Å; Q365-G369 PolarHBondContact O-N 3.36Å
366	R	70	Confident	64	Low	112 Å²	112	86 Å²	86	42%	0.423	45%	0.445	S	S	.	.	H	α-helix	trans	-69.4	-49.2	171.9	-161	-175.5	73.8	-104.7	-6.4	111.4	Q362 E363 Q364 L368 G369 E370	Q362-R366 PolarHBondContact O-N 2.78Å; E363-R366 VanDerWaalsContact CD-NH1 3.34Å; E363-R366 PolarHBondContact O-N 3.22Å; E363-R366 VanDerWaalsContact O-N 3.11Å; E363-R366 IonicContact OE1-CZ 2.73Å; E363-R366 IonicContact OE1-NH1 2.81Å; E363-R366 PolarHBondContact OE1-NH1 3.17Å; E363-R366 IonicContact OE1-NH2 2.57Å; E363-R366 PolarHBondContact OE1-NH2 2.86Å; E363-R366 IonicContact OE2-CZ 2.69Å; E363-R366 IonicContact OE2-NH1 3.84Å; E363-R366 PolarHBondContact OE2-NH1 3.3Å; E363-R366 IonicContact OE2-NH2 3.17Å; E363-R366 PolarHBondContact OE2-NH2 3Å; Q364-R366 VanDerWaalsContact C-N 3.29Å; Q364-R366 PolarHBondContact O-N 3.16Å; R366-L368 VanDerWaalsContact C-N 3.32Å; R366-L368 PolarHBondContact O-N 3.2Å; R366-G369 CarbonylContact O-C 3.37Å; R366-G369 WeakPolarHBondContact O-CA 3.42Å; R366-G369 PolarHBondContact O-N 3.09Å; R366-E370 HydrophobicContact CG-CG 4.45Å; R366-E370 IonicContact NE-OE1 2.59Å; R366-E370 PolarHBondContact NE-OE1 2.94Å; R366-E370 WeakPolarHBondContact O-CG 3.32Å; R366-E370 PolarHBondContact O-N 3.26Å
367	V	69.7	Low	61.7	Low	4 Å²	4	92.9 Å²	92.9	2%	0.024	47%	0.474	C	S	.	.	H	α-helix	trans	-55.8	-44.8	177.5	169.2	0	0	0	0	111.5	F355 L356 L359 E363 Q364 G369 E370 D371	F355-V367 HydrophobicContact CE1-CG1 4.5Å; L356-V367 HydrophobicContact CD2-CB 4.27Å; L356-V367 HydrophobicContact CD2-CG1 3.84Å; L359-V367 HydrophobicContact CD1-CG2 4.04Å; E363-V367 WeakPolarHBondContact O-CG2 3.02Å; E363-V367 PolarHBondContact O-N 3.32Å; Q364-V367 PolarHBondContact O-N 2.99Å; V367-G369 VanDerWaalsContact C-N 3.28Å; V367-G369 PolarHBondContact O-N 3.33Å; V367-E370 PolarHBondContact O-N 2.75Å; V367-D371 PolarHBondContact O-N 3.24Å
368	L	69.1	Low	59.3	Low	70 Å²	70	95 Å²	95	37%	0.366	48%	0.478	S	S	.	.	H	α-helix	trans	-69.2	-22	174.7	-68.8	171.2	0	0	0	113.6	L356 Q364 R366 K372	L356-L368 HydrophobicContact CD1-CD2 4.2Å; L356-L368 HydrophobicContact CD2-CG 4.39Å; Q364-L368 WeakPolarHBondContact O-CB 3.48Å; Q364-L368 VanDerWaalsContact O-CG 3.28Å; Q364-L368 WeakPolarHBondContact O-CG 3.48Å; Q364-L368 PolarHBondContact O-N 3.27Å; R366-L368 VanDerWaalsContact C-N 3.32Å; R366-L368 PolarHBondContact O-N 3.2Å; L368-K372 WeakPolarHBondContact O-CD 3.44Å; L368-K372 VanDerWaalsContact O-CE 3.23Å; L368-K372 WeakPolarHBondContact O-CE 3.27Å; L368-K372 VanDerWaalsContact O-CG 3.27Å; L368-K372 WeakPolarHBondContact O-CG 3.28Å
369	G	60.5	Low	56.9	Low	23 Å²	23	95.3 Å²	95.3	24%	0.237	48%	0.484	C	S	.	.	H	α-helix	trans	-78.2	-47.2	171.7	0	0	0	0	0	112.4	Q365 R366 V367 D371 K372 I373	Q365-G369 PolarHBondContact O-N 3.36Å; R366-G369 CarbonylContact O-C 3.37Å; R366-G369 WeakPolarHBondContact O-CA 3.42Å; R366-G369 PolarHBondContact O-N 3.09Å; V367-G369 VanDerWaalsContact C-N 3.28Å; V367-G369 PolarHBondContact O-N 3.33Å; G369-D371 VanDerWaalsContact C-N 3.32Å; G369-D371 PolarHBondContact O-N 2.72Å; G369-K372 WeakPolarHBondContact O-CB 3.33Å; G369-K372 PolarHBondContact O-N 3.5Å; G369-K372 VanDerWaalsContact O-N 3.09Å; G369-I373 WeakPolarHBondContact O-CG1 3.45Å; G369-I373 PolarHBondContact O-N 3.15Å
370	E	64.6	Low	54.6	Low	41 Å²	41	97.8 Å²	97.8	19%	0.192	51%	0.51	C	S	.	.	H	α-helix	trans	-54.6	-45.8	176.8	-70.2	173.8	172.4	0	0	111.6	R281 R290 R366 V367 K372 I373 G374	R281-E370 IonicContact CZ-OE1 3.75Å; R281-E370 IonicContact CZ-OE2 2.64Å; R281-E370 IonicContact NH1-OE1 3.31Å; R281-E370 IonicContact NH1-OE2 2.69Å; R281-E370 PolarHBondContact NH1-OE2 3.5Å; R281-E370 IonicContact NH2-OE1 3.86Å; R281-E370 PolarHBondContact NH2-OE1 3.37Å; R281-E370 IonicContact NH2-OE2 2.71Å; R281-E370 PolarHBondContact NH2-OE2 3.11Å; R290-E370 IonicContact NH1-OE2 2.73Å; R290-E370 PolarHBondContact NH1-OE2 3.37Å; R366-E370 HydrophobicContact CG-CG 4.45Å; R366-E370 IonicContact NE-OE1 2.59Å; R366-E370 PolarHBondContact NE-OE1 2.94Å; R366-E370 WeakPolarHBondContact O-CG 3.32Å; R366-E370 PolarHBondContact O-N 3.26Å; V367-E370 PolarHBondContact O-N 2.75Å; E370-K372 VanDerWaalsContact C-N 3.3Å; E370-K372 PolarHBondContact O-N 2.75Å; E370-I373 PolarHBondContact O-N 2.97Å; E370-I373 VanDerWaalsContact O-N 3.09Å; E370-G374 PolarHBondContact O-N 2.76Å
371	D	58.2	Low	52.5	Low	55 Å²	55	98.8 Å²	98.8	29%	0.294	52%	0.523	S	S	.	.	H	α-helix	trans	-66.8	-28.5	179.3	-92	-44.4	0	0	0	113.4	R290 K293 V367 G369	R290-D371 IonicContact CZ-OD2 3.23Å; R290-D371 IonicContact NH2-OD1 2.81Å; R290-D371 IonicContact NH2-OD2 3.65Å; R290-D371 PolarHBondContact NH2-OD2 3.37Å; K293-D371 IonicContact NZ-OD1 2.75Å; K293-D371 PolarHBondContact NZ-OD1 3.34Å; V367-D371 PolarHBondContact O-N 3.24Å; G369-D371 VanDerWaalsContact C-N 3.32Å; G369-D371 PolarHBondContact O-N 2.72Å
372	K	52.4	Low	50.5	Low	138 Å²	138	96.5 Å²	96.5	60%	0.6	53%	0.525	S	S	*	.	H	α-helix	trans	-74.5	-31.5	171.2	-66.9	164.7	-168.9	161.1	0	112.1	L368 G369 E370	L368-K372 WeakPolarHBondContact O-CD 3.44Å; L368-K372 VanDerWaalsContact O-CE 3.23Å; L368-K372 WeakPolarHBondContact O-CE 3.27Å; L368-K372 VanDerWaalsContact O-CG 3.27Å; L368-K372 WeakPolarHBondContact O-CG 3.28Å; G369-K372 WeakPolarHBondContact O-CB 3.33Å; G369-K372 PolarHBondContact O-N 3.5Å; G369-K372 VanDerWaalsContact O-N 3.09Å; E370-K372 VanDerWaalsContact C-N 3.3Å; E370-K372 PolarHBondContact O-N 2.75Å
373	I	47.7	Very low	48.9	Very low	111 Å²	111	93.8 Å²	93.8	57%	0.569	52%	0.524	S	S	*	.	H	α-helix	trans	-77.1	-43.1	179.5	-67.6	163.9	0	0	0	111.1	G369 E370 L375 K376 K377	G369-I373 WeakPolarHBondContact O-CG1 3.45Å; G369-I373 PolarHBondContact O-N 3.15Å; E370-I373 PolarHBondContact O-N 2.97Å; E370-I373 VanDerWaalsContact O-N 3.09Å; I373-L375 PolarHBondContact O-N 3.26Å; I373-K376 PolarHBondContact O-N 3.33Å; I373-K377 PolarHBondContact O-N 3.45Å
374	G	43	Very low	47.2	Very low	33 Å²	33	98 Å²	98	34%	0.34	56%	0.556	S	S	.	*	H	α-helix	trans	-57.6	-36.3	176.2	0	0	0	0	0	112.8	E370 K376 K377 N378	E370-G374 PolarHBondContact O-N 2.76Å; G374-K376 VanDerWaalsContact C-N 3.27Å; G374-K376 PolarHBondContact O-N 2.91Å; G374-K377 PolarHBondContact O-N 2.97Å; G374-N378 PolarHBondContact O-N 3.44Å
375	L	38.5	Very low	45.4	Very low	147 Å²	147	99.3 Å²	99.3	77%	0.77	58%	0.577	S	S	*	*	H	α-helix	trans	-66.9	-24.9	176.5	-157.8	70.2	0	0	0	113.5	I373	I373-L375 PolarHBondContact O-N 3.26Å
376	K	35.9	Very low	43.9	Very low	167 Å²	167	98 Å²	98	73%	0.726	58%	0.583	S	S	*	*	H	α-helix	trans	-82.9	-42.4	170.3	-75.5	-174.9	174	-177.8	0	112.4	I373 G374 N378 S379	I373-K376 PolarHBondContact O-N 3.33Å; G374-K376 VanDerWaalsContact C-N 3.27Å; G374-K376 PolarHBondContact O-N 2.91Å; K376-N378 VanDerWaalsContact C-N 3.25Å; K376-N378 PolarHBondContact O-N 3.22Å; K376-S379 PolarHBondContact O-N 3.39Å; K376-S379 VanDerWaalsContact O-N 3.16Å; K376-S379 PolarHBondContact O-OG 3.1Å
377	K	35	Very low	42	Very low	163 Å²	163	104.3 Å²	104.3	71%	0.709	61%	0.607	S	S	*	*	H	α-helix	trans	-66.3	-28.8	-174.6	-153	172.4	-174.8	-179	0	112.5	I373 G374 S379 A380	I373-K377 PolarHBondContact O-N 3.45Å; G374-K377 PolarHBondContact O-N 2.97Å; K377-S379 PolarHBondContact O-N 3.1Å; K377-S379 VanDerWaalsContact O-N 3.17Å; K377-A380 PolarHBondContact O-N 3.3Å
378	N	30.6	Very low	40.4	Very low	142 Å²	142	113.8 Å²	113.8	76%	0.759	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-5.5	175	-74.7	0.1	0	0	0	115.3	G374 K376	G374-N378 PolarHBondContact O-N 3.44Å; K376-N378 VanDerWaalsContact C-N 3.25Å; K376-N378 PolarHBondContact O-N 3.22Å
379	S	30.6	Very low	38.5	Very low	110 Å²	110	119.8 Å²	119.8	77%	0.769	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	8.5	173.4	80.7	0	0	0	0	114.3	K376 K377	K376-S379 PolarHBondContact O-N 3.39Å; K376-S379 VanDerWaalsContact O-N 3.16Å; K376-S379 PolarHBondContact O-OG 3.1Å; K377-S379 PolarHBondContact O-N 3.1Å; K377-S379 VanDerWaalsContact O-N 3.17Å
380	A	31.8	Very low	36.9	Very low	88 Å²	88	126.4 Å²	126.4	73%	0.727	70%	0.7	S	S	*	*	S	Bend	trans	-120.5	2.3	-174	0	0	0	0	0	114.3	K377	K377-A380 PolarHBondContact O-N 3.3Å
381	A	32.2	Very low	35.1	Very low	95 Å²	95	129.4 Å²	129.4	79%	0.785	73%	0.733	S	S	*	*	S	Bend	trans	-122.7	65.8	-177.8	0	0	0	0	0	111.2
382	S	26.9	Very low	33.8	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	76%	0.759	S	S	*	*	S	Bend	trans	-159.7	115.2	170.1	-177.9	0	0	0	0	109.6
383	S	27	Very low	32.9	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	77%	0.771	S	S	*	*			trans	-67.3	155.7	179.8	-55	0	0	0	0	112.1	A385	S383-A385 PolarHBondContact O-N 2.93Å
384	P	31.1	Very low	32.1	Very low	143 Å²	143	140.9 Å²	140.9	93%	0.929	79%	0.788	S	S	*	*	S	Bend	trans	-88.2	67.5	-150.4	34.8	-38	0	0	0	115.2
385	A	32	Very low	31.5	Very low	86 Å²	86	143.5 Å²	143.5	71%	0.711	81%	0.806	S	S	*	*			trans	-114.2	109	174.5	0	0	0	0	0	113.5	S383	S383-A385 PolarHBondContact O-N 2.93Å
386	S	35.2	Very low	31.4	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	81%	0.809	S	S	*	*	S	Bend	trans	64.2	94.7	166.3	78	0	0	0	0	119
387	R	29.6	Very low	31.4	Very low	245 Å²	245	140.3 Å²	140.3	93%	0.925	81%	0.812	S	S	*	*				167	118.1	108.8	-88.6	167.3	-176.6	-159.9	-0.1	112.7
388	K	36.8	Very low	32	Very low	203 Å²	203	141.6 Å²	141.6	88%	0.883	82%	0.82	S	S	*	*			trans	-71.8	128.7	163.9	-71.2	173.9	176.4	170.6	0	110.3
389	K	29.6	Very low	32.2	Very low	195 Å²	195	143.7 Å²	143.7	85%	0.848	82%	0.823	S	S	*	*			trans	-176.7	108.2	131	-101.1	162.2	-173.6	179.4	0	113.5
390	N	25.5	Very low	32.8	Very low	162 Å²	162	143.2 Å²	143.2	87%	0.866	82%	0.817	S	S	*	*			trans	38.1	103	147.9	-56.6	10.6	0	0	0	119.6
391	A	28.4	Very low	33.6	Very low	105 Å²	105	148.7 Å²	148.7	87%	0.868	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-90.9	127.6	152.8	0	0	0	0	0	110.3
392	K	31.1	Very low	34.3	Very low	197 Å²	197	155.1 Å²	155.1	86%	0.857	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-83.5	135.7	164.7	-97.2	-171.1	173.7	-175.2	0	109.4
393	T	33.3	Very low	35.7	Very low	139 Å²	139	152 Å²	152	85%	0.853	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-61.4	130.7	175.1	46.8	0	0	0	0	111.9
394	K	30.7	Very low	37.9	Very low	209 Å²	209	150.9 Å²	150.9	91%	0.909	79%	0.79	S	S	*	*			trans	-88.1	111	162	-80.1	-173.2	173.9	-179.7	0	109.6
395	A	30.8	Very low	40.3	Very low	88 Å²	88	146.5 Å²	146.5	73%	0.727	76%	0.763	S	S	*	*			trans	-75.7	165	158.5	0	0	0	0	0	110
396	S	35.8	Very low	42.8	Very low	119 Å²	119	142.5 Å²	142.5	83%	0.832	73%	0.73	S	S	*	*			trans	-64.6	142.1	174.1	46.3	0	0	0	0	112
397	T	35.4	Very low	45.1	Very low	127 Å²	127	139.8 Å²	139.8	78%	0.779	71%	0.706	S	S	*	*			trans	-134.4	111.7	162.8	-45.8	0	0	0	0	106.7	K399	T397-K399 PolarHBondContact O-N 3.5Å
398	E	47.4	Very low	47.8	Very low	191 Å²	191	134.6 Å²	134.6	89%	0.893	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-64.1	130	169.7	-62.4	-164.6	129.5	0	0	108.5
399	K	35.9	Very low	50.2	Low	186 Å²	186	126.2 Å²	126.2	81%	0.809	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-95.1	134.1	167.4	-70.9	-172.4	174.4	-172.4	0	107.8	T397 K401	T397-K399 PolarHBondContact O-N 3.5Å; K399-K401 PolarHBondContact O-N 3.29Å
400	P	43.6	Very low	53	Low	100 Å²	100	117.1 Å²	117.1	65%	0.649	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-57.8	137.7	175.6	23.9	-32.7	0	0	0	110.2
401	K	46.9	Very low	55.9	Low	202 Å²	202	109.8 Å²	109.8	88%	0.878	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.9	141.3	171.7	-67.5	179	-179.4	176	0	108.5	K399	K399-K401 PolarHBondContact O-N 3.29Å
402	R	47.9	Very low	58.6	Low	230 Å²	230	111.1 Å²	111.1	87%	0.868	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-61	149.8	178	-68.6	-179.8	177.7	174.7	-1	110.5
403	P	56.2	Low	61.2	Low	52 Å²	52	104.7 Å²	104.7	34%	0.338	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-58.1	145.9	177.3	24.3	-34.7	0	0	0	111.9	K457	P403-K457 HydrophobicContact CB-CB 4.02Å; P403-K457 HydrophobicContact CG-CB 3.95Å; P403-K457 HydrophobicContact CG-CD 4.5Å; P403-K457 HydrophobicContact CG-CG 4.06Å
404	I	72.6	Confident	63.7	Low	84 Å²	84	101 Å²	101	43%	0.431	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-73.7	128.2	-176.8	-56.9	176.1	0	0	0	109	F408 I409	I404-F408 HydrophobicContact CG2-CB 3.44Å; I404-F408 VanDerWaalsContact CG2-CB 3.44Å; I404-F408 HydrophobicContact CG2-CG 4.5Å; I404-I409 HydrophobicContact CB-CG1 4.41Å; I404-I409 HydrophobicContact CG2-CG1 3.93Å
405	S	81.2	Confident	66.3	Low	52 Å²	52	94 Å²	94	36%	0.364	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-76.5	153.2	-177.1	-169.6	0	0	0	0	112.8	M407 F408 I409 E453	S405-M407 PolarHBondContact O-N 2.85Å; S405-F408 WeakPolarHBondContact O-CA 3.42Å; S405-F408 WeakPolarHBondContact O-CB 3.36Å; S405-F408 PolarHBondContact O-N 3.36Å; S405-I409 PolarHBondContact O-N 3.11Å; S405-I409 VanDerWaalsContact O-N 3.09Å; S405-E453 VanDerWaalsContact CA-CD 3.49Å; S405-E453 WeakPolarHBondContact CA-OE1 2.99Å; S405-E453 VanDerWaalsContact CB-OE1 3.3Å; S405-E453 WeakPolarHBondContact CB-OE1 3.37Å; S405-E453 PolarHBondContact OG-OE1 3.37Å; S405-E453 PolarHBondContact OG-OE2 2.84Å
406	A	84.3	Confident	68.8	Low	2 Å²	2	93.1 Å²	93.1	2%	0.017	47%	0.471	C	S	.	.	H	α-helix	trans	-52.3	-33.7	-175.8	0	0	0	0	0	114.2	I409 F410 W438 Y449 K450 E453	A406-I409 PolarHBondContact O-N 2.94Å; A406-F410 WeakPolarHBondContact O-CB 3.42Å; A406-F410 PolarHBondContact O-N 2.78Å; A406-W438 HydrophobicContact CB-CH2 3.82Å; A406-W438 HydrophobicContact CB-CZ2 4.25Å; A406-Y449 VanDerWaalsContact CB-C 3.44Å; A406-K450 HydrophobicContact CB-CG 4.19Å; A406-E453 HydrophobicContact CB-CB 4.13Å; A406-E453 WeakPolarHBondContact CB-OE2 3.26Å; A406-E453 VanDerWaalsContact N-CD 3.28Å; A406-E453 PolarHBondContact N-OE2 3.38Å
407	M	85.2	Confident	71.1	Confident	47 Å²	47	91.8 Å²	91.8	23%	0.232	45%	0.45	C	S	.	.	H	α-helix	trans	-61	-42.5	172.7	167.5	51.1	-168.2	0	0	112.2	S405 F410 S411 A435 W438	S405-M407 PolarHBondContact O-N 2.85Å; M407-F410 HydrophobicContact SD-CD1 4.39Å; M407-S411 VanDerWaalsContact O-CB 3.3Å; M407-S411 WeakPolarHBondContact O-CB 3.45Å; M407-S411 PolarHBondContact O-N 3.49Å; M407-S411 PolarHBondContact O-OG 2.83Å; M407-A435 HydrophobicContact CE-CB 4.15Å; M407-W438 HydrophobicContact CB-CD2 4.3Å; M407-W438 HydrophobicContact CB-CG 4.47Å; M407-W438 HydrophobicContact CB-CZ2 4.37Å; M407-W438 HydrophobicContact CE-CB 4.28Å; M407-W438 HydrophobicContact CG-CG 4.38Å; M407-W438 HydrophobicContact SD-CB 3.35Å; M407-W438 WeakPolarHBondContact SD-CB 3.47Å; M407-W438 VanDerWaalsContact SD-CD1 3.55Å; M407-W438 HydrophobicContact SD-CD2 3.85Å; M407-W438 HydrophobicContact SD-CG 3.26Å
408	F	85.3	Confident	73.2	Confident	136 Å²	136	86.9 Å²	86.9	60%	0.596	42%	0.419	S	S	*	.	H	α-helix	trans	-71.9	-39	176.6	-86.6	-90.8	0	0	0	112.1	I404 S405 F410 S411 E412	I404-F408 HydrophobicContact CG2-CB 3.44Å; I404-F408 VanDerWaalsContact CG2-CB 3.44Å; I404-F408 HydrophobicContact CG2-CG 4.5Å; S405-F408 WeakPolarHBondContact O-CA 3.42Å; S405-F408 WeakPolarHBondContact O-CB 3.36Å; S405-F408 PolarHBondContact O-N 3.36Å; F408-F410 VanDerWaalsContact C-N 3.29Å; F408-F410 PolarHBondContact O-N 3.43Å; F408-S411 PolarHBondContact O-N 2.93Å; F408-S411 PolarHBondContact O-OG 3.36Å; F408-E412 WeakPolarHBondContact O-CB 3.44Å; F408-E412 PolarHBondContact O-N 2.94Å
409	I	87.5	Confident	74.7	Confident	27 Å²	27	81.3 Å²	81.3	14%	0.138	39%	0.393	C	S	.	.	H	α-helix	trans	-61.3	-40.8	175	-53.5	171.5	0	0	0	110.7	I404 S405 A406 E413 Y449 V452 E453 L456	I404-I409 HydrophobicContact CB-CG1 4.41Å; I404-I409 HydrophobicContact CG2-CG1 3.93Å; S405-I409 PolarHBondContact O-N 3.11Å; S405-I409 VanDerWaalsContact O-N 3.09Å; A406-I409 PolarHBondContact O-N 2.94Å; I409-E413 PolarHBondContact O-N 2.89Å; I409-Y449 HydrophobicContact CB-CD1 4.46Å; I409-Y449 HydrophobicContact CG2-CD1 4.1Å; I409-V452 HydrophobicContact CD1-CB 4.06Å; I409-V452 HydrophobicContact CD1-CG1 3.96Å; I409-V452 HydrophobicContact CG2-CB 4.41Å; I409-V452 HydrophobicContact CG2-CG1 4.13Å; I409-E453 HydrophobicContact CD1-CB 4Å; I409-L456 HydrophobicContact CD1-CD1 3.84Å; I409-L456 HydrophobicContact CG1-CD1 4.44Å
410	F	89.1	Confident	76.9	Confident	5 Å²	5	80.1 Å²	80.1	2%	0.022	39%	0.39	C	S	.	.	H	α-helix	trans	-66.1	-46.7	172.2	164.8	-103.3	0	0	0	112.4	A406 M407 F408 E412 E413 K414 M437 W438 L441 Y449	A406-F410 WeakPolarHBondContact O-CB 3.42Å; A406-F410 PolarHBondContact O-N 2.78Å; M407-F410 HydrophobicContact SD-CD1 4.39Å; F408-F410 VanDerWaalsContact C-N 3.29Å; F408-F410 PolarHBondContact O-N 3.43Å; F410-E412 VanDerWaalsContact C-N 3.27Å; F410-E412 PolarHBondContact O-N 3.02Å; F410-E413 PolarHBondContact O-N 3.31Å; F410-K414 HydrophobicContact CD2-CG 3.95Å; F410-K414 HydrophobicContact CE2-CB 4.29Å; F410-K414 HydrophobicContact CE2-CD 4.38Å; F410-K414 HydrophobicContact CE2-CG 3.32Å; F410-K414 HydrophobicContact CZ-CB 4.26Å; F410-K414 HydrophobicContact CZ-CG 3.68Å; F410-K414 PolarHBondContact O-N 2.92Å; F410-K414 VanDerWaalsContact O-N 3.13Å; F410-M437 HydrophobicContact CE1-CB 4.29Å; F410-M437 HydrophobicContact CZ-CB 4.03Å; F410-W438 HydrophobicContact CB-CE3 3.58Å; F410-W438 HydrophobicContact CB-CZ3 3.64Å; F410-W438 HydrophobicContact CD1-CB 3.8Å; F410-W438 HydrophobicContact CD1-CD2 4.21Å; F410-W438 AromaticContact CD1-CE3 3.56Å; F410-W438 HydrophobicContact CD1-CE3 3.56Å; F410-W438 HydrophobicContact CD1-CG 4.35Å; F410-W438 HydrophobicContact CD1-CZ3 4.47Å; F410-W438 HydrophobicContact CD2-CE3 4.35Å; F410-W438 HydrophobicContact CE1-CB 3.78Å; F410-W438 HydrophobicContact CE1-CE3 4.37Å; F410-W438 AromaticContact CG-CE3 3.54Å; F410-W438 HydrophobicContact CG-CE3 3.54Å; F410-W438 HydrophobicContact CG-CZ3 4.03Å; F410-L441 HydrophobicContact CD1-CD1 4.33Å; F410-L441 HydrophobicContact CD2-CD1 3.56Å; F410-L441 HydrophobicContact CE1-CD1 4.05Å; F410-L441 HydrophobicContact CE2-CD1 3.22Å; F410-L441 HydrophobicContact CE2-CG 4.47Å; F410-L441 HydrophobicContact CG-CD1 4.1Å; F410-L441 HydrophobicContact CZ-CD1 3.5Å; F410-L441 VanDerWaalsContact CZ-CD1 3.5Å; F410-Y449 HydrophobicContact CB-CD1 3.94Å; F410-Y449 HydrophobicContact CB-CD2 4.13Å; F410-Y449 HydrophobicContact CB-CE1 4.1Å; F410-Y449 HydrophobicContact CB-CE2 4.28Å; F410-Y449 HydrophobicContact CB-CG 3.97Å; F410-Y449 HydrophobicContact CD2-CD2 4.47Å; F410-Y449 HydrophobicContact CD2-CE1 4.31Å; F410-Y449 AromaticContact CD2-CE2 3.85Å; F410-Y449 HydrophobicContact CD2-CE2 3.85Å; F410-Y449 AromaticContact CD2-CZ 3.76Å; F410-Y449 HydrophobicContact CG-CE2 4.48Å
411	S	85.6	Confident	78.7	Confident	8 Å²	8	81.9 Å²	81.9	6%	0.056	39%	0.389	C	S	.	.	H	α-helix	trans	-66.5	-32.6	-175.2	80.5	0	0	0	0	111.4	M407 F408 K414 R415	M407-S411 VanDerWaalsContact O-CB 3.3Å; M407-S411 WeakPolarHBondContact O-CB 3.45Å; M407-S411 PolarHBondContact O-N 3.49Å; M407-S411 PolarHBondContact O-OG 2.83Å; F408-S411 PolarHBondContact O-N 2.93Å; F408-S411 PolarHBondContact O-OG 3.36Å; S411-K414 PolarHBondContact O-N 3.44Å; S411-R415 WeakPolarHBondContact O-CA 3.48Å; S411-R415 WeakPolarHBondContact O-CB 3.39Å; S411-R415 PolarHBondContact O-N 2.66Å
412	E	85	Confident	80.1	Confident	132 Å²	132	80 Å²	80	62%	0.617	38%	0.377	S	S	*	.	H	α-helix	trans	-65.3	-49.5	172.2	-168	167.4	-156.7	0	0	112.2	F408 F410 K414 R415	F408-E412 WeakPolarHBondContact O-CB 3.44Å; F408-E412 PolarHBondContact O-N 2.94Å; F410-E412 VanDerWaalsContact C-N 3.27Å; F410-E412 PolarHBondContact O-N 3.02Å; E412-K414 PolarHBondContact O-N 3.08Å; E412-K414 VanDerWaalsContact O-N 3.13Å; E412-R415 PolarHBondContact O-N 3.5Å
413	E	85.8	Confident	81.5	Confident	62 Å²	62	73.4 Å²	73.4	29%	0.29	36%	0.364	S	S	.	.	H	α-helix	trans	-61.2	-25	177.8	-155.8	-140	102.6	0	0	113.2	I409 F410 K417 K448 Y449	I409-E413 PolarHBondContact O-N 2.89Å; F410-E413 PolarHBondContact O-N 3.31Å; E413-K417 WeakPolarHBondContact O-CD 3Å; E413-K417 WeakPolarHBondContact O-CE 3.32Å; E413-K417 IonicContact OE1-NZ 2.73Å; E413-K417 PolarHBondContact OE1-NZ 3.49Å; E413-K448 IonicContact OE2-NZ 2.74Å; E413-K448 PolarHBondContact OE2-NZ 3.38Å; E413-Y449 PolarHBondContact OE2-OH 3.35Å
414	K	85.8	Confident	82.4	Confident	62 Å²	62	78.2 Å²	78.2	27%	0.27	39%	0.387	S	S	.	.	H	α-helix	trans	-102.9	-26.1	-178.7	-69.5	-51.7	-167.2	169.7	0	115.1	F410 S411 E412 K417 L418 L434	F410-K414 HydrophobicContact CD2-CG 3.95Å; F410-K414 HydrophobicContact CE2-CB 4.29Å; F410-K414 HydrophobicContact CE2-CD 4.38Å; F410-K414 HydrophobicContact CE2-CG 3.32Å; F410-K414 HydrophobicContact CZ-CB 4.26Å; F410-K414 HydrophobicContact CZ-CG 3.68Å; F410-K414 PolarHBondContact O-N 2.92Å; F410-K414 VanDerWaalsContact O-N 3.13Å; S411-K414 PolarHBondContact O-N 3.44Å; E412-K414 PolarHBondContact O-N 3.08Å; E412-K414 VanDerWaalsContact O-N 3.13Å; K414-K417 HydrophobicContact CD-CD 4.29Å; K414-K417 PolarHBondContact O-N 3.17Å; K414-L418 WeakPolarHBondContact O-CB 3.22Å; K414-L418 WeakPolarHBondContact O-CG 3.21Å; K414-L418 PolarHBondContact O-N 2.81Å; K414-L434 HydrophobicContact CB-CD2 3.37Å
415	R	84.8	Confident	82.8	Confident	62 Å²	62	76.7 Å²	76.7	23%	0.234	38%	0.379	C	S	.	.	H	α-helix	trans	-57.7	-51.4	174.1	-167.9	-172	-130.3	88	-5.3	109.4	S411 E412 K417 L418 Q419 D427 L430 T431 L434	S411-R415 WeakPolarHBondContact O-CA 3.48Å; S411-R415 WeakPolarHBondContact O-CB 3.39Å; S411-R415 PolarHBondContact O-N 2.66Å; E412-R415 PolarHBondContact O-N 3.5Å; R415-K417 VanDerWaalsContact C-N 3.26Å; R415-K417 PolarHBondContact O-N 3.33Å; R415-L418 PolarHBondContact O-N 2.94Å; R415-Q419 WeakPolarHBondContact O-CB 3.48Å; R415-Q419 PolarHBondContact O-N 3.01Å; R415-D427 IonicContact CZ-OD2 3.42Å; R415-D427 VanDerWaalsContact CZ-OD2 3.3Å; R415-D427 IonicContact NE-OD1 2.7Å; R415-D427 PolarHBondContact NE-OD1 3.27Å; R415-D427 IonicContact NE-OD2 3.46Å; R415-D427 PolarHBondContact NE-OD2 3.45Å; R415-D427 VanDerWaalsContact NE-OD2 3.13Å; R415-D427 IonicContact NH2-OD2 3.5Å; R415-D427 PolarHBondContact NH2-OD2 2.87Å; R415-L430 HydrophobicContact CG-CD2 3.53Å; R415-L430 HydrophobicContact CG-CG 4.04Å; R415-T431 PolarHBondContact NH2-OG1 3.41Å; R415-L434 HydrophobicContact CB-CD1 3.78Å; R415-L434 HydrophobicContact CG-CD1 4.14Å
416	A	83.8	Confident	82.9	Confident	69 Å²	69	77.8 Å²	77.8	57%	0.57	39%	0.385	S	S	*	.	H	α-helix	trans	-55.2	-38.3	179.1	0	0	0	0	0	113.5	Q420	A416-Q420 WeakPolarHBondContact O-CB 3.3Å; A416-Q420 PolarHBondContact O-N 2.96Å
417	K	83.4	Confident	82.7	Confident	91 Å²	91	81.1 Å²	81.1	40%	0.396	40%	0.402	S	S	.	.	H	α-helix	trans	-76.6	-48.7	-179.2	-65.3	171.2	-171.5	171.1	0	111.5	E413 K414 R415 Q419 Q420 E421	E413-K417 WeakPolarHBondContact O-CD 3Å; E413-K417 WeakPolarHBondContact O-CE 3.32Å; E413-K417 IonicContact OE1-NZ 2.73Å; E413-K417 PolarHBondContact OE1-NZ 3.49Å; K414-K417 HydrophobicContact CD-CD 4.29Å; K414-K417 PolarHBondContact O-N 3.17Å; R415-K417 VanDerWaalsContact C-N 3.26Å; R415-K417 PolarHBondContact O-N 3.33Å; K417-Q419 VanDerWaalsContact C-N 3.33Å; K417-Q419 PolarHBondContact O-N 2.97Å; K417-Q420 PolarHBondContact O-N 3.29Å; K417-E421 WeakPolarHBondContact O-CG 3.42Å; K417-E421 PolarHBondContact O-N 3.38Å
418	L	80.9	Confident	82.5	Confident	24 Å²	24	82.6 Å²	82.6	13%	0.126	42%	0.417	C	S	.	.	H	α-helix	trans	-65.8	-33.6	178.9	-71.4	170.4	0	0	0	112.9	K414 R415 Q420 E421 R422 L430 L433 L434 M437	K414-L418 WeakPolarHBondContact O-CB 3.22Å; K414-L418 WeakPolarHBondContact O-CG 3.21Å; K414-L418 PolarHBondContact O-N 2.81Å; R415-L418 PolarHBondContact O-N 2.94Å; L418-Q420 VanDerWaalsContact C-N 3.32Å; L418-E421 PolarHBondContact O-N 2.98Å; L418-R422 WeakPolarHBondContact O-CA 3.19Å; L418-R422 WeakPolarHBondContact O-CB 3.41Å; L418-R422 PolarHBondContact O-N 3.36Å; L418-L430 HydrophobicContact CB-CD1 3.53Å; L418-L430 HydrophobicContact CD1-CD1 3.81Å; L418-L430 HydrophobicContact CG-CD1 4.35Å; L418-L433 HydrophobicContact CD1-CD2 4.08Å; L418-L433 HydrophobicContact CD1-CG 4.34Å; L418-L433 HydrophobicContact CD2-CD2 4.3Å; L418-L434 HydrophobicContact CD1-CD2 3.64Å; L418-L434 HydrophobicContact CD1-CG 4.14Å; L418-M437 HydrophobicContact CD1-SD 3.77Å; L418-M437 HydrophobicContact CD2-SD 4.49Å
