A0A077ZLR6_TRITR Loading...

HAMP and PAS 3 and MCPsignal domain containing pr otein

AlphaFold DB , UniProt , Accession A0A077ZLR6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 504 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	33.4	Very low	69.8	Low	244 Å²	244	113.6 Å²	113.6	100%	1.202	60%	0.6	S	S	*	*				0	103.8	0	-74.8	166.1	135.9	0	0	107.7	S3	M1-S3 PolarHBondContact O-N 3.46Å; M1-S3 VanDerWaalsContact O-N 3.08Å
2	S	43.5	Very low	71.6	Confident	112 Å²	112	107.6 Å²	107.6	78%	0.783	57%	0.571	S	S	*	*			trans	-69.5	102.6	172.4	48.7	0	0	0	0	107.6	H4	S2-H4 PolarHBondContact O-N 3.34Å
3	S	47.8	Very low	73.1	Confident	108 Å²	108	106.5 Å²	106.5	76%	0.755	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-48	117.7	172.2	50.9	0	0	0	0	108.3	M1 P5	M1-S3 PolarHBondContact O-N 3.46Å; M1-S3 VanDerWaalsContact O-N 3.08Å; S3-P5 WeakPolarHBondContact O-CD 3.34Å; S3-P5 VanDerWaalsContact O-N 3.13Å
4	H	56.6	Low	74.5	Confident	175 Å²	175	99.9 Å²	99.9	81%	0.81	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-54.2	124.2	171.5	-83.2	-64	0	0	0	107.4	S2 Y6	S2-H4 PolarHBondContact O-N 3.34Å; H4-Y6 PolarHBondContact O-N 2.75Å; H4-Y6 VanDerWaalsContact O-N 3.08Å
5	P	64.8	Low	75.7	Confident	62 Å²	62	96.9 Å²	96.9	40%	0.403	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-58.5	122.5	-177.1	-16.3	24.8	0	0	0	108.4	S3 A7	S3-P5 WeakPolarHBondContact O-CD 3.34Å; S3-P5 VanDerWaalsContact O-N 3.13Å; P5-A7 PolarHBondContact O-N 2.62Å
6	Y	81.8	Confident	76.5	Confident	168 Å²	168	98.8 Å²	98.8	66%	0.659	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-52.4	124.6	175	175.7	-100.4	0	0	0	109	H4 T8 N89 G90	H4-Y6 PolarHBondContact O-N 2.75Å; H4-Y6 VanDerWaalsContact O-N 3.08Å; Y6-T8 HydrophobicContact CD1-CG2 4.44Å; Y6-T8 HydrophobicContact CE1-CG2 3.53Å; Y6-N89 WeakPolarHBondContact CE1-O 3.45Å; Y6-G90 VanDerWaalsContact O-CA 3.31Å; Y6-G90 WeakPolarHBondContact O-CA 3.29Å
7	A	84.5	Confident	77.3	Confident	36 Å²	36	100.8 Å²	100.8	30%	0.298	55%	0.551	S	S	.	*			trans	-134.7	121.6	-179.1	0	0	0	0	0	109	P5 P59 G90	P5-A7 PolarHBondContact O-N 2.62Å; A7-P59 HydrophobicContact CB-CG 4.15Å; A7-G90 CarbonylContact C-O 3.55Å; A7-G90 VanDerWaalsContact CA-O 3.31Å; A7-G90 WeakPolarHBondContact CA-O 3.42Å
8	T	86.3	Confident	78.2	Confident	22 Å²	22	96.2 Å²	96.2	14%	0.135	53%	0.527	C	S	.	.			trans	-85.4	165.4	170.2	84.7	0	0	0	0	108.6	Y6 Q10 G90 D91	Y6-T8 HydrophobicContact CD1-CG2 4.44Å; Y6-T8 HydrophobicContact CE1-CG2 3.53Å; T8-Q10 VanDerWaalsContact C-N 3.34Å; T8-Q10 PolarHBondContact OG1-N 3Å; T8-G90 PolarHBondContact N-O 3.12Å; T8-D91 WeakPolarHBondContact CG2-OD1 3.47Å; T8-D91 VanDerWaalsContact OG1-CA 3.24Å; T8-D91 WeakPolarHBondContact OG1-CA 3.38Å; T8-D91 PolarHBondContact OG1-N 3.44Å; T8-D91 PolarHBondContact OG1-OD1 3.42Å
9	Q	86.7	Confident	79	Confident	121 Å²	121	94.6 Å²	94.6	57%	0.565	52%	0.52	S	S	*	.	S	Bend	trans	-99.2	20.2	171	-67	-65.6	-17.9	0	0	112.1	D60 H92	Q9-D60 PolarHBondContact NE2-OD2 2.84Å; Q9-H92 PolarHBondContact O-CE1 3.31Å
10	Q	90.3	Very high	79.8	Confident	133 Å²	133	89.9 Å²	89.9	62%	0.621	49%	0.494	S	S	*	.			trans	-82.9	123.9	173.2	-62.4	-165.3	3.7	0	0	110	T8 H92	T8-Q10 VanDerWaalsContact C-N 3.34Å; T8-Q10 PolarHBondContact OG1-N 3Å; Q10-H92 PolarHBondContact O-N 3.14Å; Q10-H92 PolarHBondContact O-ND1 3.29Å; Q10-H92 VanDerWaalsContact O-ND1 3.11Å
11	N	91.8	Very high	80.5	Confident	69 Å²	69	87.5 Å²	87.5	37%	0.369	48%	0.48	S	S	.	.	B	Isolated β-bridge	trans	-85.7	132.9	173.5	-174.6	36	0	0	0	109.1	P13 H92	N11-P13 WeakPolarHBondContact O-CD 3.48Å; N11-H92 CarbonylContact C-O 3.53Å; N11-H92 WeakPolarHBondContact CA-O 3.42Å; N11-H92 PolarHBondContact OD1-O 3.32Å
12	T	92.3	Very high	83.4	Confident	41 Å²	41	75.9 Å²	75.9	25%	0.252	42%	0.423	S	S	.	.			trans	-102.6	99.7	169.5	-51.2	0	0	0	0	107.5	R87 H92 Y93	T12-R87 WeakPolarHBondContact OG1-CD 3.32Å; T12-H92 PolarHBondContact N-O 3.42Å; T12-Y93 WeakPolarHBondContact O-CB 3.49Å
13	P	90.1	Very high	85.9	Confident	94 Å²	94	70.8 Å²	70.8	61%	0.61	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-61.7	143.1	178.2	-19.8	33	0	0	0	110.8	N11	N11-P13 WeakPolarHBondContact O-CD 3.48Å
14	L	93.5	Very high	88.1	Confident	14 Å²	14	66.1 Å²	66.1	7%	0.073	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-95.5	153.1	172.7	-54.7	-177.1	0	0	0	109.5	T18 L20 V40 Y93 V95 R117	L14-T18 HydrophobicContact CB-CG2 4.16Å; L14-T18 HydrophobicContact CD1-CG2 4.17Å; L14-T18 HydrophobicContact CD2-CG2 4.46Å; L14-T18 HydrophobicContact CG-CG2 4.5Å; L14-L20 HydrophobicContact CD1-CD1 4.15Å; L14-V40 HydrophobicContact CD2-CB 4.43Å; L14-V40 HydrophobicContact CD2-CG1 3.52Å; L14-V40 HydrophobicContact CD2-CG2 3.96Å; L14-Y93 HydrophobicContact CD1-CD2 4.04Å; L14-Y93 HydrophobicContact CD2-CD2 4.42Å; L14-V95 HydrophobicContact CD1-CG1 3.73Å; L14-R117 HydrophobicContact CB-CB 4.25Å; L14-R117 HydrophobicContact CB-CG 4.29Å; L14-R117 VanDerWaalsContact O-CD 3.28Å; L14-R117 WeakPolarHBondContact O-CD 3.44Å
15	A	92.3	Very high	90	Very high	54 Å²	54	60 Å²	60	45%	0.446	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-72.3	158.8	169.7	0	0	0	0	0	110.6	D17 T18	A15-D17 VanDerWaalsContact C-N 3.29Å; A15-D17 VanDerWaalsContact CB-OD1 3.3Å; A15-D17 WeakPolarHBondContact CB-OD1 3.35Å; A15-D17 PolarHBondContact O-N 3.09Å; A15-T18 PolarHBondContact N-OG1 3.31Å; A15-T18 WeakPolarHBondContact O-CB 3.46Å; A15-T18 PolarHBondContact O-N 3.15Å; A15-T18 VanDerWaalsContact O-N 3.12Å; A15-T18 PolarHBondContact O-OG1 2.82Å; A15-T18 VanDerWaalsContact O-OG1 3.11Å
16	D	88.8	Confident	91.4	Very high	127 Å²	127	60.8 Å²	60.8	68%	0.679	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-29.3	-173.7	-69.4	-27.2	0	0	0	113.5	T18 R117	D16-T18 VanDerWaalsContact C-N 3.32Å; D16-R117 WeakPolarHBondContact OD1-CD 3.42Å; D16-R117 IonicContact OD1-CZ 3.82Å; D16-R117 IonicContact OD1-NE 3.41Å; D16-R117 IonicContact OD1-NH1 3.69Å; D16-R117 PolarHBondContact OD1-NH1 3.19Å; D16-R117 IonicContact OD2-NH1 2.8Å
17	D	89.4	Confident	91.9	Very high	133 Å²	133	58.9 Å²	58.9	71%	0.711	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.7	176.7	65.2	-23.3	0	0	0	113.4	A15 T19	A15-D17 VanDerWaalsContact C-N 3.29Å; A15-D17 VanDerWaalsContact CB-OD1 3.3Å; A15-D17 WeakPolarHBondContact CB-OD1 3.35Å; A15-D17 PolarHBondContact O-N 3.09Å; D17-T19 PolarHBondContact O-N 3.14Å; D17-T19 VanDerWaalsContact O-N 3.13Å
18	T	93.3	Very high	92.3	Very high	19 Å²	19	58.2 Å²	58.2	12%	0.117	32%	0.318	C	S	.	.			trans	-65.6	115.7	-177.8	-63.1	0	0	0	0	110.7	L14 A15 D16 L20 T36 V40	L14-T18 HydrophobicContact CB-CG2 4.16Å; L14-T18 HydrophobicContact CD1-CG2 4.17Å; L14-T18 HydrophobicContact CD2-CG2 4.46Å; L14-T18 HydrophobicContact CG-CG2 4.5Å; A15-T18 PolarHBondContact N-OG1 3.31Å; A15-T18 WeakPolarHBondContact O-CB 3.46Å; A15-T18 PolarHBondContact O-N 3.15Å; A15-T18 VanDerWaalsContact O-N 3.12Å; A15-T18 PolarHBondContact O-OG1 2.82Å; A15-T18 VanDerWaalsContact O-OG1 3.11Å; D16-T18 VanDerWaalsContact C-N 3.32Å; T18-L20 HydrophobicContact CG2-CD2 3.57Å; T18-L20 HydrophobicContact CG2-CG 4.22Å; T18-T36 HydrophobicContact CG2-CG2 3.79Å; T18-V40 HydrophobicContact CG2-CG2 4.46Å
19	T	93.8	Very high	92.8	Very high	65 Å²	65	62 Å²	62	40%	0.399	33%	0.331	S	S	.	.			trans	-115.9	113.4	175	-58.5	0	0	0	0	110.2	D17 N34 I114 R115	D17-T19 PolarHBondContact O-N 3.14Å; D17-T19 VanDerWaalsContact O-N 3.13Å; T19-N34 PolarHBondContact O-ND2 3.34Å; T19-I114 HydrophobicContact CG2-CG2 3.88Å; T19-R115 WeakPolarHBondContact CA-O 3.26Å
20	L	95.7	Very high	93.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.3	175.6	-35.2	173.9	0	0	0	109.6	L14 T18 T36 F37 V40 Y93 V95 R115	L14-L20 HydrophobicContact CD1-CD1 4.15Å; T18-L20 HydrophobicContact CG2-CD2 3.57Å; T18-L20 HydrophobicContact CG2-CG 4.22Å; L20-T36 HydrophobicContact CD2-CG2 3.62Å; L20-F37 HydrophobicContact CB-CB 4.13Å; L20-F37 HydrophobicContact CB-CD2 3.93Å; L20-F37 HydrophobicContact CD1-CD2 4.36Å; L20-V40 HydrophobicContact CD1-CB 4.48Å; L20-V40 HydrophobicContact CD1-CG1 4.04Å; L20-V40 HydrophobicContact CD2-CB 3.94Å; L20-V40 HydrophobicContact CD2-CG1 4.3Å; L20-V40 HydrophobicContact CD2-CG2 3.84Å; L20-Y93 HydrophobicContact CD1-CD2 4.26Å; L20-Y93 HydrophobicContact CD1-CE2 3.59Å; L20-V95 HydrophobicContact CD1-CG1 3.93Å; L20-R115 HydrophobicContact CB-CB 4.05Å; L20-R115 HydrophobicContact CD1-CB 4.49Å; L20-R115 HydrophobicContact CG-CB 4.43Å; L20-R115 PolarHBondContact N-O 3.33Å; L20-R115 PolarHBondContact O-N 3.46Å
21	M	94.2	Very high	93.3	Very high	40 Å²	40	53.4 Å²	53.4	20%	0.197	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134	-180	176.2	64.6	105.9	0	0	109.9	A33 N34 M112 I114	M21-A33 WeakPolarHBondContact O-CA 3.42Å; M21-N34 HydrophobicContact CB-CB 4.18Å; M21-N34 PolarHBondContact N-OD1 3.03Å; M21-N34 PolarHBondContact O-N 2.86Å; M21-N34 PolarHBondContact O-OD1 3.19Å; M21-M112 HydrophobicContact CE-CE 3.87Å; M21-M112 HydrophobicContact CE-CG 3.76Å; M21-M112 HydrophobicContact CE-SD 3.48Å; M21-M112 WeakPolarHBondContact CE-SD 3.43Å; M21-M112 HydrophobicContact SD-CG 3.49Å; M21-M112 WeakPolarHBondContact SD-CG 3.47Å; M21-M112 HydrophobicContact SD-SD 4.08Å; M21-I114 HydrophobicContact CE-CD1 3.68Å; M21-I114 HydrophobicContact CE-CG1 3.31Å; M21-I114 HydrophobicContact SD-CG1 3.56Å; M21-I114 VanDerWaalsContact SD-CG1 3.56Å
22	S	95	Very high	93.3	Very high	1 Å²	1	51 Å²	51	1%	0.007	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	145.6	167.8	62.8	0	0	0	0	110.6	H32 H53 S113 R115	S22-H32 CarbonylContact C-O 3.51Å; S22-H32 WeakPolarHBondContact CA-O 3.42Å; S22-H53 PolarHBondContact OG-NE2 3.28Å; S22-S113 PolarHBondContact N-O 3.35Å; S22-S113 PolarHBondContact O-N 3.47Å; S22-R115 PolarHBondContact OG-NH1 3.43Å; S22-R115 PolarHBondContact OG-NH2 3.32Å
23	T	94.6	Very high	93.4	Very high	4 Å²	4	49.1 Å²	49.1	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	156.1	167.7	60.2	0	0	0	0	112	I30 T31 H32 M102 Y111 M112 V504	T23-I30 WeakPolarHBondContact O-CA 3.26Å; T23-T31 PolarHBondContact O-N 2.92Å; T23-T31 PolarHBondContact O-OG1 3.48Å; T23-T31 VanDerWaalsContact O-OG1 3.14Å; T23-T31 PolarHBondContact OG1-OG1 2.85Å; T23-H32 PolarHBondContact N-O 3.24Å; T23-H32 PolarHBondContact O-N 2.96Å; T23-H32 WeakPolarHBondContact OG1-CB 3.32Å; T23-M102 HydrophobicContact CG2-SD 3.77Å; T23-Y111 CarbonylContact C-O 3.59Å; T23-Y111 WeakPolarHBondContact CA-O 3.43Å; T23-M112 HydrophobicContact CG2-CB 3.82Å; T23-M112 HydrophobicContact CG2-CE 4.07Å; T23-M112 HydrophobicContact CG2-CG 3.89Å; T23-V504 HydrophobicContact CG2-CG1 3.06Å
24	T	95.4	Very high	93.5	Very high	10 Å²	10	46.1 Å²	46.1	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	158.9	178	72.3	0	0	0	0	111.1	Y29 T31 H53 G110 Y111	T24-Y29 CarbonylContact C-O 3.56Å; T24-Y29 WeakPolarHBondContact CA-O 3.48Å; T24-Y29 WeakPolarHBondContact CB-O 3.24Å; T24-T31 PolarHBondContact N-OG1 2.83Å; T24-H53 HydrophobicContact CG2-CB 3.98Å; T24-G110 CarbonylContact O-C 3.55Å; T24-G110 WeakPolarHBondContact O-CA 3.3Å; T24-Y111 PolarHBondContact N-O 2.81Å; T24-Y111 PolarHBondContact O-N 3.39Å
25	D	94.9	Very high	93.4	Very high	46 Å²	46	50.1 Å²	50.1	25%	0.246	27%	0.27	C	S	.	.			trans	-68.2	-175	162.6	69.2	12.8	0	0	0	111.9	Q27 S28 Y29 T31	D25-Q27 PolarHBondContact O-N 3.36Å; D25-Q27 VanDerWaalsContact OD1-C 3.23Å; D25-Q27 WeakPolarHBondContact OD1-CA 3.27Å; D25-Q27 PolarHBondContact OD1-N 3.49Å; D25-S28 PolarHBondContact O-N 2.93Å; D25-S28 PolarHBondContact OD1-N 3.16Å; D25-Y29 PolarHBondContact N-O 3.44Å; D25-Y29 PolarHBondContact OD1-N 3.06Å; D25-T31 HydrophobicContact CB-CG2 4.14Å
26	L	93.9	Very high	93.4	Very high	79 Å²	79	49.7 Å²	49.7	41%	0.414	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.4	178.2	-68.9	176.1	0	0	0	113.9	I108	L26-I108 HydrophobicContact CD2-CB 4.19Å; L26-I108 HydrophobicContact CD2-CG2 3.72Å; L26-I108 WeakPolarHBondContact CD2-O 3.45Å
27	Q	93.2	Very high	93.8	Very high	128 Å²	128	43.7 Å²	43.7	60%	0.598	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	4.7	179.9	-67.8	72.5	30	0	0	112.2	D25 Y29	D25-Q27 PolarHBondContact O-N 3.36Å; D25-Q27 VanDerWaalsContact OD1-C 3.23Å; D25-Q27 WeakPolarHBondContact OD1-CA 3.27Å; D25-Q27 PolarHBondContact OD1-N 3.49Å; Q27-Y29 HydrophobicContact CB-CD2 3.64Å; Q27-Y29 HydrophobicContact CB-CE2 3.65Å
28	S	93	Very high	94	Very high	22 Å²	22	38.6 Å²	38.6	15%	0.154	20%	0.204	C	C	.	.			trans	72.1	24.8	178	-38.8	0	0	0	0	114.8	D25 H53 W70	D25-S28 PolarHBondContact O-N 2.93Å; D25-S28 PolarHBondContact OD1-N 3.16Å; S28-H53 WeakPolarHBondContact O-CB 3.26Å; S28-H53 PolarHBondContact O-N 3.2Å; S28-W70 WeakPolarHBondContact OG-CH2 3.41Å; S28-W70 WeakPolarHBondContact OG-CZ2 3.47Å
29	Y	95.9	Very high	94.1	Very high	103 Å²	103	44.7 Å²	44.7	40%	0.404	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-84.5	134.3	167.9	-63.4	-85.5	0	0	0	110	T24 D25 Q27 T31 G50 Q51 P52	T24-Y29 CarbonylContact C-O 3.56Å; T24-Y29 WeakPolarHBondContact CA-O 3.48Å; T24-Y29 WeakPolarHBondContact CB-O 3.24Å; D25-Y29 PolarHBondContact N-O 3.44Å; D25-Y29 PolarHBondContact OD1-N 3.06Å; Q27-Y29 HydrophobicContact CB-CD2 3.64Å; Q27-Y29 HydrophobicContact CB-CE2 3.65Å; Y29-T31 PolarHBondContact O-N 3.47Å; Y29-G50 WeakPolarHBondContact CD1-O 3.49Å; Y29-Q51 CarbonylContact C-O 3.45Å; Y29-Q51 WeakPolarHBondContact CA-O 3.33Å; Y29-P52 HydrophobicContact CD1-CG 3.97Å; Y29-P52 HydrophobicContact CE1-CB 4.43Å; Y29-P52 HydrophobicContact CE1-CG 3.59Å
30	I	95.8	Very high	94.1	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	121.3	-177	-63.3	168.6	0	0	0	109.6	T23 L48 G50 Q51 H53 M55	T23-I30 WeakPolarHBondContact O-CA 3.26Å; I30-L48 WeakPolarHBondContact CB-O 3.3Å; I30-L48 HydrophobicContact CD1-CB 4.29Å; I30-L48 HydrophobicContact CD1-CD2 4.12Å; I30-G50 PolarHBondContact O-N 2.71Å; I30-Q51 PolarHBondContact N-O 3.18Å; I30-H53 HydrophobicContact CG1-CB 4.21Å; I30-M55 HydrophobicContact CD1-SD 4.38Å
31	T	93.1	Very high	94.1	Very high	69 Å²	69	42.4 Å²	42.4	42%	0.423	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-31.9	175	48.5	0	0	0	0	111.7	T23 T24 D25 Y29	T23-T31 PolarHBondContact O-N 2.92Å; T23-T31 PolarHBondContact O-OG1 3.48Å; T23-T31 VanDerWaalsContact O-OG1 3.14Å; T23-T31 PolarHBondContact OG1-OG1 2.85Å; T24-T31 PolarHBondContact N-OG1 2.83Å; D25-T31 HydrophobicContact CB-CG2 4.14Å; Y29-T31 PolarHBondContact O-N 3.47Å
32	H	92.3	Very high	94.1	Very high	19 Å²	19	42.1 Å²	42.1	9%	0.088	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	149.1	177.3	-179.4	90.9	0	0	0	111.1	S22 T23 V504	S22-H32 CarbonylContact C-O 3.51Å; S22-H32 WeakPolarHBondContact CA-O 3.42Å; T23-H32 PolarHBondContact N-O 3.24Å; T23-H32 PolarHBondContact O-N 2.96Å; T23-H32 WeakPolarHBondContact OG1-CB 3.32Å; H32-V504 HydrophobicContact CB-CG2 3.93Å
33	A	93.3	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	138.2	168.3	0	0	0	0	0	110.4	M21 F37 V38 L45 L48 R497	M21-A33 WeakPolarHBondContact O-CA 3.42Å; A33-F37 HydrophobicContact CB-CB 4.43Å; A33-F37 HydrophobicContact CB-CD1 3.69Å; A33-F37 HydrophobicContact CB-CE1 4.4Å; A33-F37 HydrophobicContact CB-CG 4.42Å; A33-V38 HydrophobicContact CB-CG2 4.41Å; A33-L45 HydrophobicContact CB-CD1 4.41Å; A33-L48 HydrophobicContact CB-CD1 4.32Å; A33-R497 PolarHBondContact O-NH2 3.43Å
34	N	92.1	Very high	94.2	Very high	31 Å²	31	46.3 Å²	46.3	17%	0.166	25%	0.247	C	C	.	.			trans	-75.6	161.6	174.4	76.2	-21.8	0	0	0	111.5	T19 M21 T36 F37 V38	T19-N34 PolarHBondContact O-ND2 3.34Å; M21-N34 HydrophobicContact CB-CB 4.18Å; M21-N34 PolarHBondContact N-OD1 3.03Å; M21-N34 PolarHBondContact O-N 2.86Å; M21-N34 PolarHBondContact O-OD1 3.19Å; N34-T36 PolarHBondContact O-N 3.5Å; N34-F37 PolarHBondContact O-N 2.88Å; N34-F37 VanDerWaalsContact OD1-CB 3.22Å; N34-F37 WeakPolarHBondContact OD1-CB 3.35Å; N34-F37 PolarHBondContact OD1-N 3.48Å; N34-V38 WeakPolarHBondContact O-CG2 3.48Å; N34-V38 PolarHBondContact O-N 2.87Å; N34-V38 VanDerWaalsContact O-N 3.1Å
35	D	91.3	Very high	93.9	Very high	98 Å²	98	48.6 Å²	48.6	52%	0.524	26%	0.259	S	S	.	.	H	α-helix	trans	-58.8	-36.9	-175.8	-65.2	-28.1	0	0	0	112.3	F37 V38 Q39 R497	D35-F37 VanDerWaalsContact C-N 3.33Å; D35-F37 PolarHBondContact O-N 2.96Å; D35-V38 WeakPolarHBondContact O-CB 3.4Å; D35-V38 PolarHBondContact O-N 3.19Å; D35-Q39 WeakPolarHBondContact O-CB 3.47Å; D35-Q39 PolarHBondContact O-N 3.42Å; D35-R497 IonicContact OD1-CZ 3.78Å; D35-R497 VanDerWaalsContact OD1-CZ 3.28Å; D35-R497 IonicContact OD1-NE 2.67Å; D35-R497 PolarHBondContact OD1-NE 3.02Å; D35-R497 VanDerWaalsContact OD1-NE 3.14Å; D35-R497 IonicContact OD1-NH2 2.92Å; D35-R497 PolarHBondContact OD1-NH2 3.11Å; D35-R497 IonicContact OD2-NE 3.27Å
36	T	93.5	Very high	93.8	Very high	46 Å²	46	54.5 Å²	54.5	28%	0.282	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-39.8	176.8	-38.8	0	0	0	0	111.6	T18 L20 N34 V40	T18-T36 HydrophobicContact CG2-CG2 3.79Å; L20-T36 HydrophobicContact CD2-CG2 3.62Å; N34-T36 PolarHBondContact O-N 3.5Å; T36-V40 HydrophobicContact CG2-CG2 4.37Å; T36-V40 VanDerWaalsContact O-CB 3.23Å; T36-V40 WeakPolarHBondContact O-CB 3.49Å; T36-V40 VanDerWaalsContact O-CG2 3.25Å; T36-V40 WeakPolarHBondContact O-CG2 3.05Å; T36-V40 PolarHBondContact O-N 2.84Å
37	F	95.4	Very high	93.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-39.6	174.1	-176	-94.3	0	0	0	112.1	L20 A33 N34 D35 S41 L48 V56	L20-F37 HydrophobicContact CB-CB 4.13Å; L20-F37 HydrophobicContact CB-CD2 3.93Å; L20-F37 HydrophobicContact CD1-CD2 4.36Å; A33-F37 HydrophobicContact CB-CB 4.43Å; A33-F37 HydrophobicContact CB-CD1 3.69Å; A33-F37 HydrophobicContact CB-CE1 4.4Å; A33-F37 HydrophobicContact CB-CG 4.42Å; N34-F37 PolarHBondContact O-N 2.88Å; N34-F37 VanDerWaalsContact OD1-CB 3.22Å; N34-F37 WeakPolarHBondContact OD1-CB 3.35Å; N34-F37 PolarHBondContact OD1-N 3.48Å; D35-F37 VanDerWaalsContact C-N 3.33Å; D35-F37 PolarHBondContact O-N 2.96Å; F37-S41 WeakPolarHBondContact O-CB 3.37Å; F37-S41 PolarHBondContact O-N 3.13Å; F37-S41 PolarHBondContact O-OG 3.37Å; F37-L48 HydrophobicContact CD1-CD1 3.84Å; F37-L48 HydrophobicContact CE1-CD1 3.86Å; F37-L48 HydrophobicContact CE1-CD2 4.01Å; F37-V56 HydrophobicContact CE1-CG1 4.49Å; F37-V56 HydrophobicContact CZ-CB 4.49Å; F37-V56 HydrophobicContact CZ-CG1 3.98Å; F37-V56 HydrophobicContact CZ-CG2 3.98Å
38	V	94.5	Very high	94	Very high	27 Å²	27	48 Å²	48	16%	0.164	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-53.9	174.6	177.9	0	0	0	0	109.6	A33 N34 D35 V40 S41 G42 Y43 L45 L48	A33-V38 HydrophobicContact CB-CG2 4.41Å; N34-V38 WeakPolarHBondContact O-CG2 3.48Å; N34-V38 PolarHBondContact O-N 2.87Å; N34-V38 VanDerWaalsContact O-N 3.1Å; D35-V38 WeakPolarHBondContact O-CB 3.4Å; D35-V38 PolarHBondContact O-N 3.19Å; V38-V40 PolarHBondContact O-N 2.93Å; V38-S41 PolarHBondContact O-N 3.41Å; V38-S41 PolarHBondContact O-OG 3.45Å; V38-S41 VanDerWaalsContact O-OG 3.1Å; V38-G42 PolarHBondContact O-N 2.97Å; V38-Y43 WeakPolarHBondContact CG1-O 3.41Å; V38-L45 HydrophobicContact CG2-CB 4.27Å; V38-L45 HydrophobicContact CG2-CD1 4.09Å; V38-L48 HydrophobicContact CG2-CD1 4.04Å
39	Q	94.6	Very high	93.9	Very high	146 Å²	146	52.5 Å²	52.5	68%	0.682	27%	0.271	S	S	*	.	H	α-helix	trans	-60.5	-49	179.5	-174	-176.3	6.2	0	0	112.5	D35 G42 R87	D35-Q39 WeakPolarHBondContact O-CB 3.47Å; D35-Q39 PolarHBondContact O-N 3.42Å; Q39-G42 PolarHBondContact O-N 2.86Å; Q39-R87 PolarHBondContact O-NH2 3.08Å
40	V	95.3	Very high	93.8	Very high	18 Å²	18	49.7 Å²	49.7	11%	0.109	27%	0.274	C	S	.	.	H	α-helix	trans	-70.8	-33.2	-178.2	170	0	0	0	0	111.6	L14 T18 L20 T36 V38 G42 R87 Y93	L14-V40 HydrophobicContact CD2-CB 4.43Å; L14-V40 HydrophobicContact CD2-CG1 3.52Å; L14-V40 HydrophobicContact CD2-CG2 3.96Å; T18-V40 HydrophobicContact CG2-CG2 4.46Å; L20-V40 HydrophobicContact CD1-CB 4.48Å; L20-V40 HydrophobicContact CD1-CG1 4.04Å; L20-V40 HydrophobicContact CD2-CB 3.94Å; L20-V40 HydrophobicContact CD2-CG1 4.3Å; L20-V40 HydrophobicContact CD2-CG2 3.84Å; T36-V40 HydrophobicContact CG2-CG2 4.37Å; T36-V40 VanDerWaalsContact O-CB 3.23Å; T36-V40 WeakPolarHBondContact O-CB 3.49Å; T36-V40 VanDerWaalsContact O-CG2 3.25Å; T36-V40 WeakPolarHBondContact O-CG2 3.05Å; T36-V40 PolarHBondContact O-N 2.84Å; V38-V40 PolarHBondContact O-N 2.93Å; V40-G42 VanDerWaalsContact C-N 3.34Å; V40-R87 VanDerWaalsContact O-CZ 3.24Å; V40-R87 PolarHBondContact O-NE 2.8Å; V40-R87 PolarHBondContact O-NH2 2.92Å; V40-Y93 HydrophobicContact CG1-CD1 4.12Å; V40-Y93 HydrophobicContact CG1-CD2 3.85Å; V40-Y93 HydrophobicContact CG1-CE1 4.07Å; V40-Y93 HydrophobicContact CG1-CE2 3.78Å; V40-Y93 HydrophobicContact CG1-CG 4.01Å
41	S	95.2	Very high	93.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-75.6	-25.4	175.9	73.1	0	0	0	0	112.5	F37 V38 Y43 R87 K88	F37-S41 WeakPolarHBondContact O-CB 3.37Å; F37-S41 PolarHBondContact O-N 3.13Å; F37-S41 PolarHBondContact O-OG 3.37Å; V38-S41 PolarHBondContact O-N 3.41Å; V38-S41 PolarHBondContact O-OG 3.45Å; V38-S41 VanDerWaalsContact O-OG 3.1Å; S41-Y43 PolarHBondContact O-N 3.41Å; S41-Y43 PolarHBondContact OG-N 3.02Å; S41-R87 CarbonylContact O-C 3.6Å; S41-R87 WeakPolarHBondContact O-CA 3.48Å; S41-K88 PolarHBondContact O-N 2.96Å
42	G	94.8	Very high	94	Very high	34 Å²	34	52.5 Å²	52.5	35%	0.351	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	4.1	-176.1	0	0	0	0	0	114	V38 Q39 V40 K88	V38-G42 PolarHBondContact O-N 2.97Å; Q39-G42 PolarHBondContact O-N 2.86Å; V40-G42 VanDerWaalsContact C-N 3.34Å; G42-K88 WeakPolarHBondContact O-CB 3.4Å; G42-K88 WeakPolarHBondContact O-CD 3.47Å
43	Y	95.6	Very high	94	Very high	24 Å²	24	53 Å²	53	9%	0.094	29%	0.288	C	S	.	.			trans	-88.1	149.2	168.4	-64.8	-85	0	0	0	109.6	V38 S41 E47 L48 M55 V56 R86 K88	V38-Y43 WeakPolarHBondContact CG1-O 3.41Å; S41-Y43 PolarHBondContact O-N 3.41Å; S41-Y43 PolarHBondContact OG-N 3.02Å; Y43-E47 HydrophobicContact CD1-CB 4.25Å; Y43-L48 HydrophobicContact CD2-CD2 4.09Å; Y43-L48 HydrophobicContact CG-CD2 4.06Å; Y43-M55 HydrophobicContact CD1-CE 3.73Å; Y43-M55 HydrophobicContact CD2-CE 4.37Å; Y43-M55 HydrophobicContact CE1-CE 3.65Å; Y43-M55 HydrophobicContact CE2-CE 4.31Å; Y43-M55 HydrophobicContact CG-CE 4.1Å; Y43-V56 HydrophobicContact CD2-CG1 4.27Å; Y43-V56 HydrophobicContact CE2-CG1 4.1Å; Y43-R86 PolarHBondContact OH-NH2 3.28Å; Y43-K88 HydrophobicContact CD1-CB 4.06Å; Y43-K88 HydrophobicContact CD1-CD 3.87Å; Y43-K88 HydrophobicContact CD1-CG 3.93Å; Y43-K88 HydrophobicContact CD2-CB 4.08Å; Y43-K88 HydrophobicContact CE1-CB 3.89Å; Y43-K88 HydrophobicContact CE1-CD 4.16Å; Y43-K88 HydrophobicContact CE1-CG 3.71Å; Y43-K88 HydrophobicContact CE2-CB 3.91Å; Y43-K88 HydrophobicContact CG-CB 4.15Å; Y43-K88 HydrophobicContact CG-CD 4.38Å; Y43-K88 HydrophobicContact CG-CG 4.48Å
44	T	94.5	Very high	93.9	Very high	68 Å²	68	58.2 Å²	58.2	42%	0.417	32%	0.316	S	S	.	.			trans	-71.9	158.9	167.9	64.4	0	0	0	0	110.2	Q46 E47 L48	T44-Q46 PolarHBondContact O-N 3.44Å; T44-E47 PolarHBondContact N-OE2 3.19Å; T44-E47 WeakPolarHBondContact O-CB 3.43Å; T44-E47 PolarHBondContact O-N 2.87Å; T44-E47 VanDerWaalsContact O-N 3.08Å; T44-E47 WeakPolarHBondContact OG1-CB 3.45Å; T44-E47 WeakPolarHBondContact OG1-CG 3.31Å; T44-E47 PolarHBondContact OG1-N 3.32Å; T44-E47 PolarHBondContact OG1-OE2 3Å; T44-E47 VanDerWaalsContact OG1-OE2 3.09Å; T44-L48 PolarHBondContact O-N 3.45Å; T44-L48 VanDerWaalsContact O-N 3.17Å
45	L	90.1	Very high	94	Very high	58 Å²	58	58.5 Å²	58.5	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-57.4	-40.2	177.9	-178.2	62.1	0	0	0	111.9	A33 V38 E47 L48 Q49	A33-L45 HydrophobicContact CB-CD1 4.41Å; V38-L45 HydrophobicContact CG2-CB 4.27Å; V38-L45 HydrophobicContact CG2-CD1 4.09Å; L45-E47 VanDerWaalsContact C-N 3.33Å; L45-E47 PolarHBondContact O-N 3.48Å; L45-L48 PolarHBondContact O-N 3.28Å; L45-L48 VanDerWaalsContact O-N 3.12Å; L45-Q49 WeakPolarHBondContact O-CB 3.39Å; L45-Q49 PolarHBondContact O-N 2.93Å
46	Q	93	Very high	94.1	Very high	170 Å²	170	53.9 Å²	53.9	79%	0.794	29%	0.292	S	S	*	.	H	α-helix	trans	-63.3	-36.2	176.6	-71.5	167.4	-9.5	0	0	112.6	T44 L48	T44-Q46 PolarHBondContact O-N 3.44Å; Q46-L48 VanDerWaalsContact C-N 3.28Å; Q46-L48 PolarHBondContact O-N 3.46Å
47	E	95.3	Very high	94.1	Very high	71 Å²	71	54.6 Å²	54.6	33%	0.332	29%	0.29	S	S	.	.	H	α-helix	trans	-72.4	-20.7	175.2	-73.5	172	138.2	0	0	113.2	Y43 T44 L45 Q51 K88	Y43-E47 HydrophobicContact CD1-CB 4.25Å; T44-E47 PolarHBondContact N-OE2 3.19Å; T44-E47 WeakPolarHBondContact O-CB 3.43Å; T44-E47 PolarHBondContact O-N 2.87Å; T44-E47 VanDerWaalsContact O-N 3.08Å; T44-E47 WeakPolarHBondContact OG1-CB 3.45Å; T44-E47 WeakPolarHBondContact OG1-CG 3.31Å; T44-E47 PolarHBondContact OG1-N 3.32Å; T44-E47 PolarHBondContact OG1-OE2 3Å; T44-E47 VanDerWaalsContact OG1-OE2 3.09Å; L45-E47 VanDerWaalsContact C-N 3.33Å; L45-E47 PolarHBondContact O-N 3.48Å; E47-Q51 WeakPolarHBondContact O-CG 3.17Å; E47-K88 WeakPolarHBondContact OE1-CE 3.24Å; E47-K88 IonicContact OE1-NZ 2.92Å; E47-K88 PolarHBondContact OE1-NZ 3.46Å; E47-K88 IonicContact OE2-NZ 3.99Å; E47-K88 PolarHBondContact OE2-NZ 3.47Å
48	L	94.7	Very high	94.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-90.3	-39.4	178	-69.3	171	0	0	0	112	I30 A33 F37 V38 Y43 T44 L45 Q46 G50 Q51 M55 V56	I30-L48 WeakPolarHBondContact CB-O 3.3Å; I30-L48 HydrophobicContact CD1-CB 4.29Å; I30-L48 HydrophobicContact CD1-CD2 4.12Å; A33-L48 HydrophobicContact CB-CD1 4.32Å; F37-L48 HydrophobicContact CD1-CD1 3.84Å; F37-L48 HydrophobicContact CE1-CD1 3.86Å; F37-L48 HydrophobicContact CE1-CD2 4.01Å; V38-L48 HydrophobicContact CG2-CD1 4.04Å; Y43-L48 HydrophobicContact CD2-CD2 4.09Å; Y43-L48 HydrophobicContact CG-CD2 4.06Å; T44-L48 PolarHBondContact O-N 3.45Å; T44-L48 VanDerWaalsContact O-N 3.17Å; L45-L48 PolarHBondContact O-N 3.28Å; L45-L48 VanDerWaalsContact O-N 3.12Å; Q46-L48 VanDerWaalsContact C-N 3.28Å; Q46-L48 PolarHBondContact O-N 3.46Å; L48-G50 PolarHBondContact O-N 2.91Å; L48-Q51 WeakPolarHBondContact O-CB 3.49Å; L48-Q51 PolarHBondContact O-N 2.85Å; L48-Q51 VanDerWaalsContact O-N 3.1Å; L48-M55 HydrophobicContact CD2-CE 4.16Å; L48-M55 HydrophobicContact CD2-SD 3.92Å; L48-V56 HydrophobicContact CD2-CG1 4.33Å
49	Q	92.2	Very high	93.9	Very high	116 Å²	116	56.7 Å²	56.7	54%	0.542	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	130.7	-171.1	-165.8	163.2	12.8	0	0	111.8	L45 Q51	L45-Q49 WeakPolarHBondContact O-CB 3.39Å; L45-Q49 PolarHBondContact O-N 2.93Å; Q49-Q51 PolarHBondContact O-N 3.33Å
50	G	94	Very high	93.8	Very high	45 Å²	45	52.3 Å²	52.3	46%	0.464	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	4.9	-177.1	0	0	0	0	0	114.5	Y29 I30 L48	Y29-G50 WeakPolarHBondContact CD1-O 3.49Å; I30-G50 PolarHBondContact O-N 2.71Å; L48-G50 PolarHBondContact O-N 2.91Å
51	Q	96.2	Very high	93.7	Very high	91 Å²	91	51.6 Å²	51.6	43%	0.425	28%	0.28	S	S	.	.	S	Bend	trans	-90.5	150.4	175.3	-65.9	-57.1	-38.3	0	0	112	Y29 I30 E47 L48 Q49 H53 M55	Y29-Q51 CarbonylContact C-O 3.45Å; Y29-Q51 WeakPolarHBondContact CA-O 3.33Å; I30-Q51 PolarHBondContact N-O 3.18Å; E47-Q51 WeakPolarHBondContact O-CG 3.17Å; L48-Q51 WeakPolarHBondContact O-CB 3.49Å; L48-Q51 PolarHBondContact O-N 2.85Å; L48-Q51 VanDerWaalsContact O-N 3.1Å; Q49-Q51 PolarHBondContact O-N 3.33Å; Q51-H53 PolarHBondContact O-N 2.95Å; Q51-M55 HydrophobicContact CB-CE 4.45Å; Q51-M55 HydrophobicContact CB-SD 3.38Å; Q51-M55 WeakPolarHBondContact CB-SD 3.29Å; Q51-M55 HydrophobicContact CG-SD 4.03Å
52	P	95.4	Very high	93.5	Very high	41 Å²	41	51.6 Å²	51.6	27%	0.266	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-57.2	129.9	172.5	-22.2	31.6	0	0	0	111.2	Y29 N54 M55	Y29-P52 HydrophobicContact CD1-CG 3.97Å; Y29-P52 HydrophobicContact CE1-CB 4.43Å; Y29-P52 HydrophobicContact CE1-CG 3.59Å; P52-N54 WeakPolarHBondContact CB-OD1 3.39Å; P52-N54 PolarHBondContact O-N 3.41Å; P52-M55 WeakPolarHBondContact O-CB 3.21Å; P52-M55 VanDerWaalsContact O-CG 3.3Å; P52-M55 WeakPolarHBondContact O-CG 3.4Å; P52-M55 PolarHBondContact O-N 2.94Å
53	H	93.3	Very high	93.3	Very high	28 Å²	28	58.4 Å²	58.4	13%	0.13	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-56.5	-29.4	-179	-166	-73.3	0	0	0	112.8	S22 T24 S28 I30 Q51 M55 V56 R115	S22-H53 PolarHBondContact OG-NE2 3.28Å; T24-H53 HydrophobicContact CG2-CB 3.98Å; S28-H53 WeakPolarHBondContact O-CB 3.26Å; S28-H53 PolarHBondContact O-N 3.2Å; I30-H53 HydrophobicContact CG1-CB 4.21Å; Q51-H53 PolarHBondContact O-N 2.95Å; H53-M55 PolarHBondContact O-N 3.15Å; H53-V56 WeakPolarHBondContact O-CG2 3.5Å; H53-V56 PolarHBondContact O-N 2.94Å; H53-R115 PolarHBondContact CE1-NH2 3.45Å; H53-R115 PolarHBondContact NE2-NH2 2.97Å
54	N	92.1	Very high	93	Very high	110 Å²	110	59.7 Å²	59.7	59%	0.588	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-62.8	-7.6	177.4	71.8	9	0	0	0	114.5	P52 V56 R57	P52-N54 WeakPolarHBondContact CB-OD1 3.39Å; P52-N54 PolarHBondContact O-N 3.41Å; N54-V56 PolarHBondContact O-N 3.45Å; N54-R57 WeakPolarHBondContact O-CB 3.43Å; N54-R57 PolarHBondContact O-N 3.17Å
55	M	93.1	Very high	92.8	Very high	38 Å²	38	56.5 Å²	56.5	19%	0.187	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-60	-33.4	175	71.1	-178.2	-68.9	0	0	113	I30 Y43 L48 Q51 P52 H53 R57 R86	I30-M55 HydrophobicContact CD1-SD 4.38Å; Y43-M55 HydrophobicContact CD1-CE 3.73Å; Y43-M55 HydrophobicContact CD2-CE 4.37Å; Y43-M55 HydrophobicContact CE1-CE 3.65Å; Y43-M55 HydrophobicContact CE2-CE 4.31Å; Y43-M55 HydrophobicContact CG-CE 4.1Å; L48-M55 HydrophobicContact CD2-CE 4.16Å; L48-M55 HydrophobicContact CD2-SD 3.92Å; Q51-M55 HydrophobicContact CB-CE 4.45Å; Q51-M55 HydrophobicContact CB-SD 3.38Å; Q51-M55 WeakPolarHBondContact CB-SD 3.29Å; Q51-M55 HydrophobicContact CG-SD 4.03Å; P52-M55 WeakPolarHBondContact O-CB 3.21Å; P52-M55 VanDerWaalsContact O-CG 3.3Å; P52-M55 WeakPolarHBondContact O-CG 3.4Å; P52-M55 PolarHBondContact O-N 2.94Å; H53-M55 PolarHBondContact O-N 3.15Å; M55-R57 VanDerWaalsContact C-N 3.29Å; M55-R86 PolarHBondContact O-NH2 3.44Å
56	V	94.4	Very high	92.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-87.8	4.9	177	-59.1	0	0	0	0	112.5	F37 Y43 L48 H53 N54 N85 R86	F37-V56 HydrophobicContact CE1-CG1 4.49Å; F37-V56 HydrophobicContact CZ-CB 4.49Å; F37-V56 HydrophobicContact CZ-CG1 3.98Å; F37-V56 HydrophobicContact CZ-CG2 3.98Å; Y43-V56 HydrophobicContact CD2-CG1 4.27Å; Y43-V56 HydrophobicContact CE2-CG1 4.1Å; L48-V56 HydrophobicContact CD2-CG1 4.33Å; H53-V56 WeakPolarHBondContact O-CG2 3.5Å; H53-V56 PolarHBondContact O-N 2.94Å; N54-V56 PolarHBondContact O-N 3.45Å; V56-N85 CarbonylContact O-C 3.5Å; V56-N85 VanDerWaalsContact O-CA 3.23Å; V56-N85 WeakPolarHBondContact O-CA 3.44Å; V56-N85 WeakPolarHBondContact O-CB 3.44Å; V56-N85 PolarHBondContact O-OD1 3.02Å; V56-R86 PolarHBondContact O-N 3.38Å
57	R	93.2	Very high	92.7	Very high	62 Å²	62	49.9 Å²	49.9	23%	0.234	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-75.3	134.4	-180	179.1	-179.3	165.1	171.6	0.2	110.6	N54 M55 M61 F66	N54-R57 WeakPolarHBondContact O-CB 3.43Å; N54-R57 PolarHBondContact O-N 3.17Å; M55-R57 VanDerWaalsContact C-N 3.29Å; R57-M61 HydrophobicContact CG-CB 4.25Å; R57-M61 PolarHBondContact NH2-O 3.41Å; R57-F66 HydrophobicContact CB-CZ 4.45Å; R57-F66 HydrophobicContact CG-CE2 3.63Å; R57-F66 HydrophobicContact CG-CZ 3.78Å; R57-F66 VanDerWaalsContact NE-CE2 3.25Å
58	H	94.7	Very high	92.6	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.262	C	S	.	.			trans	-75.5	138.8	170.2	-163.7	-83.2	0	0	0	111.8	D60 M61 K84 R86	H58-D60 VanDerWaalsContact C-N 3.26Å; H58-D60 IonicContact CE1-OD1 3.28Å; H58-D60 IonicContact CE1-OD2 4Å; H58-D60 PolarHBondContact CE1-OD2 3.16Å; H58-D60 VanDerWaalsContact ND1-CB 3.35Å; H58-D60 WeakPolarHBondContact ND1-CB 3.48Å; H58-D60 VanDerWaalsContact ND1-CG 3.33Å; H58-D60 PolarHBondContact ND1-N 3.46Å; H58-D60 IonicContact ND1-OD1 3.14Å; H58-D60 IonicContact ND1-OD2 3.62Å; H58-D60 PolarHBondContact ND1-OD2 3.38Å; H58-D60 PolarHBondContact O-N 3.27Å; H58-M61 WeakPolarHBondContact O-CB 3.39Å; H58-M61 PolarHBondContact O-N 2.88Å; H58-K84 HydrophobicContact CB-CB 3.99Å; H58-K84 HydrophobicContact CB-CD 4.1Å; H58-K84 HydrophobicContact CB-CG 3.77Å; H58-K84 WeakPolarHBondContact CB-O 3.48Å; H58-K84 PolarHBondContact N-O 3.03Å; H58-R86 HydrophobicContact CB-CB 4.33Å
59	P	91.3	Very high	92.6	Very high	69 Å²	69	48.2 Å²	48.2	45%	0.448	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-37.3	177.8	-28.3	35.2	0	0	0	114.5	A7 M61	A7-P59 HydrophobicContact CB-CG 4.15Å; P59-M61 PolarHBondContact O-N 2.9Å; P59-M61 VanDerWaalsContact O-N 3.15Å
60	D	92	Very high	92.7	Very high	55 Å²	55	46 Å²	46	29%	0.294	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.3	177.3	-58.5	-11.9	0	0	0	114.2	Q9 H58 P62 K84 N134	Q9-D60 PolarHBondContact NE2-OD2 2.84Å; H58-D60 VanDerWaalsContact C-N 3.26Å; H58-D60 IonicContact CE1-OD1 3.28Å; H58-D60 IonicContact CE1-OD2 4Å; H58-D60 PolarHBondContact CE1-OD2 3.16Å; H58-D60 VanDerWaalsContact ND1-CB 3.35Å; H58-D60 WeakPolarHBondContact ND1-CB 3.48Å; H58-D60 VanDerWaalsContact ND1-CG 3.33Å; H58-D60 PolarHBondContact ND1-N 3.46Å; H58-D60 IonicContact ND1-OD1 3.14Å; H58-D60 IonicContact ND1-OD2 3.62Å; H58-D60 PolarHBondContact ND1-OD2 3.38Å; H58-D60 PolarHBondContact O-N 3.27Å; D60-P62 WeakPolarHBondContact O-CD 3.44Å; D60-K84 HydrophobicContact CB-CD 4.24Å; D60-K84 IonicContact OD2-NZ 2.78Å; D60-K84 PolarHBondContact OD2-NZ 3.36Å; D60-N134 PolarHBondContact O-ND2 3.31Å
61	M	93	Very high	92.6	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.256	C	S	.	.	S	Bend	trans	-69.2	127.3	178.4	-80.6	-61.3	-65.4	0	0	111.6	R57 H58 P59 K63 A65 F66 V83 K84 Y130	R57-M61 HydrophobicContact CG-CB 4.25Å; R57-M61 PolarHBondContact NH2-O 3.41Å; H58-M61 WeakPolarHBondContact O-CB 3.39Å; H58-M61 PolarHBondContact O-N 2.88Å; P59-M61 PolarHBondContact O-N 2.9Å; P59-M61 VanDerWaalsContact O-N 3.15Å; M61-K63 PolarHBondContact O-N 3.45Å; M61-A65 HydrophobicContact CE-CB 4.07Å; M61-F66 HydrophobicContact CB-CD2 4.37Å; M61-F66 HydrophobicContact CB-CE2 3.64Å; M61-F66 HydrophobicContact CE-CE2 4.04Å; M61-F66 HydrophobicContact CG-CE2 4.09Å; M61-V83 HydrophobicContact CE-CB 4.35Å; M61-V83 HydrophobicContact CE-CG1 4.18Å; M61-V83 HydrophobicContact CE-CG2 4.29Å; M61-V83 HydrophobicContact CG-CG1 4.47Å; M61-V83 HydrophobicContact SD-CG1 4.46Å; M61-K84 HydrophobicContact CG-CB 3.9Å; M61-K84 WeakPolarHBondContact CG-O 3.27Å; M61-K84 HydrophobicContact SD-CB 3.8Å; M61-K84 PolarHBondContact SD-N 2.98Å; M61-Y130 HydrophobicContact CE-CD2 4.43Å; M61-Y130 HydrophobicContact CE-CE2 3.85Å; M61-Y130 HydrophobicContact SD-CD2 3.8Å; M61-Y130 HydrophobicContact SD-CE2 3.61Å
62	P	91.8	Very high	92.5	Very high	1 Å²	1	45 Å²	45	1%	0.006	24%	0.236	C	C	.	.			trans	-62.6	135.6	-179	-21.8	32.5	0	0	0	113.6	D60 A64 A65 Y130 L133 N134	D60-P62 WeakPolarHBondContact O-CD 3.44Å; P62-A64 PolarHBondContact O-N 2.9Å; P62-A65 HydrophobicContact CB-CB 4.42Å; P62-A65 WeakPolarHBondContact O-CB 3.46Å; P62-A65 PolarHBondContact O-N 3.21Å; P62-Y130 HydrophobicContact CG-CD1 3.82Å; P62-Y130 HydrophobicContact CG-CD2 4.45Å; P62-Y130 HydrophobicContact CG-CG 3.71Å; P62-L133 HydrophobicContact CB-CB 4.04Å; P62-L133 HydrophobicContact CB-CD1 4.4Å; P62-L133 HydrophobicContact CG-CB 3.98Å; P62-L133 HydrophobicContact CG-CD1 4.17Å; P62-N134 WeakPolarHBondContact CA-OD1 3.43Å; P62-N134 WeakPolarHBondContact CB-OD1 3.49Å
63	K	90.1	Very high	92.4	Very high	177 Å²	177	43.2 Å²	43.2	77%	0.77	22%	0.223	S	C	*	.	H	α-helix	trans	-55.8	-34.3	171.1	-66.4	-177.1	-179	179.3	0	111.6	M61 A65 F66 A67	M61-K63 PolarHBondContact O-N 3.45Å; K63-A65 VanDerWaalsContact C-N 3.32Å; K63-A65 PolarHBondContact O-N 2.94Å; K63-F66 PolarHBondContact O-N 3.01Å; K63-A67 WeakPolarHBondContact O-CB 3Å; K63-A67 PolarHBondContact O-N 3.46Å
64	A	89	Confident	92.4	Very high	51 Å²	51	48.8 Å²	48.8	42%	0.421	25%	0.247	S	C	.	.	H	α-helix	trans	-62.9	-33.6	176.5	0	0	0	0	0	113.7	P62 D68	P62-A64 PolarHBondContact O-N 2.9Å; A64-D68 WeakPolarHBondContact O-CB 3.43Å; A64-D68 PolarHBondContact O-N 2.88Å
65	A	90.9	Very high	92.3	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-46.2	178.7	0	0	0	0	0	111.1	M61 P62 K63 D68 M69 I142	M61-A65 HydrophobicContact CE-CB 4.07Å; P62-A65 HydrophobicContact CB-CB 4.42Å; P62-A65 WeakPolarHBondContact O-CB 3.46Å; P62-A65 PolarHBondContact O-N 3.21Å; K63-A65 VanDerWaalsContact C-N 3.32Å; K63-A65 PolarHBondContact O-N 2.94Å; A65-D68 PolarHBondContact O-N 3.42Å; A65-M69 PolarHBondContact O-N 3.31Å; A65-I142 HydrophobicContact CB-CD1 3.48Å; A65-I142 VanDerWaalsContact CB-CD1 3.48Å
66	F	89.7	Confident	92.2	Very high	28 Å²	28	48.6 Å²	48.6	12%	0.123	25%	0.245	C	C	.	.	H	α-helix	trans	-71.8	-34.7	177.3	-76	-79.7	0	0	0	113.1	R57 M61 K63 D68 M69 W70 V83	R57-F66 HydrophobicContact CB-CZ 4.45Å; R57-F66 HydrophobicContact CG-CE2 3.63Å; R57-F66 HydrophobicContact CG-CZ 3.78Å; R57-F66 VanDerWaalsContact NE-CE2 3.25Å; M61-F66 HydrophobicContact CB-CD2 4.37Å; M61-F66 HydrophobicContact CB-CE2 3.64Å; M61-F66 HydrophobicContact CE-CE2 4.04Å; M61-F66 HydrophobicContact CG-CE2 4.09Å; K63-F66 PolarHBondContact O-N 3.01Å; F66-D68 VanDerWaalsContact C-N 3.3Å; F66-D68 PolarHBondContact O-N 3.39Å; F66-M69 HydrophobicContact CD1-CE 3.77Å; F66-M69 HydrophobicContact CD1-SD 4.17Å; F66-M69 HydrophobicContact CE1-CE 4.27Å; F66-M69 HydrophobicContact CE1-SD 4.4Å; F66-M69 PolarHBondContact O-N 2.89Å; F66-W70 PolarHBondContact O-N 2.91Å; F66-V83 HydrophobicContact CZ-CG1 4.19Å
