A0A087WW42_HUMAN Loading...

DNA polymerase epsilon catalytic subunit

DNA polymerase II participates in chromosomal DNA replication.

AlphaFold DB (A0A5F9ZHA7), UniProt , Accession A0A087WW42, Species HUMAN (Homo sapiens, Human), Gene POLE, Length 308 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	C	67.8	Low	86.9	Confident	132 Å²	132	108.2 Å²	108.2	89%	0.892	57%	0.567	S	S	*	*				0	-62.3	0	-54.8	0	0	0	0	111.2	N3 M4 E5	C1-N3 PolarHBondContact O-N 3.05Å; C1-N3 VanDerWaalsContact O-N 3.14Å; C1-M4 WeakPolarHBondContact O-CB 3.41Å; C1-M4 PolarHBondContact O-N 3.37Å; C1-E5 PolarHBondContact O-N 3.14Å; C1-E5 VanDerWaalsContact O-N 3.07Å
2	K	77.8	Confident	87.4	Confident	164 Å²	164	109.8 Å²	109.8	71%	0.713	57%	0.569	S	S	*	*	H	α-helix	trans	-46.7	-44.3	177.6	-71.1	-171.3	175.5	-174.4	0	116.5	M4 E5 V6	K2-M4 VanDerWaalsContact C-N 3.3Å; K2-M4 PolarHBondContact O-N 2.93Å; K2-E5 PolarHBondContact O-N 3.06Å; K2-V6 WeakPolarHBondContact O-CG2 3.49Å; K2-V6 PolarHBondContact O-N 2.88Å
3	N	83.4	Confident	87.7	Confident	143 Å²	143	109.2 Å²	109.2	77%	0.765	57%	0.567	S	S	*	*	H	α-helix	trans	-65.2	-32.5	178.7	-69.5	1.7	0	0	0	113.3	C1 L7	C1-N3 PolarHBondContact O-N 3.05Å; C1-N3 VanDerWaalsContact O-N 3.14Å; N3-L7 WeakPolarHBondContact O-CB 3.3Å; N3-L7 PolarHBondContact O-N 3.07Å; N3-L7 VanDerWaalsContact O-N 3.13Å
4	M	89.1	Confident	88.2	Confident	89 Å²	89	105.1 Å²	105.1	44%	0.438	56%	0.556	S	S	.	*	H	α-helix	trans	-76.9	-37.7	176.6	-67.8	-62.1	-61.5	0	0	111.3	C1 K2 L7 Y8	C1-M4 WeakPolarHBondContact O-CB 3.41Å; C1-M4 PolarHBondContact O-N 3.37Å; K2-M4 VanDerWaalsContact C-N 3.3Å; K2-M4 PolarHBondContact O-N 2.93Å; M4-L7 HydrophobicContact CE-CD2 4.47Å; M4-L7 PolarHBondContact O-N 2.91Å; M4-L7 HydrophobicContact SD-CD2 4.37Å; M4-Y8 HydrophobicContact CB-CD2 4.43Å; M4-Y8 HydrophobicContact CB-CE2 4.34Å; M4-Y8 HydrophobicContact CE-CD2 4.35Å; M4-Y8 HydrophobicContact CE-CE2 3.45Å; M4-Y8 VanDerWaalsContact CE-CE2 3.45Å; M4-Y8 WeakPolarHBondContact CE-OH 3.41Å; M4-Y8 WeakPolarHBondContact O-CD2 3.39Å; M4-Y8 PolarHBondContact O-N 3.14Å
5	E	87.4	Confident	88.6	Confident	104 Å²	104	106.2 Å²	106.2	49%	0.486	56%	0.557	S	S	.	*	H	α-helix	trans	-57.3	-54.1	172.3	-71.1	153.4	-150.5	0	0	110.2	C1 K2 L7 Y8 D9	C1-E5 PolarHBondContact O-N 3.14Å; C1-E5 VanDerWaalsContact O-N 3.07Å; K2-E5 PolarHBondContact O-N 3.06Å; E5-L7 VanDerWaalsContact C-N 3.28Å; E5-L7 PolarHBondContact O-N 3.13Å; E5-Y8 PolarHBondContact O-N 2.91Å; E5-D9 WeakPolarHBondContact O-CB 3.47Å; E5-D9 VanDerWaalsContact O-CG 3.25Å; E5-D9 PolarHBondContact O-N 2.61Å
6	V	89.1	Confident	89	Confident	91 Å²	91	106.7 Å²	106.7	55%	0.552	55%	0.553	S	S	*	*	H	α-helix	trans	-58	-40.3	177.8	173.9	0	0	0	0	112	K2 S10	K2-V6 WeakPolarHBondContact O-CG2 3.49Å; K2-V6 PolarHBondContact O-N 2.88Å; V6-S10 VanDerWaalsContact O-CB 3.28Å; V6-S10 WeakPolarHBondContact O-CB 3.12Å; V6-S10 PolarHBondContact O-N 2.84Å; V6-S10 PolarHBondContact O-OG 3.33Å
7	L	92.7	Very high	89.3	Confident	86 Å²	86	105.3 Å²	105.3	45%	0.45	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-49.6	177.5	177.4	63.8	0	0	0	111.7	N3 M4 E5 S10 L11	N3-L7 WeakPolarHBondContact O-CB 3.3Å; N3-L7 PolarHBondContact O-N 3.07Å; N3-L7 VanDerWaalsContact O-N 3.13Å; M4-L7 HydrophobicContact CE-CD2 4.47Å; M4-L7 PolarHBondContact O-N 2.91Å; M4-L7 HydrophobicContact SD-CD2 4.37Å; E5-L7 VanDerWaalsContact C-N 3.28Å; E5-L7 PolarHBondContact O-N 3.13Å; L7-S10 PolarHBondContact O-N 3.26Å; L7-L11 HydrophobicContact CD1-CD1 4.21Å; L7-L11 HydrophobicContact CD1-CG 4.36Å; L7-L11 HydrophobicContact CG-CD1 4.11Å; L7-L11 WeakPolarHBondContact O-CB 3.16Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.37Å