419	Q	78.8	Confident	82.5	Confident	74 Å²	74	79.8 Å²	79.8	35%	0.346	41%	0.406	S	S	.	.	H	α-helix	trans	-75.7	-22	178.1	-156.1	148.5	32.8	0	0	112.3	R415 K417 P423 D427 L430	R415-Q419 WeakPolarHBondContact O-CB 3.48Å; R415-Q419 PolarHBondContact O-N 3.01Å; K417-Q419 VanDerWaalsContact C-N 3.33Å; K417-Q419 PolarHBondContact O-N 2.97Å; Q419-P423 WeakPolarHBondContact O-CA 3.47Å; Q419-D427 PolarHBondContact NE2-OD1 3.33Å; Q419-L430 HydrophobicContact CB-CD2 3.88Å; Q419-L430 VanDerWaalsContact CD-CD2 3.5Å; Q419-L430 HydrophobicContact CG-CD2 4.02Å
420	Q	82.1	Confident	82.4	Confident	161 Å²	161	78.6 Å²	78.6	75%	0.752	40%	0.4	S	S	*	.	H	α-helix	trans	-79.1	-40.2	167.7	-172.1	177.5	17	0	0	111.9	A416 K417 L418 R422	A416-Q420 WeakPolarHBondContact O-CB 3.3Å; A416-Q420 PolarHBondContact O-N 2.96Å; K417-Q420 PolarHBondContact O-N 3.29Å; L418-Q420 VanDerWaalsContact C-N 3.32Å; Q420-R422 VanDerWaalsContact C-N 3.34Å
421	E	80.5	Confident	82.2	Confident	137 Å²	137	81.4 Å²	81.4	64%	0.64	42%	0.418	S	S	*	.	H	α-helix	trans	-71.7	-26.4	176.3	-71.4	170	-163.2	0	0	113.1	K417 L418	K417-E421 WeakPolarHBondContact O-CG 3.42Å; K417-E421 PolarHBondContact O-N 3.38Å; L418-E421 PolarHBondContact O-N 2.98Å
422	R	75.5	Confident	82.3	Confident	164 Å²	164	86.9 Å²	86.9	62%	0.619	44%	0.437	S	S	*	.			trans	-145.2	76.5	-177.4	-62.4	-65.5	174.8	173.2	-2.8	111.9	L418 Q420 D424 I425	L418-R422 WeakPolarHBondContact O-CA 3.19Å; L418-R422 WeakPolarHBondContact O-CB 3.41Å; L418-R422 PolarHBondContact O-N 3.36Å; Q420-R422 VanDerWaalsContact C-N 3.34Å; R422-D424 PolarHBondContact O-N 2.78Å; R422-I425 HydrophobicContact CB-CB 4.3Å; R422-I425 HydrophobicContact CB-CD1 3.48Å; R422-I425 VanDerWaalsContact CB-CD1 3.48Å; R422-I425 HydrophobicContact CB-CG1 3.77Å; R422-I425 HydrophobicContact CG-CD1 3.74Å; R422-I425 HydrophobicContact CG-CG1 4.46Å; R422-I425 PolarHBondContact O-N 3.36Å
423	P	78.1	Confident	82.3	Confident	90 Å²	90	83.2 Å²	83.2	58%	0.584	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-32.1	179.8	-25.1	36	0	0	0	114	Q419 I425	Q419-P423 WeakPolarHBondContact O-CA 3.47Å; P423-I425 VanDerWaalsContact C-N 3.3Å; P423-I425 PolarHBondContact O-N 2.76Å
424	D	75.5	Confident	82.4	Confident	153 Å²	153	80.3 Å²	80.3	82%	0.818	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.9	-175	-43.9	-70.3	0	0	0	114.2	R422 P426	R422-D424 PolarHBondContact O-N 2.78Å; D424-P426 WeakPolarHBondContact O-CD 3.25Å
425	I	80.3	Confident	82.4	Confident	53 Å²	53	79 Å²	79	27%	0.272	41%	0.409	S	S	.	.	S	Bend	trans	-80.4	118.2	176.4	-71.4	-178.1	0	0	0	109.1	R422 P423 E429 L430	R422-I425 HydrophobicContact CB-CB 4.3Å; R422-I425 HydrophobicContact CB-CD1 3.48Å; R422-I425 VanDerWaalsContact CB-CD1 3.48Å; R422-I425 HydrophobicContact CB-CG1 3.77Å; R422-I425 HydrophobicContact CG-CD1 3.74Å; R422-I425 HydrophobicContact CG-CG1 4.46Å; R422-I425 PolarHBondContact O-N 3.36Å; P423-I425 VanDerWaalsContact C-N 3.3Å; P423-I425 PolarHBondContact O-N 2.76Å; I425-E429 HydrophobicContact CG2-CB 3.5Å; I425-L430 HydrophobicContact CG2-CB 4.03Å
426	P	83.9	Confident	82.5	Confident	75 Å²	75	81.6 Å²	81.6	49%	0.487	42%	0.418	S	S	.	.			trans	-66.6	150.6	-179.5	28	-34.7	0	0	0	111.1	D424 S428 E429 L430	D424-P426 WeakPolarHBondContact O-CD 3.25Å; P426-S428 PolarHBondContact O-N 3.11Å; P426-E429 HydrophobicContact CG-CB 4.06Å; P426-E429 HydrophobicContact CG-CG 3.75Å; P426-E429 WeakPolarHBondContact O-CA 3.35Å; P426-E429 WeakPolarHBondContact O-CB 3.28Å; P426-E429 PolarHBondContact O-N 2.91Å; P426-L430 PolarHBondContact O-N 3.08Å
427	D	79.3	Confident	82.6	Confident	72 Å²	72	81.3 Å²	81.3	39%	0.385	41%	0.406	S	S	.	.	H	α-helix	trans	-62.9	-19.2	-166	-139.1	60.9	0	0	0	114	R415 Q419 T431	R415-D427 IonicContact CZ-OD2 3.42Å; R415-D427 VanDerWaalsContact CZ-OD2 3.3Å; R415-D427 IonicContact NE-OD1 2.7Å; R415-D427 PolarHBondContact NE-OD1 3.27Å; R415-D427 IonicContact NE-OD2 3.46Å; R415-D427 PolarHBondContact NE-OD2 3.45Å; R415-D427 VanDerWaalsContact NE-OD2 3.13Å; R415-D427 IonicContact NH2-OD2 3.5Å; R415-D427 PolarHBondContact NH2-OD2 2.87Å; Q419-D427 PolarHBondContact NE2-OD1 3.33Å; D427-T431 WeakPolarHBondContact O-CB 3.33Å; D427-T431 PolarHBondContact O-N 3.27Å; D427-T431 PolarHBondContact O-OG1 2.84Å
428	S	82.2	Confident	82.8	Confident	77 Å²	77	78.7 Å²	78.7	54%	0.538	39%	0.393	S	S	.	.	H	α-helix	trans	-79.4	-34.9	172.8	59	0	0	0	0	114.3	P426 R432	P426-S428 PolarHBondContact O-N 3.11Å; S428-R432 WeakPolarHBondContact O-CB 3.5Å; S428-R432 PolarHBondContact O-N 3.25Å
429	E	84.9	Confident	83.1	Confident	77 Å²	77	83 Å²	83	36%	0.36	42%	0.417	S	S	.	.	H	α-helix	trans	-65.2	-48.1	165.8	-78.4	-65.4	136.6	0	0	109.6	I425 P426 T431 R432 L433	I425-E429 HydrophobicContact CG2-CB 3.5Å; P426-E429 HydrophobicContact CG-CB 4.06Å; P426-E429 HydrophobicContact CG-CG 3.75Å; P426-E429 WeakPolarHBondContact O-CA 3.35Å; P426-E429 WeakPolarHBondContact O-CB 3.28Å; P426-E429 PolarHBondContact O-N 2.91Å; E429-T431 PolarHBondContact O-N 3.41Å; E429-R432 CarbonylContact O-C 3.6Å; E429-R432 WeakPolarHBondContact O-CB 3.43Å; E429-R432 PolarHBondContact O-N 2.93Å; E429-R432 VanDerWaalsContact O-N 3.08Å; E429-R432 IonicContact OE1-CZ 3.88Å; E429-R432 IonicContact OE1-NH1 3.55Å; E429-R432 PolarHBondContact OE1-NH1 2.81Å; E429-R432 IonicContact OE1-NH2 3.34Å; E429-R432 PolarHBondContact OE1-NH2 3.1Å; E429-R432 IonicContact OE2-CZ 3.64Å; E429-R432 IonicContact OE2-NH1 2.65Å; E429-R432 IonicContact OE2-NH2 3.79Å; E429-R432 PolarHBondContact OE2-NH2 3.17Å; E429-L433 WeakPolarHBondContact O-CB 3.39Å; E429-L433 PolarHBondContact O-N 2.68Å
430	L	84.8	Confident	83.6	Confident	3 Å²	3	86.1 Å²	86.1	2%	0.016	43%	0.431	C	S	.	.	H	α-helix	trans	-59	-44.7	179.5	-178.9	51.8	0	0	0	111.8	R415 L418 Q419 I425 P426 R432 L433 L434	R415-L430 HydrophobicContact CG-CD2 3.53Å; R415-L430 HydrophobicContact CG-CG 4.04Å; L418-L430 HydrophobicContact CB-CD1 3.53Å; L418-L430 HydrophobicContact CD1-CD1 3.81Å; L418-L430 HydrophobicContact CG-CD1 4.35Å; Q419-L430 HydrophobicContact CB-CD2 3.88Å; Q419-L430 VanDerWaalsContact CD-CD2 3.5Å; Q419-L430 HydrophobicContact CG-CD2 4.02Å; I425-L430 HydrophobicContact CG2-CB 4.03Å; P426-L430 PolarHBondContact O-N 3.08Å; L430-R432 PolarHBondContact O-N 3.44Å; L430-L433 PolarHBondContact O-N 3.24Å; L430-L434 HydrophobicContact CD1-CD1 4.06Å; L430-L434 HydrophobicContact CD1-CG 4.23Å; L430-L434 HydrophobicContact CG-CD1 4.05Å; L430-L434 WeakPolarHBondContact O-CB 3.35Å; L430-L434 WeakPolarHBondContact O-CD1 3.48Å; L430-L434 WeakPolarHBondContact O-CG 3.47Å; L430-L434 PolarHBondContact O-N 3.26Å
431	T	85.8	Confident	83.8	Confident	64 Å²	64	79.5 Å²	79.5	39%	0.393	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-41.1	174.1	-58.7	0	0	0	0	112.3	R415 D427 E429 L434 A435	R415-T431 PolarHBondContact NH2-OG1 3.41Å; D427-T431 WeakPolarHBondContact O-CB 3.33Å; D427-T431 PolarHBondContact O-N 3.27Å; D427-T431 PolarHBondContact O-OG1 2.84Å; E429-T431 PolarHBondContact O-N 3.41Å; T431-L434 PolarHBondContact O-N 3.4Å; T431-A435 WeakPolarHBondContact O-CB 3.44Å; T431-A435 PolarHBondContact O-N 2.89Å
432	R	86.6	Confident	84.3	Confident	122 Å²	122	76.8 Å²	76.8	46%	0.46	40%	0.395	S	S	.	.	H	α-helix	trans	-70.2	-28.9	176	-95	164.8	42.5	-113.1	-2.3	113.7	S428 E429 L430 R436	S428-R432 WeakPolarHBondContact O-CB 3.5Å; S428-R432 PolarHBondContact O-N 3.25Å; E429-R432 CarbonylContact O-C 3.6Å; E429-R432 WeakPolarHBondContact O-CB 3.43Å; E429-R432 PolarHBondContact O-N 2.93Å; E429-R432 VanDerWaalsContact O-N 3.08Å; E429-R432 IonicContact OE1-CZ 3.88Å; E429-R432 IonicContact OE1-NH1 3.55Å; E429-R432 PolarHBondContact OE1-NH1 2.81Å; E429-R432 IonicContact OE1-NH2 3.34Å; E429-R432 PolarHBondContact OE1-NH2 3.1Å; E429-R432 IonicContact OE2-CZ 3.64Å; E429-R432 IonicContact OE2-NH1 2.65Å; E429-R432 IonicContact OE2-NH2 3.79Å; E429-R432 PolarHBondContact OE2-NH2 3.17Å; L430-R432 PolarHBondContact O-N 3.44Å; R432-R436 PolarHBondContact O-N 3.47Å; R432-R436 PolarHBondContact O-NE 2.95Å
433	L	84.9	Confident	84.7	Confident	55 Å²	55	74 Å²	74	29%	0.288	39%	0.393	S	S	.	.	H	α-helix	trans	-72.1	-47.3	172.6	180	58	0	0	0	110.3	L418 E429 L430 A435 R436 M437	L418-L433 HydrophobicContact CD1-CD2 4.08Å; L418-L433 HydrophobicContact CD1-CG 4.34Å; L418-L433 HydrophobicContact CD2-CD2 4.3Å; E429-L433 WeakPolarHBondContact O-CB 3.39Å; E429-L433 PolarHBondContact O-N 2.68Å; L430-L433 PolarHBondContact O-N 3.24Å; L433-A435 VanDerWaalsContact C-N 3.32Å; L433-A435 PolarHBondContact O-N 2.82Å; L433-R436 WeakPolarHBondContact O-CB 3.3Å; L433-R436 PolarHBondContact O-N 2.67Å; L433-R436 VanDerWaalsContact O-N 3.13Å; L433-M437 HydrophobicContact CD1-CG 4.31Å; L433-M437 HydrophobicContact CD1-SD 4.33Å; L433-M437 HydrophobicContact CG-SD 4.09Å; L433-M437 WeakPolarHBondContact O-CG 3.45Å; L433-M437 PolarHBondContact O-N 3.42Å
434	L	87.9	Confident	85.1	Confident	1 Å²	1	79.3 Å²	79.3	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-59.2	-39.6	175.6	-69.8	165.8	0	0	0	112.5	K414 R415 L418 L430 T431 M437 W438	K414-L434 HydrophobicContact CB-CD2 3.37Å; R415-L434 HydrophobicContact CB-CD1 3.78Å; R415-L434 HydrophobicContact CG-CD1 4.14Å; L418-L434 HydrophobicContact CD1-CD2 3.64Å; L418-L434 HydrophobicContact CD1-CG 4.14Å; L430-L434 HydrophobicContact CD1-CD1 4.06Å; L430-L434 HydrophobicContact CD1-CG 4.23Å; L430-L434 HydrophobicContact CG-CD1 4.05Å; L430-L434 WeakPolarHBondContact O-CB 3.35Å; L430-L434 WeakPolarHBondContact O-CD1 3.48Å; L430-L434 WeakPolarHBondContact O-CG 3.47Å; L430-L434 PolarHBondContact O-N 3.26Å; T431-L434 PolarHBondContact O-N 3.4Å; L434-M437 PolarHBondContact O-N 3.39Å; L434-W438 WeakPolarHBondContact O-CB 3.43Å; L434-W438 PolarHBondContact O-N 3.09Å
435	A	85.6	Confident	85.6	Confident	35 Å²	35	78.3 Å²	78.3	29%	0.289	40%	0.395	S	S	.	.	H	α-helix	trans	-63.4	-40.5	174.6	0	0	0	0	0	113	M407 T431 L433 N439	M407-A435 HydrophobicContact CE-CB 4.15Å; T431-A435 WeakPolarHBondContact O-CB 3.44Å; T431-A435 PolarHBondContact O-N 2.89Å; L433-A435 VanDerWaalsContact C-N 3.32Å; L433-A435 PolarHBondContact O-N 2.82Å; A435-N439 VanDerWaalsContact O-CG 3.28Å; A435-N439 PolarHBondContact O-N 3.12Å; A435-N439 VanDerWaalsContact O-N 3.11Å; A435-N439 PolarHBondContact O-ND2 3.39Å
436	R	87.6	Confident	85.9	Confident	117 Å²	117	77.3 Å²	77.3	44%	0.442	39%	0.389	S	S	.	.	H	α-helix	trans	-65	-51.3	173.8	-82.2	176.7	-78.1	174.1	-2	111.6	R432 L433 W438 N439 E440	R432-R436 PolarHBondContact O-N 3.47Å; R432-R436 PolarHBondContact O-NE 2.95Å; L433-R436 WeakPolarHBondContact O-CB 3.3Å; L433-R436 PolarHBondContact O-N 2.67Å; L433-R436 VanDerWaalsContact O-N 3.13Å; R436-W438 PolarHBondContact O-N 2.88Å; R436-N439 PolarHBondContact O-N 3.13Å; R436-E440 WeakPolarHBondContact O-CB 3.47Å; R436-E440 WeakPolarHBondContact O-CG 3.48Å; R436-E440 PolarHBondContact O-N 2.78Å
437	M	85.6	Confident	86.2	Confident	62 Å²	62	76.8 Å²	76.8	31%	0.305	38%	0.38	S	S	.	.	H	α-helix	trans	-59.4	-29.6	177.1	-67.2	179.3	77.1	0	0	113.6	F410 L418 L433 L434 L441	F410-M437 HydrophobicContact CE1-CB 4.29Å; F410-M437 HydrophobicContact CZ-CB 4.03Å; L418-M437 HydrophobicContact CD1-SD 3.77Å; L418-M437 HydrophobicContact CD2-SD 4.49Å; L433-M437 HydrophobicContact CD1-CG 4.31Å; L433-M437 HydrophobicContact CD1-SD 4.33Å; L433-M437 HydrophobicContact CG-SD 4.09Å; L433-M437 WeakPolarHBondContact O-CG 3.45Å; L433-M437 PolarHBondContact O-N 3.42Å; L434-M437 PolarHBondContact O-N 3.39Å; M437-L441 VanDerWaalsContact O-CB 3.24Å; M437-L441 WeakPolarHBondContact O-CB 3.36Å; M437-L441 VanDerWaalsContact O-CG 3.31Å; M437-L441 WeakPolarHBondContact O-CG 3.36Å; M437-L441 PolarHBondContact O-N 2.94Å
438	W	88.6	Confident	86.6	Confident	36 Å²	36	78.4 Å²	78.4	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-72.8	-42.5	171.2	175.4	-104	0	0	0	112.6	A406 M407 F410 L434 R436 L441 K446 Y449	A406-W438 HydrophobicContact CB-CH2 3.82Å; A406-W438 HydrophobicContact CB-CZ2 4.25Å; M407-W438 HydrophobicContact CB-CD2 4.3Å; M407-W438 HydrophobicContact CB-CG 4.47Å; M407-W438 HydrophobicContact CB-CZ2 4.37Å; M407-W438 HydrophobicContact CE-CB 4.28Å; M407-W438 HydrophobicContact CG-CG 4.38Å; M407-W438 HydrophobicContact SD-CB 3.35Å; M407-W438 WeakPolarHBondContact SD-CB 3.47Å; M407-W438 VanDerWaalsContact SD-CD1 3.55Å; M407-W438 HydrophobicContact SD-CD2 3.85Å; M407-W438 HydrophobicContact SD-CG 3.26Å; F410-W438 HydrophobicContact CB-CE3 3.58Å; F410-W438 HydrophobicContact CB-CZ3 3.64Å; F410-W438 HydrophobicContact CD1-CB 3.8Å; F410-W438 HydrophobicContact CD1-CD2 4.21Å; F410-W438 AromaticContact CD1-CE3 3.56Å; F410-W438 HydrophobicContact CD1-CE3 3.56Å; F410-W438 HydrophobicContact CD1-CG 4.35Å; F410-W438 HydrophobicContact CD1-CZ3 4.47Å; F410-W438 HydrophobicContact CD2-CE3 4.35Å; F410-W438 HydrophobicContact CE1-CB 3.78Å; F410-W438 HydrophobicContact CE1-CE3 4.37Å; F410-W438 AromaticContact CG-CE3 3.54Å; F410-W438 HydrophobicContact CG-CE3 3.54Å; F410-W438 HydrophobicContact CG-CZ3 4.03Å; L434-W438 WeakPolarHBondContact O-CB 3.43Å; L434-W438 PolarHBondContact O-N 3.09Å; R436-W438 PolarHBondContact O-N 2.88Å; W438-L441 HydrophobicContact CE3-CD1 3.99Å; W438-L441 VanDerWaalsContact O-CB 3.3Å; W438-L441 WeakPolarHBondContact O-CB 3.46Å; W438-L441 PolarHBondContact O-N 3.29Å; W438-K446 HydrophobicContact CE3-CG 4.33Å; W438-K446 HydrophobicContact CH2-CB 3.9Å; W438-K446 HydrophobicContact CH2-CG 3.98Å; W438-K446 HydrophobicContact CZ2-CB 4.33Å; W438-K446 HydrophobicContact CZ2-CG 4.16Å; W438-K446 HydrophobicContact CZ3-CB 4.26Å; W438-K446 HydrophobicContact CZ3-CG 4.07Å; W438-K446 WeakPolarHBondContact O-CE 3.38Å; W438-K446 PolarHBondContact O-NZ 3.27Å; W438-Y449 AromaticContact CZ3-CD2 3.82Å; W438-Y449 HydrophobicContact CZ3-CD2 3.82Å; W438-Y449 HydrophobicContact CZ3-CG 4.2Å
439	N	87.3	Confident	86.9	Confident	115 Å²	115	75.6 Å²	75.6	62%	0.615	36%	0.361	S	S	*	.	H	α-helix	trans	-65.8	-43.7	179.4	-69.8	-18.7	0	0	0	111.1	A435 R436 L441 K446	A435-N439 VanDerWaalsContact O-CG 3.28Å; A435-N439 PolarHBondContact O-N 3.12Å; A435-N439 VanDerWaalsContact O-N 3.11Å; A435-N439 PolarHBondContact O-ND2 3.39Å; R436-N439 PolarHBondContact O-N 3.13Å; N439-L441 VanDerWaalsContact C-N 3.25Å; N439-L441 PolarHBondContact O-N 3Å; N439-K446 PolarHBondContact O-NZ 3.39Å
440	E	88.9	Confident	87	Confident	139 Å²	139	76.4 Å²	76.4	65%	0.65	36%	0.363	S	S	*	.	S	Bend	trans	-68.5	-17.5	176.3	-67.8	156.2	-155.7	0	0	113.9	R436 P442	R436-E440 WeakPolarHBondContact O-CB 3.47Å; R436-E440 WeakPolarHBondContact O-CG 3.48Å; R436-E440 PolarHBondContact O-N 2.78Å; E440-P442 WeakPolarHBondContact O-CD 3.13Å
441	L	87.2	Confident	87.1	Confident	22 Å²	22	83.5 Å²	83.5	12%	0.115	39%	0.39	C	S	.	.	S	Bend	trans	-66.1	125.3	-175.6	-119.9	170.8	0	0	0	111.5	F410 M437 W438 N439 K445 K446	F410-L441 HydrophobicContact CD1-CD1 4.33Å; F410-L441 HydrophobicContact CD2-CD1 3.56Å; F410-L441 HydrophobicContact CE1-CD1 4.05Å; F410-L441 HydrophobicContact CE2-CD1 3.22Å; F410-L441 HydrophobicContact CE2-CG 4.47Å; F410-L441 HydrophobicContact CG-CD1 4.1Å; F410-L441 HydrophobicContact CZ-CD1 3.5Å; F410-L441 VanDerWaalsContact CZ-CD1 3.5Å; M437-L441 VanDerWaalsContact O-CB 3.24Å; M437-L441 WeakPolarHBondContact O-CB 3.36Å; M437-L441 VanDerWaalsContact O-CG 3.31Å; M437-L441 WeakPolarHBondContact O-CG 3.36Å; M437-L441 PolarHBondContact O-N 2.94Å; W438-L441 HydrophobicContact CE3-CD1 3.99Å; W438-L441 VanDerWaalsContact O-CB 3.3Å; W438-L441 WeakPolarHBondContact O-CB 3.46Å; W438-L441 PolarHBondContact O-N 3.29Å; N439-L441 VanDerWaalsContact C-N 3.25Å; N439-L441 PolarHBondContact O-N 3Å; L441-K445 HydrophobicContact CD2-CB 3.27Å; L441-K445 HydrophobicContact CD2-CD 3.66Å; L441-K445 HydrophobicContact CD2-CG 4.11Å; L441-K446 HydrophobicContact CB-CG 4.06Å; L441-K446 WeakPolarHBondContact O-CD 3.12Å; L441-K446 WeakPolarHBondContact O-CE 3.49Å; L441-K446 PolarHBondContact O-NZ 3.21Å
442	P	90.7	Very high	87	Confident	80 Å²	80	83 Å²	83	52%	0.519	39%	0.387	S	S	.	.			trans	-59.2	144.9	177.2	-29.2	36.5	0	0	0	113.2	E440 K444 K445 K446	E440-P442 WeakPolarHBondContact O-CD 3.13Å; P442-K444 VanDerWaalsContact C-N 3.28Å; P442-K444 PolarHBondContact O-N 3.25Å; P442-K444 VanDerWaalsContact O-N 3.17Å; P442-K445 WeakPolarHBondContact O-CA 3.39Å; P442-K445 WeakPolarHBondContact O-CB 3.49Å; P442-K445 PolarHBondContact O-N 2.91Å; P442-K446 PolarHBondContact O-N 3.2Å; P442-K446 VanDerWaalsContact O-N 3.08Å
443	D	83.8	Confident	87.1	Confident	107 Å²	107	79.9 Å²	79.9	57%	0.572	38%	0.377	S	S	*	.	H	α-helix	trans	-58.9	-36	-172.1	-66.8	-59.6	0	0	0	113.7	K445 K446 E447	D443-K445 PolarHBondContact O-N 3.18Å; D443-K446 PolarHBondContact O-N 2.96Å; D443-K446 VanDerWaalsContact O-N 3.13Å; D443-K446 WeakPolarHBondContact OD1-CD 3.41Å; D443-E447 WeakPolarHBondContact O-CB 3.4Å; D443-E447 PolarHBondContact O-N 3.25Å
444	K	86.4	Confident	87.1	Confident	201 Å²	201	80 Å²	80	87%	0.874	39%	0.386	S	S	*	.	H	α-helix	trans	-54.2	-27.8	172.5	-68.1	-174.6	178.2	-179.3	0	113.4	P442	P442-K444 VanDerWaalsContact C-N 3.28Å; P442-K444 PolarHBondContact O-N 3.25Å; P442-K444 VanDerWaalsContact O-N 3.17Å
445	K	85.5	Confident	87	Confident	132 Å²	132	85.8 Å²	85.8	57%	0.574	42%	0.417	S	S	*	.	H	α-helix	trans	-93.6	-36.9	176.2	-69.1	179.1	179.5	176	0	112.2	L441 P442 D443 E447 K448 Y449	L441-K445 HydrophobicContact CD2-CB 3.27Å; L441-K445 HydrophobicContact CD2-CD 3.66Å; L441-K445 HydrophobicContact CD2-CG 4.11Å; P442-K445 WeakPolarHBondContact O-CA 3.39Å; P442-K445 WeakPolarHBondContact O-CB 3.49Å; P442-K445 PolarHBondContact O-N 2.91Å; D443-K445 PolarHBondContact O-N 3.18Å; K445-E447 PolarHBondContact O-N 2.78Å; K445-K448 WeakPolarHBondContact O-CB 3.48Å; K445-K448 PolarHBondContact O-N 3.09Å; K445-Y449 VanDerWaalsContact O-CD2 3.26Å; K445-Y449 WeakPolarHBondContact O-CD2 3.44Å; K445-Y449 WeakPolarHBondContact O-CE2 3.35Å
446	K	87.6	Confident	86.9	Confident	31 Å²	31	88 Å²	88	14%	0.135	42%	0.423	C	S	.	.	H	α-helix	trans	-56.1	-38.6	169.7	-70	171.2	169.5	139.1	0	111.4	W438 N439 L441 P442 D443 K448 Y449 K450	W438-K446 HydrophobicContact CE3-CG 4.33Å; W438-K446 HydrophobicContact CH2-CB 3.9Å; W438-K446 HydrophobicContact CH2-CG 3.98Å; W438-K446 HydrophobicContact CZ2-CB 4.33Å; W438-K446 HydrophobicContact CZ2-CG 4.16Å; W438-K446 HydrophobicContact CZ3-CB 4.26Å; W438-K446 HydrophobicContact CZ3-CG 4.07Å; W438-K446 WeakPolarHBondContact O-CE 3.38Å; W438-K446 PolarHBondContact O-NZ 3.27Å; N439-K446 PolarHBondContact O-NZ 3.39Å; L441-K446 HydrophobicContact CB-CG 4.06Å; L441-K446 WeakPolarHBondContact O-CD 3.12Å; L441-K446 WeakPolarHBondContact O-CE 3.49Å; L441-K446 PolarHBondContact O-NZ 3.21Å; P442-K446 PolarHBondContact O-N 3.2Å; P442-K446 VanDerWaalsContact O-N 3.08Å; D443-K446 PolarHBondContact O-N 2.96Å; D443-K446 VanDerWaalsContact O-N 3.13Å; D443-K446 WeakPolarHBondContact OD1-CD 3.41Å; K446-K448 VanDerWaalsContact C-N 3.28Å; K446-K448 PolarHBondContact O-N 3.48Å; K446-Y449 PolarHBondContact O-N 3.29Å; K446-K450 PolarHBondContact O-N 2.59Å
447	E	88.8	Confident	86.6	Confident	65 Å²	65	87.2 Å²	87.2	30%	0.304	42%	0.423	S	S	.	.	H	α-helix	trans	-60.1	-30.4	179.8	-173.2	58.9	-155.1	0	0	113.7	D443 K445 Y449 K450 R451	D443-E447 WeakPolarHBondContact O-CB 3.4Å; D443-E447 PolarHBondContact O-N 3.25Å; K445-E447 PolarHBondContact O-N 2.78Å; E447-Y449 VanDerWaalsContact C-N 3.32Å; E447-Y449 PolarHBondContact O-N 3.36Å; E447-K450 PolarHBondContact O-N 2.69Å; E447-K450 WeakPolarHBondContact OE2-CD 3.47Å; E447-R451 VanDerWaalsContact CG-NH2 3.25Å; E447-R451 WeakPolarHBondContact O-CG 3.46Å; E447-R451 PolarHBondContact O-N 2.86Å; E447-R451 IonicContact OE1-CZ 3.9Å; E447-R451 IonicContact OE1-NE 3.27Å; E447-R451 PolarHBondContact OE1-NE 3.38Å; E447-R451 IonicContact OE1-NH2 3.68Å
448	K	88.5	Confident	86.4	Confident	106 Å²	106	86.8 Å²	86.8	46%	0.461	43%	0.429	S	S	.	.	H	α-helix	trans	-53.9	-51.5	169.5	179.9	-162	168.1	-165	0	110.2	E413 K445 K446 R451 V452	E413-K448 IonicContact OE2-NZ 2.74Å; E413-K448 PolarHBondContact OE2-NZ 3.38Å; K445-K448 WeakPolarHBondContact O-CB 3.48Å; K445-K448 PolarHBondContact O-N 3.09Å; K446-K448 VanDerWaalsContact C-N 3.28Å; K446-K448 PolarHBondContact O-N 3.48Å; K448-R451 PolarHBondContact O-N 3.44Å; K448-V452 PolarHBondContact O-N 3.31Å
449	Y	88.5	Confident	86	Confident	18 Å²	18	89.9 Å²	89.9	7%	0.071	45%	0.445	C	S	.	.	H	α-helix	trans	-76.1	-33.3	-174.2	-53.6	-82.8	0	0	0	112.2	A406 I409 F410 E413 W438 K445 K446 E447 R451 V452 E453	A406-Y449 VanDerWaalsContact CB-C 3.44Å; I409-Y449 HydrophobicContact CB-CD1 4.46Å; I409-Y449 HydrophobicContact CG2-CD1 4.1Å; F410-Y449 HydrophobicContact CB-CD1 3.94Å; F410-Y449 HydrophobicContact CB-CD2 4.13Å; F410-Y449 HydrophobicContact CB-CE1 4.1Å; F410-Y449 HydrophobicContact CB-CE2 4.28Å; F410-Y449 HydrophobicContact CB-CG 3.97Å; F410-Y449 HydrophobicContact CD2-CD2 4.47Å; F410-Y449 HydrophobicContact CD2-CE1 4.31Å; F410-Y449 AromaticContact CD2-CE2 3.85Å; F410-Y449 HydrophobicContact CD2-CE2 3.85Å; F410-Y449 AromaticContact CD2-CZ 3.76Å; F410-Y449 HydrophobicContact CG-CE2 4.48Å; E413-Y449 PolarHBondContact OE2-OH 3.35Å; W438-Y449 AromaticContact CZ3-CD2 3.82Å; W438-Y449 HydrophobicContact CZ3-CD2 3.82Å; W438-Y449 HydrophobicContact CZ3-CG 4.2Å; K445-Y449 VanDerWaalsContact O-CD2 3.26Å; K445-Y449 WeakPolarHBondContact O-CD2 3.44Å; K445-Y449 WeakPolarHBondContact O-CE2 3.35Å; K446-Y449 PolarHBondContact O-N 3.29Å; E447-Y449 VanDerWaalsContact C-N 3.32Å; E447-Y449 PolarHBondContact O-N 3.36Å; Y449-R451 VanDerWaalsContact C-N 3.28Å; Y449-R451 PolarHBondContact O-N 2.89Å; Y449-V452 PolarHBondContact O-N 3.03Å; Y449-V452 VanDerWaalsContact O-N 3.13Å; Y449-E453 PolarHBondContact O-N 3.45Å
450	K	86.9	Confident	85.5	Confident	93 Å²	93	86.4 Å²	86.4	40%	0.404	43%	0.43	S	S	.	.	H	α-helix	trans	-57.8	-38.4	171.3	-71.3	177.6	179.4	173.6	0	112.5	A406 K446 E447 E453 A454	A406-K450 HydrophobicContact CB-CG 4.19Å; K446-K450 PolarHBondContact O-N 2.59Å; E447-K450 PolarHBondContact O-N 2.69Å; E447-K450 WeakPolarHBondContact OE2-CD 3.47Å; K450-E453 PolarHBondContact O-N 2.99Å; K450-A454 WeakPolarHBondContact O-CB 3.41Å; K450-A454 PolarHBondContact O-N 3.43Å
451	R	87.1	Confident	84.9	Confident	153 Å²	153	84 Å²	84	58%	0.577	42%	0.419	S	S	*	.	H	α-helix	trans	-69.3	-35.7	175.3	-66.7	174.7	-158.8	157.4	-0.3	112.6	E447 K448 Y449 A454 L455	E447-R451 VanDerWaalsContact CG-NH2 3.25Å; E447-R451 WeakPolarHBondContact O-CG 3.46Å; E447-R451 PolarHBondContact O-N 2.86Å; E447-R451 IonicContact OE1-CZ 3.9Å; E447-R451 IonicContact OE1-NE 3.27Å; E447-R451 PolarHBondContact OE1-NE 3.38Å; E447-R451 IonicContact OE1-NH2 3.68Å; K448-R451 PolarHBondContact O-N 3.44Å; Y449-R451 VanDerWaalsContact C-N 3.28Å; Y449-R451 PolarHBondContact O-N 2.89Å; R451-A454 PolarHBondContact O-N 3Å; R451-L455 VanDerWaalsContact O-CG 3.3Å; R451-L455 WeakPolarHBondContact O-CG 3.47Å; R451-L455 PolarHBondContact O-N 3.09Å