67	A	91.3	Very high	92	Very high	61 Å²	61	51.2 Å²	51.2	50%	0.504	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-42.5	173.5	0	0	0	0	0	111.2	K63 F71	K63-A67 WeakPolarHBondContact O-CB 3Å; K63-A67 PolarHBondContact O-N 3.46Å; A67-F71 VanDerWaalsContact O-CB 3.26Å; A67-F71 WeakPolarHBondContact O-CB 3.44Å; A67-F71 PolarHBondContact O-N 3.26Å
68	D	93.2	Very high	92	Very high	14 Å²	14	51.2 Å²	51.2	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-44.4	173.9	175.6	70	0	0	0	112.3	A64 A65 F66 F71 T72 W79 I142 H143 K144 G145	A64-D68 WeakPolarHBondContact O-CB 3.43Å; A64-D68 PolarHBondContact O-N 2.88Å; A65-D68 PolarHBondContact O-N 3.42Å; F66-D68 VanDerWaalsContact C-N 3.3Å; F66-D68 PolarHBondContact O-N 3.39Å; D68-F71 PolarHBondContact O-N 3.13Å; D68-T72 WeakPolarHBondContact O-CB 3.42Å; D68-T72 PolarHBondContact O-N 3.36Å; D68-T72 PolarHBondContact O-OG1 3.41Å; D68-W79 PolarHBondContact OD2-NE1 2.88Å; D68-I142 HydrophobicContact CB-CB 4.4Å; D68-I142 HydrophobicContact CB-CG2 4.14Å; D68-I142 WeakPolarHBondContact OD2-CG2 3.49Å; D68-H143 WeakPolarHBondContact OD1-CA 3.48Å; D68-K144 VanDerWaalsContact CG-N 3.27Å; D68-K144 PolarHBondContact OD1-N 3.45Å; D68-K144 WeakPolarHBondContact OD2-CA 3.32Å; D68-K144 PolarHBondContact OD2-N 3.49Å; D68-G145 PolarHBondContact OD2-N 3.31Å
69	M	94.2	Very high	92.1	Very high	22 Å²	22	51.3 Å²	51.3	11%	0.108	27%	0.266	C	S	.	.	H	α-helix	trans	-54.9	-55.2	174.5	-175.4	-170.9	82.9	0	0	111.5	A65 F66 F71 T72 L73 W79	A65-M69 PolarHBondContact O-N 3.31Å; F66-M69 HydrophobicContact CD1-CE 3.77Å; F66-M69 HydrophobicContact CD1-SD 4.17Å; F66-M69 HydrophobicContact CE1-CE 4.27Å; F66-M69 HydrophobicContact CE1-SD 4.4Å; F66-M69 PolarHBondContact O-N 2.89Å; M69-F71 VanDerWaalsContact C-N 3.34Å; M69-F71 PolarHBondContact O-N 2.75Å; M69-T72 WeakPolarHBondContact O-CB 3.42Å; M69-T72 PolarHBondContact O-N 2.89Å; M69-T72 VanDerWaalsContact O-N 3.12Å; M69-L73 HydrophobicContact CE-CD1 4.35Å; M69-L73 HydrophobicContact CG-CD1 3.84Å; M69-L73 HydrophobicContact CG-CG 4.35Å; M69-L73 WeakPolarHBondContact O-CG 3.25Å; M69-L73 PolarHBondContact O-N 2.95Å; M69-L73 HydrophobicContact SD-CD1 4.5Å; M69-W79 VanDerWaalsContact CA-CD1 3.44Å; M69-W79 HydrophobicContact CB-CD2 3.77Å; M69-W79 HydrophobicContact CB-CE3 4.31Å; M69-W79 HydrophobicContact CB-CG 3.97Å; M69-W79 HydrophobicContact CB-CZ2 4.19Å; M69-W79 HydrophobicContact CG-CB 4.2Å; M69-W79 HydrophobicContact CG-CD2 3.57Å; M69-W79 HydrophobicContact CG-CE3 3.74Å; M69-W79 HydrophobicContact CG-CG 3.79Å; M69-W79 HydrophobicContact CG-CZ3 4.33Å; M69-W79 HydrophobicContact SD-CD2 4.47Å; M69-W79 HydrophobicContact SD-CE3 4.08Å; M69-W79 HydrophobicContact SD-CZ3 4.19Å
70	W	92.9	Very high	92.2	Very high	70 Å²	70	50.8 Å²	50.8	27%	0.265	26%	0.263	S	S	.	.	H	α-helix	trans	-64.3	-37.8	-178.7	-73	121.3	0	0	0	113.2	S28 F66 T72 L73 K74 Y111	S28-W70 WeakPolarHBondContact OG-CH2 3.41Å; S28-W70 WeakPolarHBondContact OG-CZ2 3.47Å; F66-W70 PolarHBondContact O-N 2.91Å; W70-T72 VanDerWaalsContact C-N 3.28Å; W70-T72 PolarHBondContact O-N 2.9Å; W70-L73 HydrophobicContact CE3-CD1 4.14Å; W70-L73 HydrophobicContact CZ3-CD1 4.04Å; W70-K74 VanDerWaalsContact O-CB 3.28Å; W70-K74 WeakPolarHBondContact O-CB 3.39Å; W70-K74 VanDerWaalsContact O-CG 3.23Å; W70-K74 WeakPolarHBondContact O-CG 3.45Å; W70-K74 PolarHBondContact O-N 2.97Å; W70-Y111 HydrophobicContact CE3-CE2 4.46Å; W70-Y111 HydrophobicContact CH2-CD2 4.19Å; W70-Y111 HydrophobicContact CH2-CE2 4.48Å; W70-Y111 HydrophobicContact CZ3-CD1 4.49Å; W70-Y111 AromaticContact CZ3-CD2 3.67Å; W70-Y111 HydrophobicContact CZ3-CD2 3.67Å; W70-Y111 HydrophobicContact CZ3-CE1 4.5Å; W70-Y111 AromaticContact CZ3-CE2 3.64Å; W70-Y111 HydrophobicContact CZ3-CE2 3.64Å; W70-Y111 HydrophobicContact CZ3-CG 4.1Å
71	F	93.4	Very high	92.3	Very high	115 Å²	115	48.4 Å²	48.4	50%	0.504	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-38	174.7	-179.6	-98.2	0	0	0	111.9	A67 D68 M69 K75	A67-F71 VanDerWaalsContact O-CB 3.26Å; A67-F71 WeakPolarHBondContact O-CB 3.44Å; A67-F71 PolarHBondContact O-N 3.26Å; D68-F71 PolarHBondContact O-N 3.13Å; M69-F71 VanDerWaalsContact C-N 3.34Å; M69-F71 PolarHBondContact O-N 2.75Å; F71-K75 HydrophobicContact CD1-CD 4.49Å; F71-K75 HydrophobicContact CE1-CD 4.05Å; F71-K75 HydrophobicContact CZ-CD 4.28Å; F71-K75 WeakPolarHBondContact O-CG 3.49Å
72	T	93.8	Very high	92.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-70.7	-51.3	178.5	-54.4	0	0	0	0	111	D68 M69 W70 K74 K75 E77 P78 W79 K144	D68-T72 WeakPolarHBondContact O-CB 3.42Å; D68-T72 PolarHBondContact O-N 3.36Å; D68-T72 PolarHBondContact O-OG1 3.41Å; M69-T72 WeakPolarHBondContact O-CB 3.42Å; M69-T72 PolarHBondContact O-N 2.89Å; M69-T72 VanDerWaalsContact O-N 3.12Å; W70-T72 VanDerWaalsContact C-N 3.28Å; W70-T72 PolarHBondContact O-N 2.9Å; T72-K74 PolarHBondContact O-N 3.04Å; T72-K75 WeakPolarHBondContact O-CB 3.49Å; T72-K75 PolarHBondContact O-N 2.95Å; T72-E77 HydrophobicContact CG2-CB 3.81Å; T72-E77 PolarHBondContact O-N 3.15Å; T72-P78 VanDerWaalsContact CG2-O 3.26Å; T72-P78 WeakPolarHBondContact CG2-O 3.3Å; T72-W79 HydrophobicContact CG2-CB 4.15Å; T72-K144 HydrophobicContact CG2-CB 4.39Å; T72-K144 HydrophobicContact CG2-CD 4.5Å; T72-K144 HydrophobicContact CG2-CG 4Å
73	L	93.9	Very high	92.6	Very high	2 Å²	2	49 Å²	49	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-39.5	-178.9	-66.7	175.9	0	0	0	112.7	M69 W70 K75 G76 W79 A99 Y111	M69-L73 HydrophobicContact CE-CD1 4.35Å; M69-L73 HydrophobicContact CG-CD1 3.84Å; M69-L73 HydrophobicContact CG-CG 4.35Å; M69-L73 WeakPolarHBondContact O-CG 3.25Å; M69-L73 PolarHBondContact O-N 2.95Å; M69-L73 HydrophobicContact SD-CD1 4.5Å; W70-L73 HydrophobicContact CE3-CD1 4.14Å; W70-L73 HydrophobicContact CZ3-CD1 4.04Å; L73-K75 PolarHBondContact O-N 3.49Å; L73-G76 PolarHBondContact O-N 3.32Å; L73-W79 HydrophobicContact CD2-CB 4.33Å; L73-W79 HydrophobicContact CG-CB 4.47Å; L73-A99 HydrophobicContact CD1-CB 4.05Å; L73-A99 HydrophobicContact CD2-CB 3.9Å; L73-A99 WeakPolarHBondContact CD2-O 3.38Å; L73-Y111 HydrophobicContact CB-CD1 3.89Å; L73-Y111 HydrophobicContact CB-CE1 3.69Å; L73-Y111 HydrophobicContact CD1-CD1 4.04Å; L73-Y111 HydrophobicContact CD1-CG 4.47Å; L73-Y111 HydrophobicContact CD2-CD1 4.45Å; L73-Y111 HydrophobicContact CG-CD1 4.36Å
74	K	91.8	Very high	92.8	Very high	146 Å²	146	40.7 Å²	40.7	64%	0.635	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.5	176.8	-74.6	179.3	178.6	-173.6	0	113.7	W70 T72 G76	W70-K74 VanDerWaalsContact O-CB 3.28Å; W70-K74 WeakPolarHBondContact O-CB 3.39Å; W70-K74 VanDerWaalsContact O-CG 3.23Å; W70-K74 WeakPolarHBondContact O-CG 3.45Å; W70-K74 PolarHBondContact O-N 2.97Å; T72-K74 PolarHBondContact O-N 3.04Å; K74-G76 VanDerWaalsContact C-N 3.26Å
75	K	90.8	Very high	93.1	Very high	126 Å²	126	38.4 Å²	38.4	55%	0.548	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2.3	172	-73.6	-176.2	171.4	-166.5	0	113.4	F71 T72 L73 E77	F71-K75 HydrophobicContact CD1-CD 4.49Å; F71-K75 HydrophobicContact CE1-CD 4.05Å; F71-K75 HydrophobicContact CZ-CD 4.28Å; F71-K75 WeakPolarHBondContact O-CG 3.49Å; T72-K75 WeakPolarHBondContact O-CB 3.49Å; T72-K75 PolarHBondContact O-N 2.95Å; L73-K75 PolarHBondContact O-N 3.49Å; K75-E77 VanDerWaalsContact C-N 3.31Å; K75-E77 HydrophobicContact CB-CG 4.26Å
76	G	90	Very high	93.4	Very high	17 Å²	17	39.5 Å²	39.5	18%	0.175	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	12.1	-175.8	0	0	0	0	0	113.3	L73 K74	L73-G76 PolarHBondContact O-N 3.32Å; K74-G76 VanDerWaalsContact C-N 3.26Å
77	E	91.5	Very high	93.7	Very high	56 Å²	56	40.4 Å²	40.4	26%	0.262	21%	0.207	S	C	.	.			trans	-104.8	148.6	-174.2	-60.6	178.9	136.8	0	0	111.7	T72 K75 K144	T72-E77 HydrophobicContact CG2-CB 3.81Å; T72-E77 PolarHBondContact O-N 3.15Å; K75-E77 VanDerWaalsContact C-N 3.31Å; K75-E77 HydrophobicContact CB-CG 4.26Å; E77-K144 IonicContact OE1-NZ 2.68Å; E77-K144 PolarHBondContact OE1-NZ 3.21Å; E77-K144 WeakPolarHBondContact OE2-CE 3.47Å; E77-K144 IonicContact OE2-NZ 3.66Å; E77-K144 PolarHBondContact OE2-NZ 3.16Å
78	P	93.5	Very high	93.8	Very high	61 Å²	61	41.9 Å²	41.9	40%	0.396	20%	0.201	S	C	.	.			trans	-69.5	149.2	174.5	30.6	-38	0	0	0	110.9	T72 A99 V100 L220	T72-P78 VanDerWaalsContact CG2-O 3.26Å; T72-P78 WeakPolarHBondContact CG2-O 3.3Å; P78-A99 CarbonylContact C-O 3.22Å; P78-A99 WeakPolarHBondContact CA-O 3.44Å; P78-V100 HydrophobicContact CB-CG1 3.96Å; P78-L220 HydrophobicContact CG-CD1 4.33Å
79	W	95.2	Very high	93.8	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.015	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.5	172.8	-177.7	91.4	0	0	0	110	D68 M69 T72 L73 V83 A97 A99 G145	D68-W79 PolarHBondContact OD2-NE1 2.88Å; M69-W79 VanDerWaalsContact CA-CD1 3.44Å; M69-W79 HydrophobicContact CB-CD2 3.77Å; M69-W79 HydrophobicContact CB-CE3 4.31Å; M69-W79 HydrophobicContact CB-CG 3.97Å; M69-W79 HydrophobicContact CB-CZ2 4.19Å; M69-W79 HydrophobicContact CG-CB 4.2Å; M69-W79 HydrophobicContact CG-CD2 3.57Å; M69-W79 HydrophobicContact CG-CE3 3.74Å; M69-W79 HydrophobicContact CG-CG 3.79Å; M69-W79 HydrophobicContact CG-CZ3 4.33Å; M69-W79 HydrophobicContact SD-CD2 4.47Å; M69-W79 HydrophobicContact SD-CE3 4.08Å; M69-W79 HydrophobicContact SD-CZ3 4.19Å; T72-W79 HydrophobicContact CG2-CB 4.15Å; L73-W79 HydrophobicContact CD2-CB 4.33Å; L73-W79 HydrophobicContact CG-CB 4.47Å; W79-V83 HydrophobicContact CH2-CG2 3.81Å; W79-V83 HydrophobicContact CZ3-CG2 3.99Å; W79-A97 HydrophobicContact CZ3-CB 4.06Å; W79-A99 PolarHBondContact N-O 3.43Å; W79-A99 PolarHBondContact O-N 3.34Å; W79-G145 VanDerWaalsContact NE1-N 3.11Å
80	S	94.6	Very high	93.7	Very high	57 Å²	57	43.8 Å²	43.8	40%	0.399	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.6	176.2	-68.5	0	0	0	0	110.5	A97 N98 G145	S80-A97 VanDerWaalsContact CA-O 3.28Å; S80-A97 WeakPolarHBondContact CA-O 3.39Å; S80-N98 WeakPolarHBondContact CB-OD1 3.38Å; S80-N98 PolarHBondContact OG-OD1 2.91Å; S80-G145 WeakPolarHBondContact O-CA 3.42Å
81	G	94	Very high	93.9	Very high	6 Å²	6	41.4 Å²	41.4	6%	0.062	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	166.4	-180	0	0	0	0	0	113.2	A97	G81-A97 PolarHBondContact N-O 3.33Å; G81-A97 PolarHBondContact O-N 3.3Å
82	I	94.9	Very high	94	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.036	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	134.2	175.8	-60.7	-53.8	0	0	0	110.1	W94 V95 R96 A118 E122 V126 Y130	I82-W94 HydrophobicContact CG2-CE3 3.44Å; I82-W94 VanDerWaalsContact CG2-CE3 3.44Å; I82-W94 HydrophobicContact CG2-CZ3 3.72Å; I82-V95 CarbonylContact C-O 3.59Å; I82-V95 WeakPolarHBondContact CA-O 3.19Å; I82-R96 HydrophobicContact CD1-CB 3.99Å; I82-R96 HydrophobicContact CD1-CG 4.41Å; I82-A118 HydrophobicContact CD1-CB 3.74Å; I82-A118 HydrophobicContact CG2-CB 4.29Å; I82-E122 HydrophobicContact CD1-CB 4.05Å; I82-E122 HydrophobicContact CG1-CB 4.12Å; I82-V126 HydrophobicContact CB-CG1 4.13Å; I82-V126 HydrophobicContact CB-CG2 3.91Å; I82-V126 HydrophobicContact CG1-CG1 4.17Å; I82-V126 HydrophobicContact CG1-CG2 4.47Å; I82-V126 HydrophobicContact CG2-CG2 3.59Å; I82-Y130 PolarHBondContact O-OH 3.28Å
83	V	95	Very high	94.1	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	129.3	-179.1	-179.2	0	0	0	0	109.5	M61 F66 W79 N85 V95 A97	M61-V83 HydrophobicContact CE-CB 4.35Å; M61-V83 HydrophobicContact CE-CG1 4.18Å; M61-V83 HydrophobicContact CE-CG2 4.29Å; M61-V83 HydrophobicContact CG-CG1 4.47Å; M61-V83 HydrophobicContact SD-CG1 4.46Å; F66-V83 HydrophobicContact CZ-CG1 4.19Å; W79-V83 HydrophobicContact CH2-CG2 3.81Å; W79-V83 HydrophobicContact CZ3-CG2 3.99Å; V83-N85 VanDerWaalsContact CG1-OD1 3.29Å; V83-N85 WeakPolarHBondContact CG1-OD1 3.37Å; V83-V95 HydrophobicContact CB-CG2 3.99Å; V83-V95 PolarHBondContact N-O 3.44Å; V83-V95 WeakPolarHBondContact O-CG2 3.39Å; V83-V95 PolarHBondContact O-N 3.19Å; V83-A97 HydrophobicContact CB-CB 4.38Å; V83-A97 HydrophobicContact CG2-CB 3.76Å
84	K	95.7	Very high	94.3	Very high	3 Å²	3	37 Å²	37	1%	0.013	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.8	166.1	-163.9	-180	-177.1	176	0	108	H58 D60 M61 H92 W94	H58-K84 HydrophobicContact CB-CB 3.99Å; H58-K84 HydrophobicContact CB-CD 4.1Å; H58-K84 HydrophobicContact CB-CG 3.77Å; H58-K84 WeakPolarHBondContact CB-O 3.48Å; H58-K84 PolarHBondContact N-O 3.03Å; D60-K84 HydrophobicContact CB-CD 4.24Å; D60-K84 IonicContact OD2-NZ 2.78Å; D60-K84 PolarHBondContact OD2-NZ 3.36Å; M61-K84 HydrophobicContact CG-CB 3.9Å; M61-K84 WeakPolarHBondContact CG-O 3.27Å; M61-K84 HydrophobicContact SD-CB 3.8Å; M61-K84 PolarHBondContact SD-N 2.98Å; K84-H92 WeakPolarHBondContact CE-CD2 3.4Å; K84-H92 WeakPolarHBondContact CE-NE2 3.48Å; K84-H92 HydrophobicContact CG-CB 4.16Å; K84-W94 HydrophobicContact CB-CD2 4Å; K84-W94 HydrophobicContact CB-CE3 3.76Å; K84-W94 HydrophobicContact CB-CH2 3.74Å; K84-W94 HydrophobicContact CB-CZ2 3.93Å; K84-W94 HydrophobicContact CB-CZ3 3.63Å; K84-W94 HydrophobicContact CD-CH2 3.97Å; K84-W94 HydrophobicContact CD-CZ2 3.51Å; K84-W94 HydrophobicContact CG-CD2 4.05Å; K84-W94 HydrophobicContact CG-CE3 4.33Å; K84-W94 HydrophobicContact CG-CH2 4.11Å; K84-W94 HydrophobicContact CG-CZ2 3.76Å; K84-W94 HydrophobicContact CG-CZ3 4.37Å
85	N	95.8	Very high	94.5	Very high	4 Å²	4	30 Å²	30	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	156.2	174.7	-74.7	-30.5	0	0	0	110.5	V56 V83 H92 Y93	V56-N85 CarbonylContact O-C 3.5Å; V56-N85 VanDerWaalsContact O-CA 3.23Å; V56-N85 WeakPolarHBondContact O-CA 3.44Å; V56-N85 WeakPolarHBondContact O-CB 3.44Å; V56-N85 PolarHBondContact O-OD1 3.02Å; V83-N85 VanDerWaalsContact CG1-OD1 3.29Å; V83-N85 WeakPolarHBondContact CG1-OD1 3.37Å; N85-H92 CarbonylContact O-C 3.59Å; N85-H92 WeakPolarHBondContact O-CA 3.41Å; N85-H92 WeakPolarHBondContact O-CB 3.45Å; N85-Y93 HydrophobicContact CB-CD1 4.14Å; N85-Y93 HydrophobicContact CB-CD2 4.17Å; N85-Y93 HydrophobicContact CB-CE1 3.59Å; N85-Y93 HydrophobicContact CB-CE2 3.66Å; N85-Y93 HydrophobicContact CB-CG 4.41Å; N85-Y93 PolarHBondContact N-O 3.47Å; N85-Y93 PolarHBondContact O-N 3.23Å
86	R	95.4	Very high	94.7	Very high	23 Å²	23	27.8 Å²	27.8	9%	0.087	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.7	-179.1	-174.8	-173.3	65.3	87.4	6.4	109.1	Y43 M55 V56 H58 D91	Y43-R86 PolarHBondContact OH-NH2 3.28Å; M55-R86 PolarHBondContact O-NH2 3.44Å; V56-R86 PolarHBondContact O-N 3.38Å; H58-R86 HydrophobicContact CB-CB 4.33Å; R86-D91 CarbonylContact C-O 3.51Å; R86-D91 WeakPolarHBondContact CA-O 3.37Å
87	R	96	Very high	95	Very high	48 Å²	48	27.2 Å²	27.2	18%	0.181	14%	0.136	C	C	.	.			trans	-77.3	166	171.4	-53.7	-170.6	88.1	-127.2	-4.7	110.6	T12 Q39 V40 S41 N89 G90 D91 Y93	T12-R87 WeakPolarHBondContact OG1-CD 3.32Å; Q39-R87 PolarHBondContact O-NH2 3.08Å; V40-R87 VanDerWaalsContact O-CZ 3.24Å; V40-R87 PolarHBondContact O-NE 2.8Å; V40-R87 PolarHBondContact O-NH2 2.92Å; S41-R87 CarbonylContact O-C 3.6Å; S41-R87 WeakPolarHBondContact O-CA 3.48Å; R87-N89 VanDerWaalsContact C-N 3.29Å; R87-N89 VanDerWaalsContact CB-OD1 3.27Å; R87-N89 WeakPolarHBondContact CB-OD1 3.46Å; R87-N89 PolarHBondContact O-N 3.37Å; R87-G90 PolarHBondContact O-N 3.29Å; R87-G90 VanDerWaalsContact O-N 3.1Å; R87-D91 HydrophobicContact CB-CB 4.49Å; R87-D91 HydrophobicContact CG-CB 4.36Å; R87-D91 PolarHBondContact N-O 3.43Å; R87-Y93 HydrophobicContact CG-CD1 3.62Å; R87-Y93 HydrophobicContact CG-CE1 3.9Å
88	K	94	Very high	95.2	Very high	91 Å²	91	27.1 Å²	27.1	40%	0.396	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-39.3	176.4	-173.3	177	-174.6	175.9	0	113.2	S41 G42 Y43 E47 G90	S41-K88 PolarHBondContact O-N 2.96Å; G42-K88 WeakPolarHBondContact O-CB 3.4Å; G42-K88 WeakPolarHBondContact O-CD 3.47Å; Y43-K88 HydrophobicContact CD1-CB 4.06Å; Y43-K88 HydrophobicContact CD1-CD 3.87Å; Y43-K88 HydrophobicContact CD1-CG 3.93Å; Y43-K88 HydrophobicContact CD2-CB 4.08Å; Y43-K88 HydrophobicContact CE1-CB 3.89Å; Y43-K88 HydrophobicContact CE1-CD 4.16Å; Y43-K88 HydrophobicContact CE1-CG 3.71Å; Y43-K88 HydrophobicContact CE2-CB 3.91Å; Y43-K88 HydrophobicContact CG-CB 4.15Å; Y43-K88 HydrophobicContact CG-CD 4.38Å; Y43-K88 HydrophobicContact CG-CG 4.48Å; E47-K88 WeakPolarHBondContact OE1-CE 3.24Å; E47-K88 IonicContact OE1-NZ 2.92Å; E47-K88 PolarHBondContact OE1-NZ 3.46Å; E47-K88 IonicContact OE2-NZ 3.99Å; E47-K88 PolarHBondContact OE2-NZ 3.47Å; K88-G90 PolarHBondContact O-N 3.18Å
89	N	93	Very high	95.3	Very high	76 Å²	76	24.5 Å²	24.5	41%	0.406	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-2.1	179.1	70.9	-14.3	0	0	0	114.2	Y6 R87 D91	Y6-N89 WeakPolarHBondContact CE1-O 3.45Å; R87-N89 VanDerWaalsContact C-N 3.29Å; R87-N89 VanDerWaalsContact CB-OD1 3.27Å; R87-N89 WeakPolarHBondContact CB-OD1 3.46Å; R87-N89 PolarHBondContact O-N 3.37Å; N89-D91 PolarHBondContact ND2-OD2 2.88Å; N89-D91 WeakPolarHBondContact OD1-CB 3.39Å; N89-D91 PolarHBondContact OD1-N 2.89Å; N89-D91 VanDerWaalsContact OD1-N 3.08Å
90	G	93.1	Very high	95.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	96.2	-17.4	-179.1	0	0	0	0	0	114.7	Y6 A7 T8 R87 K88	Y6-G90 VanDerWaalsContact O-CA 3.31Å; Y6-G90 WeakPolarHBondContact O-CA 3.29Å; A7-G90 CarbonylContact C-O 3.55Å; A7-G90 VanDerWaalsContact CA-O 3.31Å; A7-G90 WeakPolarHBondContact CA-O 3.42Å; T8-G90 PolarHBondContact N-O 3.12Å; R87-G90 PolarHBondContact O-N 3.29Å; R87-G90 VanDerWaalsContact O-N 3.1Å; K88-G90 PolarHBondContact O-N 3.18Å
91	D	95.8	Very high	95.3	Very high	21 Å²	21	23.1 Å²	23.1	11%	0.112	11%	0.11	C	C	.	.			trans	-60.7	167.2	173.4	-59.7	-17.3	0	0	0	111.1	T8 R86 R87 N89	T8-D91 WeakPolarHBondContact CG2-OD1 3.47Å; T8-D91 VanDerWaalsContact OG1-CA 3.24Å; T8-D91 WeakPolarHBondContact OG1-CA 3.38Å; T8-D91 PolarHBondContact OG1-N 3.44Å; T8-D91 PolarHBondContact OG1-OD1 3.42Å; R86-D91 CarbonylContact C-O 3.51Å; R86-D91 WeakPolarHBondContact CA-O 3.37Å; R87-D91 HydrophobicContact CB-CB 4.49Å; R87-D91 HydrophobicContact CG-CB 4.36Å; R87-D91 PolarHBondContact N-O 3.43Å; N89-D91 PolarHBondContact ND2-OD2 2.88Å; N89-D91 WeakPolarHBondContact OD1-CB 3.39Å; N89-D91 PolarHBondContact OD1-N 2.89Å; N89-D91 VanDerWaalsContact OD1-N 3.08Å
92	H	96.2	Very high	95.2	Very high	10 Å²	10	24 Å²	24	5%	0.046	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161	-179.4	71.1	-93.5	0	0	0	112.4	Q9 Q10 N11 T12 K84 N85 W94	Q9-H92 PolarHBondContact O-CE1 3.31Å; Q10-H92 PolarHBondContact O-N 3.14Å; Q10-H92 PolarHBondContact O-ND1 3.29Å; Q10-H92 VanDerWaalsContact O-ND1 3.11Å; N11-H92 CarbonylContact C-O 3.53Å; N11-H92 WeakPolarHBondContact CA-O 3.42Å; N11-H92 PolarHBondContact OD1-O 3.32Å; T12-H92 PolarHBondContact N-O 3.42Å; K84-H92 WeakPolarHBondContact CE-CD2 3.4Å; K84-H92 WeakPolarHBondContact CE-NE2 3.48Å; K84-H92 HydrophobicContact CG-CB 4.16Å; N85-H92 CarbonylContact O-C 3.59Å; N85-H92 WeakPolarHBondContact O-CA 3.41Å; N85-H92 WeakPolarHBondContact O-CB 3.45Å; H92-W94 AromaticContact CD2-CD1 3.74Å; H92-W94 AromaticContact CD2-NE1 3.44Å; H92-W94 PolarHBondContact CD2-NE1 3.06Å; H92-W94 AromaticContact NE2-NE1 3.43Å; H92-W94 PolarHBondContact NE2-NE1 2.81Å
93	Y	96.4	Very high	95	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	150.2	173.3	59.8	-81.1	0	0	0	108.9	T12 L14 L20 V40 N85 R87 V95	T12-Y93 WeakPolarHBondContact O-CB 3.49Å; L14-Y93 HydrophobicContact CD1-CD2 4.04Å; L14-Y93 HydrophobicContact CD2-CD2 4.42Å; L20-Y93 HydrophobicContact CD1-CD2 4.26Å; L20-Y93 HydrophobicContact CD1-CE2 3.59Å; V40-Y93 HydrophobicContact CG1-CD1 4.12Å; V40-Y93 HydrophobicContact CG1-CD2 3.85Å; V40-Y93 HydrophobicContact CG1-CE1 4.07Å; V40-Y93 HydrophobicContact CG1-CE2 3.78Å; V40-Y93 HydrophobicContact CG1-CG 4.01Å; N85-Y93 HydrophobicContact CB-CD1 4.14Å; N85-Y93 HydrophobicContact CB-CD2 4.17Å; N85-Y93 HydrophobicContact CB-CE1 3.59Å; N85-Y93 HydrophobicContact CB-CE2 3.66Å; N85-Y93 HydrophobicContact CB-CG 4.41Å; N85-Y93 PolarHBondContact N-O 3.47Å; N85-Y93 PolarHBondContact O-N 3.23Å; R87-Y93 HydrophobicContact CG-CD1 3.62Å; R87-Y93 HydrophobicContact CG-CE1 3.9Å; Y93-V95 HydrophobicContact CD2-CG1 3.73Å; Y93-V95 HydrophobicContact CE2-CG1 3.88Å
94	W	96.7	Very high	94.5	Very high	13 Å²	13	29.5 Å²	29.5	5%	0.049	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.7	-178	-70.3	93.9	0	0	0	110.9	I82 K84 H92 A118 I123 V126 E127 Y130	I82-W94 HydrophobicContact CG2-CE3 3.44Å; I82-W94 VanDerWaalsContact CG2-CE3 3.44Å; I82-W94 HydrophobicContact CG2-CZ3 3.72Å; K84-W94 HydrophobicContact CB-CD2 4Å; K84-W94 HydrophobicContact CB-CE3 3.76Å; K84-W94 HydrophobicContact CB-CH2 3.74Å; K84-W94 HydrophobicContact CB-CZ2 3.93Å; K84-W94 HydrophobicContact CB-CZ3 3.63Å; K84-W94 HydrophobicContact CD-CH2 3.97Å; K84-W94 HydrophobicContact CD-CZ2 3.51Å; K84-W94 HydrophobicContact CG-CD2 4.05Å; K84-W94 HydrophobicContact CG-CE3 4.33Å; K84-W94 HydrophobicContact CG-CH2 4.11Å; K84-W94 HydrophobicContact CG-CZ2 3.76Å; K84-W94 HydrophobicContact CG-CZ3 4.37Å; H92-W94 AromaticContact CD2-CD1 3.74Å; H92-W94 AromaticContact CD2-NE1 3.44Å; H92-W94 PolarHBondContact CD2-NE1 3.06Å; H92-W94 AromaticContact NE2-NE1 3.43Å; H92-W94 PolarHBondContact NE2-NE1 2.81Å; W94-A118 HydrophobicContact CB-CB 3.94Å; W94-A118 PolarHBondContact O-N 3.14Å; W94-I123 HydrophobicContact CB-CD1 3.57Å; W94-I123 HydrophobicContact CB-CG1 3.76Å; W94-I123 HydrophobicContact CD2-CG1 4.1Å; W94-I123 HydrophobicContact CD2-CG2 4.09Å; W94-I123 HydrophobicContact CG-CD1 3.76Å; W94-I123 HydrophobicContact CG-CG1 3.79Å; W94-I123 HydrophobicContact CG-CG2 4.27Å; W94-I123 HydrophobicContact CZ2-CG2 4.17Å; W94-V126 HydrophobicContact CH2-CG2 4.28Å; W94-V126 HydrophobicContact CZ3-CG2 3.83Å; W94-E127 HydrophobicContact CH2-CB 4.35Å; W94-E127 HydrophobicContact CH2-CG 4.48Å; W94-E127 HydrophobicContact CZ2-CB 4.4Å; W94-E127 HydrophobicContact CZ2-CG 4.28Å; W94-Y130 HydrophobicContact CH2-CD2 4.2Å; W94-Y130 HydrophobicContact CZ3-CD2 4.17Å; W94-Y130 HydrophobicContact CZ3-CE2 4.05Å
95	V	96.8	Very high	94	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149.2	-179.6	-65.4	0	0	0	0	111.6	L14 L20 I82 V83 Y93 A97 R115 T116	L14-V95 HydrophobicContact CD1-CG1 3.73Å; L20-V95 HydrophobicContact CD1-CG1 3.93Å; I82-V95 CarbonylContact C-O 3.59Å; I82-V95 WeakPolarHBondContact CA-O 3.19Å; V83-V95 HydrophobicContact CB-CG2 3.99Å; V83-V95 PolarHBondContact N-O 3.44Å; V83-V95 WeakPolarHBondContact O-CG2 3.39Å; V83-V95 PolarHBondContact O-N 3.19Å; Y93-V95 HydrophobicContact CD2-CG1 3.73Å; Y93-V95 HydrophobicContact CE2-CG1 3.88Å; V95-A97 HydrophobicContact CG2-CB 4.43Å; V95-A97 PolarHBondContact O-N 2.98Å; V95-R115 HydrophobicContact CB-CB 3.97Å; V95-R115 HydrophobicContact CB-CG 4.38Å; V95-R115 HydrophobicContact CG1-CB 4.17Å; V95-R115 HydrophobicContact CG2-CB 4.29Å; V95-R115 HydrophobicContact CG2-CG 4.14Å; V95-T116 CarbonylContact C-O 3.54Å; V95-T116 WeakPolarHBondContact CA-O 3.39Å; V95-T116 WeakPolarHBondContact CB-O 3.49Å
96	R	95.6	Very high	93.5	Very high	80 Å²	80	41.3 Å²	41.3	30%	0.302	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	101.9	159.1	-178.4	158.3	-63.9	-97.7	-23.5	108	I82 N98 R115 T116 E122	I82-R96 HydrophobicContact CD1-CB 3.99Å; I82-R96 HydrophobicContact CD1-CG 4.41Å; R96-N98 PolarHBondContact O-ND2 3.27Å; R96-R115 WeakPolarHBondContact O-CA 3.39Å; R96-T116 PolarHBondContact N-O 2.98Å; R96-T116 PolarHBondContact O-N 2.86Å; R96-T116 VanDerWaalsContact O-N 3.17Å; R96-E122 IonicContact CZ-OE1 3.25Å; R96-E122 IonicContact CZ-OE2 3.98Å; R96-E122 VanDerWaalsContact CZ-OE2 3.27Å; R96-E122 IonicContact NE-OE1 2.72Å; R96-E122 PolarHBondContact NE-OE1 3.24Å; R96-E122 IonicContact NE-OE2 3.5Å; R96-E122 PolarHBondContact NE-OE2 3.41Å; R96-E122 IonicContact NH1-OE1 2.61Å; R96-E122 IonicContact NH2-OE1 3.04Å; R96-E122 PolarHBondContact NH2-OE1 3.12Å; R96-E122 IonicContact NH2-OE2 3.97Å; R96-E122 PolarHBondContact NH2-OE2 2.99Å
97	A	95.9	Very high	93.2	Very high	4 Å²	4	48.1 Å²	48.1	3%	0.033	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125	-179.5	0	0	0	0	0	110.2	W79 S80 G81 V83 V95 R115	W79-A97 HydrophobicContact CZ3-CB 4.06Å; S80-A97 VanDerWaalsContact CA-O 3.28Å; S80-A97 WeakPolarHBondContact CA-O 3.39Å; G81-A97 PolarHBondContact N-O 3.33Å; G81-A97 PolarHBondContact O-N 3.3Å; V83-A97 HydrophobicContact CB-CB 4.38Å; V83-A97 HydrophobicContact CG2-CB 3.76Å; V95-A97 HydrophobicContact CG2-CB 4.43Å; V95-A97 PolarHBondContact O-N 2.98Å; A97-R115 HydrophobicContact CB-CG 4Å
98	N	95.4	Very high	93.1	Very high	55 Å²	55	48 Å²	48	29%	0.294	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	104	173.3	-55.6	-73.6	0	0	0	107.2	S80 R96 S113 I114	S80-N98 WeakPolarHBondContact CB-OD1 3.38Å; S80-N98 PolarHBondContact OG-OD1 2.91Å; R96-N98 PolarHBondContact O-ND2 3.27Å; N98-S113 VanDerWaalsContact O-CA 3.3Å; N98-S113 WeakPolarHBondContact O-CA 3.47Å; N98-I114 WeakPolarHBondContact CB-O 3.43Å; N98-I114 PolarHBondContact N-O 2.9Å; N98-I114 PolarHBondContact ND2-O 2.92Å; N98-I114 PolarHBondContact O-N 3.47Å
99	A	95.7	Very high	93	Very high	6 Å²	6	46.4 Å²	46.4	5%	0.05	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.2	-177.8	0	0	0	0	0	110.6	L73 P78 W79 M112	L73-A99 HydrophobicContact CD1-CB 4.05Å; L73-A99 HydrophobicContact CD2-CB 3.9Å; L73-A99 WeakPolarHBondContact CD2-O 3.38Å; P78-A99 CarbonylContact C-O 3.22Å; P78-A99 WeakPolarHBondContact CA-O 3.44Å; W79-A99 PolarHBondContact N-O 3.43Å; W79-A99 PolarHBondContact O-N 3.34Å; A99-M112 CarbonylContact C-O 3.45Å; A99-M112 WeakPolarHBondContact CA-O 3.45Å
100	V	94.1	Very high	93	Very high	31 Å²	31	42.9 Å²	42.9	19%	0.188	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.9	178.6	-62.1	0	0	0	0	110.3	P78 M112	P78-V100 HydrophobicContact CB-CG1 3.96Å; V100-M112 HydrophobicContact CG2-CB 3.99Å; V100-M112 HydrophobicContact CG2-CG 4.48Å; V100-M112 HydrophobicContact CG2-SD 4.44Å; V100-M112 PolarHBondContact N-O 3.15Å; V100-M112 PolarHBondContact O-N 2.71Å
101	P	95.3	Very high	93.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	135.4	167.6	26.3	-25.4	0	0	0	109.4	I108 Y111 T224	P101-I108 HydrophobicContact CB-CD1 4.05Å; P101-I108 HydrophobicContact CB-CG1 4.17Å; P101-I108 HydrophobicContact CB-CG2 3.95Å; P101-Y111 HydrophobicContact CB-CD1 4.17Å; P101-Y111 HydrophobicContact CB-CE1 4.2Å; P101-T224 HydrophobicContact CG-CG2 3.94Å; P101-T224 WeakPolarHBondContact O-CA 3.45Å; P101-T224 VanDerWaalsContact O-CB 3.32Å; P101-T224 WeakPolarHBondContact O-CB 3.45Å; P101-T224 WeakPolarHBondContact O-CG2 3.5Å
102	M	92.6	Very high	93.1	Very high	24 Å²	24	44.1 Å²	44.1	12%	0.118	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.1	172.2	-61.7	170.9	64.5	0	0	107.9	T23 I108 S109 G110 M112 V504	T23-M102 HydrophobicContact CG2-SD 3.77Å; M102-I108 CarbonylContact O-C 3.58Å; M102-I108 WeakPolarHBondContact O-CA 3.5Å; M102-S109 PolarHBondContact O-N 2.99Å; M102-S109 PolarHBondContact O-OG 3.03Å; M102-G110 PolarHBondContact N-O 3.24Å; M102-M112 HydrophobicContact CE-CE 4.4Å; M102-M112 HydrophobicContact CG-CB 3.8Å; M102-M112 HydrophobicContact SD-CB 3.88Å; M102-M112 HydrophobicContact SD-CE 4.38Å; M102-V504 HydrophobicContact CE-CG1 4.2Å; M102-V504 WeakPolarHBondContact CE-O 3.4Å
103	V	90.3	Very high	93	Very high	11 Å²	11	44.1 Å²	44.1	7%	0.067	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.5	-176.5	179.7	0	0	0	0	109.9	K107 I108 T224 E226	V103-K107 CarbonylContact C-O 3.53Å; V103-K107 WeakPolarHBondContact CA-O 3.46Å; V103-I108 HydrophobicContact CG2-CG1 4.24Å; V103-T224 HydrophobicContact CG2-CG2 4.38Å; V103-T224 PolarHBondContact N-O 2.96Å; V103-E226 HydrophobicContact CB-CB 4.04Å; V103-E226 HydrophobicContact CG1-CB 3.88Å; V103-E226 HydrophobicContact CG1-CG 3.83Å
104	R	84.9	Confident	92.9	Very high	120 Å²	120	47.4 Å²	47.4	45%	0.453	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.6	173.8	-61.2	-65.3	-173.3	-135.4	-0	107.9	G106 K107 V504	R104-G106 PolarHBondContact O-N 3.01Å; R104-G106 VanDerWaalsContact O-N 3.14Å; R104-K107 PolarHBondContact N-O 3.45Å; R104-K107 PolarHBondContact O-N 3.49Å; R104-K107 VanDerWaalsContact O-O 3.05Å; R104-V504 PolarHBondContact NH2-O 2.84Å
105	E	84.2	Confident	92.9	Very high	200 Å²	200	47.4 Å²	47.4	94%	0.935	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	37.2	179.7	-56	-178.3	169.9	0	0	113.8	K107	E105-K107 PolarHBondContact O-N 3.04Å
106	G	85.6	Confident	92.9	Very high	55 Å²	55	49.8 Å²	49.8	57%	0.567	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	5.2	179.8	0	0	0	0	0	115.2	R104	R104-G106 PolarHBondContact O-N 3.01Å; R104-G106 VanDerWaalsContact O-N 3.14Å
107	K	90.1	Very high	92.8	Very high	165 Å²	165	49.5 Å²	49.5	72%	0.717	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.8	174.8	-65.2	178.4	-175.6	171.3	0	110.4	V103 R104 E105 S109	V103-K107 CarbonylContact C-O 3.53Å; V103-K107 WeakPolarHBondContact CA-O 3.46Å; R104-K107 PolarHBondContact N-O 3.45Å; R104-K107 PolarHBondContact O-N 3.49Å; R104-K107 VanDerWaalsContact O-O 3.05Å; E105-K107 PolarHBondContact O-N 3.04Å; K107-S109 PolarHBondContact O-N 3.32Å
108	I	92.6	Very high	92.8	Very high	47 Å²	47	49.4 Å²	49.4	24%	0.241	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.7	170.1	-56.5	176.4	0	0	0	107.1	L26 P101 M102 V103 G110 Y111	L26-I108 HydrophobicContact CD2-CB 4.19Å; L26-I108 HydrophobicContact CD2-CG2 3.72Å; L26-I108 WeakPolarHBondContact CD2-O 3.45Å; P101-I108 HydrophobicContact CB-CD1 4.05Å; P101-I108 HydrophobicContact CB-CG1 4.17Å; P101-I108 HydrophobicContact CB-CG2 3.95Å; M102-I108 CarbonylContact O-C 3.58Å; M102-I108 WeakPolarHBondContact O-CA 3.5Å; V103-I108 HydrophobicContact CG2-CG1 4.24Å; I108-G110 WeakPolarHBondContact CG2-O 3.36Å; I108-Y111 HydrophobicContact CG2-CE1 4.09Å
109	S	91.8	Very high	92.7	Very high	57 Å²	57	49.8 Å²	49.8	40%	0.399	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-19	176.6	62.5	0	0	0	0	112.5	M102 K107	M102-S109 PolarHBondContact O-N 2.99Å; M102-S109 PolarHBondContact O-OG 3.03Å; K107-S109 PolarHBondContact O-N 3.32Å
110	G	94.5	Very high	92.6	Very high	2 Å²	2	54.7 Å²	54.7	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174	-165.8	-176.5	0	0	0	0	0	111.8	T24 M102 I108	T24-G110 CarbonylContact O-C 3.55Å; T24-G110 WeakPolarHBondContact O-CA 3.3Å; M102-G110 PolarHBondContact N-O 3.24Å; I108-G110 WeakPolarHBondContact CG2-O 3.36Å
111	Y	95.5	Very high	92.6	Very high	18 Å²	18	61 Å²	61	7%	0.071	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.8	179.2	-53.7	-77.4	0	0	0	110.5	T23 T24 W70 L73 P101 I108	T23-Y111 CarbonylContact C-O 3.59Å; T23-Y111 WeakPolarHBondContact CA-O 3.43Å; T24-Y111 PolarHBondContact N-O 2.81Å; T24-Y111 PolarHBondContact O-N 3.39Å; W70-Y111 HydrophobicContact CE3-CE2 4.46Å; W70-Y111 HydrophobicContact CH2-CD2 4.19Å; W70-Y111 HydrophobicContact CH2-CE2 4.48Å; W70-Y111 HydrophobicContact CZ3-CD1 4.49Å; W70-Y111 AromaticContact CZ3-CD2 3.67Å; W70-Y111 HydrophobicContact CZ3-CD2 3.67Å; W70-Y111 HydrophobicContact CZ3-CE1 4.5Å; W70-Y111 AromaticContact CZ3-CE2 3.64Å; W70-Y111 HydrophobicContact CZ3-CE2 3.64Å; W70-Y111 HydrophobicContact CZ3-CG 4.1Å; L73-Y111 HydrophobicContact CB-CD1 3.89Å; L73-Y111 HydrophobicContact CB-CE1 3.69Å; L73-Y111 HydrophobicContact CD1-CD1 4.04Å; L73-Y111 HydrophobicContact CD1-CG 4.47Å; L73-Y111 HydrophobicContact CD2-CD1 4.45Å; L73-Y111 HydrophobicContact CG-CD1 4.36Å; P101-Y111 HydrophobicContact CB-CD1 4.17Å; P101-Y111 HydrophobicContact CB-CE1 4.2Å; I108-Y111 HydrophobicContact CG2-CE1 4.09Å
112	M	94.2	Very high	92.4	Very high	28 Å²	28	63.2 Å²	63.2	14%	0.138	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142	175.1	176.4	-174.4	-79.2	0	0	109.3	M21 T23 A99 V100 M102 I114 V504	M21-M112 HydrophobicContact CE-CE 3.87Å; M21-M112 HydrophobicContact CE-CG 3.76Å; M21-M112 HydrophobicContact CE-SD 3.48Å; M21-M112 WeakPolarHBondContact CE-SD 3.43Å; M21-M112 HydrophobicContact SD-CG 3.49Å; M21-M112 WeakPolarHBondContact SD-CG 3.47Å; M21-M112 HydrophobicContact SD-SD 4.08Å; T23-M112 HydrophobicContact CG2-CB 3.82Å; T23-M112 HydrophobicContact CG2-CE 4.07Å; T23-M112 HydrophobicContact CG2-CG 3.89Å; A99-M112 CarbonylContact C-O 3.45Å; A99-M112 WeakPolarHBondContact CA-O 3.45Å; V100-M112 HydrophobicContact CG2-CB 3.99Å; V100-M112 HydrophobicContact CG2-CG 4.48Å; V100-M112 HydrophobicContact CG2-SD 4.44Å; V100-M112 PolarHBondContact N-O 3.15Å; V100-M112 PolarHBondContact O-N 2.71Å; M102-M112 HydrophobicContact CE-CE 4.4Å; M102-M112 HydrophobicContact CG-CB 3.8Å; M102-M112 HydrophobicContact SD-CB 3.88Å; M102-M112 HydrophobicContact SD-CE 4.38Å; M112-I114 HydrophobicContact SD-CD1 4.46Å; M112-V504 HydrophobicContact CE-CG1 3.74Å
113	S	95.1	Very high	92.5	Very high	11 Å²	11	63 Å²	63	8%	0.077	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	115.3	173.2	-176.6	0	0	0	0	111	S22 N98 R115	S22-S113 PolarHBondContact N-O 3.35Å; S22-S113 PolarHBondContact O-N 3.47Å; N98-S113 VanDerWaalsContact O-CA 3.3Å; N98-S113 WeakPolarHBondContact O-CA 3.47Å; S113-R115 PolarHBondContact OG-NE 3.02Å; S113-R115 PolarHBondContact OG-NH2 2.87Å; S113-R115 VanDerWaalsContact OG-NH2 3.15Å
114	I	94.7	Very high	92.6	Very high	69 Å²	69	65.6 Å²	65.6	35%	0.354	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.9	170.7	-59.6	171	0	0	0	107.8	T19 M21 N98 M112	T19-I114 HydrophobicContact CG2-CG2 3.88Å; M21-I114 HydrophobicContact CE-CD1 3.68Å; M21-I114 HydrophobicContact CE-CG1 3.31Å; M21-I114 HydrophobicContact SD-CG1 3.56Å; M21-I114 VanDerWaalsContact SD-CG1 3.56Å; N98-I114 WeakPolarHBondContact CB-O 3.43Å; N98-I114 PolarHBondContact N-O 2.9Å; N98-I114 PolarHBondContact ND2-O 2.92Å; N98-I114 PolarHBondContact O-N 3.47Å; M112-I114 HydrophobicContact SD-CD1 4.46Å
115	R	96.8	Very high	92.7	Very high	12 Å²	12	63.2 Å²	63.2	5%	0.045	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131	-174.1	-64	165.7	-172	117.6	11.4	110	T19 L20 S22 H53 V95 R96 A97 S113	T19-R115 WeakPolarHBondContact CA-O 3.26Å; L20-R115 HydrophobicContact CB-CB 4.05Å; L20-R115 HydrophobicContact CD1-CB 4.49Å; L20-R115 HydrophobicContact CG-CB 4.43Å; L20-R115 PolarHBondContact N-O 3.33Å; L20-R115 PolarHBondContact O-N 3.46Å; S22-R115 PolarHBondContact OG-NH1 3.43Å; S22-R115 PolarHBondContact OG-NH2 3.32Å; H53-R115 PolarHBondContact CE1-NH2 3.45Å; H53-R115 PolarHBondContact NE2-NH2 2.97Å; V95-R115 HydrophobicContact CB-CB 3.97Å; V95-R115 HydrophobicContact CB-CG 4.38Å; V95-R115 HydrophobicContact CG1-CB 4.17Å; V95-R115 HydrophobicContact CG2-CB 4.29Å; V95-R115 HydrophobicContact CG2-CG 4.14Å; R96-R115 WeakPolarHBondContact O-CA 3.39Å; A97-R115 HydrophobicContact CB-CG 4Å; S113-R115 PolarHBondContact OG-NE 3.02Å; S113-R115 PolarHBondContact OG-NH2 2.87Å; S113-R115 VanDerWaalsContact OG-NH2 3.15Å
116	T	95.3	Very high	93	Very high	51 Å²	51	54.5 Å²	54.5	31%	0.313	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	168.8	170.9	59.6	0	0	0	0	109.5	V95 R96 A118	V95-T116 CarbonylContact C-O 3.54Å; V95-T116 WeakPolarHBondContact CA-O 3.39Å; V95-T116 WeakPolarHBondContact CB-O 3.49Å; R96-T116 PolarHBondContact N-O 2.98Å; R96-T116 PolarHBondContact O-N 2.86Å; R96-T116 VanDerWaalsContact O-N 3.17Å; T116-A118 PolarHBondContact O-N 2.74Å
117	R	95	Very high	93.2	Very high	74 Å²	74	54.7 Å²	54.7	28%	0.279	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	134.3	170.4	-176.8	-168.5	172.5	171.9	-1.5	110.4	L14 D16	L14-R117 HydrophobicContact CB-CB 4.25Å; L14-R117 HydrophobicContact CB-CG 4.29Å; L14-R117 VanDerWaalsContact O-CD 3.28Å; L14-R117 WeakPolarHBondContact O-CD 3.44Å; D16-R117 WeakPolarHBondContact OD1-CD 3.42Å; D16-R117 IonicContact OD1-CZ 3.82Å; D16-R117 IonicContact OD1-NE 3.41Å; D16-R117 IonicContact OD1-NH1 3.69Å; D16-R117 PolarHBondContact OD1-NH1 3.19Å; D16-R117 IonicContact OD2-NH1 2.8Å
118	A	94.7	Very high	93.3	Very high	2 Å²	2	50.7 Å²	50.7	2%	0.017	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-81.5	136.5	165.4	0	0	0	0	0	109.5	I82 W94 T116 E122 I123	I82-A118 HydrophobicContact CD1-CB 3.74Å; I82-A118 HydrophobicContact CG2-CB 4.29Å; W94-A118 HydrophobicContact CB-CB 3.94Å; W94-A118 PolarHBondContact O-N 3.14Å; T116-A118 PolarHBondContact O-N 2.74Å; A118-E122 WeakPolarHBondContact CA-OE2 3.49Å; A118-I123 HydrophobicContact CB-CD1 4.26Å; A118-I123 HydrophobicContact CB-CG1 3.93Å
119	T	94.1	Very high	93	Very high	62 Å²	62	49.2 Å²	49.2	38%	0.38	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-73.3	157.6	177.5	72.9	0	0	0	0	111	E121 E122 I123	T119-E121 PolarHBondContact O-N 3.35Å; T119-E122 PolarHBondContact N-OE2 2.9Å; T119-E122 WeakPolarHBondContact O-CB 3.15Å; T119-E122 PolarHBondContact O-N 3.45Å; T119-E122 WeakPolarHBondContact OG1-CG 3.44Å; T119-E122 PolarHBondContact OG1-N 2.96Å; T119-I123 WeakPolarHBondContact O-CG1 3.49Å; T119-I123 PolarHBondContact O-N 2.98Å
120	D	92.9	Very high	93	Very high	109 Å²	109	47.1 Å²	47.1	58%	0.583	26%	0.263	S	S	*	.	H	α-helix	trans	-61.5	-34.7	-179.7	-60.5	-27.9	0	0	0	111.6	I123 A124	D120-I123 PolarHBondContact O-N 3.39Å; D120-A124 VanDerWaalsContact O-CB 3.27Å; D120-A124 WeakPolarHBondContact O-CB 3.3Å; D120-A124 PolarHBondContact O-N 3.25Å
121	E	93.6	Very high	92.8	Very high	163 Å²	163	52.9 Å²	52.9	76%	0.762	29%	0.288	S	S	*	.	H	α-helix	trans	-62.2	-42.8	173.2	-64.2	-177.8	177.1	0	0	112.1	T119 A124 A125	T119-E121 PolarHBondContact O-N 3.35Å; E121-A124 PolarHBondContact O-N 3.12Å; E121-A125 WeakPolarHBondContact O-CB 3.36Å; E121-A125 PolarHBondContact O-N 3.22Å