8	Y	93.8	Very high	89.6	Confident	142 Å²	142	104.9 Å²	104.9	56%	0.557	55%	0.551	S	S	*	*	H	α-helix	trans	-67.8	-39.2	-179	-73.9	-53.3	0	0	0	112.3	M4 E5 S10 L11 Q12	M4-Y8 HydrophobicContact CB-CD2 4.43Å; M4-Y8 HydrophobicContact CB-CE2 4.34Å; M4-Y8 HydrophobicContact CE-CD2 4.35Å; M4-Y8 HydrophobicContact CE-CE2 3.45Å; M4-Y8 VanDerWaalsContact CE-CE2 3.45Å; M4-Y8 WeakPolarHBondContact CE-OH 3.41Å; M4-Y8 WeakPolarHBondContact O-CD2 3.39Å; M4-Y8 PolarHBondContact O-N 3.14Å; E5-Y8 PolarHBondContact O-N 2.91Å; Y8-S10 VanDerWaalsContact C-N 3.32Å; Y8-S10 PolarHBondContact O-N 2.86Å; Y8-L11 HydrophobicContact CD1-CD1 4.37Å; Y8-L11 PolarHBondContact O-N 3.13Å; Y8-Q12 WeakPolarHBondContact O-CB 3.44Å; Y8-Q12 PolarHBondContact O-N 2.84Å
9	D	89.1	Confident	89.8	Confident	91 Å²	91	105.6 Å²	105.6	49%	0.487	56%	0.555	S	S	.	*	H	α-helix	trans	-60.4	-44.9	173.8	-70.9	-13.1	0	0	0	110.7	E5 L11 Q12 L13	E5-D9 WeakPolarHBondContact O-CB 3.47Å; E5-D9 VanDerWaalsContact O-CG 3.25Å; E5-D9 PolarHBondContact O-N 2.61Å; D9-L11 PolarHBondContact O-N 3.33Å; D9-Q12 PolarHBondContact O-N 2.89Å; D9-L13 WeakPolarHBondContact O-CB 3.33Å; D9-L13 VanDerWaalsContact O-CG 3.23Å; D9-L13 WeakPolarHBondContact O-CG 3.34Å; D9-L13 PolarHBondContact O-N 2.98Å
10	S	91.3	Very high	89.9	Confident	69 Å²	69	105.2 Å²	105.2	48%	0.483	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-43.7	176.8	-60	0	0	0	0	111.9	V6 L7 Y8 L13 A14	V6-S10 VanDerWaalsContact O-CB 3.28Å; V6-S10 WeakPolarHBondContact O-CB 3.12Å; V6-S10 PolarHBondContact O-N 2.84Å; V6-S10 PolarHBondContact O-OG 3.33Å; L7-S10 PolarHBondContact O-N 3.26Å; Y8-S10 VanDerWaalsContact C-N 3.32Å; Y8-S10 PolarHBondContact O-N 2.86Å; S10-L13 PolarHBondContact O-N 3.18Å; S10-A14 WeakPolarHBondContact O-CB 3.48Å; S10-A14 PolarHBondContact O-N 3.46Å
11	L	95.1	Very high	90.2	Very high	79 Å²	79	103.6 Å²	103.6	41%	0.414	55%	0.55	S	S	.	*	H	α-helix	trans	-65.2	-44.5	177.8	-74.9	172.5	0	0	0	111.8	L7 Y8 D9 L13 A14 H15	L7-L11 HydrophobicContact CD1-CD1 4.21Å; L7-L11 HydrophobicContact CD1-CG 4.36Å; L7-L11 HydrophobicContact CG-CD1 4.11Å; L7-L11 WeakPolarHBondContact O-CB 3.16Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.37Å; Y8-L11 HydrophobicContact CD1-CD1 4.37Å; Y8-L11 PolarHBondContact O-N 3.13Å; D9-L11 PolarHBondContact O-N 3.33Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 2.9Å; L11-A14 PolarHBondContact O-N 3.2Å; L11-H15 PolarHBondContact O-N 3.25Å; L11-H15 PolarHBondContact O-ND1 3.4Å
12	Q	92.4	Very high	91.5	Very high	128 Å²	128	104 Å²	104	60%	0.598	54%	0.537	S	S	*	.	H	α-helix	trans	-60	-45.7	176.3	178.4	-170.3	-29.3	0	0	110.7	Y8 D9 A14 H15 K16	Y8-Q12 WeakPolarHBondContact O-CB 3.44Å; Y8-Q12 PolarHBondContact O-N 2.84Å; D9-Q12 PolarHBondContact O-N 2.89Å; Q12-A14 VanDerWaalsContact C-N 3.35Å; Q12-A14 PolarHBondContact O-N 2.79Å; Q12-H15 PolarHBondContact O-N 2.66Å; Q12-K16 WeakPolarHBondContact O-CB 3.43Å; Q12-K16 PolarHBondContact O-N 3.33Å