452	V	83.7	Confident	84.4	Confident	53 Å²	53	88.1 Å²	88.1	32%	0.321	44%	0.436	S	S	.	.	H	α-helix	trans	-68.7	-40.7	174.2	-173.1	0	0	0	0	110.9	I409 K448 Y449 A454 L455 L456	I409-V452 HydrophobicContact CD1-CB 4.06Å; I409-V452 HydrophobicContact CD1-CG1 3.96Å; I409-V452 HydrophobicContact CG2-CB 4.41Å; I409-V452 HydrophobicContact CG2-CG1 4.13Å; K448-V452 PolarHBondContact O-N 3.31Å; Y449-V452 PolarHBondContact O-N 3.03Å; Y449-V452 VanDerWaalsContact O-N 3.13Å; V452-A454 VanDerWaalsContact C-N 3.35Å; V452-A454 PolarHBondContact O-N 3.18Å; V452-L455 PolarHBondContact O-N 3.37Å; V452-L456 HydrophobicContact CG1-CD1 4Å; V452-L456 HydrophobicContact CG1-CG 4.29Å; V452-L456 WeakPolarHBondContact O-CB 3.18Å; V452-L456 WeakPolarHBondContact O-CG 3.32Å; V452-L456 PolarHBondContact O-N 2.92Å
453	E	87.2	Confident	83.5	Confident	57 Å²	57	90.2 Å²	90.2	27%	0.266	44%	0.437	S	S	.	.	H	α-helix	trans	-57.4	-45.6	170.7	171.8	174.4	-155.3	0	0	111.5	S405 A406 I409 Y449 K450 L455 L456 K457	S405-E453 VanDerWaalsContact CA-CD 3.49Å; S405-E453 WeakPolarHBondContact CA-OE1 2.99Å; S405-E453 VanDerWaalsContact CB-OE1 3.3Å; S405-E453 WeakPolarHBondContact CB-OE1 3.37Å; S405-E453 PolarHBondContact OG-OE1 3.37Å; S405-E453 PolarHBondContact OG-OE2 2.84Å; A406-E453 HydrophobicContact CB-CB 4.13Å; A406-E453 WeakPolarHBondContact CB-OE2 3.26Å; A406-E453 VanDerWaalsContact N-CD 3.28Å; A406-E453 PolarHBondContact N-OE2 3.38Å; I409-E453 HydrophobicContact CD1-CB 4Å; Y449-E453 PolarHBondContact O-N 3.45Å; K450-E453 PolarHBondContact O-N 2.99Å; E453-L455 PolarHBondContact O-N 3.12Å; E453-L456 PolarHBondContact O-N 3.17Å; E453-K457 WeakPolarHBondContact O-CB 3.34Å; E453-K457 PolarHBondContact O-N 3.49Å
454	A	85	Confident	82.8	Confident	58 Å²	58	90.9 Å²	90.9	48%	0.479	44%	0.436	S	S	.	.	H	α-helix	trans	-63.2	-40.5	177.5	0	0	0	0	0	113	K450 R451 V452 A458	K450-A454 WeakPolarHBondContact O-CB 3.41Å; K450-A454 PolarHBondContact O-N 3.43Å; R451-A454 PolarHBondContact O-N 3Å; V452-A454 VanDerWaalsContact C-N 3.35Å; V452-A454 PolarHBondContact O-N 3.18Å; A454-A458 WeakPolarHBondContact O-CB 3.4Å; A454-A458 PolarHBondContact O-N 3.23Å
455	L	86.5	Confident	81.9	Confident	122 Å²	122	89.6 Å²	89.6	64%	0.639	43%	0.426	S	S	*	.	H	α-helix	trans	-69.5	-45.2	177.1	-71.7	167.4	0	0	0	112.2	R451 V452 E453 K457 A458 E459	R451-L455 VanDerWaalsContact O-CG 3.3Å; R451-L455 WeakPolarHBondContact O-CG 3.47Å; R451-L455 PolarHBondContact O-N 3.09Å; V452-L455 PolarHBondContact O-N 3.37Å; E453-L455 PolarHBondContact O-N 3.12Å; L455-K457 VanDerWaalsContact C-N 3.29Å; L455-K457 PolarHBondContact O-N 3.02Å; L455-A458 PolarHBondContact O-N 2.89Å; L455-E459 PolarHBondContact O-N 3.01Å
456	L	82.8	Confident	81.1	Confident	81 Å²	81	87.4 Å²	87.4	42%	0.424	42%	0.418	S	S	.	.	H	α-helix	trans	-62.9	-37	175.2	-71.4	173.6	0	0	0	111.7	I409 V452 E453 S460	I409-L456 HydrophobicContact CD1-CD1 3.84Å; I409-L456 HydrophobicContact CG1-CD1 4.44Å; V452-L456 HydrophobicContact CG1-CD1 4Å; V452-L456 HydrophobicContact CG1-CG 4.29Å; V452-L456 WeakPolarHBondContact O-CB 3.18Å; V452-L456 WeakPolarHBondContact O-CG 3.32Å; V452-L456 PolarHBondContact O-N 2.92Å; E453-L456 PolarHBondContact O-N 3.17Å; L456-S460 WeakPolarHBondContact O-CB 3.4Å; L456-S460 PolarHBondContact O-N 3.11Å; L456-S460 PolarHBondContact O-OG 3.34Å
457	K	82.3	Confident	79.8	Confident	100 Å²	100	88.9 Å²	88.9	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-62.7	-50.5	171.6	176.8	172.6	173.3	-177.4	0	111.4	P403 E453 L455 E459 S460 E461	P403-K457 HydrophobicContact CB-CB 4.02Å; P403-K457 HydrophobicContact CG-CB 3.95Å; P403-K457 HydrophobicContact CG-CD 4.5Å; P403-K457 HydrophobicContact CG-CG 4.06Å; E453-K457 WeakPolarHBondContact O-CB 3.34Å; E453-K457 PolarHBondContact O-N 3.49Å; L455-K457 VanDerWaalsContact C-N 3.29Å; L455-K457 PolarHBondContact O-N 3.02Å; K457-E459 VanDerWaalsContact C-N 3.32Å; K457-E459 PolarHBondContact O-N 3.34Å; K457-S460 WeakPolarHBondContact CA-OG 3.43Å; K457-S460 PolarHBondContact O-N 3.38Å; K457-S460 VanDerWaalsContact O-N 3.09Å; K457-S460 PolarHBondContact O-OG 2.88Å; K457-E461 WeakPolarHBondContact CE-OE1 3.5Å; K457-E461 HydrophobicContact CG-CG 4.5Å; K457-E461 IonicContact NZ-OE1 2.68Å; K457-E461 PolarHBondContact O-N 3.43Å
458	A	82.1	Confident	78.5	Confident	54 Å²	54	95.2 Å²	95.2	45%	0.446	45%	0.448	S	S	.	.	H	α-helix	trans	-59.2	-41.5	179.5	0	0	0	0	0	112.4	A454 L455 E461 K462	A454-A458 WeakPolarHBondContact O-CB 3.4Å; A454-A458 PolarHBondContact O-N 3.23Å; L455-A458 PolarHBondContact O-N 2.89Å; A458-E461 PolarHBondContact O-N 2.8Å; A458-K462 VanDerWaalsContact O-CB 3.27Å; A458-K462 WeakPolarHBondContact O-CB 3.48Å; A458-K462 PolarHBondContact O-N 2.91Å
459	E	79.8	Confident	77.1	Confident	101 Å²	101	94.7 Å²	94.7	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-68.3	-34.8	175.7	-165.4	58.8	-145.8	0	0	111.8	L455 K457 K462 K463	L455-E459 PolarHBondContact O-N 3.01Å; K457-E459 VanDerWaalsContact C-N 3.32Å; K457-E459 PolarHBondContact O-N 3.34Å; E459-K462 PolarHBondContact O-N 2.93Å; E459-K462 IonicContact OE1-NZ 2.66Å; E459-K462 PolarHBondContact OE1-NZ 3.4Å; E459-K462 IonicContact OE2-NZ 3.93Å; E459-K462 PolarHBondContact OE2-NZ 3.13Å; E459-K463 WeakPolarHBondContact O-CB 3.28Å; E459-K463 PolarHBondContact O-N 3.47Å
460	S	75.9	Confident	76	Confident	42 Å²	42	99.5 Å²	99.5	29%	0.294	48%	0.476	S	S	.	.	H	α-helix	trans	-67.3	-39.6	173.6	74.8	0	0	0	0	113.5	L456 K457 K463 E464	L456-S460 WeakPolarHBondContact O-CB 3.4Å; L456-S460 PolarHBondContact O-N 3.11Å; L456-S460 PolarHBondContact O-OG 3.34Å; K457-S460 WeakPolarHBondContact CA-OG 3.43Å; K457-S460 PolarHBondContact O-N 3.38Å; K457-S460 VanDerWaalsContact O-N 3.09Å; K457-S460 PolarHBondContact O-OG 2.88Å; S460-K463 PolarHBondContact O-N 3.31Å; S460-E464 PolarHBondContact O-N 3.23Å
461	E	77.1	Confident	75.1	Confident	87 Å²	87	100.8 Å²	100.8	41%	0.407	49%	0.486	S	S	.	.	H	α-helix	trans	-71.9	-33	176.4	-70.3	179.6	-175.6	0	0	112.1	K457 A458 R465	K457-E461 WeakPolarHBondContact CE-OE1 3.5Å; K457-E461 HydrophobicContact CG-CG 4.5Å; K457-E461 IonicContact NZ-OE1 2.68Å; K457-E461 PolarHBondContact O-N 3.43Å; A458-E461 PolarHBondContact O-N 2.8Å; E461-R465 WeakPolarHBondContact O-CB 3.38Å; E461-R465 PolarHBondContact O-N 3.4Å; E461-R465 VanDerWaalsContact O-N 3.08Å
462	K	77	Confident	74.5	Confident	110 Å²	110	94.5 Å²	94.5	48%	0.478	47%	0.465	S	S	.	.	H	α-helix	trans	-64.9	-46	170.3	172.5	177.2	159.7	-123.1	0	110.9	A458 E459 R465 E466	A458-K462 VanDerWaalsContact O-CB 3.27Å; A458-K462 WeakPolarHBondContact O-CB 3.48Å; A458-K462 PolarHBondContact O-N 2.91Å; E459-K462 PolarHBondContact O-N 2.93Å; E459-K462 IonicContact OE1-NZ 2.66Å; E459-K462 PolarHBondContact OE1-NZ 3.4Å; E459-K462 IonicContact OE2-NZ 3.93Å; E459-K462 PolarHBondContact OE2-NZ 3.13Å; K462-R465 WeakPolarHBondContact O-CB 3.43Å; K462-R465 PolarHBondContact O-N 3.27Å; K462-E466 PolarHBondContact O-N 2.96Å
463	K	71.5	Confident	74.3	Confident	123 Å²	123	96.8 Å²	96.8	54%	0.535	48%	0.476	S	S	.	.	H	α-helix	trans	-64.6	-42.5	175.8	-176	170.3	-179.4	175.6	0	112.6	E459 S460 R465 E466 D467	E459-K463 WeakPolarHBondContact O-CB 3.28Å; E459-K463 PolarHBondContact O-N 3.47Å; S460-K463 PolarHBondContact O-N 3.31Å; K463-R465 VanDerWaalsContact C-N 3.27Å; K463-R465 PolarHBondContact O-N 3.21Å; K463-E466 PolarHBondContact O-N 3.37Å; K463-D467 WeakPolarHBondContact CE-OD2 3.33Å; K463-D467 WeakPolarHBondContact CG-OD2 2.83Å; K463-D467 WeakPolarHBondContact O-CB 3.36Å; K463-D467 PolarHBondContact O-N 3.49Å
464	E	68.6	Low	74	Confident	122 Å²	122	98.6 Å²	98.6	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-59.5	-39.5	173.8	-177.2	178.1	-172.7	0	0	111.6	S460 R468	S460-E464 PolarHBondContact O-N 3.23Å; E464-R468 VanDerWaalsContact O-CB 3.27Å; E464-R468 WeakPolarHBondContact O-CB 3.17Å; E464-R468 PolarHBondContact O-N 2.94Å
465	R	67.8	Low	74.2	Confident	174 Å²	174	97.5 Å²	97.5	66%	0.657	48%	0.481	S	S	*	.	H	α-helix	trans	-66.2	-40.7	175.8	-168.2	-178.5	-54	167.3	7.8	112.3	E461 K462 K463 S469	E461-R465 WeakPolarHBondContact O-CB 3.38Å; E461-R465 PolarHBondContact O-N 3.4Å; E461-R465 VanDerWaalsContact O-N 3.08Å; K462-R465 WeakPolarHBondContact O-CB 3.43Å; K462-R465 PolarHBondContact O-N 3.27Å; K463-R465 VanDerWaalsContact C-N 3.27Å; K463-R465 PolarHBondContact O-N 3.21Å; R465-S469 PolarHBondContact O-N 2.98Å; R465-S469 VanDerWaalsContact O-N 3.15Å
466	E	68.4	Low	74.4	Confident	85 Å²	85	95.1 Å²	95.1	40%	0.397	47%	0.465	S	S	.	.	H	α-helix	trans	-66.3	-50.6	176.1	-165.4	-174.6	165.9	0	0	111.3	K462 K463 R468 S469 R470	K462-E466 PolarHBondContact O-N 2.96Å; K463-E466 PolarHBondContact O-N 3.37Å; E466-R468 VanDerWaalsContact C-N 3.26Å; E466-R468 PolarHBondContact O-N 3.4Å; E466-S469 CarbonylContact O-C 3.55Å; E466-S469 WeakPolarHBondContact O-CA 3.48Å; E466-S469 WeakPolarHBondContact O-CB 3.45Å; E466-S469 PolarHBondContact O-N 3.25Å; E466-S469 PolarHBondContact O-OG 2.75Å; E466-R470 VanDerWaalsContact CD-NH2 3.34Å; E466-R470 WeakPolarHBondContact O-CG 3.42Å; E466-R470 PolarHBondContact O-N 2.81Å; E466-R470 VanDerWaalsContact O-N 3.11Å; E466-R470 IonicContact OE1-CZ 3.35Å; E466-R470 IonicContact OE1-NE 2.64Å; E466-R470 IonicContact OE1-NH2 3.29Å; E466-R470 PolarHBondContact OE1-NH2 2.71Å; E466-R470 IonicContact OE2-NH2 3.41Å
467	D	60.7	Low	74.9	Confident	63 Å²	63	94.8 Å²	94.8	34%	0.337	47%	0.466	S	S	.	.	H	α-helix	trans	-62.7	-31.8	177.3	-73.8	-35.2	0	0	0	112.1	K463 S469 R470	K463-D467 WeakPolarHBondContact CE-OD2 3.33Å; K463-D467 WeakPolarHBondContact CG-OD2 2.83Å; K463-D467 WeakPolarHBondContact O-CB 3.36Å; K463-D467 PolarHBondContact O-N 3.49Å; D467-S469 VanDerWaalsContact C-N 3.32Å; D467-S469 PolarHBondContact O-N 2.81Å; D467-R470 PolarHBondContact O-N 2.85Å; D467-R470 IonicContact OD1-CZ 2.65Å; D467-R470 IonicContact OD1-NE 3.37Å; D467-R470 IonicContact OD1-NH1 2.83Å; D467-R470 PolarHBondContact OD1-NH1 2.68Å
468	R	60.4	Low	75.3	Confident	198 Å²	198	90.6 Å²	90.6	75%	0.747	45%	0.451	S	S	*	.	H	α-helix	trans	-68.2	-28.5	170.3	-159.1	-176.3	84.7	-172.6	7.5	113.2	E464 E466 R470	E464-R468 VanDerWaalsContact O-CB 3.27Å; E464-R468 WeakPolarHBondContact O-CB 3.17Å; E464-R468 PolarHBondContact O-N 2.94Å; E466-R468 VanDerWaalsContact C-N 3.26Å; E466-R468 PolarHBondContact O-N 3.4Å; R468-R470 VanDerWaalsContact C-N 3.33Å
469	S	59.5	Low	75.8	Confident	94 Å²	94	90.6 Å²	90.6	66%	0.657	44%	0.442	S	S	*	.	H	α-helix	trans	-81.7	-10.3	174	68.9	0	0	0	0	113.9	R465 E466 D467	R465-S469 PolarHBondContact O-N 2.98Å; R465-S469 VanDerWaalsContact O-N 3.15Å; E466-S469 CarbonylContact O-C 3.55Å; E466-S469 WeakPolarHBondContact O-CA 3.48Å; E466-S469 WeakPolarHBondContact O-CB 3.45Å; E466-S469 PolarHBondContact O-N 3.25Å; E466-S469 PolarHBondContact O-OG 2.75Å; D467-S469 VanDerWaalsContact C-N 3.32Å; D467-S469 PolarHBondContact O-N 2.81Å
470	R	65.9	Low	76.5	Confident	120 Å²	120	90.2 Å²	90.2	45%	0.453	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	8.1	174.8	-66.2	171.4	-177	176.5	-11.7	113.6	E466 D467 R468 M538	E466-R470 VanDerWaalsContact CD-NH2 3.34Å; E466-R470 WeakPolarHBondContact O-CG 3.42Å; E466-R470 PolarHBondContact O-N 2.81Å; E466-R470 VanDerWaalsContact O-N 3.11Å; E466-R470 IonicContact OE1-CZ 3.35Å; E466-R470 IonicContact OE1-NE 2.64Å; E466-R470 IonicContact OE1-NH2 3.29Å; E466-R470 PolarHBondContact OE1-NH2 2.71Å; E466-R470 IonicContact OE2-NH2 3.41Å; D467-R470 PolarHBondContact O-N 2.85Å; D467-R470 IonicContact OD1-CZ 2.65Å; D467-R470 IonicContact OD1-NE 3.37Å; D467-R470 IonicContact OD1-NH1 2.83Å; D467-R470 PolarHBondContact OD1-NH1 2.68Å; R468-R470 VanDerWaalsContact C-N 3.33Å; R470-M538 VanDerWaalsContact O-CE 3.23Å; R470-M538 WeakPolarHBondContact O-CE 3.36Å
471	L	68.1	Low	77.2	Confident	119 Å²	119	89 Å²	89	62%	0.623	43%	0.43	S	S	*	.	S	Bend	trans	-114.7	136.3	178.1	-68.3	176.2	0	0	0	111.2
472	P	75.4	Confident	78.1	Confident	21 Å²	21	85.3 Å²	85.3	14%	0.136	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-59.9	148.3	174	-23.5	33.8	0	0	0	113.1	Y531 D534 L535 M538	P472-Y531 HydrophobicContact CB-CD2 4.18Å; P472-Y531 HydrophobicContact CB-CE2 4.37Å; P472-D534 HydrophobicContact CB-CB 3.74Å; P472-D534 HydrophobicContact CG-CB 3.69Å; P472-L535 HydrophobicContact CG-CD2 4.24Å; P472-M538 HydrophobicContact CG-CG 4.04Å
473	D	78.4	Confident	78.9	Confident	102 Å²	102	81.1 Å²	81.1	55%	0.545	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-56.4	134.2	174.9	-66.9	-56.3	0	0	0	111.7	R530 Y531	D473-R530 IonicContact OD2-NH1 3.84Å; D473-Y531 WeakPolarHBondContact O-CD2 3.2Å
474	P	80.8	Confident	79.9	Confident	94 Å²	94	81 Å²	81	61%	0.61	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-62.4	149	176.5	26.9	-34.6	0	0	0	112.1
475	P	88.8	Confident	81	Confident	36 Å²	36	78.4 Å²	78.4	23%	0.234	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-75.1	135.4	-169.8	29.6	-31.5	0	0	0	111.2	Q528 Y531	P475-Q528 HydrophobicContact CB-CB 4.46Å; P475-Q528 VanDerWaalsContact CG-OE1 3.24Å; P475-Y531 HydrophobicContact CB-CD1 4.38Å; P475-Y531 HydrophobicContact CB-CG 4.22Å; P475-Y531 VanDerWaalsContact CD-CD1 3.5Å; P475-Y531 HydrophobicContact CG-CD1 3.69Å; P475-Y531 HydrophobicContact CG-CE1 4.24Å; P475-Y531 HydrophobicContact CG-CG 3.96Å
476	K	91.3	Very high	82.2	Confident	71 Å²	71	71.3 Å²	71.3	31%	0.309	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-82.7	142.3	-173.5	-66.1	167.1	-174.6	168.8	0	111.9	E480 I481 D527	K476-E480 HydrophobicContact CB-CB 4.14Å; K476-I481 HydrophobicContact CB-CD1 4.08Å; K476-I481 HydrophobicContact CB-CG1 3.59Å; K476-I481 HydrophobicContact CD-CG1 4.38Å; K476-D527 WeakPolarHBondContact CB-OD2 3.45Å; K476-D527 PolarHBondContact N-OD2 3.02Å
477	T	92.4	Very high	83.3	Confident	74 Å²	74	69.5 Å²	69.5	45%	0.454	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-68.7	161.3	170.9	65.2	0	0	0	0	111.5	Q479 E480 I481	T477-Q479 PolarHBondContact O-N 3.28Å; T477-E480 VanDerWaalsContact CB-OE2 3.24Å; T477-E480 WeakPolarHBondContact CB-OE2 3.31Å; T477-E480 VanDerWaalsContact CG2-OE2 3.29Å; T477-E480 WeakPolarHBondContact CG2-OE2 3.43Å; T477-E480 PolarHBondContact N-OE2 2.64Å; T477-E480 PolarHBondContact O-N 2.83Å; T477-E480 VanDerWaalsContact O-N 3.09Å; T477-E480 WeakPolarHBondContact OG1-CG 3.4Å; T477-E480 PolarHBondContact OG1-N 3.49Å; T477-E480 PolarHBondContact OG1-OE2 2.94Å; T477-I481 WeakPolarHBondContact O-CG1 3.39Å; T477-I481 PolarHBondContact O-N 2.96Å
478	A	92	Very high	84.7	Confident	13 Å²	13	68.9 Å²	68.9	11%	0.107	37%	0.368	C	S	.	.	H	α-helix	trans	-56.1	-33.8	174.5	0	0	0	0	0	112.5	W482 W509 W520 I521 A524	A478-W482 WeakPolarHBondContact O-CB 3.03Å; A478-W482 PolarHBondContact O-N 2.69Å; A478-W482 VanDerWaalsContact O-N 3.09Å; A478-W509 HydrophobicContact CB-CH2 3.71Å; A478-W509 HydrophobicContact CB-CZ2 3.96Å; A478-W520 HydrophobicContact CB-CB 4.02Å; A478-W520 WeakPolarHBondContact CB-O 3.45Å; A478-I521 HydrophobicContact CB-CG1 3.89Å; A478-A524 HydrophobicContact CB-CB 4.1Å
479	Q	93.1	Very high	86.2	Confident	54 Å²	54	64.1 Å²	64.1	25%	0.252	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-49.1	175	-176.1	167.6	-20.9	0	0	111.3	T477 I481 W482 Q483 W509	T477-Q479 PolarHBondContact O-N 3.28Å; Q479-I481 PolarHBondContact O-N 3.44Å; Q479-W482 PolarHBondContact O-N 2.73Å; Q479-Q483 HydrophobicContact CG-CG 4.35Å; Q479-Q483 VanDerWaalsContact O-CB 3.3Å; Q479-Q483 WeakPolarHBondContact O-CB 3.42Å; Q479-Q483 VanDerWaalsContact O-CG 3.24Å; Q479-Q483 WeakPolarHBondContact O-CG 3.25Å; Q479-Q483 PolarHBondContact O-N 3.45Å; Q479-W509 HydrophobicContact CB-CD2 4.03Å; Q479-W509 HydrophobicContact CB-CG 4.24Å; Q479-W509 HydrophobicContact CB-CZ2 3.99Å; Q479-W509 HydrophobicContact CG-CB 4.4Å; Q479-W509 HydrophobicContact CG-CD2 4Å; Q479-W509 HydrophobicContact CG-CG 3.73Å
480	E	92.6	Very high	87.7	Confident	92 Å²	92	61.3 Å²	61.3	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-66.6	-36.2	-178.6	-70.5	157.7	129.9	0	0	112.5	K476 T477 Q483 Q484	K476-E480 HydrophobicContact CB-CB 4.14Å; T477-E480 VanDerWaalsContact CB-OE2 3.24Å; T477-E480 WeakPolarHBondContact CB-OE2 3.31Å; T477-E480 VanDerWaalsContact CG2-OE2 3.29Å; T477-E480 WeakPolarHBondContact CG2-OE2 3.43Å; T477-E480 PolarHBondContact N-OE2 2.64Å; T477-E480 PolarHBondContact O-N 2.83Å; T477-E480 VanDerWaalsContact O-N 3.09Å; T477-E480 WeakPolarHBondContact OG1-CG 3.4Å; T477-E480 PolarHBondContact OG1-N 3.49Å; T477-E480 PolarHBondContact OG1-OE2 2.94Å; E480-Q483 PolarHBondContact O-N 3.01Å; E480-Q484 VanDerWaalsContact O-CB 3.29Å; E480-Q484 WeakPolarHBondContact O-CB 3.41Å; E480-Q484 PolarHBondContact O-N 3Å
481	I	92.4	Very high	89	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.087	32%	0.315	C	S	.	.	H	α-helix	trans	-69.1	-42	176.1	-62.1	176	0	0	0	111	K476 T477 Q479 S485 W520 K523 A524 D527	K476-I481 HydrophobicContact CB-CD1 4.08Å; K476-I481 HydrophobicContact CB-CG1 3.59Å; K476-I481 HydrophobicContact CD-CG1 4.38Å; T477-I481 WeakPolarHBondContact O-CG1 3.39Å; T477-I481 PolarHBondContact O-N 2.96Å; Q479-I481 PolarHBondContact O-N 3.44Å; I481-S485 PolarHBondContact O-N 3.17Å; I481-S485 VanDerWaalsContact O-N 3.15Å; I481-W520 HydrophobicContact CG2-CE3 3.97Å; I481-W520 HydrophobicContact CG2-CZ3 4.18Å; I481-K523 HydrophobicContact CG2-CB 4.26Å; I481-K523 HydrophobicContact CG2-CD 3.81Å; I481-K523 HydrophobicContact CG2-CG 3.95Å; I481-A524 HydrophobicContact CD1-CB 3.96Å; I481-D527 HydrophobicContact CD1-CB 3.96Å
482	W	94.9	Very high	90.1	Very high	9 Å²	9	54 Å²	54	3%	0.034	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-47.8	172.3	170.8	68.3	0	0	0	111.2	A478 Q479 Q484 S485 V486 M505 V508 W509 M512 W520	A478-W482 WeakPolarHBondContact O-CB 3.03Å; A478-W482 PolarHBondContact O-N 2.69Å; A478-W482 VanDerWaalsContact O-N 3.09Å; Q479-W482 PolarHBondContact O-N 2.73Å; W482-Q484 VanDerWaalsContact C-N 3.33Å; W482-Q484 PolarHBondContact O-N 3.32Å; W482-S485 WeakPolarHBondContact O-CA 3.43Å; W482-S485 WeakPolarHBondContact O-CB 3.35Å; W482-S485 PolarHBondContact O-N 2.8Å; W482-S485 PolarHBondContact O-OG 3.06Å; W482-V486 HydrophobicContact CD2-CG2 4.43Å; W482-V486 HydrophobicContact CH2-CG2 4.18Å; W482-V486 HydrophobicContact CZ2-CG1 4.49Å; W482-V486 HydrophobicContact CZ2-CG2 3.83Å; W482-V486 PolarHBondContact O-N 2.82Å; W482-M505 HydrophobicContact CH2-CB 3.88Å; W482-M505 HydrophobicContact CH2-CG 4.39Å; W482-M505 WeakPolarHBondContact CH2-O 3.39Å; W482-M505 HydrophobicContact CZ3-CB 3.82Å; W482-M505 WeakPolarHBondContact CZ3-O 3.43Å; W482-V508 HydrophobicContact CH2-CB 3.99Å; W482-V508 HydrophobicContact CH2-CG1 4Å; W482-V508 HydrophobicContact CZ2-CB 4.36Å; W482-V508 HydrophobicContact CZ2-CG1 3.87Å; W482-W509 HydrophobicContact CB-CE3 4.02Å; W482-W509 HydrophobicContact CB-CZ3 3.76Å; W482-W509 AromaticContact CD2-CE3 3.86Å; W482-W509 HydrophobicContact CD2-CE3 3.86Å; W482-W509 HydrophobicContact CD2-CZ3 4.43Å; W482-W509 HydrophobicContact CE3-CB 3.94Å; W482-W509 HydrophobicContact CE3-CD2 4.29Å; W482-W509 AromaticContact CE3-CE3 3.72Å; W482-W509 HydrophobicContact CE3-CE3 3.72Å; W482-W509 HydrophobicContact CE3-CG 4.41Å; W482-W509 AromaticContact CG-CE3 3.99Å; W482-W509 HydrophobicContact CG-CE3 3.99Å; W482-W509 HydrophobicContact CG-CZ3 4.07Å; W482-W509 HydrophobicContact CH2-CB 4.41Å; W482-W509 HydrophobicContact CZ3-CB 3.66Å; W482-M512 HydrophobicContact CZ2-CE 4.1Å; W482-W520 HydrophobicContact CB-CB 4.43Å; W482-W520 HydrophobicContact CB-CD2 3.65Å; W482-W520 HydrophobicContact CB-CE3 3.94Å; W482-W520 HydrophobicContact CB-CG 3.83Å; W482-W520 AromaticContact CD1-CE2 3.49Å; W482-W520 VanDerWaalsContact CD1-CE2 3.49Å; W482-W520 AromaticContact CD1-CZ2 3.66Å; W482-W520 AromaticContact CD1-NE1 3.57Å; W482-W520 HydrophobicContact CG-CD2 4.26Å; W482-W520 HydrophobicContact CG-CG 4.48Å
483	Q	93.8	Very high	90.8	Very high	23 Å²	23	61.6 Å²	61.6	11%	0.107	34%	0.339	C	S	.	.	H	α-helix	trans	-56.3	-46.7	177.4	-77.7	-171.2	-2.4	0	0	111	Q479 E480 S485 V486 I487 M505	Q479-Q483 HydrophobicContact CG-CG 4.35Å; Q479-Q483 VanDerWaalsContact O-CB 3.3Å; Q479-Q483 WeakPolarHBondContact O-CB 3.42Å; Q479-Q483 VanDerWaalsContact O-CG 3.24Å; Q479-Q483 WeakPolarHBondContact O-CG 3.25Å; Q479-Q483 PolarHBondContact O-N 3.45Å; E480-Q483 PolarHBondContact O-N 3.01Å; Q483-S485 PolarHBondContact O-N 3.26Å; Q483-V486 PolarHBondContact O-N 2.7Å; Q483-V486 VanDerWaalsContact O-N 3.16Å; Q483-I487 WeakPolarHBondContact O-CB 3.34Å; Q483-I487 PolarHBondContact O-N 3.2Å; Q483-M505 VanDerWaalsContact CA-CE 3.47Å; Q483-M505 HydrophobicContact CB-CE 3.46Å; Q483-M505 VanDerWaalsContact CB-CE 3.46Å; Q483-M505 HydrophobicContact CG-CB 4.23Å; Q483-M505 HydrophobicContact CG-CE 3.68Å; Q483-M505 WeakPolarHBondContact O-CE 3.49Å
484	Q	91.8	Very high	91.4	Very high	121 Å²	121	60.2 Å²	60.2	57%	0.565	33%	0.329	S	S	*	.	H	α-helix	trans	-63.6	-25.3	177.2	-173	164.9	25.5	0	0	113	E480 W482	E480-Q484 VanDerWaalsContact O-CB 3.29Å; E480-Q484 WeakPolarHBondContact O-CB 3.41Å; E480-Q484 PolarHBondContact O-N 3Å; W482-Q484 VanDerWaalsContact C-N 3.33Å; W482-Q484 PolarHBondContact O-N 3.32Å
485	S	92.8	Very high	91.9	Very high	67 Å²	67	65 Å²	65	47%	0.469	34%	0.34	S	S	.	.	H	α-helix	trans	-78.2	-25.5	175.1	75.5	0	0	0	0	114.4	I481 W482 Q483 W520	I481-S485 PolarHBondContact O-N 3.17Å; I481-S485 VanDerWaalsContact O-N 3.15Å; W482-S485 WeakPolarHBondContact O-CA 3.43Å; W482-S485 WeakPolarHBondContact O-CB 3.35Å; W482-S485 PolarHBondContact O-N 2.8Å; W482-S485 PolarHBondContact O-OG 3.06Å; Q483-S485 PolarHBondContact O-N 3.26Å; S485-W520 WeakPolarHBondContact OG-CH2 3.36Å
486	V	92.9	Very high	91.9	Very high	25 Å²	25	69.3 Å²	69.3	15%	0.152	36%	0.361	C	S	.	.	H	α-helix	trans	-112.2	-4.9	-177	-53.8	0	0	0	0	114.2	W482 Q483 G488 D489 Y490 M505	W482-V486 HydrophobicContact CD2-CG2 4.43Å; W482-V486 HydrophobicContact CH2-CG2 4.18Å; W482-V486 HydrophobicContact CZ2-CG1 4.49Å; W482-V486 HydrophobicContact CZ2-CG2 3.83Å; W482-V486 PolarHBondContact O-N 2.82Å; Q483-V486 PolarHBondContact O-N 2.7Å; Q483-V486 VanDerWaalsContact O-N 3.16Å; V486-G488 PolarHBondContact O-N 3.27Å; V486-G488 VanDerWaalsContact O-N 3.15Å; V486-D489 PolarHBondContact O-N 2.79Å; V486-Y490 HydrophobicContact CB-CD2 3.96Å; V486-Y490 HydrophobicContact CB-CE2 3.99Å; V486-Y490 HydrophobicContact CG2-CD2 3.8Å; V486-Y490 HydrophobicContact CG2-CE2 3.77Å; V486-Y490 WeakPolarHBondContact O-CD2 3.26Å; V486-Y490 PolarHBondContact O-N 2.96Å; V486-M505 HydrophobicContact CG2-CE 3.93Å; V486-M505 HydrophobicContact CG2-CG 4.18Å; V486-M505 HydrophobicContact CG2-SD 4.5Å
487	I	91	Very high	91.9	Very high	46 Å²	46	68.1 Å²	68.1	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-56.4	-34.1	-174.2	-172.2	62.5	0	0	0	113.1	Q483 V491 M505	Q483-I487 WeakPolarHBondContact O-CB 3.34Å; Q483-I487 PolarHBondContact O-N 3.2Å; I487-V491 HydrophobicContact CD1-CG2 3.68Å; I487-V491 HydrophobicContact CG1-CG2 3.92Å; I487-V491 VanDerWaalsContact O-CB 3.23Å; I487-V491 WeakPolarHBondContact O-CB 3.49Å; I487-V491 WeakPolarHBondContact O-CG2 3.15Å; I487-V491 PolarHBondContact O-N 3.22Å; I487-M505 HydrophobicContact CB-CE 4.04Å; I487-M505 HydrophobicContact CD1-CE 3.75Å; I487-M505 HydrophobicContact CD1-SD 3.67Å; I487-M505 HydrophobicContact CG1-CE 4.48Å
488	G	90.4	Very high	91.5	Very high	50 Å²	50	72.7 Å²	72.7	52%	0.515	37%	0.367	S	S	.	.	H	α-helix	trans	-59.9	-55.7	176.7	0	0	0	0	0	112.3	V486 Y490 V491 A492	V486-G488 PolarHBondContact O-N 3.27Å; V486-G488 VanDerWaalsContact O-N 3.15Å; G488-Y490 VanDerWaalsContact C-N 3.32Å; G488-Y490 PolarHBondContact O-N 3.37Å; G488-V491 PolarHBondContact O-N 3.28Å; G488-A492 PolarHBondContact O-N 3.15Å
489	D	91.6	Very high	91.5	Very high	98 Å²	98	77 Å²	77	52%	0.524	39%	0.394	S	S	.	.	H	α-helix	trans	-58.8	-42.2	179.7	-64.1	-5.4	0	0	0	112.2	V486 R493	V486-D489 PolarHBondContact O-N 2.79Å; D489-R493 WeakPolarHBondContact O-CB 3.39Å; D489-R493 WeakPolarHBondContact O-CD 3.3Å; D489-R493 WeakPolarHBondContact O-CG 2.82Å; D489-R493 PolarHBondContact O-N 3.13Å