122	E	92.5	Very high	92.6	Very high	47 Å²	47	53.5 Å²	53.5	22%	0.22	30%	0.296	C	S	.	.	H	α-helix	trans	-66.2	-42	179	-67.6	164.6	162.1	0	0	111.1	I82 R96 A118 T119 A125 V126	I82-E122 HydrophobicContact CD1-CB 4.05Å; I82-E122 HydrophobicContact CG1-CB 4.12Å; R96-E122 IonicContact CZ-OE1 3.25Å; R96-E122 IonicContact CZ-OE2 3.98Å; R96-E122 VanDerWaalsContact CZ-OE2 3.27Å; R96-E122 IonicContact NE-OE1 2.72Å; R96-E122 PolarHBondContact NE-OE1 3.24Å; R96-E122 IonicContact NE-OE2 3.5Å; R96-E122 PolarHBondContact NE-OE2 3.41Å; R96-E122 IonicContact NH1-OE1 2.61Å; R96-E122 IonicContact NH2-OE1 3.04Å; R96-E122 PolarHBondContact NH2-OE1 3.12Å; R96-E122 IonicContact NH2-OE2 3.97Å; R96-E122 PolarHBondContact NH2-OE2 2.99Å; A118-E122 WeakPolarHBondContact CA-OE2 3.49Å; T119-E122 PolarHBondContact N-OE2 2.9Å; T119-E122 WeakPolarHBondContact O-CB 3.15Å; T119-E122 PolarHBondContact O-N 3.45Å; T119-E122 WeakPolarHBondContact OG1-CG 3.44Å; T119-E122 PolarHBondContact OG1-N 2.96Å; E122-A125 PolarHBondContact O-N 2.84Å; E122-V126 WeakPolarHBondContact O-CG2 3.43Å; E122-V126 PolarHBondContact O-N 3.33Å; E122-V126 VanDerWaalsContact O-N 3.14Å
123	I	93.2	Very high	92.2	Very high	19 Å²	19	53.6 Å²	53.6	10%	0.097	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-50	176.3	-62.9	166.1	0	0	0	110	W94 A118 T119 D120 A125 V126 E127	W94-I123 HydrophobicContact CB-CD1 3.57Å; W94-I123 HydrophobicContact CB-CG1 3.76Å; W94-I123 HydrophobicContact CD2-CG1 4.1Å; W94-I123 HydrophobicContact CD2-CG2 4.09Å; W94-I123 HydrophobicContact CG-CD1 3.76Å; W94-I123 HydrophobicContact CG-CG1 3.79Å; W94-I123 HydrophobicContact CG-CG2 4.27Å; W94-I123 HydrophobicContact CZ2-CG2 4.17Å; A118-I123 HydrophobicContact CB-CD1 4.26Å; A118-I123 HydrophobicContact CB-CG1 3.93Å; T119-I123 WeakPolarHBondContact O-CG1 3.49Å; T119-I123 PolarHBondContact O-N 2.98Å; D120-I123 PolarHBondContact O-N 3.39Å; I123-A125 PolarHBondContact O-N 3.46Å; I123-V126 PolarHBondContact O-N 3Å; I123-V126 VanDerWaalsContact O-N 3.16Å; I123-E127 WeakPolarHBondContact O-CB 3.33Å; I123-E127 PolarHBondContact O-N 2.96Å
124	A	92.5	Very high	92	Very high	66 Å²	66	57 Å²	57	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-59.5	-33.1	178.9	0	0	0	0	0	112.5	D120 E121 P128	D120-A124 VanDerWaalsContact O-CB 3.27Å; D120-A124 WeakPolarHBondContact O-CB 3.3Å; D120-A124 PolarHBondContact O-N 3.25Å; E121-A124 PolarHBondContact O-N 3.12Å; A124-P128 WeakPolarHBondContact O-CD 3.37Å
125	A	88.7	Confident	91.8	Very high	71 Å²	71	56.5 Å²	56.5	59%	0.587	32%	0.321	S	S	*	.	H	α-helix	trans	-73.5	-37.5	177.1	0	0	0	0	0	113.4	E121 E122 I123	E121-A125 WeakPolarHBondContact O-CB 3.36Å; E121-A125 PolarHBondContact O-N 3.22Å; E122-A125 PolarHBondContact O-N 2.84Å; I123-A125 PolarHBondContact O-N 3.46Å
126	V	89.8	Confident	91.1	Very high	16 Å²	16	58.7 Å²	58.7	10%	0.097	35%	0.347	C	S	.	.	H	α-helix	trans	-93.2	-28.7	-174.2	-58.7	0	0	0	0	114.2	I82 W94 E122 I123 L129 Y130	I82-V126 HydrophobicContact CB-CG1 4.13Å; I82-V126 HydrophobicContact CB-CG2 3.91Å; I82-V126 HydrophobicContact CG1-CG1 4.17Å; I82-V126 HydrophobicContact CG1-CG2 4.47Å; I82-V126 HydrophobicContact CG2-CG2 3.59Å; W94-V126 HydrophobicContact CH2-CG2 4.28Å; W94-V126 HydrophobicContact CZ3-CG2 3.83Å; E122-V126 WeakPolarHBondContact O-CG2 3.43Å; E122-V126 PolarHBondContact O-N 3.33Å; E122-V126 VanDerWaalsContact O-N 3.14Å; I123-V126 PolarHBondContact O-N 3Å; I123-V126 VanDerWaalsContact O-N 3.16Å; V126-L129 CarbonylContact O-C 3.55Å; V126-L129 WeakPolarHBondContact O-CB 3.45Å; V126-L129 PolarHBondContact O-N 2.93Å; V126-Y130 HydrophobicContact CB-CD1 4.38Å; V126-Y130 HydrophobicContact CB-CD2 4.38Å; V126-Y130 HydrophobicContact CB-CE1 4Å; V126-Y130 HydrophobicContact CB-CE2 3.99Å; V126-Y130 HydrophobicContact CG2-CD2 4.3Å; V126-Y130 HydrophobicContact CG2-CE2 3.89Å; V126-Y130 WeakPolarHBondContact O-CB 3.48Å; V126-Y130 WeakPolarHBondContact O-CD1 3.48Å; V126-Y130 VanDerWaalsContact O-CG 3.28Å; V126-Y130 PolarHBondContact O-N 3.08Å
127	E	90.5	Very high	90.5	Very high	60 Å²	60	67 Å²	67	28%	0.28	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-48.2	-173.5	-171.2	-172	168.9	0	0	112.9	W94 I123 L129 Y130 K131	W94-E127 HydrophobicContact CH2-CB 4.35Å; W94-E127 HydrophobicContact CH2-CG 4.48Å; W94-E127 HydrophobicContact CZ2-CB 4.4Å; W94-E127 HydrophobicContact CZ2-CG 4.28Å; I123-E127 WeakPolarHBondContact O-CB 3.33Å; I123-E127 PolarHBondContact O-N 2.96Å; E127-L129 VanDerWaalsContact C-N 3.26Å; E127-L129 PolarHBondContact O-N 3.3Å; E127-Y130 PolarHBondContact O-N 2.86Å; E127-K131 WeakPolarHBondContact O-CG 3.4Å; E127-K131 PolarHBondContact O-N 3.13Å; E127-K131 VanDerWaalsContact OE1-CE 3.28Å; E127-K131 WeakPolarHBondContact OE1-CE 3.18Å; E127-K131 IonicContact OE1-NZ 3.03Å; E127-K131 PolarHBondContact OE1-NZ 2.97Å
128	P	90.7	Very high	89.8	Confident	81 Å²	81	64.4 Å²	64.4	53%	0.526	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-35.6	175.5	-20.4	33.4	0	0	0	112	A124 A132	A124-P128 WeakPolarHBondContact O-CD 3.37Å; P128-A132 WeakPolarHBondContact O-CB 3.34Å; P128-A132 PolarHBondContact O-N 3.02Å
129	L	87.5	Confident	89.1	Confident	16 Å²	16	68.5 Å²	68.5	8%	0.084	39%	0.394	C	S	.	.	H	α-helix	trans	-64.9	-43.6	176.3	171.9	72.9	0	0	0	111.5	V126 E127 A132 L133 K140 V147	V126-L129 CarbonylContact O-C 3.55Å; V126-L129 WeakPolarHBondContact O-CB 3.45Å; V126-L129 PolarHBondContact O-N 2.93Å; E127-L129 VanDerWaalsContact C-N 3.26Å; E127-L129 PolarHBondContact O-N 3.3Å; L129-A132 CarbonylContact O-C 3.59Å; L129-A132 PolarHBondContact O-N 2.82Å; L129-L133 HydrophobicContact CD1-CD1 4.27Å; L129-L133 HydrophobicContact CD1-CG 4.29Å; L129-L133 HydrophobicContact CD2-CD1 4.4Å; L129-L133 HydrophobicContact CG-CD1 3.94Å; L129-L133 HydrophobicContact CG-CG 4.37Å; L129-L133 WeakPolarHBondContact O-CB 3.34Å; L129-L133 WeakPolarHBondContact O-CG 3.5Å; L129-L133 PolarHBondContact O-N 3.22Å; L129-K140 HydrophobicContact CD1-CB 3.96Å; L129-K140 HydrophobicContact CD1-CD 3.92Å; L129-V147 HydrophobicContact CD1-CG1 3.95Å; L129-V147 HydrophobicContact CD2-CB 3.92Å; L129-V147 HydrophobicContact CD2-CG1 3.4Å; L129-V147 HydrophobicContact CD2-CG2 3.2Å; L129-V147 HydrophobicContact CG-CG1 4.32Å
130	Y	91.7	Very high	88.6	Confident	12 Å²	12	70 Å²	70	5%	0.047	40%	0.395	C	S	.	.	H	α-helix	trans	-66.4	-40.8	-179.5	-72.5	-0.1	0	0	0	110.7	M61 P62 I82 W94 V126 E127 A132 L133 N134 I142	M61-Y130 HydrophobicContact CE-CD2 4.43Å; M61-Y130 HydrophobicContact CE-CE2 3.85Å; M61-Y130 HydrophobicContact SD-CD2 3.8Å; M61-Y130 HydrophobicContact SD-CE2 3.61Å; P62-Y130 HydrophobicContact CG-CD1 3.82Å; P62-Y130 HydrophobicContact CG-CD2 4.45Å; P62-Y130 HydrophobicContact CG-CG 3.71Å; I82-Y130 PolarHBondContact O-OH 3.28Å; W94-Y130 HydrophobicContact CH2-CD2 4.2Å; W94-Y130 HydrophobicContact CZ3-CD2 4.17Å; W94-Y130 HydrophobicContact CZ3-CE2 4.05Å; V126-Y130 HydrophobicContact CB-CD1 4.38Å; V126-Y130 HydrophobicContact CB-CD2 4.38Å; V126-Y130 HydrophobicContact CB-CE1 4Å; V126-Y130 HydrophobicContact CB-CE2 3.99Å; V126-Y130 HydrophobicContact CG2-CD2 4.3Å; V126-Y130 HydrophobicContact CG2-CE2 3.89Å; V126-Y130 WeakPolarHBondContact O-CB 3.48Å; V126-Y130 WeakPolarHBondContact O-CD1 3.48Å; V126-Y130 VanDerWaalsContact O-CG 3.28Å; V126-Y130 PolarHBondContact O-N 3.08Å; E127-Y130 PolarHBondContact O-N 2.86Å; Y130-A132 PolarHBondContact O-N 3.41Å; Y130-L133 HydrophobicContact CD1-CD1 4.08Å; Y130-L133 PolarHBondContact O-N 3.42Å; Y130-N134 WeakPolarHBondContact O-CB 3.48Å; Y130-N134 PolarHBondContact O-N 3.46Å; Y130-N134 PolarHBondContact O-ND2 3.14Å; Y130-I142 HydrophobicContact CE1-CD1 4.02Å
131	K	90.6	Very high	88.2	Confident	124 Å²	124	69 Å²	69	54%	0.539	38%	0.383	S	S	.	.	H	α-helix	trans	-57.4	-47.3	169.3	-69.8	175.4	-175.2	167.1	0	111.5	E127 L133 N134 A135	E127-K131 WeakPolarHBondContact O-CG 3.4Å; E127-K131 PolarHBondContact O-N 3.13Å; E127-K131 VanDerWaalsContact OE1-CE 3.28Å; E127-K131 WeakPolarHBondContact OE1-CE 3.18Å; E127-K131 IonicContact OE1-NZ 3.03Å; E127-K131 PolarHBondContact OE1-NZ 2.97Å; K131-L133 PolarHBondContact O-N 3.39Å; K131-N134 PolarHBondContact O-N 3.27Å; K131-A135 WeakPolarHBondContact O-CB 3.46Å; K131-A135 PolarHBondContact O-N 3.02Å
132	A	89.8	Confident	87.8	Confident	31 Å²	31	62.1 Å²	62.1	26%	0.256	35%	0.351	S	S	.	.	H	α-helix	trans	-67.8	-34.5	179.2	0	0	0	0	0	113.8	P128 L129 Y130 G136 R137	P128-A132 WeakPolarHBondContact O-CB 3.34Å; P128-A132 PolarHBondContact O-N 3.02Å; L129-A132 CarbonylContact O-C 3.59Å; L129-A132 PolarHBondContact O-N 2.82Å; Y130-A132 PolarHBondContact O-N 3.41Å; A132-G136 PolarHBondContact O-N 2.87Å; A132-R137 PolarHBondContact O-N 3.19Å
133	L	87.5	Confident	87.5	Confident	29 Å²	29	61.8 Å²	61.8	15%	0.152	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-45	173.5	-81.5	167.7	0	0	0	111.1	P62 L129 Y130 K131 A135 G136 T138 I142	P62-L133 HydrophobicContact CB-CB 4.04Å; P62-L133 HydrophobicContact CB-CD1 4.4Å; P62-L133 HydrophobicContact CG-CB 3.98Å; P62-L133 HydrophobicContact CG-CD1 4.17Å; L129-L133 HydrophobicContact CD1-CD1 4.27Å; L129-L133 HydrophobicContact CD1-CG 4.29Å; L129-L133 HydrophobicContact CD2-CD1 4.4Å; L129-L133 HydrophobicContact CG-CD1 3.94Å; L129-L133 HydrophobicContact CG-CG 4.37Å; L129-L133 WeakPolarHBondContact O-CB 3.34Å; L129-L133 WeakPolarHBondContact O-CG 3.5Å; L129-L133 PolarHBondContact O-N 3.22Å; Y130-L133 HydrophobicContact CD1-CD1 4.08Å; Y130-L133 PolarHBondContact O-N 3.42Å; K131-L133 PolarHBondContact O-N 3.39Å; L133-A135 VanDerWaalsContact C-N 3.33Å; L133-G136 PolarHBondContact O-N 3.08Å; L133-G136 VanDerWaalsContact O-N 3.15Å; L133-T138 HydrophobicContact CB-CG2 4.38Å; L133-T138 HydrophobicContact CD2-CG2 3.45Å; L133-T138 VanDerWaalsContact CD2-CG2 3.45Å; L133-T138 HydrophobicContact CG-CG2 3.8Å; L133-I142 HydrophobicContact CD1-CD1 3.62Å; L133-I142 HydrophobicContact CD1-CG1 3.9Å
134	N	89.6	Confident	87.1	Confident	82 Å²	82	64.4 Å²	64.4	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-37.8	176.3	-73.3	-23.7	0	0	0	112.4	D60 P62 Y130 K131 G136	D60-N134 PolarHBondContact O-ND2 3.31Å; P62-N134 WeakPolarHBondContact CA-OD1 3.43Å; P62-N134 WeakPolarHBondContact CB-OD1 3.49Å; Y130-N134 WeakPolarHBondContact O-CB 3.48Å; Y130-N134 PolarHBondContact O-N 3.46Å; Y130-N134 PolarHBondContact O-ND2 3.14Å; K131-N134 PolarHBondContact O-N 3.27Å; N134-G136 PolarHBondContact O-N 2.91Å
135	A	90	Very high	86.7	Confident	59 Å²	59	61.9 Å²	61.9	49%	0.488	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.1	175.6	0	0	0	0	0	113.7	K131 L133 R137	K131-A135 WeakPolarHBondContact O-CB 3.46Å; K131-A135 PolarHBondContact O-N 3.02Å; L133-A135 VanDerWaalsContact C-N 3.33Å; A135-R137 HydrophobicContact CB-CB 4.46Å; A135-R137 HydrophobicContact CB-CG 4.13Å; A135-R137 WeakPolarHBondContact O-CG 3.17Å; A135-R137 PolarHBondContact O-N 3.35Å
136	G	83.3	Confident	86.4	Confident	58 Å²	58	64.1 Å²	64.1	60%	0.598	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	7.2	-175.4	0	0	0	0	0	114.8	A132 L133 N134 T138	A132-G136 PolarHBondContact O-N 2.87Å; L133-G136 PolarHBondContact O-N 3.08Å; L133-G136 VanDerWaalsContact O-N 3.15Å; N134-G136 PolarHBondContact O-N 2.91Å; G136-T138 PolarHBondContact O-N 3.05Å
137	R	82	Confident	85.9	Confident	225 Å²	225	66.3 Å²	66.3	85%	0.849	36%	0.356	S	S	*	.			trans	-94	17.7	-170.6	-64.3	-178.1	-173	173.9	0.6	114.4	A132 A135	A132-R137 PolarHBondContact O-N 3.19Å; A135-R137 HydrophobicContact CB-CB 4.46Å; A135-R137 HydrophobicContact CB-CG 4.13Å; A135-R137 WeakPolarHBondContact O-CG 3.17Å; A135-R137 PolarHBondContact O-N 3.35Å
138	T	80.3	Confident	85.6	Confident	21 Å²	21	64 Å²	64	13%	0.129	35%	0.345	C	S	.	.			trans	-110.6	138.2	-174.7	-174.8	0	0	0	0	113.1	L133 G136 K140 K150	L133-T138 HydrophobicContact CB-CG2 4.38Å; L133-T138 HydrophobicContact CD2-CG2 3.45Å; L133-T138 VanDerWaalsContact CD2-CG2 3.45Å; L133-T138 HydrophobicContact CG-CG2 3.8Å; G136-T138 PolarHBondContact O-N 3.05Å; T138-K140 WeakPolarHBondContact CG2-O 3.31Å; T138-K140 PolarHBondContact O-N 3.49Å; T138-K140 WeakPolarHBondContact OG1-CB 3.37Å; T138-K140 PolarHBondContact OG1-N 3.41Å; T138-K150 WeakPolarHBondContact O-CE 3.31Å; T138-K150 PolarHBondContact O-NZ 3.27Å
139	S	80.3	Confident	85.1	Confident	87 Å²	87	68 Å²	68	61%	0.608	35%	0.35	S	S	*	.	S	Bend	trans	-82.5	11.4	166.9	62.8	0	0	0	0	112.3	R149 K150	S139-R149 CarbonylContact O-C 3.53Å; S139-K150 VanDerWaalsContact O-CB 3.27Å; S139-K150 WeakPolarHBondContact O-CB 3.33Å; S139-K150 WeakPolarHBondContact O-CG 3.42Å; S139-K150 PolarHBondContact O-N 3.47Å
140	K	83.8	Confident	84.5	Confident	94 Å²	94	72.9 Å²	72.9	41%	0.409	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	158	177.4	-59	176.7	179.1	-178	0	111.1	L129 T138 V147 V148 K150	L129-K140 HydrophobicContact CD1-CB 3.96Å; L129-K140 HydrophobicContact CD1-CD 3.92Å; T138-K140 WeakPolarHBondContact CG2-O 3.31Å; T138-K140 PolarHBondContact O-N 3.49Å; T138-K140 WeakPolarHBondContact OG1-CB 3.37Å; T138-K140 PolarHBondContact OG1-N 3.41Å; K140-V147 HydrophobicContact CB-CG1 4.04Å; K140-V147 HydrophobicContact CD-CG1 3.79Å; K140-V147 HydrophobicContact CG-CG1 4.39Å; K140-V148 CarbonylContact C-O 3.52Å; K140-V148 VanDerWaalsContact CA-O 3.26Å; K140-V148 WeakPolarHBondContact CA-O 3.46Å; K140-K150 WeakPolarHBondContact O-CE 3.48Å
141	R	84.4	Confident	83.7	Confident	89 Å²	89	74.7 Å²	74.7	34%	0.336	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	161.6	172.9	66.8	176.7	-178	151.7	6.8	109.3	V148 K150	R141-V148 HydrophobicContact CG-CG2 3.52Å; R141-V148 PolarHBondContact N-O 3Å; R141-V148 PolarHBondContact O-N 2.96Å; R141-V148 VanDerWaalsContact O-O 3.11Å; R141-K150 HydrophobicContact CB-CG 4.38Å
142	I	84.7	Confident	82.8	Confident	17 Å²	17	77.7 Å²	77.7	9%	0.087	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	135.4	173.9	-57.2	172.9	0	0	0	107.6	A65 D68 Y130 L133 L146	A65-I142 HydrophobicContact CB-CD1 3.48Å; A65-I142 VanDerWaalsContact CB-CD1 3.48Å; D68-I142 HydrophobicContact CB-CB 4.4Å; D68-I142 HydrophobicContact CB-CG2 4.14Å; D68-I142 WeakPolarHBondContact OD2-CG2 3.49Å; Y130-I142 HydrophobicContact CE1-CD1 4.02Å; L133-I142 HydrophobicContact CD1-CD1 3.62Å; L133-I142 HydrophobicContact CD1-CG1 3.9Å; I142-L146 CarbonylContact C-O 3.47Å; I142-L146 WeakPolarHBondContact CA-O 3.42Å
143	H	85.7	Confident	82	Confident	40 Å²	40	80.6 Å²	80.6	19%	0.185	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	113.9	174.8	-176.7	63	0	0	0	110.2	D68 G145 L146 V148 S158	D68-H143 WeakPolarHBondContact OD1-CA 3.48Å; H143-G145 PolarHBondContact O-N 2.98Å; H143-L146 PolarHBondContact N-O 3.38Å; H143-L146 WeakPolarHBondContact O-CB 3.48Å; H143-L146 PolarHBondContact O-N 3.35Å; H143-V148 HydrophobicContact CB-CG2 3.91Å; H143-S158 VanDerWaalsContact CD2-CB 3.41Å; H143-S158 WeakPolarHBondContact CD2-CB 3.4Å; H143-S158 VanDerWaalsContact NE2-CB 3.26Å; H143-S158 WeakPolarHBondContact NE2-CB 3.47Å
144	K	85.1	Confident	81.4	Confident	75 Å²	75	79.3 Å²	79.3	33%	0.326	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	37.8	-172.6	-56.6	-173.9	173.9	-165.2	0	112.3	D68 T72 E77 L146	D68-K144 VanDerWaalsContact CG-N 3.27Å; D68-K144 PolarHBondContact OD1-N 3.45Å; D68-K144 WeakPolarHBondContact OD2-CA 3.32Å; D68-K144 PolarHBondContact OD2-N 3.49Å; T72-K144 HydrophobicContact CG2-CB 4.39Å; T72-K144 HydrophobicContact CG2-CD 4.5Å; T72-K144 HydrophobicContact CG2-CG 4Å; E77-K144 IonicContact OE1-NZ 2.68Å; E77-K144 PolarHBondContact OE1-NZ 3.21Å; E77-K144 WeakPolarHBondContact OE2-CE 3.47Å; E77-K144 IonicContact OE2-NZ 3.66Å; E77-K144 PolarHBondContact OE2-NZ 3.16Å; K144-L146 PolarHBondContact O-N 3.08Å
145	G	84.1	Confident	80.7	Confident	13 Å²	13	81.3 Å²	81.3	13%	0.134	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-13	-177.3	0	0	0	0	0	115.5	D68 W79 S80 H143	D68-G145 PolarHBondContact OD2-N 3.31Å; W79-G145 VanDerWaalsContact NE1-N 3.11Å; S80-G145 WeakPolarHBondContact O-CA 3.42Å; H143-G145 PolarHBondContact O-N 2.98Å
146	L	82.5	Confident	80.2	Confident	117 Å²	117	82.6 Å²	82.6	61%	0.613	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	143.3	175.2	-64.2	170.5	0	0	0	111.9	I142 H143 K144 V148	I142-L146 CarbonylContact C-O 3.47Å; I142-L146 WeakPolarHBondContact CA-O 3.42Å; H143-L146 PolarHBondContact N-O 3.38Å; H143-L146 WeakPolarHBondContact O-CB 3.48Å; H143-L146 PolarHBondContact O-N 3.35Å; K144-L146 PolarHBondContact O-N 3.08Å; L146-V148 PolarHBondContact O-N 3.26Å
147	V	80.5	Confident	79.9	Confident	63 Å²	63	83.2 Å²	83.2	38%	0.382	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	108.5	176.7	-175.5	0	0	0	0	109.5	L129 K140	L129-V147 HydrophobicContact CD1-CG1 3.95Å; L129-V147 HydrophobicContact CD2-CB 3.92Å; L129-V147 HydrophobicContact CD2-CG1 3.4Å; L129-V147 HydrophobicContact CD2-CG2 3.2Å; L129-V147 HydrophobicContact CG-CG1 4.32Å; K140-V147 HydrophobicContact CB-CG1 4.04Å; K140-V147 HydrophobicContact CD-CG1 3.79Å; K140-V147 HydrophobicContact CG-CG1 4.39Å
148	V	82.6	Confident	79.7	Confident	10 Å²	10	74.4 Å²	74.4	6%	0.061	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	151.5	-179.5	-60.1	0	0	0	0	111.4	K140 R141 H143 L146 P157	K140-V148 CarbonylContact C-O 3.52Å; K140-V148 VanDerWaalsContact CA-O 3.26Å; K140-V148 WeakPolarHBondContact CA-O 3.46Å; R141-V148 HydrophobicContact CG-CG2 3.52Å; R141-V148 PolarHBondContact N-O 3Å; R141-V148 PolarHBondContact O-N 2.96Å; R141-V148 VanDerWaalsContact O-O 3.11Å; H143-V148 HydrophobicContact CB-CG2 3.91Å; L146-V148 PolarHBondContact O-N 3.26Å; V148-P157 HydrophobicContact CG1-CB 4.05Å; V148-P157 HydrophobicContact CG1-CG 4.05Å
149	R	80.6	Confident	79.7	Confident	166 Å²	166	76.6 Å²	76.6	63%	0.626	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	157.2	173.4	-68.8	-176.8	178.8	179.8	-0.6	110.6	S139 G154	S139-R149 CarbonylContact O-C 3.53Å; R149-G154 WeakPolarHBondContact O-CA 3.43Å
150	K	74.8	Confident	80	Confident	118 Å²	118	75.6 Å²	75.6	51%	0.513	38%	0.377	S	S	.	.	S	Bend	trans	-79.6	146.9	166	-72.2	178.7	179.1	168.1	0	108.2	T138 S139 K140 R141	T138-K150 WeakPolarHBondContact O-CE 3.31Å; T138-K150 PolarHBondContact O-NZ 3.27Å; S139-K150 VanDerWaalsContact O-CB 3.27Å; S139-K150 WeakPolarHBondContact O-CB 3.33Å; S139-K150 WeakPolarHBondContact O-CG 3.42Å; S139-K150 PolarHBondContact O-N 3.47Å; K140-K150 WeakPolarHBondContact O-CE 3.48Å; R141-K150 HydrophobicContact CB-CG 4.38Å
151	G	75.8	Confident	80.2	Confident	50 Å²	50	74.2 Å²	74.2	52%	0.515	37%	0.374	S	S	.	.	S	Bend	trans	99.4	-171.4	-177.8	0	0	0	0	0	114.4	L153 G154	G151-L153 PolarHBondContact O-N 3.17Å; G151-G154 PolarHBondContact O-N 3.38Å; G151-G154 VanDerWaalsContact O-N 3.16Å
152	W	72.5	Confident	80.4	Confident	188 Å²	188	74.8 Å²	74.8	71%	0.712	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-64.4	-38.3	-173.4	73.2	-91.5	0	0	0	112.8	G154 K155 L156	W152-G154 PolarHBondContact O-N 3.04Å; W152-K155 WeakPolarHBondContact O-CB 3.49Å; W152-K155 PolarHBondContact O-N 2.91Å; W152-L156 HydrophobicContact CE3-CD1 3.84Å; W152-L156 HydrophobicContact CZ3-CD1 3.75Å
153	L	72.9	Confident	80.6	Confident	92 Å²	92	81 Å²	81	48%	0.482	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-58.2	-33.5	174.3	-79.7	139.9	0	0	0	112.6	G151 K155 L156	G151-L153 PolarHBondContact O-N 3.17Å; L153-K155 VanDerWaalsContact C-N 3.27Å; L153-K155 PolarHBondContact O-N 3.42Å; L153-L156 PolarHBondContact O-N 3.05Å
154	G	74.4	Confident	80.6	Confident	2 Å²	2	84.6 Å²	84.6	2%	0.021	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-75.8	-11.4	176	0	0	0	0	0	115.2	R149 G151 W152	R149-G154 WeakPolarHBondContact O-CA 3.43Å; G151-G154 PolarHBondContact O-N 3.38Å; G151-G154 VanDerWaalsContact O-N 3.16Å; W152-G154 PolarHBondContact O-N 3.04Å
155	K	75.8	Confident	80.7	Confident	124 Å²	124	81.8 Å²	81.8	54%	0.539	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-86.3	-20.3	174	-64.6	-169.4	178	-178.2	0	112.2	W152 L153 S158 L159	W152-K155 WeakPolarHBondContact O-CB 3.49Å; W152-K155 PolarHBondContact O-N 2.91Å; L153-K155 VanDerWaalsContact C-N 3.27Å; L153-K155 PolarHBondContact O-N 3.42Å; K155-S158 WeakPolarHBondContact CA-OG 3.26Å; K155-S158 CarbonylContact O-C 3.58Å; K155-S158 PolarHBondContact O-N 3.35Å; K155-S158 PolarHBondContact O-OG 3.47Å; K155-L159 HydrophobicContact CB-CD1 4.35Å; K155-L159 WeakPolarHBondContact O-CD1 3.49Å; K155-L159 PolarHBondContact O-N 3.46Å
156	L	77.9	Confident	81	Confident	85 Å²	85	85.3 Å²	85.3	45%	0.445	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-49.2	178.2	-86.5	106	0	0	0	112.8	W152 L153 S158 L159 R164	W152-L156 HydrophobicContact CE3-CD1 3.84Å; W152-L156 HydrophobicContact CZ3-CD1 3.75Å; L153-L156 PolarHBondContact O-N 3.05Å; L156-S158 PolarHBondContact O-N 2.92Å; L156-L159 WeakPolarHBondContact O-CB 3.49Å; L156-L159 PolarHBondContact O-N 2.83Å; L156-L159 VanDerWaalsContact O-N 3.13Å; L156-R164 PolarHBondContact O-NE 3.38Å; L156-R164 PolarHBondContact O-NH2 2.88Å
157	P	77	Confident	81.2	Confident	71 Å²	71	81.8 Å²	81.8	46%	0.461	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-34.4	178.7	-25.2	35.3	0	0	0	113	V148 R164	V148-P157 HydrophobicContact CG1-CB 4.05Å; V148-P157 HydrophobicContact CG1-CG 4.05Å; P157-R164 PolarHBondContact O-NH2 3.4Å
158	S	77.9	Confident	81.6	Confident	40 Å²	40	82.8 Å²	82.8	28%	0.28	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-6.8	-179.9	58.5	0	0	0	0	114.9	H143 K155 L156	H143-S158 VanDerWaalsContact CD2-CB 3.41Å; H143-S158 WeakPolarHBondContact CD2-CB 3.4Å; H143-S158 VanDerWaalsContact NE2-CB 3.26Å; H143-S158 WeakPolarHBondContact NE2-CB 3.47Å; K155-S158 WeakPolarHBondContact CA-OG 3.26Å; K155-S158 CarbonylContact O-C 3.58Å; K155-S158 PolarHBondContact O-N 3.35Å; K155-S158 PolarHBondContact O-OG 3.47Å; L156-S158 PolarHBondContact O-N 2.92Å
159	L	81.5	Confident	82	Confident	67 Å²	67	83.9 Å²	83.9	35%	0.351	41%	0.412	S	S	.	.	S	Bend	trans	-70.2	127.8	-173.9	-129.9	94.6	0	0	0	110.1	K155 L156 W163 R164	K155-L159 HydrophobicContact CB-CD1 4.35Å; K155-L159 WeakPolarHBondContact O-CD1 3.49Å; K155-L159 PolarHBondContact O-N 3.46Å; L156-L159 WeakPolarHBondContact O-CB 3.49Å; L156-L159 PolarHBondContact O-N 2.83Å; L156-L159 VanDerWaalsContact O-N 3.13Å; L159-W163 HydrophobicContact CD2-CB 3.52Å; L159-W163 HydrophobicContact CG-CB 4.19Å; L159-R164 HydrophobicContact CB-CG 4.11Å; L159-R164 HydrophobicContact CD2-CG 4.22Å
160	P	85.7	Confident	82.5	Confident	67 Å²	67	79.7 Å²	79.7	44%	0.435	41%	0.405	S	S	.	.			trans	-56.4	147.7	174	-24.7	33.7	0	0	0	111.8	R162 W163 R164	P160-R162 HydrophobicContact CB-CG 3.88Å; P160-R162 PolarHBondContact O-N 3.26Å; P160-W163 PolarHBondContact O-N 3.19Å; P160-R164 PolarHBondContact O-N 3.02Å
161	L	87.5	Confident	83.3	Confident	65 Å²	65	79 Å²	79	34%	0.34	41%	0.406	S	S	.	.	H	α-helix	trans	-55.4	-38.9	-176.4	-175.5	62.4	0	0	0	112.4	W163 R164 A165 V209 I212	L161-W163 VanDerWaalsContact C-N 3.29Å; L161-W163 PolarHBondContact O-N 2.9Å; L161-R164 PolarHBondContact O-N 3.49Å; L161-R164 VanDerWaalsContact O-N 3.17Å; L161-A165 PolarHBondContact O-N 3.25Å; L161-V209 HydrophobicContact CG-CG2 4.44Å; L161-I212 HydrophobicContact CD2-CB 4.03Å; L161-I212 HydrophobicContact CD2-CD1 3.63Å; L161-I212 HydrophobicContact CD2-CG1 4.43Å; L161-I212 HydrophobicContact CD2-CG2 3.79Å
162	R	88.9	Confident	83.9	Confident	100 Å²	100	82 Å²	82	38%	0.377	41%	0.409	S	S	.	.	H	α-helix	trans	-52.6	-41.7	175	59.3	177.6	75.4	-176.7	3.2	114	P160 R166 V209 E213	P160-R162 HydrophobicContact CB-CG 3.88Å; P160-R162 PolarHBondContact O-N 3.26Å; R162-R166 WeakPolarHBondContact O-CB 3.4Å; R162-R166 VanDerWaalsContact O-CG 3.31Å; R162-R166 WeakPolarHBondContact O-CG 3.43Å; R162-R166 PolarHBondContact O-N 3.41Å; R162-V209 HydrophobicContact CB-CG1 3.75Å; R162-E213 IonicContact CZ-OE1 3.05Å; R162-E213 IonicContact CZ-OE2 3.04Å; R162-E213 IonicContact NE-OE1 3.6Å; R162-E213 PolarHBondContact NE-OE1 3.37Å; R162-E213 IonicContact NE-OE2 3.91Å; R162-E213 VanDerWaalsContact NH2-CD 3.25Å; R162-E213 IonicContact NH2-OE1 2.87Å; R162-E213 PolarHBondContact NH2-OE1 2.96Å; R162-E213 VanDerWaalsContact NH2-OE1 3.15Å; R162-E213 IonicContact NH2-OE2 2.75Å; R162-E213 PolarHBondContact NH2-OE2 3.37Å
163	W	88.6	Confident	84.8	Confident	147 Å²	147	76.2 Å²	76.2	56%	0.557	39%	0.389	S	S	*	.	H	α-helix	trans	-79.7	-30.9	-178.1	-72.8	110.6	0	0	0	112	L159 P160 L161 G167	L159-W163 HydrophobicContact CD2-CB 3.52Å; L159-W163 HydrophobicContact CG-CB 4.19Å; P160-W163 PolarHBondContact O-N 3.19Å; L161-W163 VanDerWaalsContact C-N 3.29Å; L161-W163 PolarHBondContact O-N 2.9Å; W163-G167 PolarHBondContact O-N 2.9Å
164	R	86.8	Confident	85.7	Confident	117 Å²	117	76.6 Å²	76.6	44%	0.442	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-48.1	171	-66.1	-172.9	176.6	-174.1	3.9	110.9	L156 P157 L159 P160 L161 G167 V168	L156-R164 PolarHBondContact O-NE 3.38Å; L156-R164 PolarHBondContact O-NH2 2.88Å; P157-R164 PolarHBondContact O-NH2 3.4Å; L159-R164 HydrophobicContact CB-CG 4.11Å; L159-R164 HydrophobicContact CD2-CG 4.22Å; P160-R164 PolarHBondContact O-N 3.02Å; L161-R164 PolarHBondContact O-N 3.49Å; L161-R164 VanDerWaalsContact O-N 3.17Å; R164-G167 PolarHBondContact O-N 2.98Å; R164-V168 WeakPolarHBondContact O-CG2 3.49Å; R164-V168 PolarHBondContact O-N 3.08Å; R164-V168 VanDerWaalsContact O-N 3.1Å
165	A	87	Confident	86.5	Confident	15 Å²	15	81.6 Å²	81.6	12%	0.124	42%	0.416	C	S	.	.	H	α-helix	trans	-60.1	-50.8	178.4	0	0	0	0	0	111.8	L161 G167 V168 M169 F204 V209	L161-A165 PolarHBondContact O-N 3.25Å; A165-G167 VanDerWaalsContact C-N 3.32Å; A165-G167 PolarHBondContact O-N 3.36Å; A165-V168 PolarHBondContact O-N 3.4Å; A165-M169 WeakPolarHBondContact O-CG 3.47Å; A165-M169 PolarHBondContact O-N 3.37Å; A165-F204 HydrophobicContact CB-CD1 3.78Å; A165-F204 HydrophobicContact CB-CE1 3.58Å; A165-V209 HydrophobicContact CB-CG2 3.99Å
166	R	89.4	Confident	87.2	Confident	88 Å²	88	78.9 Å²	78.9	33%	0.332	41%	0.407	S	S	.	.	H	α-helix	trans	-59.6	-41.8	176.7	-71.9	177.1	-174.6	178.2	0.1	112	R162 V168 M169 T170 E205	R162-R166 WeakPolarHBondContact O-CB 3.4Å; R162-R166 VanDerWaalsContact O-CG 3.31Å; R162-R166 WeakPolarHBondContact O-CG 3.43Å; R162-R166 PolarHBondContact O-N 3.41Å; R166-V168 VanDerWaalsContact C-N 3.35Å; R166-V168 PolarHBondContact O-N 3.09Å; R166-M169 PolarHBondContact O-N 3.05Å; R166-T170 WeakPolarHBondContact O-CB 3.36Å; R166-T170 PolarHBondContact O-N 2.81Å; R166-T170 PolarHBondContact O-OG1 2.88Å; R166-E205 IonicContact CZ-OE2 2.72Å; R166-E205 IonicContact NE-OE2 3.38Å; R166-E205 PolarHBondContact NE-OE2 3.22Å; R166-E205 VanDerWaalsContact NH2-CD 3.34Å; R166-E205 IonicContact NH2-OE1 3.62Å; R166-E205 PolarHBondContact NH2-OE1 3Å; R166-E205 VanDerWaalsContact NH2-OE1 3.13Å; R166-E205 IonicContact NH2-OE2 3.64Å; R166-E205 PolarHBondContact NH2-OE2 3.36Å
167	G	88.5	Confident	87.8	Confident	42 Å²	42	76 Å²	76	43%	0.433	40%	0.395	S	S	.	.	H	α-helix	trans	-58.8	-42.4	176.8	0	0	0	0	0	113.4	W163 R164 A165 L171	W163-G167 PolarHBondContact O-N 2.9Å; R164-G167 PolarHBondContact O-N 2.98Å; A165-G167 VanDerWaalsContact C-N 3.32Å; A165-G167 PolarHBondContact O-N 3.36Å; G167-L171 WeakPolarHBondContact O-CB 3.39Å; G167-L171 PolarHBondContact O-N 2.87Å
168	V	88.7	Confident	88.4	Confident	84 Å²	84	75.2 Å²	75.2	51%	0.509	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-45.3	175	174.4	0	0	0	0	111.1	R164 A165 R166 T170 L171 M172	R164-V168 WeakPolarHBondContact O-CG2 3.49Å; R164-V168 PolarHBondContact O-N 3.08Å; R164-V168 VanDerWaalsContact O-N 3.1Å; A165-V168 PolarHBondContact O-N 3.4Å; R166-V168 VanDerWaalsContact C-N 3.35Å; R166-V168 PolarHBondContact O-N 3.09Å; V168-T170 PolarHBondContact O-N 3.03Å; V168-L171 PolarHBondContact O-N 3.22Å; V168-M172 HydrophobicContact CG1-SD 4.43Å; V168-M172 WeakPolarHBondContact O-CG 3.48Å; V168-M172 PolarHBondContact O-N 3.43Å
169	M	89.9	Confident	88.9	Confident	33 Å²	33	79.9 Å²	79.9	16%	0.163	41%	0.414	C	S	.	.	H	α-helix	trans	-63.7	-40	178.7	-66.2	-58.6	-77.8	0	0	112.4	A165 R166 M172 F173 V197 A200	A165-M169 WeakPolarHBondContact O-CG 3.47Å; A165-M169 PolarHBondContact O-N 3.37Å; R166-M169 PolarHBondContact O-N 3.05Å; M169-M172 PolarHBondContact O-N 3.39Å; M169-F173 PolarHBondContact O-N 2.86Å; M169-V197 HydrophobicContact CB-CG1 4.36Å; M169-V197 HydrophobicContact CE-CG1 4.16Å; M169-A200 HydrophobicContact CE-CB 3.46Å; M169-A200 VanDerWaalsContact CE-CB 3.46Å
170	T	90.6	Very high	89.3	Confident	78 Å²	78	78.1 Å²	78.1	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-64.6	-41.3	174.6	-54	0	0	0	0	111.3	R166 V168 F173 I174	R166-T170 WeakPolarHBondContact O-CB 3.36Å; R166-T170 PolarHBondContact O-N 2.81Å; R166-T170 PolarHBondContact O-OG1 2.88Å; V168-T170 PolarHBondContact O-N 3.03Å; T170-F173 WeakPolarHBondContact O-CB 3.48Å; T170-F173 PolarHBondContact O-N 3.05Å; T170-I174 HydrophobicContact CG2-CD1 4.14Å; T170-I174 VanDerWaalsContact O-CG1 3.3Å; T170-I174 WeakPolarHBondContact O-CG1 3.36Å; T170-I174 PolarHBondContact O-N 3.18Å
171	L	91.6	Very high	89.4	Confident	103 Å²	103	84.8 Å²	84.8	54%	0.539	42%	0.421	S	S	.	.	H	α-helix	trans	-62.6	-44.4	175.4	-175.6	71.4	0	0	0	111.6	G167 V168 F173 I174 L175	G167-L171 WeakPolarHBondContact O-CB 3.39Å; G167-L171 PolarHBondContact O-N 2.87Å; V168-L171 PolarHBondContact O-N 3.22Å; L171-F173 VanDerWaalsContact C-N 3.3Å; L171-F173 PolarHBondContact O-N 3.48Å; L171-I174 PolarHBondContact O-N 3Å; L171-L175 HydrophobicContact CG-CD1 4.4Å; L171-L175 WeakPolarHBondContact O-CG 3.4Å; L171-L175 PolarHBondContact O-N 3.08Å
172	M	89.9	Confident	89.4	Confident	114 Å²	114	90.6 Å²	90.6	56%	0.562	44%	0.444	S	S	*	.	H	α-helix	trans	-60.6	-39.9	175.5	-72.4	-176	73.2	0	0	111.9	V168 M169 L175 L176	V168-M172 HydrophobicContact CG1-SD 4.43Å; V168-M172 WeakPolarHBondContact O-CG 3.48Å; V168-M172 PolarHBondContact O-N 3.43Å; M169-M172 PolarHBondContact O-N 3.39Å; M172-L175 PolarHBondContact O-N 3Å; M172-L176 WeakPolarHBondContact O-CB 3.42Å; M172-L176 PolarHBondContact O-N 2.99Å
173	F	91	Very high	89.3	Confident	67 Å²	67	91.2 Å²	91.2	29%	0.294	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-43.4	174.6	179.4	-110.8	0	0	0	112.6	M169 T170 L171 L175 L176 A177 A194 V197	M169-F173 PolarHBondContact O-N 2.86Å; T170-F173 WeakPolarHBondContact O-CB 3.48Å; T170-F173 PolarHBondContact O-N 3.05Å; L171-F173 VanDerWaalsContact C-N 3.3Å; L171-F173 PolarHBondContact O-N 3.48Å; F173-L175 VanDerWaalsContact C-N 3.35Å; F173-L175 PolarHBondContact O-N 3.39Å; F173-L176 PolarHBondContact O-N 3.27Å; F173-A177 VanDerWaalsContact O-CB 3.31Å; F173-A177 WeakPolarHBondContact O-CB 3.26Å; F173-A177 PolarHBondContact O-N 3.37Å; F173-A194 VanDerWaalsContact CE2-CA 3.43Å; F173-A194 HydrophobicContact CE2-CB 3.55Å; F173-A194 HydrophobicContact CZ-CB 3.8Å; F173-V197 HydrophobicContact CB-CB 4.5Å; F173-V197 HydrophobicContact CB-CG1 4.11Å; F173-V197 HydrophobicContact CB-CG2 4.22Å; F173-V197 HydrophobicContact CD2-CB 4.3Å; F173-V197 HydrophobicContact CD2-CG2 4.02Å
174	I	91.5	Very high	89.1	Confident	99 Å²	99	88.4 Å²	88.4	51%	0.508	47%	0.467	S	S	.	.	H	α-helix	trans	-61.5	-44.6	177.5	-68.7	164.6	0	0	0	110.5	T170 L171 A177 A178	T170-I174 HydrophobicContact CG2-CD1 4.14Å; T170-I174 VanDerWaalsContact O-CG1 3.3Å; T170-I174 WeakPolarHBondContact O-CG1 3.36Å; T170-I174 PolarHBondContact O-N 3.18Å; L171-I174 PolarHBondContact O-N 3Å; I174-A177 PolarHBondContact O-N 3.19Å; I174-A178 WeakPolarHBondContact O-CB 3.4Å; I174-A178 PolarHBondContact O-N 3.1Å
175	L	91.4	Very high	89	Confident	108 Å²	108	83.8 Å²	83.8	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-64.2	-41.9	177.6	-70.8	171.9	0	0	0	112.1	L171 M172 F173 A178 M179	L171-L175 HydrophobicContact CG-CD1 4.4Å; L171-L175 WeakPolarHBondContact O-CG 3.4Å; L171-L175 PolarHBondContact O-N 3.08Å; M172-L175 PolarHBondContact O-N 3Å; F173-L175 VanDerWaalsContact C-N 3.35Å; F173-L175 PolarHBondContact O-N 3.39Å; L175-A178 PolarHBondContact O-N 3.01Å; L175-M179 PolarHBondContact O-N 3.4Å
176	L	90.4	Very high	89.1	Confident	66 Å²	66	87.2 Å²	87.2	35%	0.346	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-44.2	176.5	-174.8	67.3	0	0	0	111.5	M172 F173 A178 M179 L180 C193	M172-L176 WeakPolarHBondContact O-CB 3.42Å; M172-L176 PolarHBondContact O-N 2.99Å; F173-L176 PolarHBondContact O-N 3.27Å; L176-A178 VanDerWaalsContact C-N 3.32Å; L176-A178 PolarHBondContact O-N 3.47Å; L176-M179 PolarHBondContact O-N 3.07Å; L176-L180 HydrophobicContact CG-CD1 4.33Å; L176-L180 WeakPolarHBondContact O-CG 3.37Å; L176-L180 PolarHBondContact O-N 3.25Å; L176-C193 HydrophobicContact CD2-CB 3.68Å; L176-C193 HydrophobicContact CG-CB 4.49Å
177	A	89.1	Confident	88.9	Confident	24 Å²	24	88.2 Å²	88.2	20%	0.198	49%	0.49	C	S	.	.	H	α-helix	trans	-62	-39.3	176.4	0	0	0	0	0	111.7	F173 I174 L180 W181 Y190	F173-A177 VanDerWaalsContact O-CB 3.31Å; F173-A177 WeakPolarHBondContact O-CB 3.26Å; F173-A177 PolarHBondContact O-N 3.37Å; I174-A177 PolarHBondContact O-N 3.19Å; A177-L180 PolarHBondContact O-N 3.49Å; A177-W181 WeakPolarHBondContact O-CB 3.39Å; A177-W181 PolarHBondContact O-N 2.87Å; A177-Y190 HydrophobicContact CB-CD1 4.4Å; A177-Y190 HydrophobicContact CB-CE1 4.37Å
178	A	89.6	Confident	88.8	Confident	55 Å²	55	91.6 Å²	91.6	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-40.3	175.3	0	0	0	0	0	112.5	I174 L175 L176 W181 F182	I174-A178 WeakPolarHBondContact O-CB 3.4Å; I174-A178 PolarHBondContact O-N 3.1Å; L175-A178 PolarHBondContact O-N 3.01Å; L176-A178 VanDerWaalsContact C-N 3.32Å; L176-A178 PolarHBondContact O-N 3.47Å; A178-W181 PolarHBondContact O-N 2.86Å; A178-F182 PolarHBondContact O-N 3.32Å; A178-F182 VanDerWaalsContact O-N 3.13Å
179	M	89.5	Confident	88.8	Confident	139 Å²	139	89.6 Å²	89.6	69%	0.685	49%	0.49	S	S	*	.	H	α-helix	trans	-65.6	-43.3	174.2	-80.5	-170.9	178	0	0	112.5	L175 L176 W181 F182 V183	L175-M179 PolarHBondContact O-N 3.4Å; L176-M179 PolarHBondContact O-N 3.07Å; M179-W181 PolarHBondContact O-N 3.24Å; M179-F182 WeakPolarHBondContact O-CB 3.43Å; M179-F182 PolarHBondContact O-N 3.48Å; M179-F182 VanDerWaalsContact O-N 3.15Å; M179-V183 WeakPolarHBondContact O-CG2 3.47Å; M179-V183 PolarHBondContact O-N 2.88Å; M179-V183 VanDerWaalsContact O-N 3.11Å
180	L	90.2	Very high	88.7	Confident	30 Å²	30	90.8 Å²	90.8	16%	0.157	49%	0.493	C	S	.	.	H	α-helix	trans	-61.7	-33.8	176.5	-71.7	170.4	0	0	0	112.1	L176 A177 V183 A184 A185 Y190 C193	L176-L180 HydrophobicContact CG-CD1 4.33Å; L176-L180 WeakPolarHBondContact O-CG 3.37Å; L176-L180 PolarHBondContact O-N 3.25Å; A177-L180 PolarHBondContact O-N 3.49Å; L180-V183 PolarHBondContact O-N 3.3Å; L180-A184 PolarHBondContact O-N 3.45Å; L180-A185 HydrophobicContact CB-CB 4.14Å; L180-A185 HydrophobicContact CD2-CB 3.78Å; L180-A185 WeakPolarHBondContact O-CB 3.5Å; L180-A185 PolarHBondContact O-N 2.93Å; L180-Y190 VanDerWaalsContact C-OH 3.3Å; L180-Y190 HydrophobicContact CB-CD1 4.33Å; L180-Y190 HydrophobicContact CB-CE1 3.75Å; L180-Y190 HydrophobicContact CB-CE2 4.33Å; L180-Y190 HydrophobicContact CD1-CD1 4.15Å; L180-Y190 HydrophobicContact CD1-CE1 4.39Å; L180-Y190 HydrophobicContact CD1-CG 4.44Å; L180-Y190 PolarHBondContact O-OH 3.29Å; L180-C193 HydrophobicContact CD1-CB 4.12Å
181	W	87.7	Confident	88.6	Confident	207 Å²	207	92.4 Å²	92.4	78%	0.784	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-40.8	175.1	-170.2	58	0	0	0	111.9	A177 A178 M179 V183 A184 Y190	A177-W181 WeakPolarHBondContact O-CB 3.39Å; A177-W181 PolarHBondContact O-N 2.87Å; A178-W181 PolarHBondContact O-N 2.86Å; M179-W181 PolarHBondContact O-N 3.24Å; W181-V183 VanDerWaalsContact C-N 3.33Å; W181-V183 PolarHBondContact O-N 3.22Å; W181-A184 PolarHBondContact O-N 3.38Å; W181-Y190 WeakPolarHBondContact CA-OH 3.38Å; W181-Y190 WeakPolarHBondContact CB-OH 3.41Å; W181-Y190 PolarHBondContact N-OH 2.92Å
182	F	86.7	Confident	88.6	Confident	186 Å²	186	92.9 Å²	92.9	82%	0.816	50%	0.501	S	S	*	.	H	α-helix	trans	-65.5	-33.6	176.5	-166	-97.6	0	0	0	113.3	A178 M179 A184	A178-F182 PolarHBondContact O-N 3.32Å; A178-F182 VanDerWaalsContact O-N 3.13Å; M179-F182 WeakPolarHBondContact O-CB 3.43Å; M179-F182 PolarHBondContact O-N 3.48Å; M179-F182 VanDerWaalsContact O-N 3.15Å; F182-A184 VanDerWaalsContact C-N 3.28Å; F182-A184 PolarHBondContact O-N 3.22Å
183	V	88	Confident	88.6	Confident	113 Å²	113	88.8 Å²	88.8	69%	0.685	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	3.7	178.5	-176.2	0	0	0	0	112.4	M179 L180 W181 A185	M179-V183 WeakPolarHBondContact O-CG2 3.47Å; M179-V183 PolarHBondContact O-N 2.88Å; M179-V183 VanDerWaalsContact O-N 3.11Å; L180-V183 PolarHBondContact O-N 3.3Å; W181-V183 VanDerWaalsContact C-N 3.33Å; W181-V183 PolarHBondContact O-N 3.22Å; V183-A185 PolarHBondContact O-N 3.42Å
184	A	83.5	Confident	88.5	Confident	88 Å²	88	86.9 Å²	86.9	73%	0.727	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	39.6	-176.2	0	0	0	0	0	113.2	L180 W181 F182	L180-A184 PolarHBondContact O-N 3.45Å; W181-A184 PolarHBondContact O-N 3.38Å; F182-A184 VanDerWaalsContact C-N 3.28Å; F182-A184 PolarHBondContact O-N 3.22Å
185	A	85.6	Confident	88.6	Confident	20 Å²	20	87 Å²	87	17%	0.165	48%	0.48	C	S	.	.			trans	-65.4	147.1	-178.2	0	0	0	0	0	111.6	L180 V183 T189 Y190	L180-A185 HydrophobicContact CB-CB 4.14Å; L180-A185 HydrophobicContact CD2-CB 3.78Å; L180-A185 WeakPolarHBondContact O-CB 3.5Å; L180-A185 PolarHBondContact O-N 2.93Å; V183-A185 PolarHBondContact O-N 3.42Å; A185-T189 VanDerWaalsContact CB-OG1 3.28Å; A185-T189 WeakPolarHBondContact CB-OG1 3.4Å; A185-Y190 WeakPolarHBondContact O-CE2 3.43Å