13	L	91.4	Very high	92.3	Very high	102 Å²	102	100.6 Å²	100.6	53%	0.534	52%	0.52	S	S	.	.	H	α-helix	trans	-62.9	-40.5	177.7	-72.3	171	0	0	0	112.1	D9 S10 L11 K16 C17	D9-L13 WeakPolarHBondContact O-CB 3.33Å; D9-L13 VanDerWaalsContact O-CG 3.23Å; D9-L13 WeakPolarHBondContact O-CG 3.34Å; D9-L13 PolarHBondContact O-N 2.98Å; S10-L13 PolarHBondContact O-N 3.18Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 2.9Å; L13-K16 WeakPolarHBondContact O-CB 3.23Å; L13-K16 PolarHBondContact O-N 2.66Å; L13-C17 PolarHBondContact O-N 3.29Å; L13-C17 VanDerWaalsContact O-N 3.07Å
14	A	94.1	Very high	92.7	Very high	51 Å²	51	95.8 Å²	95.8	42%	0.421	50%	0.504	S	S	.	.	H	α-helix	trans	-60.6	-46.6	175.2	0	0	0	0	0	111.7	S10 L11 Q12 K16 C17 I18	S10-A14 WeakPolarHBondContact O-CB 3.48Å; S10-A14 PolarHBondContact O-N 3.46Å; L11-A14 PolarHBondContact O-N 3.2Å; Q12-A14 VanDerWaalsContact C-N 3.35Å; Q12-A14 PolarHBondContact O-N 2.79Å; A14-K16 VanDerWaalsContact C-N 3.35Å; A14-K16 PolarHBondContact O-N 3.4Å; A14-C17 PolarHBondContact O-N 2.71Å; A14-I18 PolarHBondContact O-N 3.4Å
15	H	95.3	Very high	93.1	Very high	122 Å²	122	94.7 Å²	94.7	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-65.9	-36.3	176.1	-71.6	89.5	0	0	0	112.2	L11 Q12 C17 I18 L19	L11-H15 PolarHBondContact O-N 3.25Å; L11-H15 PolarHBondContact O-ND1 3.4Å; Q12-H15 PolarHBondContact O-N 2.66Å; H15-C17 VanDerWaalsContact C-N 3.32Å; H15-C17 PolarHBondContact O-N 3.21Å; H15-I18 PolarHBondContact O-N 3.45Å; H15-I18 VanDerWaalsContact O-N 3.15Å; H15-L19 WeakPolarHBondContact O-CB 3.45Å; H15-L19 PolarHBondContact O-N 2.83Å
16	K	94.3	Very high	93.6	Very high	114 Å²	114	90.4 Å²	90.4	50%	0.496	48%	0.476	S	S	.	.	H	α-helix	trans	-58.4	-42.4	174.5	-177.1	174.6	-177.8	169.2	0	111.8	Q12 L13 A14 I18 L19 N20	Q12-K16 WeakPolarHBondContact O-CB 3.43Å; Q12-K16 PolarHBondContact O-N 3.33Å; L13-K16 WeakPolarHBondContact O-CB 3.23Å; L13-K16 PolarHBondContact O-N 2.66Å; A14-K16 VanDerWaalsContact C-N 3.35Å; A14-K16 PolarHBondContact O-N 3.4Å; K16-I18 VanDerWaalsContact C-N 3.35Å; K16-I18 PolarHBondContact O-N 2.86Å; K16-L19 PolarHBondContact O-N 2.83Å; K16-N20 WeakPolarHBondContact O-CB 3.34Å; K16-N20 VanDerWaalsContact O-CG 3.31Å; K16-N20 PolarHBondContact O-N 3.45Å
17	C	93.5	Very high	93.9	Very high	83 Å²	83	89.8 Å²	89.8	56%	0.561	47%	0.469	S	S	*	.	H	α-helix	trans	-61.3	-43.1	175.1	-71.3	0	0	0	0	112	L13 A14 H15 S21	L13-C17 PolarHBondContact O-N 3.29Å; L13-C17 VanDerWaalsContact O-N 3.07Å; A14-C17 PolarHBondContact O-N 2.71Å; H15-C17 VanDerWaalsContact C-N 3.32Å; H15-C17 PolarHBondContact O-N 3.21Å; C17-S21 WeakPolarHBondContact O-CB 3.45Å; C17-S21 PolarHBondContact O-N 3.01Å; C17-S21 PolarHBondContact O-OG 3.48Å
18	I	95.3	Very high	94.1	Very high	99 Å²	99	93.6 Å²	93.6	51%	0.508	48%	0.477	S	S	.	.	H	α-helix	trans	-66.4	-46.9	178.2	-63	170.5	0	0	0	110.4	A14 H15 K16 N20 S21 F22	A14-I18 PolarHBondContact O-N 3.4Å; H15-I18 PolarHBondContact O-N 3.45Å; H15-I18 VanDerWaalsContact O-N 3.15Å; K16-I18 VanDerWaalsContact C-N 3.35Å; K16-I18 PolarHBondContact O-N 2.86Å; I18-N20 PolarHBondContact O-N 3.35Å; I18-S21 WeakPolarHBondContact O-CA 3.46Å; I18-S21 WeakPolarHBondContact O-CB 3.38Å; I18-S21 PolarHBondContact O-N 3.49Å; I18-F22 HydrophobicContact CG2-CD2 4.47Å; I18-F22 HydrophobicContact CG2-CE2 3.89Å; I18-F22 WeakPolarHBondContact O-CD2 3.33Å; I18-F22 PolarHBondContact O-N 3.3Å