490	Y	92.3	Very high	91.4	Very high	35 Å²	35	80.2 Å²	80.2	14%	0.137	41%	0.407	C	S	.	.	H	α-helix	trans	-71.6	-41.7	179.7	-81.9	-106.1	0	0	0	111.8	V486 G488 A492 R493 F494 A504 M505	V486-Y490 HydrophobicContact CB-CD2 3.96Å; V486-Y490 HydrophobicContact CB-CE2 3.99Å; V486-Y490 HydrophobicContact CG2-CD2 3.8Å; V486-Y490 HydrophobicContact CG2-CE2 3.77Å; V486-Y490 WeakPolarHBondContact O-CD2 3.26Å; V486-Y490 PolarHBondContact O-N 2.96Å; G488-Y490 VanDerWaalsContact C-N 3.32Å; G488-Y490 PolarHBondContact O-N 3.37Å; Y490-A492 VanDerWaalsContact C-N 3.28Å; Y490-A492 PolarHBondContact O-N 2.94Å; Y490-R493 PolarHBondContact O-N 2.97Å; Y490-F494 HydrophobicContact CD1-CD2 4.47Å; Y490-F494 HydrophobicContact CD1-CE2 4.07Å; Y490-F494 WeakPolarHBondContact O-CB 3.14Å; Y490-F494 VanDerWaalsContact O-CD2 3.28Å; Y490-F494 WeakPolarHBondContact O-CD2 3.4Å; Y490-F494 PolarHBondContact O-N 3.03Å; Y490-A504 HydrophobicContact CD1-CB 4.04Å; Y490-A504 HydrophobicContact CE1-CB 4.04Å; Y490-M505 VanDerWaalsContact CB-SD 3.59Å; Y490-M505 HydrophobicContact CD1-CB 4.49Å; Y490-M505 HydrophobicContact CD1-CG 3.34Å; Y490-M505 HydrophobicContact CD1-SD 4.2Å; Y490-M505 HydrophobicContact CD2-CG 3.83Å; Y490-M505 HydrophobicContact CD2-SD 4.35Å; Y490-M505 HydrophobicContact CE1-CB 4.48Å; Y490-M505 HydrophobicContact CE1-CG 3.65Å; Y490-M505 HydrophobicContact CE2-CG 4.12Å; Y490-M505 HydrophobicContact CG-CG 3.41Å; Y490-M505 VanDerWaalsContact CG-CG 3.41Å; Y490-M505 HydrophobicContact CG-SD 3.82Å
491	V	91.4	Very high	91.3	Very high	16 Å²	16	75.9 Å²	75.9	10%	0.097	39%	0.387	C	S	.	.	H	α-helix	trans	-62.8	-36.6	175.7	169.8	0	0	0	0	111.1	I487 G488 K495 N496 R498 A501	I487-V491 HydrophobicContact CD1-CG2 3.68Å; I487-V491 HydrophobicContact CG1-CG2 3.92Å; I487-V491 VanDerWaalsContact O-CB 3.23Å; I487-V491 WeakPolarHBondContact O-CB 3.49Å; I487-V491 WeakPolarHBondContact O-CG2 3.15Å; I487-V491 PolarHBondContact O-N 3.22Å; G488-V491 PolarHBondContact O-N 3.28Å; V491-K495 PolarHBondContact O-N 3.36Å; V491-N496 WeakPolarHBondContact CG1-OD1 3.27Å; V491-N496 WeakPolarHBondContact O-CA 3.47Å; V491-N496 PolarHBondContact O-N 2.67Å; V491-R498 HydrophobicContact CG2-CG 4.01Å; V491-A501 HydrophobicContact CG2-CB 3.95Å
492	A	91.5	Very high	91.2	Very high	71 Å²	71	79 Å²	79	59%	0.587	40%	0.401	S	S	*	.	H	α-helix	trans	-64.4	-51.5	171.1	0	0	0	0	0	112.2	G488 Y490 F494 K495	G488-A492 PolarHBondContact O-N 3.15Å; Y490-A492 VanDerWaalsContact C-N 3.28Å; Y490-A492 PolarHBondContact O-N 2.94Å; A492-F494 PolarHBondContact O-N 3.44Å; A492-K495 PolarHBondContact O-N 3.35Å; A492-K495 VanDerWaalsContact O-N 3.11Å
493	R	90.1	Very high	91.1	Very high	179 Å²	179	85.7 Å²	85.7	68%	0.675	43%	0.43	S	S	*	.	H	α-helix	trans	-56.7	-34.8	177.7	-72.2	164.4	-166.5	-127.7	5.2	112.8	D489 Y490	D489-R493 WeakPolarHBondContact O-CB 3.39Å; D489-R493 WeakPolarHBondContact O-CD 3.3Å; D489-R493 WeakPolarHBondContact O-CG 2.82Å; D489-R493 PolarHBondContact O-N 3.13Å; Y490-R493 PolarHBondContact O-N 2.97Å
494	F	91.9	Very high	91	Very high	73 Å²	73	85.6 Å²	85.6	32%	0.32	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	21.7	179.8	-72.5	-76.4	0	0	0	114.2	Y490 A492 N496 D497 K500 A501 A504	Y490-F494 HydrophobicContact CD1-CD2 4.47Å; Y490-F494 HydrophobicContact CD1-CE2 4.07Å; Y490-F494 WeakPolarHBondContact O-CB 3.14Å; Y490-F494 VanDerWaalsContact O-CD2 3.28Å; Y490-F494 WeakPolarHBondContact O-CD2 3.4Å; Y490-F494 PolarHBondContact O-N 3.03Å; A492-F494 PolarHBondContact O-N 3.44Å; F494-N496 VanDerWaalsContact C-N 3.35Å; F494-N496 PolarHBondContact O-N 3.38Å; F494-D497 HydrophobicContact CB-CB 4.39Å; F494-D497 WeakPolarHBondContact O-CB 3.29Å; F494-D497 PolarHBondContact O-N 3.37Å; F494-K500 HydrophobicContact CB-CB 4.32Å; F494-K500 HydrophobicContact CD1-CB 3.73Å; F494-K500 HydrophobicContact CD1-CD 4.46Å; F494-K500 HydrophobicContact CE1-CB 4.31Å; F494-K500 HydrophobicContact CG-CB 4.09Å; F494-A501 HydrophobicContact CB-CB 4.32Å; F494-A501 HydrophobicContact CD2-CB 4.15Å; F494-A504 HydrophobicContact CD2-CB 4.39Å; F494-A504 HydrophobicContact CE2-CB 3.37Å; F494-A504 HydrophobicContact CZ-CB 3.49Å; F494-A504 VanDerWaalsContact CZ-CB 3.49Å
495	K	91.5	Very high	91	Very high	195 Å²	195	79.8 Å²	79.8	85%	0.848	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	46	174.1	-56.5	-176.2	179.1	-176.6	0	113.4	V491 A492 D497	V491-K495 PolarHBondContact O-N 3.36Å; A492-K495 PolarHBondContact O-N 3.35Å; A492-K495 VanDerWaalsContact O-N 3.11Å; K495-D497 PolarHBondContact O-N 3.08Å
496	N	87.7	Confident	91	Very high	127 Å²	127	81.8 Å²	81.8	68%	0.679	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	5.7	-174.3	-65.1	-39.6	0	0	0	116.8	V491 F494 R498	V491-N496 WeakPolarHBondContact CG1-OD1 3.27Å; V491-N496 WeakPolarHBondContact O-CA 3.47Å; V491-N496 PolarHBondContact O-N 2.67Å; F494-N496 VanDerWaalsContact C-N 3.35Å; F494-N496 PolarHBondContact O-N 3.38Å; N496-R498 PolarHBondContact O-N 2.9Å
497	D	90.9	Very high	91	Very high	46 Å²	46	84.4 Å²	84.4	25%	0.246	42%	0.424	C	S	.	.			trans	-73.4	88.2	172.5	-168.2	-42.1	0	0	0	111.1	F494 K495 P499 K500 A501	F494-D497 HydrophobicContact CB-CB 4.39Å; F494-D497 WeakPolarHBondContact O-CB 3.29Å; F494-D497 PolarHBondContact O-N 3.37Å; K495-D497 PolarHBondContact O-N 3.08Å; D497-P499 VanDerWaalsContact OD1-CD 3.24Å; D497-P499 WeakPolarHBondContact OD1-CD 3.46Å; D497-K500 HydrophobicContact CB-CB 4.14Å; D497-K500 HydrophobicContact CB-CD 4.41Å; D497-K500 HydrophobicContact CB-CG 4.39Å; D497-K500 PolarHBondContact O-N 3.42Å; D497-K500 WeakPolarHBondContact OD1-CB 3.26Å; D497-K500 WeakPolarHBondContact OD1-CG 3.32Å; D497-K500 PolarHBondContact OD1-N 3.05Å; D497-K500 WeakPolarHBondContact OD2-CD 3.24Å; D497-K500 WeakPolarHBondContact OD2-CG 3.44Å; D497-K500 IonicContact OD2-NZ 3.58Å; D497-K500 PolarHBondContact OD2-NZ 3.16Å; D497-A501 WeakPolarHBondContact O-CB 3.35Å; D497-A501 PolarHBondContact O-N 2.94Å
498	R	85.9	Confident	91.1	Very high	169 Å²	169	84.6 Å²	84.6	64%	0.638	43%	0.428	S	S	*	.	H	α-helix	trans	-56.3	-44.6	177.6	-70.3	-176	176.3	109.9	-1.8	113.1	V491 N496 K500 A501 H502	V491-R498 HydrophobicContact CG2-CG 4.01Å; N496-R498 PolarHBondContact O-N 2.9Å; R498-K500 PolarHBondContact O-N 2.98Å; R498-A501 PolarHBondContact O-N 3.49Å; R498-H502 PolarHBondContact O-CD2 2.69Å; R498-H502 PolarHBondContact O-N 3.46Å
499	P	90.9	Very high	91.1	Very high	104 Å²	104	83.8 Å²	83.8	68%	0.675	41%	0.409	S	S	*	.	H	α-helix	trans	-56	-46.9	174.4	-28.4	35.6	0	0	0	114.4	D497 K503	D497-P499 VanDerWaalsContact OD1-CD 3.24Å; D497-P499 WeakPolarHBondContact OD1-CD 3.46Å; P499-K503 PolarHBondContact O-N 3.1Å; P499-K503 VanDerWaalsContact O-N 3.09Å
500	K	90.4	Very high	91.1	Very high	122 Å²	122	83 Å²	83	53%	0.53	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-40.9	177.1	-70.5	-173.5	-174.6	91.6	0	111.8	F494 D497 R498 K503 A504	F494-K500 HydrophobicContact CB-CB 4.32Å; F494-K500 HydrophobicContact CD1-CB 3.73Å; F494-K500 HydrophobicContact CD1-CD 4.46Å; F494-K500 HydrophobicContact CE1-CB 4.31Å; F494-K500 HydrophobicContact CG-CB 4.09Å; D497-K500 HydrophobicContact CB-CB 4.14Å; D497-K500 HydrophobicContact CB-CD 4.41Å; D497-K500 HydrophobicContact CB-CG 4.39Å; D497-K500 PolarHBondContact O-N 3.42Å; D497-K500 WeakPolarHBondContact OD1-CB 3.26Å; D497-K500 WeakPolarHBondContact OD1-CG 3.32Å; D497-K500 PolarHBondContact OD1-N 3.05Å; D497-K500 WeakPolarHBondContact OD2-CD 3.24Å; D497-K500 WeakPolarHBondContact OD2-CG 3.44Å; D497-K500 IonicContact OD2-NZ 3.58Å; D497-K500 PolarHBondContact OD2-NZ 3.16Å; R498-K500 PolarHBondContact O-N 2.98Å; K500-K503 PolarHBondContact O-N 3.15Å; K500-A504 WeakPolarHBondContact O-CB 3.5Å; K500-A504 PolarHBondContact O-N 2.82Å
501	A	91.6	Very high	91	Very high	0 Å²	0	86.7 Å²	86.7	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-56.4	-54.5	173.9	0	0	0	0	0	111.8	V491 F494 D497 R498 K503 A504 M505	V491-A501 HydrophobicContact CG2-CB 3.95Å; F494-A501 HydrophobicContact CB-CB 4.32Å; F494-A501 HydrophobicContact CD2-CB 4.15Å; D497-A501 WeakPolarHBondContact O-CB 3.35Å; D497-A501 PolarHBondContact O-N 2.94Å; R498-A501 PolarHBondContact O-N 3.49Å; A501-K503 VanDerWaalsContact C-N 3.34Å; A501-K503 PolarHBondContact O-N 2.64Å; A501-A504 PolarHBondContact O-N 3.31Å; A501-M505 HydrophobicContact CB-SD 4.42Å; A501-M505 WeakPolarHBondContact O-CG 3.25Å; A501-M505 PolarHBondContact O-N 3.3Å; A501-M505 VanDerWaalsContact O-SD 3.34Å
502	H	90.6	Very high	91	Very high	84 Å²	84	87.5 Å²	87.5	39%	0.389	44%	0.441	S	S	.	.	H	α-helix	trans	-59.1	-40.8	178.8	-87	-83.3	0	0	0	112.9	R498 M505 E506	R498-H502 PolarHBondContact O-CD2 2.69Å; R498-H502 PolarHBondContact O-N 3.46Å; H502-M505 PolarHBondContact O-N 3.02Å; H502-E506 PolarHBondContact O-N 3.47Å
503	K	92.4	Very high	90.9	Very high	149 Å²	149	89 Å²	89	65%	0.648	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-42.8	177.7	-170.9	175.2	-176.9	178.7	0	112.2	P499 K500 A501 M505 E506 T507	P499-K503 PolarHBondContact O-N 3.1Å; P499-K503 VanDerWaalsContact O-N 3.09Å; K500-K503 PolarHBondContact O-N 3.15Å; A501-K503 VanDerWaalsContact C-N 3.34Å; A501-K503 PolarHBondContact O-N 2.64Å; K503-M505 VanDerWaalsContact C-N 3.31Å; K503-M505 PolarHBondContact O-N 3.11Å; K503-E506 PolarHBondContact O-N 3.23Å; K503-T507 PolarHBondContact O-N 3.44Å; K503-T507 VanDerWaalsContact O-N 3.08Å; K503-T507 PolarHBondContact O-OG1 3.43Å
504	A	92.4	Very high	90.7	Very high	20 Å²	20	89.3 Å²	89.3	17%	0.165	44%	0.442	C	S	.	.	H	α-helix	trans	-64	-38.1	175.2	0	0	0	0	0	111.9	Y490 F494 K500 A501 T507 V508	Y490-A504 HydrophobicContact CD1-CB 4.04Å; Y490-A504 HydrophobicContact CE1-CB 4.04Å; F494-A504 HydrophobicContact CD2-CB 4.39Å; F494-A504 HydrophobicContact CE2-CB 3.37Å; F494-A504 HydrophobicContact CZ-CB 3.49Å; F494-A504 VanDerWaalsContact CZ-CB 3.49Å; K500-A504 WeakPolarHBondContact O-CB 3.5Å; K500-A504 PolarHBondContact O-N 2.82Å; A501-A504 PolarHBondContact O-N 3.31Å; A504-T507 WeakPolarHBondContact CA-OG1 3.47Å; A504-T507 PolarHBondContact O-N 3.38Å; A504-T507 PolarHBondContact O-OG1 2.91Å; A504-V508 PolarHBondContact O-N 3.19Å
505	M	91.8	Very high	90.6	Very high	0 Å²	0	92.3 Å²	92.3	0%	0	45%	0.454	C	S	.	.	H	α-helix	trans	-63.4	-46.8	174	-66.9	155.9	60.2	0	0	110.8	W482 Q483 V486 I487 Y490 A501 H502 K503 T507 V508 W509	W482-M505 HydrophobicContact CH2-CB 3.88Å; W482-M505 HydrophobicContact CH2-CG 4.39Å; W482-M505 WeakPolarHBondContact CH2-O 3.39Å; W482-M505 HydrophobicContact CZ3-CB 3.82Å; W482-M505 WeakPolarHBondContact CZ3-O 3.43Å; Q483-M505 VanDerWaalsContact CA-CE 3.47Å; Q483-M505 HydrophobicContact CB-CE 3.46Å; Q483-M505 VanDerWaalsContact CB-CE 3.46Å; Q483-M505 HydrophobicContact CG-CB 4.23Å; Q483-M505 HydrophobicContact CG-CE 3.68Å; Q483-M505 WeakPolarHBondContact O-CE 3.49Å; V486-M505 HydrophobicContact CG2-CE 3.93Å; V486-M505 HydrophobicContact CG2-CG 4.18Å; V486-M505 HydrophobicContact CG2-SD 4.5Å; I487-M505 HydrophobicContact CB-CE 4.04Å; I487-M505 HydrophobicContact CD1-CE 3.75Å; I487-M505 HydrophobicContact CD1-SD 3.67Å; I487-M505 HydrophobicContact CG1-CE 4.48Å; Y490-M505 VanDerWaalsContact CB-SD 3.59Å; Y490-M505 HydrophobicContact CD1-CB 4.49Å; Y490-M505 HydrophobicContact CD1-CG 3.34Å; Y490-M505 HydrophobicContact CD1-SD 4.2Å; Y490-M505 HydrophobicContact CD2-CG 3.83Å; Y490-M505 HydrophobicContact CD2-SD 4.35Å; Y490-M505 HydrophobicContact CE1-CB 4.48Å; Y490-M505 HydrophobicContact CE1-CG 3.65Å; Y490-M505 HydrophobicContact CE2-CG 4.12Å; Y490-M505 HydrophobicContact CG-CG 3.41Å; Y490-M505 VanDerWaalsContact CG-CG 3.41Å; Y490-M505 HydrophobicContact CG-SD 3.82Å; A501-M505 HydrophobicContact CB-SD 4.42Å; A501-M505 WeakPolarHBondContact O-CG 3.25Å; A501-M505 PolarHBondContact O-N 3.3Å; A501-M505 VanDerWaalsContact O-SD 3.34Å; H502-M505 PolarHBondContact O-N 3.02Å; K503-M505 VanDerWaalsContact C-N 3.31Å; K503-M505 PolarHBondContact O-N 3.11Å; M505-T507 VanDerWaalsContact C-N 3.3Å; M505-T507 PolarHBondContact O-N 3.06Å; M505-V508 PolarHBondContact O-N 3.15Å; M505-V508 VanDerWaalsContact O-N 3.09Å; M505-W509 PolarHBondContact O-N 3.49Å
506	E	92.3	Very high	90.5	Very high	109 Å²	109	86.9 Å²	86.9	51%	0.509	43%	0.432	S	S	.	.	H	α-helix	trans	-57	-40.1	175.4	-176.7	169.5	-134.6	0	0	112.8	H502 K503 V508 W509 S510	H502-E506 PolarHBondContact O-N 3.47Å; K503-E506 PolarHBondContact O-N 3.23Å; E506-V508 VanDerWaalsContact C-N 3.33Å; E506-V508 PolarHBondContact O-N 2.73Å; E506-W509 PolarHBondContact O-N 3.37Å; E506-S510 PolarHBondContact O-N 3.14Å
507	T	92.6	Very high	90.7	Very high	80 Å²	80	82.7 Å²	82.7	49%	0.491	41%	0.408	S	S	.	.	H	α-helix	trans	-69.4	-24.3	175.7	51.4	0	0	0	0	114.9	K503 A504 M505 S510 T511	K503-T507 PolarHBondContact O-N 3.44Å; K503-T507 VanDerWaalsContact O-N 3.08Å; K503-T507 PolarHBondContact O-OG1 3.43Å; A504-T507 WeakPolarHBondContact CA-OG1 3.47Å; A504-T507 PolarHBondContact O-N 3.38Å; A504-T507 PolarHBondContact O-OG1 2.91Å; M505-T507 VanDerWaalsContact C-N 3.3Å; M505-T507 PolarHBondContact O-N 3.06Å; T507-S510 PolarHBondContact O-OG 2.83Å; T507-S510 VanDerWaalsContact O-OG 3.09Å; T507-T511 PolarHBondContact O-OG1 2.92Å; T507-T511 VanDerWaalsContact O-OG1 3.06Å
508	V	92.8	Very high	90.7	Very high	50 Å²	50	84.7 Å²	84.7	30%	0.303	42%	0.417	S	S	.	.	H	α-helix	trans	-84.2	-35.2	172.6	170.4	0	0	0	0	110.8	W482 A504 M505 E506 S510 T511 M512	W482-V508 HydrophobicContact CH2-CB 3.99Å; W482-V508 HydrophobicContact CH2-CG1 4Å; W482-V508 HydrophobicContact CZ2-CB 4.36Å; W482-V508 HydrophobicContact CZ2-CG1 3.87Å; A504-V508 PolarHBondContact O-N 3.19Å; M505-V508 PolarHBondContact O-N 3.15Å; M505-V508 VanDerWaalsContact O-N 3.09Å; E506-V508 VanDerWaalsContact C-N 3.33Å; E506-V508 PolarHBondContact O-N 2.73Å; V508-S510 VanDerWaalsContact C-N 3.34Å; V508-S510 PolarHBondContact O-N 3.34Å; V508-T511 PolarHBondContact O-N 3.18Å; V508-T511 PolarHBondContact O-OG1 2.89Å; V508-M512 HydrophobicContact CG1-CE 4.46Å; V508-M512 WeakPolarHBondContact O-CB 3.28Å; V508-M512 WeakPolarHBondContact O-CG 3.38Å; V508-M512 PolarHBondContact O-N 3.01Å
509	W	91.3	Very high	90.9	Very high	33 Å²	33	82 Å²	82	13%	0.125	41%	0.414	C	S	.	.	H	α-helix	trans	-64.1	-37.3	172.5	-179.3	-103.4	0	0	0	112.3	A478 Q479 W482 M505 E506 M512 K517 W520	A478-W509 HydrophobicContact CB-CH2 3.71Å; A478-W509 HydrophobicContact CB-CZ2 3.96Å; Q479-W509 HydrophobicContact CB-CD2 4.03Å; Q479-W509 HydrophobicContact CB-CG 4.24Å; Q479-W509 HydrophobicContact CB-CZ2 3.99Å; Q479-W509 HydrophobicContact CG-CB 4.4Å; Q479-W509 HydrophobicContact CG-CD2 4Å; Q479-W509 HydrophobicContact CG-CG 3.73Å; W482-W509 HydrophobicContact CB-CE3 4.02Å; W482-W509 HydrophobicContact CB-CZ3 3.76Å; W482-W509 AromaticContact CD2-CE3 3.86Å; W482-W509 HydrophobicContact CD2-CE3 3.86Å; W482-W509 HydrophobicContact CD2-CZ3 4.43Å; W482-W509 HydrophobicContact CE3-CB 3.94Å; W482-W509 HydrophobicContact CE3-CD2 4.29Å; W482-W509 AromaticContact CE3-CE3 3.72Å; W482-W509 HydrophobicContact CE3-CE3 3.72Å; W482-W509 HydrophobicContact CE3-CG 4.41Å; W482-W509 AromaticContact CG-CE3 3.99Å; W482-W509 HydrophobicContact CG-CE3 3.99Å; W482-W509 HydrophobicContact CG-CZ3 4.07Å; W482-W509 HydrophobicContact CH2-CB 4.41Å; W482-W509 HydrophobicContact CZ3-CB 3.66Å; M505-W509 PolarHBondContact O-N 3.49Å; E506-W509 PolarHBondContact O-N 3.37Å; W509-M512 HydrophobicContact CE3-SD 4.09Å; W509-M512 HydrophobicContact CZ3-SD 4.4Å; W509-K517 HydrophobicContact CH2-CB 4.41Å; W509-K517 HydrophobicContact CH2-CG 3.88Å; W509-K517 HydrophobicContact CZ2-CG 4.22Å; W509-K517 HydrophobicContact CZ3-CG 4.07Å; W509-K517 WeakPolarHBondContact O-CE 3.43Å; W509-K517 PolarHBondContact O-NZ 3.01Å; W509-W520 HydrophobicContact CH2-CB 3.97Å; W509-W520 HydrophobicContact CZ3-CB 4.06Å; W509-W520 AromaticContact CZ3-CD1 3.98Å; W509-W520 HydrophobicContact CZ3-CG 4.14Å
510	S	90	Very high	91.1	Very high	82 Å²	82	78.4 Å²	78.4	57%	0.573	39%	0.387	S	S	*	.	H	α-helix	trans	-65.3	-44.6	177.7	64.8	0	0	0	0	111.6	E506 T507 V508 K517	E506-S510 PolarHBondContact O-N 3.14Å; T507-S510 PolarHBondContact O-OG 2.83Å; T507-S510 VanDerWaalsContact O-OG 3.09Å; V508-S510 VanDerWaalsContact C-N 3.34Å; V508-S510 PolarHBondContact O-N 3.34Å; S510-K517 PolarHBondContact O-NZ 3.23Å; S510-K517 VanDerWaalsContact O-NZ 3.12Å
511	T	91.8	Very high	91.1	Very high	111 Å²	111	77.2 Å²	77.2	68%	0.681	39%	0.385	S	S	*	.	H	α-helix	trans	-78.5	-24.7	-177.1	54.1	0	0	0	0	115.2	T507 V508	T507-T511 PolarHBondContact O-OG1 2.92Å; T507-T511 VanDerWaalsContact O-OG1 3.06Å; V508-T511 PolarHBondContact O-N 3.18Å; V508-T511 PolarHBondContact O-OG1 2.89Å
512	M	90.8	Very high	91.1	Very high	34 Å²	34	84.2 Å²	84.2	17%	0.167	42%	0.416	C	S	.	.	S	Bend	trans	-47	140.6	177.1	-98.8	-173.6	175.6	0	0	113.7	W482 V508 W509 E516 K517	W482-M512 HydrophobicContact CZ2-CE 4.1Å; V508-M512 HydrophobicContact CG1-CE 4.46Å; V508-M512 WeakPolarHBondContact O-CB 3.28Å; V508-M512 WeakPolarHBondContact O-CG 3.38Å; V508-M512 PolarHBondContact O-N 3.01Å; W509-M512 HydrophobicContact CE3-SD 4.09Å; W509-M512 HydrophobicContact CZ3-SD 4.4Å; M512-E516 WeakPolarHBondContact CA-OE2 3.31Å; M512-E516 HydrophobicContact CG-CB 4.4Å; M512-E516 HydrophobicContact SD-CB 4.37Å; M512-K517 HydrophobicContact CB-CD 4.31Å; M512-K517 HydrophobicContact CB-CG 4.27Å; M512-K517 WeakPolarHBondContact O-CE 3.48Å; M512-K517 PolarHBondContact O-NZ 3.4Å
513	E	89.7	Confident	91.2	Very high	103 Å²	103	85.7 Å²	85.7	48%	0.481	42%	0.421	S	S	.	.			trans	-69.9	158.8	177.4	-81.9	-170.5	-125.1	0	0	113	K515 E516 K517	E513-K515 HydrophobicContact CB-CD 4.47Å; E513-K515 HydrophobicContact CB-CG 3.97Å; E513-K515 VanDerWaalsContact CD-CE 3.45Å; E513-K515 PolarHBondContact O-N 3.04Å; E513-K515 WeakPolarHBondContact OE1-CE 3.45Å; E513-K515 IonicContact OE1-NZ 4Å; E513-K515 PolarHBondContact OE1-NZ 3.18Å; E513-K515 VanDerWaalsContact OE2-CD 3.26Å; E513-K515 WeakPolarHBondContact OE2-CD 3.43Å; E513-K515 WeakPolarHBondContact OE2-CE 3.43Å; E513-K515 IonicContact OE2-NZ 2.72Å; E513-K515 PolarHBondContact OE2-NZ 2.74Å; E513-E516 HydrophobicContact CB-CG 4.34Å; E513-E516 PolarHBondContact N-OE2 3.22Å; E513-E516 PolarHBondContact O-N 2.95Å; E513-K517 PolarHBondContact O-N 3.36Å; E513-K517 VanDerWaalsContact O-N 3.08Å
514	K	85.9	Confident	91.2	Very high	185 Å²	185	79.3 Å²	79.3	80%	0.804	40%	0.396	S	S	*	.	H	α-helix	trans	-56.7	-36.2	173.8	-67.2	176	-177.1	170.1	0	112	E516 K517 I518	K514-E516 PolarHBondContact O-N 2.97Å; K514-K517 PolarHBondContact O-N 2.87Å; K514-I518 WeakPolarHBondContact O-CG1 3.38Å; K514-I518 PolarHBondContact O-N 2.84Å
515	K	89.1	Confident	91.1	Very high	135 Å²	135	80.9 Å²	80.9	59%	0.587	41%	0.409	S	S	*	.	H	α-helix	trans	-62.4	-40.6	179.1	72.7	-166.3	179.4	-145.6	0	112.4	E513	E513-K515 HydrophobicContact CB-CD 4.47Å; E513-K515 HydrophobicContact CB-CG 3.97Å; E513-K515 VanDerWaalsContact CD-CE 3.45Å; E513-K515 PolarHBondContact O-N 3.04Å; E513-K515 WeakPolarHBondContact OE1-CE 3.45Å; E513-K515 IonicContact OE1-NZ 4Å; E513-K515 PolarHBondContact OE1-NZ 3.18Å; E513-K515 VanDerWaalsContact OE2-CD 3.26Å; E513-K515 WeakPolarHBondContact OE2-CD 3.43Å; E513-K515 WeakPolarHBondContact OE2-CE 3.43Å; E513-K515 IonicContact OE2-NZ 2.72Å; E513-K515 PolarHBondContact OE2-NZ 2.74Å
516	E	89.1	Confident	91	Very high	82 Å²	82	87.1 Å²	87.1	38%	0.383	44%	0.438	S	S	.	.	H	α-helix	trans	-73.2	-40	179.4	-56.5	173.8	116.7	0	0	110.8	M512 E513 K514 I518 M519 W520	M512-E516 WeakPolarHBondContact CA-OE2 3.31Å; M512-E516 HydrophobicContact CG-CB 4.4Å; M512-E516 HydrophobicContact SD-CB 4.37Å; E513-E516 HydrophobicContact CB-CG 4.34Å; E513-E516 PolarHBondContact N-OE2 3.22Å; E513-E516 PolarHBondContact O-N 2.95Å; K514-E516 PolarHBondContact O-N 2.97Å; E516-I518 PolarHBondContact O-N 3.15Å; E516-M519 WeakPolarHBondContact O-CG 3.34Å; E516-W520 VanDerWaalsContact O-CD1 3.32Å
517	K	92.3	Very high	90.9	Very high	39 Å²	39	83.3 Å²	83.3	17%	0.17	42%	0.421	C	S	.	.	H	α-helix	trans	-63.2	-24.5	177.1	-75.2	163	171	156.2	0	113.5	W509 S510 M512 E513 K514 M519 W520 I521	W509-K517 HydrophobicContact CH2-CB 4.41Å; W509-K517 HydrophobicContact CH2-CG 3.88Å; W509-K517 HydrophobicContact CZ2-CG 4.22Å; W509-K517 HydrophobicContact CZ3-CG 4.07Å; W509-K517 WeakPolarHBondContact O-CE 3.43Å; W509-K517 PolarHBondContact O-NZ 3.01Å; S510-K517 PolarHBondContact O-NZ 3.23Å; S510-K517 VanDerWaalsContact O-NZ 3.12Å; M512-K517 HydrophobicContact CB-CD 4.31Å; M512-K517 HydrophobicContact CB-CG 4.27Å; M512-K517 WeakPolarHBondContact O-CE 3.48Å; M512-K517 PolarHBondContact O-NZ 3.4Å; E513-K517 PolarHBondContact O-N 3.36Å; E513-K517 VanDerWaalsContact O-N 3.08Å; K514-K517 PolarHBondContact O-N 2.87Å; K517-M519 PolarHBondContact O-N 3.02Å; K517-W520 PolarHBondContact O-N 2.85Å; K517-I521 HydrophobicContact CB-CD1 4.13Å; K517-I521 WeakPolarHBondContact O-CD1 3.45Å; K517-I521 VanDerWaalsContact O-CG1 3.25Å; K517-I521 WeakPolarHBondContact O-CG1 3.29Å; K517-I521 PolarHBondContact O-N 2.78Å
518	I	90.6	Very high	90.6	Very high	87 Å²	87	82.8 Å²	82.8	45%	0.446	41%	0.413	S	S	.	.	H	α-helix	trans	-59.3	-40.1	-178.5	-77.4	165	0	0	0	113	K514 E516 W520 I521 K522	K514-I518 WeakPolarHBondContact O-CG1 3.38Å; K514-I518 PolarHBondContact O-N 2.84Å; E516-I518 PolarHBondContact O-N 3.15Å; I518-W520 VanDerWaalsContact C-N 3.33Å; I518-W520 PolarHBondContact O-N 3.06Å; I518-I521 PolarHBondContact O-N 3.47Å; I518-K522 HydrophobicContact CG2-CD 4.24Å; I518-K522 WeakPolarHBondContact O-CG 3.34Å; I518-K522 PolarHBondContact O-N 2.77Å
519	M	91.8	Very high	90.5	Very high	113 Å²	113	87 Å²	87	56%	0.557	43%	0.427	S	S	*	.	H	α-helix	trans	-66	-38.4	-179.9	68.9	-178.1	-75.1	0	0	111.8	E516 K517 K522 K523	E516-M519 WeakPolarHBondContact O-CG 3.34Å; K517-M519 PolarHBondContact O-N 3.02Å; M519-K522 PolarHBondContact O-N 3.38Å; M519-K523 PolarHBondContact O-N 3.04Å
520	W	94.3	Very high	90.5	Very high	28 Å²	28	88.8 Å²	88.8	11%	0.106	43%	0.434	C	S	.	.	H	α-helix	trans	-74.6	-34.8	179.6	-54.3	111.2	0	0	0	112.1	A478 I481 W482 S485 W509 E516 K517 I518 K523 A524	A478-W520 HydrophobicContact CB-CB 4.02Å; A478-W520 WeakPolarHBondContact CB-O 3.45Å; I481-W520 HydrophobicContact CG2-CE3 3.97Å; I481-W520 HydrophobicContact CG2-CZ3 4.18Å; W482-W520 HydrophobicContact CB-CB 4.43Å; W482-W520 HydrophobicContact CB-CD2 3.65Å; W482-W520 HydrophobicContact CB-CE3 3.94Å; W482-W520 HydrophobicContact CB-CG 3.83Å; W482-W520 AromaticContact CD1-CE2 3.49Å; W482-W520 VanDerWaalsContact CD1-CE2 3.49Å; W482-W520 AromaticContact CD1-CZ2 3.66Å; W482-W520 AromaticContact CD1-NE1 3.57Å; W482-W520 HydrophobicContact CG-CD2 4.26Å; W482-W520 HydrophobicContact CG-CG 4.48Å; S485-W520 WeakPolarHBondContact OG-CH2 3.36Å; W509-W520 HydrophobicContact CH2-CB 3.97Å; W509-W520 HydrophobicContact CZ3-CB 4.06Å; W509-W520 AromaticContact CZ3-CD1 3.98Å; W509-W520 HydrophobicContact CZ3-CG 4.14Å; E516-W520 VanDerWaalsContact O-CD1 3.32Å; K517-W520 PolarHBondContact O-N 2.85Å; I518-W520 VanDerWaalsContact C-N 3.33Å; I518-W520 PolarHBondContact O-N 3.06Å; W520-K523 PolarHBondContact O-N 2.62Å; W520-A524 WeakPolarHBondContact O-CB 3.22Å; W520-A524 PolarHBondContact O-N 3.37Å