186	P	87.9	Confident	88.6	Confident	87 Å²	87	85.9 Å²	85.9	57%	0.565	48%	0.478	S	S	*	.			trans	-69.1	150.7	-178.6	25.8	-31.8	0	0	0	111.9	V188 T189	P186-V188 PolarHBondContact O-N 3.49Å; P186-T189 HydrophobicContact CG-CG2 3.93Å; P186-T189 WeakPolarHBondContact O-CB 3.4Å; P186-T189 PolarHBondContact O-N 3.21Å; P186-T189 PolarHBondContact O-OG1 3.24Å
187	V	84.7	Confident	88.6	Confident	110 Å²	110	84 Å²	84	67%	0.667	47%	0.469	S	S	*	.	H	α-helix	trans	-50.6	-35.8	-175.4	178.9	0	0	0	0	113.4	T189 Y190 I191	V187-T189 PolarHBondContact O-N 3.41Å; V187-Y190 WeakPolarHBondContact O-CB 3.43Å; V187-Y190 PolarHBondContact O-N 3.47Å; V187-Y190 VanDerWaalsContact O-N 3.07Å; V187-I191 HydrophobicContact CG1-CD1 4.44Å; V187-I191 PolarHBondContact O-N 2.97Å
188	V	88.2	Confident	88.8	Confident	112 Å²	112	88.8 Å²	88.8	68%	0.679	49%	0.491	S	S	*	.	H	α-helix	trans	-56.4	-34.8	177.2	-178.8	0	0	0	0	112.1	P186 I191 L192	P186-V188 PolarHBondContact O-N 3.49Å; V188-I191 PolarHBondContact O-N 3.27Å; V188-L192 PolarHBondContact O-N 3.25Å
189	T	87.8	Confident	89	Confident	42 Å²	42	91.3 Å²	91.3	26%	0.258	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-37.5	177.2	59.3	0	0	0	0	112.6	A185 P186 V187 I191 L192 C193	A185-T189 VanDerWaalsContact CB-OG1 3.28Å; A185-T189 WeakPolarHBondContact CB-OG1 3.4Å; P186-T189 HydrophobicContact CG-CG2 3.93Å; P186-T189 WeakPolarHBondContact O-CB 3.4Å; P186-T189 PolarHBondContact O-N 3.21Å; P186-T189 PolarHBondContact O-OG1 3.24Å; V187-T189 PolarHBondContact O-N 3.41Å; T189-I191 PolarHBondContact O-N 2.95Å; T189-L192 PolarHBondContact O-N 3.05Å; T189-C193 WeakPolarHBondContact O-CB 3.39Å; T189-C193 PolarHBondContact O-N 3.37Å; T189-C193 PolarHBondContact O-SG 2.78Å
190	Y	87.3	Confident	89.1	Confident	59 Å²	59	86.7 Å²	86.7	23%	0.231	48%	0.48	C	S	.	.	H	α-helix	trans	-63.5	-42.9	175.3	-68.5	-94.2	0	0	0	111.8	A177 L180 W181 A185 V187 L192 C193 A194	A177-Y190 HydrophobicContact CB-CD1 4.4Å; A177-Y190 HydrophobicContact CB-CE1 4.37Å; L180-Y190 VanDerWaalsContact C-OH 3.3Å; L180-Y190 HydrophobicContact CB-CD1 4.33Å; L180-Y190 HydrophobicContact CB-CE1 3.75Å; L180-Y190 HydrophobicContact CB-CE2 4.33Å; L180-Y190 HydrophobicContact CD1-CD1 4.15Å; L180-Y190 HydrophobicContact CD1-CE1 4.39Å; L180-Y190 HydrophobicContact CD1-CG 4.44Å; L180-Y190 PolarHBondContact O-OH 3.29Å; W181-Y190 WeakPolarHBondContact CA-OH 3.38Å; W181-Y190 WeakPolarHBondContact CB-OH 3.41Å; W181-Y190 PolarHBondContact N-OH 2.92Å; A185-Y190 WeakPolarHBondContact O-CE2 3.43Å; V187-Y190 WeakPolarHBondContact O-CB 3.43Å; V187-Y190 PolarHBondContact O-N 3.47Å; V187-Y190 VanDerWaalsContact O-N 3.07Å; Y190-L192 VanDerWaalsContact C-N 3.35Å; Y190-C193 PolarHBondContact O-N 2.92Å; Y190-A194 WeakPolarHBondContact O-CB 3.48Å; Y190-A194 PolarHBondContact O-N 2.87Å
191	I	89	Confident	89.1	Confident	112 Å²	112	86.3 Å²	86.3	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-62.6	-45.6	177.8	-61.1	173.9	0	0	0	109.8	V187 V188 T189 C193 A194 L195	V187-I191 HydrophobicContact CG1-CD1 4.44Å; V187-I191 PolarHBondContact O-N 2.97Å; V188-I191 PolarHBondContact O-N 3.27Å; T189-I191 PolarHBondContact O-N 2.95Å; I191-C193 PolarHBondContact O-N 2.91Å; I191-A194 PolarHBondContact O-N 3.48Å; I191-L195 WeakPolarHBondContact O-CB 3.37Å; I191-L195 PolarHBondContact O-N 3.44Å
192	L	91	Very high	89.3	Confident	113 Å²	113	79.2 Å²	79.2	59%	0.592	47%	0.465	S	S	*	.	H	α-helix	trans	-60.2	-47.2	177.5	-161.4	88.1	0	0	0	111.2	V188 T189 Y190 A194 L195 V196	V188-L192 PolarHBondContact O-N 3.25Å; T189-L192 PolarHBondContact O-N 3.05Å; Y190-L192 VanDerWaalsContact C-N 3.35Å; L192-A194 PolarHBondContact O-N 3.28Å; L192-L195 PolarHBondContact O-N 3.02Å; L192-V196 WeakPolarHBondContact O-CG2 3.44Å; L192-V196 PolarHBondContact O-N 3.36Å
193	C	90	Very high	89.7	Confident	27 Å²	27	73 Å²	73	18%	0.182	44%	0.444	C	S	.	.	H	α-helix	trans	-63.7	-40.4	177.8	-74	0	0	0	0	112.7	L176 L180 T189 Y190 I191 L195 V196 V197	L176-C193 HydrophobicContact CD2-CB 3.68Å; L176-C193 HydrophobicContact CG-CB 4.49Å; L180-C193 HydrophobicContact CD1-CB 4.12Å; T189-C193 WeakPolarHBondContact O-CB 3.39Å; T189-C193 PolarHBondContact O-N 3.37Å; T189-C193 PolarHBondContact O-SG 2.78Å; Y190-C193 PolarHBondContact O-N 2.92Å; I191-C193 PolarHBondContact O-N 2.91Å; C193-L195 VanDerWaalsContact C-N 3.32Å; C193-L195 PolarHBondContact O-N 3.11Å; C193-V196 PolarHBondContact O-N 3.21Å; C193-V197 WeakPolarHBondContact O-CG2 3.18Å; C193-V197 PolarHBondContact O-N 3.48Å
194	A	90.4	Very high	89.8	Confident	28 Å²	28	71.4 Å²	71.4	23%	0.231	43%	0.428	C	S	.	.	H	α-helix	trans	-61.3	-42.5	174.8	0	0	0	0	0	111.5	F173 Y190 I191 L192 V197 L198	F173-A194 VanDerWaalsContact CE2-CA 3.43Å; F173-A194 HydrophobicContact CE2-CB 3.55Å; F173-A194 HydrophobicContact CZ-CB 3.8Å; Y190-A194 WeakPolarHBondContact O-CB 3.48Å; Y190-A194 PolarHBondContact O-N 2.87Å; I191-A194 PolarHBondContact O-N 3.48Å; L192-A194 PolarHBondContact O-N 3.28Å; A194-V197 PolarHBondContact O-N 3.39Å; A194-L198 WeakPolarHBondContact O-CB 3.47Å; A194-L198 PolarHBondContact O-N 2.83Å
195	L	92.8	Very high	90.2	Very high	100 Å²	100	68.9 Å²	68.9	52%	0.524	40%	0.401	S	S	.	.	H	α-helix	trans	-65.1	-41.8	177.1	-168.1	128.4	0	0	0	111.7	I191 L192 C193 L198 L199	I191-L195 WeakPolarHBondContact O-CB 3.37Å; I191-L195 PolarHBondContact O-N 3.44Å; L192-L195 PolarHBondContact O-N 3.02Å; C193-L195 VanDerWaalsContact C-N 3.32Å; C193-L195 PolarHBondContact O-N 3.11Å; L195-L198 PolarHBondContact O-N 2.99Å; L195-L199 HydrophobicContact CD2-CD1 3.65Å; L195-L199 HydrophobicContact CD2-CG 4.44Å; L195-L199 HydrophobicContact CG-CD1 4.41Å; L195-L199 WeakPolarHBondContact O-CB 3.3Å; L195-L199 WeakPolarHBondContact O-CG 3.5Å; L195-L199 PolarHBondContact O-N 3.36Å
196	V	91.6	Very high	90.4	Very high	86 Å²	86	76 Å²	76	52%	0.521	42%	0.424	S	S	.	.	H	α-helix	trans	-60.8	-45.7	174.1	171.1	0	0	0	0	111.2	L192 C193 L199 A200	L192-V196 WeakPolarHBondContact O-CG2 3.44Å; L192-V196 PolarHBondContact O-N 3.36Å; C193-V196 PolarHBondContact O-N 3.21Å; V196-L199 PolarHBondContact O-N 3.24Å; V196-A200 VanDerWaalsContact O-CB 3.26Å; V196-A200 WeakPolarHBondContact O-CB 3.24Å; V196-A200 PolarHBondContact O-N 3.07Å
197	V	91.2	Very high	90.6	Very high	26 Å²	26	76.5 Å²	76.5	16%	0.158	42%	0.419	C	S	.	.	H	α-helix	trans	-65.8	-39.7	177.8	174.7	0	0	0	0	111.6	M169 F173 C193 A194 A200 S201	M169-V197 HydrophobicContact CB-CG1 4.36Å; M169-V197 HydrophobicContact CE-CG1 4.16Å; F173-V197 HydrophobicContact CB-CB 4.5Å; F173-V197 HydrophobicContact CB-CG1 4.11Å; F173-V197 HydrophobicContact CB-CG2 4.22Å; F173-V197 HydrophobicContact CD2-CB 4.3Å; F173-V197 HydrophobicContact CD2-CG2 4.02Å; C193-V197 WeakPolarHBondContact O-CG2 3.18Å; C193-V197 PolarHBondContact O-N 3.48Å; A194-V197 PolarHBondContact O-N 3.39Å; V197-A200 PolarHBondContact O-N 3.08Å; V197-S201 VanDerWaalsContact O-CB 3.29Å; V197-S201 WeakPolarHBondContact O-CB 3.39Å; V197-S201 PolarHBondContact O-N 3.32Å
198	L	92.1	Very high	90.9	Very high	124 Å²	124	74 Å²	74	65%	0.649	40%	0.401	S	S	*	.	H	α-helix	trans	-61.9	-46.6	175.5	-88	165.3	0	0	0	111.8	A194 L195 S201 A202	A194-L198 WeakPolarHBondContact O-CB 3.47Å; A194-L198 PolarHBondContact O-N 2.83Å; L195-L198 PolarHBondContact O-N 2.99Å; L198-S201 PolarHBondContact O-N 2.96Å; L198-A202 WeakPolarHBondContact O-CB 3.38Å; L198-A202 PolarHBondContact O-N 3.16Å
199	L	93.6	Very high	91.1	Very high	109 Å²	109	68.8 Å²	68.8	57%	0.571	37%	0.369	S	S	*	.	H	α-helix	trans	-63.1	-43.7	176.1	-73.5	172.6	0	0	0	111.6	L195 V196 S201 A202 C203	L195-L199 HydrophobicContact CD2-CD1 3.65Å; L195-L199 HydrophobicContact CD2-CG 4.44Å; L195-L199 HydrophobicContact CG-CD1 4.41Å; L195-L199 WeakPolarHBondContact O-CB 3.3Å; L195-L199 WeakPolarHBondContact O-CG 3.5Å; L195-L199 PolarHBondContact O-N 3.36Å; V196-L199 PolarHBondContact O-N 3.24Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 2.88Å; L199-A202 PolarHBondContact O-N 2.95Å; L199-C203 VanDerWaalsContact O-CB 3.24Å; L199-C203 WeakPolarHBondContact O-CB 3.11Å; L199-C203 PolarHBondContact O-N 3.15Å
200	A	91.1	Very high	91.3	Very high	41 Å²	41	73.9 Å²	73.9	34%	0.339	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-41	175.9	0	0	0	0	0	111.5	M169 V196 V197 C203 F204	M169-A200 HydrophobicContact CE-CB 3.46Å; M169-A200 VanDerWaalsContact CE-CB 3.46Å; V196-A200 VanDerWaalsContact O-CB 3.26Å; V196-A200 WeakPolarHBondContact O-CB 3.24Å; V196-A200 PolarHBondContact O-N 3.07Å; V197-A200 PolarHBondContact O-N 3.08Å; A200-C203 PolarHBondContact O-N 3.42Å; A200-F204 WeakPolarHBondContact O-CB 3.35Å; A200-F204 PolarHBondContact O-N 3.48Å
201	S	91.7	Very high	91.6	Very high	23 Å²	23	71.8 Å²	71.8	16%	0.161	38%	0.378	C	S	.	.	H	α-helix	trans	-65.8	-41.8	176.3	-174.6	0	0	0	0	111.5	V197 L198 L199 F204 E205	V197-S201 VanDerWaalsContact O-CB 3.29Å; V197-S201 WeakPolarHBondContact O-CB 3.39Å; V197-S201 PolarHBondContact O-N 3.32Å; L198-S201 PolarHBondContact O-N 2.96Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 2.88Å; S201-F204 PolarHBondContact O-N 3.38Å; S201-E205 VanDerWaalsContact O-CB 3.31Å; S201-E205 WeakPolarHBondContact O-CB 3.28Å; S201-E205 PolarHBondContact O-N 2.94Å
202	A	92.3	Very high	91.8	Very high	58 Å²	58	69.2 Å²	69.2	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-65.2	-42.2	176.2	0	0	0	0	0	111.4	L198 L199 E205 W206	L198-A202 WeakPolarHBondContact O-CB 3.38Å; L198-A202 PolarHBondContact O-N 3.16Å; L199-A202 PolarHBondContact O-N 2.95Å; A202-E205 PolarHBondContact O-N 3.07Å; A202-W206 WeakPolarHBondContact O-CB 3.32Å; A202-W206 PolarHBondContact O-N 3.39Å
203	C	93.2	Very high	91.9	Very high	54 Å²	54	66.3 Å²	66.3	37%	0.365	35%	0.348	S	S	.	.	H	α-helix	trans	-61.3	-48.6	174.9	-175.9	0	0	0	0	111.4	L199 A200 E205 W206 Q207	L199-C203 VanDerWaalsContact O-CB 3.24Å; L199-C203 WeakPolarHBondContact O-CB 3.11Å; L199-C203 PolarHBondContact O-N 3.15Å; A200-C203 PolarHBondContact O-N 3.42Å; C203-E205 VanDerWaalsContact C-N 3.34Å; C203-E205 PolarHBondContact O-N 3.43Å; C203-W206 PolarHBondContact O-N 2.81Å; C203-Q207 WeakPolarHBondContact O-CB 3.41Å; C203-Q207 WeakPolarHBondContact O-CG 3.37Å; C203-Q207 PolarHBondContact O-N 3.25Å; C203-Q207 PolarHBondContact SG-NE2 3.36Å; C203-Q207 VanDerWaalsContact SG-NE2 3.36Å
204	F	90.7	Very high	92	Very high	81 Å²	81	68 Å²	68	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-62.3	-41.2	177.4	-168.3	-87.7	0	0	0	111.9	A165 A200 S201 W206 I208 V209	A165-F204 HydrophobicContact CB-CD1 3.78Å; A165-F204 HydrophobicContact CB-CE1 3.58Å; A200-F204 WeakPolarHBondContact O-CB 3.35Å; A200-F204 PolarHBondContact O-N 3.48Å; S201-F204 PolarHBondContact O-N 3.38Å; F204-W206 VanDerWaalsContact C-N 3.34Å; F204-W206 PolarHBondContact O-N 3.32Å; F204-I208 HydrophobicContact CD2-CD1 3.65Å; F204-I208 HydrophobicContact CE1-CB 4.3Å; F204-I208 HydrophobicContact CE1-CG2 4.18Å; F204-I208 HydrophobicContact CE2-CD1 3.33Å; F204-I208 HydrophobicContact CE2-CG1 4.47Å; F204-I208 HydrophobicContact CG-CD1 4.4Å; F204-I208 HydrophobicContact CZ-CB 4.31Å; F204-I208 HydrophobicContact CZ-CD1 3.82Å; F204-I208 HydrophobicContact CZ-CG2 4.07Å; F204-I208 WeakPolarHBondContact O-CB 3.42Å; F204-I208 PolarHBondContact O-N 3.33Å; F204-V209 HydrophobicContact CD1-CG2 3.9Å; F204-V209 HydrophobicContact CE1-CG2 3.95Å; F204-V209 PolarHBondContact O-N 3.43Å
205	E	91.8	Very high	92.2	Very high	35 Å²	35	67.3 Å²	67.3	16%	0.164	35%	0.348	C	S	.	.	I	π-helix	trans	-63.2	-41.4	176.3	-170.8	169.7	153.8	0	0	111.6	R166 S201 A202 C203 V209 R210	R166-E205 IonicContact CZ-OE2 2.72Å; R166-E205 IonicContact NE-OE2 3.38Å; R166-E205 PolarHBondContact NE-OE2 3.22Å; R166-E205 VanDerWaalsContact NH2-CD 3.34Å; R166-E205 IonicContact NH2-OE1 3.62Å; R166-E205 PolarHBondContact NH2-OE1 3Å; R166-E205 VanDerWaalsContact NH2-OE1 3.13Å; R166-E205 IonicContact NH2-OE2 3.64Å; R166-E205 PolarHBondContact NH2-OE2 3.36Å; S201-E205 VanDerWaalsContact O-CB 3.31Å; S201-E205 WeakPolarHBondContact O-CB 3.28Å; S201-E205 PolarHBondContact O-N 2.94Å; A202-E205 PolarHBondContact O-N 3.07Å; C203-E205 VanDerWaalsContact C-N 3.34Å; C203-E205 PolarHBondContact O-N 3.43Å; E205-V209 HydrophobicContact CG-CB 4.25Å; E205-V209 PolarHBondContact O-N 3.14Å; E205-R210 HydrophobicContact CG-CG 4.44Å; E205-R210 WeakPolarHBondContact O-CB 3.25Å; E205-R210 WeakPolarHBondContact O-CG 3.43Å; E205-R210 PolarHBondContact O-N 3Å
206	W	91.1	Very high	92.2	Very high	170 Å²	170	65.5 Å²	65.5	64%	0.644	35%	0.347	S	S	*	.	I	π-helix	trans	-72.8	-42.8	178.9	-178.1	69.1	0	0	0	113.4	A202 C203 F204 P211	A202-W206 WeakPolarHBondContact O-CB 3.32Å; A202-W206 PolarHBondContact O-N 3.39Å; C203-W206 PolarHBondContact O-N 2.81Å; F204-W206 VanDerWaalsContact C-N 3.34Å; F204-W206 PolarHBondContact O-N 3.32Å; W206-P211 WeakPolarHBondContact O-CD 3.43Å; W206-P211 WeakPolarHBondContact O-CG 3.49Å
207	Q	90.8	Very high	92.2	Very high	96 Å²	96	67.3 Å²	67.3	45%	0.449	35%	0.35	S	S	.	.	I	π-helix	trans	-83.8	-28	-175.3	-67.6	-169.5	6.3	0	0	114	C203 R235	C203-Q207 WeakPolarHBondContact O-CB 3.41Å; C203-Q207 WeakPolarHBondContact O-CG 3.37Å; C203-Q207 PolarHBondContact O-N 3.25Å; C203-Q207 PolarHBondContact SG-NE2 3.36Å; C203-Q207 VanDerWaalsContact SG-NE2 3.36Å; Q207-R235 PolarHBondContact O-NH1 3.3Å; Q207-R235 PolarHBondContact O-NH2 3.02Å
208	I	91.3	Very high	92.3	Very high	59 Å²	59	66.8 Å²	66.8	30%	0.303	35%	0.346	S	S	.	.	I	π-helix	trans	-121.9	-57	-171.9	-66	169.6	0	0	0	110.9	F204 P211 I212	F204-I208 HydrophobicContact CD2-CD1 3.65Å; F204-I208 HydrophobicContact CE1-CB 4.3Å; F204-I208 HydrophobicContact CE1-CG2 4.18Å; F204-I208 HydrophobicContact CE2-CD1 3.33Å; F204-I208 HydrophobicContact CE2-CG1 4.47Å; F204-I208 HydrophobicContact CG-CD1 4.4Å; F204-I208 HydrophobicContact CZ-CB 4.31Å; F204-I208 HydrophobicContact CZ-CD1 3.82Å; F204-I208 HydrophobicContact CZ-CG2 4.07Å; F204-I208 WeakPolarHBondContact O-CB 3.42Å; F204-I208 PolarHBondContact O-N 3.33Å; I208-P211 WeakPolarHBondContact O-CD 3.12Å; I208-I212 HydrophobicContact CG2-CD1 3.64Å; I208-I212 WeakPolarHBondContact O-CB 3.5Å; I208-I212 WeakPolarHBondContact O-CD1 3.2Å; I208-I212 VanDerWaalsContact O-CG1 3.25Å; I208-I212 WeakPolarHBondContact O-CG1 3.34Å; I208-I212 PolarHBondContact O-N 3.44Å; I208-I212 VanDerWaalsContact O-N 3.08Å
209	V	92.6	Very high	92.4	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.006	33%	0.326	C	S	.	.	I	π-helix	trans	-66.1	-53.6	-170.4	-179.3	0	0	0	0	112	L161 R162 A165 F204 E205 I212 E213	L161-V209 HydrophobicContact CG-CG2 4.44Å; R162-V209 HydrophobicContact CB-CG1 3.75Å; A165-V209 HydrophobicContact CB-CG2 3.99Å; F204-V209 HydrophobicContact CD1-CG2 3.9Å; F204-V209 HydrophobicContact CE1-CG2 3.95Å; F204-V209 PolarHBondContact O-N 3.43Å; E205-V209 HydrophobicContact CG-CB 4.25Å; E205-V209 PolarHBondContact O-N 3.14Å; V209-I212 PolarHBondContact O-N 2.99Å; V209-E213 HydrophobicContact CG1-CG 4.42Å; V209-E213 WeakPolarHBondContact O-CG 3.18Å; V209-E213 PolarHBondContact O-N 2.69Å
210	R	92.2	Very high	92.3	Very high	150 Å²	150	59.2 Å²	59.2	57%	0.566	31%	0.31	S	S	*	.	H	α-helix	trans	-61.3	-45.2	-178.6	-73.6	-179.1	-178.8	-165.3	1.2	112.6	E205 E213 N214	E205-R210 HydrophobicContact CG-CG 4.44Å; E205-R210 WeakPolarHBondContact O-CB 3.25Å; E205-R210 WeakPolarHBondContact O-CG 3.43Å; E205-R210 PolarHBondContact O-N 3Å; R210-E213 PolarHBondContact O-N 2.87Å; R210-N214 WeakPolarHBondContact O-CB 3.49Å; R210-N214 PolarHBondContact O-N 3.2Å
211	P	92.8	Very high	92.4	Very high	15 Å²	15	59.5 Å²	59.5	10%	0.097	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-42.8	175.2	-29.1	39.6	0	0	0	113.1	W206 I208 E213 N214 V215 R235 L239	W206-P211 WeakPolarHBondContact O-CD 3.43Å; W206-P211 WeakPolarHBondContact O-CG 3.49Å; I208-P211 WeakPolarHBondContact O-CD 3.12Å; P211-E213 PolarHBondContact O-N 3.4Å; P211-N214 WeakPolarHBondContact O-CB 3.36Å; P211-N214 PolarHBondContact O-N 2.96Å; P211-V215 WeakPolarHBondContact O-CG2 3.19Å; P211-V215 PolarHBondContact O-N 3.49Å; P211-R235 VanDerWaalsContact CG-NH1 3.31Å; P211-L239 HydrophobicContact CB-CD1 3.84Å
212	I	93.6	Very high	92.4	Very high	58 Å²	58	59.6 Å²	59.6	30%	0.297	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-44	176	-71.7	168.7	0	0	0	111.3	L161 I208 V209 N214 V215 A216 L239	L161-I212 HydrophobicContact CD2-CB 4.03Å; L161-I212 HydrophobicContact CD2-CD1 3.63Å; L161-I212 HydrophobicContact CD2-CG1 4.43Å; L161-I212 HydrophobicContact CD2-CG2 3.79Å; I208-I212 HydrophobicContact CG2-CD1 3.64Å; I208-I212 WeakPolarHBondContact O-CB 3.5Å; I208-I212 WeakPolarHBondContact O-CD1 3.2Å; I208-I212 VanDerWaalsContact O-CG1 3.25Å; I208-I212 WeakPolarHBondContact O-CG1 3.34Å; I208-I212 PolarHBondContact O-N 3.44Å; I208-I212 VanDerWaalsContact O-N 3.08Å; V209-I212 PolarHBondContact O-N 2.99Å; I212-N214 VanDerWaalsContact C-N 3.29Å; I212-N214 PolarHBondContact O-N 3.43Å; I212-V215 PolarHBondContact O-N 3.48Å; I212-A216 PolarHBondContact O-N 3.07Å; I212-L239 HydrophobicContact CD1-CD2 4.26Å; I212-L239 HydrophobicContact CG1-CD1 3.79Å; I212-L239 HydrophobicContact CG1-CD2 3.53Å; I212-L239 HydrophobicContact CG1-CG 4.35Å
213	E	92.3	Very high	92.2	Very high	52 Å²	52	59.7 Å²	59.7	24%	0.243	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-40.4	176	-73.5	-179.3	168.5	0	0	111.3	R162 V209 R210 P211 A216 H217	R162-E213 IonicContact CZ-OE1 3.05Å; R162-E213 IonicContact CZ-OE2 3.04Å; R162-E213 IonicContact NE-OE1 3.6Å; R162-E213 PolarHBondContact NE-OE1 3.37Å; R162-E213 IonicContact NE-OE2 3.91Å; R162-E213 VanDerWaalsContact NH2-CD 3.25Å; R162-E213 IonicContact NH2-OE1 2.87Å; R162-E213 PolarHBondContact NH2-OE1 2.96Å; R162-E213 VanDerWaalsContact NH2-OE1 3.15Å; R162-E213 IonicContact NH2-OE2 2.75Å; R162-E213 PolarHBondContact NH2-OE2 3.37Å; V209-E213 HydrophobicContact CG1-CG 4.42Å; V209-E213 WeakPolarHBondContact O-CG 3.18Å; V209-E213 PolarHBondContact O-N 2.69Å; R210-E213 PolarHBondContact O-N 2.87Å; P211-E213 PolarHBondContact O-N 3.4Å; E213-A216 PolarHBondContact O-N 3.44Å; E213-H217 WeakPolarHBondContact O-CB 3.48Å; E213-H217 PolarHBondContact O-N 3.14Å
214	N	92.6	Very high	92.1	Very high	62 Å²	62	57.6 Å²	57.6	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-45.9	174.1	-173.5	28.1	0	0	0	111.9	R210 P211 I212 A216 H217 Q218	R210-N214 WeakPolarHBondContact O-CB 3.49Å; R210-N214 PolarHBondContact O-N 3.2Å; P211-N214 WeakPolarHBondContact O-CB 3.36Å; P211-N214 PolarHBondContact O-N 2.96Å; I212-N214 VanDerWaalsContact C-N 3.29Å; I212-N214 PolarHBondContact O-N 3.43Å; N214-A216 VanDerWaalsContact C-N 3.34Å; N214-A216 PolarHBondContact O-N 2.86Å; N214-H217 PolarHBondContact O-N 3.28Å; N214-Q218 PolarHBondContact ND2-NE2 3.37Å; N214-Q218 WeakPolarHBondContact O-CG 3.5Å; N214-Q218 PolarHBondContact O-N 3.48Å; N214-Q218 PolarHBondContact OD1-NE2 3.24Å
215	V	94.6	Very high	91.9	Very high	14 Å²	14	54.9 Å²	54.9	9%	0.085	28%	0.284	C	S	.	.	H	α-helix	trans	-58.2	-47	176.4	173.8	0	0	0	0	110.9	P211 I212 H217 Q218 A219 L233 T242 L243	P211-V215 WeakPolarHBondContact O-CG2 3.19Å; P211-V215 PolarHBondContact O-N 3.49Å; I212-V215 PolarHBondContact O-N 3.48Å; V215-H217 PolarHBondContact O-N 2.96Å; V215-Q218 PolarHBondContact O-N 3.49Å; V215-A219 VanDerWaalsContact O-CB 3.27Å; V215-A219 WeakPolarHBondContact O-CB 3.31Å; V215-A219 PolarHBondContact O-N 3.11Å; V215-L233 HydrophobicContact CG2-CD2 4.26Å; V215-T242 HydrophobicContact CG1-CG2 4.04Å; V215-L243 HydrophobicContact CG1-CD1 4.36Å; V215-L243 HydrophobicContact CG2-CB 4.09Å; V215-L243 HydrophobicContact CG2-CD1 4.46Å; V215-L243 HydrophobicContact CG2-CD2 4.48Å
216	A	93	Very high	91.7	Very high	62 Å²	62	56.6 Å²	56.6	51%	0.512	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-41.1	177.8	0	0	0	0	0	112.3	I212 E213 N214 L220	I212-A216 PolarHBondContact O-N 3.07Å; E213-A216 PolarHBondContact O-N 3.44Å; N214-A216 VanDerWaalsContact C-N 3.34Å; N214-A216 PolarHBondContact O-N 2.86Å; A216-L220 WeakPolarHBondContact O-CB 3.43Å; A216-L220 PolarHBondContact O-N 3.38Å
217	H	91.8	Very high	91.5	Very high	124 Å²	124	52.9 Å²	52.9	57%	0.574	28%	0.278	S	S	*	.	H	α-helix	trans	-64.8	-43.7	179.2	-138.7	76.3	0	0	0	111.8	E213 N214 V215 L220 K221	E213-H217 WeakPolarHBondContact O-CB 3.48Å; E213-H217 PolarHBondContact O-N 3.14Å; N214-H217 PolarHBondContact O-N 3.28Å; V215-H217 PolarHBondContact O-N 2.96Å; H217-L220 WeakPolarHBondContact O-CB 3.47Å; H217-L220 PolarHBondContact O-N 2.94Å; H217-K221 WeakPolarHBondContact O-CG 3.14Å; H217-K221 PolarHBondContact O-N 3.5Å
218	Q	94.1	Very high	91.1	Very high	14 Å²	14	50.9 Å²	50.9	7%	0.065	27%	0.27	C	S	.	.	H	α-helix	trans	-71.3	-39.7	178.4	-68	-168.4	48.3	0	0	112.3	N214 V215 L220 K221 V222 V230 E231 L243	N214-Q218 PolarHBondContact ND2-NE2 3.37Å; N214-Q218 WeakPolarHBondContact O-CG 3.5Å; N214-Q218 PolarHBondContact O-N 3.48Å; N214-Q218 PolarHBondContact OD1-NE2 3.24Å; V215-Q218 PolarHBondContact O-N 3.49Å; Q218-L220 PolarHBondContact O-N 3.18Å; Q218-K221 PolarHBondContact O-N 3.45Å; Q218-K221 VanDerWaalsContact O-N 3.12Å; Q218-V222 PolarHBondContact O-N 2.85Å; Q218-V222 VanDerWaalsContact O-N 3.08Å; Q218-V230 HydrophobicContact CB-CG1 4.36Å; Q218-E231 PolarHBondContact OE1-O 2.9Å; Q218-L243 HydrophobicContact CB-CD1 3.84Å
219	A	93.5	Very high	90.8	Very high	28 Å²	28	51.3 Å²	51.3	23%	0.231	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-37.6	173.7	0	0	0	0	0	112.2	V215 V222 A223 V246	V215-A219 VanDerWaalsContact O-CB 3.27Å; V215-A219 WeakPolarHBondContact O-CB 3.31Å; V215-A219 PolarHBondContact O-N 3.11Å; A219-V222 PolarHBondContact O-N 3.08Å; A219-A223 WeakPolarHBondContact O-CB 3.48Å; A219-A223 PolarHBondContact O-N 3.42Å; A219-V246 HydrophobicContact CB-CG1 3.78Å; A219-V246 HydrophobicContact CB-CG2 4.19Å
220	L	92.1	Very high	90.7	Very high	46 Å²	46	52.3 Å²	52.3	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-41.2	174.4	-177.5	59	0	0	0	112.4	P78 A216 H217 Q218 V222 A223 T224	P78-L220 HydrophobicContact CG-CD1 4.33Å; A216-L220 WeakPolarHBondContact O-CB 3.43Å; A216-L220 PolarHBondContact O-N 3.38Å; H217-L220 WeakPolarHBondContact O-CB 3.47Å; H217-L220 PolarHBondContact O-N 2.94Å; Q218-L220 PolarHBondContact O-N 3.18Å; L220-V222 VanDerWaalsContact C-N 3.27Å; L220-V222 PolarHBondContact O-N 3.28Å; L220-A223 PolarHBondContact O-N 2.79Å; L220-T224 HydrophobicContact CD1-CG2 3.92Å; L220-T224 HydrophobicContact CG-CG2 4.35Å; L220-T224 WeakPolarHBondContact O-CB 3.5Å; L220-T224 VanDerWaalsContact O-CG2 3.28Å; L220-T224 WeakPolarHBondContact O-CG2 3.17Å; L220-T224 PolarHBondContact O-N 3.37Å; L220-T224 PolarHBondContact O-OG1 3.07Å
221	K	91.8	Very high	90.6	Very high	47 Å²	47	50.5 Å²	50.5	20%	0.204	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-33.7	175.7	-69.3	-171.1	176.6	-134	0	112.9	H217 Q218 T224 G225 E226 R227	H217-K221 WeakPolarHBondContact O-CG 3.14Å; H217-K221 PolarHBondContact O-N 3.5Å; Q218-K221 PolarHBondContact O-N 3.45Å; Q218-K221 VanDerWaalsContact O-N 3.12Å; K221-T224 PolarHBondContact O-OG1 3.21Å; K221-G225 PolarHBondContact O-N 3.44Å; K221-E226 HydrophobicContact CB-CB 4.33Å; K221-E226 WeakPolarHBondContact CE-OE1 3.42Å; K221-E226 IonicContact NZ-OE1 2.75Å; K221-E226 PolarHBondContact NZ-OE1 3.49Å; K221-E226 IonicContact NZ-OE2 2.74Å; K221-E226 PolarHBondContact O-N 3.47Å; K221-R227 HydrophobicContact CB-CB 4.28Å; K221-R227 HydrophobicContact CB-CG 4.4Å; K221-R227 HydrophobicContact CD-CG 4.43Å; K221-R227 PolarHBondContact O-N 2.96Å; K221-R227 VanDerWaalsContact O-N 3.09Å
222	V	92.2	Very high	90.2	Very high	26 Å²	26	57.7 Å²	57.7	16%	0.158	32%	0.315	C	S	.	.	H	α-helix	trans	-69.5	-49.3	172.9	176.7	0	0	0	0	111.2	Q218 A219 L220 T224 G225 R227 V230 V246 G250	Q218-V222 PolarHBondContact O-N 2.85Å; Q218-V222 VanDerWaalsContact O-N 3.08Å; A219-V222 PolarHBondContact O-N 3.08Å; L220-V222 VanDerWaalsContact C-N 3.27Å; L220-V222 PolarHBondContact O-N 3.28Å; V222-T224 VanDerWaalsContact C-N 3.29Å; V222-T224 PolarHBondContact O-N 3.23Å; V222-G225 PolarHBondContact O-N 2.97Å; V222-G225 VanDerWaalsContact O-N 3.14Å; V222-R227 VanDerWaalsContact CA-O 3.29Å; V222-R227 WeakPolarHBondContact CA-O 3.31Å; V222-V230 HydrophobicContact CG2-CG1 3.95Å; V222-V246 HydrophobicContact CB-CG1 4.32Å; V222-V246 HydrophobicContact CG2-CG1 4.2Å; V222-G250 VanDerWaalsContact CG1-CA 3.49Å
223	A	89.1	Confident	89.9	Confident	60 Å²	60	56.5 Å²	56.5	50%	0.496	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-29.4	-178.3	0	0	0	0	0	114.1	A219 L220 G225	A219-A223 WeakPolarHBondContact O-CB 3.48Å; A219-A223 PolarHBondContact O-N 3.42Å; L220-A223 PolarHBondContact O-N 2.79Å; A223-G225 VanDerWaalsContact C-N 3.35Å
224	T	89.6	Confident	89.7	Confident	9 Å²	9	62 Å²	62	6%	0.055	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-6.4	178.1	53.7	0	0	0	0	113.6	P101 V103 L220 K221 V222 E226	P101-T224 HydrophobicContact CG-CG2 3.94Å; P101-T224 WeakPolarHBondContact O-CA 3.45Å; P101-T224 VanDerWaalsContact O-CB 3.32Å; P101-T224 WeakPolarHBondContact O-CB 3.45Å; P101-T224 WeakPolarHBondContact O-CG2 3.5Å; V103-T224 HydrophobicContact CG2-CG2 4.38Å; V103-T224 PolarHBondContact N-O 2.96Å; L220-T224 HydrophobicContact CD1-CG2 3.92Å; L220-T224 HydrophobicContact CG-CG2 4.35Å; L220-T224 WeakPolarHBondContact O-CB 3.5Å; L220-T224 VanDerWaalsContact O-CG2 3.28Å; L220-T224 WeakPolarHBondContact O-CG2 3.17Å; L220-T224 PolarHBondContact O-N 3.37Å; L220-T224 PolarHBondContact O-OG1 3.07Å; K221-T224 PolarHBondContact O-OG1 3.21Å; V222-T224 VanDerWaalsContact C-N 3.29Å; V222-T224 PolarHBondContact O-N 3.23Å; T224-E226 VanDerWaalsContact C-N 3.29Å; T224-E226 PolarHBondContact O-N 3.42Å
225	G	87.1	Confident	89.6	Confident	24 Å²	24	62.1 Å²	62.1	25%	0.247	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	11	-176.2	0	0	0	0	0	114.8	K221 V222 A223	K221-G225 PolarHBondContact O-N 3.44Å; V222-G225 PolarHBondContact O-N 2.97Å; V222-G225 VanDerWaalsContact O-N 3.14Å; A223-G225 VanDerWaalsContact C-N 3.35Å
226	E	88.5	Confident	89.4	Confident	71 Å²	71	66.8 Å²	66.8	33%	0.332	37%	0.369	S	S	.	.	S	Bend	trans	-67.5	-39.7	176.2	-172.1	-170.7	142.6	0	0	111.3	V103 K221 T224	V103-E226 HydrophobicContact CB-CB 4.04Å; V103-E226 HydrophobicContact CG1-CB 3.88Å; V103-E226 HydrophobicContact CG1-CG 3.83Å; K221-E226 HydrophobicContact CB-CB 4.33Å; K221-E226 WeakPolarHBondContact CE-OE1 3.42Å; K221-E226 IonicContact NZ-OE1 2.75Å; K221-E226 PolarHBondContact NZ-OE1 3.49Å; K221-E226 IonicContact NZ-OE2 2.74Å; K221-E226 PolarHBondContact O-N 3.47Å; T224-E226 VanDerWaalsContact C-N 3.29Å; T224-E226 PolarHBondContact O-N 3.42Å
227	R	85.5	Confident	89.4	Confident	93 Å²	93	66.2 Å²	66.2	35%	0.351	36%	0.358	S	S	.	.			trans	-134.1	142.1	176.9	-67.5	-171.5	174.6	-167.7	-1.8	109.7	K221 V222 E231	K221-R227 HydrophobicContact CB-CB 4.28Å; K221-R227 HydrophobicContact CB-CG 4.4Å; K221-R227 HydrophobicContact CD-CG 4.43Å; K221-R227 PolarHBondContact O-N 2.96Å; K221-R227 VanDerWaalsContact O-N 3.09Å; V222-R227 VanDerWaalsContact CA-O 3.29Å; V222-R227 WeakPolarHBondContact CA-O 3.31Å; R227-E231 IonicContact CZ-OE1 3.84Å; R227-E231 IonicContact NH1-OE1 2.81Å; R227-E231 PolarHBondContact NH1-OE1 2.87Å; R227-E231 IonicContact NH2-OE1 3.27Å
228	N	82.6	Confident	89.5	Confident	53 Å²	53	67.3 Å²	67.3	28%	0.283	36%	0.363	S	S	.	.	S	Bend	trans	-95.4	-2.1	174.4	-58.6	-56.3	0	0	0	112.8	G250 L251 R254	N228-G250 CarbonylContact O-C 3.54Å; N228-G250 VanDerWaalsContact O-C 3.22Å; N228-L251 PolarHBondContact O-N 3.42Å; N228-R254 HydrophobicContact CB-CB 4.02Å; N228-R254 HydrophobicContact CB-CG 4.21Å; N228-R254 PolarHBondContact ND2-NH1 2.93Å
229	S	85.6	Confident	89.4	Confident	69 Å²	69	68.1 Å²	68.1	48%	0.483	37%	0.367	S	S	.	.	S	Bend	trans	-139	160.9	-178.3	62.8	0	0	0	0	110.9
230	V	90.2	Very high	89.5	Confident	22 Å²	22	66.8 Å²	66.8	13%	0.133	36%	0.357	C	S	.	.			trans	-107.8	149.7	177.9	-62.2	0	0	0	0	109.5	Q218 V222 L243 V246	Q218-V230 HydrophobicContact CB-CG1 4.36Å; V222-V230 HydrophobicContact CG2-CG1 3.95Å; V230-L243 HydrophobicContact CB-CD1 3.88Å; V230-L243 HydrophobicContact CB-CG 4.04Å; V230-L243 HydrophobicContact CG1-CD1 3.78Å; V230-L243 HydrophobicContact CG1-CG 4.39Å; V230-L243 HydrophobicContact CG2-CD1 4.37Å; V230-L243 HydrophobicContact CG2-CG 4.05Å; V230-V246 HydrophobicContact CG1-CG1 4.08Å
231	E	89.7	Confident	89.6	Confident	111 Å²	111	70 Å²	70	52%	0.519	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-75.6	128.9	168.2	-71.6	172.6	-162.6	0	0	109	Q218 R227 L233 L243	Q218-E231 PolarHBondContact OE1-O 2.9Å; R227-E231 IonicContact CZ-OE1 3.84Å; R227-E231 IonicContact NH1-OE1 2.81Å; R227-E231 PolarHBondContact NH1-OE1 2.87Å; R227-E231 IonicContact NH2-OE1 3.27Å; E231-L233 PolarHBondContact O-N 3.25Å; E231-L233 VanDerWaalsContact O-N 3.16Å; E231-L243 WeakPolarHBondContact O-CD2 3.21Å
232	H	84.8	Confident	89.7	Confident	167 Å²	167	71 Å²	71	77%	0.773	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-59	121.6	-177.1	-72.7	-66.8	0	0	0	111.6
233	L	86.6	Confident	89.8	Confident	33 Å²	33	69.9 Å²	69.9	17%	0.173	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-81.9	120.7	165.2	-174.3	63.1	0	0	0	107.9	V215 E231 R235 L239 L243	V215-L233 HydrophobicContact CG2-CD2 4.26Å; E231-L233 PolarHBondContact O-N 3.25Å; E231-L233 VanDerWaalsContact O-N 3.16Å; L233-R235 HydrophobicContact CD2-CB 4.38Å; L233-R235 HydrophobicContact CD2-CG 4.45Å; L233-R235 HydrophobicContact CG-CB 4.12Å; L233-R235 HydrophobicContact CG-CG 4.05Å; L233-R235 PolarHBondContact O-N 3.34Å; L233-L239 HydrophobicContact CD2-CB 4.2Å; L233-L243 HydrophobicContact CB-CD2 3.65Å
234	N	89.7	Confident	90	Very high	167 Å²	167	72.5 Å²	72.5	89%	0.893	37%	0.374	S	S	*	.	S	Bend	trans	-73.8	61.3	177.8	-169.6	17.4	0	0	0	111.6
235	R	89.3	Confident	90.2	Very high	65 Å²	65	74.5 Å²	74.5	25%	0.245	39%	0.391	C	S	.	.			trans	-142.5	149.7	178.1	-67.7	174.1	70.2	148.4	-0.1	109.3	Q207 P211 L233 D237 R244	Q207-R235 PolarHBondContact O-NH1 3.3Å; Q207-R235 PolarHBondContact O-NH2 3.02Å; P211-R235 VanDerWaalsContact CG-NH1 3.31Å; L233-R235 HydrophobicContact CD2-CB 4.38Å; L233-R235 HydrophobicContact CD2-CG 4.45Å; L233-R235 HydrophobicContact CG-CB 4.12Å; L233-R235 HydrophobicContact CG-CG 4.05Å; L233-R235 PolarHBondContact O-N 3.34Å; R235-D237 IonicContact CZ-OD1 3.13Å; R235-D237 IonicContact CZ-OD2 2.78Å; R235-D237 IonicContact NE-OD1 3.2Å; R235-D237 PolarHBondContact NE-OD1 3.47Å; R235-D237 IonicContact NE-OD2 2.76Å; R235-D237 PolarHBondContact NE-OD2 3.1Å; R235-D237 IonicContact NH2-OD1 3.4Å; R235-D237 IonicContact NH2-OD2 2.76Å; R235-D237 PolarHBondContact NH2-OD2 3.09Å; R235-R244 PolarHBondContact O-NH1 2.85Å; R235-R244 PolarHBondContact O-NH2 2.8Å
236	S	90.1	Very high	90.6	Very high	112 Å²	112	74.7 Å²	74.7	78%	0.783	39%	0.387	S	S	*	.			trans	-113.7	1.9	176.9	47.5	0	0	0	0	113.4
237	D	93.2	Very high	90.8	Very high	50 Å²	50	71.5 Å²	71.5	27%	0.267	37%	0.374	S	S	.	.	S	Bend	trans	-79	-172.1	177.1	61	15.7	0	0	0	112.9	R235 L239 G240 L241	R235-D237 IonicContact CZ-OD1 3.13Å; R235-D237 IonicContact CZ-OD2 2.78Å; R235-D237 IonicContact NE-OD1 3.2Å; R235-D237 PolarHBondContact NE-OD1 3.47Å; R235-D237 IonicContact NE-OD2 2.76Å; R235-D237 PolarHBondContact NE-OD2 3.1Å; R235-D237 IonicContact NH2-OD1 3.4Å; R235-D237 IonicContact NH2-OD2 2.76Å; R235-D237 PolarHBondContact NH2-OD2 3.09Å; D237-L239 PolarHBondContact O-N 2.96Å; D237-L239 VanDerWaalsContact O-N 3.16Å; D237-L239 PolarHBondContact OD1-N 3.35Å; D237-G240 PolarHBondContact O-N 3.4Å; D237-G240 VanDerWaalsContact O-N 3.08Å; D237-G240 PolarHBondContact OD1-N 3.32Å; D237-L241 WeakPolarHBondContact O-CB 3.49Å; D237-L241 PolarHBondContact O-N 3.08Å
238	E	94.4	Very high	91.2	Very high	146 Å²	146	72.4 Å²	72.4	68%	0.682	38%	0.382	S	S	*	.	H	α-helix	trans	-57.6	-31.6	-177.4	-61.7	75.8	-165.8	0	0	112.3	T242	E238-T242 VanDerWaalsContact O-CB 3.23Å; E238-T242 WeakPolarHBondContact O-CB 3.44Å; E238-T242 PolarHBondContact O-N 3.46Å; E238-T242 PolarHBondContact O-OG1 3.48Å
239	L	92.8	Very high	91.7	Very high	31 Å²	31	74.9 Å²	74.9	16%	0.162	40%	0.395	C	S	.	.	H	α-helix	trans	-73.3	-44.3	177.1	-59.2	-173.7	0	0	0	111.2	P211 I212 L233 D237 T242 L243	P211-L239 HydrophobicContact CB-CD1 3.84Å; I212-L239 HydrophobicContact CD1-CD2 4.26Å; I212-L239 HydrophobicContact CG1-CD1 3.79Å; I212-L239 HydrophobicContact CG1-CD2 3.53Å; I212-L239 HydrophobicContact CG1-CG 4.35Å; L233-L239 HydrophobicContact CD2-CB 4.2Å; D237-L239 PolarHBondContact O-N 2.96Å; D237-L239 VanDerWaalsContact O-N 3.16Å; D237-L239 PolarHBondContact OD1-N 3.35Å; L239-T242 PolarHBondContact O-N 2.88Å; L239-L243 PolarHBondContact O-N 3.31Å
240	G	93.6	Very high	92	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-60.8	-44.5	173	0	0	0	0	0	112	D237 L243 R244	D237-G240 PolarHBondContact O-N 3.4Å; D237-G240 VanDerWaalsContact O-N 3.08Å; D237-G240 PolarHBondContact OD1-N 3.32Å; G240-L243 PolarHBondContact O-N 3.47Å; G240-R244 WeakPolarHBondContact O-CG 3.31Å; G240-R244 PolarHBondContact O-N 2.92Å
241	L	94.6	Very high	92.1	Very high	113 Å²	113	74.9 Å²	74.9	59%	0.592	39%	0.389	S	S	*	.	H	α-helix	trans	-63.5	-46.4	177.7	-172.4	72.5	0	0	0	111.7	D237 L243 R244 A245	D237-L241 WeakPolarHBondContact O-CB 3.49Å; D237-L241 PolarHBondContact O-N 3.08Å; L241-L243 VanDerWaalsContact C-N 3.35Å; L241-L243 PolarHBondContact O-N 3.19Å; L241-R244 PolarHBondContact O-N 3.29Å; L241-A245 WeakPolarHBondContact O-CB 3.42Å; L241-A245 PolarHBondContact O-N 2.98Å
242	T	94.7	Very high	92.2	Very high	69 Å²	69	74.2 Å²	74.2	42%	0.423	39%	0.387	S	S	.	.	H	α-helix	trans	-59.9	-45.9	178.1	-60	0	0	0	0	110.9	V215 E238 L239 R244 A245 V246	V215-T242 HydrophobicContact CG1-CG2 4.04Å; E238-T242 VanDerWaalsContact O-CB 3.23Å; E238-T242 WeakPolarHBondContact O-CB 3.44Å; E238-T242 PolarHBondContact O-N 3.46Å; E238-T242 PolarHBondContact O-OG1 3.48Å; L239-T242 PolarHBondContact O-N 2.88Å; T242-R244 PolarHBondContact O-N 2.94Å; T242-A245 PolarHBondContact O-N 3.25Å; T242-V246 WeakPolarHBondContact O-CG2 3.39Å; T242-V246 PolarHBondContact O-N 3.37Å
243	L	94.5	Very high	92.4	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-65.5	-41.1	179	-169.3	59.9	0	0	0	111.9	V215 Q218 V230 E231 L233 L239 G240 L241 A245 V246 G247	V215-L243 HydrophobicContact CG1-CD1 4.36Å; V215-L243 HydrophobicContact CG2-CB 4.09Å; V215-L243 HydrophobicContact CG2-CD1 4.46Å; V215-L243 HydrophobicContact CG2-CD2 4.48Å; Q218-L243 HydrophobicContact CB-CD1 3.84Å; V230-L243 HydrophobicContact CB-CD1 3.88Å; V230-L243 HydrophobicContact CB-CG 4.04Å; V230-L243 HydrophobicContact CG1-CD1 3.78Å; V230-L243 HydrophobicContact CG1-CG 4.39Å; V230-L243 HydrophobicContact CG2-CD1 4.37Å; V230-L243 HydrophobicContact CG2-CG 4.05Å; E231-L243 WeakPolarHBondContact O-CD2 3.21Å; L233-L243 HydrophobicContact CB-CD2 3.65Å; L239-L243 PolarHBondContact O-N 3.31Å; G240-L243 PolarHBondContact O-N 3.47Å; L241-L243 VanDerWaalsContact C-N 3.35Å; L241-L243 PolarHBondContact O-N 3.19Å; L243-A245 VanDerWaalsContact C-N 3.33Å; L243-A245 PolarHBondContact O-N 3.33Å; L243-V246 PolarHBondContact O-N 3.34Å; L243-G247 PolarHBondContact O-N 2.96Å
244	R	93.4	Very high	92.5	Very high	114 Å²	114	73.6 Å²	73.6	43%	0.43	39%	0.385	S	S	.	.	H	α-helix	trans	-60.4	-42.6	173.8	-74.9	-175.4	-165.9	109.8	9.5	111.7	R235 G240 L241 T242 G247 Q248	R235-R244 PolarHBondContact O-NH1 2.85Å; R235-R244 PolarHBondContact O-NH2 2.8Å; G240-R244 WeakPolarHBondContact O-CG 3.31Å; G240-R244 PolarHBondContact O-N 2.92Å; L241-R244 PolarHBondContact O-N 3.29Å; T242-R244 PolarHBondContact O-N 2.94Å; R244-G247 PolarHBondContact O-N 3.22Å; R244-Q248 WeakPolarHBondContact O-CB 3.24Å; R244-Q248 PolarHBondContact O-N 3.3Å
245	A	93.7	Very high	92.6	Very high	51 Å²	51	73.1 Å²	73.1	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-42.8	177.6	0	0	0	0	0	111.9	L241 T242 L243 Q248 L249	L241-A245 WeakPolarHBondContact O-CB 3.42Å; L241-A245 PolarHBondContact O-N 2.98Å; T242-A245 PolarHBondContact O-N 3.25Å; L243-A245 VanDerWaalsContact C-N 3.33Å; L243-A245 PolarHBondContact O-N 3.33Å; A245-Q248 PolarHBondContact O-N 3.27Å; A245-L249 WeakPolarHBondContact O-CG 3.43Å; A245-L249 PolarHBondContact O-N 3.16Å
246	V	94.4	Very high	92.7	Very high	28 Å²	28	74.1 Å²	74.1	17%	0.17	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-42.9	173.2	168	0	0	0	0	111.5	A219 V222 V230 T242 L243 Q248 L249 G250	A219-V246 HydrophobicContact CB-CG1 3.78Å; A219-V246 HydrophobicContact CB-CG2 4.19Å; V222-V246 HydrophobicContact CB-CG1 4.32Å; V222-V246 HydrophobicContact CG2-CG1 4.2Å; V230-V246 HydrophobicContact CG1-CG1 4.08Å; T242-V246 WeakPolarHBondContact O-CG2 3.39Å; T242-V246 PolarHBondContact O-N 3.37Å; L243-V246 PolarHBondContact O-N 3.34Å; V246-Q248 VanDerWaalsContact C-N 3.34Å; V246-Q248 PolarHBondContact O-N 3.41Å; V246-L249 PolarHBondContact O-N 3.49Å; V246-G250 PolarHBondContact O-N 3.27Å
247	G	93	Very high	92.7	Very high	5 Å²	5	72.3 Å²	72.3	5%	0.052	36%	0.362	C	S	.	.	H	α-helix	trans	-59.3	-44.6	174.1	0	0	0	0	0	112.5	L243 R244 G250 L251	L243-G247 PolarHBondContact O-N 2.96Å; R244-G247 PolarHBondContact O-N 3.22Å; G247-G250 PolarHBondContact O-N 3.06Å; G247-L251 WeakPolarHBondContact O-CG 3.37Å; G247-L251 PolarHBondContact O-N 3.45Å
248	Q	93.8	Very high	92.5	Very high	112 Å²	112	74 Å²	74	52%	0.523	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-42.1	177.2	-168.3	68.7	-3.1	0	0	111.7	R244 A245 V246 G250 L251 M252	R244-Q248 WeakPolarHBondContact O-CB 3.24Å; R244-Q248 PolarHBondContact O-N 3.3Å; A245-Q248 PolarHBondContact O-N 3.27Å; V246-Q248 VanDerWaalsContact C-N 3.34Å; V246-Q248 PolarHBondContact O-N 3.41Å; Q248-G250 PolarHBondContact O-N 3.43Å; Q248-L251 PolarHBondContact O-N 3.32Å; Q248-M252 HydrophobicContact CG-CG 4.5Å; Q248-M252 HydrophobicContact CG-SD 4.15Å; Q248-M252 WeakPolarHBondContact O-CB 3.12Å; Q248-M252 VanDerWaalsContact O-CG 3.25Å; Q248-M252 WeakPolarHBondContact O-CG 3.27Å; Q248-M252 PolarHBondContact O-N 2.83Å