19	L	93.9	Very high	94.2	Very high	118 Å²	118	96.3 Å²	96.3	62%	0.618	49%	0.492	S	S	*	.	H	α-helix	trans	-56.6	-51.6	179	-175.5	64.2	0	0	0	111.3	H15 K16 S21 F22	H15-L19 WeakPolarHBondContact O-CB 3.45Å; H15-L19 PolarHBondContact O-N 2.83Å; K16-L19 PolarHBondContact O-N 2.83Å; L19-S21 PolarHBondContact O-N 3.26Å; L19-F22 WeakPolarHBondContact O-CB 3.43Å; L19-F22 PolarHBondContact O-N 2.92Å; L19-F22 VanDerWaalsContact O-N 3.11Å
20	N	91.8	Very high	94.4	Very high	96 Å²	96	96 Å²	96	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-27.8	177.7	-70	-12.2	0	0	0	112.5	K16 I18 F22 Y23 G24	K16-N20 WeakPolarHBondContact O-CB 3.34Å; K16-N20 VanDerWaalsContact O-CG 3.31Å; K16-N20 PolarHBondContact O-N 3.45Å; I18-N20 PolarHBondContact O-N 3.35Å; N20-F22 VanDerWaalsContact C-N 3.32Å; N20-F22 PolarHBondContact O-N 2.94Å; N20-Y23 PolarHBondContact O-N 3.42Å; N20-G24 PolarHBondContact O-N 2.82Å; N20-G24 VanDerWaalsContact O-N 3.17Å
21	S	94.8	Very high	94.7	Very high	72 Å²	72	93.4 Å²	93.4	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-70.1	-25.2	175.7	-62.2	0	0	0	0	112.8	C17 I18 L19 Y23 G24 Y25	C17-S21 WeakPolarHBondContact O-CB 3.45Å; C17-S21 PolarHBondContact O-N 3.01Å; C17-S21 PolarHBondContact O-OG 3.48Å; I18-S21 WeakPolarHBondContact O-CA 3.46Å; I18-S21 WeakPolarHBondContact O-CB 3.38Å; I18-S21 PolarHBondContact O-N 3.49Å; L19-S21 PolarHBondContact O-N 3.26Å; S21-Y23 VanDerWaalsContact C-N 3.34Å; S21-G24 PolarHBondContact O-N 3.01Å; S21-Y25 WeakPolarHBondContact O-CA 3.33Å; S21-Y25 WeakPolarHBondContact O-CB 3.28Å; S21-Y25 PolarHBondContact O-N 2.78Å
22	F	96.1	Very high	94.8	Very high	140 Å²	140	99.8 Å²	99.8	61%	0.614	51%	0.511	S	S	*	.	H	α-helix	trans	-62.1	-43.4	173.2	-78.9	-77.3	0	0	0	111.6	I18 L19 N20 Y25	I18-F22 HydrophobicContact CG2-CD2 4.47Å; I18-F22 HydrophobicContact CG2-CE2 3.89Å; I18-F22 WeakPolarHBondContact O-CD2 3.33Å; I18-F22 PolarHBondContact O-N 3.3Å; L19-F22 WeakPolarHBondContact O-CB 3.43Å; L19-F22 PolarHBondContact O-N 2.92Å; L19-F22 VanDerWaalsContact O-N 3.11Å; N20-F22 VanDerWaalsContact C-N 3.32Å; N20-F22 PolarHBondContact O-N 2.94Å; F22-Y25 PolarHBondContact O-N 2.97Å
23	Y	93.8	Very high	95.1	Very high	94 Å²	94	102.8 Å²	102.8	37%	0.369	52%	0.517	S	S	.	.	H	α-helix	trans	-64.6	-46.3	173.4	168.1	-104.8	0	0	0	111.6	N20 S21 Y25 V26 A39 V42 C43	N20-Y23 PolarHBondContact O-N 3.42Å; S21-Y23 VanDerWaalsContact C-N 3.34Å; Y23-Y25 VanDerWaalsContact C-N 3.26Å; Y23-Y25 PolarHBondContact O-N 2.93Å; Y23-V26 WeakPolarHBondContact O-CG2 3.49Å; Y23-A39 HydrophobicContact CE2-CB 4.08Å; Y23-V42 HydrophobicContact CD2-CB 4.12Å; Y23-V42 HydrophobicContact CD2-CG1 3.78Å; Y23-V42 HydrophobicContact CD2-CG2 4.48Å; Y23-V42 HydrophobicContact CE2-CB 3.86Å; Y23-V42 HydrophobicContact CE2-CG1 3.76Å; Y23-C43 PolarHBondContact OH-SG 3.47Å
24	G	93.4	Very high	95.4	Very high	41 Å²	41	103.4 Å²	103.4	42%	0.423	51%	0.513	S	S	.	.	H	α-helix	trans	-65.1	-28.3	177	0	0	0	0	0	113.9	N20 S21 V26 M27 R28	N20-G24 PolarHBondContact O-N 2.82Å; N20-G24 VanDerWaalsContact O-N 3.17Å; S21-G24 PolarHBondContact O-N 3.01Å; G24-V26 PolarHBondContact O-N 2.89Å; G24-M27 PolarHBondContact O-N 3.17Å; G24-R28 PolarHBondContact O-N 3.17Å