521	I	90.3	Very high	90.3	Very high	97 Å²	97	87.8 Å²	87.8	50%	0.497	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-41.9	171.2	-68.1	163.9	0	0	0	110.9	A478 K517 I518 A524 A525	A478-I521 HydrophobicContact CB-CG1 3.89Å; K517-I521 HydrophobicContact CB-CD1 4.13Å; K517-I521 WeakPolarHBondContact O-CD1 3.45Å; K517-I521 VanDerWaalsContact O-CG1 3.25Å; K517-I521 WeakPolarHBondContact O-CG1 3.29Å; K517-I521 PolarHBondContact O-N 2.78Å; I518-I521 PolarHBondContact O-N 3.47Å; I521-A524 PolarHBondContact O-N 3.26Å; I521-A525 WeakPolarHBondContact O-CB 3.15Å; I521-A525 PolarHBondContact O-N 3.24Å
522	K	92.4	Very high	89.8	Confident	148 Å²	148	87.6 Å²	87.6	64%	0.643	41%	0.41	S	S	*	.	H	α-helix	trans	-60.1	-45.9	172.7	-75.5	176.1	178.3	-179.1	0	111.4	I518 M519 A525 E526	I518-K522 HydrophobicContact CG2-CD 4.24Å; I518-K522 WeakPolarHBondContact O-CG 3.34Å; I518-K522 PolarHBondContact O-N 2.77Å; M519-K522 PolarHBondContact O-N 3.38Å; K522-A525 PolarHBondContact O-N 3.04Å; K522-E526 PolarHBondContact O-N 3.45Å; K522-E526 VanDerWaalsContact O-N 3.07Å
523	K	92	Very high	89.4	Confident	115 Å²	115	92.6 Å²	92.6	50%	0.5	43%	0.427	S	S	.	.	H	α-helix	trans	-68.1	-33.2	-179.7	-157	164.1	-177.5	173	0	113	I481 M519 W520 E526 D527	I481-K523 HydrophobicContact CG2-CB 4.26Å; I481-K523 HydrophobicContact CG2-CD 3.81Å; I481-K523 HydrophobicContact CG2-CG 3.95Å; M519-K523 PolarHBondContact O-N 3.04Å; W520-K523 PolarHBondContact O-N 2.62Å; K523-E526 WeakPolarHBondContact O-CB 3.36Å; K523-E526 PolarHBondContact O-N 3.1Å; K523-D527 PolarHBondContact O-N 3.1Å
524	A	92.2	Very high	88.8	Confident	15 Å²	15	89.2 Å²	89.2	12%	0.124	41%	0.412	C	S	.	.	H	α-helix	trans	-69.7	-36.8	170.9	0	0	0	0	0	112.9	A478 I481 W520 I521 E526 D527 Q528	A478-A524 HydrophobicContact CB-CB 4.1Å; I481-A524 HydrophobicContact CD1-CB 3.96Å; W520-A524 WeakPolarHBondContact O-CB 3.22Å; W520-A524 PolarHBondContact O-N 3.37Å; I521-A524 PolarHBondContact O-N 3.26Å; A524-E526 PolarHBondContact O-N 3.04Å; A524-D527 PolarHBondContact O-N 3.31Å; A524-Q528 VanDerWaalsContact O-CB 3.29Å; A524-Q528 WeakPolarHBondContact O-CB 3.45Å; A524-Q528 PolarHBondContact O-N 3.02Å
525	A	89.9	Confident	88.3	Confident	53 Å²	53	83.4 Å²	83.4	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-68.5	-18	172	0	0	0	0	0	113.1	I521 K522 K529	I521-A525 WeakPolarHBondContact O-CB 3.15Å; I521-A525 PolarHBondContact O-N 3.24Å; K522-A525 PolarHBondContact O-N 3.04Å; A525-K529 WeakPolarHBondContact O-CD 3.43Å; A525-K529 VanDerWaalsContact O-CG 3.32Å; A525-K529 WeakPolarHBondContact O-CG 3.43Å
526	E	90.8	Very high	87.6	Confident	131 Å²	131	80.9 Å²	80.9	61%	0.612	39%	0.388	S	S	*	.	H	α-helix	trans	-86.5	-41.2	172.1	-172.4	158.9	-123.7	0	0	112	K522 K523 A524 Q528 K529 R530	K522-E526 PolarHBondContact O-N 3.45Å; K522-E526 VanDerWaalsContact O-N 3.07Å; K523-E526 WeakPolarHBondContact O-CB 3.36Å; K523-E526 PolarHBondContact O-N 3.1Å; A524-E526 PolarHBondContact O-N 3.04Å; E526-Q528 VanDerWaalsContact C-N 3.34Å; E526-Q528 PolarHBondContact O-N 2.9Å; E526-K529 CarbonylContact O-C 3.59Å; E526-K529 WeakPolarHBondContact O-CB 3.32Å; E526-K529 PolarHBondContact O-N 3.04Å; E526-K529 VanDerWaalsContact O-N 3.15Å; E526-R530 PolarHBondContact O-N 3.32Å
527	D	89	Confident	86.7	Confident	29 Å²	29	82.1 Å²	82.1	16%	0.155	39%	0.393	C	S	.	.	H	α-helix	trans	-65.8	-35.1	173.1	-163.6	52	0	0	0	112.2	K476 I481 K523 A524 K529 R530 Y531	K476-D527 WeakPolarHBondContact CB-OD2 3.45Å; K476-D527 PolarHBondContact N-OD2 3.02Å; I481-D527 HydrophobicContact CD1-CB 3.96Å; K523-D527 PolarHBondContact O-N 3.1Å; A524-D527 PolarHBondContact O-N 3.31Å; D527-K529 PolarHBondContact O-N 3.42Å; D527-R530 WeakPolarHBondContact O-CB 3.47Å; D527-R530 PolarHBondContact O-N 3.21Å; D527-R530 VanDerWaalsContact O-N 3.15Å; D527-Y531 PolarHBondContact O-N 2.8Å
528	Q	86.9	Confident	85.3	Confident	69 Å²	69	85.8 Å²	85.8	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-58.5	-44	168.6	179.8	65.2	43.8	0	0	112	P475 A524 E526 R530 Y531 E532	P475-Q528 HydrophobicContact CB-CB 4.46Å; P475-Q528 VanDerWaalsContact CG-OE1 3.24Å; A524-Q528 VanDerWaalsContact O-CB 3.29Å; A524-Q528 WeakPolarHBondContact O-CB 3.45Å; A524-Q528 PolarHBondContact O-N 3.02Å; E526-Q528 VanDerWaalsContact C-N 3.34Å; E526-Q528 PolarHBondContact O-N 2.9Å; Q528-R530 VanDerWaalsContact C-N 3.32Å; Q528-Y531 PolarHBondContact O-N 2.72Å; Q528-E532 PolarHBondContact NE2-OE1 3Å; Q528-E532 WeakPolarHBondContact O-CB 3.4Å; Q528-E532 VanDerWaalsContact O-CG 3.31Å; Q528-E532 WeakPolarHBondContact O-CG 3.21Å; Q528-E532 PolarHBondContact O-N 3.26Å
529	K	89.7	Confident	83.9	Confident	137 Å²	137	92.1 Å²	92.1	60%	0.596	43%	0.431	S	S	*	.	H	α-helix	trans	-68.7	-30.6	174.8	-72.1	169.7	-176.4	175.6	0	112.5	A525 E526 D527 R533	A525-K529 WeakPolarHBondContact O-CD 3.43Å; A525-K529 VanDerWaalsContact O-CG 3.32Å; A525-K529 WeakPolarHBondContact O-CG 3.43Å; E526-K529 CarbonylContact O-C 3.59Å; E526-K529 WeakPolarHBondContact O-CB 3.32Å; E526-K529 PolarHBondContact O-N 3.04Å; E526-K529 VanDerWaalsContact O-N 3.15Å; D527-K529 PolarHBondContact O-N 3.42Å; K529-R533 WeakPolarHBondContact O-CB 3.24Å; K529-R533 PolarHBondContact O-N 2.85Å
530	R	91.5	Very high	81.6	Confident	71 Å²	71	89.8 Å²	89.8	27%	0.268	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-53	172.6	171.4	-102	158.3	157.4	-4.4	109.9	D473 E526 D527 Q528 E532 R533 D534	D473-R530 IonicContact OD2-NH1 3.84Å; E526-R530 PolarHBondContact O-N 3.32Å; D527-R530 WeakPolarHBondContact O-CB 3.47Å; D527-R530 PolarHBondContact O-N 3.21Å; D527-R530 VanDerWaalsContact O-N 3.15Å; Q528-R530 VanDerWaalsContact C-N 3.32Å; R530-E532 VanDerWaalsContact C-N 3.31Å; R530-E532 PolarHBondContact O-N 2.86Å; R530-R533 WeakPolarHBondContact O-CB 3.31Å; R530-R533 PolarHBondContact O-N 3.39Å; R530-D534 IonicContact CZ-OD2 2.73Å; R530-D534 VanDerWaalsContact CZ-OD2 3.23Å; R530-D534 IonicContact NE-OD1 2.72Å; R530-D534 IonicContact NE-OD2 3.39Å; R530-D534 PolarHBondContact NE-OD2 2.98Å; R530-D534 IonicContact NH2-OD2 3.24Å; R530-D534 PolarHBondContact NH2-OD2 3.4Å; R530-D534 VanDerWaalsContact O-CG 3.23Å; R530-D534 PolarHBondContact O-N 3.46Å
531	Y	86.2	Confident	79	Confident	61 Å²	61	94.2 Å²	94.2	24%	0.239	46%	0.458	C	S	.	.	H	α-helix	trans	-56.9	-41.6	174.5	-179.9	-113.4	0	0	0	113.4	P472 D473 P475 D527 Q528 R533 L535	P472-Y531 HydrophobicContact CB-CD2 4.18Å; P472-Y531 HydrophobicContact CB-CE2 4.37Å; D473-Y531 WeakPolarHBondContact O-CD2 3.2Å; P475-Y531 HydrophobicContact CB-CD1 4.38Å; P475-Y531 HydrophobicContact CB-CG 4.22Å; P475-Y531 VanDerWaalsContact CD-CD1 3.5Å; P475-Y531 HydrophobicContact CG-CD1 3.69Å; P475-Y531 HydrophobicContact CG-CE1 4.24Å; P475-Y531 HydrophobicContact CG-CG 3.96Å; D527-Y531 PolarHBondContact O-N 2.8Å; Q528-Y531 PolarHBondContact O-N 2.72Å; Y531-R533 VanDerWaalsContact C-N 3.35Å; Y531-R533 PolarHBondContact O-N 3.03Å; Y531-L535 HydrophobicContact CD1-CD1 3.88Å; Y531-L535 HydrophobicContact CD1-CG 4.49Å; Y531-L535 HydrophobicContact CD2-CD1 4.42Å; Y531-L535 HydrophobicContact CD2-CG 4.25Å; Y531-L535 HydrophobicContact CE1-CD1 3.36Å; Y531-L535 HydrophobicContact CE1-CG 4.21Å; Y531-L535 HydrophobicContact CE2-CD1 3.97Å; Y531-L535 HydrophobicContact CE2-CD2 4.34Å; Y531-L535 HydrophobicContact CE2-CG 3.95Å; Y531-L535 HydrophobicContact CG-CD1 4.41Å; Y531-L535 VanDerWaalsContact CZ-CD1 3.43Å; Y531-L535 VanDerWaalsContact O-CB 3.28Å; Y531-L535 WeakPolarHBondContact O-CB 3.37Å; Y531-L535 WeakPolarHBondContact O-CG 3.45Å; Y531-L535 PolarHBondContact O-N 3.31Å
532	E	81	Confident	76.5	Confident	108 Å²	108	94.3 Å²	94.3	51%	0.505	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-34.1	175.9	-75.4	169.7	-170.4	0	0	113.2	Q528 R530 C536	Q528-E532 PolarHBondContact NE2-OE1 3Å; Q528-E532 WeakPolarHBondContact O-CB 3.4Å; Q528-E532 VanDerWaalsContact O-CG 3.31Å; Q528-E532 WeakPolarHBondContact O-CG 3.21Å; Q528-E532 PolarHBondContact O-N 3.26Å; R530-E532 VanDerWaalsContact C-N 3.31Å; R530-E532 PolarHBondContact O-N 2.86Å; E532-C536 VanDerWaalsContact O-CB 3.32Å; E532-C536 WeakPolarHBondContact O-CB 3.34Å; E532-C536 PolarHBondContact O-N 3.04Å
533	R	82.1	Confident	73.5	Confident	139 Å²	139	94.9 Å²	94.9	53%	0.525	48%	0.484	S	S	.	.	H	α-helix	trans	-68.8	-55.7	172.8	-172.7	-159.7	-49.8	106.9	-0.2	110.8	K529 R530 Y531 L535 C536 E537	K529-R533 WeakPolarHBondContact O-CB 3.24Å; K529-R533 PolarHBondContact O-N 2.85Å; R530-R533 WeakPolarHBondContact O-CB 3.31Å; R530-R533 PolarHBondContact O-N 3.39Å; Y531-R533 VanDerWaalsContact C-N 3.35Å; Y531-R533 PolarHBondContact O-N 3.03Å; R533-L535 PolarHBondContact O-N 3.49Å; R533-C536 WeakPolarHBondContact O-CA 3.45Å; R533-C536 WeakPolarHBondContact O-CB 3.44Å; R533-C536 PolarHBondContact O-N 2.96Å; R533-E537 PolarHBondContact O-N 3.41Å
534	D	78.7	Confident	70.6	Confident	32 Å²	32	93.8 Å²	93.8	17%	0.171	50%	0.496	C	S	.	.	H	α-helix	trans	-59.4	-37.4	-176.6	-60.5	18.6	0	0	0	110.5	P472 R530 M538	P472-D534 HydrophobicContact CB-CB 3.74Å; P472-D534 HydrophobicContact CG-CB 3.69Å; R530-D534 IonicContact CZ-OD2 2.73Å; R530-D534 VanDerWaalsContact CZ-OD2 3.23Å; R530-D534 IonicContact NE-OD1 2.72Å; R530-D534 IonicContact NE-OD2 3.39Å; R530-D534 PolarHBondContact NE-OD2 2.98Å; R530-D534 IonicContact NH2-OD2 3.24Å; R530-D534 PolarHBondContact NH2-OD2 3.4Å; R530-D534 VanDerWaalsContact O-CG 3.23Å; R530-D534 PolarHBondContact O-N 3.46Å; D534-M538 WeakPolarHBondContact O-CB 3.21Å; D534-M538 VanDerWaalsContact O-CG 3.29Å; D534-M538 WeakPolarHBondContact O-CG 3.47Å; D534-M538 PolarHBondContact O-N 3.39Å
535	L	73.8	Confident	67.9	Low	63 Å²	63	98.4 Å²	98.4	33%	0.33	52%	0.522	S	S	.	.	H	α-helix	trans	-68	-35.8	171.3	-81.4	-176.9	0	0	0	113.9	P472 Y531 R533 E537 R539	P472-L535 HydrophobicContact CG-CD2 4.24Å; Y531-L535 HydrophobicContact CD1-CD1 3.88Å; Y531-L535 HydrophobicContact CD1-CG 4.49Å; Y531-L535 HydrophobicContact CD2-CD1 4.42Å; Y531-L535 HydrophobicContact CD2-CG 4.25Å; Y531-L535 HydrophobicContact CE1-CD1 3.36Å; Y531-L535 HydrophobicContact CE1-CG 4.21Å; Y531-L535 HydrophobicContact CE2-CD1 3.97Å; Y531-L535 HydrophobicContact CE2-CD2 4.34Å; Y531-L535 HydrophobicContact CE2-CG 3.95Å; Y531-L535 HydrophobicContact CG-CD1 4.41Å; Y531-L535 VanDerWaalsContact CZ-CD1 3.43Å; Y531-L535 VanDerWaalsContact O-CB 3.28Å; Y531-L535 WeakPolarHBondContact O-CB 3.37Å; Y531-L535 WeakPolarHBondContact O-CG 3.45Å; Y531-L535 PolarHBondContact O-N 3.31Å; R533-L535 PolarHBondContact O-N 3.49Å; L535-E537 VanDerWaalsContact C-N 3.35Å; L535-R539 WeakPolarHBondContact O-CB 3.41Å; L535-R539 PolarHBondContact O-N 3.2Å
536	C	75.1	Confident	64.9	Low	82 Å²	82	100.2 Å²	100.2	55%	0.554	53%	0.528	S	S	*	.	H	α-helix	trans	-69.8	-37.7	178.3	-165.7	0	0	0	0	111.2	E532 R533 S540	E532-C536 VanDerWaalsContact O-CB 3.32Å; E532-C536 WeakPolarHBondContact O-CB 3.34Å; E532-C536 PolarHBondContact O-N 3.04Å; R533-C536 WeakPolarHBondContact O-CA 3.45Å; R533-C536 WeakPolarHBondContact O-CB 3.44Å; R533-C536 PolarHBondContact O-N 2.96Å; C536-S540 PolarHBondContact O-N 3.11Å; C536-S540 PolarHBondContact O-OG 3.08Å
537	E	70.5	Confident	62	Low	108 Å²	108	98.5 Å²	98.5	51%	0.505	53%	0.53	S	S	.	.	H	α-helix	trans	-65.1	-52.6	174	-165.7	156.6	-160.5	0	0	110.5	R533 L535 R539 S540	R533-E537 PolarHBondContact O-N 3.41Å; L535-E537 VanDerWaalsContact C-N 3.35Å; E537-R539 VanDerWaalsContact C-N 3.27Å; E537-R539 PolarHBondContact O-N 3.35Å; E537-S540 PolarHBondContact O-N 2.97Å
538	M	62.8	Low	59.5	Low	116 Å²	116	106 Å²	106	57%	0.571	57%	0.57	S	S	*	*	H	α-helix	trans	-66.5	-20.9	176.5	-68.5	-58.1	-70.5	0	0	114.7	R470 P472 D534 S540	R470-M538 VanDerWaalsContact O-CE 3.23Å; R470-M538 WeakPolarHBondContact O-CE 3.36Å; P472-M538 HydrophobicContact CG-CG 4.04Å; D534-M538 WeakPolarHBondContact O-CB 3.21Å; D534-M538 VanDerWaalsContact O-CG 3.29Å; D534-M538 WeakPolarHBondContact O-CG 3.47Å; D534-M538 PolarHBondContact O-N 3.39Å; M538-S540 VanDerWaalsContact C-N 3.28Å
539	R	62	Low	57.1	Low	219 Å²	219	108.6 Å²	108.6	83%	0.826	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-13.2	173.4	-175.8	169.4	-178.1	-179	0.4	113	L535 E537	L535-R539 WeakPolarHBondContact O-CB 3.41Å; L535-R539 PolarHBondContact O-N 3.2Å; E537-R539 VanDerWaalsContact C-N 3.27Å; E537-R539 PolarHBondContact O-N 3.35Å
540	S	41.6	Very low	54.9	Low	64 Å²	64	108.6 Å²	108.6	45%	0.448	58%	0.58	S	S	.	*	S	Bend	trans	-102.2	111.3	-178	-55.8	0	0	0	0	109.3	C536 E537 M538 A542	C536-S540 PolarHBondContact O-N 3.11Å; C536-S540 PolarHBondContact O-OG 3.08Å; E537-S540 PolarHBondContact O-N 2.97Å; M538-S540 VanDerWaalsContact C-N 3.28Å; S540-A542 PolarHBondContact O-N 2.84Å
541	P	41.2	Very low	53	Low	121 Å²	121	109.5 Å²	109.5	79%	0.786	59%	0.588	S	S	*	*			trans	-59.7	137.5	170.9	26.9	-33.6	0	0	0	108.9	N543	P541-N543 PolarHBondContact O-N 2.95Å
542	A	36.3	Very low	51.2	Low	100 Å²	100	115.1 Å²	115.1	83%	0.826	61%	0.614	S	S	*	*	S	Bend	trans	-66.3	98.6	-162	0	0	0	0	0	113.5	S540	S540-A542 PolarHBondContact O-N 2.84Å
543	N	29.8	Very low	50.7	Low	160 Å²	160	111.4 Å²	111.4	86%	0.856	60%	0.596	S	S	*	*	S	Bend	trans	-155.6	141.6	133.2	-103.2	-31.8	0	0	0	111.6	P541	P541-N543 PolarHBondContact O-N 2.95Å
544	A	31.2	Very low	49.9	Very low	92 Å²	92	113.6 Å²	113.6	76%	0.76	61%	0.612	S	S	*	*			trans	53.9	72.6	173.2	0	0	0	0	0	117.2	T546	A544-T546 PolarHBondContact O-N 2.8Å
545	V	35.1	Very low	49.5	Very low	111 Å²	111	114.9 Å²	114.9	67%	0.673	63%	0.633	S	S	*	*			trans	-61.7	104.4	146.1	175.3	0	0	0	0	108.1
546	T	26.8	Very low	49.9	Very low	91 Å²	91	114.4 Å²	114.4	56%	0.558	63%	0.629	S	S	*	*			trans	-120.7	155.5	137.2	71.7	0	0	0	0	108.9	A544	A544-T546 PolarHBondContact O-N 2.8Å
547	S	31	Very low	50.1	Low	95 Å²	95	111.8 Å²	111.8	66%	0.664	61%	0.611	S	S	*	*			trans	-58.9	-176.2	178.5	-35.4	0	0	0	0	111.7	K549	S547-K549 PolarHBondContact O-N 3.35Å
548	L	35.6	Very low	50.5	Low	187 Å²	187	116.1 Å²	116.1	98%	0.979	63%	0.628	S	S	*	*	S	Bend	trans	-67.5	42.1	164.1	-149.6	81	0	0	0	113.2
549	K	37.8	Very low	51.4	Low	124 Å²	124	117.6 Å²	117.6	54%	0.539	63%	0.632	S	S	.	*			trans	-51.4	151.7	159.6	-74.7	177.3	-179	165.6	0	108	S547 M551	S547-K549 PolarHBondContact O-N 3.35Å; K549-M551 PolarHBondContact O-N 2.94Å
550	K	42.8	Very low	52.4	Low	137 Å²	137	108.7 Å²	108.7	60%	0.596	60%	0.602	S	S	*	*			trans	-46.9	133.1	159.2	-54.7	171.9	-175.8	178.6	0	107.4	K552	K550-K552 VanDerWaalsContact C-N 3.35Å; K550-K552 PolarHBondContact O-N 3.44Å
551	M	50.9	Low	54.5	Low	89 Å²	89	106.5 Å²	106.5	44%	0.438	59%	0.586	S	S	.	*			trans	-58.6	106.5	167.4	-167.8	146.5	84.2	0	0	105.6	K549 F553 Y638	K549-M551 PolarHBondContact O-N 2.94Å; M551-F553 HydrophobicContact CB-CE2 4Å; M551-F553 HydrophobicContact CB-CZ 4.43Å; M551-F553 HydrophobicContact CE-CE1 3.98Å; M551-F553 HydrophobicContact CE-CE2 4.22Å; M551-F553 HydrophobicContact CE-CZ 3.46Å; M551-F553 VanDerWaalsContact CE-CZ 3.46Å; M551-F553 HydrophobicContact CG-CE2 4.15Å; M551-F553 HydrophobicContact CG-CZ 4.21Å; M551-F553 WeakPolarHBondContact O-CD2 3.41Å; M551-F553 WeakPolarHBondContact O-CE2 3.33Å; M551-F553 PolarHBondContact O-N 3.11Å; M551-F553 VanDerWaalsContact O-N 3.15Å; M551-Y638 HydrophobicContact CB-CD1 4.22Å; M551-Y638 HydrophobicContact CB-CD2 4.07Å; M551-Y638 HydrophobicContact CB-CE1 3.81Å; M551-Y638 HydrophobicContact CB-CE2 3.66Å; M551-Y638 HydrophobicContact CB-CG 4.34Å; M551-Y638 HydrophobicContact CE-CD2 3.77Å; M551-Y638 HydrophobicContact CE-CE2 4.5Å; M551-Y638 HydrophobicContact CE-CG 3.86Å; M551-Y638 PolarHBondContact N-OH 2.81Å; M551-Y638 HydrophobicContact SD-CD2 4.34Å
552	K	50.3	Low	56.4	Low	179 Å²	179	103.8 Å²	103.8	78%	0.778	57%	0.57	S	S	*	*			trans	-83.2	92.8	-174.9	-82.4	-168.2	171.3	-165.7	0	106.8	K550	K550-K552 VanDerWaalsContact C-N 3.35Å; K550-K552 PolarHBondContact O-N 3.44Å
553	F	69.1	Low	58.9	Low	30 Å²	30	103.5 Å²	103.5	13%	0.132	56%	0.555	C	S	.	*			trans	-66.4	135.6	166	-55.5	-99	0	0	0	107.7	M551 E556 W623 Y635 Y638	M551-F553 HydrophobicContact CB-CE2 4Å; M551-F553 HydrophobicContact CB-CZ 4.43Å; M551-F553 HydrophobicContact CE-CE1 3.98Å; M551-F553 HydrophobicContact CE-CE2 4.22Å; M551-F553 HydrophobicContact CE-CZ 3.46Å; M551-F553 VanDerWaalsContact CE-CZ 3.46Å; M551-F553 HydrophobicContact CG-CE2 4.15Å; M551-F553 HydrophobicContact CG-CZ 4.21Å; M551-F553 WeakPolarHBondContact O-CD2 3.41Å; M551-F553 WeakPolarHBondContact O-CE2 3.33Å; M551-F553 PolarHBondContact O-N 3.11Å; M551-F553 VanDerWaalsContact O-N 3.15Å; F553-E556 HydrophobicContact CB-CB 4.39Å; F553-E556 WeakPolarHBondContact O-CB 3.44Å; F553-E556 PolarHBondContact O-N 3.46Å; F553-E556 VanDerWaalsContact O-N 3.14Å; F553-W623 HydrophobicContact CB-CH2 3.4Å; F553-W623 HydrophobicContact CB-CZ2 3.36Å; F553-W623 AromaticContact CG-CH2 3.97Å; F553-W623 HydrophobicContact CG-CH2 3.97Å; F553-W623 HydrophobicContact CG-CZ2 4.37Å; F553-Y635 AromaticContact CD1-CD2 3.95Å; F553-Y635 HydrophobicContact CD1-CD2 3.95Å; F553-Y635 AromaticContact CD2-CD2 3.44Å; F553-Y635 HydrophobicContact CD2-CD2 3.44Å; F553-Y635 VanDerWaalsContact CD2-CD2 3.44Å; F553-Y635 AromaticContact CD2-CE2 3.63Å; F553-Y635 HydrophobicContact CD2-CE2 3.63Å; F553-Y635 AromaticContact CE1-CD2 3.91Å; F553-Y635 HydrophobicContact CE1-CD2 3.91Å; F553-Y635 HydrophobicContact CE1-CG 4.49Å; F553-Y635 AromaticContact CE2-CD2 3.41Å; F553-Y635 HydrophobicContact CE2-CD2 3.41Å; F553-Y635 VanDerWaalsContact CE2-CD2 3.41Å; F553-Y635 AromaticContact CE2-CE2 3.8Å; F553-Y635 HydrophobicContact CE2-CE2 3.8Å; F553-Y635 HydrophobicContact CE2-CG 4.42Å; F553-Y635 AromaticContact CG-CD2 3.73Å; F553-Y635 HydrophobicContact CG-CD2 3.73Å; F553-Y635 HydrophobicContact CG-CE2 4.21Å; F553-Y635 AromaticContact CZ-CD2 3.65Å; F553-Y635 HydrophobicContact CZ-CD2 3.65Å; F553-Y635 HydrophobicContact CZ-CE2 4.47Å; F553-Y635 HydrophobicContact CZ-CG 4.31Å; F553-Y638 AromaticContact CE2-CD1 3.78Å; F553-Y638 HydrophobicContact CE2-CD1 3.78Å; F553-Y638 HydrophobicContact CE2-CE1 4.32Å; F553-Y638 HydrophobicContact CE2-CG 4.32Å; F553-Y638 HydrophobicContact CZ-CD1 4.15Å; F553-Y638 HydrophobicContact CZ-CG 4.25Å
554	E	65.4	Low	61.6	Low	185 Å²	185	96 Å²	96	86%	0.864	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	135.6	-171.8	-165.3	135.2	-139.3	0	0	110.3	E556 W623	E554-E556 VanDerWaalsContact C-N 3.28Å; E554-E556 PolarHBondContact O-N 3.49Å; E554-W623 PolarHBondContact O-NE1 3.26Å
555	G	70.5	Confident	64.5	Low	59 Å²	59	95 Å²	95	61%	0.608	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	-3.5	-170.4	0	0	0	0	0	116.6	P557 W623	G555-P557 VanDerWaalsContact O-CD 3.3Å; G555-P557 WeakPolarHBondContact O-CD 3.43Å; G555-P557 VanDerWaalsContact O-N 3.14Å; G555-W623 VanDerWaalsContact C-NE1 3.31Å
556	E	81.4	Confident	67	Low	54 Å²	54	93.8 Å²	93.8	25%	0.252	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-53.2	120.8	-177.7	-172.4	-172.3	-155.5	0	0	111.1	F553 E554 W623 Y635	F553-E556 HydrophobicContact CB-CB 4.39Å; F553-E556 WeakPolarHBondContact O-CB 3.44Å; F553-E556 PolarHBondContact O-N 3.46Å; F553-E556 VanDerWaalsContact O-N 3.14Å; E554-E556 VanDerWaalsContact C-N 3.28Å; E554-E556 PolarHBondContact O-N 3.49Å; E556-W623 HydrophobicContact CB-CH2 3.97Å; E556-W623 HydrophobicContact CB-CZ2 3.84Å; E556-W623 HydrophobicContact CB-CZ3 4.46Å; E556-W623 HydrophobicContact CG-CH2 4.06Å; E556-W623 HydrophobicContact CG-CZ2 4.41Å; E556-W623 HydrophobicContact CG-CZ3 4.15Å; E556-Y635 HydrophobicContact CG-CE2 4.48Å; E556-Y635 WeakPolarHBondContact OE1-CE2 3.22Å; E556-Y635 PolarHBondContact OE1-OH 2.65Å
557	P	80.4	Confident	70.2	Confident	26 Å²	26	91 Å²	91	17%	0.169	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-56.8	144.2	178.8	-28.7	37.1	0	0	0	112.5	G555 Y616 L619 W623	G555-P557 VanDerWaalsContact O-CD 3.3Å; G555-P557 WeakPolarHBondContact O-CD 3.43Å; G555-P557 VanDerWaalsContact O-N 3.14Å; P557-Y616 HydrophobicContact CB-CD2 4Å; P557-Y616 HydrophobicContact CB-CE2 3.71Å; P557-Y616 WeakPolarHBondContact O-CE2 3.4Å; P557-L619 HydrophobicContact CB-CB 4.27Å; P557-L619 HydrophobicContact CG-CB 4.05Å; P557-W623 HydrophobicContact CG-CB 4.19Å
558	K	78.6	Confident	73	Confident	199 Å²	199	87 Å²	87	87%	0.865	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-78.8	124.9	178.4	-66.9	174.4	-173.7	165.4	0	109.9	Y616	K558-Y616 WeakPolarHBondContact O-CD2 3.41Å
559	K	81.4	Confident	75.5	Confident	148 Å²	148	78.8 Å²	78.8	64%	0.643	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-57	127.3	175.3	-67.9	-161.7	175.4	-139.4	0	111.1	Y616	K559-Y616 HydrophobicContact CB-CE2 4.48Å; K559-Y616 WeakPolarHBondContact CE-OH 3.4Å; K559-Y616 HydrophobicContact CG-CE1 4.06Å; K559-Y616 HydrophobicContact CG-CE2 3.99Å; K559-Y616 WeakPolarHBondContact CG-OH 3.1Å
560	P	84.4	Confident	78	Confident	31 Å²	31	77.8 Å²	77.8	20%	0.201	39%	0.385	C	S	.	.			trans	-74.3	174.5	175.3	35.1	-39.6	0	0	0	111	S562 K612 Q613 Y616	P560-S562 PolarHBondContact O-N 2.88Å; P560-K612 HydrophobicContact CB-CB 3.92Å; P560-K612 WeakPolarHBondContact CG-O 3.39Å; P560-Q613 HydrophobicContact CG-CG 3.76Å; P560-Y616 HydrophobicContact CG-CG 4.1Å
561	P	84.8	Confident	80.2	Confident	18 Å²	18	73.8 Å²	73.8	12%	0.117	37%	0.368	C	S	.	.			trans	-51.7	131.8	163.6	-26.5	36.4	0	0	0	111.8	Q566 K567	P561-Q566 HydrophobicContact CB-CB 3.69Å; P561-K567 HydrophobicContact CB-CB 4.01Å; P561-K567 HydrophobicContact CG-CB 4.23Å; P561-K567 HydrophobicContact CG-CD 4.19Å
562	S	80.4	Confident	81.9	Confident	64 Å²	64	70.5 Å²	70.5	45%	0.448	35%	0.352	S	S	.	.	S	Bend	trans	-91.8	1.4	-175.1	78.2	0	0	0	0	115	P560 Q566 Q613	P560-S562 PolarHBondContact O-N 2.88Å; S562-Q566 PolarHBondContact OG-NE2 3.32Å; S562-Q566 PolarHBondContact OG-OE1 3.17Å; S562-Q613 PolarHBondContact O-NE2 2.95Å
563	N	89.3	Confident	83.6	Confident	95 Å²	95	64.6 Å²	64.6	51%	0.508	33%	0.329	S	S	.	.	S	Bend	trans	-163.2	158.6	178.1	-165.8	-26.5	0	0	0	108.7	Y565 Q566 K567 A609	N563-Y565 VanDerWaalsContact C-N 3.29Å; N563-Y565 PolarHBondContact O-N 3.23Å; N563-Q566 WeakPolarHBondContact O-CA 3.46Å; N563-Q566 WeakPolarHBondContact O-CB 3.34Å; N563-Q566 PolarHBondContact O-N 3.5Å; N563-K567 PolarHBondContact O-N 2.97Å; N563-A609 VanDerWaalsContact C-CB 3.5Å
564	G	87.5	Confident	84.3	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-53.7	-39.5	179.7	0	0	0	0	0	114	Q566 K567 F568 Y605	G564-Q566 VanDerWaalsContact C-N 3.28Å; G564-Q566 PolarHBondContact O-N 3.36Å; G564-K567 PolarHBondContact O-N 3.48Å; G564-F568 WeakPolarHBondContact O-CB 3.03Å; G564-F568 PolarHBondContact O-N 3.3Å; G564-Y605 VanDerWaalsContact CA-C 3.5Å; G564-Y605 VanDerWaalsContact CA-O 3.27Å; G564-Y605 WeakPolarHBondContact CA-O 3.25Å
565	Y	90.4	Very high	85.1	Confident	71 Å²	71	63.2 Å²	63.2	28%	0.278	34%	0.335	S	S	.	.	H	α-helix	trans	-60.7	-35.2	174.2	177.5	-124.2	0	0	0	113	N563 F568 S569 I590 W594	N563-Y565 VanDerWaalsContact C-N 3.29Å; N563-Y565 PolarHBondContact O-N 3.23Å; Y565-F568 HydrophobicContact CD2-CD1 4.46Å; Y565-S569 VanDerWaalsContact O-CB 3.29Å; Y565-S569 WeakPolarHBondContact O-CB 3.46Å; Y565-S569 PolarHBondContact O-N 3.29Å; Y565-S569 PolarHBondContact O-OG 3.2Å; Y565-I590 HydrophobicContact CE2-CG2 4.05Å; Y565-W594 HydrophobicContact CD2-CB 3.63Å; Y565-W594 AromaticContact CD2-CD1 3.65Å; Y565-W594 AromaticContact CD2-CD2 3.61Å; Y565-W594 HydrophobicContact CD2-CD2 3.61Å; Y565-W594 HydrophobicContact CD2-CE3 4.2Å; Y565-W594 AromaticContact CD2-CG 3.32Å; Y565-W594 HydrophobicContact CD2-CG 3.32Å; Y565-W594 HydrophobicContact CE2-CB 3.65Å; Y565-W594 AromaticContact CE2-CG 3.85Å; Y565-W594 HydrophobicContact CE2-CG 3.85Å; Y565-W594 HydrophobicContact CG-CD2 4.29Å; Y565-W594 HydrophobicContact CG-CG 4.23Å