249	L	92.6	Very high	92.4	Very high	104 Å²	104	70 Å²	70	55%	0.545	35%	0.354	S	S	.	.	H	α-helix	trans	-60.2	-44.6	174.1	-74.5	169.1	0	0	0	111.7	A245 V246 L251 M252 C253	A245-L249 WeakPolarHBondContact O-CG 3.43Å; A245-L249 PolarHBondContact O-N 3.16Å; V246-L249 PolarHBondContact O-N 3.49Å; L249-L251 PolarHBondContact O-N 3.44Å; L249-M252 PolarHBondContact O-N 2.89Å; L249-C253 WeakPolarHBondContact O-CB 3.39Å; L249-C253 PolarHBondContact O-N 3.13Å; L249-C253 PolarHBondContact O-SG 2.91Å; L249-C253 VanDerWaalsContact O-SG 3.34Å
250	G	92.7	Very high	92.4	Very high	2 Å²	2	70.8 Å²	70.8	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-44.9	175.6	0	0	0	0	0	112.9	V222 N228 V246 G247 Q248 C253 R254	V222-G250 VanDerWaalsContact CG1-CA 3.49Å; N228-G250 CarbonylContact O-C 3.54Å; N228-G250 VanDerWaalsContact O-C 3.22Å; V246-G250 PolarHBondContact O-N 3.27Å; G247-G250 PolarHBondContact O-N 3.06Å; Q248-G250 PolarHBondContact O-N 3.43Å; G250-C253 PolarHBondContact O-N 2.96Å; G250-R254 WeakPolarHBondContact O-CB 3.38Å; G250-R254 PolarHBondContact O-N 2.96Å
251	L	92.3	Very high	92.3	Very high	89 Å²	89	73 Å²	73	47%	0.466	38%	0.376	S	S	.	.	H	α-helix	trans	-65.5	-41.5	176.5	-68.5	175.1	0	0	0	112.2	N228 G247 Q248 L249 R254 W255	N228-L251 PolarHBondContact O-N 3.42Å; G247-L251 WeakPolarHBondContact O-CG 3.37Å; G247-L251 PolarHBondContact O-N 3.45Å; Q248-L251 PolarHBondContact O-N 3.32Å; L249-L251 PolarHBondContact O-N 3.44Å; L251-R254 PolarHBondContact O-N 3.31Å; L251-W255 WeakPolarHBondContact O-CB 3.39Å; L251-W255 PolarHBondContact O-N 3.48Å
252	M	92.2	Very high	92.1	Very high	98 Å²	98	70.9 Å²	70.9	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-44.5	176.5	-74.1	175	69.5	0	0	111.8	Q248 L249 R254 W255 L256	Q248-M252 HydrophobicContact CG-CG 4.5Å; Q248-M252 HydrophobicContact CG-SD 4.15Å; Q248-M252 WeakPolarHBondContact O-CB 3.12Å; Q248-M252 VanDerWaalsContact O-CG 3.25Å; Q248-M252 WeakPolarHBondContact O-CG 3.27Å; Q248-M252 PolarHBondContact O-N 2.83Å; L249-M252 PolarHBondContact O-N 2.89Å; M252-R254 VanDerWaalsContact C-N 3.34Å; M252-R254 PolarHBondContact O-N 3.46Å; M252-W255 PolarHBondContact O-N 3.29Å; M252-L256 WeakPolarHBondContact O-CB 3.48Å; M252-L256 WeakPolarHBondContact O-CG 3.47Å; M252-L256 PolarHBondContact O-N 3.23Å
253	C	89.5	Confident	92	Very high	70 Å²	70	72.6 Å²	72.6	47%	0.473	37%	0.373	S	S	.	.	H	α-helix	trans	-60.9	-43.8	175	-72.1	0	0	0	0	111.4	L249 G250 L256 I257	L249-C253 WeakPolarHBondContact O-CB 3.39Å; L249-C253 PolarHBondContact O-N 3.13Å; L249-C253 PolarHBondContact O-SG 2.91Å; L249-C253 VanDerWaalsContact O-SG 3.34Å; G250-C253 PolarHBondContact O-N 2.96Å; C253-L256 PolarHBondContact O-N 2.92Å; C253-I257 WeakPolarHBondContact O-CB 3.43Å; C253-I257 VanDerWaalsContact O-CG1 3.27Å; C253-I257 WeakPolarHBondContact O-CG1 3.48Å; C253-I257 PolarHBondContact O-N 3.08Å
254	R	88.1	Confident	92	Very high	116 Å²	116	72.8 Å²	72.8	44%	0.438	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-44.2	176.6	177.7	59.1	161.4	-153.9	-0.2	112.2	N228 G250 L251 M252 N258	N228-R254 HydrophobicContact CB-CB 4.02Å; N228-R254 HydrophobicContact CB-CG 4.21Å; N228-R254 PolarHBondContact ND2-NH1 2.93Å; G250-R254 WeakPolarHBondContact O-CB 3.38Å; G250-R254 PolarHBondContact O-N 2.96Å; L251-R254 PolarHBondContact O-N 3.31Å; M252-R254 VanDerWaalsContact C-N 3.34Å; M252-R254 PolarHBondContact O-N 3.46Å; R254-N258 WeakPolarHBondContact O-CB 3.3Å; R254-N258 VanDerWaalsContact O-CG 3.3Å; R254-N258 PolarHBondContact O-N 3.39Å
255	W	91.3	Very high	91.9	Very high	157 Å²	157	69.4 Å²	69.4	60%	0.595	37%	0.368	S	S	*	.	H	α-helix	trans	-62.1	-48.9	176.7	172.6	78.6	0	0	0	110.9	L251 M252 I257 N258 D259	L251-W255 WeakPolarHBondContact O-CB 3.39Å; L251-W255 PolarHBondContact O-N 3.48Å; M252-W255 PolarHBondContact O-N 3.29Å; W255-I257 PolarHBondContact O-N 3.04Å; W255-N258 PolarHBondContact O-N 3.33Å; W255-D259 HydrophobicContact CZ2-CB 4.33Å; W255-D259 VanDerWaalsContact O-CB 3.28Å; W255-D259 WeakPolarHBondContact O-CB 3.48Å; W255-D259 PolarHBondContact O-N 2.99Å
256	L	91.6	Very high	91.8	Very high	86 Å²	86	70.2 Å²	70.2	45%	0.45	37%	0.371	S	S	.	.	H	α-helix	trans	-57	-46.7	177	-79.1	167.5	0	0	0	112	M252 C253 D259 V260	M252-L256 WeakPolarHBondContact O-CB 3.48Å; M252-L256 WeakPolarHBondContact O-CG 3.47Å; M252-L256 PolarHBondContact O-N 3.23Å; C253-L256 PolarHBondContact O-N 2.92Å; L256-D259 PolarHBondContact O-N 3.46Å; L256-V260 VanDerWaalsContact O-CB 3.32Å; L256-V260 WeakPolarHBondContact O-CB 3.09Å; L256-V260 WeakPolarHBondContact O-CG2 3.37Å; L256-V260 PolarHBondContact O-N 3.45Å
257	I	89.6	Confident	91.8	Very high	74 Å²	74	72.2 Å²	72.2	38%	0.379	38%	0.383	S	S	.	.	H	α-helix	trans	-60.4	-48.5	177.9	-73.6	167.7	0	0	0	110.7	C253 W255 S261 V502	C253-I257 WeakPolarHBondContact O-CB 3.43Å; C253-I257 VanDerWaalsContact O-CG1 3.27Å; C253-I257 WeakPolarHBondContact O-CG1 3.48Å; C253-I257 PolarHBondContact O-N 3.08Å; W255-I257 PolarHBondContact O-N 3.04Å; I257-S261 WeakPolarHBondContact O-CB 3.11Å; I257-S261 PolarHBondContact O-N 3.36Å; I257-V502 HydrophobicContact CB-CG1 4.3Å; I257-V502 HydrophobicContact CG2-CG1 3.73Å; I257-V502 WeakPolarHBondContact O-CG1 3.43Å
258	N	89.5	Confident	91.7	Very high	86 Å²	86	75.9 Å²	75.9	46%	0.46	40%	0.395	S	S	.	.	H	α-helix	trans	-65.8	-42.2	-179.2	-75.2	-6.4	0	0	0	112.2	R254 W255 S262	R254-N258 WeakPolarHBondContact O-CB 3.3Å; R254-N258 VanDerWaalsContact O-CG 3.3Å; R254-N258 PolarHBondContact O-N 3.39Å; W255-N258 PolarHBondContact O-N 3.33Å; N258-S262 WeakPolarHBondContact O-CB 3.39Å; N258-S262 PolarHBondContact O-N 3.32Å
259	D	92.7	Very high	91.7	Very high	62 Å²	62	74 Å²	74	33%	0.332	39%	0.389	S	S	.	.	H	α-helix	trans	-66	-50.8	180	-171.4	63	0	0	0	110.6	W255 L256 S261 S262 Q263	W255-D259 HydrophobicContact CZ2-CB 4.33Å; W255-D259 VanDerWaalsContact O-CB 3.28Å; W255-D259 WeakPolarHBondContact O-CB 3.48Å; W255-D259 PolarHBondContact O-N 2.99Å; L256-D259 PolarHBondContact O-N 3.46Å; D259-S261 VanDerWaalsContact C-N 3.34Å; D259-S261 PolarHBondContact O-N 3.44Å; D259-S262 WeakPolarHBondContact O-CB 3.22Å; D259-S262 PolarHBondContact O-N 3.21Å; D259-S262 VanDerWaalsContact O-N 3.16Å; D259-Q263 WeakPolarHBondContact O-CG 3.41Å; D259-Q263 PolarHBondContact O-N 3.33Å
260	V	92.4	Very high	91.7	Very high	48 Å²	48	70.9 Å²	70.9	29%	0.291	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-42.8	177.3	179.2	0	0	0	0	110.8	L256 S262 Q263 V264 L498 V502	L256-V260 VanDerWaalsContact O-CB 3.32Å; L256-V260 WeakPolarHBondContact O-CB 3.09Å; L256-V260 WeakPolarHBondContact O-CG2 3.37Å; L256-V260 PolarHBondContact O-N 3.45Å; V260-S262 VanDerWaalsContact C-N 3.33Å; V260-S262 PolarHBondContact O-N 3.1Å; V260-Q263 PolarHBondContact O-N 3.01Å; V260-V264 HydrophobicContact CG1-CG2 4.13Å; V260-V264 WeakPolarHBondContact O-CB 3.35Å; V260-V264 WeakPolarHBondContact O-CG2 3.16Å; V260-V264 PolarHBondContact O-N 3.46Å; V260-L498 HydrophobicContact CG1-CD1 4.36Å; V260-L498 HydrophobicContact CG1-CD2 4.18Å; V260-L498 HydrophobicContact CG1-CG 4.16Å; V260-V502 HydrophobicContact CB-CG2 4.14Å; V260-V502 HydrophobicContact CG1-CG2 3.55Å
261	S	90.8	Very high	91.7	Very high	48 Å²	48	71.1 Å²	71.1	34%	0.336	38%	0.383	S	S	.	.	H	α-helix	trans	-58.8	-43.5	175.9	-178.9	0	0	0	0	112.1	I257 D259 V264 S265	I257-S261 WeakPolarHBondContact O-CB 3.11Å; I257-S261 PolarHBondContact O-N 3.36Å; D259-S261 VanDerWaalsContact C-N 3.34Å; D259-S261 PolarHBondContact O-N 3.44Å; S261-V264 PolarHBondContact O-N 3.24Å; S261-S265 WeakPolarHBondContact O-CB 3.11Å; S261-S265 PolarHBondContact O-N 3.33Å
262	S	91.5	Very high	91.8	Very high	67 Å²	67	71.4 Å²	71.4	47%	0.469	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-43.8	176.9	-174.9	0	0	0	0	112.4	N258 D259 V260 S265 S266	N258-S262 WeakPolarHBondContact O-CB 3.39Å; N258-S262 PolarHBondContact O-N 3.32Å; D259-S262 WeakPolarHBondContact O-CB 3.22Å; D259-S262 PolarHBondContact O-N 3.21Å; D259-S262 VanDerWaalsContact O-N 3.16Å; V260-S262 VanDerWaalsContact C-N 3.33Å; V260-S262 PolarHBondContact O-N 3.1Å; S262-S265 PolarHBondContact O-N 2.99Å; S262-S266 PolarHBondContact O-N 2.69Å; S262-S266 PolarHBondContact O-OG 3.39Å
263	Q	92.4	Very high	91.9	Very high	106 Å²	106	71.7 Å²	71.7	50%	0.495	39%	0.389	S	S	.	.	H	α-helix	trans	-64.1	-42.4	176.6	-66.1	-55.1	-33.9	0	0	111.6	D259 V260 S266 V267	D259-Q263 WeakPolarHBondContact O-CG 3.41Å; D259-Q263 PolarHBondContact O-N 3.33Å; V260-Q263 PolarHBondContact O-N 3.01Å; Q263-S266 WeakPolarHBondContact O-CB 3.25Å; Q263-S266 PolarHBondContact O-N 2.94Å; Q263-V267 WeakPolarHBondContact O-CG2 3.23Å; Q263-V267 PolarHBondContact O-N 3.4Å
264	V	93.6	Very high	92.1	Very high	5 Å²	5	72.4 Å²	72.4	3%	0.03	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-46.4	176.5	169.4	0	0	0	0	111.7	V260 S261 S266 V267 R268 A495 L498 E499	V260-V264 HydrophobicContact CG1-CG2 4.13Å; V260-V264 WeakPolarHBondContact O-CB 3.35Å; V260-V264 WeakPolarHBondContact O-CG2 3.16Å; V260-V264 PolarHBondContact O-N 3.46Å; S261-V264 PolarHBondContact O-N 3.24Å; V264-S266 VanDerWaalsContact C-N 3.27Å; V264-S266 PolarHBondContact O-N 2.88Å; V264-V267 PolarHBondContact O-N 2.76Å; V264-R268 WeakPolarHBondContact O-CB 3.41Å; V264-R268 PolarHBondContact O-N 3.48Å; V264-A495 HydrophobicContact CG1-CB 4.27Å; V264-A495 WeakPolarHBondContact CG1-O 3.48Å; V264-L498 HydrophobicContact CG2-CB 3.77Å; V264-L498 HydrophobicContact CG2-CD2 3.38Å; V264-L498 HydrophobicContact CG2-CG 3.4Å; V264-L498 VanDerWaalsContact CG2-CG 3.4Å; V264-E499 HydrophobicContact CG1-CB 3.72Å; V264-E499 HydrophobicContact CG1-CG 4.45Å
265	S	92	Very high	92.3	Very high	44 Å²	44	68.5 Å²	68.5	31%	0.308	38%	0.38	S	S	.	.	H	α-helix	trans	-58.7	-42	176.2	-177.1	0	0	0	0	111.3	S261 S262 R268 N269	S261-S265 WeakPolarHBondContact O-CB 3.11Å; S261-S265 PolarHBondContact O-N 3.33Å; S262-S265 PolarHBondContact O-N 2.99Å; S265-R268 PolarHBondContact O-N 3.26Å; S265-N269 WeakPolarHBondContact O-CB 3.23Å; S265-N269 PolarHBondContact O-N 3.45Å; S265-N269 PolarHBondContact O-ND2 3.19Å
266	S	92.5	Very high	92.4	Very high	67 Å²	67	67.1 Å²	67.1	47%	0.469	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-45	176.6	-57.9	0	0	0	0	112.3	S262 Q263 V264 R268 N269 G270	S262-S266 PolarHBondContact O-N 2.69Å; S262-S266 PolarHBondContact O-OG 3.39Å; Q263-S266 WeakPolarHBondContact O-CB 3.25Å; Q263-S266 PolarHBondContact O-N 2.94Å; V264-S266 VanDerWaalsContact C-N 3.27Å; V264-S266 PolarHBondContact O-N 2.88Å; S266-R268 VanDerWaalsContact C-N 3.35Å; S266-R268 PolarHBondContact O-N 3.36Å; S266-N269 PolarHBondContact O-N 3.01Å; S266-G270 PolarHBondContact O-N 2.99Å
267	V	94.2	Very high	92.5	Very high	70 Å²	70	64.6 Å²	64.6	42%	0.424	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-40.5	176.5	172.1	0	0	0	0	111.4	Q263 V264 G270 S271 V491 A495	Q263-V267 WeakPolarHBondContact O-CG2 3.23Å; Q263-V267 PolarHBondContact O-N 3.4Å; V264-V267 PolarHBondContact O-N 2.76Å; V267-G270 PolarHBondContact O-N 3.17Å; V267-S271 WeakPolarHBondContact O-CB 3.37Å; V267-S271 PolarHBondContact O-N 3.07Å; V267-S271 PolarHBondContact O-OG 2.89Å; V267-V491 HydrophobicContact CG1-CG1 3.49Å; V267-V491 VanDerWaalsContact CG1-CG1 3.49Å; V267-A495 HydrophobicContact CG1-CB 4.12Å
268	R	91	Very high	92.7	Very high	83 Å²	83	61.3 Å²	61.3	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-47.1	178.1	-165.1	-172.6	75.6	165.1	8.6	111.5	V264 S265 S266 S271 E272 K492 A495 E499	V264-R268 WeakPolarHBondContact O-CB 3.41Å; V264-R268 PolarHBondContact O-N 3.48Å; S265-R268 PolarHBondContact O-N 3.26Å; S266-R268 VanDerWaalsContact C-N 3.35Å; S266-R268 PolarHBondContact O-N 3.36Å; R268-S271 PolarHBondContact O-N 3.35Å; R268-E272 PolarHBondContact O-N 3.48Å; R268-K492 HydrophobicContact CG-CG 4.45Å; R268-A495 HydrophobicContact CB-CB 4.07Å; R268-E499 IonicContact NH1-OE1 2.79Å; R268-E499 IonicContact NH1-OE2 3.66Å; R268-E499 PolarHBondContact NH1-OE2 2.96Å
269	N	92.7	Very high	92.9	Very high	72 Å²	72	62.6 Å²	62.6	39%	0.385	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-38.6	178.1	-66	-14.2	0	0	0	111.8	S265 S266 E272 T273	S265-N269 WeakPolarHBondContact O-CB 3.23Å; S265-N269 PolarHBondContact O-N 3.45Å; S265-N269 PolarHBondContact O-ND2 3.19Å; S266-N269 PolarHBondContact O-N 3.01Å; N269-E272 PolarHBondContact O-N 3.43Å; N269-T273 PolarHBondContact O-N 2.93Å; N269-T273 PolarHBondContact O-OG1 2.76Å
270	G	93.4	Very high	93	Very high	38 Å²	38	63.9 Å²	63.9	39%	0.392	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-43	173.2	0	0	0	0	0	112.3	S266 V267 E272 T273 L274	S266-G270 PolarHBondContact O-N 2.99Å; V267-G270 PolarHBondContact O-N 3.17Å; G270-E272 VanDerWaalsContact C-N 3.34Å; G270-E272 PolarHBondContact O-N 2.92Å; G270-T273 PolarHBondContact O-N 3.27Å; G270-L274 WeakPolarHBondContact O-CB 3.4Å; G270-L274 PolarHBondContact O-N 3.15Å
271	S	93.4	Very high	93.2	Very high	8 Å²	8	65 Å²	65	6%	0.056	37%	0.372	C	S	.	.	H	α-helix	trans	-66.4	-35	177.4	-54.3	0	0	0	0	112.5	V267 R268 L274 A275 V491	V267-S271 WeakPolarHBondContact O-CB 3.37Å; V267-S271 PolarHBondContact O-N 3.07Å; V267-S271 PolarHBondContact O-OG 2.89Å; R268-S271 PolarHBondContact O-N 3.35Å; S271-L274 PolarHBondContact O-N 3.16Å; S271-A275 WeakPolarHBondContact O-CB 3.18Å; S271-A275 PolarHBondContact O-N 3.18Å; S271-V491 WeakPolarHBondContact OG-CG1 2.99Å
272	E	92.7	Very high	93.3	Very high	95 Å²	95	66.6 Å²	66.6	44%	0.444	38%	0.376	S	S	.	.	H	α-helix	trans	-69.5	-40.1	175.2	-175.6	153.5	-112.9	0	0	112.2	R268 N269 G270 L274 A275 K276 K492	R268-E272 PolarHBondContact O-N 3.48Å; N269-E272 PolarHBondContact O-N 3.43Å; G270-E272 VanDerWaalsContact C-N 3.34Å; G270-E272 PolarHBondContact O-N 2.92Å; E272-L274 VanDerWaalsContact C-N 3.33Å; E272-A275 PolarHBondContact O-N 3.26Å; E272-K276 PolarHBondContact O-N 3.18Å; E272-K492 IonicContact OE1-NZ 2.6Å; E272-K492 PolarHBondContact OE1-NZ 3.38Å
273	T	94.5	Very high	93.6	Very high	103 Å²	103	69.9 Å²	69.9	63%	0.632	38%	0.384	S	S	*	.	H	α-helix	trans	-61.2	-43.2	171.4	-54.8	0	0	0	0	111.3	N269 G270 K276 G277	N269-T273 PolarHBondContact O-N 2.93Å; N269-T273 PolarHBondContact O-OG1 2.76Å; G270-T273 PolarHBondContact O-N 3.27Å; T273-K276 PolarHBondContact O-N 3.42Å; T273-G277 PolarHBondContact O-N 3.02Å
274	L	93.8	Very high	93.7	Very high	85 Å²	85	69.9 Å²	69.9	45%	0.445	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-41.5	178.8	-174	60.3	0	0	0	112	G270 S271 E272 G277 T278 S488	G270-L274 WeakPolarHBondContact O-CB 3.4Å; G270-L274 PolarHBondContact O-N 3.15Å; S271-L274 PolarHBondContact O-N 3.16Å; E272-L274 VanDerWaalsContact C-N 3.33Å; L274-G277 PolarHBondContact O-N 3.23Å; L274-T278 WeakPolarHBondContact O-CB 3.32Å; L274-T278 PolarHBondContact O-N 3.08Å; L274-T278 PolarHBondContact O-OG1 3.26Å; L274-S488 WeakPolarHBondContact CD2-OG 3.47Å; L274-S488 WeakPolarHBondContact CG-OG 3.35Å
275	A	92.1	Very high	93.7	Very high	34 Å²	34	70 Å²	70	28%	0.281	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-47.1	174.2	0	0	0	0	0	111.2	S271 E272 G277 T278 D279	S271-A275 WeakPolarHBondContact O-CB 3.18Å; S271-A275 PolarHBondContact O-N 3.18Å; E272-A275 PolarHBondContact O-N 3.26Å; A275-G277 PolarHBondContact O-N 3.33Å; A275-T278 VanDerWaalsContact O-CB 3.32Å; A275-T278 WeakPolarHBondContact O-CB 3.28Å; A275-T278 PolarHBondContact O-N 3.36Å; A275-T278 VanDerWaalsContact O-N 3.11Å; A275-D279 PolarHBondContact O-N 2.93Å
276	K	93.6	Very high	93.8	Very high	129 Å²	129	73 Å²	73	56%	0.561	39%	0.394	S	S	*	.	H	α-helix	trans	-61.8	-44.6	176.6	-171.7	-173.4	175.3	-159.8	0	112.5	E272 T273 T278 D279 E280	E272-K276 PolarHBondContact O-N 3.18Å; T273-K276 PolarHBondContact O-N 3.42Å; K276-T278 PolarHBondContact O-N 2.88Å; K276-D279 WeakPolarHBondContact O-CB 3.36Å; K276-D279 PolarHBondContact O-N 3.43Å; K276-D279 VanDerWaalsContact O-N 3.16Å; K276-E280 VanDerWaalsContact CE-OE1 3.28Å; K276-E280 WeakPolarHBondContact CE-OE1 3.3Å; K276-E280 IonicContact NZ-OE1 3.47Å; K276-E280 PolarHBondContact O-N 3.43Å
277	G	94.5	Very high	93.8	Very high	33 Å²	33	74.6 Å²	74.6	34%	0.34	39%	0.394	S	S	.	.	H	α-helix	trans	-63.5	-28.2	176.2	0	0	0	0	0	112.7	T273 L274 A275 L281	T273-G277 PolarHBondContact O-N 3.02Å; L274-G277 PolarHBondContact O-N 3.23Å; A275-G277 PolarHBondContact O-N 3.33Å; G277-L281 WeakPolarHBondContact O-CB 3.16Å; G277-L281 PolarHBondContact O-N 2.86Å
278	T	94.3	Very high	93.8	Very high	5 Å²	5	73.8 Å²	73.8	3%	0.031	39%	0.389	C	S	.	.	H	α-helix	trans	-71.4	-40	173.8	-55.8	0	0	0	0	111.4	L274 A275 K276 L281 N282 V481 S484 A485	L274-T278 WeakPolarHBondContact O-CB 3.32Å; L274-T278 PolarHBondContact O-N 3.08Å; L274-T278 PolarHBondContact O-OG1 3.26Å; A275-T278 VanDerWaalsContact O-CB 3.32Å; A275-T278 WeakPolarHBondContact O-CB 3.28Å; A275-T278 PolarHBondContact O-N 3.36Å; A275-T278 VanDerWaalsContact O-N 3.11Å; K276-T278 PolarHBondContact O-N 2.88Å; T278-L281 PolarHBondContact O-N 3.3Å; T278-N282 WeakPolarHBondContact O-CB 3.47Å; T278-N282 PolarHBondContact O-N 3Å; T278-V481 HydrophobicContact CG2-CB 4.25Å; T278-V481 HydrophobicContact CG2-CG1 3.76Å; T278-V481 WeakPolarHBondContact CG2-O 3.26Å; T278-S484 PolarHBondContact OG1-OG 3.29Å; T278-A485 HydrophobicContact CG2-CB 3.99Å
279	D	93.4	Very high	93.9	Very high	112 Å²	112	71.5 Å²	71.5	60%	0.599	39%	0.385	S	S	*	.	H	α-helix	trans	-61.8	-43.7	173.4	-65.5	-28.1	0	0	0	111.4	A275 K276 N282 E283	A275-D279 PolarHBondContact O-N 2.93Å; K276-D279 WeakPolarHBondContact O-CB 3.36Å; K276-D279 PolarHBondContact O-N 3.43Å; K276-D279 VanDerWaalsContact O-N 3.16Å; D279-N282 WeakPolarHBondContact O-CB 3.09Å; D279-N282 PolarHBondContact O-N 2.71Å; D279-E283 PolarHBondContact O-N 3.36Å; D279-E283 VanDerWaalsContact O-N 3.08Å
280	E	95.4	Very high	94	Very high	89 Å²	89	72 Å²	72	42%	0.416	39%	0.387	S	S	.	.	H	α-helix	trans	-63.6	-42.3	175.6	-70.2	174.1	-171.5	0	0	111.7	K276 N282 E283 H284	K276-E280 VanDerWaalsContact CE-OE1 3.28Å; K276-E280 WeakPolarHBondContact CE-OE1 3.3Å; K276-E280 IonicContact NZ-OE1 3.47Å; K276-E280 PolarHBondContact O-N 3.43Å; E280-N282 VanDerWaalsContact C-N 3.3Å; E280-N282 PolarHBondContact O-N 3.12Å; E280-E283 PolarHBondContact O-N 2.88Å; E280-H284 PolarHBondContact O-CD2 3.02Å; E280-H284 PolarHBondContact O-N 3.29Å
281	L	95	Very high	94	Very high	72 Å²	72	73.9 Å²	73.9	38%	0.377	39%	0.388	S	S	.	.	H	α-helix	trans	-63.8	-36.7	175.9	-176.7	62.5	0	0	0	111.8	G277 T278 H284 T285 V481	G277-L281 WeakPolarHBondContact O-CB 3.16Å; G277-L281 PolarHBondContact O-N 2.86Å; T278-L281 PolarHBondContact O-N 3.3Å; L281-H284 PolarHBondContact O-N 3.48Å; L281-T285 VanDerWaalsContact O-CB 3.3Å; L281-T285 WeakPolarHBondContact O-CB 3.41Å; L281-T285 PolarHBondContact O-N 3.05Å; L281-T285 PolarHBondContact O-OG1 3.47Å; L281-V481 HydrophobicContact CB-CG2 3.96Å; L281-V481 HydrophobicContact CD2-CG2 3.63Å; L281-V481 HydrophobicContact CG-CG2 3.58Å
282	N	94.5	Very high	94.1	Very high	82 Å²	82	74.1 Å²	74.1	44%	0.439	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-45.7	175.1	-168.9	43.5	0	0	0	111.5	T278 D279 E280 T285 Q286 V481	T278-N282 WeakPolarHBondContact O-CB 3.47Å; T278-N282 PolarHBondContact O-N 3Å; D279-N282 WeakPolarHBondContact O-CB 3.09Å; D279-N282 PolarHBondContact O-N 2.71Å; E280-N282 VanDerWaalsContact C-N 3.3Å; E280-N282 PolarHBondContact O-N 3.12Å; N282-T285 PolarHBondContact O-N 3.27Å; N282-Q286 PolarHBondContact O-N 2.88Å; N282-V481 HydrophobicContact CB-CG1 3.71Å; N282-V481 HydrophobicContact CB-CG2 4.46Å
283	E	95.9	Very high	94.2	Very high	136 Å²	136	75.5 Å²	75.5	64%	0.636	40%	0.396	S	S	*	.	H	α-helix	trans	-60	-47	176.4	-174.6	177.3	-178.4	0	0	111.5	D279 E280 T285 Q286 Q287	D279-E283 PolarHBondContact O-N 3.36Å; D279-E283 VanDerWaalsContact O-N 3.08Å; E280-E283 PolarHBondContact O-N 2.88Å; E283-T285 VanDerWaalsContact C-N 3.33Å; E283-T285 PolarHBondContact O-N 3.47Å; E283-Q286 PolarHBondContact O-N 3.04Å; E283-Q287 PolarHBondContact O-N 3.16Å
284	H	94.4	Very high	94.2	Very high	106 Å²	106	76.8 Å²	76.8	49%	0.491	40%	0.395	S	S	.	.	H	α-helix	trans	-65	-35.4	176.4	-75.2	-52.5	0	0	0	113.3	E280 L281 Q287 T288	E280-H284 PolarHBondContact O-CD2 3.02Å; E280-H284 PolarHBondContact O-N 3.29Å; L281-H284 PolarHBondContact O-N 3.48Å; H284-Q287 PolarHBondContact O-N 3.01Å; H284-T288 WeakPolarHBondContact O-CB 3.35Å; H284-T288 PolarHBondContact O-N 3.18Å; H284-T288 PolarHBondContact O-OG1 3.45Å
285	T	94.8	Very high	94.2	Very high	7 Å²	7	75.8 Å²	75.8	4%	0.043	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-45.1	175	-60.6	0	0	0	0	109.9	L281 N282 E283 Q287 T288 V289 T474 N477 A478	L281-T285 VanDerWaalsContact O-CB 3.3Å; L281-T285 WeakPolarHBondContact O-CB 3.41Å; L281-T285 PolarHBondContact O-N 3.05Å; L281-T285 PolarHBondContact O-OG1 3.47Å; N282-T285 PolarHBondContact O-N 3.27Å; E283-T285 VanDerWaalsContact C-N 3.33Å; E283-T285 PolarHBondContact O-N 3.47Å; T285-Q287 PolarHBondContact O-N 3.34Å; T285-T288 WeakPolarHBondContact O-CB 3.21Å; T285-T288 PolarHBondContact O-N 2.96Å; T285-T288 VanDerWaalsContact O-N 3.16Å; T285-V289 PolarHBondContact O-N 2.93Å; T285-V289 VanDerWaalsContact O-N 3.07Å; T285-T474 HydrophobicContact CG2-CG2 3.75Å; T285-T474 WeakPolarHBondContact CG2-O 3.29Å; T285-N477 HydrophobicContact CG2-CB 3.93Å; T285-A478 HydrophobicContact CG2-CB 4.35Å
286	Q	93	Very high	94.4	Very high	108 Å²	108	76.9 Å²	76.9	51%	0.505	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-44	175.4	-173.3	58.3	59.7	0	0	112.1	N282 E283 T288 V289 D290	N282-Q286 PolarHBondContact O-N 2.88Å; E283-Q286 PolarHBondContact O-N 3.04Å; Q286-T288 VanDerWaalsContact C-N 3.26Å; Q286-T288 PolarHBondContact O-N 2.98Å; Q286-V289 WeakPolarHBondContact O-CB 3.4Å; Q286-V289 PolarHBondContact O-N 3.43Å; Q286-V289 VanDerWaalsContact O-N 3.17Å; Q286-D290 PolarHBondContact O-N 3.37Å
287	Q	94.4	Very high	94.5	Very high	100 Å²	100	73.2 Å²	73.2	47%	0.467	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-34.4	175.6	-170.5	-176.3	-3.5	0	0	112.2	E283 H284 T285 D290 N291	E283-Q287 PolarHBondContact O-N 3.16Å; H284-Q287 PolarHBondContact O-N 3.01Å; T285-Q287 PolarHBondContact O-N 3.34Å; Q287-D290 PolarHBondContact O-N 2.72Å; Q287-N291 VanDerWaalsContact O-CG 3.29Å; Q287-N291 PolarHBondContact O-N 3.48Å; Q287-N291 PolarHBondContact O-ND2 2.9Å
288	T	93.6	Very high	94.5	Very high	52 Å²	52	74.8 Å²	74.8	32%	0.319	39%	0.392	S	S	.	.	H	α-helix	trans	-65.5	-39.5	175.8	-57.9	0	0	0	0	111	H284 T285 Q286 D290 N291 V292 T474	H284-T288 WeakPolarHBondContact O-CB 3.35Å; H284-T288 PolarHBondContact O-N 3.18Å; H284-T288 PolarHBondContact O-OG1 3.45Å; T285-T288 WeakPolarHBondContact O-CB 3.21Å; T285-T288 PolarHBondContact O-N 2.96Å; T285-T288 VanDerWaalsContact O-N 3.16Å; Q286-T288 VanDerWaalsContact C-N 3.26Å; Q286-T288 PolarHBondContact O-N 2.98Å; T288-D290 VanDerWaalsContact C-N 3.34Å; T288-D290 PolarHBondContact O-N 2.8Å; T288-N291 PolarHBondContact O-N 2.93Å; T288-V292 HydrophobicContact CG2-CG2 4.31Å; T288-V292 WeakPolarHBondContact O-CB 3.13Å; T288-V292 VanDerWaalsContact O-CG2 3.26Å; T288-V292 WeakPolarHBondContact O-CG2 3.43Å; T288-V292 PolarHBondContact O-N 3.11Å; T288-T474 HydrophobicContact CG2-CG2 4.41Å; T288-T474 WeakPolarHBondContact CG2-OG1 3.24Å
289	V	93.5	Very high	94.5	Very high	36 Å²	36	75.3 Å²	75.3	22%	0.218	39%	0.394	C	S	.	.	H	α-helix	trans	-56.5	-49.2	172.6	177.5	0	0	0	0	110.6	T285 Q286 N291 V292 Q293 T474	T285-V289 PolarHBondContact O-N 2.93Å; T285-V289 VanDerWaalsContact O-N 3.07Å; Q286-V289 WeakPolarHBondContact O-CB 3.4Å; Q286-V289 PolarHBondContact O-N 3.43Å; Q286-V289 VanDerWaalsContact O-N 3.17Å; V289-N291 VanDerWaalsContact C-N 3.35Å; V289-N291 PolarHBondContact O-N 3.27Å; V289-V292 PolarHBondContact O-N 3.41Å; V289-Q293 HydrophobicContact CG1-CG 4.44Å; V289-Q293 WeakPolarHBondContact O-CG 3.13Å; V289-Q293 PolarHBondContact O-N 3.47Å; V289-T474 HydrophobicContact CB-CG2 4.48Å; V289-T474 HydrophobicContact CG2-CG2 3.34Å
290	D	94.8	Very high	94.6	Very high	81 Å²	81	75 Å²	75	43%	0.433	39%	0.392	S	S	.	.	H	α-helix	trans	-62.4	-43.2	-178	-62.3	-14.5	0	0	0	111.4	Q286 Q287 T288 Q293 Q294	Q286-D290 PolarHBondContact O-N 3.37Å; Q287-D290 PolarHBondContact O-N 2.72Å; T288-D290 VanDerWaalsContact C-N 3.34Å; T288-D290 PolarHBondContact O-N 2.8Å; D290-Q293 PolarHBondContact O-N 2.9Å; D290-Q294 PolarHBondContact O-N 3.31Å
291	N	93.4	Very high	94.6	Very high	79 Å²	79	77.4 Å²	77.4	42%	0.422	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-40.9	176.2	-72.3	-27.7	0	0	0	112.4	Q287 T288 V289 Q294 T295	Q287-N291 VanDerWaalsContact O-CG 3.29Å; Q287-N291 PolarHBondContact O-N 3.48Å; Q287-N291 PolarHBondContact O-ND2 2.9Å; T288-N291 PolarHBondContact O-N 2.93Å; V289-N291 VanDerWaalsContact C-N 3.35Å; V289-N291 PolarHBondContact O-N 3.27Å; N291-Q294 PolarHBondContact O-N 3.36Å; N291-T295 WeakPolarHBondContact O-CB 3.36Å; N291-T295 PolarHBondContact O-N 3.5Å; N291-T295 PolarHBondContact O-OG1 2.74Å
292	V	95.5	Very high	94.6	Very high	12 Å²	12	78.5 Å²	78.5	7%	0.073	41%	0.408	C	S	.	.	H	α-helix	trans	-62.3	-46	175.6	163.1	0	0	0	0	110	T288 V289 Q294 T295 V296 V467 L470	T288-V292 HydrophobicContact CG2-CG2 4.31Å; T288-V292 WeakPolarHBondContact O-CB 3.13Å; T288-V292 VanDerWaalsContact O-CG2 3.26Å; T288-V292 WeakPolarHBondContact O-CG2 3.43Å; T288-V292 PolarHBondContact O-N 3.11Å; V289-V292 PolarHBondContact O-N 3.41Å; V292-Q294 PolarHBondContact O-N 3.01Å; V292-T295 WeakPolarHBondContact O-CB 3.19Å; V292-T295 PolarHBondContact O-N 2.97Å; V292-T295 VanDerWaalsContact O-N 3.13Å; V292-V296 WeakPolarHBondContact O-CG2 3.44Å; V292-V296 PolarHBondContact O-N 3.43Å; V292-V467 HydrophobicContact CG1-CG1 4.03Å; V292-L470 HydrophobicContact CG2-CB 3.97Å
293	Q	93.2	Very high	94.6	Very high	124 Å²	124	76.4 Å²	76.4	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-61.2	-43.2	177.1	-71.8	179.5	0.7	0	0	112.4	V289 D290 T295 V296 A297	V289-Q293 HydrophobicContact CG1-CG 4.44Å; V289-Q293 WeakPolarHBondContact O-CG 3.13Å; V289-Q293 PolarHBondContact O-N 3.47Å; D290-Q293 PolarHBondContact O-N 2.9Å; Q293-T295 VanDerWaalsContact C-N 3.29Å; Q293-T295 PolarHBondContact O-N 3.34Å; Q293-V296 PolarHBondContact O-N 2.89Å; Q293-A297 PolarHBondContact O-N 2.6Å
294	Q	94.9	Very high	94.7	Very high	131 Å²	131	72.9 Å²	72.9	61%	0.612	40%	0.396	S	S	*	.	H	α-helix	trans	-63.3	-37.2	174.9	-176.9	176.2	-21.6	0	0	112	D290 N291 V292 A297 T298	D290-Q294 PolarHBondContact O-N 3.31Å; N291-Q294 PolarHBondContact O-N 3.36Å; V292-Q294 PolarHBondContact O-N 3.01Å; Q294-A297 PolarHBondContact O-N 2.79Å; Q294-T298 WeakPolarHBondContact O-CB 3.39Å; Q294-T298 PolarHBondContact O-N 3.43Å; Q294-T298 PolarHBondContact O-OG1 3.42Å
295	T	94.7	Very high	94.8	Very high	64 Å²	64	70.8 Å²	70.8	39%	0.393	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-45.4	176.1	-57.3	0	0	0	0	110.7	N291 V292 Q293 A297 T298 M299 V467	N291-T295 WeakPolarHBondContact O-CB 3.36Å; N291-T295 PolarHBondContact O-N 3.5Å; N291-T295 PolarHBondContact O-OG1 2.74Å; V292-T295 WeakPolarHBondContact O-CB 3.19Å; V292-T295 PolarHBondContact O-N 2.97Å; V292-T295 VanDerWaalsContact O-N 3.13Å; Q293-T295 VanDerWaalsContact C-N 3.29Å; Q293-T295 PolarHBondContact O-N 3.34Å; T295-A297 VanDerWaalsContact C-N 3.33Å; T295-A297 PolarHBondContact O-N 3.24Å; T295-T298 PolarHBondContact O-N 2.92Å; T295-M299 HydrophobicContact CG2-CG 4.46Å; T295-M299 HydrophobicContact CG2-SD 3.95Å; T295-M299 WeakPolarHBondContact O-CB 3.39Å; T295-M299 VanDerWaalsContact O-CG 3.26Å; T295-M299 WeakPolarHBondContact O-CG 3.35Å; T295-M299 PolarHBondContact O-N 3.08Å; T295-V467 HydrophobicContact CG2-CG2 3.82Å
296	V	95	Very high	94.9	Very high	57 Å²	57	71 Å²	71	35%	0.345	40%	0.395	S	S	.	.	H	α-helix	trans	-56.4	-46.5	172.9	173.6	0	0	0	0	111.1	V292 Q293 T298 M299 N300 V467	V292-V296 WeakPolarHBondContact O-CG2 3.44Å; V292-V296 PolarHBondContact O-N 3.43Å; Q293-V296 PolarHBondContact O-N 2.89Å; V296-T298 PolarHBondContact O-N 2.75Å; V296-M299 PolarHBondContact O-N 3.42Å; V296-N300 PolarHBondContact O-N 2.93Å; V296-N300 PolarHBondContact O-ND2 3.08Å; V296-V467 HydrophobicContact CG2-CG1 3.43Å; V296-V467 VanDerWaalsContact CG2-CG1 3.43Å
297	A	95.8	Very high	95	Very high	51 Å²	51	73.8 Å²	73.8	42%	0.421	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-45.1	179.1	0	0	0	0	0	112	Q293 Q294 T295 M299 N300 Q301	Q293-A297 PolarHBondContact O-N 2.6Å; Q294-A297 PolarHBondContact O-N 2.79Å; T295-A297 VanDerWaalsContact C-N 3.33Å; T295-A297 PolarHBondContact O-N 3.24Å; A297-M299 VanDerWaalsContact C-N 3.33Å; A297-M299 PolarHBondContact O-N 3.01Å; A297-N300 PolarHBondContact O-N 2.92Å; A297-Q301 WeakPolarHBondContact O-CG 3.12Å; A297-Q301 PolarHBondContact O-N 3.47Å; A297-Q301 VanDerWaalsContact O-N 3.08Å
298	T	95.2	Very high	95.1	Very high	66 Å²	66	74.9 Å²	74.9	41%	0.405	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-39.4	177.4	-54	0	0	0	0	111.3	Q294 T295 V296 Q301 M302	Q294-T298 WeakPolarHBondContact O-CB 3.39Å; Q294-T298 PolarHBondContact O-N 3.43Å; Q294-T298 PolarHBondContact O-OG1 3.42Å; T295-T298 PolarHBondContact O-N 2.92Å; V296-T298 PolarHBondContact O-N 2.75Å; T298-Q301 WeakPolarHBondContact O-CB 3.19Å; T298-Q301 PolarHBondContact O-N 3.3Å; T298-M302 WeakPolarHBondContact O-CB 3.29Å; T298-M302 PolarHBondContact O-N 2.92Å
299	M	95.2	Very high	95.3	Very high	17 Å²	17	75.5 Å²	75.5	8%	0.084	41%	0.412	C	S	.	.	H	α-helix	trans	-66.4	-39.4	176.1	-76	172.8	54.5	0	0	112.7	T295 V296 A297 Q301 M302 A303 L460 L463 T464 V467	T295-M299 HydrophobicContact CG2-CG 4.46Å; T295-M299 HydrophobicContact CG2-SD 3.95Å; T295-M299 WeakPolarHBondContact O-CB 3.39Å; T295-M299 VanDerWaalsContact O-CG 3.26Å; T295-M299 WeakPolarHBondContact O-CG 3.35Å; T295-M299 PolarHBondContact O-N 3.08Å; V296-M299 PolarHBondContact O-N 3.42Å; A297-M299 VanDerWaalsContact C-N 3.33Å; A297-M299 PolarHBondContact O-N 3.01Å; M299-Q301 VanDerWaalsContact C-N 3.31Å; M299-Q301 PolarHBondContact O-N 3Å; M299-M302 CarbonylContact O-C 3.58Å; M299-M302 WeakPolarHBondContact O-CB 3.23Å; M299-M302 PolarHBondContact O-N 2.99Å; M299-A303 PolarHBondContact O-N 3.47Å; M299-L460 HydrophobicContact CB-CD1 3.94Å; M299-L460 HydrophobicContact CE-CD1 4.16Å; M299-L460 HydrophobicContact CG-CD1 3.99Å; M299-L463 VanDerWaalsContact CE-C 3.42Å; M299-L463 HydrophobicContact CE-CB 3.55Å; M299-L463 HydrophobicContact SD-CB 3.91Å; M299-T464 VanDerWaalsContact CE-N 3.28Å; M299-T464 WeakPolarHBondContact CE-OG1 3.46Å; M299-V467 HydrophobicContact CE-CG2 4.41Å; M299-V467 HydrophobicContact SD-CB 4.5Å; M299-V467 HydrophobicContact SD-CG2 3.59Å; M299-V467 VanDerWaalsContact SD-CG2 3.59Å
300	N	93.7	Very high	95.4	Very high	105 Å²	105	76.3 Å²	76.3	56%	0.561	42%	0.419	S	S	*	.	H	α-helix	trans	-63.2	-39.1	174.1	-77.1	-34.3	0	0	0	111.8	V296 A297 A303 A304	V296-N300 PolarHBondContact O-N 2.93Å; V296-N300 PolarHBondContact O-ND2 3.08Å; A297-N300 PolarHBondContact O-N 2.92Å; N300-A303 WeakPolarHBondContact O-CB 3.41Å; N300-A303 PolarHBondContact O-N 3.45Å; N300-A304 PolarHBondContact O-N 3.29Å; N300-A304 VanDerWaalsContact O-N 3.08Å
301	Q	95.8	Very high	95.4	Very high	139 Å²	139	74.9 Å²	74.9	65%	0.65	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-41.6	172.5	-70.7	177.8	-27	0	0	111.8	A297 T298 M299 A303 A304 S305	A297-Q301 WeakPolarHBondContact O-CG 3.12Å; A297-Q301 PolarHBondContact O-N 3.47Å; A297-Q301 VanDerWaalsContact O-N 3.08Å; T298-Q301 WeakPolarHBondContact O-CB 3.19Å; T298-Q301 PolarHBondContact O-N 3.3Å; M299-Q301 VanDerWaalsContact C-N 3.31Å; M299-Q301 PolarHBondContact O-N 3Å; Q301-A303 VanDerWaalsContact C-N 3.34Å; Q301-A303 PolarHBondContact O-N 3.43Å; Q301-A304 PolarHBondContact O-N 3.37Å; Q301-S305 PolarHBondContact O-N 2.91Å
302	M	95.3	Very high	95.6	Very high	96 Å²	96	74.8 Å²	74.8	47%	0.473	42%	0.421	S	S	.	.	H	α-helix	trans	-63.3	-40.4	175.2	-168.5	174.1	-68.6	0	0	111.5	T298 M299 A304 S305 V306 L460	T298-M302 WeakPolarHBondContact O-CB 3.29Å; T298-M302 PolarHBondContact O-N 2.92Å; M299-M302 CarbonylContact O-C 3.58Å; M299-M302 WeakPolarHBondContact O-CB 3.23Å; M299-M302 PolarHBondContact O-N 2.99Å; M302-A304 VanDerWaalsContact C-N 3.32Å; M302-A304 PolarHBondContact O-N 3.44Å; M302-S305 WeakPolarHBondContact O-CB 3.4Å; M302-S305 PolarHBondContact O-N 2.92Å; M302-V306 HydrophobicContact CG-CG2 4.48Å; M302-V306 WeakPolarHBondContact O-CG2 3.49Å; M302-V306 PolarHBondContact O-N 3.33Å; M302-L460 HydrophobicContact CB-CD1 4.3Å; M302-L460 HydrophobicContact CG-CD1 4.43Å; M302-L460 HydrophobicContact SD-CD1 4.25Å
303	A	95.6	Very high	95.7	Very high	38 Å²	38	74.6 Å²	74.6	31%	0.314	42%	0.42	S	S	.	.	H	α-helix	trans	-57	-47	174.2	0	0	0	0	0	111.4	M299 N300 Q301 S305 V306 K307 L460	M299-A303 PolarHBondContact O-N 3.47Å; N300-A303 WeakPolarHBondContact O-CB 3.41Å; N300-A303 PolarHBondContact O-N 3.45Å; Q301-A303 VanDerWaalsContact C-N 3.34Å; Q301-A303 PolarHBondContact O-N 3.43Å; A303-S305 VanDerWaalsContact C-N 3.35Å; A303-V306 PolarHBondContact O-N 2.99Å; A303-K307 WeakPolarHBondContact O-CB 3.48Å; A303-K307 PolarHBondContact O-N 3.08Å; A303-L460 HydrophobicContact CB-CD2 3.39Å
304	A	97.1	Very high	95.8	Very high	62 Å²	62	71.4 Å²	71.4	51%	0.512	41%	0.412	S	S	.	.	H	α-helix	trans	-63.2	-41.8	177.6	0	0	0	0	0	111.6	N300 Q301 M302 K307 Q308	N300-A304 PolarHBondContact O-N 3.29Å; N300-A304 VanDerWaalsContact O-N 3.08Å; Q301-A304 PolarHBondContact O-N 3.37Å; M302-A304 VanDerWaalsContact C-N 3.32Å; M302-A304 PolarHBondContact O-N 3.44Å; A304-K307 PolarHBondContact O-N 3.29Å; A304-Q308 WeakPolarHBondContact O-CB 3.22Å; A304-Q308 PolarHBondContact O-N 2.96Å
305	S	96.6	Very high	95.8	Very high	62 Å²	62	68.1 Å²	68.1	43%	0.434	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-45.5	176.7	-171	0	0	0	0	112.3	Q301 M302 A303 K307 Q308 N309	Q301-S305 PolarHBondContact O-N 2.91Å; M302-S305 WeakPolarHBondContact O-CB 3.4Å; M302-S305 PolarHBondContact O-N 2.92Å; A303-S305 VanDerWaalsContact C-N 3.35Å; S305-K307 VanDerWaalsContact C-N 3.34Å; S305-K307 PolarHBondContact O-N 2.94Å; S305-Q308 PolarHBondContact O-N 3.09Å; S305-Q308 VanDerWaalsContact O-N 3.14Å; S305-N309 WeakPolarHBondContact O-CB 3.48Å; S305-N309 VanDerWaalsContact O-CG 3.3Å; S305-N309 PolarHBondContact O-N 3.22Å
306	V	97.4	Very high	96	Very high	12 Å²	12	66.6 Å²	66.6	7%	0.073	40%	0.401	C	S	.	.	H	α-helix	trans	-59.6	-44.6	175.4	168.2	0	0	0	0	110.9	M302 A303 Q308 N309 S310 T453 Q456 A457	M302-V306 HydrophobicContact CG-CG2 4.48Å; M302-V306 WeakPolarHBondContact O-CG2 3.49Å; M302-V306 PolarHBondContact O-N 3.33Å; A303-V306 PolarHBondContact O-N 2.99Å; V306-Q308 VanDerWaalsContact C-N 3.32Å; V306-Q308 PolarHBondContact O-N 2.87Å; V306-N309 PolarHBondContact O-N 2.98Å; V306-S310 PolarHBondContact O-N 3.32Å; V306-T453 HydrophobicContact CG1-CG2 3.77Å; V306-T453 WeakPolarHBondContact CG1-O 3.28Å; V306-T453 WeakPolarHBondContact O-CG2 3.46Å; V306-Q456 HydrophobicContact CG2-CB 3.86Å; V306-A457 HydrophobicContact CG1-CB 3.82Å
307	K	94.8	Very high	96.1	Very high	166 Å²	166	66.4 Å²	66.4	72%	0.722	40%	0.398	S	S	*	.	H	α-helix	trans	-61.2	-41.8	175.4	-173	176.4	-178.4	178.6	0	111.8	A303 A304 S305 S310 A311	A303-K307 WeakPolarHBondContact O-CB 3.48Å; A303-K307 PolarHBondContact O-N 3.08Å; A304-K307 PolarHBondContact O-N 3.29Å; S305-K307 VanDerWaalsContact C-N 3.34Å; S305-K307 PolarHBondContact O-N 2.94Å; K307-S310 PolarHBondContact O-N 3.32Å; K307-A311 PolarHBondContact O-N 2.86Å; K307-A311 VanDerWaalsContact O-N 3.08Å
308	Q	97	Very high	96.1	Very high	123 Å²	123	70.4 Å²	70.4	58%	0.575	41%	0.406	S	S	*	.	H	α-helix	trans	-67.8	-39.1	177.9	-177.1	67	-17.3	0	0	112.4	A304 S305 V306 S310 A311 T312	A304-Q308 WeakPolarHBondContact O-CB 3.22Å; A304-Q308 PolarHBondContact O-N 2.96Å; S305-Q308 PolarHBondContact O-N 3.09Å; S305-Q308 VanDerWaalsContact O-N 3.14Å; V306-Q308 VanDerWaalsContact C-N 3.32Å; V306-Q308 PolarHBondContact O-N 2.87Å; Q308-S310 VanDerWaalsContact C-N 3.34Å; Q308-A311 PolarHBondContact O-N 2.99Å; Q308-T312 WeakPolarHBondContact O-CB 3.4Å; Q308-T312 PolarHBondContact O-N 3.2Å; Q308-T312 PolarHBondContact O-OG1 2.82Å
309	N	96	Very high	96.1	Very high	65 Å²	65	73.1 Å²	73.1	35%	0.348	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-42.6	175	-73.5	-10.5	0	0	0	111.1	S305 V306 T312 A313 T453	S305-N309 WeakPolarHBondContact O-CB 3.48Å; S305-N309 VanDerWaalsContact O-CG 3.3Å; S305-N309 PolarHBondContact O-N 3.22Å; V306-N309 PolarHBondContact O-N 2.98Å; N309-T312 PolarHBondContact O-N 3.34Å; N309-A313 WeakPolarHBondContact O-CB 3.12Å; N309-A313 PolarHBondContact O-N 3.1Å; N309-T453 HydrophobicContact CB-CG2 3.97Å
310	S	95.7	Very high	96.2	Very high	52 Å²	52	73 Å²	73	36%	0.364	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-45.6	176.4	-179.2	0	0	0	0	111.5	V306 K307 Q308 T312 A313 S314	V306-S310 PolarHBondContact O-N 3.32Å; K307-S310 PolarHBondContact O-N 3.32Å; Q308-S310 VanDerWaalsContact C-N 3.34Å; S310-T312 PolarHBondContact O-N 3.29Å; S310-A313 PolarHBondContact O-N 3.39Å; S310-S314 PolarHBondContact O-N 3.38Å