25	Y	97.3	Very high	95.6	Very high	67 Å²	67	102.5 Å²	102.5	26%	0.263	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-37.7	-176.3	174.5	-93.3	0	0	0	112.4	S21 F22 Y23 M27 R28 A31 R32 W33	S21-Y25 WeakPolarHBondContact O-CA 3.33Å; S21-Y25 WeakPolarHBondContact O-CB 3.28Å; S21-Y25 PolarHBondContact O-N 2.78Å; F22-Y25 PolarHBondContact O-N 2.97Å; Y23-Y25 VanDerWaalsContact C-N 3.26Å; Y23-Y25 PolarHBondContact O-N 2.93Å; Y25-M27 PolarHBondContact O-N 3.49Å; Y25-R28 VanDerWaalsContact O-CB 3.27Å; Y25-R28 WeakPolarHBondContact O-CB 3.36Å; Y25-R28 PolarHBondContact O-N 2.76Å; Y25-A31 HydrophobicContact CD1-CB 4.36Å; Y25-A31 HydrophobicContact CE1-CB 3.88Å; Y25-A31 HydrophobicContact CE2-CB 4.09Å; Y25-A31 WeakPolarHBondContact O-CB 3.33Å; Y25-R32 PolarHBondContact OH-N 3.22Å; Y25-W33 HydrophobicContact CE1-CB 4.25Å; Y25-W33 AromaticContact CE1-CE3 3.94Å; Y25-W33 HydrophobicContact CE1-CE3 3.94Å
26	V	96.9	Very high	95.6	Very high	13 Å²	13	101.9 Å²	101.9	8%	0.079	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.6	-177.6	-60.4	0	0	0	0	113.7	Y23 G24 Y34 S35 M38 A39	Y23-V26 WeakPolarHBondContact O-CG2 3.49Å; G24-V26 PolarHBondContact O-N 2.89Å; V26-Y34 CarbonylContact O-C 3.57Å; V26-Y34 VanDerWaalsContact O-CA 3.27Å; V26-Y34 WeakPolarHBondContact O-CA 3.23Å; V26-Y34 WeakPolarHBondContact O-CD2 3.39Å; V26-S35 PolarHBondContact O-N 3.48Å; V26-M38 HydrophobicContact CB-CE 4.05Å; V26-M38 HydrophobicContact CB-SD 4.46Å; V26-M38 HydrophobicContact CG1-CE 3.49Å; V26-M38 VanDerWaalsContact CG1-CE 3.49Å; V26-M38 HydrophobicContact CG1-SD 3.81Å; V26-M38 HydrophobicContact CG2-CE 3.53Å; V26-M38 HydrophobicContact CG2-SD 4.4Å; V26-A39 HydrophobicContact CG2-CB 3.98Å
27	M	96.5	Very high	95.8	Very high	79 Å²	79	103 Å²	103	39%	0.389	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	2.8	173.2	-73.1	-66.8	-73.4	0	0	113.1	G24 Y25 Y34 M36 A39	G24-M27 PolarHBondContact O-N 3.17Å; Y25-M27 PolarHBondContact O-N 3.49Å; M27-Y34 HydrophobicContact SD-CE2 4.3Å; M27-M36 HydrophobicContact CE-CE 4.26Å; M27-M36 HydrophobicContact CE-CG 4.07Å; M27-M36 VanDerWaalsContact SD-CA 3.53Å; M27-M36 HydrophobicContact SD-CB 3.88Å; M27-M36 HydrophobicContact SD-CG 3.97Å; M27-A39 HydrophobicContact CG-CB 3.53Å; M27-A39 HydrophobicContact SD-CB 4.14Å
28	R	96	Very high	96	Very high	165 Å²	165	102.9 Å²	102.9	62%	0.623	50%	0.502	S	S	*	.	S	Bend	trans	-73.6	133	-179	-178.6	-177.4	173.1	-170	-0.7	110.4	G24 Y25 G30 A31	G24-R28 PolarHBondContact O-N 3.17Å; Y25-R28 VanDerWaalsContact O-CB 3.27Å; Y25-R28 WeakPolarHBondContact O-CB 3.36Å; Y25-R28 PolarHBondContact O-N 2.76Å; R28-G30 PolarHBondContact O-N 3.04Å; R28-A31 HydrophobicContact CB-CB 4.27Å; R28-A31 WeakPolarHBondContact O-CB 3.42Å; R28-A31 PolarHBondContact O-N 3.05Å
29	K	95.1	Very high	96.1	Very high	200 Å²	200	98.4 Å²	98.4	87%	0.87	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	127.7	172.4	-65	-175.3	-179.8	-177.7	0	110.6	A31	K29-A31 VanDerWaalsContact C-N 3.3Å
30	G	94.9	Very high	96.2	Very high	83 Å²	83	94.7 Å²	94.7	86%	0.856	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	12.2	-177.7	0	0	0	0	0	114.8	R28	R28-G30 PolarHBondContact O-N 3.04Å
31	A	96.9	Very high	96.5	Very high	16 Å²	16	95.3 Å²	95.3	13%	0.132	47%	0.472	C	S	.	.			trans	-62.1	140	170.6	0	0	0	0	0	110.7	Y25 R28 K29 W33	Y25-A31 HydrophobicContact CD1-CB 4.36Å; Y25-A31 HydrophobicContact CE1-CB 3.88Å; Y25-A31 HydrophobicContact CE2-CB 4.09Å; Y25-A31 WeakPolarHBondContact O-CB 3.33Å; R28-A31 HydrophobicContact CB-CB 4.27Å; R28-A31 WeakPolarHBondContact O-CB 3.42Å; R28-A31 PolarHBondContact O-N 3.05Å; K29-A31 VanDerWaalsContact C-N 3.3Å; A31-W33 VanDerWaalsContact C-N 3.29Å