566	Q	89.2	Confident	85.3	Confident	87 Å²	87	61.7 Å²	61.7	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-70.6	-34.7	174.4	-69.1	-176.4	17.8	0	0	111.6	P561 S562 N563 G564 S569 Q570	P561-Q566 HydrophobicContact CB-CB 3.69Å; S562-Q566 PolarHBondContact OG-NE2 3.32Å; S562-Q566 PolarHBondContact OG-OE1 3.17Å; N563-Q566 WeakPolarHBondContact O-CA 3.46Å; N563-Q566 WeakPolarHBondContact O-CB 3.34Å; N563-Q566 PolarHBondContact O-N 3.5Å; G564-Q566 VanDerWaalsContact C-N 3.28Å; G564-Q566 PolarHBondContact O-N 3.36Å; Q566-S569 WeakPolarHBondContact CA-OG 3.2Å; Q566-S569 PolarHBondContact O-OG 3.4Å; Q566-Q570 VanDerWaalsContact O-CB 3.26Å; Q566-Q570 WeakPolarHBondContact O-CB 3.49Å; Q566-Q570 PolarHBondContact O-N 3.47Å
567	K	92.1	Very high	85.3	Confident	33 Å²	33	63.8 Å²	63.8	14%	0.143	33%	0.33	C	S	.	.	H	α-helix	trans	-70	-41.5	176.6	177.1	64.4	-160.7	69	0	111.7	P561 N563 G564 E571 Y605 I608 A609	P561-K567 HydrophobicContact CB-CB 4.01Å; P561-K567 HydrophobicContact CG-CB 4.23Å; P561-K567 HydrophobicContact CG-CD 4.19Å; N563-K567 PolarHBondContact O-N 2.97Å; G564-K567 PolarHBondContact O-N 3.48Å; K567-E571 IonicContact NZ-OE2 3.78Å; K567-E571 PolarHBondContact NZ-OE2 2.98Å; K567-E571 WeakPolarHBondContact O-CB 3.12Å; K567-E571 PolarHBondContact O-N 2.92Å; K567-E571 VanDerWaalsContact O-N 3.13Å; K567-Y605 HydrophobicContact CG-CD1 4.15Å; K567-I608 HydrophobicContact CD-CG2 3.95Å; K567-I608 HydrophobicContact CG-CB 4.48Å; K567-I608 HydrophobicContact CG-CG2 3.86Å; K567-A609 HydrophobicContact CB-CB 4.16Å
568	F	91.4	Very high	85.3	Confident	11 Å²	11	62.8 Å²	62.8	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-48.5	173.9	174.9	-102.3	0	0	0	111.9	G564 Y565 Q570 E571 M572 I590 R593 W594 L597 Y605	G564-F568 WeakPolarHBondContact O-CB 3.03Å; G564-F568 PolarHBondContact O-N 3.3Å; Y565-F568 HydrophobicContact CD2-CD1 4.46Å; F568-Q570 VanDerWaalsContact C-N 3.34Å; F568-Q570 PolarHBondContact O-N 3.46Å; F568-E571 WeakPolarHBondContact O-CB 3.26Å; F568-E571 PolarHBondContact O-N 3.02Å; F568-M572 HydrophobicContact CD1-CG 4.23Å; F568-M572 HydrophobicContact CD2-CG 4.31Å; F568-M572 HydrophobicContact CE1-CG 3.8Å; F568-M572 HydrophobicContact CE2-CG 3.9Å; F568-M572 HydrophobicContact CE2-SD 4.03Å; F568-M572 HydrophobicContact CG-CG 4.48Å; F568-M572 HydrophobicContact CZ-CG 3.63Å; F568-M572 HydrophobicContact CZ-SD 4.01Å; F568-M572 WeakPolarHBondContact O-CG 3.08Å; F568-M572 PolarHBondContact O-N 3.13Å; F568-I590 HydrophobicContact CD1-CG2 4.3Å; F568-I590 HydrophobicContact CE1-CG2 4.24Å; F568-R593 HydrophobicContact CE1-CB 4.22Å; F568-R593 HydrophobicContact CZ-CB 3.99Å; F568-W594 HydrophobicContact CB-CE3 3.67Å; F568-W594 HydrophobicContact CB-CZ3 3.69Å; F568-W594 HydrophobicContact CD1-CB 3.95Å; F568-W594 HydrophobicContact CD1-CD2 4.33Å; F568-W594 AromaticContact CD1-CE3 3.61Å; F568-W594 HydrophobicContact CD1-CE3 3.61Å; F568-W594 HydrophobicContact CD1-CZ3 4.48Å; F568-W594 HydrophobicContact CD2-CE3 4.3Å; F568-W594 HydrophobicContact CE1-CB 3.83Å; F568-W594 HydrophobicContact CE1-CE3 4.31Å; F568-W594 AromaticContact CG-CE3 3.59Å; F568-W594 HydrophobicContact CG-CE3 3.59Å; F568-W594 HydrophobicContact CG-CZ3 4.04Å; F568-L597 HydrophobicContact CD2-CD2 4.1Å; F568-L597 HydrophobicContact CE2-CD1 4.43Å; F568-L597 HydrophobicContact CE2-CD2 4.1Å; F568-Y605 HydrophobicContact CB-CD1 4.46Å; F568-Y605 HydrophobicContact CB-CD2 4.18Å; F568-Y605 HydrophobicContact CB-CG 4.17Å; F568-Y605 HydrophobicContact CD2-CD2 4.02Å; F568-Y605 AromaticContact CD2-CE2 3.61Å; F568-Y605 HydrophobicContact CD2-CE2 3.61Å; F568-Y605 AromaticContact CD2-CZ 3.94Å; F568-Y605 HydrophobicContact CE2-CE2 4.33Å
569	S	87.8	Confident	85.4	Confident	13 Å²	13	57.7 Å²	57.7	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-65.8	-34.2	178.3	54.3	0	0	0	0	112.9	Y565 Q566 E571 L573 I590	Y565-S569 VanDerWaalsContact O-CB 3.29Å; Y565-S569 WeakPolarHBondContact O-CB 3.46Å; Y565-S569 PolarHBondContact O-N 3.29Å; Y565-S569 PolarHBondContact O-OG 3.2Å; Q566-S569 WeakPolarHBondContact CA-OG 3.2Å; Q566-S569 PolarHBondContact O-OG 3.4Å; S569-E571 VanDerWaalsContact C-N 3.31Å; S569-E571 PolarHBondContact O-N 3.47Å; S569-L573 WeakPolarHBondContact O-CB 3.42Å; S569-L573 VanDerWaalsContact O-CG 3.24Å; S569-L573 WeakPolarHBondContact O-CG 3.33Å; S569-L573 PolarHBondContact O-N 3.25Å; S569-L573 VanDerWaalsContact O-N 3.1Å; S569-I590 VanDerWaalsContact CB-CG2 3.43Å
570	Q	89.2	Confident	85.3	Confident	103 Å²	103	57.6 Å²	57.6	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-42.8	169	-177.1	-177.1	30.3	0	0	111.7	Q566 F568 L573 S574	Q566-Q570 VanDerWaalsContact O-CB 3.26Å; Q566-Q570 WeakPolarHBondContact O-CB 3.49Å; Q566-Q570 PolarHBondContact O-N 3.47Å; F568-Q570 VanDerWaalsContact C-N 3.34Å; F568-Q570 PolarHBondContact O-N 3.46Å; Q570-L573 PolarHBondContact O-N 3.16Å; Q570-S574 PolarHBondContact O-N 3.49Å; Q570-S574 PolarHBondContact O-OG 3.06Å
571	E	90.1	Very high	85.1	Confident	53 Å²	53	58.4 Å²	58.4	25%	0.248	31%	0.309	C	S	.	.	H	α-helix	trans	-68.7	-47.5	-178.9	-157.4	164.4	122.3	0	0	111.9	K567 F568 S569 L573 S574 N575 Y605	K567-E571 IonicContact NZ-OE2 3.78Å; K567-E571 PolarHBondContact NZ-OE2 2.98Å; K567-E571 WeakPolarHBondContact O-CB 3.12Å; K567-E571 PolarHBondContact O-N 2.92Å; K567-E571 VanDerWaalsContact O-N 3.13Å; F568-E571 WeakPolarHBondContact O-CB 3.26Å; F568-E571 PolarHBondContact O-N 3.02Å; S569-E571 VanDerWaalsContact C-N 3.31Å; S569-E571 PolarHBondContact O-N 3.47Å; E571-L573 PolarHBondContact O-N 2.91Å; E571-S574 WeakPolarHBondContact CA-OG 3.19Å; E571-S574 PolarHBondContact O-N 3.2Å; E571-S574 PolarHBondContact O-OG 3.45Å; E571-N575 WeakPolarHBondContact O-CB 3.16Å; E571-N575 PolarHBondContact O-N 3.18Å; E571-N575 PolarHBondContact O-OD1 3.13Å; E571-N575 VanDerWaalsContact O-OD1 3.05Å; E571-Y605 PolarHBondContact OE1-OH 3.05Å
572	M	87.1	Confident	85	Confident	21 Å²	21	61 Å²	61	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-61.9	-24.2	174.5	-66.2	-53.1	-47.8	0	0	113.5	F568 E577 L578 I590 R593	F568-M572 HydrophobicContact CD1-CG 4.23Å; F568-M572 HydrophobicContact CD2-CG 4.31Å; F568-M572 HydrophobicContact CE1-CG 3.8Å; F568-M572 HydrophobicContact CE2-CG 3.9Å; F568-M572 HydrophobicContact CE2-SD 4.03Å; F568-M572 HydrophobicContact CG-CG 4.48Å; F568-M572 HydrophobicContact CZ-CG 3.63Å; F568-M572 HydrophobicContact CZ-SD 4.01Å; F568-M572 WeakPolarHBondContact O-CG 3.08Å; F568-M572 PolarHBondContact O-N 3.13Å; M572-E577 WeakPolarHBondContact CE-OE2 3.47Å; M572-L578 HydrophobicContact CB-CD1 4.34Å; M572-L578 HydrophobicContact CE-CD1 4.27Å; M572-I590 HydrophobicContact CB-CD1 3.84Å; M572-I590 HydrophobicContact CB-CG1 3.74Å; M572-I590 HydrophobicContact CG-CG1 4.41Å; M572-R593 VanDerWaalsContact CE-NH1 3.32Å
573	L	84.7	Confident	84.7	Confident	54 Å²	54	63 Å²	63	28%	0.283	33%	0.329	S	S	.	.	H	α-helix	trans	-85.5	-29.7	172.3	-70.9	171.4	0	0	0	113.3	S569 Q570 E571 M583 R586 M587 I590	S569-L573 WeakPolarHBondContact O-CB 3.42Å; S569-L573 VanDerWaalsContact O-CG 3.24Å; S569-L573 WeakPolarHBondContact O-CG 3.33Å; S569-L573 PolarHBondContact O-N 3.25Å; S569-L573 VanDerWaalsContact O-N 3.1Å; Q570-L573 PolarHBondContact O-N 3.16Å; E571-L573 PolarHBondContact O-N 2.91Å; L573-M583 HydrophobicContact CD2-SD 4.22Å; L573-R586 HydrophobicContact CD2-CB 4.24Å; L573-M587 HydrophobicContact CD1-SD 4.29Å; L573-I590 HydrophobicContact CD1-CD1 4.43Å; L573-I590 HydrophobicContact CD2-CD1 3.77Å; L573-I590 HydrophobicContact CG-CD1 3.69Å
574	S	85.1	Confident	84.3	Confident	85 Å²	85	66.8 Å²	66.8	59%	0.594	34%	0.341	S	S	*	.	H	α-helix	trans	-77.6	-32.8	175.3	56.6	0	0	0	0	113.2	Q570 E571 G576	Q570-S574 PolarHBondContact O-N 3.49Å; Q570-S574 PolarHBondContact O-OG 3.06Å; E571-S574 WeakPolarHBondContact CA-OG 3.19Å; E571-S574 PolarHBondContact O-N 3.2Å; E571-S574 PolarHBondContact O-OG 3.45Å; S574-G576 PolarHBondContact O-N 2.85Å; S574-G576 VanDerWaalsContact O-N 3.11Å
575	N	81.4	Confident	84.2	Confident	102 Å²	102	71.3 Å²	71.3	55%	0.545	36%	0.362	S	S	.	.	S	Bend	trans	-73.6	-1	-174.9	-62.9	1.9	0	0	0	113.4	E571 E577	E571-N575 WeakPolarHBondContact O-CB 3.16Å; E571-N575 PolarHBondContact O-N 3.18Å; E571-N575 PolarHBondContact O-OD1 3.13Å; E571-N575 VanDerWaalsContact O-OD1 3.05Å; N575-E577 PolarHBondContact O-N 3.22Å
576	G	75.3	Confident	84	Confident	27 Å²	27	69.9 Å²	69.9	28%	0.278	36%	0.356	S	S	.	.			trans	75.7	-22.9	165.7	0	0	0	0	0	116.8	S574 L578 N579	S574-G576 PolarHBondContact O-N 2.85Å; S574-G576 VanDerWaalsContact O-N 3.11Å; G576-L578 PolarHBondContact O-N 3.08Å; G576-L578 VanDerWaalsContact O-N 3.1Å; G576-N579 WeakPolarHBondContact CA-ND2 3.27Å; G576-N579 WeakPolarHBondContact O-CB 3.43Å; G576-N579 PolarHBondContact O-N 3.46Å; G576-N579 PolarHBondContact O-ND2 3.48Å
577	E	81.8	Confident	84	Confident	98 Å²	98	69.5 Å²	69.5	46%	0.458	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-43.6	-46.4	-178.9	-166.7	-160.3	151.2	0	0	113.4	M572 N575 N579 H580 R593	M572-E577 WeakPolarHBondContact CE-OE2 3.47Å; N575-E577 PolarHBondContact O-N 3.22Å; E577-N579 VanDerWaalsContact C-N 3.35Å; E577-N579 PolarHBondContact O-N 3.39Å; E577-H580 PolarHBondContact O-CE1 2.95Å; E577-H580 PolarHBondContact O-ND1 3.03Å; E577-R593 IonicContact OE1-CZ 3.72Å; E577-R593 IonicContact OE1-NH1 2.66Å; E577-R593 PolarHBondContact OE1-NH1 3.48Å; E577-R593 IonicContact OE1-NH2 3.63Å; E577-R593 PolarHBondContact OE1-NH2 2.93Å; E577-R593 IonicContact OE2-CZ 3.92Å; E577-R593 IonicContact OE2-NH1 2.78Å; E577-R593 PolarHBondContact OE2-NH1 2.8Å
578	L	78.9	Confident	83.8	Confident	4 Å²	4	72.2 Å²	72.2	2%	0.021	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-86.5	4.3	-175.6	-64.3	168.5	0	0	0	114.1	M572 G576 H580 L581 R586 E589 I590	M572-L578 HydrophobicContact CB-CD1 4.34Å; M572-L578 HydrophobicContact CE-CD1 4.27Å; G576-L578 PolarHBondContact O-N 3.08Å; G576-L578 VanDerWaalsContact O-N 3.1Å; L578-H580 PolarHBondContact O-N 3.5Å; L578-L581 HydrophobicContact CD2-CD1 4.23Å; L578-L581 PolarHBondContact O-N 3.34Å; L578-L581 VanDerWaalsContact O-N 3.09Å; L578-R586 HydrophobicContact CB-CB 4.49Å; L578-R586 HydrophobicContact CB-CG 4.1Å; L578-R586 VanDerWaalsContact O-CD 3.32Å; L578-R586 WeakPolarHBondContact O-CD 3.24Å; L578-R586 WeakPolarHBondContact O-CG 3.35Å; L578-R586 PolarHBondContact O-NE 3.41Å; L578-E589 HydrophobicContact CD2-CB 4.4Å; L578-E589 HydrophobicContact CD2-CG 3.87Å; L578-I590 HydrophobicContact CD1-CD1 3.85Å; L578-I590 HydrophobicContact CD1-CG1 3.47Å; L578-I590 VanDerWaalsContact CD1-CG1 3.47Å
579	N	80.9	Confident	83.7	Confident	92 Å²	92	74.3 Å²	74.3	49%	0.492	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-63.9	-23.7	-174.9	-85.2	-30.4	0	0	0	114.3	G576 E577 L581 R586	G576-N579 WeakPolarHBondContact CA-ND2 3.27Å; G576-N579 WeakPolarHBondContact O-CB 3.43Å; G576-N579 PolarHBondContact O-N 3.46Å; G576-N579 PolarHBondContact O-ND2 3.48Å; E577-N579 VanDerWaalsContact C-N 3.35Å; E577-N579 PolarHBondContact O-N 3.39Å; N579-L581 PolarHBondContact O-N 3.23Å; N579-R586 PolarHBondContact O-NH2 3.43Å; N579-R586 PolarHBondContact OD1-NH1 3.43Å
580	H	80.2	Confident	83.7	Confident	146 Å²	146	73.7 Å²	73.7	68%	0.676	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-68.4	-18.1	176.3	68.2	-86.6	0	0	0	113.4	E577 L578	E577-H580 PolarHBondContact O-CE1 2.95Å; E577-H580 PolarHBondContact O-ND1 3.03Å; L578-H580 PolarHBondContact O-N 3.5Å
581	L	79.1	Confident	83.8	Confident	48 Å²	48	69.7 Å²	69.7	25%	0.251	37%	0.367	S	S	.	.	S	Bend	trans	-95.1	146.9	179.4	-61.1	178.5	0	0	0	112.7	L578 N579 E585 R586	L578-L581 HydrophobicContact CD2-CD1 4.23Å; L578-L581 PolarHBondContact O-N 3.34Å; L578-L581 VanDerWaalsContact O-N 3.09Å; N579-L581 PolarHBondContact O-N 3.23Å; L581-E585 HydrophobicContact CB-CB 4.31Å; L581-R586 HydrophobicContact CB-CG 4Å; L581-R586 PolarHBondContact O-NE 2.95Å
582	P	83.3	Confident	83.8	Confident	72 Å²	72	69.5 Å²	69.5	47%	0.468	37%	0.372	S	S	.	.			trans	-51.8	142.2	166	-25.7	34.5	0	0	0	112.1	K584 E585 R586	P582-K584 PolarHBondContact O-N 2.89Å; P582-E585 WeakPolarHBondContact CD-OE2 3.37Å; P582-E585 PolarHBondContact O-N 3.47Å; P582-R586 PolarHBondContact O-N 2.99Å
583	M	73.9	Confident	84	Confident	107 Å²	107	71.6 Å²	71.6	53%	0.527	38%	0.378	S	S	.	.	H	α-helix	trans	-53.3	-33	-175.1	-174.8	61.6	76.3	0	0	113.6	L573 M587	L573-M583 HydrophobicContact CD2-SD 4.22Å; M583-M587 WeakPolarHBondContact O-CG 3.36Å; M583-M587 PolarHBondContact O-N 3.2Å
584	K	80.9	Confident	84.3	Confident	174 Å²	174	70.9 Å²	70.9	76%	0.757	37%	0.372	S	S	*	.	H	α-helix	trans	-62.7	-44.9	175.3	-172.2	-172.4	175.2	-165	0	111.9	P582 M587 T588	P582-K584 PolarHBondContact O-N 2.89Å; K584-M587 PolarHBondContact O-N 2.75Å; K584-T588 PolarHBondContact O-N 2.81Å; K584-T588 PolarHBondContact O-OG1 3.37Å
585	E	85.4	Confident	84.4	Confident	97 Å²	97	73.6 Å²	73.6	45%	0.453	38%	0.375	S	S	.	.	H	α-helix	trans	-73.7	-35	-179.9	-75.3	145.6	-122.9	0	0	111.9	L581 P582 M587 T588 E589	L581-E585 HydrophobicContact CB-CB 4.31Å; P582-E585 WeakPolarHBondContact CD-OE2 3.37Å; P582-E585 PolarHBondContact O-N 3.47Å; E585-M587 VanDerWaalsContact C-N 3.32Å; E585-M587 PolarHBondContact O-N 2.92Å; E585-T588 WeakPolarHBondContact O-CB 3.4Å; E585-T588 PolarHBondContact O-N 3.31Å; E585-E589 PolarHBondContact O-N 3.42Å
586	R	87.3	Confident	84.9	Confident	40 Å²	40	76.7 Å²	76.7	15%	0.151	38%	0.379	C	S	.	.	H	α-helix	trans	-55.5	-47.7	169.8	-57.4	-171.2	-151.4	-176.5	-2.1	111.8	L573 L578 N579 L581 P582 T588 E589 I590	L573-R586 HydrophobicContact CD2-CB 4.24Å; L578-R586 HydrophobicContact CB-CB 4.49Å; L578-R586 HydrophobicContact CB-CG 4.1Å; L578-R586 VanDerWaalsContact O-CD 3.32Å; L578-R586 WeakPolarHBondContact O-CD 3.24Å; L578-R586 WeakPolarHBondContact O-CG 3.35Å; L578-R586 PolarHBondContact O-NE 3.41Å; N579-R586 PolarHBondContact O-NH2 3.43Å; N579-R586 PolarHBondContact OD1-NH1 3.43Å; L581-R586 HydrophobicContact CB-CG 4Å; L581-R586 PolarHBondContact O-NE 2.95Å; P582-R586 PolarHBondContact O-N 2.99Å; R586-T588 VanDerWaalsContact C-N 3.29Å; R586-T588 PolarHBondContact O-N 3.22Å; R586-E589 PolarHBondContact O-N 3Å; R586-I590 VanDerWaalsContact O-CB 3.31Å; R586-I590 WeakPolarHBondContact O-CB 3.47Å; R586-I590 WeakPolarHBondContact O-CD1 3.28Å; R586-I590 WeakPolarHBondContact O-CG1 3.39Å; R586-I590 PolarHBondContact O-N 2.75Å
587	M	87.8	Confident	85.7	Confident	79 Å²	79	76.8 Å²	76.8	39%	0.389	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-34.2	180	-67.9	-56.6	-58.2	0	0	112.1	L573 M583 K584 E585 G591	L573-M587 HydrophobicContact CD1-SD 4.29Å; M583-M587 WeakPolarHBondContact O-CG 3.36Å; M583-M587 PolarHBondContact O-N 3.2Å; K584-M587 PolarHBondContact O-N 2.75Å; E585-M587 VanDerWaalsContact C-N 3.32Å; E585-M587 PolarHBondContact O-N 2.92Å; M587-G591 PolarHBondContact O-N 2.87Å; M587-G591 VanDerWaalsContact O-N 3.12Å
588	T	87.6	Confident	86.2	Confident	91 Å²	91	75.7 Å²	75.7	56%	0.558	38%	0.375	S	S	*	.	H	α-helix	trans	-64.3	-52	171.8	-53.7	0	0	0	0	111.5	K584 E585 R586 I590 G591 S592	K584-T588 PolarHBondContact O-N 2.81Å; K584-T588 PolarHBondContact O-OG1 3.37Å; E585-T588 WeakPolarHBondContact O-CB 3.4Å; E585-T588 PolarHBondContact O-N 3.31Å; R586-T588 VanDerWaalsContact C-N 3.29Å; R586-T588 PolarHBondContact O-N 3.22Å; T588-I590 VanDerWaalsContact C-N 3.35Å; T588-I590 PolarHBondContact O-N 3.39Å; T588-G591 WeakPolarHBondContact O-CA 3.48Å; T588-G591 PolarHBondContact O-N 2.73Å; T588-G591 VanDerWaalsContact O-N 3.13Å; T588-S592 PolarHBondContact O-N 2.68Å; T588-S592 PolarHBondContact O-OG 3.34Å
589	E	89.5	Confident	86.6	Confident	54 Å²	54	81.6 Å²	81.6	25%	0.252	41%	0.405	S	S	.	.	H	α-helix	trans	-66.4	-35.9	-177.5	177.2	53.7	-163.6	0	0	112.2	L578 E585 R586 G591 S592 R593 R596	L578-E589 HydrophobicContact CD2-CB 4.4Å; L578-E589 HydrophobicContact CD2-CG 3.87Å; E585-E589 PolarHBondContact O-N 3.42Å; R586-E589 PolarHBondContact O-N 3Å; E589-G591 VanDerWaalsContact C-N 3.33Å; E589-G591 PolarHBondContact O-N 3.33Å; E589-S592 CarbonylContact O-C 3.29Å; E589-S592 PolarHBondContact O-N 3.33Å; E589-R593 HydrophobicContact CG-CG 4.46Å; E589-R593 WeakPolarHBondContact O-CB 3.19Å; E589-R593 WeakPolarHBondContact O-CG 3.45Å; E589-R593 PolarHBondContact O-N 3.46Å; E589-R593 VanDerWaalsContact OE1-CG 3.32Å; E589-R593 WeakPolarHBondContact OE1-CG 3.28Å; E589-R593 IonicContact OE1-CZ 2.65Å; E589-R593 IonicContact OE1-NE 3.13Å; E589-R593 PolarHBondContact OE1-NE 3.5Å; E589-R593 IonicContact OE1-NH2 3.43Å; E589-R596 IonicContact OE1-NH2 3.63Å; E589-R596 PolarHBondContact OE1-NH2 3.18Å; E589-R596 IonicContact OE2-NH2 3.51Å
590	I	89.3	Confident	87	Confident	0 Å²	0	85.8 Å²	85.8	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-62.6	-40.2	172.4	-71.1	169.5	0	0	0	111.2	Y565 F568 S569 M572 L573 L578 R586 T588 R593 W594	Y565-I590 HydrophobicContact CE2-CG2 4.05Å; F568-I590 HydrophobicContact CD1-CG2 4.3Å; F568-I590 HydrophobicContact CE1-CG2 4.24Å; S569-I590 VanDerWaalsContact CB-CG2 3.43Å; M572-I590 HydrophobicContact CB-CD1 3.84Å; M572-I590 HydrophobicContact CB-CG1 3.74Å; M572-I590 HydrophobicContact CG-CG1 4.41Å; L573-I590 HydrophobicContact CD1-CD1 4.43Å; L573-I590 HydrophobicContact CD2-CD1 3.77Å; L573-I590 HydrophobicContact CG-CD1 3.69Å; L578-I590 HydrophobicContact CD1-CD1 3.85Å; L578-I590 HydrophobicContact CD1-CG1 3.47Å; L578-I590 VanDerWaalsContact CD1-CG1 3.47Å; R586-I590 VanDerWaalsContact O-CB 3.31Å; R586-I590 WeakPolarHBondContact O-CB 3.47Å; R586-I590 WeakPolarHBondContact O-CD1 3.28Å; R586-I590 WeakPolarHBondContact O-CG1 3.39Å; R586-I590 PolarHBondContact O-N 2.75Å; T588-I590 VanDerWaalsContact C-N 3.35Å; T588-I590 PolarHBondContact O-N 3.39Å; I590-R593 PolarHBondContact O-N 3.08Å; I590-W594 WeakPolarHBondContact O-CB 3.44Å; I590-W594 PolarHBondContact O-N 3.14Å
591	G	89.7	Confident	87.4	Confident	19 Å²	19	81 Å²	81	20%	0.196	40%	0.398	C	S	.	.	H	α-helix	trans	-60.5	-49	171.2	0	0	0	0	0	112	M587 T588 E589 R593 W594 Q595	M587-G591 PolarHBondContact O-N 2.87Å; M587-G591 VanDerWaalsContact O-N 3.12Å; T588-G591 WeakPolarHBondContact O-CA 3.48Å; T588-G591 PolarHBondContact O-N 2.73Å; T588-G591 VanDerWaalsContact O-N 3.13Å; E589-G591 VanDerWaalsContact C-N 3.33Å; E589-G591 PolarHBondContact O-N 3.33Å; G591-R593 VanDerWaalsContact C-N 3.3Å; G591-R593 PolarHBondContact O-N 3.4Å; G591-W594 PolarHBondContact O-N 3.44Å; G591-Q595 WeakPolarHBondContact O-CG 3.43Å; G591-Q595 PolarHBondContact O-N 2.91Å
592	S	91.1	Very high	88	Confident	50 Å²	50	80.6 Å²	80.6	35%	0.35	40%	0.395	S	S	.	.	H	α-helix	trans	-61.6	-33.8	177.1	-61.4	0	0	0	0	113.4	T588 E589 R596	T588-S592 PolarHBondContact O-N 2.68Å; T588-S592 PolarHBondContact O-OG 3.34Å; E589-S592 CarbonylContact O-C 3.29Å; E589-S592 PolarHBondContact O-N 3.33Å; S592-R596 WeakPolarHBondContact O-CG 3.31Å; S592-R596 PolarHBondContact O-N 2.79Å; S592-R596 PolarHBondContact O-NE 3.07Å
593	R	90.3	Very high	88.3	Confident	64 Å²	64	81 Å²	81	24%	0.242	39%	0.393	C	S	.	.	H	α-helix	trans	-75.1	-40.6	174.3	-72.1	179.8	-176.8	-155	7	112.2	F568 M572 E577 E589 I590 G591 Q595 R596 L597	F568-R593 HydrophobicContact CE1-CB 4.22Å; F568-R593 HydrophobicContact CZ-CB 3.99Å; M572-R593 VanDerWaalsContact CE-NH1 3.32Å; E577-R593 IonicContact OE1-CZ 3.72Å; E577-R593 IonicContact OE1-NH1 2.66Å; E577-R593 PolarHBondContact OE1-NH1 3.48Å; E577-R593 IonicContact OE1-NH2 3.63Å; E577-R593 PolarHBondContact OE1-NH2 2.93Å; E577-R593 IonicContact OE2-CZ 3.92Å; E577-R593 IonicContact OE2-NH1 2.78Å; E577-R593 PolarHBondContact OE2-NH1 2.8Å; E589-R593 HydrophobicContact CG-CG 4.46Å; E589-R593 WeakPolarHBondContact O-CB 3.19Å; E589-R593 WeakPolarHBondContact O-CG 3.45Å; E589-R593 PolarHBondContact O-N 3.46Å; E589-R593 VanDerWaalsContact OE1-CG 3.32Å; E589-R593 WeakPolarHBondContact OE1-CG 3.28Å; E589-R593 IonicContact OE1-CZ 2.65Å; E589-R593 IonicContact OE1-NE 3.13Å; E589-R593 PolarHBondContact OE1-NE 3.5Å; E589-R593 IonicContact OE1-NH2 3.43Å; I590-R593 PolarHBondContact O-N 3.08Å; G591-R593 VanDerWaalsContact C-N 3.3Å; G591-R593 PolarHBondContact O-N 3.4Å; R593-Q595 VanDerWaalsContact C-N 3.34Å; R593-Q595 PolarHBondContact O-N 3.12Å; R593-R596 PolarHBondContact O-N 3.4Å; R593-L597 PolarHBondContact O-N 3.41Å
594	W	90.7	Very high	89.1	Confident	40 Å²	40	80.9 Å²	80.9	15%	0.152	39%	0.387	C	S	.	.	H	α-helix	trans	-61.1	-42.1	174.9	176.4	-103.9	0	0	0	111.8	Y565 F568 I590 G591 R596 L597 K602 Y605	Y565-W594 HydrophobicContact CD2-CB 3.63Å; Y565-W594 AromaticContact CD2-CD1 3.65Å; Y565-W594 AromaticContact CD2-CD2 3.61Å; Y565-W594 HydrophobicContact CD2-CD2 3.61Å; Y565-W594 HydrophobicContact CD2-CE3 4.2Å; Y565-W594 AromaticContact CD2-CG 3.32Å; Y565-W594 HydrophobicContact CD2-CG 3.32Å; Y565-W594 HydrophobicContact CE2-CB 3.65Å; Y565-W594 AromaticContact CE2-CG 3.85Å; Y565-W594 HydrophobicContact CE2-CG 3.85Å; Y565-W594 HydrophobicContact CG-CD2 4.29Å; Y565-W594 HydrophobicContact CG-CG 4.23Å; F568-W594 HydrophobicContact CB-CE3 3.67Å; F568-W594 HydrophobicContact CB-CZ3 3.69Å; F568-W594 HydrophobicContact CD1-CB 3.95Å; F568-W594 HydrophobicContact CD1-CD2 4.33Å; F568-W594 AromaticContact CD1-CE3 3.61Å; F568-W594 HydrophobicContact CD1-CE3 3.61Å; F568-W594 HydrophobicContact CD1-CZ3 4.48Å; F568-W594 HydrophobicContact CD2-CE3 4.3Å; F568-W594 HydrophobicContact CE1-CB 3.83Å; F568-W594 HydrophobicContact CE1-CE3 4.31Å; F568-W594 AromaticContact CG-CE3 3.59Å; F568-W594 HydrophobicContact CG-CE3 3.59Å; F568-W594 HydrophobicContact CG-CZ3 4.04Å; I590-W594 WeakPolarHBondContact O-CB 3.44Å; I590-W594 PolarHBondContact O-N 3.14Å; G591-W594 PolarHBondContact O-N 3.44Å; W594-R596 PolarHBondContact O-N 2.89Å; W594-L597 HydrophobicContact CE3-CD2 3.71Å; W594-L597 HydrophobicContact CZ3-CD2 3.79Å; W594-L597 VanDerWaalsContact O-CB 3.26Å; W594-L597 WeakPolarHBondContact O-CB 3.35Å; W594-L597 PolarHBondContact O-N 2.66Å; W594-K602 HydrophobicContact CD2-CG 4.43Å; W594-K602 HydrophobicContact CE3-CG 4.33Å; W594-K602 HydrophobicContact CH2-CB 3.8Å; W594-K602 HydrophobicContact CH2-CG 3.79Å; W594-K602 HydrophobicContact CZ2-CB 4.1Å; W594-K602 HydrophobicContact CZ2-CG 3.87Å; W594-K602 HydrophobicContact CZ3-CB 4.34Å; W594-K602 HydrophobicContact CZ3-CG 4.02Å; W594-K602 WeakPolarHBondContact O-CE 3.41Å; W594-K602 PolarHBondContact O-NZ 2.98Å; W594-Y605 HydrophobicContact CZ3-CD2 4.03Å; W594-Y605 HydrophobicContact CZ3-CG 4.41Å
595	Q	89.1	Confident	89.7	Confident	141 Å²	141	73.6 Å²	73.6	66%	0.659	35%	0.354	S	S	*	.	H	α-helix	trans	-61.4	-45.2	177.4	-68.1	-61.9	-4.9	0	0	111.8	G591 R593 L597 K602	G591-Q595 WeakPolarHBondContact O-CG 3.43Å; G591-Q595 PolarHBondContact O-N 2.91Å; R593-Q595 VanDerWaalsContact C-N 3.34Å; R593-Q595 PolarHBondContact O-N 3.12Å; Q595-L597 PolarHBondContact O-N 2.93Å; Q595-K602 PolarHBondContact O-NZ 3.07Å
596	R	90.5	Very high	90	Very high	168 Å²	168	73.8 Å²	73.8	63%	0.634	35%	0.354	S	S	*	.	H	α-helix	trans	-69.3	-9.4	176.3	-71.1	178.8	-72.3	171.6	-1.7	115	E589 S592 R593 W594	E589-R596 IonicContact OE1-NH2 3.63Å; E589-R596 PolarHBondContact OE1-NH2 3.18Å; E589-R596 IonicContact OE2-NH2 3.51Å; S592-R596 WeakPolarHBondContact O-CG 3.31Å; S592-R596 PolarHBondContact O-N 2.79Å; S592-R596 PolarHBondContact O-NE 3.07Å; R593-R596 PolarHBondContact O-N 3.4Å; W594-R596 PolarHBondContact O-N 2.89Å