311	A	96.7	Very high	96.3	Very high	52 Å²	52	71.9 Å²	71.9	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-42.5	175.8	0	0	0	0	0	112.1	K307 Q308 S314 A315	K307-A311 PolarHBondContact O-N 2.86Å; K307-A311 VanDerWaalsContact O-N 3.08Å; Q308-A311 PolarHBondContact O-N 2.99Å; A311-S314 PolarHBondContact O-N 2.76Å; A311-A315 WeakPolarHBondContact O-CB 2.84Å; A311-A315 PolarHBondContact O-N 3.33Å
312	T	96.7	Very high	96.4	Very high	77 Å²	77	69.5 Å²	69.5	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-65.6	-43.5	178.9	-56.7	0	0	0	0	111.4	Q308 N309 S310 A315 A316	Q308-T312 WeakPolarHBondContact O-CB 3.4Å; Q308-T312 PolarHBondContact O-N 3.2Å; Q308-T312 PolarHBondContact O-OG1 2.82Å; N309-T312 PolarHBondContact O-N 3.34Å; S310-T312 PolarHBondContact O-N 3.29Å; T312-A315 PolarHBondContact O-N 2.99Å; T312-A316 WeakPolarHBondContact O-CB 3.34Å; T312-A316 PolarHBondContact O-N 3.1Å
313	A	96.7	Very high	96.5	Very high	7 Å²	7	67 Å²	67	6%	0.058	40%	0.401	C	S	.	.	H	α-helix	trans	-61.4	-44.8	175.5	0	0	0	0	0	111.2	N309 S310 A315 A316 D317 I446 I449	N309-A313 WeakPolarHBondContact O-CB 3.12Å; N309-A313 PolarHBondContact O-N 3.1Å; S310-A313 PolarHBondContact O-N 3.39Å; A313-A315 VanDerWaalsContact C-N 3.35Å; A313-A315 PolarHBondContact O-N 2.85Å; A313-A316 PolarHBondContact O-N 2.8Å; A313-D317 WeakPolarHBondContact O-CB 3.13Å; A313-D317 PolarHBondContact O-N 3.08Å; A313-I446 HydrophobicContact CB-CG2 4.19Å; A313-I446 WeakPolarHBondContact O-CG2 3.33Å; A313-I449 HydrophobicContact CB-CG2 4.15Å
314	S	95.3	Very high	96.5	Very high	58 Å²	58	66.6 Å²	66.6	41%	0.406	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-38.1	176.5	-173.5	0	0	0	0	112.8	S310 A311 K318	S310-S314 PolarHBondContact O-N 3.38Å; A311-S314 PolarHBondContact O-N 2.76Å; S314-K318 WeakPolarHBondContact O-CG 3.45Å; S314-K318 PolarHBondContact O-N 3.35Å
315	A	96.8	Very high	96.5	Very high	61 Å²	61	68.3 Å²	68.3	50%	0.504	40%	0.396	S	S	.	.	H	α-helix	trans	-67.5	-42.7	175.3	0	0	0	0	0	111.9	A311 T312 A313 K318 L319	A311-A315 WeakPolarHBondContact O-CB 2.84Å; A311-A315 PolarHBondContact O-N 3.33Å; T312-A315 PolarHBondContact O-N 2.99Å; A313-A315 VanDerWaalsContact C-N 3.35Å; A313-A315 PolarHBondContact O-N 2.85Å; A315-K318 PolarHBondContact O-N 3.4Å; A315-L319 PolarHBondContact O-N 3.49Å; A315-L319 VanDerWaalsContact O-N 3.07Å
316	A	97.3	Very high	96.5	Very high	33 Å²	33	68.2 Å²	68.2	27%	0.273	40%	0.399	S	S	.	.	H	α-helix	trans	-63.1	-40.9	176.7	0	0	0	0	0	111.6	T312 A313 K318 L319 S320 I446	T312-A316 WeakPolarHBondContact O-CB 3.34Å; T312-A316 PolarHBondContact O-N 3.1Å; A313-A316 PolarHBondContact O-N 2.8Å; A316-K318 PolarHBondContact O-N 2.94Å; A316-L319 PolarHBondContact O-N 2.64Å; A316-S320 PolarHBondContact O-N 2.59Å; A316-S320 PolarHBondContact O-OG 2.75Å; A316-I446 HydrophobicContact CB-CD1 3.63Å; A316-I446 HydrophobicContact CB-CG1 4.1Å
317	D	96.7	Very high	96.5	Very high	53 Å²	53	68 Å²	68	28%	0.283	40%	0.398	S	S	.	.	H	α-helix	trans	-58.9	-47.9	176.8	-178.2	61.6	0	0	0	111.5	A313 L319 S320 I321 I446	A313-D317 WeakPolarHBondContact O-CB 3.13Å; A313-D317 PolarHBondContact O-N 3.08Å; D317-L319 VanDerWaalsContact C-N 3.32Å; D317-L319 PolarHBondContact O-N 2.86Å; D317-S320 WeakPolarHBondContact O-CB 3.06Å; D317-S320 PolarHBondContact O-N 2.76Å; D317-I321 WeakPolarHBondContact O-CG1 3.22Å; D317-I321 PolarHBondContact O-N 3.48Å; D317-I446 HydrophobicContact CB-CG2 3.93Å
318	K	96.1	Very high	96.6	Very high	135 Å²	135	63.1 Å²	63.1	59%	0.587	38%	0.382	S	S	*	.	H	α-helix	trans	-60.3	-40.6	175.7	-70.1	175.9	-177	178.2	0	112.6	S314 A315 A316 I321 T322	S314-K318 WeakPolarHBondContact O-CG 3.45Å; S314-K318 PolarHBondContact O-N 3.35Å; A315-K318 PolarHBondContact O-N 3.4Å; A316-K318 PolarHBondContact O-N 2.94Å; K318-I321 PolarHBondContact O-N 3.05Å; K318-T322 PolarHBondContact O-N 2.83Å; K318-T322 VanDerWaalsContact O-N 3.08Å; K318-T322 PolarHBondContact O-OG1 3.27Å
319	L	96.6	Very high	96.6	Very high	123 Å²	123	63.7 Å²	63.7	64%	0.644	39%	0.385	S	S	*	.	H	α-helix	trans	-67.5	-41	178	-175.4	61.6	0	0	0	111.4	A315 A316 D317 T322 A323	A315-L319 PolarHBondContact O-N 3.49Å; A315-L319 VanDerWaalsContact O-N 3.07Å; A316-L319 PolarHBondContact O-N 2.64Å; D317-L319 VanDerWaalsContact C-N 3.32Å; D317-L319 PolarHBondContact O-N 2.86Å; L319-T322 WeakPolarHBondContact O-CB 3.16Å; L319-T322 PolarHBondContact O-N 3.17Å; L319-A323 WeakPolarHBondContact O-CB 3.2Å; L319-A323 PolarHBondContact O-N 3.45Å
320	S	97.2	Very high	96.6	Very high	14 Å²	14	61.4 Å²	61.4	10%	0.098	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-45	174.1	-70.4	0	0	0	0	111.9	A316 D317 T322 A323 S324 V439 T443	A316-S320 PolarHBondContact O-N 2.59Å; A316-S320 PolarHBondContact O-OG 2.75Å; D317-S320 WeakPolarHBondContact O-CB 3.06Å; D317-S320 PolarHBondContact O-N 2.76Å; S320-T322 VanDerWaalsContact C-N 3.29Å; S320-T322 PolarHBondContact O-N 3.11Å; S320-A323 PolarHBondContact O-N 3.07Å; S320-S324 WeakPolarHBondContact O-CB 3.21Å; S320-S324 PolarHBondContact O-N 3.1Å; S320-V439 WeakPolarHBondContact O-CG1 3.36Å; S320-T443 WeakPolarHBondContact CB-OG1 3.12Å
321	I	95.9	Very high	96.6	Very high	81 Å²	81	59.7 Å²	59.7	42%	0.415	37%	0.368	S	S	.	.	H	α-helix	trans	-58.4	-44	175	-67.9	166.1	0	0	0	110.7	D317 K318 S324 N325	D317-I321 WeakPolarHBondContact O-CG1 3.22Å; D317-I321 PolarHBondContact O-N 3.48Å; K318-I321 PolarHBondContact O-N 3.05Å; I321-S324 PolarHBondContact O-N 3.2Å; I321-N325 VanDerWaalsContact O-CG 3.25Å; I321-N325 PolarHBondContact O-N 3.41Å; I321-N325 PolarHBondContact O-ND2 3.12Å
322	T	96.8	Very high	96.5	Very high	89 Å²	89	63.1 Å²	63.1	55%	0.546	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-43.8	178.8	-53.9	0	0	0	0	111.8	K318 L319 S320 N325 A326	K318-T322 PolarHBondContact O-N 2.83Å; K318-T322 VanDerWaalsContact O-N 3.08Å; K318-T322 PolarHBondContact O-OG1 3.27Å; L319-T322 WeakPolarHBondContact O-CB 3.16Å; L319-T322 PolarHBondContact O-N 3.17Å; S320-T322 VanDerWaalsContact C-N 3.29Å; S320-T322 PolarHBondContact O-N 3.11Å; T322-N325 PolarHBondContact O-N 2.84Å; T322-A326 PolarHBondContact O-N 3.17Å
323	A	96.6	Very high	96.5	Very high	44 Å²	44	61.6 Å²	61.6	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-40.4	177.2	0	0	0	0	0	112	L319 S320 A326 A327 V439	L319-A323 WeakPolarHBondContact O-CB 3.2Å; L319-A323 PolarHBondContact O-N 3.45Å; S320-A323 PolarHBondContact O-N 3.07Å; A323-A326 PolarHBondContact O-N 3.01Å; A323-A327 PolarHBondContact O-N 3.44Å; A323-V439 HydrophobicContact CB-CG2 4.36Å
324	S	97.4	Very high	96.4	Very high	29 Å²	29	63.4 Å²	63.4	20%	0.203	38%	0.378	C	S	.	.	H	α-helix	trans	-61.1	-47.5	175.1	-171	0	0	0	0	111	S320 I321 A326 A327 V328	S320-S324 WeakPolarHBondContact O-CB 3.21Å; S320-S324 PolarHBondContact O-N 3.1Å; I321-S324 PolarHBondContact O-N 3.2Å; S324-A326 VanDerWaalsContact C-N 3.34Å; S324-A326 PolarHBondContact O-N 3.28Å; S324-A327 PolarHBondContact O-N 2.91Å; S324-V328 WeakPolarHBondContact O-CG2 3.36Å; S324-V328 PolarHBondContact O-N 2.97Å
325	N	96.9	Very high	96.4	Very high	99 Å²	99	65 Å²	65	53%	0.529	39%	0.386	S	S	.	.	H	α-helix	trans	-60.8	-41.9	177.8	-70.3	-18.2	0	0	0	112.1	I321 T322 A327 V328 Q329	I321-N325 VanDerWaalsContact O-CG 3.25Å; I321-N325 PolarHBondContact O-N 3.41Å; I321-N325 PolarHBondContact O-ND2 3.12Å; T322-N325 PolarHBondContact O-N 2.84Å; N325-A327 VanDerWaalsContact C-N 3.34Å; N325-A327 PolarHBondContact O-N 2.93Å; N325-V328 PolarHBondContact O-N 3.44Å; N325-Q329 WeakPolarHBondContact O-CB 3.45Å; N325-Q329 PolarHBondContact O-N 2.85Å
326	A	96.6	Very high	96.3	Very high	60 Å²	60	66.5 Å²	66.5	50%	0.496	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-39.5	176.5	0	0	0	0	0	112.2	T322 A323 S324 G330	T322-A326 PolarHBondContact O-N 3.17Å; A323-A326 PolarHBondContact O-N 3.01Å; S324-A326 VanDerWaalsContact C-N 3.34Å; S324-A326 PolarHBondContact O-N 3.28Å; A326-G330 PolarHBondContact O-N 3.39Å
327	A	96.8	Very high	96.2	Very high	6 Å²	6	67.3 Å²	67.3	5%	0.05	39%	0.39	C	S	.	.	H	α-helix	trans	-68.4	-40.3	176	0	0	0	0	0	112.3	A323 S324 N325 G330 G331 M432 I435 V436	A323-A327 PolarHBondContact O-N 3.44Å; S324-A327 PolarHBondContact O-N 2.91Å; N325-A327 VanDerWaalsContact C-N 3.34Å; N325-A327 PolarHBondContact O-N 2.93Å; A327-G330 PolarHBondContact O-N 3.05Å; A327-G331 PolarHBondContact O-N 3.18Å; A327-M432 HydrophobicContact CB-SD 4.49Å; A327-I435 HydrophobicContact CB-CB 4.18Å; A327-I435 HydrophobicContact CB-CG2 3.61Å; A327-V436 HydrophobicContact CB-CG2 3.65Å
328	V	97.5	Very high	96.1	Very high	64 Å²	64	66.1 Å²	66.1	39%	0.388	38%	0.383	S	S	.	.	H	α-helix	trans	-59.9	-48.6	173.7	171.2	0	0	0	0	110.7	S324 N325 G330 G331 E332 V436	S324-V328 WeakPolarHBondContact O-CG2 3.36Å; S324-V328 PolarHBondContact O-N 2.97Å; N325-V328 PolarHBondContact O-N 3.44Å; V328-G330 VanDerWaalsContact C-N 3.3Å; V328-G330 PolarHBondContact O-N 2.67Å; V328-G331 WeakPolarHBondContact O-CA 3.3Å; V328-G331 PolarHBondContact O-N 3.14Å; V328-G331 VanDerWaalsContact O-N 3.08Å; V328-E332 PolarHBondContact O-N 3.01Å; V328-V436 HydrophobicContact CG2-CG1 4.47Å; V328-V436 HydrophobicContact CG2-CG2 3.78Å
329	Q	96.2	Very high	96	Very high	135 Å²	135	66.1 Å²	66.1	63%	0.631	38%	0.383	S	S	*	.	H	α-helix	trans	-61.8	-38.8	176.3	-172	-179.6	13.8	0	0	111.9	N325 G331 E332 A333	N325-Q329 WeakPolarHBondContact O-CB 3.45Å; N325-Q329 PolarHBondContact O-N 2.85Å; Q329-G331 VanDerWaalsContact C-N 3.32Å; Q329-G331 PolarHBondContact O-N 3.33Å; Q329-E332 PolarHBondContact O-N 3.35Å; Q329-A333 PolarHBondContact O-N 3.42Å
330	G	95.6	Very high	96	Very high	17 Å²	17	63.3 Å²	63.3	18%	0.175	37%	0.371	C	S	.	.	H	α-helix	trans	-59.4	-42.2	172.1	0	0	0	0	0	112.2	A326 A327 V328 A333 M334	A326-G330 PolarHBondContact O-N 3.39Å; A327-G330 PolarHBondContact O-N 3.05Å; V328-G330 VanDerWaalsContact C-N 3.3Å; V328-G330 PolarHBondContact O-N 2.67Å; G330-A333 PolarHBondContact O-N 3.14Å; G330-M334 WeakPolarHBondContact O-CG 3.4Å; G330-M334 PolarHBondContact O-N 2.9Å
331	G	95.5	Very high	95.8	Very high	17 Å²	17	64.4 Å²	64.4	18%	0.175	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-47.7	173.6	0	0	0	0	0	112.9	A327 V328 Q329 A333 M334 T335	A327-G331 PolarHBondContact O-N 3.18Å; V328-G331 WeakPolarHBondContact O-CA 3.3Å; V328-G331 PolarHBondContact O-N 3.14Å; V328-G331 VanDerWaalsContact O-N 3.08Å; Q329-G331 VanDerWaalsContact C-N 3.32Å; Q329-G331 PolarHBondContact O-N 3.33Å; G331-A333 VanDerWaalsContact C-N 3.31Å; G331-A333 PolarHBondContact O-N 3.31Å; G331-M334 WeakPolarHBondContact O-CB 3.49Å; G331-M334 PolarHBondContact O-N 3.25Å; G331-M334 VanDerWaalsContact O-N 3.08Å; G331-T335 PolarHBondContact O-N 2.88Å; G331-T335 PolarHBondContact O-OG1 3.1Å
332	E	95.3	Very high	95.7	Very high	124 Å²	124	64.8 Å²	64.8	58%	0.579	38%	0.378	S	S	*	.	H	α-helix	trans	-60.2	-39.6	176.6	-68.8	177.9	173.3	0	0	112.4	V328 Q329 M334 T335 T336	V328-E332 PolarHBondContact O-N 3.01Å; Q329-E332 PolarHBondContact O-N 3.35Å; E332-M334 VanDerWaalsContact C-N 3.34Å; E332-T335 WeakPolarHBondContact O-CB 3.28Å; E332-T335 PolarHBondContact O-N 2.83Å; E332-T336 PolarHBondContact O-N 3.42Å; E332-T336 VanDerWaalsContact O-N 3.08Å; E332-T336 PolarHBondContact O-OG1 3.03Å; E332-T336 VanDerWaalsContact O-OG1 3.08Å
333	A	95.9	Very high	95.7	Very high	44 Å²	44	64.9 Å²	64.9	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-41.6	174	0	0	0	0	0	111.3	Q329 G330 G331 T335 T336 V337	Q329-A333 PolarHBondContact O-N 3.42Å; G330-A333 PolarHBondContact O-N 3.14Å; G331-A333 VanDerWaalsContact C-N 3.31Å; G331-A333 PolarHBondContact O-N 3.31Å; A333-T335 PolarHBondContact O-N 2.85Å; A333-T336 WeakPolarHBondContact O-CB 3.48Å; A333-T336 PolarHBondContact O-N 3.39Å; A333-V337 WeakPolarHBondContact O-CG2 3.49Å; A333-V337 PolarHBondContact O-N 3.09Å
334	M	95.3	Very high	95.6	Very high	45 Å²	45	66 Å²	66	22%	0.222	37%	0.374	C	S	.	.	H	α-helix	trans	-63.6	-40.1	175.5	-65.8	-56.6	96.8	0	0	111.9	G330 G331 E332 T336 V337 I338 V425 A428	G330-M334 WeakPolarHBondContact O-CG 3.4Å; G330-M334 PolarHBondContact O-N 2.9Å; G331-M334 WeakPolarHBondContact O-CB 3.49Å; G331-M334 PolarHBondContact O-N 3.25Å; G331-M334 VanDerWaalsContact O-N 3.08Å; E332-M334 VanDerWaalsContact C-N 3.34Å; M334-T336 VanDerWaalsContact C-N 3.26Å; M334-T336 PolarHBondContact O-N 3.49Å; M334-V337 PolarHBondContact O-N 3.41Å; M334-V337 VanDerWaalsContact O-N 3.14Å; M334-I338 WeakPolarHBondContact O-CG1 3.17Å; M334-I338 PolarHBondContact O-N 2.93Å; M334-V425 HydrophobicContact CB-CG1 4.1Å; M334-V425 WeakPolarHBondContact O-CG1 3.32Å; M334-V425 HydrophobicContact SD-CG1 3.97Å; M334-A428 HydrophobicContact CG-CB 4.2Å; M334-A428 HydrophobicContact SD-CB 3.68Å
335	T	94.7	Very high	95.4	Very high	93 Å²	93	66.6 Å²	66.6	57%	0.571	38%	0.381	S	S	*	.	H	α-helix	trans	-58.6	-39.4	173.6	-52.7	0	0	0	0	112	G331 E332 A333 I338 K339	G331-T335 PolarHBondContact O-N 2.88Å; G331-T335 PolarHBondContact O-OG1 3.1Å; E332-T335 WeakPolarHBondContact O-CB 3.28Å; E332-T335 PolarHBondContact O-N 2.83Å; A333-T335 PolarHBondContact O-N 2.85Å; T335-I338 PolarHBondContact O-N 3.25Å; T335-K339 PolarHBondContact O-N 3.19Å; T335-K339 VanDerWaalsContact O-N 3.16Å
336	T	95.9	Very high	95.4	Very high	91 Å²	91	65.6 Å²	65.6	56%	0.558	38%	0.376	S	S	*	.	H	α-helix	trans	-65.8	-40	176	-55.6	0	0	0	0	111.7	E332 A333 M334 K339 T340	E332-T336 PolarHBondContact O-N 3.42Å; E332-T336 VanDerWaalsContact O-N 3.08Å; E332-T336 PolarHBondContact O-OG1 3.03Å; E332-T336 VanDerWaalsContact O-OG1 3.08Å; A333-T336 WeakPolarHBondContact O-CB 3.48Å; A333-T336 PolarHBondContact O-N 3.39Å; M334-T336 VanDerWaalsContact C-N 3.26Å; M334-T336 PolarHBondContact O-N 3.49Å; T336-K339 PolarHBondContact O-N 3.02Å; T336-T340 PolarHBondContact O-N 3.01Å; T336-T340 VanDerWaalsContact O-N 3.12Å; T336-T340 PolarHBondContact O-OG1 3.23Å
337	V	95.3	Very high	95.3	Very high	51 Å²	51	65.6 Å²	65.6	31%	0.309	37%	0.372	S	S	.	.	H	α-helix	trans	-68.2	-38.6	176.7	178.9	0	0	0	0	111.3	A333 M334 K339 T340 M341 V425	A333-V337 WeakPolarHBondContact O-CG2 3.49Å; A333-V337 PolarHBondContact O-N 3.09Å; M334-V337 PolarHBondContact O-N 3.41Å; M334-V337 VanDerWaalsContact O-N 3.14Å; V337-K339 PolarHBondContact O-N 2.99Å; V337-T340 WeakPolarHBondContact O-CB 3.43Å; V337-T340 PolarHBondContact O-N 2.8Å; V337-T340 VanDerWaalsContact O-N 3.12Å; V337-M341 HydrophobicContact CG1-CE 4.34Å; V337-M341 WeakPolarHBondContact O-CG 3.46Å; V337-M341 PolarHBondContact O-N 3.11Å; V337-V425 HydrophobicContact CB-CG1 3.8Å; V337-V425 HydrophobicContact CB-CG2 4.44Å; V337-V425 HydrophobicContact CG1-CB 4.29Å; V337-V425 HydrophobicContact CG1-CG1 3.8Å; V337-V425 HydrophobicContact CG1-CG2 3.53Å
338	I	93.7	Very high	95.3	Very high	28 Å²	28	65.9 Å²	65.9	14%	0.144	37%	0.373	C	S	.	.	H	α-helix	trans	-56.5	-50.6	174.2	-70.8	162.1	0	0	0	110.1	M334 T335 T340 M341 D342 V425 H426	M334-I338 WeakPolarHBondContact O-CG1 3.17Å; M334-I338 PolarHBondContact O-N 2.93Å; T335-I338 PolarHBondContact O-N 3.25Å; I338-T340 PolarHBondContact O-N 3.43Å; I338-M341 WeakPolarHBondContact O-CA 3.14Å; I338-M341 WeakPolarHBondContact O-CB 3.5Å; I338-M341 PolarHBondContact O-N 3.23Å; I338-D342 PolarHBondContact O-N 2.88Å; I338-V425 HydrophobicContact CD1-CG1 4.35Å; I338-V425 HydrophobicContact CG1-CB 4.27Å; I338-V425 HydrophobicContact CG1-CG1 3.64Å; I338-H426 WeakPolarHBondContact CD1-ND1 3.5Å
339	K	94.7	Very high	95.1	Very high	134 Å²	134	69.2 Å²	69.2	58%	0.583	39%	0.385	S	S	*	.	H	α-helix	trans	-56.5	-40.3	176.9	-176.3	-179.6	177.1	-177	0	112.1	T335 T336 V337 M341 D342 D343	T335-K339 PolarHBondContact O-N 3.19Å; T335-K339 VanDerWaalsContact O-N 3.16Å; T336-K339 PolarHBondContact O-N 3.02Å; V337-K339 PolarHBondContact O-N 2.99Å; K339-M341 VanDerWaalsContact C-N 3.35Å; K339-D342 PolarHBondContact O-N 3.33Å; K339-D343 PolarHBondContact O-N 2.86Å
340	T	95.6	Very high	95	Very high	65 Å²	65	70.3 Å²	70.3	40%	0.399	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-38.6	176.8	-52.7	0	0	0	0	111.6	T336 V337 I338 D342 D343 I344	T336-T340 PolarHBondContact O-N 3.01Å; T336-T340 VanDerWaalsContact O-N 3.12Å; T336-T340 PolarHBondContact O-OG1 3.23Å; V337-T340 WeakPolarHBondContact O-CB 3.43Å; V337-T340 PolarHBondContact O-N 2.8Å; V337-T340 VanDerWaalsContact O-N 3.12Å; I338-T340 PolarHBondContact O-N 3.43Å; T340-D342 VanDerWaalsContact C-N 3.35Å; T340-D343 PolarHBondContact O-N 3.44Å; T340-I344 HydrophobicContact CG2-CD1 4.02Å; T340-I344 WeakPolarHBondContact O-CD1 3.44Å; T340-I344 WeakPolarHBondContact O-CG1 3.41Å; T340-I344 PolarHBondContact O-N 3.34Å
341	M	94.4	Very high	95.1	Very high	37 Å²	37	73.5 Å²	73.5	18%	0.182	40%	0.395	C	S	.	.	H	α-helix	trans	-64.5	-39.6	174.7	-67.8	-63.4	126.2	0	0	111.7	V337 I338 K339 I344 A345 V418	V337-M341 HydrophobicContact CG1-CE 4.34Å; V337-M341 WeakPolarHBondContact O-CG 3.46Å; V337-M341 PolarHBondContact O-N 3.11Å; I338-M341 WeakPolarHBondContact O-CA 3.14Å; I338-M341 WeakPolarHBondContact O-CB 3.5Å; I338-M341 PolarHBondContact O-N 3.23Å; K339-M341 VanDerWaalsContact C-N 3.35Å; M341-I344 HydrophobicContact CE-CD1 4.04Å; M341-I344 PolarHBondContact O-N 3.38Å; M341-A345 WeakPolarHBondContact O-CB 3.32Å; M341-A345 PolarHBondContact O-N 2.98Å; M341-V418 HydrophobicContact CB-CG1 4.46Å; M341-V418 VanDerWaalsContact O-CG1 3.3Å; M341-V418 WeakPolarHBondContact O-CG1 3.27Å; M341-V418 HydrophobicContact SD-CG1 4.42Å
342	D	93.9	Very high	95.1	Very high	88 Å²	88	73.6 Å²	73.6	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-43.3	175.2	-67.4	-23.9	0	0	0	111.6	I338 K339 T340 I344 A345 D346	I338-D342 PolarHBondContact O-N 2.88Å; K339-D342 PolarHBondContact O-N 3.33Å; T340-D342 VanDerWaalsContact C-N 3.35Å; D342-I344 VanDerWaalsContact C-N 3.35Å; D342-I344 PolarHBondContact O-N 3.34Å; D342-A345 WeakPolarHBondContact O-CB 3.46Å; D342-A345 PolarHBondContact O-N 3.04Å; D342-D346 PolarHBondContact O-N 3.26Å
343	D	95.9	Very high	95.1	Very high	92 Å²	92	71.8 Å²	71.8	49%	0.492	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-38.7	176.4	-70	-22.5	0	0	0	111.9	K339 T340 S347	K339-D343 PolarHBondContact O-N 2.86Å; T340-D343 PolarHBondContact O-N 3.44Å; D343-S347 WeakPolarHBondContact O-CB 3.4Å; D343-S347 PolarHBondContact O-N 3.43Å; D343-S347 PolarHBondContact O-OG 3.37Å
344	I	95.4	Very high	95.1	Very high	67 Å²	67	74.4 Å²	74.4	34%	0.344	40%	0.4	S	S	.	.	H	α-helix	trans	-69.6	-37.9	175	-62.9	164.3	0	0	0	110.6	T340 M341 D342 S347 T348 V418	T340-I344 HydrophobicContact CG2-CD1 4.02Å; T340-I344 WeakPolarHBondContact O-CD1 3.44Å; T340-I344 WeakPolarHBondContact O-CG1 3.41Å; T340-I344 PolarHBondContact O-N 3.34Å; M341-I344 HydrophobicContact CE-CD1 4.04Å; M341-I344 PolarHBondContact O-N 3.38Å; D342-I344 VanDerWaalsContact C-N 3.35Å; D342-I344 PolarHBondContact O-N 3.34Å; I344-S347 PolarHBondContact O-N 2.98Å; I344-T348 WeakPolarHBondContact O-CB 3.36Å; I344-T348 PolarHBondContact O-N 3.23Å; I344-T348 PolarHBondContact O-OG1 3.08Å; I344-V418 HydrophobicContact CB-CG1 4.34Å; I344-V418 HydrophobicContact CB-CG2 4.29Å; I344-V418 HydrophobicContact CG2-CG1 4.33Å; I344-V418 HydrophobicContact CG2-CG2 3.42Å; I344-V418 VanDerWaalsContact CG2-CG2 3.42Å
345	A	93.4	Very high	95.2	Very high	42 Å²	42	72.6 Å²	72.6	35%	0.347	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-46.8	176.6	0	0	0	0	0	111.2	M341 D342 S347 T348 Q349 V418	M341-A345 WeakPolarHBondContact O-CB 3.32Å; M341-A345 PolarHBondContact O-N 2.98Å; D342-A345 WeakPolarHBondContact O-CB 3.46Å; D342-A345 PolarHBondContact O-N 3.04Å; A345-S347 VanDerWaalsContact C-N 3.33Å; A345-S347 PolarHBondContact O-N 3.01Å; A345-T348 PolarHBondContact O-N 3.42Å; A345-Q349 PolarHBondContact O-N 2.98Å; A345-V418 HydrophobicContact CB-CG1 3.85Å
346	D	95.5	Very high	95.2	Very high	78 Å²	78	70.4 Å²	70.4	42%	0.417	38%	0.38	S	S	.	.	H	α-helix	trans	-58.8	-45.5	174.2	-175.5	63.5	0	0	0	111.3	D342 T348 Q349 R350	D342-D346 PolarHBondContact O-N 3.26Å; D346-T348 VanDerWaalsContact C-N 3.33Å; D346-T348 PolarHBondContact O-N 3.08Å; D346-Q349 PolarHBondContact O-N 3.41Å; D346-R350 WeakPolarHBondContact O-CG 3.14Å; D346-R350 PolarHBondContact O-N 3.02Å; D346-R350 IonicContact OD1-NE 3.84Å; D346-R350 IonicContact OD2-CZ 3.32Å; D346-R350 VanDerWaalsContact OD2-CZ 3.32Å; D346-R350 IonicContact OD2-NE 2.8Å; D346-R350 PolarHBondContact OD2-NE 3.03Å; D346-R350 IonicContact OD2-NH2 3.08Å; D346-R350 PolarHBondContact OD2-NH2 2.91Å; D346-R350 VanDerWaalsContact OD2-NH2 3.08Å
347	S	95.6	Very high	95.3	Very high	59 Å²	59	70.9 Å²	70.9	41%	0.413	38%	0.379	S	S	.	.	H	α-helix	trans	-59.8	-44.1	177.3	-62.3	0	0	0	0	111.7	D343 I344 A345 Q349 R350 I351	D343-S347 WeakPolarHBondContact O-CB 3.4Å; D343-S347 PolarHBondContact O-N 3.43Å; D343-S347 PolarHBondContact O-OG 3.37Å; I344-S347 PolarHBondContact O-N 2.98Å; A345-S347 VanDerWaalsContact C-N 3.33Å; A345-S347 PolarHBondContact O-N 3.01Å; S347-Q349 PolarHBondContact O-N 3.43Å; S347-R350 PolarHBondContact O-N 3.06Å; S347-I351 WeakPolarHBondContact O-CG1 3.4Å; S347-I351 PolarHBondContact O-N 2.93Å
348	T	95.6	Very high	95.3	Very high	13 Å²	13	72.3 Å²	72.3	8%	0.08	38%	0.384	C	S	.	.	H	α-helix	trans	-62.8	-42.6	178.8	-55.9	0	0	0	0	111.1	I344 A345 D346 R350 I351 G352 I411 A415	I344-T348 WeakPolarHBondContact O-CB 3.36Å; I344-T348 PolarHBondContact O-N 3.23Å; I344-T348 PolarHBondContact O-OG1 3.08Å; A345-T348 PolarHBondContact O-N 3.42Å; D346-T348 VanDerWaalsContact C-N 3.33Å; D346-T348 PolarHBondContact O-N 3.08Å; T348-R350 PolarHBondContact O-N 3.23Å; T348-I351 PolarHBondContact O-N 3.15Å; T348-G352 PolarHBondContact O-N 3.41Å; T348-I411 HydrophobicContact CG2-CG2 3.67Å; T348-I411 WeakPolarHBondContact CG2-O 3.41Å; T348-I411 WeakPolarHBondContact O-CG2 3.43Å; T348-A415 HydrophobicContact CG2-CB 3.81Å
349	Q	93.6	Very high	95.4	Very high	134 Å²	134	72.6 Å²	72.6	63%	0.626	39%	0.386	S	S	*	.	H	α-helix	trans	-62.8	-41.6	176.2	-177.5	62.4	19	0	0	112.5	A345 D346 S347 G352 T353	A345-Q349 PolarHBondContact O-N 2.98Å; D346-Q349 PolarHBondContact O-N 3.41Å; S347-Q349 PolarHBondContact O-N 3.43Å; Q349-G352 PolarHBondContact O-N 2.73Å; Q349-T353 PolarHBondContact O-N 2.86Å; Q349-T353 PolarHBondContact O-OG1 3.41Å
350	R	95.1	Very high	95.5	Very high	158 Å²	158	69.8 Å²	69.8	60%	0.596	38%	0.377	S	S	*	.	H	α-helix	trans	-64	-44.9	175.9	-70.7	177.9	-171.8	-138	4	111.8	D346 S347 T348 G352 T353 I354	D346-R350 WeakPolarHBondContact O-CG 3.14Å; D346-R350 PolarHBondContact O-N 3.02Å; D346-R350 IonicContact OD1-NE 3.84Å; D346-R350 IonicContact OD2-CZ 3.32Å; D346-R350 VanDerWaalsContact OD2-CZ 3.32Å; D346-R350 IonicContact OD2-NE 2.8Å; D346-R350 PolarHBondContact OD2-NE 3.03Å; D346-R350 IonicContact OD2-NH2 3.08Å; D346-R350 PolarHBondContact OD2-NH2 2.91Å; D346-R350 VanDerWaalsContact OD2-NH2 3.08Å; S347-R350 PolarHBondContact O-N 3.06Å; T348-R350 PolarHBondContact O-N 3.23Å; R350-G352 VanDerWaalsContact C-N 3.29Å; R350-G352 PolarHBondContact O-N 3.29Å; R350-T353 WeakPolarHBondContact O-CB 3.38Å; R350-T353 PolarHBondContact O-N 2.93Å; R350-I354 WeakPolarHBondContact O-CG1 3.06Å; R350-I354 PolarHBondContact O-N 3.23Å
351	I	96	Very high	95.5	Very high	84 Å²	84	70.8 Å²	70.8	43%	0.431	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-40.1	176.8	-60.7	165.7	0	0	0	109.8	S347 T348 T353 I354 T355 I411	S347-I351 WeakPolarHBondContact O-CG1 3.4Å; S347-I351 PolarHBondContact O-N 2.93Å; T348-I351 PolarHBondContact O-N 3.15Å; I351-T353 VanDerWaalsContact C-N 3.33Å; I351-T353 PolarHBondContact O-N 3.02Å; I351-I354 PolarHBondContact O-N 3.25Å; I351-T355 WeakPolarHBondContact O-CB 3.27Å; I351-T355 PolarHBondContact O-N 3.22Å; I351-T355 PolarHBondContact O-OG1 3.22Å; I351-I411 HydrophobicContact CB-CD1 4.24Å; I351-I411 HydrophobicContact CG2-CD1 3.41Å; I351-I411 VanDerWaalsContact CG2-CD1 3.41Å; I351-I411 HydrophobicContact CG2-CG1 3.89Å
352	G	95.5	Very high	95.6	Very high	18 Å²	18	69.2 Å²	69.2	19%	0.186	37%	0.372	C	S	.	.	H	α-helix	trans	-57	-45.2	173.5	0	0	0	0	0	112.6	T348 Q349 R350 T355 S356	T348-G352 PolarHBondContact O-N 3.41Å; Q349-G352 PolarHBondContact O-N 2.73Å; R350-G352 VanDerWaalsContact C-N 3.29Å; R350-G352 PolarHBondContact O-N 3.29Å; G352-T355 PolarHBondContact O-N 2.98Å; G352-S356 PolarHBondContact O-N 3.33Å
353	T	96.3	Very high	95.7	Very high	86 Å²	86	71.1 Å²	71.1	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-62	-45.9	176.6	-52	0	0	0	0	112.1	Q349 R350 I351 T355 S356 L357	Q349-T353 PolarHBondContact O-N 2.86Å; Q349-T353 PolarHBondContact O-OG1 3.41Å; R350-T353 WeakPolarHBondContact O-CB 3.38Å; R350-T353 PolarHBondContact O-N 2.93Å; I351-T353 VanDerWaalsContact C-N 3.33Å; I351-T353 PolarHBondContact O-N 3.02Å; T353-T355 VanDerWaalsContact C-N 3.31Å; T353-T355 PolarHBondContact O-N 2.86Å; T353-S356 WeakPolarHBondContact O-CB 3.49Å; T353-S356 PolarHBondContact O-N 2.99Å; T353-L357 PolarHBondContact O-N 3.07Å
354	I	96.3	Very high	95.7	Very high	100 Å²	100	72.8 Å²	72.8	51%	0.513	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-42	176.9	-67.6	166.9	0	0	0	110.6	R350 I351 S356 L357 I358	R350-I354 WeakPolarHBondContact O-CG1 3.06Å; R350-I354 PolarHBondContact O-N 3.23Å; I351-I354 PolarHBondContact O-N 3.25Å; I354-S356 VanDerWaalsContact C-N 3.35Å; I354-S356 PolarHBondContact O-N 2.91Å; I354-L357 WeakPolarHBondContact O-CB 3.02Å; I354-L357 PolarHBondContact O-N 2.78Å; I354-I358 HydrophobicContact CG2-CD1 3.92Å; I354-I358 HydrophobicContact CG2-CG1 4.42Å; I354-I358 VanDerWaalsContact O-CG1 3.31Å; I354-I358 WeakPolarHBondContact O-CG1 3.44Å; I354-I358 PolarHBondContact O-N 3.01Å
355	T	96.1	Very high	95.7	Very high	6 Å²	6	71.9 Å²	71.9	4%	0.037	38%	0.379	C	S	.	.	H	α-helix	trans	-67.1	-37.5	-179.5	-53.3	0	0	0	0	111.6	I351 G352 T353 I358 N359 A404 I407 R408 I411	I351-T355 WeakPolarHBondContact O-CB 3.27Å; I351-T355 PolarHBondContact O-N 3.22Å; I351-T355 PolarHBondContact O-OG1 3.22Å; G352-T355 PolarHBondContact O-N 2.98Å; T353-T355 VanDerWaalsContact C-N 3.31Å; T353-T355 PolarHBondContact O-N 2.86Å; T355-I358 PolarHBondContact O-N 2.88Å; T355-N359 PolarHBondContact O-N 3.22Å; T355-A404 HydrophobicContact CG2-CB 4.24Å; T355-A404 WeakPolarHBondContact CG2-O 3.39Å; T355-I407 HydrophobicContact CG2-CB 4.01Å; T355-I407 HydrophobicContact CG2-CG2 3.9Å; T355-R408 HydrophobicContact CG2-CB 4.06Å; T355-I411 HydrophobicContact CG2-CD1 4.31Å; T355-I411 WeakPolarHBondContact OG1-CD1 3.38Å
356	S	95.7	Very high	95.7	Very high	48 Å²	48	71.6 Å²	71.6	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-46.7	170.9	-167	0	0	0	0	111.3	G352 T353 I354 I358 N359 D360	G352-S356 PolarHBondContact O-N 3.33Å; T353-S356 WeakPolarHBondContact O-CB 3.49Å; T353-S356 PolarHBondContact O-N 2.99Å; I354-S356 VanDerWaalsContact C-N 3.35Å; I354-S356 PolarHBondContact O-N 2.91Å; S356-I358 VanDerWaalsContact C-N 3.33Å; S356-I358 PolarHBondContact O-N 2.83Å; S356-N359 WeakPolarHBondContact O-CB 3.4Å; S356-N359 PolarHBondContact O-N 3.39Å; S356-N359 VanDerWaalsContact O-N 3.15Å; S356-D360 VanDerWaalsContact O-CG 3.3Å; S356-D360 PolarHBondContact O-N 3.13Å
357	L	96.9	Very high	95.7	Very high	101 Å²	101	71 Å²	71	53%	0.529	37%	0.368	S	S	.	.	H	α-helix	trans	-60.1	-41.7	176.5	178.2	65.1	0	0	0	112	T353 I354 N359 D360 I361	T353-L357 PolarHBondContact O-N 3.07Å; I354-L357 WeakPolarHBondContact O-CB 3.02Å; I354-L357 PolarHBondContact O-N 2.78Å; L357-N359 VanDerWaalsContact C-N 3.31Å; L357-N359 PolarHBondContact O-N 2.91Å; L357-D360 PolarHBondContact O-N 3.21Å; L357-I361 HydrophobicContact CD1-CD1 4.29Å; L357-I361 HydrophobicContact CD1-CG1 4.41Å; L357-I361 HydrophobicContact CG-CD1 3.99Å; L357-I361 VanDerWaalsContact O-CG1 3.3Å; L357-I361 WeakPolarHBondContact O-CG1 3.21Å; L357-I361 PolarHBondContact O-N 3.12Å
358	I	96	Very high	95.7	Very high	80 Å²	80	73.7 Å²	73.7	41%	0.41	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-42.2	175.9	-68.6	166.9	0	0	0	110.7	I354 T355 S356 D360 I361 A362 A404	I354-I358 HydrophobicContact CG2-CD1 3.92Å; I354-I358 HydrophobicContact CG2-CG1 4.42Å; I354-I358 VanDerWaalsContact O-CG1 3.31Å; I354-I358 WeakPolarHBondContact O-CG1 3.44Å; I354-I358 PolarHBondContact O-N 3.01Å; T355-I358 PolarHBondContact O-N 2.88Å; S356-I358 VanDerWaalsContact C-N 3.33Å; S356-I358 PolarHBondContact O-N 2.83Å; I358-D360 VanDerWaalsContact C-N 3.34Å; I358-I361 PolarHBondContact O-N 2.72Å; I358-A362 WeakPolarHBondContact O-CB 3.27Å; I358-A362 PolarHBondContact O-N 2.86Å; I358-A404 HydrophobicContact CB-CB 4.47Å; I358-A404 HydrophobicContact CG2-CB 3.99Å
359	N	95.7	Very high	95.6	Very high	34 Å²	34	73.3 Å²	73.3	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-40.7	175.6	179.5	81.2	0	0	0	111.8	T355 S356 L357 A362 F363 A404 N405	T355-N359 PolarHBondContact O-N 3.22Å; S356-N359 WeakPolarHBondContact O-CB 3.4Å; S356-N359 PolarHBondContact O-N 3.39Å; S356-N359 VanDerWaalsContact O-N 3.15Å; L357-N359 VanDerWaalsContact C-N 3.31Å; L357-N359 PolarHBondContact O-N 2.91Å; N359-A362 PolarHBondContact O-N 2.86Å; N359-F363 WeakPolarHBondContact O-CB 3.43Å; N359-F363 PolarHBondContact O-N 2.85Å; N359-A404 HydrophobicContact CB-CB 4Å; N359-N405 PolarHBondContact OD1-ND2 3.42Å; N359-N405 VanDerWaalsContact OD1-ND2 3.13Å
360	D	97.1	Very high	95.5	Very high	76 Å²	76	70.1 Å²	70.1	41%	0.406	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-41.9	177.3	-64.5	-22.4	0	0	0	111.8	S356 L357 I358 F363 Q364	S356-D360 VanDerWaalsContact O-CG 3.3Å; S356-D360 PolarHBondContact O-N 3.13Å; L357-D360 PolarHBondContact O-N 3.21Å; I358-D360 VanDerWaalsContact C-N 3.34Å; D360-F363 WeakPolarHBondContact O-CB 3.44Å; D360-F363 PolarHBondContact O-N 3.23Å; D360-Q364 WeakPolarHBondContact O-CG 3.4Å; D360-Q364 PolarHBondContact O-N 3.01Å
361	I	95.9	Very high	95.3	Very high	85 Å²	85	67 Å²	67	44%	0.436	36%	0.357	S	S	.	.	H	α-helix	trans	-63	-43.1	174.1	-67.4	166.4	0	0	0	110.4	L357 I358 F363 Q364 T365	L357-I361 HydrophobicContact CD1-CD1 4.29Å; L357-I361 HydrophobicContact CD1-CG1 4.41Å; L357-I361 HydrophobicContact CG-CD1 3.99Å; L357-I361 VanDerWaalsContact O-CG1 3.3Å; L357-I361 WeakPolarHBondContact O-CG1 3.21Å; L357-I361 PolarHBondContact O-N 3.12Å; I358-I361 PolarHBondContact O-N 2.72Å; I361-F363 VanDerWaalsContact C-N 3.32Å; I361-F363 PolarHBondContact O-N 3.45Å; I361-Q364 PolarHBondContact O-N 2.68Å; I361-T365 WeakPolarHBondContact O-CB 3.28Å; I361-T365 PolarHBondContact O-N 3.36Å; I361-T365 PolarHBondContact O-OG1 2.97Å
362	A	95.9	Very high	95.1	Very high	5 Å²	5	65.2 Å²	65.2	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-41.4	176.1	0	0	0	0	0	111.3	I358 N359 T365 N366 A401	I358-A362 WeakPolarHBondContact O-CB 3.27Å; I358-A362 PolarHBondContact O-N 2.86Å; N359-A362 PolarHBondContact O-N 2.86Å; A362-T365 PolarHBondContact O-N 2.83Å; A362-N366 WeakPolarHBondContact O-CB 3.5Å; A362-N366 PolarHBondContact O-N 2.99Å; A362-A401 HydrophobicContact CB-CB 3.93Å
363	F	95.6	Very high	94.9	Very high	128 Å²	128	65.9 Å²	65.9	56%	0.561	36%	0.358	S	S	*	.	H	α-helix	trans	-62.8	-48.8	174.6	-178.5	-100.7	0	0	0	112.1	N359 D360 I361 T365 N366 I367	N359-F363 WeakPolarHBondContact O-CB 3.43Å; N359-F363 PolarHBondContact O-N 2.85Å; D360-F363 WeakPolarHBondContact O-CB 3.44Å; D360-F363 PolarHBondContact O-N 3.23Å; I361-F363 VanDerWaalsContact C-N 3.32Å; I361-F363 PolarHBondContact O-N 3.45Å; F363-T365 VanDerWaalsContact C-N 3.3Å; F363-T365 PolarHBondContact O-N 3.14Å; F363-N366 WeakPolarHBondContact O-CB 3.37Å; F363-N366 PolarHBondContact O-N 3.16Å; F363-N366 VanDerWaalsContact O-N 3.15Å; F363-I367 HydrophobicContact CD1-CG1 4.44Å; F363-I367 HydrophobicContact CE1-CG1 4.09Å; F363-I367 HydrophobicContact CZ-CD1 4.19Å; F363-I367 HydrophobicContact CZ-CG1 4.26Å; F363-I367 WeakPolarHBondContact O-CG1 3.4Å; F363-I367 PolarHBondContact O-N 2.96Å
364	Q	96.7	Very high	94.6	Very high	126 Å²	126	66 Å²	66	59%	0.589	36%	0.359	S	S	*	.	H	α-helix	trans	-58.5	-42.2	175.5	-73.4	179	-2.8	0	0	111.9	D360 I361 N366 I367 L368	D360-Q364 WeakPolarHBondContact O-CG 3.4Å; D360-Q364 PolarHBondContact O-N 3.01Å; I361-Q364 PolarHBondContact O-N 2.68Å; Q364-N366 VanDerWaalsContact C-N 3.32Å; Q364-N366 PolarHBondContact O-N 2.9Å; Q364-I367 PolarHBondContact O-N 3.39Å; Q364-I367 VanDerWaalsContact O-N 3.16Å; Q364-L368 WeakPolarHBondContact O-CG 3.39Å; Q364-L368 PolarHBondContact O-N 3.03Å
365	T	96.1	Very high	94.3	Very high	48 Å²	48	66.5 Å²	66.5	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-62.6	-40.6	177	-54.6	0	0	0	0	111.1	I361 A362 F363 I367 L368 A369 V393 A397	I361-T365 WeakPolarHBondContact O-CB 3.28Å; I361-T365 PolarHBondContact O-N 3.36Å; I361-T365 PolarHBondContact O-OG1 2.97Å; A362-T365 PolarHBondContact O-N 2.83Å; F363-T365 VanDerWaalsContact C-N 3.3Å; F363-T365 PolarHBondContact O-N 3.14Å; T365-I367 VanDerWaalsContact C-N 3.33Å; T365-I367 PolarHBondContact O-N 2.96Å; T365-L368 PolarHBondContact O-N 2.71Å; T365-A369 VanDerWaalsContact O-CB 3.32Å; T365-A369 WeakPolarHBondContact O-CB 3.35Å; T365-A369 PolarHBondContact O-N 2.84Å; T365-V393 HydrophobicContact CG2-CG1 3.83Å; T365-A397 HydrophobicContact CG2-CB 4.01Å
366	N	93.5	Very high	94	Very high	37 Å²	37	66.4 Å²	66.4	20%	0.198	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-36.9	174.7	175.4	82.4	0	0	0	112.2	A362 F363 Q364 L370 R394 A397	A362-N366 WeakPolarHBondContact O-CB 3.5Å; A362-N366 PolarHBondContact O-N 2.99Å; F363-N366 WeakPolarHBondContact O-CB 3.37Å; F363-N366 PolarHBondContact O-N 3.16Å; F363-N366 VanDerWaalsContact O-N 3.15Å; Q364-N366 VanDerWaalsContact C-N 3.32Å; Q364-N366 PolarHBondContact O-N 2.9Å; N366-L370 PolarHBondContact O-N 3.3Å; N366-R394 WeakPolarHBondContact OD1-CG 3.46Å; N366-A397 HydrophobicContact CB-CB 3.83Å
367	I	94.7	Very high	93.5	Very high	65 Å²	65	67.8 Å²	67.8	33%	0.333	37%	0.373	S	S	.	.	H	α-helix	trans	-69	-42.9	174	-61.5	-57.2	0	0	0	111.6	F363 Q364 T365 A369 L370 N371	F363-I367 HydrophobicContact CD1-CG1 4.44Å; F363-I367 HydrophobicContact CE1-CG1 4.09Å; F363-I367 HydrophobicContact CZ-CD1 4.19Å; F363-I367 HydrophobicContact CZ-CG1 4.26Å; F363-I367 WeakPolarHBondContact O-CG1 3.4Å; F363-I367 PolarHBondContact O-N 2.96Å; Q364-I367 PolarHBondContact O-N 3.39Å; Q364-I367 VanDerWaalsContact O-N 3.16Å; T365-I367 VanDerWaalsContact C-N 3.33Å; T365-I367 PolarHBondContact O-N 2.96Å; I367-A369 VanDerWaalsContact C-N 3.31Å; I367-A369 PolarHBondContact O-N 2.8Å; I367-L370 WeakPolarHBondContact O-CB 3.39Å; I367-L370 PolarHBondContact O-N 2.94Å; I367-N371 PolarHBondContact O-N 3.44Å
368	L	94.7	Very high	93.1	Very high	116 Å²	116	72.3 Å²	72.3	61%	0.607	38%	0.383	S	S	*	.	H	α-helix	trans	-61.6	-41.4	175.2	-72.7	172.7	0	0	0	111.7	Q364 T365 L370 N371 A372	Q364-L368 WeakPolarHBondContact O-CG 3.39Å; Q364-L368 PolarHBondContact O-N 3.03Å; T365-L368 PolarHBondContact O-N 2.71Å; L368-L370 VanDerWaalsContact C-N 3.32Å; L368-L370 PolarHBondContact O-N 2.9Å; L368-N371 PolarHBondContact O-N 3.2Å; L368-A372 WeakPolarHBondContact O-CB 3.23Å; L368-A372 PolarHBondContact O-N 3.21Å
369	A	94.2	Very high	92.7	Very high	4 Å²	4	71.1 Å²	71.1	3%	0.033	39%	0.385	C	S	.	.	H	α-helix	trans	-64	-37.6	175.3	0	0	0	0	0	112	T365 I367 A372 A373 V393 R394	T365-A369 VanDerWaalsContact O-CB 3.32Å; T365-A369 WeakPolarHBondContact O-CB 3.35Å; T365-A369 PolarHBondContact O-N 2.84Å; I367-A369 VanDerWaalsContact C-N 3.31Å; I367-A369 PolarHBondContact O-N 2.8Å; A369-A372 PolarHBondContact O-N 3.15Å; A369-A373 WeakPolarHBondContact O-CB 3.44Å; A369-A373 PolarHBondContact O-N 3.35Å; A369-V393 HydrophobicContact CB-CB 4.1Å; A369-V393 HydrophobicContact CB-CG1 3.88Å; A369-R394 HydrophobicContact CB-CB 3.73Å; A369-R394 HydrophobicContact CB-CG 4.35Å
370	L	90.9	Very high	92.1	Very high	68 Å²	68	71.5 Å²	71.5	36%	0.356	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-46.1	172.8	-176.8	68.4	0	0	0	111.5	N366 I367 L368 A372 A373 V374	N366-L370 PolarHBondContact O-N 3.3Å; I367-L370 WeakPolarHBondContact O-CB 3.39Å; I367-L370 PolarHBondContact O-N 2.94Å; L368-L370 VanDerWaalsContact C-N 3.32Å; L368-L370 PolarHBondContact O-N 2.9Å; L370-A372 VanDerWaalsContact C-N 3.31Å; L370-A372 PolarHBondContact O-N 3.46Å; L370-A373 WeakPolarHBondContact O-CB 3.28Å; L370-A373 PolarHBondContact O-N 3.37Å; L370-V374 WeakPolarHBondContact O-CG2 3.34Å; L370-V374 PolarHBondContact O-N 3.36Å
371	N	91.4	Very high	91.4	Very high	93 Å²	93	74.3 Å²	74.3	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-42.3	176.1	-68.8	-16.6	0	0	0	111.3	I367 L368 A373 V374 E375	I367-N371 PolarHBondContact O-N 3.44Å; L368-N371 PolarHBondContact O-N 3.2Å; N371-A373 PolarHBondContact O-N 2.96Å; N371-V374 PolarHBondContact O-N 2.87Å; N371-E375 PolarHBondContact O-N 2.81Å
372	A	91.8	Very high	90.8	Very high	46 Å²	46	78.3 Å²	78.3	38%	0.38	43%	0.425	S	S	.	.	H	α-helix	trans	-64.2	-38.5	175.6	0	0	0	0	0	112.3	L368 A369 L370 V374 E375 A376 A390	L368-A372 WeakPolarHBondContact O-CB 3.23Å; L368-A372 PolarHBondContact O-N 3.21Å; A369-A372 PolarHBondContact O-N 3.15Å; L370-A372 VanDerWaalsContact C-N 3.31Å; L370-A372 PolarHBondContact O-N 3.46Å; A372-V374 VanDerWaalsContact C-N 3.32Å; A372-V374 PolarHBondContact O-N 2.99Å; A372-E375 PolarHBondContact O-N 2.85Å; A372-A376 VanDerWaalsContact O-CB 3.26Å; A372-A376 WeakPolarHBondContact O-CB 3.26Å; A372-A376 PolarHBondContact O-N 3.48Å; A372-A390 HydrophobicContact CB-CB 3.93Å
373	A	91.1	Very high	90.2	Very high	31 Å²	31	78 Å²	78	26%	0.256	42%	0.423	S	S	.	.	H	α-helix	trans	-64.3	-37.7	175.5	0	0	0	0	0	111.9	A369 L370 N371 A377 A390	A369-A373 WeakPolarHBondContact O-CB 3.44Å; A369-A373 PolarHBondContact O-N 3.35Å; L370-A373 WeakPolarHBondContact O-CB 3.28Å; L370-A373 PolarHBondContact O-N 3.37Å; N371-A373 PolarHBondContact O-N 2.96Å; A373-A377 WeakPolarHBondContact O-CB 3.35Å; A373-A377 PolarHBondContact O-N 2.95Å; A373-A390 HydrophobicContact CB-CB 3.85Å