32	R	97.9	Very high	96.6	Very high	213 Å²	213	95.3 Å²	95.3	80%	0.804	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-32.8	175.8	-67.8	-177.2	179.1	-87.4	1.3	111.5	Y25	Y25-R32 PolarHBondContact OH-N 3.22Å
33	W	97.6	Very high	96.6	Very high	190 Å²	190	91.9 Å²	91.9	72%	0.72	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	65.9	177.1	-59.5	-76.5	0	0	0	110	Y25 A31	Y25-W33 HydrophobicContact CE1-CB 4.25Å; Y25-W33 AromaticContact CE1-CE3 3.94Å; Y25-W33 HydrophobicContact CE1-CE3 3.94Å; A31-W33 VanDerWaalsContact C-N 3.29Å
34	Y	97.8	Very high	96.7	Very high	116 Å²	116	93.9 Å²	93.9	46%	0.455	47%	0.472	S	S	.	.			trans	-79.9	128.5	174.9	-176.5	-83.9	0	0	0	110.2	V26 M27 M36	V26-Y34 CarbonylContact O-C 3.57Å; V26-Y34 VanDerWaalsContact O-CA 3.27Å; V26-Y34 WeakPolarHBondContact O-CA 3.23Å; V26-Y34 WeakPolarHBondContact O-CD2 3.39Å; M27-Y34 HydrophobicContact SD-CE2 4.3Å; Y34-M36 HydrophobicContact CE1-CB 4.4Å
35	S	97.7	Very high	96.9	Very high	32 Å²	32	94.2 Å²	94.2	22%	0.224	47%	0.466	C	S	.	.			trans	-151.9	116.6	171	176.1	0	0	0	0	110.6	V26 E37 M38	V26-S35 PolarHBondContact O-N 3.48Å; S35-E37 PolarHBondContact OG-OE2 3.1Å; S35-E37 VanDerWaalsContact OG-OE2 3.12Å; S35-M38 WeakPolarHBondContact OG-CB 3.33Å; S35-M38 PolarHBondContact OG-N 2.86Å; S35-M38 VanDerWaalsContact OG-N 3.1Å
36	M	97	Very high	96.9	Very high	108 Å²	108	92.6 Å²	92.6	53%	0.532	47%	0.469	S	S	.	.	H	α-helix	trans	-75	-34.6	176	-174.2	-178.2	-64	0	0	111.4	M27 Y34 A39 G40	M27-M36 HydrophobicContact CE-CE 4.26Å; M27-M36 HydrophobicContact CE-CG 4.07Å; M27-M36 VanDerWaalsContact SD-CA 3.53Å; M27-M36 HydrophobicContact SD-CB 3.88Å; M27-M36 HydrophobicContact SD-CG 3.97Å; Y34-M36 HydrophobicContact CE1-CB 4.4Å; M36-A39 PolarHBondContact O-N 3.32Å; M36-G40 PolarHBondContact O-N 2.88Å
37	E	97.9	Very high	96.9	Very high	137 Å²	137	94.1 Å²	94.1	64%	0.64	48%	0.484	S	S	*	.	H	α-helix	trans	-63.2	-47.3	179.1	-57.7	79.1	-175.8	0	0	110.5	S35 A39 G40 I41	S35-E37 PolarHBondContact OG-OE2 3.1Å; S35-E37 VanDerWaalsContact OG-OE2 3.12Å; E37-A39 VanDerWaalsContact C-N 3.34Å; E37-A39 PolarHBondContact O-N 2.87Å; E37-G40 PolarHBondContact O-N 3.31Å; E37-I41 VanDerWaalsContact O-CG1 3.31Å; E37-I41 WeakPolarHBondContact O-CG1 3.45Å; E37-I41 PolarHBondContact O-N 3.25Å
38	M	97.6	Very high	96.9	Very high	82 Å²	82	93.1 Å²	93.1	40%	0.404	48%	0.48	S	S	.	.	H	α-helix	trans	-58.9	-46.6	176.6	-168.8	-159.7	103.9	0	0	111.1	V26 S35 G40 I41 V42	V26-M38 HydrophobicContact CB-CE 4.05Å; V26-M38 HydrophobicContact CB-SD 4.46Å; V26-M38 HydrophobicContact CG1-CE 3.49Å; V26-M38 VanDerWaalsContact CG1-CE 3.49Å; V26-M38 HydrophobicContact CG1-SD 3.81Å; V26-M38 HydrophobicContact CG2-CE 3.53Å; V26-M38 HydrophobicContact CG2-SD 4.4Å; S35-M38 WeakPolarHBondContact OG-CB 3.33Å; S35-M38 PolarHBondContact OG-N 2.86Å; S35-M38 VanDerWaalsContact OG-N 3.1Å; M38-G40 VanDerWaalsContact C-N 3.34Å; M38-G40 PolarHBondContact O-N 3.38Å; M38-I41 PolarHBondContact O-N 2.88Å; M38-V42 WeakPolarHBondContact O-CG2 3.1Å; M38-V42 PolarHBondContact O-N 2.89Å; M38-V42 VanDerWaalsContact O-N 3.11Å
39	A	96.5	Very high	97	Very high	5 Å²	5	86 Å²	86	4%	0.041	45%	0.454	C	S	.	.	H	α-helix	trans	-63.3	-40.9	178.6	0	0	0	0	0	112.2	Y23 V26 M27 M36 E37 V42 C43	Y23-A39 HydrophobicContact CE2-CB 4.08Å; V26-A39 HydrophobicContact CG2-CB 3.98Å; M27-A39 HydrophobicContact CG-CB 3.53Å; M27-A39 HydrophobicContact SD-CB 4.14Å; M36-A39 PolarHBondContact O-N 3.32Å; E37-A39 VanDerWaalsContact C-N 3.34Å; E37-A39 PolarHBondContact O-N 2.87Å; A39-V42 PolarHBondContact O-N 3.48Å; A39-C43 PolarHBondContact O-N 2.59Å; A39-C43 VanDerWaalsContact O-N 3.07Å