597	L	92.1	Very high	90.2	Very high	29 Å²	29	79.2 Å²	79.2	15%	0.152	38%	0.379	C	S	.	.	S	Bend	trans	-73.2	136.2	-177	-168.6	70.3	0	0	0	111.1	F568 R593 W594 Q595 D601 K602 Y605	F568-L597 HydrophobicContact CD2-CD2 4.1Å; F568-L597 HydrophobicContact CE2-CD1 4.43Å; F568-L597 HydrophobicContact CE2-CD2 4.1Å; R593-L597 PolarHBondContact O-N 3.41Å; W594-L597 HydrophobicContact CE3-CD2 3.71Å; W594-L597 HydrophobicContact CZ3-CD2 3.79Å; W594-L597 VanDerWaalsContact O-CB 3.26Å; W594-L597 WeakPolarHBondContact O-CB 3.35Å; W594-L597 PolarHBondContact O-N 2.66Å; Q595-L597 PolarHBondContact O-N 2.93Å; L597-D601 HydrophobicContact CD1-CB 3.76Å; L597-D601 HydrophobicContact CD2-CB 3.94Å; L597-D601 HydrophobicContact CG-CB 3.61Å; L597-K602 HydrophobicContact CB-CG 4.21Å; L597-K602 HydrophobicContact CD2-CG 3.95Å; L597-K602 HydrophobicContact CG-CG 4.25Å; L597-K602 WeakPolarHBondContact O-CE 3.28Å; L597-K602 PolarHBondContact O-NZ 2.88Å; L597-Y605 HydrophobicContact CD2-CD2 3.8Å; L597-Y605 HydrophobicContact CD2-CE2 3.81Å
598	P	92.1	Very high	90.2	Very high	75 Å²	75	78.1 Å²	78.1	49%	0.487	37%	0.374	S	S	.	.			trans	-58.1	153.6	175.5	-26.3	35.7	0	0	0	113.5	K600 D601 K602	P598-K600 PolarHBondContact O-N 2.97Å; P598-D601 HydrophobicContact CB-CB 4.49Å; P598-D601 WeakPolarHBondContact CD-OD2 2.98Å; P598-D601 WeakPolarHBondContact CG-OD2 3.05Å; P598-D601 WeakPolarHBondContact O-CB 3.26Å; P598-D601 PolarHBondContact O-N 3.2Å; P598-D601 VanDerWaalsContact O-N 3.15Å; P598-K602 WeakPolarHBondContact O-CG 3.24Å; P598-K602 PolarHBondContact O-N 3.42Å
599	L	88.3	Confident	90.3	Very high	128 Å²	128	73.8 Å²	73.8	67%	0.67	35%	0.347	S	S	*	.	H	α-helix	trans	-56.9	-52.5	178.9	-69.5	170.7	0	0	0	111.6	D601 K602 D603	L599-D601 PolarHBondContact O-N 3.12Å; L599-K602 HydrophobicContact CD2-CD 4.35Å; L599-K602 CarbonylContact O-C 3.53Å; L599-K602 WeakPolarHBondContact O-CA 3.39Å; L599-K602 WeakPolarHBondContact O-CB 3.48Å; L599-K602 PolarHBondContact O-N 3.09Å; L599-D603 VanDerWaalsContact C-OD2 3.27Å; L599-D603 VanDerWaalsContact O-CG 3.23Å; L599-D603 PolarHBondContact O-N 3.05Å
600	K	89.8	Confident	90.4	Very high	180 Å²	180	74.9 Å²	74.9	78%	0.783	35%	0.352	S	S	*	.	H	α-helix	trans	-50.9	-32.4	175.5	-174.1	174	-177.6	173.6	0	114.5	P598 R604	P598-K600 PolarHBondContact O-N 2.97Å; K600-R604 PolarHBondContact O-N 3.11Å
601	D	87.9	Confident	90.5	Very high	44 Å²	44	80 Å²	80	24%	0.235	38%	0.376	C	S	.	.	H	α-helix	trans	-79	-42.2	174.6	-74.9	-58.2	0	0	0	112.2	L597 P598 L599 D603 R604 Y605	L597-D601 HydrophobicContact CD1-CB 3.76Å; L597-D601 HydrophobicContact CD2-CB 3.94Å; L597-D601 HydrophobicContact CG-CB 3.61Å; P598-D601 HydrophobicContact CB-CB 4.49Å; P598-D601 WeakPolarHBondContact CD-OD2 2.98Å; P598-D601 WeakPolarHBondContact CG-OD2 3.05Å; P598-D601 WeakPolarHBondContact O-CB 3.26Å; P598-D601 PolarHBondContact O-N 3.2Å; P598-D601 VanDerWaalsContact O-N 3.15Å; L599-D601 PolarHBondContact O-N 3.12Å; D601-D603 VanDerWaalsContact C-N 3.27Å; D601-D603 PolarHBondContact O-N 2.78Å; D601-R604 PolarHBondContact O-N 3.18Å; D601-R604 IonicContact OD1-CZ 3.72Å; D601-R604 IonicContact OD1-NH1 2.71Å; D601-R604 PolarHBondContact OD1-NH1 3.08Å; D601-R604 IonicContact OD1-NH2 3.3Å; D601-R604 PolarHBondContact OD1-NH2 3.12Å; D601-Y605 WeakPolarHBondContact O-CD2 3.44Å; D601-Y605 PolarHBondContact O-N 3.38Å; D601-Y605 VanDerWaalsContact O-N 3.1Å
602	K	91.1	Very high	90.4	Very high	40 Å²	40	83.5 Å²	83.5	17%	0.174	39%	0.386	C	S	.	.	H	α-helix	trans	-56.8	-42.3	171.7	-69.7	165.5	167.6	147	0	111.1	W594 Q595 L597 P598 L599 Y605 K606	W594-K602 HydrophobicContact CD2-CG 4.43Å; W594-K602 HydrophobicContact CE3-CG 4.33Å; W594-K602 HydrophobicContact CH2-CB 3.8Å; W594-K602 HydrophobicContact CH2-CG 3.79Å; W594-K602 HydrophobicContact CZ2-CB 4.1Å; W594-K602 HydrophobicContact CZ2-CG 3.87Å; W594-K602 HydrophobicContact CZ3-CB 4.34Å; W594-K602 HydrophobicContact CZ3-CG 4.02Å; W594-K602 WeakPolarHBondContact O-CE 3.41Å; W594-K602 PolarHBondContact O-NZ 2.98Å; Q595-K602 PolarHBondContact O-NZ 3.07Å; L597-K602 HydrophobicContact CB-CG 4.21Å; L597-K602 HydrophobicContact CD2-CG 3.95Å; L597-K602 HydrophobicContact CG-CG 4.25Å; L597-K602 WeakPolarHBondContact O-CE 3.28Å; L597-K602 PolarHBondContact O-NZ 2.88Å; P598-K602 WeakPolarHBondContact O-CG 3.24Å; P598-K602 PolarHBondContact O-N 3.42Å; L599-K602 HydrophobicContact CD2-CD 4.35Å; L599-K602 CarbonylContact O-C 3.53Å; L599-K602 WeakPolarHBondContact O-CA 3.39Å; L599-K602 WeakPolarHBondContact O-CB 3.48Å; L599-K602 PolarHBondContact O-N 3.09Å; K602-Y605 CarbonylContact O-C 3.5Å; K602-Y605 PolarHBondContact O-N 3.06Å; K602-Y605 VanDerWaalsContact O-N 3.17Å; K602-K606 PolarHBondContact O-N 3.49Å
603	D	89.8	Confident	90.2	Very high	80 Å²	80	84.5 Å²	84.5	43%	0.428	39%	0.385	S	S	.	.	H	α-helix	trans	-69.4	-37.2	179.6	-59.8	-37.3	0	0	0	112.4	L599 D601 Y605 K606 K607	L599-D603 VanDerWaalsContact C-OD2 3.27Å; L599-D603 VanDerWaalsContact O-CG 3.23Å; L599-D603 PolarHBondContact O-N 3.05Å; D601-D603 VanDerWaalsContact C-N 3.27Å; D601-D603 PolarHBondContact O-N 2.78Å; D603-Y605 VanDerWaalsContact C-N 3.31Å; D603-Y605 PolarHBondContact O-N 3.17Å; D603-K606 WeakPolarHBondContact O-CB 3.38Å; D603-K606 PolarHBondContact O-N 2.93Å; D603-K607 PolarHBondContact O-N 2.8Å
604	R	92	Very high	90.1	Very high	105 Å²	105	88.3 Å²	88.3	40%	0.396	40%	0.404	S	S	.	.	H	α-helix	trans	-58	-45.2	168.4	-177.1	-178	62.7	-100.3	-0.4	110.7	K600 D601 I608	K600-R604 PolarHBondContact O-N 3.11Å; D601-R604 PolarHBondContact O-N 3.18Å; D601-R604 IonicContact OD1-CZ 3.72Å; D601-R604 IonicContact OD1-NH1 2.71Å; D601-R604 PolarHBondContact OD1-NH1 3.08Å; D601-R604 IonicContact OD1-NH2 3.3Å; D601-R604 PolarHBondContact OD1-NH2 3.12Å; R604-I608 HydrophobicContact CG-CD1 3.77Å; R604-I608 HydrophobicContact CG-CG1 4.49Å; R604-I608 WeakPolarHBondContact O-CB 3.48Å; R604-I608 VanDerWaalsContact O-CG1 3.23Å; R604-I608 WeakPolarHBondContact O-CG1 3.4Å; R604-I608 PolarHBondContact O-N 2.61Å
605	Y	91.6	Very high	89.9	Confident	21 Å²	21	89.9 Å²	89.9	8%	0.082	41%	0.412	C	S	.	.	H	α-helix	trans	-69.6	-31.8	177.1	-66.9	-62.2	0	0	0	113.2	G564 K567 F568 E571 W594 L597 D601 K602 D603 A609	G564-Y605 VanDerWaalsContact CA-C 3.5Å; G564-Y605 VanDerWaalsContact CA-O 3.27Å; G564-Y605 WeakPolarHBondContact CA-O 3.25Å; K567-Y605 HydrophobicContact CG-CD1 4.15Å; F568-Y605 HydrophobicContact CB-CD1 4.46Å; F568-Y605 HydrophobicContact CB-CD2 4.18Å; F568-Y605 HydrophobicContact CB-CG 4.17Å; F568-Y605 HydrophobicContact CD2-CD2 4.02Å; F568-Y605 AromaticContact CD2-CE2 3.61Å; F568-Y605 HydrophobicContact CD2-CE2 3.61Å; F568-Y605 AromaticContact CD2-CZ 3.94Å; F568-Y605 HydrophobicContact CE2-CE2 4.33Å; E571-Y605 PolarHBondContact OE1-OH 3.05Å; W594-Y605 HydrophobicContact CZ3-CD2 4.03Å; W594-Y605 HydrophobicContact CZ3-CG 4.41Å; L597-Y605 HydrophobicContact CD2-CD2 3.8Å; L597-Y605 HydrophobicContact CD2-CE2 3.81Å; D601-Y605 WeakPolarHBondContact O-CD2 3.44Å; D601-Y605 PolarHBondContact O-N 3.38Å; D601-Y605 VanDerWaalsContact O-N 3.1Å; K602-Y605 CarbonylContact O-C 3.5Å; K602-Y605 PolarHBondContact O-N 3.06Å; K602-Y605 VanDerWaalsContact O-N 3.17Å; D603-Y605 VanDerWaalsContact C-N 3.31Å; D603-Y605 PolarHBondContact O-N 3.17Å; Y605-A609 WeakPolarHBondContact O-CB 3.14Å; Y605-A609 PolarHBondContact O-N 3.33Å
606	K	91.6	Very high	89.8	Confident	102 Å²	102	84.4 Å²	84.4	44%	0.443	39%	0.386	S	S	.	.	H	α-helix	trans	-57.3	-59.5	170.1	177.4	-175.3	169.9	-172.3	0	109.8	K602 D603 I608 A609 E610	K602-K606 PolarHBondContact O-N 3.49Å; D603-K606 WeakPolarHBondContact O-CB 3.38Å; D603-K606 PolarHBondContact O-N 2.93Å; K606-I608 PolarHBondContact O-N 3.05Å; K606-A609 WeakPolarHBondContact O-CB 3.36Å; K606-A609 PolarHBondContact O-N 3.34Å; K606-E610 WeakPolarHBondContact CE-OE1 3.49Å; K606-E610 WeakPolarHBondContact CG-OE1 3.47Å; K606-E610 WeakPolarHBondContact O-CG 3.04Å; K606-E610 PolarHBondContact O-N 3.21Å
607	K	92.3	Very high	89.6	Confident	154 Å²	154	82.4 Å²	82.4	67%	0.67	38%	0.382	S	S	*	.	H	α-helix	trans	-57.8	-41.8	-180	-67.3	-168.3	175.8	-164.8	0	112.9	D603 A609 E610 E611	D603-K607 PolarHBondContact O-N 2.8Å; K607-A609 VanDerWaalsContact C-N 3.35Å; K607-A609 PolarHBondContact O-N 3.04Å; K607-E610 PolarHBondContact O-N 3.09Å; K607-E611 PolarHBondContact O-N 2.92Å
608	I	88.1	Confident	89.5	Confident	55 Å²	55	84.5 Å²	84.5	28%	0.282	40%	0.396	S	S	.	.	H	α-helix	trans	-64.6	-35.8	175.7	-67	168.1	0	0	0	112.2	K567 R604 K606 K612	K567-I608 HydrophobicContact CD-CG2 3.95Å; K567-I608 HydrophobicContact CG-CB 4.48Å; K567-I608 HydrophobicContact CG-CG2 3.86Å; R604-I608 HydrophobicContact CG-CD1 3.77Å; R604-I608 HydrophobicContact CG-CG1 4.49Å; R604-I608 WeakPolarHBondContact O-CB 3.48Å; R604-I608 VanDerWaalsContact O-CG1 3.23Å; R604-I608 WeakPolarHBondContact O-CG1 3.4Å; R604-I608 PolarHBondContact O-N 2.61Å; K606-I608 PolarHBondContact O-N 3.05Å; I608-K612 WeakPolarHBondContact O-CB 3.43Å; I608-K612 WeakPolarHBondContact O-CG 3.42Å; I608-K612 PolarHBondContact O-N 3.49Å
609	A	90.2	Very high	89.3	Confident	1 Å²	1	85.3 Å²	85.3	1%	0.008	40%	0.396	C	S	.	.	H	α-helix	trans	-73.2	-35.8	176.4	0	0	0	0	0	112.2	N563 K567 Y605 K606 K607 Q613	N563-A609 VanDerWaalsContact C-CB 3.5Å; K567-A609 HydrophobicContact CB-CB 4.16Å; Y605-A609 WeakPolarHBondContact O-CB 3.14Å; Y605-A609 PolarHBondContact O-N 3.33Å; K606-A609 WeakPolarHBondContact O-CB 3.36Å; K606-A609 PolarHBondContact O-N 3.34Å; K607-A609 VanDerWaalsContact C-N 3.35Å; K607-A609 PolarHBondContact O-N 3.04Å; A609-Q613 WeakPolarHBondContact O-CG 3.45Å; A609-Q613 PolarHBondContact O-N 3.36Å; A609-Q613 VanDerWaalsContact O-N 3.08Å; A609-Q613 PolarHBondContact O-NE2 3.31Å
610	E	91.1	Very high	89.1	Confident	76 Å²	76	80.6 Å²	80.6	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-69.4	-46.9	177	-73.6	158.6	173.3	0	0	111.9	K606 K607 K612 Q613 K614	K606-E610 WeakPolarHBondContact CE-OE1 3.49Å; K606-E610 WeakPolarHBondContact CG-OE1 3.47Å; K606-E610 WeakPolarHBondContact O-CG 3.04Å; K606-E610 PolarHBondContact O-N 3.21Å; K607-E610 PolarHBondContact O-N 3.09Å; E610-K612 VanDerWaalsContact C-N 3.31Å; E610-K612 PolarHBondContact O-N 3.18Å; E610-Q613 CarbonylContact O-C 3.55Å; E610-Q613 WeakPolarHBondContact O-CA 3.34Å; E610-Q613 WeakPolarHBondContact O-CB 3.27Å; E610-Q613 PolarHBondContact O-N 3.22Å; E610-K614 PolarHBondContact O-N 2.86Å
611	E	91.8	Very high	88.9	Confident	108 Å²	108	76.9 Å²	76.9	51%	0.505	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-40.7	176.5	-163.3	-160.5	154.8	0	0	111.3	K607 Q613 K614 Q615	K607-E611 PolarHBondContact O-N 2.92Å; E611-Q613 PolarHBondContact O-N 3.44Å; E611-K614 PolarHBondContact O-N 2.83Å; E611-Q615 WeakPolarHBondContact O-CB 3.49Å; E611-Q615 WeakPolarHBondContact O-CG 3.35Å; E611-Q615 PolarHBondContact O-N 3.04Å; E611-Q615 PolarHBondContact OE1-NE2 3.28Å
612	K	87.7	Confident	88.9	Confident	92 Å²	92	80.4 Å²	80.4	40%	0.4	37%	0.372	S	S	.	.	H	α-helix	trans	-65.1	-28.3	174.2	-68	-69.5	157.4	-157.5	0	112.5	P560 I608 E610 Y616	P560-K612 HydrophobicContact CB-CB 3.92Å; P560-K612 WeakPolarHBondContact CG-O 3.39Å; I608-K612 WeakPolarHBondContact O-CB 3.43Å; I608-K612 WeakPolarHBondContact O-CG 3.42Å; I608-K612 PolarHBondContact O-N 3.49Å; E610-K612 VanDerWaalsContact C-N 3.31Å; E610-K612 PolarHBondContact O-N 3.18Å; K612-Y616 VanDerWaalsContact O-CB 3.28Å; K612-Y616 WeakPolarHBondContact O-CB 3.25Å; K612-Y616 PolarHBondContact O-N 2.75Å
613	Q	86.4	Confident	88.7	Confident	72 Å²	72	79.6 Å²	79.6	34%	0.336	37%	0.367	S	S	.	.	H	α-helix	trans	-74.3	-42.1	170.7	-75.8	177.5	100.2	0	0	112.9	P560 S562 A609 E610 E611 Y616 K617	P560-Q613 HydrophobicContact CG-CG 3.76Å; S562-Q613 PolarHBondContact O-NE2 2.95Å; A609-Q613 WeakPolarHBondContact O-CG 3.45Å; A609-Q613 PolarHBondContact O-N 3.36Å; A609-Q613 VanDerWaalsContact O-N 3.08Å; A609-Q613 PolarHBondContact O-NE2 3.31Å; E610-Q613 CarbonylContact O-C 3.55Å; E610-Q613 WeakPolarHBondContact O-CA 3.34Å; E610-Q613 WeakPolarHBondContact O-CB 3.27Å; E610-Q613 PolarHBondContact O-N 3.22Å; E611-Q613 PolarHBondContact O-N 3.44Å; Q613-Y616 PolarHBondContact O-N 2.72Å; Q613-K617 PolarHBondContact O-N 3.05Å
614	K	88.9	Confident	88.4	Confident	144 Å²	144	77.5 Å²	77.5	63%	0.626	36%	0.356	S	S	*	.	H	α-helix	trans	-57.5	-48.5	171.9	-70.3	-169.3	176.7	-171	0	110.1	E610 E611 Y616 K617 V618	E610-K614 PolarHBondContact O-N 2.86Å; E611-K614 PolarHBondContact O-N 2.83Å; K614-Y616 PolarHBondContact O-N 3.35Å; K614-K617 PolarHBondContact O-N 3.14Å; K614-V618 PolarHBondContact O-N 3.45Å
615	Q	85.9	Confident	88.1	Confident	72 Å²	72	75.7 Å²	75.7	34%	0.336	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-41.4	174.4	-70.5	172.6	7.5	0	0	113.1	E611 L619	E611-Q615 WeakPolarHBondContact O-CB 3.49Å; E611-Q615 WeakPolarHBondContact O-CG 3.35Å; E611-Q615 PolarHBondContact O-N 3.04Å; E611-Q615 PolarHBondContact OE1-NE2 3.28Å; Q615-L619 WeakPolarHBondContact O-CG 3.04Å; Q615-L619 PolarHBondContact O-N 2.79Å; Q615-L619 VanDerWaalsContact O-N 3.13Å
616	Y	87.1	Confident	87.7	Confident	27 Å²	27	79 Å²	79	11%	0.106	39%	0.39	C	S	.	.	H	α-helix	trans	-65.4	-39	176.8	171.9	-97.5	0	0	0	113.2	P557 K558 K559 P560 K612 Q613 K614 L619 L620	P557-Y616 HydrophobicContact CB-CD2 4Å; P557-Y616 HydrophobicContact CB-CE2 3.71Å; P557-Y616 WeakPolarHBondContact O-CE2 3.4Å; K558-Y616 WeakPolarHBondContact O-CD2 3.41Å; K559-Y616 HydrophobicContact CB-CE2 4.48Å; K559-Y616 WeakPolarHBondContact CE-OH 3.4Å; K559-Y616 HydrophobicContact CG-CE1 4.06Å; K559-Y616 HydrophobicContact CG-CE2 3.99Å; K559-Y616 WeakPolarHBondContact CG-OH 3.1Å; P560-Y616 HydrophobicContact CG-CG 4.1Å; K612-Y616 VanDerWaalsContact O-CB 3.28Å; K612-Y616 WeakPolarHBondContact O-CB 3.25Å; K612-Y616 PolarHBondContact O-N 2.75Å; Q613-Y616 PolarHBondContact O-N 2.72Å; K614-Y616 PolarHBondContact O-N 3.35Å; Y616-L619 PolarHBondContact O-N 2.77Å; Y616-L620 HydrophobicContact CE1-CB 4.41Å; Y616-L620 HydrophobicContact CE1-CD2 3.96Å; Y616-L620 WeakPolarHBondContact O-CB 3.45Å; Y616-L620 PolarHBondContact O-N 3.02Å
617	K	85.4	Confident	87.2	Confident	125 Å²	125	75.2 Å²	75.2	54%	0.543	37%	0.374	S	S	.	.	H	α-helix	trans	-59.6	-50.2	177.7	-178.2	-176.6	171.5	-170.9	0	110.5	Q613 K614 L619 L620 E621	Q613-K617 PolarHBondContact O-N 3.05Å; K614-K617 PolarHBondContact O-N 3.14Å; K617-L619 PolarHBondContact O-N 2.82Å; K617-L620 PolarHBondContact O-N 3.31Å; K617-E621 WeakPolarHBondContact CE-OE1 3.42Å; K617-E621 VanDerWaalsContact CG-OE1 3.3Å; K617-E621 WeakPolarHBondContact CG-OE1 3.29Å; K617-E621 WeakPolarHBondContact O-CG 3.45Å; K617-E621 PolarHBondContact O-N 3.38Å
618	V	90	Very high	86.8	Confident	74 Å²	74	70.6 Å²	70.6	45%	0.448	36%	0.361	S	S	.	.	H	α-helix	trans	-59	-47.4	177.7	176.6	0	0	0	0	111.6	K614 L620 E621 Q622	K614-V618 PolarHBondContact O-N 3.45Å; V618-L620 VanDerWaalsContact C-N 3.32Å; V618-L620 PolarHBondContact O-N 3.4Å; V618-E621 PolarHBondContact O-N 3.28Å; V618-Q622 HydrophobicContact CG1-CG 4.45Å; V618-Q622 WeakPolarHBondContact O-CB 3.46Å; V618-Q622 WeakPolarHBondContact O-CG 3.37Å; V618-Q622 PolarHBondContact O-N 3.15Å
619	L	87.3	Confident	86.3	Confident	92 Å²	92	72.2 Å²	72.2	48%	0.482	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-37.5	177.3	-72.2	170.6	0	0	0	112.6	P557 Q615 Y616 K617 W623	P557-L619 HydrophobicContact CB-CB 4.27Å; P557-L619 HydrophobicContact CG-CB 4.05Å; Q615-L619 WeakPolarHBondContact O-CG 3.04Å; Q615-L619 PolarHBondContact O-N 2.79Å; Q615-L619 VanDerWaalsContact O-N 3.13Å; Y616-L619 PolarHBondContact O-N 2.77Å; K617-L619 PolarHBondContact O-N 2.82Å; L619-W623 WeakPolarHBondContact O-CB 3.12Å; L619-W623 PolarHBondContact O-N 3.29Å
620	L	84.3	Confident	85.5	Confident	29 Å²	29	79.8 Å²	79.8	15%	0.152	41%	0.413	C	S	.	.	H	α-helix	trans	-69.1	-39	177.2	-175.6	68	0	0	0	111.7	Y616 K617 V618 W623 L624	Y616-L620 HydrophobicContact CE1-CB 4.41Å; Y616-L620 HydrophobicContact CE1-CD2 3.96Å; Y616-L620 WeakPolarHBondContact O-CB 3.45Å; Y616-L620 PolarHBondContact O-N 3.02Å; K617-L620 PolarHBondContact O-N 3.31Å; V618-L620 VanDerWaalsContact C-N 3.32Å; V618-L620 PolarHBondContact O-N 3.4Å; L620-W623 HydrophobicContact CD1-CE3 3.87Å; L620-W623 HydrophobicContact CD1-CZ3 4.15Å; L620-L624 HydrophobicContact CG-CD1 4.19Å; L620-L624 WeakPolarHBondContact O-CB 3.36Å; L620-L624 VanDerWaalsContact O-CG 3.23Å; L620-L624 WeakPolarHBondContact O-CG 3.38Å; L620-L624 PolarHBondContact O-N 2.81Å
621	E	86.5	Confident	84.8	Confident	101 Å²	101	80.5 Å²	80.5	47%	0.472	42%	0.416	S	S	.	.	H	α-helix	trans	-69.5	-43.6	177.8	-74.4	167.2	-174.4	0	0	111.8	K617 V618 W623 L624 A625	K617-E621 WeakPolarHBondContact CE-OE1 3.42Å; K617-E621 VanDerWaalsContact CG-OE1 3.3Å; K617-E621 WeakPolarHBondContact CG-OE1 3.29Å; K617-E621 WeakPolarHBondContact O-CG 3.45Å; K617-E621 PolarHBondContact O-N 3.38Å; V618-E621 PolarHBondContact O-N 3.28Å; E621-W623 PolarHBondContact O-N 2.77Å; E621-L624 PolarHBondContact O-N 3.45Å; E621-A625 WeakPolarHBondContact O-CB 3.22Å; E621-A625 PolarHBondContact O-N 3.27Å
622	Q	87.1	Confident	84.2	Confident	119 Å²	119	79.4 Å²	79.4	56%	0.556	41%	0.407	S	S	*	.	H	α-helix	trans	-59.4	-44.6	171.5	-72.5	175.3	-2	0	0	112	V618 A625 S626	V618-Q622 HydrophobicContact CG1-CG 4.45Å; V618-Q622 WeakPolarHBondContact O-CB 3.46Å; V618-Q622 WeakPolarHBondContact O-CG 3.37Å; V618-Q622 PolarHBondContact O-N 3.15Å; Q622-A625 WeakPolarHBondContact O-CB 3.36Å; Q622-A625 PolarHBondContact O-N 3.09Å; Q622-S626 PolarHBondContact O-N 3.27Å
623	W	88.1	Confident	83.6	Confident	23 Å²	23	79.6 Å²	79.6	9%	0.087	41%	0.412	C	S	.	.	H	α-helix	trans	-65.4	-44.6	177.2	174.8	78.8	0	0	0	111.9	F553 E554 G555 E556 P557 L619 L620 E621 A625 S626 L627 Y635	F553-W623 HydrophobicContact CB-CH2 3.4Å; F553-W623 HydrophobicContact CB-CZ2 3.36Å; F553-W623 AromaticContact CG-CH2 3.97Å; F553-W623 HydrophobicContact CG-CH2 3.97Å; F553-W623 HydrophobicContact CG-CZ2 4.37Å; E554-W623 PolarHBondContact O-NE1 3.26Å; G555-W623 VanDerWaalsContact C-NE1 3.31Å; E556-W623 HydrophobicContact CB-CH2 3.97Å; E556-W623 HydrophobicContact CB-CZ2 3.84Å; E556-W623 HydrophobicContact CB-CZ3 4.46Å; E556-W623 HydrophobicContact CG-CH2 4.06Å; E556-W623 HydrophobicContact CG-CZ2 4.41Å; E556-W623 HydrophobicContact CG-CZ3 4.15Å; P557-W623 HydrophobicContact CG-CB 4.19Å; L619-W623 WeakPolarHBondContact O-CB 3.12Å; L619-W623 PolarHBondContact O-N 3.29Å; L620-W623 HydrophobicContact CD1-CE3 3.87Å; L620-W623 HydrophobicContact CD1-CZ3 4.15Å; E621-W623 PolarHBondContact O-N 2.77Å; W623-A625 VanDerWaalsContact C-N 3.26Å; W623-A625 PolarHBondContact O-N 3.13Å; W623-S626 PolarHBondContact O-N 2.8Å; W623-S626 PolarHBondContact O-OG 3.15Å; W623-L627 HydrophobicContact CD2-CD1 4.47Å; W623-L627 HydrophobicContact CE3-CD1 4.39Å; W623-L627 HydrophobicContact CH2-CD1 3.65Å; W623-L627 HydrophobicContact CZ2-CD1 3.73Å; W623-L627 HydrophobicContact CZ2-CD2 4.35Å; W623-L627 HydrophobicContact CZ2-CG 4.31Å; W623-L627 HydrophobicContact CZ3-CD1 4Å; W623-L627 PolarHBondContact O-N 3.45Å; W623-Y635 AromaticContact CH2-CD2 3.64Å; W623-Y635 HydrophobicContact CH2-CD2 3.64Å; W623-Y635 AromaticContact CH2-CE2 3.63Å; W623-Y635 HydrophobicContact CH2-CE2 3.63Å; W623-Y635 HydrophobicContact CH2-CG 4.49Å; W623-Y635 AromaticContact CZ3-CD2 3.78Å; W623-Y635 HydrophobicContact CZ3-CD2 3.78Å; W623-Y635 HydrophobicContact CZ3-CE1 4.49Å; W623-Y635 AromaticContact CZ3-CE2 3.57Å; W623-Y635 HydrophobicContact CZ3-CE2 3.57Å; W623-Y635 HydrophobicContact CZ3-CG 4.36Å; W623-Y635 AromaticContact CZ3-CZ 3.96Å
624	L	83.4	Confident	83.2	Confident	36 Å²	36	79.1 Å²	79.1	19%	0.188	42%	0.415	C	S	.	.	H	α-helix	trans	-61	-33.3	173.5	-75.6	172	0	0	0	112.9	L620 E621 L627 R632 Y635	L620-L624 HydrophobicContact CG-CD1 4.19Å; L620-L624 WeakPolarHBondContact O-CB 3.36Å; L620-L624 VanDerWaalsContact O-CG 3.23Å; L620-L624 WeakPolarHBondContact O-CG 3.38Å; L620-L624 PolarHBondContact O-N 2.81Å; E621-L624 PolarHBondContact O-N 3.45Å; L624-L627 HydrophobicContact CD2-CD1 4.41Å; L624-R632 VanDerWaalsContact O-CZ 3.26Å; L624-R632 PolarHBondContact O-NE 2.92Å; L624-R632 PolarHBondContact O-NH2 2.89Å; L624-R632 VanDerWaalsContact O-NH2 3.12Å; L624-Y635 HydrophobicContact CD2-CD1 3.58Å; L624-Y635 HydrophobicContact CD2-CE1 3.99Å; L624-Y635 HydrophobicContact CD2-CG 3.93Å
625	A	84.8	Confident	82.7	Confident	66 Å²	66	72.9 Å²	72.9	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-68.7	-34.5	173.6	0	0	0	0	0	112.5	E621 Q622 W623 R632	E621-A625 WeakPolarHBondContact O-CB 3.22Å; E621-A625 PolarHBondContact O-N 3.27Å; Q622-A625 WeakPolarHBondContact O-CB 3.36Å; Q622-A625 PolarHBondContact O-N 3.09Å; W623-A625 VanDerWaalsContact C-N 3.26Å; W623-A625 PolarHBondContact O-N 3.13Å; A625-R632 PolarHBondContact O-NH2 3.43Å
626	S	83.2	Confident	82.3	Confident	92 Å²	92	77.3 Å²	77.3	64%	0.643	40%	0.401	S	S	*	.	H	α-helix	trans	-71.7	-24	176.8	75.8	0	0	0	0	114.5	Q622 W623	Q622-S626 PolarHBondContact O-N 3.27Å; W623-S626 PolarHBondContact O-N 2.8Å; W623-S626 PolarHBondContact O-OG 3.15Å
627	L	82.6	Confident	81.8	Confident	22 Å²	22	81.5 Å²	81.5	12%	0.115	42%	0.421	C	S	.	.	S	Bend	trans	-74.5	148.5	176.4	-69.7	-177.9	0	0	0	112.6	W623 L624 E631 R632	W623-L627 HydrophobicContact CD2-CD1 4.47Å; W623-L627 HydrophobicContact CE3-CD1 4.39Å; W623-L627 HydrophobicContact CH2-CD1 3.65Å; W623-L627 HydrophobicContact CZ2-CD1 3.73Å; W623-L627 HydrophobicContact CZ2-CD2 4.35Å; W623-L627 HydrophobicContact CZ2-CG 4.31Å; W623-L627 HydrophobicContact CZ3-CD1 4Å; W623-L627 PolarHBondContact O-N 3.45Å; L624-L627 HydrophobicContact CD2-CD1 4.41Å; L627-E631 HydrophobicContact CB-CB 4.13Å; L627-E631 HydrophobicContact CD1-CB 4.3Å; L627-E631 HydrophobicContact CD2-CB 4.34Å; L627-R632 PolarHBondContact O-NH2 3.27Å
628	S	83	Confident	81.5	Confident	57 Å²	57	78 Å²	78	40%	0.399	41%	0.405	S	S	.	.			trans	-63.2	160.8	173.5	72.5	0	0	0	0	112.3	Q630 E631 R632	S628-Q630 PolarHBondContact O-N 2.86Å; S628-E631 WeakPolarHBondContact CB-OE2 3.09Å; S628-E631 PolarHBondContact N-OE2 2.76Å; S628-E631 PolarHBondContact O-N 2.94Å; S628-E631 VanDerWaalsContact OG-CD 3.32Å; S628-E631 WeakPolarHBondContact OG-CG 3.25Å; S628-E631 PolarHBondContact OG-N 2.94Å; S628-E631 PolarHBondContact OG-OE2 3.21Å; S628-R632 WeakPolarHBondContact O-CB 3.39Å; S628-R632 PolarHBondContact O-N 3.21Å
629	S	76.5	Confident	80.3	Confident	89 Å²	89	77.1 Å²	77.1	62%	0.622	40%	0.398	S	S	*	.	H	α-helix	trans	-57.5	-34.7	178.6	-168.9	0	0	0	0	112.7	N633	S629-N633 WeakPolarHBondContact O-CB 3.38Å; S629-N633 VanDerWaalsContact O-CG 3.26Å; S629-N633 PolarHBondContact O-N 2.92Å; S629-N633 VanDerWaalsContact O-N 3.16Å; S629-N633 PolarHBondContact O-ND2 3.13Å
630	Q	73.4	Confident	79.4	Confident	160 Å²	160	76.1 Å²	76.1	75%	0.748	40%	0.399	S	S	*	.	H	α-helix	trans	-69.5	-46.7	177.9	-171.1	170	-10.4	0	0	111.5	S628 N633 T634	S628-Q630 PolarHBondContact O-N 2.86Å; Q630-N633 PolarHBondContact O-N 3.22Å; Q630-T634 PolarHBondContact O-N 3.3Å
631	E	77.4	Confident	78.4	Confident	90 Å²	90	80 Å²	80	42%	0.421	42%	0.416	S	S	.	.	H	α-helix	trans	-67.8	-37.5	177.9	-65.8	162.4	120.9	0	0	112.5	L627 S628 N633 T634 Y635	L627-E631 HydrophobicContact CB-CB 4.13Å; L627-E631 HydrophobicContact CD1-CB 4.3Å; L627-E631 HydrophobicContact CD2-CB 4.34Å; S628-E631 WeakPolarHBondContact CB-OE2 3.09Å; S628-E631 PolarHBondContact N-OE2 2.76Å; S628-E631 PolarHBondContact O-N 2.94Å; S628-E631 VanDerWaalsContact OG-CD 3.32Å; S628-E631 WeakPolarHBondContact OG-CG 3.25Å; S628-E631 PolarHBondContact OG-N 2.94Å; S628-E631 PolarHBondContact OG-OE2 3.21Å; E631-N633 VanDerWaalsContact C-N 3.25Å; E631-N633 PolarHBondContact O-N 3.44Å; E631-T634 PolarHBondContact O-N 3.06Å; E631-T634 PolarHBondContact O-OG1 3.36Å; E631-T634 VanDerWaalsContact O-OG1 3.1Å; E631-Y635 WeakPolarHBondContact O-CB 3.41Å; E631-Y635 PolarHBondContact O-N 3.32Å