374	V	90.6	Very high	89.7	Confident	90 Å²	90	77.7 Å²	77.7	55%	0.545	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-45.6	174.3	173.1	0	0	0	0	111	L370 N371 A372 A376 A377 R378	L370-V374 WeakPolarHBondContact O-CG2 3.34Å; L370-V374 PolarHBondContact O-N 3.36Å; N371-V374 PolarHBondContact O-N 2.87Å; A372-V374 VanDerWaalsContact C-N 3.32Å; A372-V374 PolarHBondContact O-N 2.99Å; V374-A376 VanDerWaalsContact C-N 3.35Å; V374-A377 WeakPolarHBondContact O-CB 3.36Å; V374-A377 PolarHBondContact O-N 3.47Å; V374-R378 PolarHBondContact O-N 3.04Å
375	E	89.2	Confident	89.2	Confident	109 Å²	109	74 Å²	74	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-67.5	-37.4	179.1	-162.4	59.9	-147.4	0	0	111.7	N371 A372 A377 R378 A379	N371-E375 PolarHBondContact O-N 2.81Å; A372-E375 PolarHBondContact O-N 2.85Å; E375-A377 PolarHBondContact O-N 3.48Å; E375-R378 WeakPolarHBondContact O-CB 3.34Å; E375-R378 PolarHBondContact O-N 3.45Å; E375-R378 VanDerWaalsContact O-N 3.16Å; E375-R378 IonicContact OE2-NH1 3.9Å; E375-A379 PolarHBondContact O-N 2.87Å
376	A	89.8	Confident	89	Confident	5 Å²	5	79 Å²	79	4%	0.041	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-41.1	172.2	0	0	0	0	0	112.2	A372 V374 R378 A379 G383 F386 A387	A372-A376 VanDerWaalsContact O-CB 3.26Å; A372-A376 WeakPolarHBondContact O-CB 3.26Å; A372-A376 PolarHBondContact O-N 3.48Å; V374-A376 VanDerWaalsContact C-N 3.35Å; A376-R378 VanDerWaalsContact C-N 3.29Å; A376-R378 PolarHBondContact O-N 3.17Å; A376-A379 PolarHBondContact O-N 3.22Å; A376-G383 WeakPolarHBondContact O-CA 3.32Å; A376-F386 HydrophobicContact CB-CB 3.81Å; A376-A387 HydrophobicContact CB-CB 3.74Å; A376-A387 VanDerWaalsContact CB-N 3.33Å
377	A	86.6	Confident	88.9	Confident	76 Å²	76	79.1 Å²	79.1	63%	0.628	44%	0.441	S	S	*	.	H	α-helix	trans	-63.8	-36.1	173.5	0	0	0	0	0	111.9	A373 V374 E375 A379 G380	A373-A377 WeakPolarHBondContact O-CB 3.35Å; A373-A377 PolarHBondContact O-N 2.95Å; V374-A377 WeakPolarHBondContact O-CB 3.36Å; V374-A377 PolarHBondContact O-N 3.47Å; E375-A377 PolarHBondContact O-N 3.48Å; A377-A379 VanDerWaalsContact C-N 3.34Å; A377-A379 PolarHBondContact O-N 3.5Å; A377-G380 PolarHBondContact O-N 3.34Å
378	R	86.7	Confident	88.8	Confident	197 Å²	197	81.1 Å²	81.1	74%	0.743	46%	0.457	S	S	*	.	H	α-helix	trans	-66.3	-32.8	177.5	-162	-178.9	-172.7	-179.8	1.8	113.1	V374 E375 A376 G380	V374-R378 PolarHBondContact O-N 3.04Å; E375-R378 WeakPolarHBondContact O-CB 3.34Å; E375-R378 PolarHBondContact O-N 3.45Å; E375-R378 VanDerWaalsContact O-N 3.16Å; E375-R378 IonicContact OE2-NH1 3.9Å; A376-R378 VanDerWaalsContact C-N 3.29Å; A376-R378 PolarHBondContact O-N 3.17Å; R378-G380 VanDerWaalsContact C-N 3.26Å; R378-G380 PolarHBondContact O-N 3.22Å
379	A	87.7	Confident	88.7	Confident	54 Å²	54	79.7 Å²	79.7	45%	0.446	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-3.3	177.8	0	0	0	0	0	114.5	E375 A376 A377 E381 Q382	E375-A379 PolarHBondContact O-N 2.87Å; A376-A379 PolarHBondContact O-N 3.22Å; A377-A379 VanDerWaalsContact C-N 3.34Å; A377-A379 PolarHBondContact O-N 3.5Å; A379-E381 PolarHBondContact O-N 2.79Å; A379-Q382 PolarHBondContact O-N 2.85Å
380	G	84	Confident	88.7	Confident	43 Å²	43	79.7 Å²	79.7	44%	0.443	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	62.9	-130.7	176.9	0	0	0	0	0	113.2	A377 R378 Q382 G383	A377-G380 PolarHBondContact O-N 3.34Å; R378-G380 VanDerWaalsContact C-N 3.26Å; R378-G380 PolarHBondContact O-N 3.22Å; G380-Q382 VanDerWaalsContact C-N 3.3Å; G380-Q382 PolarHBondContact O-N 2.92Å; G380-G383 PolarHBondContact O-N 3.16Å; G380-G383 VanDerWaalsContact O-N 3.14Å
381	E	83.4	Confident	88.8	Confident	135 Å²	135	78.3 Å²	78.3	63%	0.631	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-58.6	-38.1	-179.2	-83.9	-67.9	148.8	0	0	113	A379 G383 K384	A379-E381 PolarHBondContact O-N 2.79Å; E381-G383 PolarHBondContact O-N 3.34Å; E381-K384 PolarHBondContact O-N 3.19Å; E381-K384 VanDerWaalsContact OE1-CE 3.29Å; E381-K384 WeakPolarHBondContact OE1-CE 3.28Å; E381-K384 IonicContact OE1-NZ 2.62Å; E381-K384 PolarHBondContact OE1-NZ 3.38Å; E381-K384 WeakPolarHBondContact OE2-CE 3.44Å; E381-K384 IonicContact OE2-NZ 2.75Å; E381-K384 PolarHBondContact OE2-NZ 3.48Å
382	Q	81.6	Confident	89.1	Confident	168 Å²	168	79.7 Å²	79.7	79%	0.785	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-70.8	-20.9	-178.9	-57.8	-59.5	-18.1	0	0	112.5	A379 G380	A379-Q382 PolarHBondContact O-N 2.85Å; G380-Q382 VanDerWaalsContact C-N 3.3Å; G380-Q382 PolarHBondContact O-N 2.92Å
383	G	84.1	Confident	89.2	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-86	-9.7	-179.3	0	0	0	0	0	114.8	A376 G380 E381 G385 F386 A387	A376-G383 WeakPolarHBondContact O-CA 3.32Å; G380-G383 PolarHBondContact O-N 3.16Å; G380-G383 VanDerWaalsContact O-N 3.14Å; E381-G383 PolarHBondContact O-N 3.34Å; G383-G385 VanDerWaalsContact C-N 3.3Å; G383-G385 PolarHBondContact O-N 2.88Å; G383-F386 CarbonylContact O-C 3.56Å; G383-F386 WeakPolarHBondContact O-CA 3.2Å; G383-F386 WeakPolarHBondContact O-CB 3.49Å; G383-F386 PolarHBondContact O-N 3.05Å; G383-A387 PolarHBondContact O-N 3.14Å
384	K	84.8	Confident	89.4	Confident	120 Å²	120	84.4 Å²	84.4	52%	0.522	47%	0.465	S	S	.	.	H	α-helix	trans	-53.3	-43.7	-173.9	-80.5	-179.1	177.3	165.4	0	113.6	E381 A387 V388	E381-K384 PolarHBondContact O-N 3.19Å; E381-K384 VanDerWaalsContact OE1-CE 3.29Å; E381-K384 WeakPolarHBondContact OE1-CE 3.28Å; E381-K384 IonicContact OE1-NZ 2.62Å; E381-K384 PolarHBondContact OE1-NZ 3.38Å; E381-K384 WeakPolarHBondContact OE2-CE 3.44Å; E381-K384 IonicContact OE2-NZ 2.75Å; E381-K384 PolarHBondContact OE2-NZ 3.48Å; K384-A387 PolarHBondContact O-N 3.25Å; K384-V388 WeakPolarHBondContact O-CG2 3.47Å; K384-V388 PolarHBondContact O-N 2.99Å; K384-V388 VanDerWaalsContact O-N 3.15Å
385	G	87.4	Confident	89.6	Confident	50 Å²	50	85.1 Å²	85.1	52%	0.515	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-44.7	176.6	0	0	0	0	0	112.5	G383 A387 V388 V389	G383-G385 VanDerWaalsContact C-N 3.3Å; G383-G385 PolarHBondContact O-N 2.88Å; G385-A387 VanDerWaalsContact C-N 3.3Å; G385-A387 PolarHBondContact O-N 3.41Å; G385-V388 PolarHBondContact O-N 2.98Å; G385-V389 WeakPolarHBondContact O-CG2 3.39Å; G385-V389 PolarHBondContact O-N 3.29Å; G385-V389 VanDerWaalsContact O-N 3.09Å
386	F	90.5	Very high	90	Very high	151 Å²	151	84.7 Å²	84.7	66%	0.662	46%	0.463	S	S	*	.	H	α-helix	trans	-63.8	-34.9	175.2	-68.9	-67.9	0	0	0	112.4	A376 G383 V389 A390	A376-F386 HydrophobicContact CB-CB 3.81Å; G383-F386 CarbonylContact O-C 3.56Å; G383-F386 WeakPolarHBondContact O-CA 3.2Å; G383-F386 WeakPolarHBondContact O-CB 3.49Å; G383-F386 PolarHBondContact O-N 3.05Å; F386-V389 PolarHBondContact O-N 3.3Å; F386-A390 VanDerWaalsContact O-CB 3.27Å; F386-A390 WeakPolarHBondContact O-CB 3.26Å; F386-A390 PolarHBondContact O-N 2.91Å
387	A	91.1	Very high	90.3	Very high	40 Å²	40	84.7 Å²	84.7	33%	0.331	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-41	177.1	0	0	0	0	0	111.4	A376 G383 K384 G385 A390 G391	A376-A387 HydrophobicContact CB-CB 3.74Å; A376-A387 VanDerWaalsContact CB-N 3.33Å; G383-A387 PolarHBondContact O-N 3.14Å; K384-A387 PolarHBondContact O-N 3.25Å; G385-A387 VanDerWaalsContact C-N 3.3Å; G385-A387 PolarHBondContact O-N 3.41Å; A387-A390 PolarHBondContact O-N 2.99Å; A387-G391 PolarHBondContact O-N 2.81Å
388	V	92.7	Very high	90.7	Very high	108 Å²	108	83.5 Å²	83.5	66%	0.655	45%	0.45	S	S	*	.	H	α-helix	trans	-63.6	-47.6	174.7	175.5	0	0	0	0	110.7	K384 G385 A390 G391 E392	K384-V388 WeakPolarHBondContact O-CG2 3.47Å; K384-V388 PolarHBondContact O-N 2.99Å; K384-V388 VanDerWaalsContact O-N 3.15Å; G385-V388 PolarHBondContact O-N 2.98Å; V388-A390 VanDerWaalsContact C-N 3.34Å; V388-A390 PolarHBondContact O-N 3.28Å; V388-G391 PolarHBondContact O-N 3.32Å; V388-E392 PolarHBondContact O-N 2.9Å
389	V	93.2	Very high	91.1	Very high	85 Å²	85	81.7 Å²	81.7	52%	0.515	44%	0.444	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.6	175.1	0	0	0	0	111	G385 F386 G391 E392 V393	G385-V389 WeakPolarHBondContact O-CG2 3.39Å; G385-V389 PolarHBondContact O-N 3.29Å; G385-V389 VanDerWaalsContact O-N 3.09Å; F386-V389 PolarHBondContact O-N 3.3Å; V389-G391 VanDerWaalsContact C-N 3.33Å; V389-G391 PolarHBondContact O-N 2.88Å; V389-E392 PolarHBondContact O-N 2.96Å; V389-V393 HydrophobicContact CG1-CG2 4.19Å; V389-V393 VanDerWaalsContact O-CG2 3.3Å; V389-V393 WeakPolarHBondContact O-CG2 3.47Å; V389-V393 PolarHBondContact O-N 3.21Å
390	A	94.2	Very high	91.5	Very high	4 Å²	4	81.6 Å²	81.6	3%	0.033	44%	0.439	C	S	.	.	H	α-helix	trans	-61.6	-41.1	176.6	0	0	0	0	0	111.8	A372 A373 F386 A387 V388 R394	A372-A390 HydrophobicContact CB-CB 3.93Å; A373-A390 HydrophobicContact CB-CB 3.85Å; F386-A390 VanDerWaalsContact O-CB 3.27Å; F386-A390 WeakPolarHBondContact O-CB 3.26Å; F386-A390 PolarHBondContact O-N 2.91Å; A387-A390 PolarHBondContact O-N 2.99Å; V388-A390 VanDerWaalsContact C-N 3.34Å; V388-A390 PolarHBondContact O-N 3.28Å; A390-R394 VanDerWaalsContact O-CB 3.24Å; A390-R394 WeakPolarHBondContact O-CB 3.44Å; A390-R394 PolarHBondContact O-N 3.41Å
391	G	93.8	Very high	92.1	Very high	39 Å²	39	80.3 Å²	80.3	40%	0.402	43%	0.425	S	S	.	.	H	α-helix	trans	-59.4	-43.8	172.3	0	0	0	0	0	112.9	A387 V388 V389 R394 H395	A387-G391 PolarHBondContact O-N 2.81Å; V388-G391 PolarHBondContact O-N 3.32Å; V389-G391 VanDerWaalsContact C-N 3.33Å; V389-G391 PolarHBondContact O-N 2.88Å; G391-R394 WeakPolarHBondContact O-CB 3.45Å; G391-R394 PolarHBondContact O-N 3.24Å; G391-H395 PolarHBondContact O-N 3.01Å
392	E	95.8	Very high	92.7	Very high	122 Å²	122	78.4 Å²	78.4	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-69.3	-44.5	179.5	-169.2	60.9	-157.2	0	0	112.4	V388 V389 R394 H395 L396	V388-E392 PolarHBondContact O-N 2.9Å; V389-E392 PolarHBondContact O-N 2.96Å; E392-R394 VanDerWaalsContact C-N 3.25Å; E392-R394 PolarHBondContact O-N 2.98Å; E392-H395 WeakPolarHBondContact O-CB 3.47Å; E392-H395 PolarHBondContact O-N 3.42Å; E392-H395 VanDerWaalsContact O-N 3.13Å; E392-L396 WeakPolarHBondContact O-CB 3.4Å; E392-L396 PolarHBondContact O-N 3.05Å
393	V	95.8	Very high	93.3	Very high	57 Å²	57	72.8 Å²	72.8	35%	0.345	40%	0.401	S	S	.	.	H	α-helix	trans	-60.6	-40	175	175.3	0	0	0	0	110.2	T365 A369 V389 L396 A397	T365-V393 HydrophobicContact CG2-CG1 3.83Å; A369-V393 HydrophobicContact CB-CB 4.1Å; A369-V393 HydrophobicContact CB-CG1 3.88Å; V389-V393 HydrophobicContact CG1-CG2 4.19Å; V389-V393 VanDerWaalsContact O-CG2 3.3Å; V389-V393 WeakPolarHBondContact O-CG2 3.47Å; V389-V393 PolarHBondContact O-N 3.21Å; V393-L396 PolarHBondContact O-N 3.31Å; V393-A397 VanDerWaalsContact O-CB 3.26Å; V393-A397 WeakPolarHBondContact O-CB 3.36Å; V393-A397 PolarHBondContact O-N 3.42Å
394	R	95.1	Very high	93.9	Very high	119 Å²	119	72.9 Å²	72.9	45%	0.449	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-43.5	175.3	-165.8	-177.8	164.9	-176.5	-6.6	111.4	N366 A369 A390 G391 E392 A397 S398	N366-R394 WeakPolarHBondContact OD1-CG 3.46Å; A369-R394 HydrophobicContact CB-CB 3.73Å; A369-R394 HydrophobicContact CB-CG 4.35Å; A390-R394 VanDerWaalsContact O-CB 3.24Å; A390-R394 WeakPolarHBondContact O-CB 3.44Å; A390-R394 PolarHBondContact O-N 3.41Å; G391-R394 WeakPolarHBondContact O-CB 3.45Å; G391-R394 PolarHBondContact O-N 3.24Å; E392-R394 VanDerWaalsContact C-N 3.25Å; E392-R394 PolarHBondContact O-N 2.98Å; R394-A397 PolarHBondContact O-N 2.85Å; R394-S398 PolarHBondContact O-N 2.94Å
395	H	95	Very high	94.4	Very high	105 Å²	105	69.3 Å²	69.3	49%	0.486	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-44.8	176.5	-173.6	59.8	0	0	0	111.8	G391 E392 S398 R399	G391-H395 PolarHBondContact O-N 3.01Å; E392-H395 WeakPolarHBondContact O-CB 3.47Å; E392-H395 PolarHBondContact O-N 3.42Å; E392-H395 VanDerWaalsContact O-N 3.13Å; H395-S398 PolarHBondContact O-N 3.41Å; H395-R399 PolarHBondContact O-N 2.88Å
396	L	96	Very high	94.8	Very high	101 Å²	101	71 Å²	71	53%	0.529	39%	0.386	S	S	.	.	H	α-helix	trans	-61.9	-44.1	175.8	-175.7	64.6	0	0	0	111.7	E392 V393 S398 R399 S400	E392-L396 WeakPolarHBondContact O-CB 3.4Å; E392-L396 PolarHBondContact O-N 3.05Å; V393-L396 PolarHBondContact O-N 3.31Å; L396-S398 VanDerWaalsContact C-N 3.34Å; L396-S398 PolarHBondContact O-N 3.43Å; L396-R399 PolarHBondContact O-N 3.44Å; L396-S400 PolarHBondContact O-N 3.18Å; L396-S400 PolarHBondContact O-OG 3.48Å
397	A	96.1	Very high	95.1	Very high	4 Å²	4	67.8 Å²	67.8	3%	0.033	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-43	176	0	0	0	0	0	111.7	T365 N366 V393 R394 S400 A401	T365-A397 HydrophobicContact CG2-CB 4.01Å; N366-A397 HydrophobicContact CB-CB 3.83Å; V393-A397 VanDerWaalsContact O-CB 3.26Å; V393-A397 WeakPolarHBondContact O-CB 3.36Å; V393-A397 PolarHBondContact O-N 3.42Å; R394-A397 PolarHBondContact O-N 2.85Å; A397-S400 PolarHBondContact O-N 3.01Å; A397-A401 PolarHBondContact O-N 2.79Å
398	S	95.5	Very high	95.3	Very high	52 Å²	52	70.7 Å²	70.7	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-41.5	173.9	178.9	0	0	0	0	112.3	R394 H395 L396 A401 N402	R394-S398 PolarHBondContact O-N 2.94Å; H395-S398 PolarHBondContact O-N 3.41Å; L396-S398 VanDerWaalsContact C-N 3.34Å; L396-S398 PolarHBondContact O-N 3.43Å; S398-A401 PolarHBondContact O-N 2.81Å; S398-N402 VanDerWaalsContact O-CG 3.32Å; S398-N402 PolarHBondContact O-N 2.78Å
399	R	96.2	Very high	95.5	Very high	159 Å²	159	71.9 Å²	71.9	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-63.8	-42	174.7	-74	-173.6	64.9	-166.2	-2	112.4	H395 L396 N402 A403	H395-R399 PolarHBondContact O-N 2.88Å; L396-R399 PolarHBondContact O-N 3.44Å; R399-N402 PolarHBondContact O-N 3.15Å; R399-A403 WeakPolarHBondContact O-CB 3.4Å; R399-A403 PolarHBondContact O-N 2.98Å
400	S	95.8	Very high	95.6	Very high	51 Å²	51	73.6 Å²	73.6	36%	0.357	38%	0.379	S	S	.	.	H	α-helix	trans	-62.7	-41.6	176	-65.9	0	0	0	0	111.8	L396 A397 A403 A404	L396-S400 PolarHBondContact O-N 3.18Å; L396-S400 PolarHBondContact O-OG 3.48Å; A397-S400 PolarHBondContact O-N 3.01Å; S400-A403 PolarHBondContact O-N 3.14Å; S400-A404 WeakPolarHBondContact O-CB 3.37Å; S400-A404 PolarHBondContact O-N 3.03Å
401	A	95.3	Very high	95.7	Very high	17 Å²	17	74.2 Å²	74.2	14%	0.14	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-41.5	175.2	0	0	0	0	0	112	A362 A397 S398 A404 N405	A362-A401 HydrophobicContact CB-CB 3.93Å; A397-A401 PolarHBondContact O-N 2.79Å; S398-A401 PolarHBondContact O-N 2.81Å; A401-A404 PolarHBondContact O-N 2.98Å; A401-N405 PolarHBondContact O-N 2.8Å; A401-N405 PolarHBondContact O-ND2 3.06Å
402	N	96	Very high	95.8	Very high	95 Å²	95	76.5 Å²	76.5	51%	0.508	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-46.8	176.1	-70.7	-16	0	0	0	111.5	S398 R399 A404 N405 D406	S398-N402 VanDerWaalsContact O-CG 3.32Å; S398-N402 PolarHBondContact O-N 2.78Å; R399-N402 PolarHBondContact O-N 3.15Å; N402-A404 PolarHBondContact O-N 3.05Å; N402-N405 PolarHBondContact O-N 3.04Å; N402-D406 PolarHBondContact O-N 2.75Å
403	A	95.7	Very high	95.8	Very high	49 Å²	49	73 Å²	73	41%	0.405	38%	0.377	S	S	.	.	H	α-helix	trans	-61.6	-42.5	177.1	0	0	0	0	0	112	R399 S400 N405 D406 I407	R399-A403 WeakPolarHBondContact O-CB 3.4Å; R399-A403 PolarHBondContact O-N 2.98Å; S400-A403 PolarHBondContact O-N 3.14Å; A403-N405 VanDerWaalsContact C-N 3.33Å; A403-N405 PolarHBondContact O-N 3.32Å; A403-D406 PolarHBondContact O-N 2.83Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.25Å; A403-I407 PolarHBondContact O-N 2.89Å
404	A	95.7	Very high	95.7	Very high	3 Å²	3	73 Å²	73	3%	0.025	38%	0.379	C	S	.	.	H	α-helix	trans	-61	-41.5	174.8	0	0	0	0	0	111.6	T355 I358 N359 S400 A401 N402 I407 R408	T355-A404 HydrophobicContact CG2-CB 4.24Å; T355-A404 WeakPolarHBondContact CG2-O 3.39Å; I358-A404 HydrophobicContact CB-CB 4.47Å; I358-A404 HydrophobicContact CG2-CB 3.99Å; N359-A404 HydrophobicContact CB-CB 4Å; S400-A404 WeakPolarHBondContact O-CB 3.37Å; S400-A404 PolarHBondContact O-N 3.03Å; A401-A404 PolarHBondContact O-N 2.98Å; N402-A404 PolarHBondContact O-N 3.05Å; A404-I407 PolarHBondContact O-N 2.99Å; A404-R408 WeakPolarHBondContact O-CB 3.36Å; A404-R408 PolarHBondContact O-N 3.14Å
405	N	95.4	Very high	95.7	Very high	45 Å²	45	69.3 Å²	69.3	24%	0.241	37%	0.374	C	S	.	.	H	α-helix	trans	-66.5	-36.3	175.9	-79.8	-58.8	0	0	0	113.2	N359 A401 N402 A403 R408 K409	N359-N405 PolarHBondContact OD1-ND2 3.42Å; N359-N405 VanDerWaalsContact OD1-ND2 3.13Å; A401-N405 PolarHBondContact O-N 2.8Å; A401-N405 PolarHBondContact O-ND2 3.06Å; N402-N405 PolarHBondContact O-N 3.04Å; A403-N405 VanDerWaalsContact C-N 3.33Å; A403-N405 PolarHBondContact O-N 3.32Å; N405-R408 PolarHBondContact O-N 3.47Å; N405-R408 PolarHBondContact OD1-NH2 3.38Å; N405-K409 WeakPolarHBondContact O-CG 3.32Å; N405-K409 PolarHBondContact O-N 3.4Å
406	D	96.5	Very high	95.7	Very high	85 Å²	85	70 Å²	70	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-70.7	-38.7	175.7	-71.9	-22.5	0	0	0	112.1	N402 A403 R408 K409 L410	N402-D406 PolarHBondContact O-N 2.75Å; A403-D406 PolarHBondContact O-N 2.83Å; D406-R408 VanDerWaalsContact C-N 3.3Å; D406-R408 PolarHBondContact O-N 3.33Å; D406-K409 PolarHBondContact O-N 3.45Å; D406-K409 IonicContact OD1-NZ 3.54Å; D406-K409 PolarHBondContact OD1-NZ 3.36Å; D406-L410 PolarHBondContact O-N 3.02Å; D406-L410 VanDerWaalsContact O-N 3.14Å
407	I	96.5	Very high	95.7	Very high	83 Å²	83	72.9 Å²	72.9	43%	0.426	39%	0.39	S	S	.	.	H	α-helix	trans	-61.3	-41.8	170.9	-66	163.1	0	0	0	110.2	T355 A403 A404 K409 L410 I411	T355-I407 HydrophobicContact CG2-CB 4.01Å; T355-I407 HydrophobicContact CG2-CG2 3.9Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.25Å; A403-I407 PolarHBondContact O-N 2.89Å; A404-I407 PolarHBondContact O-N 2.99Å; I407-K409 PolarHBondContact O-N 3.25Å; I407-L410 WeakPolarHBondContact O-CB 3.46Å; I407-L410 PolarHBondContact O-N 2.89Å; I407-L410 VanDerWaalsContact O-N 3.12Å; I407-I411 HydrophobicContact CG2-CD1 3.54Å; I407-I411 HydrophobicContact CG2-CG1 4.19Å; I407-I411 WeakPolarHBondContact O-CD1 3.41Å; I407-I411 VanDerWaalsContact O-CG1 3.27Å; I407-I411 WeakPolarHBondContact O-CG1 3.4Å; I407-I411 PolarHBondContact O-N 3.47Å
408	R	95.5	Very high	95.6	Very high	101 Å²	101	73.5 Å²	73.5	38%	0.381	39%	0.393	S	S	.	.	H	α-helix	trans	-58.5	-46.2	176.1	-178.5	158.3	61.3	138.9	-3.2	112.2	T355 A404 N405 D406 L410 I411 D412	T355-R408 HydrophobicContact CG2-CB 4.06Å; A404-R408 WeakPolarHBondContact O-CB 3.36Å; A404-R408 PolarHBondContact O-N 3.14Å; N405-R408 PolarHBondContact O-N 3.47Å; N405-R408 PolarHBondContact OD1-NH2 3.38Å; D406-R408 VanDerWaalsContact C-N 3.3Å; D406-R408 PolarHBondContact O-N 3.33Å; R408-L410 VanDerWaalsContact C-N 3.28Å; R408-L410 PolarHBondContact O-N 2.74Å; R408-I411 WeakPolarHBondContact O-CB 3.26Å; R408-I411 PolarHBondContact O-N 3.12Å; R408-I411 VanDerWaalsContact O-N 3.14Å; R408-D412 VanDerWaalsContact O-CG 3.26Å; R408-D412 PolarHBondContact O-N 2.95Å
409	K	96.1	Very high	95.5	Very high	134 Å²	134	76.3 Å²	76.3	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-58.1	-39.7	174.8	-68.4	170.8	-167	155	0	112.5	N405 D406 I407 A413	N405-K409 WeakPolarHBondContact O-CG 3.32Å; N405-K409 PolarHBondContact O-N 3.4Å; D406-K409 PolarHBondContact O-N 3.45Å; D406-K409 IonicContact OD1-NZ 3.54Å; D406-K409 PolarHBondContact OD1-NZ 3.36Å; I407-K409 PolarHBondContact O-N 3.25Å; K409-A413 WeakPolarHBondContact O-CB 3.29Å; K409-A413 PolarHBondContact O-N 2.88Å
410	L	95.6	Very high	95.5	Very high	121 Å²	121	71.1 Å²	71.1	63%	0.634	39%	0.389	S	S	*	.	H	α-helix	trans	-69.1	-36.2	177.2	-69.1	173.3	0	0	0	112.4	D406 I407 R408 S414	D406-L410 PolarHBondContact O-N 3.02Å; D406-L410 VanDerWaalsContact O-N 3.14Å; I407-L410 WeakPolarHBondContact O-CB 3.46Å; I407-L410 PolarHBondContact O-N 2.89Å; I407-L410 VanDerWaalsContact O-N 3.12Å; R408-L410 VanDerWaalsContact C-N 3.28Å; R408-L410 PolarHBondContact O-N 2.74Å; L410-S414 WeakPolarHBondContact O-CB 3.49Å; L410-S414 PolarHBondContact O-N 2.97Å; L410-S414 PolarHBondContact O-OG 2.86Å
411	I	96.2	Very high	95.5	Very high	16 Å²	16	69.6 Å²	69.6	8%	0.082	38%	0.381	C	S	.	.	H	α-helix	trans	-66.1	-46.2	174.5	-68.1	159.5	0	0	0	110.4	T348 I351 T355 I407 R408 A413 S414 A415	T348-I411 HydrophobicContact CG2-CG2 3.67Å; T348-I411 WeakPolarHBondContact CG2-O 3.41Å; T348-I411 WeakPolarHBondContact O-CG2 3.43Å; I351-I411 HydrophobicContact CB-CD1 4.24Å; I351-I411 HydrophobicContact CG2-CD1 3.41Å; I351-I411 VanDerWaalsContact CG2-CD1 3.41Å; I351-I411 HydrophobicContact CG2-CG1 3.89Å; T355-I411 HydrophobicContact CG2-CD1 4.31Å; T355-I411 WeakPolarHBondContact OG1-CD1 3.38Å; I407-I411 HydrophobicContact CG2-CD1 3.54Å; I407-I411 HydrophobicContact CG2-CG1 4.19Å; I407-I411 WeakPolarHBondContact O-CD1 3.41Å; I407-I411 VanDerWaalsContact O-CG1 3.27Å; I407-I411 WeakPolarHBondContact O-CG1 3.4Å; I407-I411 PolarHBondContact O-N 3.47Å; R408-I411 WeakPolarHBondContact O-CB 3.26Å; R408-I411 PolarHBondContact O-N 3.12Å; R408-I411 VanDerWaalsContact O-N 3.14Å; I411-A413 VanDerWaalsContact C-N 3.32Å; I411-A413 PolarHBondContact O-N 2.85Å; I411-S414 CarbonylContact O-C 3.5Å; I411-S414 WeakPolarHBondContact O-CA 2.97Å; I411-S414 WeakPolarHBondContact O-CB 3.39Å; I411-S414 PolarHBondContact O-N 3.3Å; I411-A415 PolarHBondContact O-N 3.35Å
412	D	95.2	Very high	95.4	Very high	88 Å²	88	69.4 Å²	69.4	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-59.3	-45.7	177	-65.3	-21.9	0	0	0	110.4	R408 S414 A415 D416	R408-D412 VanDerWaalsContact O-CG 3.26Å; R408-D412 PolarHBondContact O-N 2.95Å; D412-S414 VanDerWaalsContact C-N 3.27Å; D412-S414 PolarHBondContact O-N 3.01Å; D412-A415 WeakPolarHBondContact O-CB 3.43Å; D412-A415 PolarHBondContact O-N 2.83Å; D412-D416 PolarHBondContact O-N 2.83Å
413	A	96.1	Very high	95.3	Very high	49 Å²	49	70.5 Å²	70.5	41%	0.405	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-34.4	174.1	0	0	0	0	0	112.7	K409 I411 K417	K409-A413 WeakPolarHBondContact O-CB 3.29Å; K409-A413 PolarHBondContact O-N 2.88Å; I411-A413 VanDerWaalsContact C-N 3.32Å; I411-A413 PolarHBondContact O-N 2.85Å; A413-K417 WeakPolarHBondContact O-CG 3.41Å; A413-K417 PolarHBondContact O-N 3.26Å; A413-K417 VanDerWaalsContact O-N 3.13Å
414	S	94.5	Very high	95.3	Very high	56 Å²	56	74.5 Å²	74.5	39%	0.392	39%	0.391	S	S	.	.	H	α-helix	trans	-71.3	-40.1	177.1	-59	0	0	0	0	111.1	L410 I411 D412 D416 K417 V418	L410-S414 WeakPolarHBondContact O-CB 3.49Å; L410-S414 PolarHBondContact O-N 2.97Å; L410-S414 PolarHBondContact O-OG 2.86Å; I411-S414 CarbonylContact O-C 3.5Å; I411-S414 WeakPolarHBondContact O-CA 2.97Å; I411-S414 WeakPolarHBondContact O-CB 3.39Å; I411-S414 PolarHBondContact O-N 3.3Å; D412-S414 VanDerWaalsContact C-N 3.27Å; D412-S414 PolarHBondContact O-N 3.01Å; S414-D416 VanDerWaalsContact C-N 3.33Å; S414-D416 PolarHBondContact O-N 3.49Å; S414-K417 PolarHBondContact O-N 3.36Å; S414-K417 VanDerWaalsContact O-N 3.15Å; S414-V418 VanDerWaalsContact O-CG2 3.25Å; S414-V418 WeakPolarHBondContact O-CG2 3.39Å; S414-V418 PolarHBondContact O-N 3.49Å
415	A	94.9	Very high	95.3	Very high	41 Å²	41	75.3 Å²	75.3	34%	0.339	40%	0.395	S	S	.	.	H	α-helix	trans	-59.5	-44.9	174.5	0	0	0	0	0	110.9	T348 I411 D412 K417 V418 Q419	T348-A415 HydrophobicContact CG2-CB 3.81Å; I411-A415 PolarHBondContact O-N 3.35Å; D412-A415 WeakPolarHBondContact O-CB 3.43Å; D412-A415 PolarHBondContact O-N 2.83Å; A415-K417 VanDerWaalsContact C-N 3.31Å; A415-K417 PolarHBondContact O-N 3.25Å; A415-V418 PolarHBondContact O-N 3.34Å; A415-Q419 WeakPolarHBondContact O-CB 3.36Å; A415-Q419 PolarHBondContact O-N 2.85Å
416	D	95.4	Very high	95.2	Very high	121 Å²	121	76.8 Å²	76.8	65%	0.647	40%	0.401	S	S	*	.	H	α-helix	trans	-59.7	-40.6	174.7	-77.2	-14.3	0	0	0	112.2	D412 S414 S420	D412-D416 PolarHBondContact O-N 2.83Å; S414-D416 VanDerWaalsContact C-N 3.33Å; S414-D416 PolarHBondContact O-N 3.49Å; D416-S420 WeakPolarHBondContact O-CB 3.26Å; D416-S420 PolarHBondContact O-N 2.83Å
417	K	94.6	Very high	95.1	Very high	161 Å²	161	74.9 Å²	74.9	70%	0.7	40%	0.397	S	S	*	.	H	α-helix	trans	-68	-40.1	177.2	-70.8	-62.7	-178.6	-171.5	0	112.8	A413 S414 A415 S420 G421	A413-K417 WeakPolarHBondContact O-CG 3.41Å; A413-K417 PolarHBondContact O-N 3.26Å; A413-K417 VanDerWaalsContact O-N 3.13Å; S414-K417 PolarHBondContact O-N 3.36Å; S414-K417 VanDerWaalsContact O-N 3.15Å; A415-K417 VanDerWaalsContact C-N 3.31Å; A415-K417 PolarHBondContact O-N 3.25Å; K417-S420 PolarHBondContact O-N 2.93Å; K417-G421 PolarHBondContact O-N 2.93Å
418	V	96	Very high	95.1	Very high	17 Å²	17	72.5 Å²	72.5	10%	0.103	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-43.4	176.8	174.3	0	0	0	0	110.4	M341 I344 A345 S414 A415 S420 G421 S422	M341-V418 HydrophobicContact CB-CG1 4.46Å; M341-V418 VanDerWaalsContact O-CG1 3.3Å; M341-V418 WeakPolarHBondContact O-CG1 3.27Å; M341-V418 HydrophobicContact SD-CG1 4.42Å; I344-V418 HydrophobicContact CB-CG1 4.34Å; I344-V418 HydrophobicContact CB-CG2 4.29Å; I344-V418 HydrophobicContact CG2-CG1 4.33Å; I344-V418 HydrophobicContact CG2-CG2 3.42Å; I344-V418 VanDerWaalsContact CG2-CG2 3.42Å; A345-V418 HydrophobicContact CB-CG1 3.85Å; S414-V418 VanDerWaalsContact O-CG2 3.25Å; S414-V418 WeakPolarHBondContact O-CG2 3.39Å; S414-V418 PolarHBondContact O-N 3.49Å; A415-V418 PolarHBondContact O-N 3.34Å; V418-S420 PolarHBondContact O-N 2.9Å; V418-G421 PolarHBondContact O-N 3.31Å; V418-S422 WeakPolarHBondContact O-CB 3.43Å; V418-S422 PolarHBondContact O-N 2.77Å
419	Q	93.3	Very high	95.1	Very high	110 Å²	110	68.3 Å²	68.3	51%	0.514	38%	0.377	S	S	.	.	H	α-helix	trans	-61.5	-44.3	176.1	-178.1	62.1	7.1	0	0	111.7	A415 S422 Q423	A415-Q419 WeakPolarHBondContact O-CB 3.36Å; A415-Q419 PolarHBondContact O-N 2.85Å; Q419-S422 PolarHBondContact O-N 3.46Å; Q419-Q423 WeakPolarHBondContact O-CG 3.47Å; Q419-Q423 PolarHBondContact O-N 3.49Å
420	S	95.1	Very high	95	Very high	51 Å²	51	69.4 Å²	69.4	36%	0.357	38%	0.378	S	S	.	.	H	α-helix	trans	-63	-42.5	174.9	-172.4	0	0	0	0	112	D416 K417 V418 Q423 Q424	D416-S420 WeakPolarHBondContact O-CB 3.26Å; D416-S420 PolarHBondContact O-N 2.83Å; K417-S420 PolarHBondContact O-N 2.93Å; V418-S420 PolarHBondContact O-N 2.9Å; S420-Q423 PolarHBondContact O-N 3.03Å; S420-Q424 WeakPolarHBondContact O-CG 3.27Å; S420-Q424 PolarHBondContact O-N 3.31Å
421	G	95.2	Very high	95.1	Very high	19 Å²	19	67.2 Å²	67.2	20%	0.196	37%	0.37	C	S	.	.	H	α-helix	trans	-60.4	-46.5	175.1	0	0	0	0	0	112.3	K417 V418 Q423 Q424 V425	K417-G421 PolarHBondContact O-N 2.93Å; V418-G421 PolarHBondContact O-N 3.31Å; G421-Q423 PolarHBondContact O-N 3.45Å; G421-Q424 PolarHBondContact O-N 3.3Å; G421-V425 VanDerWaalsContact O-CG2 3.24Å; G421-V425 WeakPolarHBondContact O-CG2 3.19Å; G421-V425 PolarHBondContact O-N 3.09Å
422	S	94.8	Very high	95.1	Very high	12 Å²	12	69.2 Å²	69.2	8%	0.084	38%	0.379	C	S	.	.	H	α-helix	trans	-56.9	-47.2	175.5	178.3	0	0	0	0	111.6	V418 Q419 Q424 V425 H426	V418-S422 WeakPolarHBondContact O-CB 3.43Å; V418-S422 PolarHBondContact O-N 2.77Å; Q419-S422 PolarHBondContact O-N 3.46Å; S422-Q424 VanDerWaalsContact C-N 3.34Å; S422-Q424 PolarHBondContact O-N 3.05Å; S422-V425 PolarHBondContact O-N 3Å; S422-H426 PolarHBondContact O-CD2 2.87Å; S422-H426 PolarHBondContact O-N 2.94Å
423	Q	93.9	Very high	95.1	Very high	119 Å²	119	71.6 Å²	71.6	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-59.6	-42	176.3	-72.1	176.9	-6.9	0	0	112.9	Q419 S420 G421 H426 A427	Q419-Q423 WeakPolarHBondContact O-CG 3.47Å; Q419-Q423 PolarHBondContact O-N 3.49Å; S420-Q423 PolarHBondContact O-N 3.03Å; G421-Q423 PolarHBondContact O-N 3.45Å; Q423-H426 PolarHBondContact O-N 3.18Å; Q423-A427 PolarHBondContact O-N 3.39Å
424	Q	94	Very high	95.2	Very high	132 Å²	132	74.3 Å²	74.3	62%	0.617	40%	0.396	S	S	*	.	H	α-helix	trans	-65.5	-40.7	178	-71.8	177.4	15.7	0	0	112.1	S420 G421 S422 A427 A428	S420-Q424 WeakPolarHBondContact O-CG 3.27Å; S420-Q424 PolarHBondContact O-N 3.31Å; G421-Q424 PolarHBondContact O-N 3.3Å; S422-Q424 VanDerWaalsContact C-N 3.34Å; S422-Q424 PolarHBondContact O-N 3.05Å; Q424-A427 WeakPolarHBondContact O-CB 3.42Å; Q424-A427 PolarHBondContact O-N 2.8Å; Q424-A428 PolarHBondContact O-N 3.29Å
425	V	95.6	Very high	95.3	Very high	20 Å²	20	75 Å²	75	12%	0.121	39%	0.394	C	S	.	.	H	α-helix	trans	-70.1	-37.8	179	-179.6	0	0	0	0	110.8	M334 V337 I338 G421 S422 A427 A428 G429	M334-V425 HydrophobicContact CB-CG1 4.1Å; M334-V425 WeakPolarHBondContact O-CG1 3.32Å; M334-V425 HydrophobicContact SD-CG1 3.97Å; V337-V425 HydrophobicContact CB-CG1 3.8Å; V337-V425 HydrophobicContact CB-CG2 4.44Å; V337-V425 HydrophobicContact CG1-CB 4.29Å; V337-V425 HydrophobicContact CG1-CG1 3.8Å; V337-V425 HydrophobicContact CG1-CG2 3.53Å; I338-V425 HydrophobicContact CD1-CG1 4.35Å; I338-V425 HydrophobicContact CG1-CB 4.27Å; I338-V425 HydrophobicContact CG1-CG1 3.64Å; G421-V425 VanDerWaalsContact O-CG2 3.24Å; G421-V425 WeakPolarHBondContact O-CG2 3.19Å; G421-V425 PolarHBondContact O-N 3.09Å; S422-V425 PolarHBondContact O-N 3Å; V425-A427 VanDerWaalsContact C-N 3.33Å; V425-A427 PolarHBondContact O-N 2.78Å; V425-A428 PolarHBondContact O-N 2.76Å; V425-G429 PolarHBondContact O-N 3.31Å
426	H	94.3	Very high	95.4	Very high	76 Å²	76	75 Å²	75	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-42.2	170.6	-83.7	-64.8	0	0	0	112.2	I338 S422 Q423 G429 R430	I338-H426 WeakPolarHBondContact CD1-ND1 3.5Å; S422-H426 PolarHBondContact O-CD2 2.87Å; S422-H426 PolarHBondContact O-N 2.94Å; Q423-H426 PolarHBondContact O-N 3.18Å; H426-G429 PolarHBondContact O-N 3.02Å; H426-R430 WeakPolarHBondContact O-CG 3.46Å; H426-R430 PolarHBondContact O-N 3.12Å
427	A	95	Very high	95.5	Very high	45 Å²	45	71.7 Å²	71.7	37%	0.372	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-41.3	175.5	0	0	0	0	0	112	Q423 Q424 V425 R430 T431	Q423-A427 PolarHBondContact O-N 3.39Å; Q424-A427 WeakPolarHBondContact O-CB 3.42Å; Q424-A427 PolarHBondContact O-N 2.8Å; V425-A427 VanDerWaalsContact C-N 3.33Å; V425-A427 PolarHBondContact O-N 2.78Å; A427-R430 PolarHBondContact O-N 3.43Å; A427-T431 PolarHBondContact O-N 3.35Å; A427-T431 PolarHBondContact O-OG1 3.47Å
428	A	95.2	Very high	95.6	Very high	34 Å²	34	69.7 Å²	69.7	28%	0.281	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-41	174.4	0	0	0	0	0	112.1	M334 Q424 V425 T431 M432	M334-A428 HydrophobicContact CG-CB 4.2Å; M334-A428 HydrophobicContact SD-CB 3.68Å; Q424-A428 PolarHBondContact O-N 3.29Å; V425-A428 PolarHBondContact O-N 2.76Å; A428-T431 WeakPolarHBondContact O-CB 3.49Å; A428-T431 PolarHBondContact O-N 3.31Å; A428-M432 PolarHBondContact O-N 3.32Å
429	G	95.7	Very high	95.7	Very high	12 Å²	12	69.9 Å²	69.9	12%	0.124	37%	0.373	C	S	.	.	H	α-helix	trans	-59.2	-48.9	174.7	0	0	0	0	0	112.6	V425 H426 T431 M432 E433	V425-G429 PolarHBondContact O-N 3.31Å; H426-G429 PolarHBondContact O-N 3.02Å; G429-T431 VanDerWaalsContact C-N 3.28Å; G429-T431 PolarHBondContact O-N 3.08Å; G429-M432 WeakPolarHBondContact O-CB 3.38Å; G429-M432 PolarHBondContact O-N 3Å; G429-M432 VanDerWaalsContact O-N 3.09Å; G429-E433 PolarHBondContact O-N 2.97Å; G429-E433 VanDerWaalsContact O-N 3.1Å
430	R	95.5	Very high	95.7	Very high	157 Å²	157	72.1 Å²	72.1	59%	0.592	38%	0.381	S	S	*	.	H	α-helix	trans	-59.8	-38.9	174.5	-67.5	178.7	-157.5	144	5.5	112.2	H426 A427 M432 E433 D434	H426-R430 WeakPolarHBondContact O-CG 3.46Å; H426-R430 PolarHBondContact O-N 3.12Å; A427-R430 PolarHBondContact O-N 3.43Å; R430-M432 VanDerWaalsContact C-N 3.27Å; R430-M432 PolarHBondContact O-N 2.98Å; R430-E433 WeakPolarHBondContact O-CB 3.39Å; R430-E433 PolarHBondContact O-N 3.26Å; R430-D434 PolarHBondContact O-N 2.85Å
431	T	96.3	Very high	95.8	Very high	76 Å²	76	73.3 Å²	73.3	47%	0.466	38%	0.384	S	S	.	.	H	α-helix	trans	-61.9	-37	176.7	-54.2	0	0	0	0	111.3	A427 A428 G429 D434 I435	A427-T431 PolarHBondContact O-N 3.35Å; A427-T431 PolarHBondContact O-OG1 3.47Å; A428-T431 WeakPolarHBondContact O-CB 3.49Å; A428-T431 PolarHBondContact O-N 3.31Å; G429-T431 VanDerWaalsContact C-N 3.28Å; G429-T431 PolarHBondContact O-N 3.08Å; T431-D434 PolarHBondContact O-N 3.31Å; T431-I435 HydrophobicContact CG2-CD1 4.35Å; T431-I435 VanDerWaalsContact O-CG1 3.26Å; T431-I435 WeakPolarHBondContact O-CG1 3.41Å; T431-I435 PolarHBondContact O-N 2.98Å
432	M	96.5	Very high	95.9	Very high	57 Å²	57	75.6 Å²	75.6	28%	0.281	39%	0.394	S	S	.	.	H	α-helix	trans	-68	-40.6	174.7	-67.6	-64	168.6	0	0	112.2	A327 A428 G429 R430 D434 I435 V436	A327-M432 HydrophobicContact CB-SD 4.49Å; A428-M432 PolarHBondContact O-N 3.32Å; G429-M432 WeakPolarHBondContact O-CB 3.38Å; G429-M432 PolarHBondContact O-N 3Å; G429-M432 VanDerWaalsContact O-N 3.09Å; R430-M432 VanDerWaalsContact C-N 3.27Å; R430-M432 PolarHBondContact O-N 2.98Å; M432-D434 VanDerWaalsContact C-N 3.34Å; M432-D434 PolarHBondContact O-N 3.32Å; M432-I435 PolarHBondContact O-N 3.49Å; M432-I435 HydrophobicContact SD-CD1 4.1Å; M432-V436 WeakPolarHBondContact O-CG2 3.43Å; M432-V436 PolarHBondContact O-N 3.34Å
433	E	96.2	Very high	96	Very high	139 Å²	139	77.1 Å²	77.1	65%	0.65	40%	0.402	S	S	*	.	H	α-helix	trans	-60.2	-43.4	173.7	-68.5	174.6	178.8	0	0	111.6	G429 R430 I435 V436 A437	G429-E433 PolarHBondContact O-N 2.97Å; G429-E433 VanDerWaalsContact O-N 3.1Å; R430-E433 WeakPolarHBondContact O-CB 3.39Å; R430-E433 PolarHBondContact O-N 3.26Å; E433-I435 VanDerWaalsContact C-N 3.35Å; E433-I435 PolarHBondContact O-N 2.86Å; E433-V436 PolarHBondContact O-N 2.72Å; E433-A437 PolarHBondContact O-N 2.93Å
434	D	97.1	Very high	96.1	Very high	106 Å²	106	77 Å²	77	57%	0.567	40%	0.402	S	S	*	.	H	α-helix	trans	-62	-41.6	175.6	-73.4	-23	0	0	0	111.6	R430 T431 M432 V436 A437 Q438	R430-D434 PolarHBondContact O-N 2.85Å; T431-D434 PolarHBondContact O-N 3.31Å; M432-D434 VanDerWaalsContact C-N 3.34Å; M432-D434 PolarHBondContact O-N 3.32Å; D434-V436 PolarHBondContact O-N 2.9Å; D434-A437 PolarHBondContact O-N 3.29Å; D434-Q438 WeakPolarHBondContact O-CG 3.4Å; D434-Q438 PolarHBondContact O-N 3.25Å
435	I	96.9	Very high	96.2	Very high	71 Å²	71	75.5 Å²	75.5	36%	0.364	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-46.3	175	-70.3	164.6	0	0	0	110.5	A327 T431 M432 E433 A437 Q438 V439	A327-I435 HydrophobicContact CB-CB 4.18Å; A327-I435 HydrophobicContact CB-CG2 3.61Å; T431-I435 HydrophobicContact CG2-CD1 4.35Å; T431-I435 VanDerWaalsContact O-CG1 3.26Å; T431-I435 WeakPolarHBondContact O-CG1 3.41Å; T431-I435 PolarHBondContact O-N 2.98Å; M432-I435 PolarHBondContact O-N 3.49Å; M432-I435 HydrophobicContact SD-CD1 4.1Å; E433-I435 VanDerWaalsContact C-N 3.35Å; E433-I435 PolarHBondContact O-N 2.86Å; I435-A437 VanDerWaalsContact C-N 3.31Å; I435-A437 PolarHBondContact O-N 2.66Å; I435-Q438 PolarHBondContact O-N 2.76Å; I435-V439 HydrophobicContact CG2-CG2 4.24Å; I435-V439 VanDerWaalsContact O-CG2 3.3Å; I435-V439 WeakPolarHBondContact O-CG2 3.49Å; I435-V439 PolarHBondContact O-N 3.13Å
436	V	96.9	Very high	96.3	Very high	41 Å²	41	75.2 Å²	75.2	25%	0.248	40%	0.395	C	S	.	.	H	α-helix	trans	-59.6	-43.9	177.7	172.7	0	0	0	0	111	A327 V328 M432 E433 D434 Q438 V439 K440	A327-V436 HydrophobicContact CB-CG2 3.65Å; V328-V436 HydrophobicContact CG2-CG1 4.47Å; V328-V436 HydrophobicContact CG2-CG2 3.78Å; M432-V436 WeakPolarHBondContact O-CG2 3.43Å; M432-V436 PolarHBondContact O-N 3.34Å; E433-V436 PolarHBondContact O-N 2.72Å; D434-V436 PolarHBondContact O-N 2.9Å; V436-Q438 PolarHBondContact O-N 3.43Å; V436-V439 PolarHBondContact O-N 3.03Å; V436-K440 PolarHBondContact O-N 3.25Å
437	A	96.8	Very high	96.4	Very high	50 Å²	50	74.4 Å²	74.4	41%	0.413	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-42	176.9	0	0	0	0	0	112.2	E433 D434 I435 K440 N441	E433-A437 PolarHBondContact O-N 2.93Å; D434-A437 PolarHBondContact O-N 3.29Å; I435-A437 VanDerWaalsContact C-N 3.31Å; I435-A437 PolarHBondContact O-N 2.66Å; A437-K440 WeakPolarHBondContact O-CB 3.42Å; A437-K440 PolarHBondContact O-N 3.16Å; A437-N441 PolarHBondContact O-N 3.46Å; A437-N441 PolarHBondContact O-ND2 2.93Å
438	Q	97.2	Very high	96.5	Very high	120 Å²	120	77.6 Å²	77.6	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-69.2	-39.8	177.8	-68.1	-59.1	-7.8	0	0	112.9	D434 I435 V436 K440 N441 V442	D434-Q438 WeakPolarHBondContact O-CG 3.4Å; D434-Q438 PolarHBondContact O-N 3.25Å; I435-Q438 PolarHBondContact O-N 2.76Å; V436-Q438 PolarHBondContact O-N 3.43Å; Q438-K440 PolarHBondContact O-N 3.22Å; Q438-N441 WeakPolarHBondContact O-CB 3.23Å; Q438-N441 PolarHBondContact O-N 3.47Å; Q438-N441 VanDerWaalsContact O-N 3.11Å; Q438-N441 PolarHBondContact OE1-ND2 2.76Å; Q438-V442 WeakPolarHBondContact O-CG2 3.35Å; Q438-V442 PolarHBondContact O-N 2.92Å
439	V	97.6	Very high	96.6	Very high	20 Å²	20	80.2 Å²	80.2	12%	0.121	42%	0.417	C	S	.	.	H	α-helix	trans	-61.7	-37.4	175.3	173.5	0	0	0	0	110.8	S320 A323 I435 V436 N441 V442 T443	S320-V439 WeakPolarHBondContact O-CG1 3.36Å; A323-V439 HydrophobicContact CB-CG2 4.36Å; I435-V439 HydrophobicContact CG2-CG2 4.24Å; I435-V439 VanDerWaalsContact O-CG2 3.3Å; I435-V439 WeakPolarHBondContact O-CG2 3.49Å; I435-V439 PolarHBondContact O-N 3.13Å; V436-V439 PolarHBondContact O-N 3.03Å; V439-N441 VanDerWaalsContact C-N 3.33Å; V439-N441 PolarHBondContact O-N 2.93Å; V439-V442 WeakPolarHBondContact O-CB 3.38Å; V439-V442 PolarHBondContact O-N 3.48Å; V439-V442 VanDerWaalsContact O-N 3.15Å; V439-T443 PolarHBondContact O-N 3.44Å; V439-T443 PolarHBondContact O-OG1 3.35Å