40	G	97.3	Very high	97.1	Very high	39 Å²	39	76.8 Å²	76.8	40%	0.402	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-45.3	176.7	0	0	0	0	0	112.9	M36 E37 M38 C43 F44	M36-G40 PolarHBondContact O-N 2.88Å; E37-G40 PolarHBondContact O-N 3.31Å; M38-G40 VanDerWaalsContact C-N 3.34Å; M38-G40 PolarHBondContact O-N 3.38Å; G40-C43 PolarHBondContact O-N 3.37Å; G40-F44 WeakPolarHBondContact O-CB 3.46Å; G40-F44 PolarHBondContact O-N 3.47Å
41	I	97.6	Very high	97.2	Very high	110 Å²	110	75.5 Å²	75.5	56%	0.564	39%	0.389	S	S	*	.	H	α-helix	trans	-61.4	-46.2	177.8	-69.7	166.6	0	0	0	110.6	E37 M38 C43 F44 T45	E37-I41 VanDerWaalsContact O-CG1 3.31Å; E37-I41 WeakPolarHBondContact O-CG1 3.45Å; E37-I41 PolarHBondContact O-N 3.25Å; M38-I41 PolarHBondContact O-N 2.88Å; I41-C43 PolarHBondContact O-N 3.11Å; I41-F44 PolarHBondContact O-N 3.16Å; I41-T45 WeakPolarHBondContact O-CB 3.5Å; I41-T45 PolarHBondContact O-N 2.92Å; I41-T45 PolarHBondContact O-OG1 2.92Å; I41-T45 VanDerWaalsContact O-OG1 3.04Å
42	V	96.5	Very high	97.2	Very high	71 Å²	71	78.5 Å²	78.5	43%	0.43	40%	0.401	S	S	.	.	H	α-helix	trans	-59.7	-47.2	177.7	172	0	0	0	0	111.2	Y23 M38 A39 F44 G46	Y23-V42 HydrophobicContact CD2-CB 4.12Å; Y23-V42 HydrophobicContact CD2-CG1 3.78Å; Y23-V42 HydrophobicContact CD2-CG2 4.48Å; Y23-V42 HydrophobicContact CE2-CB 3.86Å; Y23-V42 HydrophobicContact CE2-CG1 3.76Å; M38-V42 WeakPolarHBondContact O-CG2 3.1Å; M38-V42 PolarHBondContact O-N 2.89Å; M38-V42 VanDerWaalsContact O-N 3.11Å; A39-V42 PolarHBondContact O-N 3.48Å; V42-F44 PolarHBondContact O-N 2.92Å; V42-G46 PolarHBondContact O-N 3.48Å
43	C	95.8	Very high	97.2	Very high	69 Å²	69	68.4 Å²	68.4	47%	0.466	36%	0.363	S	S	.	.	H	α-helix	trans	-58.5	-48.3	176	-84.5	0	0	0	0	112.8	Y23 A39 G40 I41 G46 A47	Y23-C43 PolarHBondContact OH-SG 3.47Å; A39-C43 PolarHBondContact O-N 2.59Å; A39-C43 VanDerWaalsContact O-N 3.07Å; G40-C43 PolarHBondContact O-N 3.37Å; I41-C43 PolarHBondContact O-N 3.11Å; C43-G46 PolarHBondContact O-N 3.47Å; C43-A47 WeakPolarHBondContact O-CB 3.17Å; C43-A47 PolarHBondContact O-N 3.28Å
44	F	97.1	Very high	97.2	Very high	135 Å²	135	63 Å²	63	59%	0.592	34%	0.342	S	S	*	.	H	α-helix	trans	-65.4	-45.8	-176.3	179.5	-104.8	0	0	0	111.5	G40 I41 V42 A47 N48	G40-F44 WeakPolarHBondContact O-CB 3.46Å; G40-F44 PolarHBondContact O-N 3.47Å; I41-F44 PolarHBondContact O-N 3.16Å; V42-F44 PolarHBondContact O-N 2.92Å; F44-A47 PolarHBondContact O-N 3.25Å; F44-N48 WeakPolarHBondContact CE1-ND2 3.31Å; F44-N48 VanDerWaalsContact CZ-ND2 3.3Å; F44-N48 WeakPolarHBondContact CZ-ND2 3.36Å; F44-N48 PolarHBondContact O-N 2.89Å
45	T	97.6	Very high	97.2	Very high	49 Å²	49	61.7 Å²	61.7	30%	0.301	34%	0.34	S	S	.	.	H	α-helix	trans	-62.1	-45.6	176.7	-59.4	0	0	0	0	111.3	I41 A47 N48 I49 F112	I41-T45 WeakPolarHBondContact O-CB 3.5Å; I41-T45 PolarHBondContact O-N 2.92Å; I41-T45 PolarHBondContact O-OG1 2.92Å; I41-T45 VanDerWaalsContact O-OG1 3.04Å; T45-A47 PolarHBondContact O-N 3.4Å; T45-N48 PolarHBondContact O-N 3.16Å; T45-I49 HydrophobicContact CG2-CD1 3.99Å; T45-I49 WeakPolarHBondContact O-CG1 3.5Å; T45-I49 PolarHBondContact O-N 2.62Å; T45-F112 HydrophobicContact CG2-CD1 4.11Å; T45-F112 HydrophobicContact CG2-CE1 4.5Å