632	R	78.3	Confident	77	Confident	85 Å²	85	80.5 Å²	80.5	32%	0.321	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-36	174.7	-166.4	179.7	-59.4	167.1	10	111.5	L624 A625 L627 S628 R636	L624-R632 VanDerWaalsContact O-CZ 3.26Å; L624-R632 PolarHBondContact O-NE 2.92Å; L624-R632 PolarHBondContact O-NH2 2.89Å; L624-R632 VanDerWaalsContact O-NH2 3.12Å; A625-R632 PolarHBondContact O-NH2 3.43Å; L627-R632 PolarHBondContact O-NH2 3.27Å; S628-R632 WeakPolarHBondContact O-CB 3.39Å; S628-R632 PolarHBondContact O-N 3.21Å; R632-R636 WeakPolarHBondContact O-CG 3.26Å; R632-R636 PolarHBondContact O-N 2.86Å
633	N	76.1	Confident	75.1	Confident	96 Å²	96	86.1 Å²	86.1	51%	0.513	43%	0.433	S	S	.	.	H	α-helix	trans	-73	-43.5	175	-74	-20.6	0	0	0	112.3	S629 Q630 E631 Y635 R636 E637	S629-N633 WeakPolarHBondContact O-CB 3.38Å; S629-N633 VanDerWaalsContact O-CG 3.26Å; S629-N633 PolarHBondContact O-N 2.92Å; S629-N633 VanDerWaalsContact O-N 3.16Å; S629-N633 PolarHBondContact O-ND2 3.13Å; Q630-N633 PolarHBondContact O-N 3.22Å; E631-N633 VanDerWaalsContact C-N 3.25Å; E631-N633 PolarHBondContact O-N 3.44Å; N633-Y635 VanDerWaalsContact C-N 3.3Å; N633-Y635 PolarHBondContact O-N 2.55Å; N633-R636 PolarHBondContact O-N 2.87Å; N633-E637 PolarHBondContact O-N 3.22Å
634	T	78.6	Confident	72.9	Confident	63 Å²	63	93.9 Å²	93.9	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-65.9	-31.9	175.6	64.5	0	0	0	0	112.5	Q630 E631 Y638	Q630-T634 PolarHBondContact O-N 3.3Å; E631-T634 PolarHBondContact O-N 3.06Å; E631-T634 PolarHBondContact O-OG1 3.36Å; E631-T634 VanDerWaalsContact O-OG1 3.1Å; T634-Y638 VanDerWaalsContact O-CB 3.24Å; T634-Y638 WeakPolarHBondContact O-CB 3.49Å; T634-Y638 PolarHBondContact O-N 3.26Å
635	Y	78.8	Confident	70.5	Confident	13 Å²	13	95.7 Å²	95.7	5%	0.051	48%	0.483	C	S	.	.	H	α-helix	trans	-63.3	-46.5	171.5	-170.9	-90.9	0	0	0	112.5	F553 E556 W623 L624 E631 N633 N639	F553-Y635 AromaticContact CD1-CD2 3.95Å; F553-Y635 HydrophobicContact CD1-CD2 3.95Å; F553-Y635 AromaticContact CD2-CD2 3.44Å; F553-Y635 HydrophobicContact CD2-CD2 3.44Å; F553-Y635 VanDerWaalsContact CD2-CD2 3.44Å; F553-Y635 AromaticContact CD2-CE2 3.63Å; F553-Y635 HydrophobicContact CD2-CE2 3.63Å; F553-Y635 AromaticContact CE1-CD2 3.91Å; F553-Y635 HydrophobicContact CE1-CD2 3.91Å; F553-Y635 HydrophobicContact CE1-CG 4.49Å; F553-Y635 AromaticContact CE2-CD2 3.41Å; F553-Y635 HydrophobicContact CE2-CD2 3.41Å; F553-Y635 VanDerWaalsContact CE2-CD2 3.41Å; F553-Y635 AromaticContact CE2-CE2 3.8Å; F553-Y635 HydrophobicContact CE2-CE2 3.8Å; F553-Y635 HydrophobicContact CE2-CG 4.42Å; F553-Y635 AromaticContact CG-CD2 3.73Å; F553-Y635 HydrophobicContact CG-CD2 3.73Å; F553-Y635 HydrophobicContact CG-CE2 4.21Å; F553-Y635 AromaticContact CZ-CD2 3.65Å; F553-Y635 HydrophobicContact CZ-CD2 3.65Å; F553-Y635 HydrophobicContact CZ-CE2 4.47Å; F553-Y635 HydrophobicContact CZ-CG 4.31Å; E556-Y635 HydrophobicContact CG-CE2 4.48Å; E556-Y635 WeakPolarHBondContact OE1-CE2 3.22Å; E556-Y635 PolarHBondContact OE1-OH 2.65Å; W623-Y635 AromaticContact CH2-CD2 3.64Å; W623-Y635 HydrophobicContact CH2-CD2 3.64Å; W623-Y635 AromaticContact CH2-CE2 3.63Å; W623-Y635 HydrophobicContact CH2-CE2 3.63Å; W623-Y635 HydrophobicContact CH2-CG 4.49Å; W623-Y635 AromaticContact CZ3-CD2 3.78Å; W623-Y635 HydrophobicContact CZ3-CD2 3.78Å; W623-Y635 HydrophobicContact CZ3-CE1 4.49Å; W623-Y635 AromaticContact CZ3-CE2 3.57Å; W623-Y635 HydrophobicContact CZ3-CE2 3.57Å; W623-Y635 HydrophobicContact CZ3-CG 4.36Å; W623-Y635 AromaticContact CZ3-CZ 3.96Å; L624-Y635 HydrophobicContact CD2-CD1 3.58Å; L624-Y635 HydrophobicContact CD2-CE1 3.99Å; L624-Y635 HydrophobicContact CD2-CG 3.93Å; E631-Y635 WeakPolarHBondContact O-CB 3.41Å; E631-Y635 PolarHBondContact O-N 3.32Å; N633-Y635 VanDerWaalsContact C-N 3.3Å; N633-Y635 PolarHBondContact O-N 2.55Å; Y635-N639 WeakPolarHBondContact CE1-ND2 3.47Å; Y635-N639 PolarHBondContact O-N 3.06Å; Y635-N639 VanDerWaalsContact O-N 3.14Å; Y635-N639 PolarHBondContact OH-ND2 3.43Å
636	R	76.1	Confident	68.1	Low	165 Å²	165	98.5 Å²	98.5	62%	0.623	50%	0.495	S	S	*	.	H	α-helix	trans	-61	-47.9	176.4	-76.1	175.9	175	-147.1	-2.8	110.7	R632 N633 N639 S640	R632-R636 WeakPolarHBondContact O-CG 3.26Å; R632-R636 PolarHBondContact O-N 2.86Å; N633-R636 PolarHBondContact O-N 2.87Å; R636-N639 PolarHBondContact O-N 3.29Å; R636-S640 PolarHBondContact O-N 2.88Å; R636-S640 PolarHBondContact O-OG 3.48Å; R636-S640 VanDerWaalsContact O-OG 3.05Å
637	E	77.9	Confident	65.6	Low	114 Å²	114	98.7 Å²	98.7	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-63.6	-45.5	179.3	-160.7	-169.5	158	0	0	112.3	N633 N639 S640 Q641	N633-E637 PolarHBondContact O-N 3.22Å; E637-N639 VanDerWaalsContact C-N 3.35Å; E637-N639 PolarHBondContact O-N 2.75Å; E637-S640 CarbonylContact O-C 3.53Å; E637-S640 WeakPolarHBondContact O-CA 3.32Å; E637-S640 WeakPolarHBondContact O-CB 3.18Å; E637-S640 PolarHBondContact O-N 3.36Å; E637-Q641 HydrophobicContact CG-CG 4.41Å; E637-Q641 WeakPolarHBondContact O-CG 3.35Å; E637-Q641 PolarHBondContact O-N 3.14Å; E637-Q641 PolarHBondContact OE1-NE2 3.14Å
638	Y	77.3	Confident	63	Low	51 Å²	51	107.2 Å²	107.2	20%	0.2	54%	0.538	C	S	.	.	H	α-helix	trans	-57.4	-45.1	178.3	176.5	-105	0	0	0	112.3	M551 F553 T634 Q641 K642	M551-Y638 HydrophobicContact CB-CD1 4.22Å; M551-Y638 HydrophobicContact CB-CD2 4.07Å; M551-Y638 HydrophobicContact CB-CE1 3.81Å; M551-Y638 HydrophobicContact CB-CE2 3.66Å; M551-Y638 HydrophobicContact CB-CG 4.34Å; M551-Y638 HydrophobicContact CE-CD2 3.77Å; M551-Y638 HydrophobicContact CE-CE2 4.5Å; M551-Y638 HydrophobicContact CE-CG 3.86Å; M551-Y638 PolarHBondContact N-OH 2.81Å; M551-Y638 HydrophobicContact SD-CD2 4.34Å; F553-Y638 AromaticContact CE2-CD1 3.78Å; F553-Y638 HydrophobicContact CE2-CD1 3.78Å; F553-Y638 HydrophobicContact CE2-CE1 4.32Å; F553-Y638 HydrophobicContact CE2-CG 4.32Å; F553-Y638 HydrophobicContact CZ-CD1 4.15Å; F553-Y638 HydrophobicContact CZ-CG 4.25Å; T634-Y638 VanDerWaalsContact O-CB 3.24Å; T634-Y638 WeakPolarHBondContact O-CB 3.49Å; T634-Y638 PolarHBondContact O-N 3.26Å; Y638-Q641 PolarHBondContact O-N 3.05Å; Y638-K642 HydrophobicContact CE1-CD 4.49Å; Y638-K642 WeakPolarHBondContact O-CB 3.44Å; Y638-K642 PolarHBondContact O-N 3.35Å
639	N	66.5	Low	60.6	Low	56 Å²	56	110.8 Å²	110.8	30%	0.299	56%	0.56	S	S	.	*	H	α-helix	trans	-68.4	-32.7	175.4	-87.4	-49.3	0	0	0	112.8	Y635 R636 E637 K642 R643	Y635-N639 WeakPolarHBondContact CE1-ND2 3.47Å; Y635-N639 PolarHBondContact O-N 3.06Å; Y635-N639 VanDerWaalsContact O-N 3.14Å; Y635-N639 PolarHBondContact OH-ND2 3.43Å; R636-N639 PolarHBondContact O-N 3.29Å; E637-N639 VanDerWaalsContact C-N 3.35Å; E637-N639 PolarHBondContact O-N 2.75Å; N639-K642 PolarHBondContact O-N 2.7Å; N639-R643 PolarHBondContact O-N 3.38Å
640	S	68.2	Low	58.3	Low	72 Å²	72	110.6 Å²	110.6	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-67	-43.5	172.9	-63.5	0	0	0	0	112.8	R636 E637 K642 R643 R644	R636-S640 PolarHBondContact O-N 2.88Å; R636-S640 PolarHBondContact O-OG 3.48Å; R636-S640 VanDerWaalsContact O-OG 3.05Å; E637-S640 CarbonylContact O-C 3.53Å; E637-S640 WeakPolarHBondContact O-CA 3.32Å; E637-S640 WeakPolarHBondContact O-CB 3.18Å; E637-S640 PolarHBondContact O-N 3.36Å; S640-K642 VanDerWaalsContact C-N 3.28Å; S640-K642 PolarHBondContact O-N 3.33Å; S640-R643 PolarHBondContact O-N 3.42Å; S640-R644 PolarHBondContact O-N 2.88Å
641	Q	62.8	Low	56.1	Low	110 Å²	110	106.9 Å²	106.9	51%	0.514	58%	0.577	S	S	.	*	H	α-helix	trans	-61.3	-38.7	174.1	-68.2	179	12.7	0	0	111	E637 Y638 R643 R644	E637-Q641 HydrophobicContact CG-CG 4.41Å; E637-Q641 WeakPolarHBondContact O-CG 3.35Å; E637-Q641 PolarHBondContact O-N 3.14Å; E637-Q641 PolarHBondContact OE1-NE2 3.14Å; Y638-Q641 PolarHBondContact O-N 3.05Å; Q641-R643 VanDerWaalsContact C-N 3.32Å; Q641-R643 PolarHBondContact O-N 3Å; Q641-R644 WeakPolarHBondContact O-CA 3.41Å; Q641-R644 WeakPolarHBondContact O-CB 3.45Å; Q641-R644 PolarHBondContact O-N 3.14Å
642	K	56.7	Low	53.8	Low	112 Å²	112	107.6 Å²	107.6	49%	0.487	60%	0.598	S	S	.	*	H	α-helix	trans	-65	-29.7	178	-163	173.1	-171.5	169	0	114.1	Y638 N639 S640 R644	Y638-K642 HydrophobicContact CE1-CD 4.49Å; Y638-K642 WeakPolarHBondContact O-CB 3.44Å; Y638-K642 PolarHBondContact O-N 3.35Å; N639-K642 PolarHBondContact O-N 2.7Å; S640-K642 VanDerWaalsContact C-N 3.28Å; S640-K642 PolarHBondContact O-N 3.33Å; K642-R644 VanDerWaalsContact C-N 3.29Å
643	R	48	Very low	51.6	Low	236 Å²	236	113.8 Å²	113.8	89%	0.891	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-11.5	170.3	-72.6	-172.9	176	-166.6	-0.6	113.6	N639 S640 Q641	N639-R643 PolarHBondContact O-N 3.38Å; S640-R643 PolarHBondContact O-N 3.42Å; Q641-R643 VanDerWaalsContact C-N 3.32Å; Q641-R643 PolarHBondContact O-N 3Å
644	R	42.4	Very low	49.3	Very low	186 Å²	186	114.1 Å²	114.1	70%	0.702	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	7.4	-177.8	-74	-179.2	156.8	-148.4	-13.2	114.6	S640 Q641 K642	S640-R644 PolarHBondContact O-N 2.88Å; Q641-R644 WeakPolarHBondContact O-CA 3.41Å; Q641-R644 WeakPolarHBondContact O-CB 3.45Å; Q641-R644 PolarHBondContact O-N 3.14Å; K642-R644 VanDerWaalsContact C-N 3.29Å
645	A	32.1	Very low	46.8	Very low	75 Å²	75	120.1 Å²	120.1	62%	0.62	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-68	124.1	174.1	0	0	0	0	0	110.6	A647	A645-A647 PolarHBondContact O-N 3.27Å
646	P	33.5	Very low	44.4	Very low	125 Å²	125	126.3 Å²	126.3	81%	0.812	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-70.3	132.1	-175.3	27.3	-34.4	0	0	0	111.9
647	A	31.4	Very low	41.9	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-64.4	140.6	172.6	0	0	0	0	0	111.1	A645	A645-A647 PolarHBondContact O-N 3.27Å
648	K	27.4	Very low	39.3	Very low	202 Å²	202	129.8 Å²	129.8	88%	0.878	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-75.1	129.4	172.7	-77.3	-177.4	175.4	178.2	0	110.1
649	P	33.7	Very low	36.7	Very low	132 Å²	132	132.8 Å²	132.8	86%	0.857	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-75.2	128.2	170.2	30.4	-32.7	0	0	0	110.4
650	G	28.7	Very low	34.7	Very low	85 Å²	85	135.7 Å²	135.7	88%	0.876	76%	0.758	S	S	*	*			trans	141.5	83.6	171.7	0	0	0	0	0	115.2
651	G	26.4	Very low	32.6	Very low	81 Å²	81	138.9 Å²	138.9	84%	0.835	78%	0.775	S	S	*	*			trans	-152.1	141.1	167	0	0	0	0	0	108.8
652	A	29.5	Very low	30.8	Very low	105 Å²	105	142 Å²	142	87%	0.868	79%	0.789	S	S	*	*			trans	-88.8	163.5	-169.6	0	0	0	0	0	113.6
653	K	32.2	Very low	29.2	Very low	216 Å²	216	145 Å²	145	94%	0.939	81%	0.805	S	S	*	*			trans	-59.7	142.3	178.6	-63	-175.1	177.7	-174	0	112.1
654	A	26.5	Very low	28.6	Very low	102 Å²	102	141.9 Å²	141.9	84%	0.843	80%	0.8	S	S	*	*			trans	-123.9	151	154.5	0	0	0	0	0	108.3
655	K	27.6	Very low	27.7	Very low	189 Å²	189	142.3 Å²	142.3	82%	0.822	81%	0.81	S	S	*	*			trans	-103.7	140.5	-175.4	-99.6	-172.7	167.1	-167.8	0	111.3
656	I	27.8	Very low	27.5	Very low	143 Å²	143	146.2 Å²	146.2	73%	0.733	82%	0.821	S	S	*	*			trans	55.4	114.6	139.9	-55.6	169.2	0	0	0	117.4
657	K	22.8	Very low	27.3	Very low	197 Å²	197	146.6 Å²	146.6	86%	0.857	82%	0.816	S	S	*	*				-162.2	147.6	93.3	-149.3	179.1	-179.1	-174	0	111
658	K	24.4	Very low	27.2	Very low	156 Å²	156	150.2 Å²	150.2	68%	0.678	82%	0.822	S	S	*	*			trans	-76.8	150.6	164.9	-106.9	-173.7	162.3	-118.6	0	110.1	D660	K658-D660 IonicContact NZ-OD1 3.65Å; K658-D660 PolarHBondContact NZ-OD1 3.15Å; K658-D660 IonicContact NZ-OD2 2.8Å; K658-D660 PolarHBondContact NZ-OD2 3.27Å
659	S	23.1	Very low	27.2	Very low	114 Å²	114	148.3 Å²	148.3	80%	0.797	82%	0.822	S	S	*	*			trans	-156.3	106.9	153.5	54	0	0	0	0	106.1
660	D	24.2	Very low	26.9	Very low	117 Å²	117	149.7 Å²	149.7	63%	0.626	82%	0.822	S	S	*	*			trans	-82.3	132.8	-177.1	-58.2	-74.2	0	0	0	110	K658	K658-D660 IonicContact NZ-OD1 3.65Å; K658-D660 PolarHBondContact NZ-OD1 3.15Å; K658-D660 IonicContact NZ-OD2 2.8Å; K658-D660 PolarHBondContact NZ-OD2 3.27Å
661	T	23.1	Very low	26.9	Very low	138 Å²	138	153 Å²	153	85%	0.847	81%	0.814	S	S	*	*			trans	-164.7	110.1	156.4	-11.4	0	0	0	0	107.9
662	E	24.7	Very low	26.9	Very low	176 Å²	176	156 Å²	156	82%	0.822	81%	0.807	S	S	*	*			trans	-70.4	161.8	148.6	-67.6	162.8	165.3	0	0	106
663	E	24.9	Very low	26.8	Very low	175 Å²	175	159.3 Å²	159.3	82%	0.818	80%	0.804	S	S	*	*			cis	-148.3	148.4	49.2	-85.6	162.7	-176.1	0	0	108.5
664	E	34.7	Very low	26.5	Very low	170 Å²	170	158.6 Å²	158.6	79%	0.794	80%	0.801	S	S	*	*				56.7	107.9	80.9	-59.8	-64.1	162.3	0	0	114.3
665	E	24.3	Very low	26.5	Very low	195 Å²	195	158.1 Å²	158.1	91%	0.911	80%	0.797	S	S	*	*			trans	-149.2	101.6	160.8	-83.2	-171.8	162.1	0	0	107.4
666	D	26.3	Very low	26.3	Very low	157 Å²	157	154.6 Å²	154.6	84%	0.84	80%	0.796	S	S	*	*			trans	-88.9	162.1	156.5	-124.3	-20.1	0	0	0	108.2
667	D	30.1	Very low	26.2	Very low	134 Å²	134	153 Å²	153	72%	0.717	80%	0.798	S	S	*	*			trans	-71.1	137.4	-177.2	-66	-64.2	0	0	0	112.4
668	D	28.1	Very low	26.3	Very low	171 Å²	171	152.2 Å²	152.2	91%	0.914	80%	0.797	S	S	*	*				-172.5	157.6	122.2	-103.1	-27.5	0	0	0	114
669	D	28.7	Very low	26.3	Very low	161 Å²	161	148.9 Å²	148.9	86%	0.861	80%	0.799	S	S	*	*			trans	-83.7	146.6	173.4	-85.2	-53.2	0	0	0	111.8
670	D	27.5	Very low	26.3	Very low	161 Å²	161	150.1 Å²	150.1	86%	0.861	80%	0.796	S	S	*	*				-165.6	172.8	119.6	-133	-35.6	0	0	0	113.3
671	E	28.5	Very low	26.3	Very low	154 Å²	154	149.5 Å²	149.5	72%	0.72	80%	0.802	S	S	*	*			trans	-91.1	154.2	-166.1	-60.5	-161.2	95.1	0	0	118.5
672	Q	26.5	Very low	26.4	Very low	146 Å²	146	148 Å²	148	68%	0.682	80%	0.796	S	S	*	*			trans	89.1	158	133.2	-100	167.7	72.6	0	0	123.8
673	E	27.7	Very low	26.5	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	79%	0.787	S	S	*	*			trans	70.4	150.1	171.9	-66.5	-58.1	96.2	0	0	121.4
674	K	25.6	Very low	26.5	Very low	202 Å²	202	143.8 Å²	143.8	88%	0.878	79%	0.787	S	S	*	*			trans	-129.5	137.1	-172	-74.6	-170	176.8	-169.7	0	113.1
675	A	25.8	Very low	26.1	Very low	92 Å²	92	144.2 Å²	144.2	76%	0.76	79%	0.789	S	S	*	*			trans	-176.5	128.4	131.8	0	0	0	0	0	108.3
676	S	24	Very low	26.2	Very low	114 Å²	114	141.8 Å²	141.8	80%	0.797	78%	0.782	S	S	*	*			cis	90.2	68.2	33.5	83.3	0	0	0	0	116.5
677	S	25.9	Very low	26.1	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	78%	0.78	S	S	*	*			trans	-170.8	111.7	149.4	52.3	0	0	0	0	108.3
678	E	24.1	Very low	26	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	78%	0.783	S	S	*	*				89.1	120.4	66	-78.9	-68.5	168.6	0	0	113.7
679	A	25.6	Very low	26	Very low	86 Å²	86	141.9 Å²	141.9	71%	0.711	78%	0.777	S	S	*	*			trans	62.2	155.3	163.2	0	0	0	0	0	118.3
680	D	22	Very low	26	Very low	139 Å²	139	142.8 Å²	142.8	74%	0.743	78%	0.776	S	S	*	*			cis	-160.1	166.9	-9.4	-144.9	-54	0	0	0	109.8
681	S	25.3	Very low	26.1	Very low	105 Å²	105	142 Å²	142	73%	0.734	77%	0.772	S	S	*	*			trans	49.5	159.5	144.2	-74.7	0	0	0	0	122.3
682	S	24.9	Very low	26	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	78%	0.776	S	S	*	*			cis	-174.4	-178.8	-19.6	-174.2	0	0	0	0	107.5
683	S	25.5	Very low	26.1	Very low	89 Å²	89	141.7 Å²	141.7	62%	0.622	78%	0.78	S	S	*	*			trans	77.1	135.1	172.6	-111.8	0	0	0	0	114.7
684	E	25.1	Very low	26.1	Very low	175 Å²	175	139.8 Å²	139.8	82%	0.818	78%	0.775	S	S	*	*			cis	65.1	133.4	31.9	-48.1	179.2	157.4	0	0	110.7
685	E	27	Very low	26.2	Very low	179 Å²	179	136 Å²	136	84%	0.836	76%	0.764	S	S	*	*			cis	-129.3	159	31	-65.3	151	-164.5	0	0	109.7
686	D	25.3	Very low	26.3	Very low	144 Å²	144	137.2 Å²	137.2	77%	0.77	76%	0.758	S	S	*	*			cis	91.4	172.3	39.7	-131.8	-9.7	0	0	0	114.3
687	D	25.4	Very low	26.6	Very low	149 Å²	149	140 Å²	140	80%	0.797	76%	0.759	S	S	*	*			trans	79.8	117.3	-160.1	-61.4	-20.6	0	0	0	112.8
688	E	28	Very low	26.9	Very low	169 Å²	169	143.1 Å²	143.1	79%	0.79	77%	0.767	S	S	*	*			cis	72.7	129.4	41.4	-56.1	-164.9	162.6	0	0	113.7
689	D	28	Very low	27.3	Very low	145 Å²	145	142.3 Å²	142.3	78%	0.775	77%	0.768	S	S	*	*			cis	-132.8	-131.9	-10.4	-154.2	16.3	0	0	0	110.9
690	E	29.3	Very low	27.5	Very low	180 Å²	180	145.6 Å²	145.6	84%	0.841	77%	0.774	S	S	*	*			cis	-150.5	164.9	7.1	-165.9	176.3	-159.3	0	0	108.4
691	D	28.5	Very low	27.9	Very low	146 Å²	146	145.7 Å²	145.7	78%	0.781	77%	0.774	S	S	*	*			trans	-65.7	171.5	-178.8	-78.1	-47.1	0	0	0	114.2
692	D	26.9	Very low	28.3	Very low	151 Å²	151	149.4 Å²	149.4	81%	0.807	78%	0.78	S	S	*	*				-166	170.8	57.8	-160.1	3.4	0	0	0	113.8
693	D	28	Very low	28.6	Very low	141 Å²	141	152.6 Å²	152.6	75%	0.754	79%	0.789	S	S	*	*			trans	-62.8	171.9	178.4	-87.5	-41.1	0	0	0	112.5
694	D	28	Very low	28.9	Very low	134 Å²	134	155.5 Å²	155.5	72%	0.717	80%	0.797	S	S	*	*			cis	-169	177.6	43.8	-152.6	-5	0	0	0	113.5
695	N	26.8	Very low	29.2	Very low	122 Å²	122	153.3 Å²	153.3	65%	0.652	79%	0.791	S	S	*	*			trans	-7.8	162	150.2	-101.5	3.5	0	0	0	122
696	D	29	Very low	29.4	Very low	117 Å²	117	151.7 Å²	151.7	63%	0.626	79%	0.789	S	S	*	*			cis	-159.7	-173.5	3.1	-144.5	-30.8	0	0	0	111.9
697	E	30.3	Very low	29.7	Very low	174 Å²	174	150.7 Å²	150.7	81%	0.813	78%	0.783	S	S	*	*			trans	76.7	130.4	146.1	-77.8	174.2	164.6	0	0	121.3
698	D	32.3	Very low	30	Very low	173 Å²	173	150.8 Å²	150.8	93%	0.925	78%	0.784	S	S	*	*			trans	-79.6	148.2	166.9	-67.7	-72.1	0	0	0	110.2
699	D	31.3	Very low	30.2	Very low	166 Å²	166	148.6 Å²	148.6	89%	0.888	78%	0.777	S	S	*	*			trans	-130.7	147.6	169.6	-157.1	-0.9	0	0	0	111.4
700	D	31.4	Very low	30.4	Very low	154 Å²	154	150.4 Å²	150.4	82%	0.824	78%	0.781	S	S	*	*			trans	-91.8	127.3	-166.9	-95.8	-48.9	0	0	0	112.6	E702	D700-E702 PolarHBondContact O-N 3.22Å
701	D	30.4	Very low	30.6	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	77%	0.773	S	S	*	*			trans	-64.4	88.9	175.2	-97.6	-34.4	0	0	0	110.6	R72	R72-D701 IonicContact NH2-OD2 2.83Å; R72-D701 PolarHBondContact NH2-OD2 3.22Å; R72-D701 VanDerWaalsContact NH2-OD2 3.1Å
702	E	33.7	Very low	30.8	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	76%	0.761	S	S	*	*			trans	-79.8	141.9	165.3	-70.4	-148.1	136.5	0	0	112.3	D700 D704	D700-E702 PolarHBondContact O-N 3.22Å; E702-D704 PolarHBondContact O-N 3.21Å
703	D	30.5	Very low	31	Very low	173 Å²	173	142.3 Å²	142.3	93%	0.925	75%	0.747	S	S	*	*			trans	-83.2	89.3	-176.1	-89.6	-48.7	0	0	0	112.4	D705	D703-D705 PolarHBondContact O-N 3.09Å
704	D	30.9	Very low	31.5	Very low	149 Å²	149	144.2 Å²	144.2	80%	0.797	75%	0.749	S	S	*	*			trans	-78.2	111.5	168.8	-91.4	-35.8	0	0	0	113	E702	E702-D704 PolarHBondContact O-N 3.21Å
705	D	32.3	Very low	31.6	Very low	129 Å²	129	146.5 Å²	146.5	69%	0.69	76%	0.756	S	S	*	*			trans	-99.1	92	168.1	-104.9	-27.8	0	0	0	109.6	K185 D703	K185-D705 IonicContact NZ-OD1 3.24Å; K185-D705 PolarHBondContact NZ-OD1 2.9Å; D703-D705 PolarHBondContact O-N 3.09Å
706	D	32	Very low	31.9	Very low	146 Å²	146	148.3 Å²	148.3	78%	0.781	77%	0.765	S	S	*	*			trans	54	100.3	166.5	-75.1	-48.3	0	0	0	118.8
707	D	31.1	Very low	31.9	Very low	123 Å²	123	150.7 Å²	150.7	66%	0.658	77%	0.77	S	S	*	*			trans	-67.2	148	157.4	-88.6	-49	0	0	0	113.2
708	D	32	Very low	32.1	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	76%	0.759	S	S	*	*			trans	-127.2	75.6	167.5	-148.4	17.9	0	0	0	107.1	E710	D708-E710 PolarHBondContact O-N 3.1Å
709	D	31.4	Very low	32	Very low	123 Å²	123	143.6 Å²	143.6	66%	0.658	74%	0.744	S	S	*	*			trans	-62.1	99.2	-174.5	-86.9	-49.7	0	0	0	113.1
710	E	32.3	Very low	31.9	Very low	183 Å²	183	142.8 Å²	142.8	86%	0.855	74%	0.74	S	S	*	*			trans	-100.9	106.6	148.2	-72	-154.4	145.1	0	0	109.4	D708	D708-E710 PolarHBondContact O-N 3.1Å
711	V	33.9	Very low	31.8	Very low	112 Å²	112	143.4 Å²	143.4	68%	0.679	74%	0.743	S	S	*	*			trans	-86.5	172.2	175	-66.9	0	0	0	0	112.1
712	D	32.9	Very low	31.7	Very low	96 Å²	96	143.1 Å²	143.1	51%	0.513	74%	0.741	S	S	.	*			trans	70.7	143.4	-176.7	-68.1	-33.4	0	0	0	115.3
713	D	30.3	Very low	31.5	Very low	99 Å²	99	138.7 Å²	138.7	53%	0.529	73%	0.731	S	S	.	*			cis	-148	154.4	4	-144.1	-23.6	0	0	0	111.6	K136	K136-D713 WeakPolarHBondContact CD-OD2 3.35Å; K136-D713 WeakPolarHBondContact CE-OD2 3.14Å; K136-D713 IonicContact NZ-OD1 3.22Å; K136-D713 PolarHBondContact NZ-OD1 2.86Å; K136-D713 IonicContact NZ-OD2 3.84Å; K136-D713 PolarHBondContact NZ-OD2 2.67Å
714	K	37.9	Very low	31.4	Very low	181 Å²	181	135 Å²	135	79%	0.787	72%	0.719	S	S	*	*			trans	-102.3	129	161.7	-83	-178.7	177.9	174.3	0	107.9
715	E	30.4	Very low	31.3	Very low	183 Å²	183	132.8 Å²	132.8	86%	0.855	72%	0.715	S	S	*	*			trans	-168.8	153.3	136.5	-112.2	154.9	-158	0	0	113.9
716	N	32.6	Very low	31.1	Very low	159 Å²	159	133.6 Å²	133.6	85%	0.85	72%	0.719	S	S	*	*			trans	-95.1	143.8	177	-86.9	-10.4	0	0	0	111.1
717	K	30.5	Very low	31	Very low	167 Å²	167	130.7 Å²	130.7	73%	0.726	71%	0.71	S	S	*	*			trans	-162	105.1	140.5	-138.8	160.2	168.1	31.8	0	108.2	D719	K717-D719 IonicContact NZ-OD1 2.59Å; K717-D719 PolarHBondContact NZ-OD1 3.22Å; K717-D719 IonicContact NZ-OD2 3.92Å
718	S	33.2	Very low	30.8	Very low	85 Å²	85	131.5 Å²	131.5	59%	0.594	72%	0.715	S	S	*	*				81.8	167.9	53.6	85.1	0	0	0	0	113.4
719	D	29.8	Very low	30.6	Very low	114 Å²	114	129.3 Å²	129.3	61%	0.61	71%	0.711	S	S	*	*			trans	79.8	130.7	177.9	-33.4	-6.6	0	0	0	113.5	K717	K717-D719 IonicContact NZ-OD1 2.59Å; K717-D719 PolarHBondContact NZ-OD1 3.22Å; K717-D719 IonicContact NZ-OD2 3.92Å
720	D	30.8	Very low	30.6	Very low	148 Å²	148	127.5 Å²	127.5	79%	0.791	71%	0.713	S	S	*	*			cis	-170.1	153.2	-32.9	-105.5	-41.7	0	0	0	108
721	D	28.7	Very low	30.5	Very low	168 Å²	168	127 Å²	127	90%	0.898	71%	0.711	S	S	*	*			trans	-173	163.7	137.2	-127.4	-45.7	0	0	0	113.4
722	D	28.8	Very low	30.5	Very low	134 Å²	134	126.6 Å²	126.6	72%	0.717	71%	0.713	S	S	*	*			trans	-103.5	164.7	-153.5	-157.2	-81.7	0	0	0	116.5
723	S	28.2	Very low	30.7	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	73%	0.731	S	S	*	*			trans	108.7	113.8	137.2	-103.9	0	0	0	0	123.7
724	S	29.1	Very low	31	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	75%	0.749	S	S	*	*				74.9	91.7	118.6	-59.1	0	0	0	0	121.3
725	S	29.4	Very low	31.1	Very low	102 Å²	102	128.9 Å²	128.9	71%	0.713	75%	0.746	S	S	*	*				61.9	114.6	115.1	73.1	0	0	0	0	121.9
726	D	27.2	Very low	31.7	Very low	146 Å²	146	126.7 Å²	126.7	78%	0.781	74%	0.74	S	S	*	*				86.7	139.6	124.8	-114.8	-62.4	0	0	0	124.3
727	S	29.4	Very low	32.3	Very low	84 Å²	84	124.3 Å²	124.3	59%	0.587	74%	0.736	S	S	*	*			trans	69.1	109.9	143.9	-79.5	0	0	0	0	123.4
728	N	26.8	Very low	32.9	Very low	141 Å²	141	127.3 Å²	127.3	75%	0.754	76%	0.76	S	S	*	*				92.1	126.1	123.9	-72.3	-36.3	0	0	0	123.1
729	S	29.8	Very low	32.9	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	77%	0.768	S	S	*	*			trans	76.8	130.8	135.5	-63.5	0	0	0	0	121.7
730	A	29.8	Very low	33.1	Very low	85 Å²	85	130.2 Å²	130.2	70%	0.702	78%	0.776	S	S	*	*			trans	68.8	154.8	141.2	0	0	0	0	0	118.4
731	E	31.6	Very low	33.2	Very low	171 Å²	171	129.2 Å²	129.2	80%	0.799	78%	0.775	S	S	*	*			cis	-158.9	162.8	-23.1	52.7	-168	99.1	0	0	110.5
732	S	32.8	Very low	33.5	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	77%	0.768	S	S	*	*			trans	21.1	116.7	155.6	-51.1	0	0	0	0	120.7
733	S	36.5	Very low	33.7	Very low	129 Å²	129	126.5 Å²	126.5	90%	0.902	77%	0.771	S	S	*	*			trans	-151.6	120.6	139.5	-52.8	0	0	0	0	110.8
734	E	38.4	Very low	34.1	Very low	193 Å²	193	128.9 Å²	128.9	90%	0.902	78%	0.78	S	S	*	*			trans	-100.1	139.4	168.6	-60.7	166.9	114.7	0	0	108.9
735	S	38.7	Very low	34.5	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	79%	0.788	S	S	*	*				169.7	139.4	118.6	-115.6	0	0	0	0	114.1
736	D	42.7	Very low	34.9	Very low	136 Å²	136	133.5 Å²	133.5	73%	0.727	79%	0.794	S	S	*	*			trans	46	137.1	137.4	-67.2	-85.7	0	0	0	125.5
737	S	46.2	Very low	35.5	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	80%	0.795	S	S	*	*			trans	65.3	144.5	154.1	-58.4	0	0	0	0	118.9
738	D	43.3	Very low	36.1	Very low	230 Å²	230	136.8 Å²	136.8	100%	1.23	81%	0.814	S	S	*	*			cis	-123.7	0	9	-149.7	-105	0	0	0	111.2

Retrieved 738 of 738 residues in 136.8 ms (Link to these results)

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