440	K	95	Very high	96.6	Very high	157 Å²	157	81.8 Å²	81.8	68%	0.683	43%	0.426	S	S	*	.	H	α-helix	trans	-60	-41	173.6	-171.8	179.9	178.8	-178.8	0	112.5	V436 A437 Q438 V442 T443 Q444	V436-K440 PolarHBondContact O-N 3.25Å; A437-K440 WeakPolarHBondContact O-CB 3.42Å; A437-K440 PolarHBondContact O-N 3.16Å; Q438-K440 PolarHBondContact O-N 3.22Å; K440-V442 VanDerWaalsContact C-N 3.35Å; K440-T443 PolarHBondContact O-N 3.22Å; K440-Q444 PolarHBondContact O-N 3.04Å
441	N	96.6	Very high	96.7	Very high	77 Å²	77	79.8 Å²	79.8	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-63.1	-41.8	174.3	-65.4	-31.3	0	0	0	111.4	A437 Q438 V439 Q444 L445	A437-N441 PolarHBondContact O-N 3.46Å; A437-N441 PolarHBondContact O-ND2 2.93Å; Q438-N441 WeakPolarHBondContact O-CB 3.23Å; Q438-N441 PolarHBondContact O-N 3.47Å; Q438-N441 VanDerWaalsContact O-N 3.11Å; Q438-N441 PolarHBondContact OE1-ND2 2.76Å; V439-N441 VanDerWaalsContact C-N 3.33Å; V439-N441 PolarHBondContact O-N 2.93Å; N441-Q444 WeakPolarHBondContact O-CB 3.37Å; N441-Q444 PolarHBondContact O-N 3.46Å; N441-L445 WeakPolarHBondContact O-CG 3.41Å; N441-L445 PolarHBondContact O-N 2.96Å; N441-L445 VanDerWaalsContact O-N 3.07Å
442	V	97.5	Very high	96.7	Very high	67 Å²	67	78.6 Å²	78.6	41%	0.406	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-44.2	176.1	175.3	0	0	0	0	111.2	Q438 V439 K440 Q444 L445 I446	Q438-V442 WeakPolarHBondContact O-CG2 3.35Å; Q438-V442 PolarHBondContact O-N 2.92Å; V439-V442 WeakPolarHBondContact O-CB 3.38Å; V439-V442 PolarHBondContact O-N 3.48Å; V439-V442 VanDerWaalsContact O-N 3.15Å; K440-V442 VanDerWaalsContact C-N 3.35Å; V442-Q444 VanDerWaalsContact C-N 3.28Å; V442-Q444 PolarHBondContact O-N 3.45Å; V442-L445 PolarHBondContact O-N 3.44Å; V442-L445 VanDerWaalsContact O-N 3.16Å; V442-I446 HydrophobicContact CG1-CD1 3.8Å; V442-I446 HydrophobicContact CG1-CG1 4.43Å; V442-I446 WeakPolarHBondContact O-CG1 3.43Å; V442-I446 PolarHBondContact O-N 3.19Å
443	T	96.4	Very high	96.7	Very high	43 Å²	43	76.2 Å²	76.2	26%	0.264	41%	0.407	S	S	.	.	H	α-helix	trans	-58.7	-39.8	174.9	-63.8	0	0	0	0	111.9	S320 V439 K440 I446 A447	S320-T443 WeakPolarHBondContact CB-OG1 3.12Å; V439-T443 PolarHBondContact O-N 3.44Å; V439-T443 PolarHBondContact O-OG1 3.35Å; K440-T443 PolarHBondContact O-N 3.22Å; T443-I446 PolarHBondContact O-N 2.74Å; T443-A447 PolarHBondContact O-N 3.25Å
444	Q	96.5	Very high	96.6	Very high	117 Å²	117	74.9 Å²	74.9	55%	0.547	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-41.7	175.5	-176.1	177.8	-15.7	0	0	112.4	K440 N441 V442 I446 A447 Q448	K440-Q444 PolarHBondContact O-N 3.04Å; N441-Q444 WeakPolarHBondContact O-CB 3.37Å; N441-Q444 PolarHBondContact O-N 3.46Å; V442-Q444 VanDerWaalsContact C-N 3.28Å; V442-Q444 PolarHBondContact O-N 3.45Å; Q444-I446 VanDerWaalsContact C-N 3.35Å; Q444-A447 PolarHBondContact O-N 2.88Å; Q444-Q448 PolarHBondContact O-N 2.88Å; Q444-Q448 VanDerWaalsContact O-N 3.11Å
445	L	96.6	Very high	96.6	Very high	100 Å²	100	75.1 Å²	75.1	52%	0.524	40%	0.402	S	S	.	.	H	α-helix	trans	-64	-39.7	175.4	-68	172.7	0	0	0	111.7	N441 V442 A447 Q448 I449	N441-L445 WeakPolarHBondContact O-CG 3.41Å; N441-L445 PolarHBondContact O-N 2.96Å; N441-L445 VanDerWaalsContact O-N 3.07Å; V442-L445 PolarHBondContact O-N 3.44Å; V442-L445 VanDerWaalsContact O-N 3.16Å; L445-A447 VanDerWaalsContact C-N 3.34Å; L445-A447 PolarHBondContact O-N 2.64Å; L445-Q448 WeakPolarHBondContact O-CB 3.48Å; L445-Q448 PolarHBondContact O-N 3.27Å; L445-I449 WeakPolarHBondContact O-CG1 3.42Å; L445-I449 PolarHBondContact O-N 2.99Å
446	I	97.5	Very high	96.5	Very high	14 Å²	14	76.2 Å²	76.2	7%	0.072	41%	0.405	C	S	.	.	H	α-helix	trans	-64.1	-40.6	176.1	-67.3	162.3	0	0	0	111.1	A313 A316 D317 V442 T443 Q444 Q448 I449 S450	A313-I446 HydrophobicContact CB-CG2 4.19Å; A313-I446 WeakPolarHBondContact O-CG2 3.33Å; A316-I446 HydrophobicContact CB-CD1 3.63Å; A316-I446 HydrophobicContact CB-CG1 4.1Å; D317-I446 HydrophobicContact CB-CG2 3.93Å; V442-I446 HydrophobicContact CG1-CD1 3.8Å; V442-I446 HydrophobicContact CG1-CG1 4.43Å; V442-I446 WeakPolarHBondContact O-CG1 3.43Å; V442-I446 PolarHBondContact O-N 3.19Å; T443-I446 PolarHBondContact O-N 2.74Å; Q444-I446 VanDerWaalsContact C-N 3.35Å; I446-Q448 VanDerWaalsContact C-N 3.31Å; I446-Q448 PolarHBondContact O-N 3.5Å; I446-I449 PolarHBondContact O-N 3.42Å; I446-S450 PolarHBondContact O-N 3.5Å
447	A	96.2	Very high	96.4	Very high	59 Å²	59	76.3 Å²	76.3	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-40.2	174.9	0	0	0	0	0	111.9	T443 Q444 L445 S450 H451	T443-A447 PolarHBondContact O-N 3.25Å; Q444-A447 PolarHBondContact O-N 2.88Å; L445-A447 VanDerWaalsContact C-N 3.34Å; L445-A447 PolarHBondContact O-N 2.64Å; A447-S450 PolarHBondContact O-N 3.26Å; A447-H451 WeakPolarHBondContact O-CB 3.31Å; A447-H451 PolarHBondContact O-N 3.28Å
448	Q	97	Very high	96.3	Very high	112 Å²	112	79 Å²	79	52%	0.523	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-42.4	173.5	-71.7	178.8	-18.8	0	0	112.4	Q444 L445 I446 S450 H451 S452	Q444-Q448 PolarHBondContact O-N 2.88Å; Q444-Q448 VanDerWaalsContact O-N 3.11Å; L445-Q448 WeakPolarHBondContact O-CB 3.48Å; L445-Q448 PolarHBondContact O-N 3.27Å; I446-Q448 VanDerWaalsContact C-N 3.31Å; I446-Q448 PolarHBondContact O-N 3.5Å; Q448-S450 VanDerWaalsContact C-N 3.34Å; Q448-S450 PolarHBondContact O-N 3.16Å; Q448-H451 PolarHBondContact O-N 3.17Å; Q448-S452 WeakPolarHBondContact O-CB 3.25Å; Q448-S452 PolarHBondContact O-N 3.28Å
449	I	96.8	Very high	96.2	Very high	89 Å²	89	74.9 Å²	74.9	46%	0.456	41%	0.407	S	S	.	.	H	α-helix	trans	-61	-44.7	175.2	-67.4	166.5	0	0	0	110.4	A313 L445 I446 H451 S452 T453	A313-I449 HydrophobicContact CB-CG2 4.15Å; L445-I449 WeakPolarHBondContact O-CG1 3.42Å; L445-I449 PolarHBondContact O-N 2.99Å; I446-I449 PolarHBondContact O-N 3.42Å; I449-H451 VanDerWaalsContact C-N 3.32Å; I449-H451 PolarHBondContact O-N 2.92Å; I449-S452 PolarHBondContact O-N 3.43Å; I449-T453 VanDerWaalsContact O-CB 3.31Å; I449-T453 WeakPolarHBondContact O-CB 3.22Å; I449-T453 PolarHBondContact O-N 3.38Å; I449-T453 PolarHBondContact O-OG1 3.34Å
450	S	96.2	Very high	96.1	Very high	45 Å²	45	74.7 Å²	74.7	32%	0.315	41%	0.406	S	S	.	.	H	α-helix	trans	-61.5	-41.3	177.6	-172.4	0	0	0	0	111.7	I446 A447 Q448 T453 L454	I446-S450 PolarHBondContact O-N 3.5Å; A447-S450 PolarHBondContact O-N 3.26Å; Q448-S450 VanDerWaalsContact C-N 3.34Å; Q448-S450 PolarHBondContact O-N 3.16Å; S450-T453 PolarHBondContact O-N 2.99Å; S450-L454 WeakPolarHBondContact O-CG 3.46Å; S450-L454 PolarHBondContact O-N 3.49Å; S450-L454 VanDerWaalsContact O-N 3.14Å
451	H	96.5	Very high	96.1	Very high	116 Å²	116	69.8 Å²	69.8	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-49.8	176.7	-175.4	57.1	0	0	0	111.8	A447 Q448 I449 T453 L454 E455	A447-H451 WeakPolarHBondContact O-CB 3.31Å; A447-H451 PolarHBondContact O-N 3.28Å; Q448-H451 PolarHBondContact O-N 3.17Å; I449-H451 VanDerWaalsContact C-N 3.32Å; I449-H451 PolarHBondContact O-N 2.92Å; H451-T453 VanDerWaalsContact C-N 3.26Å; H451-T453 PolarHBondContact O-N 2.94Å; H451-L454 WeakPolarHBondContact O-CB 3.47Å; H451-L454 PolarHBondContact O-N 3.24Å; H451-E455 IonicContact CE1-OE1 3.15Å; H451-E455 IonicContact NE2-OE1 2.69Å; H451-E455 PolarHBondContact NE2-OE1 3.08Å; H451-E455 PolarHBondContact O-N 3.42Å; H451-E455 VanDerWaalsContact O-N 3.1Å
452	S	97	Very high	96	Very high	50 Å²	50	68.7 Å²	68.7	35%	0.35	39%	0.39	S	S	.	.	H	α-helix	trans	-61.1	-35.4	177.3	-176.5	0	0	0	0	112.4	Q448 I449 L454 E455 Q456	Q448-S452 WeakPolarHBondContact O-CB 3.25Å; Q448-S452 PolarHBondContact O-N 3.28Å; I449-S452 PolarHBondContact O-N 3.43Å; S452-L454 VanDerWaalsContact C-N 3.34Å; S452-L454 PolarHBondContact O-N 2.89Å; S452-E455 PolarHBondContact O-N 3.22Å; S452-Q456 WeakPolarHBondContact O-CG 3.49Å; S452-Q456 PolarHBondContact O-N 3.07Å
453	T	97	Very high	95.9	Very high	8 Å²	8	69.5 Å²	69.5	5%	0.049	39%	0.391	C	S	.	.	H	α-helix	trans	-65.8	-36.4	175.7	-56.6	0	0	0	0	111.9	V306 N309 I449 S450 H451 Q456 A457	V306-T453 HydrophobicContact CG1-CG2 3.77Å; V306-T453 WeakPolarHBondContact CG1-O 3.28Å; V306-T453 WeakPolarHBondContact O-CG2 3.46Å; N309-T453 HydrophobicContact CB-CG2 3.97Å; I449-T453 VanDerWaalsContact O-CB 3.31Å; I449-T453 WeakPolarHBondContact O-CB 3.22Å; I449-T453 PolarHBondContact O-N 3.38Å; I449-T453 PolarHBondContact O-OG1 3.34Å; S450-T453 PolarHBondContact O-N 2.99Å; H451-T453 VanDerWaalsContact C-N 3.26Å; H451-T453 PolarHBondContact O-N 2.94Å; T453-Q456 PolarHBondContact O-N 3.08Å; T453-A457 PolarHBondContact O-N 3.43Å; T453-A457 VanDerWaalsContact O-N 3.07Å
454	L	94.5	Very high	95.8	Very high	111 Å²	111	70.5 Å²	70.5	58%	0.581	40%	0.397	S	S	*	.	H	α-helix	trans	-67.3	-41.3	174.5	-72.8	168.6	0	0	0	111.8	S450 H451 S452 Q456 A457 D458	S450-L454 WeakPolarHBondContact O-CG 3.46Å; S450-L454 PolarHBondContact O-N 3.49Å; S450-L454 VanDerWaalsContact O-N 3.14Å; H451-L454 WeakPolarHBondContact O-CB 3.47Å; H451-L454 PolarHBondContact O-N 3.24Å; S452-L454 VanDerWaalsContact C-N 3.34Å; S452-L454 PolarHBondContact O-N 2.89Å; L454-Q456 VanDerWaalsContact C-N 3.34Å; L454-Q456 PolarHBondContact O-N 3.19Å; L454-A457 WeakPolarHBondContact O-CB 3.44Å; L454-A457 PolarHBondContact O-N 2.8Å; L454-D458 PolarHBondContact O-N 3.27Å; L454-D458 VanDerWaalsContact O-N 3.09Å
455	E	95.9	Very high	95.7	Very high	111 Å²	111	72 Å²	72	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-62.4	-41.3	174.7	-67.2	-178.3	154	0	0	111.8	H451 S452 A457 D458 G459	H451-E455 IonicContact CE1-OE1 3.15Å; H451-E455 IonicContact NE2-OE1 2.69Å; H451-E455 PolarHBondContact NE2-OE1 3.08Å; H451-E455 PolarHBondContact O-N 3.42Å; H451-E455 VanDerWaalsContact O-N 3.1Å; S452-E455 PolarHBondContact O-N 3.22Å; E455-A457 VanDerWaalsContact C-N 3.3Å; E455-A457 PolarHBondContact O-N 3.15Å; E455-D458 PolarHBondContact O-N 2.93Å; E455-G459 PolarHBondContact O-N 3.32Å
456	Q	95.4	Very high	95.6	Very high	93 Å²	93	69.3 Å²	69.3	44%	0.435	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-38.2	174.5	-73.2	174.9	-6.3	0	0	112.2	V306 S452 T453 L454 G459 L460	V306-Q456 HydrophobicContact CG2-CB 3.86Å; S452-Q456 WeakPolarHBondContact O-CG 3.49Å; S452-Q456 PolarHBondContact O-N 3.07Å; T453-Q456 PolarHBondContact O-N 3.08Å; L454-Q456 VanDerWaalsContact C-N 3.34Å; L454-Q456 PolarHBondContact O-N 3.19Å; Q456-G459 PolarHBondContact O-N 3.16Å; Q456-L460 WeakPolarHBondContact O-CB 3.47Å; Q456-L460 PolarHBondContact O-N 2.83Å
457	A	94.7	Very high	95.6	Very high	44 Å²	44	69.2 Å²	69.2	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-63.5	-41.7	175.7	0	0	0	0	0	111.9	V306 T453 L454 E455 L460 S461	V306-A457 HydrophobicContact CG1-CB 3.82Å; T453-A457 PolarHBondContact O-N 3.43Å; T453-A457 VanDerWaalsContact O-N 3.07Å; L454-A457 WeakPolarHBondContact O-CB 3.44Å; L454-A457 PolarHBondContact O-N 2.8Å; E455-A457 VanDerWaalsContact C-N 3.3Å; E455-A457 PolarHBondContact O-N 3.15Å; A457-L460 PolarHBondContact O-N 2.69Å; A457-S461 PolarHBondContact O-N 2.78Å
458	D	94.7	Very high	95.5	Very high	105 Å²	105	71.1 Å²	71.1	56%	0.561	39%	0.392	S	S	*	.	H	α-helix	trans	-67.5	-42.9	175.9	-172.5	60.1	0	0	0	112.1	L454 E455 L460 S461 S462	L454-D458 PolarHBondContact O-N 3.27Å; L454-D458 VanDerWaalsContact O-N 3.09Å; E455-D458 PolarHBondContact O-N 2.93Å; D458-L460 PolarHBondContact O-N 2.77Å; D458-S461 VanDerWaalsContact O-CB 3.31Å; D458-S461 WeakPolarHBondContact O-CB 3.31Å; D458-S461 PolarHBondContact O-N 3.1Å; D458-S462 PolarHBondContact O-N 3.27Å; D458-S462 VanDerWaalsContact O-N 3.16Å
459	G	95.4	Very high	95.4	Very high	34 Å²	34	71.8 Å²	71.8	35%	0.351	40%	0.395	S	S	.	.	H	α-helix	trans	-57	-37.5	173.1	0	0	0	0	0	112.5	E455 Q456 S462 L463	E455-G459 PolarHBondContact O-N 3.32Å; Q456-G459 PolarHBondContact O-N 3.16Å; G459-S462 WeakPolarHBondContact O-CB 3.43Å; G459-S462 PolarHBondContact O-N 3.05Å; G459-L463 PolarHBondContact O-N 2.87Å
460	L	95.9	Very high	95.3	Very high	17 Å²	17	71.5 Å²	71.5	9%	0.089	39%	0.394	C	S	.	.	H	α-helix	trans	-68.8	-33.5	176.6	-164.5	65.8	0	0	0	113.1	M299 M302 A303 Q456 A457 D458 S462 L463 T464	M299-L460 HydrophobicContact CB-CD1 3.94Å; M299-L460 HydrophobicContact CE-CD1 4.16Å; M299-L460 HydrophobicContact CG-CD1 3.99Å; M302-L460 HydrophobicContact CB-CD1 4.3Å; M302-L460 HydrophobicContact CG-CD1 4.43Å; M302-L460 HydrophobicContact SD-CD1 4.25Å; A303-L460 HydrophobicContact CB-CD2 3.39Å; Q456-L460 WeakPolarHBondContact O-CB 3.47Å; Q456-L460 PolarHBondContact O-N 2.83Å; A457-L460 PolarHBondContact O-N 2.69Å; D458-L460 PolarHBondContact O-N 2.77Å; L460-S462 VanDerWaalsContact C-N 3.3Å; L460-S462 PolarHBondContact O-N 2.92Å; L460-L463 HydrophobicContact CD1-CD1 4.27Å; L460-L463 PolarHBondContact O-N 3.32Å; L460-T464 PolarHBondContact O-N 2.61Å; L460-T464 PolarHBondContact O-OG1 3.13Å
461	S	93.5	Very high	95.2	Very high	53 Å²	53	73.3 Å²	73.3	37%	0.371	40%	0.4	S	S	.	.	H	α-helix	trans	-62	-40.2	171	-179.9	0	0	0	0	111.5	A457 D458 T464 R465	A457-S461 PolarHBondContact O-N 2.78Å; D458-S461 VanDerWaalsContact O-CB 3.31Å; D458-S461 WeakPolarHBondContact O-CB 3.31Å; D458-S461 PolarHBondContact O-N 3.1Å; S461-T464 WeakPolarHBondContact O-CB 3.33Å; S461-T464 PolarHBondContact O-N 3.43Å; S461-R465 PolarHBondContact O-N 3.2Å; S461-R465 PolarHBondContact O-NE 3.17Å; S461-R465 PolarHBondContact OG-NH2 2.96Å
462	S	94.3	Very high	95.1	Very high	55 Å²	55	73.1 Å²	73.1	39%	0.385	40%	0.403	S	S	.	.	H	α-helix	trans	-68.3	-41.8	177.4	-61.8	0	0	0	0	112	D458 G459 L460 T464 R465 A466	D458-S462 PolarHBondContact O-N 3.27Å; D458-S462 VanDerWaalsContact O-N 3.16Å; G459-S462 WeakPolarHBondContact O-CB 3.43Å; G459-S462 PolarHBondContact O-N 3.05Å; L460-S462 VanDerWaalsContact C-N 3.3Å; L460-S462 PolarHBondContact O-N 2.92Å; S462-T464 VanDerWaalsContact C-N 3.26Å; S462-T464 PolarHBondContact O-N 2.74Å; S462-R465 PolarHBondContact O-N 2.94Å; S462-A466 PolarHBondContact O-N 3.49Å; S462-A466 VanDerWaalsContact O-N 3.1Å
463	L	95.5	Very high	95	Very high	84 Å²	84	74.5 Å²	74.5	44%	0.44	41%	0.405	S	S	.	.	H	α-helix	trans	-60.2	-36.8	173.1	-74.9	170	0	0	0	112.1	M299 G459 L460 R465 A466 V467	M299-L463 VanDerWaalsContact CE-C 3.42Å; M299-L463 HydrophobicContact CE-CB 3.55Å; M299-L463 HydrophobicContact SD-CB 3.91Å; G459-L463 PolarHBondContact O-N 2.87Å; L460-L463 HydrophobicContact CD1-CD1 4.27Å; L460-L463 PolarHBondContact O-N 3.32Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 2.72Å; L463-A466 PolarHBondContact O-N 3.25Å; L463-V467 WeakPolarHBondContact O-CG2 3.4Å; L463-V467 PolarHBondContact O-N 3.23Å
464	T	94	Very high	94.8	Very high	64 Å²	64	74.3 Å²	74.3	39%	0.393	41%	0.405	S	S	.	.	H	α-helix	trans	-61.2	-45.6	178.5	-55.4	0	0	0	0	110.6	M299 L460 S461 S462 A466 V467 D468	M299-T464 VanDerWaalsContact CE-N 3.28Å; M299-T464 WeakPolarHBondContact CE-OG1 3.46Å; L460-T464 PolarHBondContact O-N 2.61Å; L460-T464 PolarHBondContact O-OG1 3.13Å; S461-T464 WeakPolarHBondContact O-CB 3.33Å; S461-T464 PolarHBondContact O-N 3.43Å; S462-T464 VanDerWaalsContact C-N 3.26Å; S462-T464 PolarHBondContact O-N 2.74Å; T464-A466 PolarHBondContact O-N 2.75Å; T464-V467 PolarHBondContact O-N 3.4Å; T464-D468 PolarHBondContact O-N 3.41Å
465	R	95.3	Very high	94.7	Very high	148 Å²	148	74.5 Å²	74.5	56%	0.558	40%	0.402	S	S	*	.	H	α-helix	trans	-62.3	-41.5	175.7	-68.2	175	-116.8	160.9	-2.3	112.5	S461 S462 L463 V467 D468 E469	S461-R465 PolarHBondContact O-N 3.2Å; S461-R465 PolarHBondContact O-NE 3.17Å; S461-R465 PolarHBondContact OG-NH2 2.96Å; S462-R465 PolarHBondContact O-N 2.94Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 2.72Å; R465-V467 VanDerWaalsContact C-N 3.33Å; R465-V467 PolarHBondContact O-N 2.9Å; R465-D468 PolarHBondContact O-N 3.03Å; R465-E469 PolarHBondContact O-N 3.44Å
466	A	95.1	Very high	94.7	Very high	44 Å²	44	75.4 Å²	75.4	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-64.8	-37.7	178.2	0	0	0	0	0	112.2	S462 L463 T464 E469 L470	S462-A466 PolarHBondContact O-N 3.49Å; S462-A466 VanDerWaalsContact O-N 3.1Å; L463-A466 PolarHBondContact O-N 3.25Å; T464-A466 PolarHBondContact O-N 2.75Å; A466-E469 PolarHBondContact O-N 2.91Å; A466-L470 WeakPolarHBondContact O-CG 3.4Å; A466-L470 PolarHBondContact O-N 2.94Å
467	V	96.1	Very high	94.6	Very high	11 Å²	11	73.2 Å²	73.2	7%	0.067	40%	0.396	C	S	.	.	H	α-helix	trans	-68.7	-38.8	175.7	168.1	0	0	0	0	111.9	V292 T295 V296 M299 L463 T464 R465 E469 L470 N471	V292-V467 HydrophobicContact CG1-CG1 4.03Å; T295-V467 HydrophobicContact CG2-CG2 3.82Å; V296-V467 HydrophobicContact CG2-CG1 3.43Å; V296-V467 VanDerWaalsContact CG2-CG1 3.43Å; M299-V467 HydrophobicContact CE-CG2 4.41Å; M299-V467 HydrophobicContact SD-CB 4.5Å; M299-V467 HydrophobicContact SD-CG2 3.59Å; M299-V467 VanDerWaalsContact SD-CG2 3.59Å; L463-V467 WeakPolarHBondContact O-CG2 3.4Å; L463-V467 PolarHBondContact O-N 3.23Å; T464-V467 PolarHBondContact O-N 3.4Å; R465-V467 VanDerWaalsContact C-N 3.33Å; R465-V467 PolarHBondContact O-N 2.9Å; V467-E469 VanDerWaalsContact C-N 3.31Å; V467-E469 PolarHBondContact O-N 3.38Å; V467-L470 PolarHBondContact O-N 2.83Å; V467-N471 PolarHBondContact O-N 3.23Å
468	D	94.4	Very high	94.5	Very high	100 Å²	100	73.2 Å²	73.2	54%	0.535	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-39.4	173.3	-71.6	-24.7	0	0	0	111.7	T464 R465 N471 L472	T464-D468 PolarHBondContact O-N 3.41Å; R465-D468 PolarHBondContact O-N 3.03Å; D468-N471 WeakPolarHBondContact O-CB 3.38Å; D468-N471 PolarHBondContact O-N 2.93Å; D468-L472 PolarHBondContact O-N 3.23Å; D468-L472 VanDerWaalsContact O-N 3.08Å
469	E	95.5	Very high	94.5	Very high	125 Å²	125	74 Å²	74	58%	0.584	40%	0.396	S	S	*	.	H	α-helix	trans	-66	-42.7	175	-174	174.4	-173.8	0	0	112.3	R465 A466 V467 N471 L472 I473	R465-E469 PolarHBondContact O-N 3.44Å; A466-E469 PolarHBondContact O-N 2.91Å; V467-E469 VanDerWaalsContact C-N 3.31Å; V467-E469 PolarHBondContact O-N 3.38Å; E469-N471 VanDerWaalsContact C-N 3.28Å; E469-N471 PolarHBondContact O-N 3.41Å; E469-L472 WeakPolarHBondContact O-CB 3.47Å; E469-L472 PolarHBondContact O-N 2.87Å; E469-I473 HydrophobicContact CG-CD1 4.24Å; E469-I473 WeakPolarHBondContact O-CG1 3.32Å; E469-I473 PolarHBondContact O-N 3.31Å
470	L	95	Very high	94.4	Very high	83 Å²	83	76.2 Å²	76.2	44%	0.435	40%	0.399	S	S	.	.	H	α-helix	trans	-60.5	-39	174	-75.7	173.3	0	0	0	111.9	V292 A466 V467 I473 T474	V292-L470 HydrophobicContact CG2-CB 3.97Å; A466-L470 WeakPolarHBondContact O-CG 3.4Å; A466-L470 PolarHBondContact O-N 2.94Å; V467-L470 PolarHBondContact O-N 2.83Å; L470-I473 PolarHBondContact O-N 2.8Å; L470-T474 WeakPolarHBondContact O-CB 3.45Å; L470-T474 PolarHBondContact O-N 3.01Å; L470-T474 PolarHBondContact O-OG1 3.22Å
471	N	93	Very high	94.3	Very high	83 Å²	83	76 Å²	76	44%	0.444	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-43.2	175.6	-171	44.5	0	0	0	111.4	V467 D468 E469 T474 Q475	V467-N471 PolarHBondContact O-N 3.23Å; D468-N471 WeakPolarHBondContact O-CB 3.38Å; D468-N471 PolarHBondContact O-N 2.93Å; E469-N471 VanDerWaalsContact C-N 3.28Å; E469-N471 PolarHBondContact O-N 3.41Å; N471-T474 WeakPolarHBondContact O-CB 3.4Å; N471-T474 PolarHBondContact O-N 3.46Å; N471-Q475 PolarHBondContact O-N 3.48Å
472	L	95.3	Very high	94.3	Very high	113 Å²	113	80.4 Å²	80.4	59%	0.592	41%	0.413	S	S	*	.	H	α-helix	trans	-62	-44	175.5	-178.2	67.9	0	0	0	112.4	D468 E469 T474 Q475 K476	D468-L472 PolarHBondContact O-N 3.23Å; D468-L472 VanDerWaalsContact O-N 3.08Å; E469-L472 WeakPolarHBondContact O-CB 3.47Å; E469-L472 PolarHBondContact O-N 2.87Å; L472-T474 VanDerWaalsContact C-N 3.29Å; L472-T474 PolarHBondContact O-N 3.32Å; L472-Q475 PolarHBondContact O-N 3.41Å; L472-K476 PolarHBondContact O-N 3.49Å
473	I	94.9	Very high	94.2	Very high	78 Å²	78	83.4 Å²	83.4	40%	0.4	42%	0.422	S	S	.	.	H	α-helix	trans	-61.9	-41.2	176.6	-68.9	167.6	0	0	0	110.4	E469 L470 Q475 K476 N477	E469-I473 HydrophobicContact CG-CD1 4.24Å; E469-I473 WeakPolarHBondContact O-CG1 3.32Å; E469-I473 PolarHBondContact O-N 3.31Å; L470-I473 PolarHBondContact O-N 2.8Å; I473-Q475 VanDerWaalsContact C-N 3.34Å; I473-Q475 PolarHBondContact O-N 2.85Å; I473-K476 PolarHBondContact O-N 3.41Å; I473-N477 PolarHBondContact O-N 3.36Å
474	T	93.3	Very high	94.1	Very high	5 Å²	5	80.9 Å²	80.9	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-63.5	-41.4	179.2	-54.7	0	0	0	0	111.2	T285 T288 V289 L470 N471 L472 N477 A478	T285-T474 HydrophobicContact CG2-CG2 3.75Å; T285-T474 WeakPolarHBondContact CG2-O 3.29Å; T288-T474 HydrophobicContact CG2-CG2 4.41Å; T288-T474 WeakPolarHBondContact CG2-OG1 3.24Å; V289-T474 HydrophobicContact CB-CG2 4.48Å; V289-T474 HydrophobicContact CG2-CG2 3.34Å; L470-T474 WeakPolarHBondContact O-CB 3.45Å; L470-T474 PolarHBondContact O-N 3.01Å; L470-T474 PolarHBondContact O-OG1 3.22Å; N471-T474 WeakPolarHBondContact O-CB 3.4Å; N471-T474 PolarHBondContact O-N 3.46Å; L472-T474 VanDerWaalsContact C-N 3.29Å; L472-T474 PolarHBondContact O-N 3.32Å; T474-N477 PolarHBondContact O-N 2.8Å; T474-A478 PolarHBondContact O-N 3.29Å; T474-A478 VanDerWaalsContact O-N 3.15Å
475	Q	92.7	Very high	94	Very high	115 Å²	115	79.9 Å²	79.9	54%	0.537	41%	0.409	S	S	.	.	H	α-helix	trans	-62.5	-44	173.7	-174.5	173.9	5.1	0	0	112	N471 L472 I473 N477 A478 E479	N471-Q475 PolarHBondContact O-N 3.48Å; L472-Q475 PolarHBondContact O-N 3.41Å; I473-Q475 VanDerWaalsContact C-N 3.34Å; I473-Q475 PolarHBondContact O-N 2.85Å; Q475-N477 VanDerWaalsContact C-N 3.31Å; Q475-N477 PolarHBondContact O-N 3.23Å; Q475-A478 WeakPolarHBondContact O-CB 3.49Å; Q475-A478 PolarHBondContact O-N 2.96Å; Q475-E479 PolarHBondContact O-N 3.43Å
476	K	94.1	Very high	93.9	Very high	130 Å²	130	79.8 Å²	79.8	57%	0.565	42%	0.415	S	S	*	.	H	α-helix	trans	-64.1	-35.8	177.2	-171.6	174.5	-177.4	178.5	0	112.6	L472 I473 A478 E479 L480	L472-K476 PolarHBondContact O-N 3.49Å; I473-K476 PolarHBondContact O-N 3.41Å; K476-A478 VanDerWaalsContact C-N 3.32Å; K476-E479 PolarHBondContact O-N 2.94Å; K476-L480 HydrophobicContact CG-CD1 4.38Å; K476-L480 WeakPolarHBondContact O-CG 3.3Å; K476-L480 PolarHBondContact O-N 2.83Å
477	N	93.4	Very high	93.8	Very high	47 Å²	47	80.8 Å²	80.8	25%	0.251	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-40.1	174.6	-74.4	-10.1	0	0	0	111.3	T285 I473 T474 Q475 E479 L480 V481	T285-N477 HydrophobicContact CG2-CB 3.93Å; I473-N477 PolarHBondContact O-N 3.36Å; T474-N477 PolarHBondContact O-N 2.8Å; Q475-N477 VanDerWaalsContact C-N 3.31Å; Q475-N477 PolarHBondContact O-N 3.23Å; N477-E479 VanDerWaalsContact C-N 3.35Å; N477-E479 PolarHBondContact O-N 2.97Å; N477-L480 PolarHBondContact O-N 3Å; N477-V481 WeakPolarHBondContact O-CB 3.43Å; N477-V481 VanDerWaalsContact O-CG2 3.24Å; N477-V481 WeakPolarHBondContact O-CG2 3.34Å; N477-V481 PolarHBondContact O-N 3.43Å
478	A	92.3	Very high	93.6	Very high	44 Å²	44	80.3 Å²	80.3	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-42.2	175.7	0	0	0	0	0	112.1	T285 T474 Q475 K476 V481 E482	T285-A478 HydrophobicContact CG2-CB 4.35Å; T474-A478 PolarHBondContact O-N 3.29Å; T474-A478 VanDerWaalsContact O-N 3.15Å; Q475-A478 WeakPolarHBondContact O-CB 3.49Å; Q475-A478 PolarHBondContact O-N 2.96Å; K476-A478 VanDerWaalsContact C-N 3.32Å; A478-V481 WeakPolarHBondContact O-CB 3.45Å; A478-V481 PolarHBondContact O-N 3.4Å; A478-E482 PolarHBondContact O-N 3.41Å; A478-E482 VanDerWaalsContact O-N 3.12Å
479	E	94.5	Very high	93.5	Very high	120 Å²	120	78.5 Å²	78.5	56%	0.561	41%	0.413	S	S	*	.	H	α-helix	trans	-61.6	-44.8	174.6	-67.4	174.3	-177.5	0	0	112	Q475 K476 N477 V481 E482 E483	Q475-E479 PolarHBondContact O-N 3.43Å; K476-E479 PolarHBondContact O-N 2.94Å; N477-E479 VanDerWaalsContact C-N 3.35Å; N477-E479 PolarHBondContact O-N 2.97Å; E479-V481 VanDerWaalsContact C-N 3.33Å; E479-V481 PolarHBondContact O-N 2.91Å; E479-E482 PolarHBondContact O-N 2.91Å; E479-E483 PolarHBondContact O-N 2.94Å
480	L	93.9	Very high	93.3	Very high	81 Å²	81	76.8 Å²	76.8	42%	0.424	41%	0.406	S	S	.	.	H	α-helix	trans	-66	-34.8	178.2	-72.9	171.3	0	0	0	112.8	K476 N477 S484	K476-L480 HydrophobicContact CG-CD1 4.38Å; K476-L480 WeakPolarHBondContact O-CG 3.3Å; K476-L480 PolarHBondContact O-N 2.83Å; N477-L480 PolarHBondContact O-N 3Å; L480-S484 WeakPolarHBondContact O-CB 3.34Å; L480-S484 PolarHBondContact O-N 3.37Å
481	V	95.1	Very high	93.2	Very high	12 Å²	12	75 Å²	75	7%	0.073	40%	0.398	C	S	.	.	H	α-helix	trans	-61.4	-47.5	173.5	161.7	0	0	0	0	110	T278 L281 N282 N477 A478 E479 S484 A485	T278-V481 HydrophobicContact CG2-CB 4.25Å; T278-V481 HydrophobicContact CG2-CG1 3.76Å; T278-V481 WeakPolarHBondContact CG2-O 3.26Å; L281-V481 HydrophobicContact CB-CG2 3.96Å; L281-V481 HydrophobicContact CD2-CG2 3.63Å; L281-V481 HydrophobicContact CG-CG2 3.58Å; N282-V481 HydrophobicContact CB-CG1 3.71Å; N282-V481 HydrophobicContact CB-CG2 4.46Å; N477-V481 WeakPolarHBondContact O-CB 3.43Å; N477-V481 VanDerWaalsContact O-CG2 3.24Å; N477-V481 WeakPolarHBondContact O-CG2 3.34Å; N477-V481 PolarHBondContact O-N 3.43Å; A478-V481 WeakPolarHBondContact O-CB 3.45Å; A478-V481 PolarHBondContact O-N 3.4Å; E479-V481 VanDerWaalsContact C-N 3.33Å; E479-V481 PolarHBondContact O-N 2.91Å; V481-S484 PolarHBondContact O-N 2.85Å; V481-A485 WeakPolarHBondContact O-CB 3.31Å; V481-A485 PolarHBondContact O-N 2.84Å
482	E	91.6	Very high	93.1	Very high	146 Å²	146	75 Å²	75	68%	0.682	39%	0.394	S	S	*	.	H	α-helix	trans	-65	-43.2	-179.9	-171.2	161	-168.3	0	0	112	A478 E479 A485 Q486	A478-E482 PolarHBondContact O-N 3.41Å; A478-E482 VanDerWaalsContact O-N 3.12Å; E479-E482 PolarHBondContact O-N 2.91Å; E482-A485 PolarHBondContact O-N 3.33Å; E482-Q486 PolarHBondContact O-N 3.34Å
483	E	94.1	Very high	92.8	Very high	119 Å²	119	75.7 Å²	75.7	56%	0.556	39%	0.394	S	S	*	.	H	α-helix	trans	-61.6	-46.8	174.8	-173	-179.9	178.2	0	0	111.8	E479 A485 Q486 V487	E479-E483 PolarHBondContact O-N 2.94Å; E483-A485 VanDerWaalsContact C-N 3.34Å; E483-A485 PolarHBondContact O-N 3.49Å; E483-Q486 PolarHBondContact O-N 3.44Å; E483-V487 HydrophobicContact CG-CG2 4.49Å; E483-V487 WeakPolarHBondContact O-CG2 3.45Å; E483-V487 PolarHBondContact O-N 3.37Å
484	S	92.7	Very high	92.4	Very high	31 Å²	31	80 Å²	80	22%	0.217	41%	0.405	C	S	.	.	H	α-helix	trans	-61.9	-40.8	179.1	-178.1	0	0	0	0	111.9	T278 L480 V481 V487 S488	T278-S484 PolarHBondContact OG1-OG 3.29Å; L480-S484 WeakPolarHBondContact O-CB 3.34Å; L480-S484 PolarHBondContact O-N 3.37Å; V481-S484 PolarHBondContact O-N 2.85Å; S484-V487 PolarHBondContact O-N 3.26Å; S484-S488 VanDerWaalsContact O-CB 3.25Å; S484-S488 WeakPolarHBondContact O-CB 3.34Å; S484-S488 PolarHBondContact O-N 3.41Å; S484-S488 PolarHBondContact O-OG 2.95Å
485	A	92.2	Very high	92.3	Very high	43 Å²	43	80 Å²	80	36%	0.355	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-45.6	176.8	0	0	0	0	0	111.1	T278 V481 E482 E483 S488 A489	T278-A485 HydrophobicContact CG2-CB 3.99Å; V481-A485 WeakPolarHBondContact O-CB 3.31Å; V481-A485 PolarHBondContact O-N 2.84Å; E482-A485 PolarHBondContact O-N 3.33Å; E483-A485 VanDerWaalsContact C-N 3.34Å; E483-A485 PolarHBondContact O-N 3.49Å; A485-S488 PolarHBondContact O-N 3.13Å; A485-A489 WeakPolarHBondContact O-CB 3.44Å; A485-A489 PolarHBondContact O-N 3.39Å
486	Q	93.3	Very high	92.1	Very high	146 Å²	146	76.8 Å²	76.8	68%	0.682	40%	0.396	S	S	*	.	H	α-helix	trans	-63.2	-46.1	178.2	-174.2	-177.8	-5.1	0	0	112.1	E482 E483 A489 M490	E482-Q486 PolarHBondContact O-N 3.34Å; E483-Q486 PolarHBondContact O-N 3.44Å; Q486-A489 PolarHBondContact O-N 3.39Å; Q486-M490 WeakPolarHBondContact O-CB 3.38Å; Q486-M490 PolarHBondContact O-N 3.26Å
487	V	92.2	Very high	91.6	Very high	64 Å²	64	72.2 Å²	72.2	39%	0.388	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-44.7	178.8	172.8	0	0	0	0	110.6	E483 S484 A489 M490 V491	E483-V487 HydrophobicContact CG-CG2 4.49Å; E483-V487 WeakPolarHBondContact O-CG2 3.45Å; E483-V487 PolarHBondContact O-N 3.37Å; S484-V487 PolarHBondContact O-N 3.26Å; V487-A489 VanDerWaalsContact C-N 3.35Å; V487-A489 PolarHBondContact O-N 3.49Å; V487-M490 PolarHBondContact O-N 3.33Å; V487-V491 HydrophobicContact CG1-CG2 4.31Å; V487-V491 WeakPolarHBondContact O-CG2 3.43Å; V487-V491 PolarHBondContact O-N 3.05Å
488	S	92.2	Very high	91.3	Very high	2 Å²	2	73.9 Å²	73.9	1%	0.014	38%	0.384	C	S	.	.	H	α-helix	trans	-59.8	-44	177.7	-61	0	0	0	0	112	L274 S484 A485 V491 K492	L274-S488 WeakPolarHBondContact CD2-OG 3.47Å; L274-S488 WeakPolarHBondContact CG-OG 3.35Å; S484-S488 VanDerWaalsContact O-CB 3.25Å; S484-S488 WeakPolarHBondContact O-CB 3.34Å; S484-S488 PolarHBondContact O-N 3.41Å; S484-S488 PolarHBondContact O-OG 2.95Å; A485-S488 PolarHBondContact O-N 3.13Å; S488-V491 PolarHBondContact O-N 2.95Å; S488-K492 VanDerWaalsContact O-CB 3.31Å; S488-K492 WeakPolarHBondContact O-CB 3.43Å; S488-K492 PolarHBondContact O-N 3.31Å
489	A	91.3	Very high	91	Very high	62 Å²	62	74.4 Å²	74.4	51%	0.512	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-42.9	177	0	0	0	0	0	111.9	A485 Q486 V487 K492 H493	A485-A489 WeakPolarHBondContact O-CB 3.44Å; A485-A489 PolarHBondContact O-N 3.39Å; Q486-A489 PolarHBondContact O-N 3.39Å; V487-A489 VanDerWaalsContact C-N 3.35Å; V487-A489 PolarHBondContact O-N 3.49Å; A489-K492 PolarHBondContact O-N 2.98Å; A489-H493 WeakPolarHBondContact O-CB 3.47Å; A489-H493 PolarHBondContact O-N 3.48Å
490	M	92.3	Very high	90.5	Very high	89 Å²	89	72.1 Å²	72.1	44%	0.438	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-46.4	176.7	-179.3	-169.8	60.3	0	0	111.8	Q486 V487 H493 R494	Q486-M490 WeakPolarHBondContact O-CB 3.38Å; Q486-M490 PolarHBondContact O-N 3.26Å; V487-M490 PolarHBondContact O-N 3.33Å; M490-H493 PolarHBondContact O-N 2.94Å; M490-R494 WeakPolarHBondContact O-CG 3.35Å; M490-R494 PolarHBondContact O-N 3.01Å
491	V	93.4	Very high	89.9	Confident	46 Å²	46	70.4 Å²	70.4	28%	0.279	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-42.6	-179.8	178.5	0	0	0	0	110.6	V267 S271 V487 S488 H493 R494 A495	V267-V491 HydrophobicContact CG1-CG1 3.49Å; V267-V491 VanDerWaalsContact CG1-CG1 3.49Å; S271-V491 WeakPolarHBondContact OG-CG1 2.99Å; V487-V491 HydrophobicContact CG1-CG2 4.31Å; V487-V491 WeakPolarHBondContact O-CG2 3.43Å; V487-V491 PolarHBondContact O-N 3.05Å; S488-V491 PolarHBondContact O-N 2.95Å; V491-H493 VanDerWaalsContact C-N 3.3Å; V491-H493 PolarHBondContact O-N 3.33Å; V491-R494 PolarHBondContact O-N 3.47Å; V491-A495 WeakPolarHBondContact O-CB 3.39Å; V491-A495 PolarHBondContact O-N 2.86Å
492	K	90	Very high	89.2	Confident	82 Å²	82	70.9 Å²	70.9	36%	0.357	37%	0.371	S	S	.	.	H	α-helix	trans	-57.4	-43.5	174	-173.9	170.4	-175.4	165.3	0	111.5	R268 E272 S488 A489 A495 S496	R268-K492 HydrophobicContact CG-CG 4.45Å; E272-K492 IonicContact OE1-NZ 2.6Å; E272-K492 PolarHBondContact OE1-NZ 3.38Å; S488-K492 VanDerWaalsContact O-CB 3.31Å; S488-K492 WeakPolarHBondContact O-CB 3.43Å; S488-K492 PolarHBondContact O-N 3.31Å; A489-K492 PolarHBondContact O-N 2.98Å; K492-A495 PolarHBondContact O-N 3.49Å; K492-S496 PolarHBondContact O-N 3.49Å
493	H	89.1	Confident	88.4	Confident	127 Å²	127	68.6 Å²	68.6	59%	0.588	37%	0.367	S	S	*	.	H	α-helix	trans	-64.3	-44.1	177.4	-173.2	63.7	0	0	0	112.5	A489 M490 V491 S496 R497	A489-H493 WeakPolarHBondContact O-CB 3.47Å; A489-H493 PolarHBondContact O-N 3.48Å; M490-H493 PolarHBondContact O-N 2.94Å; V491-H493 VanDerWaalsContact C-N 3.3Å; V491-H493 PolarHBondContact O-N 3.33Å; H493-S496 PolarHBondContact O-N 3.32Å; H493-R497 WeakPolarHBondContact O-CG 3.47Å; H493-R497 PolarHBondContact O-N 2.89Å
494	R	87.3	Confident	87.1	Confident	168 Å²	168	64.9 Å²	64.9	63%	0.634	35%	0.352	S	S	*	.	H	α-helix	trans	-65.1	-39.3	176.3	-72.7	-174.9	179.1	-171.4	2.1	112.7	M490 V491 R497 L498	M490-R494 WeakPolarHBondContact O-CG 3.35Å; M490-R494 PolarHBondContact O-N 3.01Å; V491-R494 PolarHBondContact O-N 3.47Å; R494-R497 PolarHBondContact O-N 3.34Å; R494-L498 PolarHBondContact O-N 3.49Å
495	A	90.6	Very high	86.8	Confident	6 Å²	6	66.6 Å²	66.6	5%	0.05	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-46	174.4	0	0	0	0	0	110.7	V264 V267 R268 V491 K492 R497 L498 E499	V264-A495 HydrophobicContact CG1-CB 4.27Å; V264-A495 WeakPolarHBondContact CG1-O 3.48Å; V267-A495 HydrophobicContact CG1-CB 4.12Å; R268-A495 HydrophobicContact CB-CB 4.07Å; V491-A495 WeakPolarHBondContact O-CB 3.39Å; V491-A495 PolarHBondContact O-N 2.86Å; K492-A495 PolarHBondContact O-N 3.49Å; A495-R497 PolarHBondContact O-N 3.28Å; A495-L498 PolarHBondContact O-N 3.03Å; A495-L498 VanDerWaalsContact O-N 3.14Å; A495-E499 PolarHBondContact O-N 3.15Å
496	S	87.9	Confident	86.6	Confident	48 Å²	48	67.8 Å²	67.8	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-60.2	-42	175.3	178.8	0	0	0	0	112.6	K492 H493 L498 E499 D500	K492-S496 PolarHBondContact O-N 3.49Å; H493-S496 PolarHBondContact O-N 3.32Å; S496-L498 VanDerWaalsContact C-N 3.29Å; S496-L498 PolarHBondContact O-N 3.21Å; S496-E499 WeakPolarHBondContact O-CB 3.5Å; S496-E499 PolarHBondContact O-N 3.44Å; S496-D500 PolarHBondContact O-N 3.01Å
497	R	85	Confident	86.2	Confident	33 Å²	33	63.4 Å²	63.4	13%	0.125	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-39.5	174.5	-74.3	-70.4	-61.8	145.4	-3	112.5	A33 D35 H493 R494 A495 A501	A33-R497 PolarHBondContact O-NH2 3.43Å; D35-R497 IonicContact OD1-CZ 3.78Å; D35-R497 VanDerWaalsContact OD1-CZ 3.28Å; D35-R497 IonicContact OD1-NE 2.67Å; D35-R497 PolarHBondContact OD1-NE 3.02Å; D35-R497 VanDerWaalsContact OD1-NE 3.14Å; D35-R497 IonicContact OD1-NH2 2.92Å; D35-R497 PolarHBondContact OD1-NH2 3.11Å; D35-R497 IonicContact OD2-NE 3.27Å; H493-R497 WeakPolarHBondContact O-CG 3.47Å; H493-R497 PolarHBondContact O-N 2.89Å; R494-R497 PolarHBondContact O-N 3.34Å; A495-R497 PolarHBondContact O-N 3.28Å; R497-A501 PolarHBondContact O-N 3.46Å
498	L	86.7	Confident	85.8	Confident	83 Å²	83	63.4 Å²	63.4	44%	0.435	34%	0.339	S	S	.	.	H	α-helix	trans	-74.1	-35.5	179	-168.8	56.3	0	0	0	111.6	V260 V264 R494 A495 S496 A501 V502	V260-L498 HydrophobicContact CG1-CD1 4.36Å; V260-L498 HydrophobicContact CG1-CD2 4.18Å; V260-L498 HydrophobicContact CG1-CG 4.16Å; V264-L498 HydrophobicContact CG2-CB 3.77Å; V264-L498 HydrophobicContact CG2-CD2 3.38Å; V264-L498 HydrophobicContact CG2-CG 3.4Å; V264-L498 VanDerWaalsContact CG2-CG 3.4Å; R494-L498 PolarHBondContact O-N 3.49Å; A495-L498 PolarHBondContact O-N 3.03Å; A495-L498 VanDerWaalsContact O-N 3.14Å; S496-L498 VanDerWaalsContact C-N 3.29Å; S496-L498 PolarHBondContact O-N 3.21Å; L498-A501 PolarHBondContact O-N 3.21Å; L498-V502 HydrophobicContact CD1-CG2 4.5Å; L498-V502 WeakPolarHBondContact O-CG2 3.48Å; L498-V502 PolarHBondContact O-N 3.35Å; L498-V502 VanDerWaalsContact O-N 3.08Å
499	E	86.5	Confident	85.4	Confident	54 Å²	54	67.3 Å²	67.3	25%	0.252	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-48	172.8	-168.1	171.6	-166.4	0	0	110.6	V264 R268 A495 S496 A501 V502 T503	V264-E499 HydrophobicContact CG1-CB 3.72Å; V264-E499 HydrophobicContact CG1-CG 4.45Å; R268-E499 IonicContact NH1-OE1 2.79Å; R268-E499 IonicContact NH1-OE2 3.66Å; R268-E499 PolarHBondContact NH1-OE2 2.96Å; A495-E499 PolarHBondContact O-N 3.15Å; S496-E499 WeakPolarHBondContact O-CB 3.5Å; S496-E499 PolarHBondContact O-N 3.44Å; E499-A501 VanDerWaalsContact C-N 3.3Å; E499-A501 PolarHBondContact O-N 2.84Å; E499-V502 PolarHBondContact O-N 3.07Å; E499-T503 PolarHBondContact O-N 2.59Å; E499-T503 VanDerWaalsContact O-N 3.08Å; E499-T503 PolarHBondContact O-OG1 3.27Å
500	D	82.7	Confident	85	Confident	73 Å²	73	67.6 Å²	67.6	39%	0.39	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-41.9	175.8	-71.5	-17.3	0	0	0	111.6	S496 V502 V504	S496-D500 PolarHBondContact O-N 3.01Å; D500-V502 VanDerWaalsContact C-N 3.31Å; D500-V502 PolarHBondContact O-N 3Å; D500-V504 WeakPolarHBondContact O-CG2 3.28Å
501	A	81.2	Confident	84.5	Confident	45 Å²	45	66.1 Å²	66.1	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-68	-29.5	-178.8	0	0	0	0	0	113.3	R497 L498 E499	R497-A501 PolarHBondContact O-N 3.46Å; L498-A501 PolarHBondContact O-N 3.21Å; E499-A501 VanDerWaalsContact C-N 3.3Å; E499-A501 PolarHBondContact O-N 2.84Å
502	V	81.2	Confident	83.8	Confident	21 Å²	21	67.6 Å²	67.6	13%	0.127	35%	0.347	C	S	.	.	H	α-helix	trans	-86.9	-25.9	-177.8	176.1	0	0	0	0	112.3	I257 V260 L498 E499 D500 V504	I257-V502 HydrophobicContact CB-CG1 4.3Å; I257-V502 HydrophobicContact CG2-CG1 3.73Å; I257-V502 WeakPolarHBondContact O-CG1 3.43Å; V260-V502 HydrophobicContact CB-CG2 4.14Å; V260-V502 HydrophobicContact CG1-CG2 3.55Å; L498-V502 HydrophobicContact CD1-CG2 4.5Å; L498-V502 WeakPolarHBondContact O-CG2 3.48Å; L498-V502 PolarHBondContact O-N 3.35Å; L498-V502 VanDerWaalsContact O-N 3.08Å; E499-V502 PolarHBondContact O-N 3.07Å; D500-V502 VanDerWaalsContact C-N 3.31Å; D500-V502 PolarHBondContact O-N 3Å; V502-V504 VanDerWaalsContact C-N 3.32Å
503	T	74.5	Confident	83.3	Confident	98 Å²	98	66.4 Å²	66.4	60%	0.601	35%	0.346	S	S	*	.	H	α-helix	trans	-77.5	-21.9	-178.3	-50.7	0	0	0	0	112.8	E499	E499-T503 PolarHBondContact O-N 2.59Å; E499-T503 VanDerWaalsContact O-N 3.08Å; E499-T503 PolarHBondContact O-OG1 3.27Å
504	V	67.1	Low	82.8	Confident	41 Å²	41	60.9 Å²	60.9	25%	0.248	33%	0.325	C	S	.	.			trans	-74.1	0	179.7	174.1	0	0	0	0	110.3	T23 H32 M102 R104 M112 D500 V502	T23-V504 HydrophobicContact CG2-CG1 3.06Å; H32-V504 HydrophobicContact CB-CG2 3.93Å; M102-V504 HydrophobicContact CE-CG1 4.2Å; M102-V504 WeakPolarHBondContact CE-O 3.4Å; R104-V504 PolarHBondContact NH2-O 2.84Å; M112-V504 HydrophobicContact CE-CG1 3.74Å; D500-V504 WeakPolarHBondContact O-CG2 3.28Å; V502-V504 VanDerWaalsContact C-N 3.32Å

Retrieved 504 of 504 residues in 159.6 ms (Link to these results)

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