46	G	96.9	Very high	97.1	Very high	32 Å²	32	62.4 Å²	62.4	33%	0.33	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-43	176.1	0	0	0	0	0	113	V42 C43 N48 I49 I50	V42-G46 PolarHBondContact O-N 3.48Å; C43-G46 PolarHBondContact O-N 3.47Å; G46-N48 VanDerWaalsContact C-N 3.33Å; G46-N48 PolarHBondContact O-N 3.4Å; G46-I49 PolarHBondContact O-N 3.31Å; G46-I50 PolarHBondContact O-N 2.71Å
47	A	96.5	Very high	97.1	Very high	46 Å²	46	57.5 Å²	57.5	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-39	175.6	0	0	0	0	0	112.4	C43 F44 T45 I50 T51	C43-A47 WeakPolarHBondContact O-CB 3.17Å; C43-A47 PolarHBondContact O-N 3.28Å; F44-A47 PolarHBondContact O-N 3.25Å; T45-A47 PolarHBondContact O-N 3.4Å; A47-I50 WeakPolarHBondContact O-CG2 3.47Å; A47-T51 VanDerWaalsContact O-CB 3.25Å; A47-T51 WeakPolarHBondContact O-CB 3.49Å; A47-T51 PolarHBondContact O-N 2.94Å; A47-T51 PolarHBondContact O-OG1 3.47Å
48	N	97.4	Very high	97.1	Very high	57 Å²	57	55 Å²	55	31%	0.305	31%	0.305	S	S	.	.	H	α-helix	trans	-67.1	-44.3	176.4	-71.9	-14.2	0	0	0	111.8	F44 T45 G46 T51 Q52 F112	F44-N48 WeakPolarHBondContact CE1-ND2 3.31Å; F44-N48 VanDerWaalsContact CZ-ND2 3.3Å; F44-N48 WeakPolarHBondContact CZ-ND2 3.36Å; F44-N48 PolarHBondContact O-N 2.89Å; T45-N48 PolarHBondContact O-N 3.16Å; G46-N48 VanDerWaalsContact C-N 3.33Å; G46-N48 PolarHBondContact O-N 3.4Å; N48-T51 PolarHBondContact O-N 2.97Å; N48-Q52 WeakPolarHBondContact O-CG 3.17Å; N48-Q52 PolarHBondContact O-N 2.57Å; N48-F112 HydrophobicContact CB-CE1 4.1Å; N48-F112 HydrophobicContact CB-CZ 4.24Å
49	I	98.1	Very high	97	Very high	15 Å²	15	58.3 Å²	58.3	8%	0.077	32%	0.32	C	S	.	.	H	α-helix	trans	-57.7	-52.2	177.5	-68.6	164.6	0	0	0	110.5	T45 G46 T51 Q52 A53 V108 F112 I136 F138	T45-I49 HydrophobicContact CG2-CD1 3.99Å; T45-I49 WeakPolarHBondContact O-CG1 3.5Å; T45-I49 PolarHBondContact O-N 2.62Å; G46-I49 PolarHBondContact O-N 3.31Å; I49-T51 VanDerWaalsContact C-N 3.29Å; I49-T51 PolarHBondContact O-N 3.02Å; I49-Q52 PolarHBondContact O-N 2.98Å; I49-A53 WeakPolarHBondContact O-CB 3.24Å; I49-A53 PolarHBondContact O-N 3.42Å; I49-V108 HydrophobicContact CG2-CG2 3.97Å; I49-F112 HydrophobicContact CB-CE2 4.4Å; I49-F112 HydrophobicContact CB-CZ 4.24Å; I49-F112 HydrophobicContact CD1-CD1 4Å; I49-F112 HydrophobicContact CD1-CE1 4.32Å; I49-F112 HydrophobicContact CD1-CG 4.12Å; I49-F112 HydrophobicContact CG1-CD1 3.53Å; I49-F112 HydrophobicContact CG1-CD2 3.77Å; I49-F112 HydrophobicContact CG1-CE1 3.42Å; I49-F112 VanDerWaalsContact CG1-CE1 3.42Å; I49-F112 HydrophobicContact CG1-CE2 3.67Å; I49-F112 HydrophobicContact CG1-CG 3.69Å; I49-F112 HydrophobicContact CG1-CZ 3.49Å; I49-F112 VanDerWaalsContact CG1-CZ 3.49Å; I49-I136 HydrophobicContact CD1-CD1 3.79Å; I49-I136 HydrophobicContact CD1-CG2 4.33Å; I49-F138 HydrophobicContact CG2-CE2 4Å; I49-F138 HydrophobicContact CG2-CZ 4.1Å
50	I	97.5	Very high	97	Very high	7 Å²	7	60.4 Å²	60.4	4%	0.036	33%	0.33	C	S	.	.	H	α-helix	trans	-69.1	-30.1	-176.4	-156.1	65.1	0	0	0	112.1	G46 A47 R54 L66 D69 I71 F138	G46-I50 PolarHBondContact O-N 2.71Å; A47-I50 WeakPolarHBondContact O-CG2 3.47Å; I50-R54 WeakPolarHBondContact O-CB 3.38Å; I50-R54 PolarHBondContact O-N 3.48Å; I50-L66 HydrophobicContact CG1-CD1 4Å; I50-L66 HydrophobicContact CG1-CD2 4.05Å; I50-L66 HydrophobicContact CG1-CG 3.96Å; I50-L66 HydrophobicContact CG2-CD1 4.42Å; I50-L66 HydrophobicContact CG2-CD2 4.19Å; I50-D69 WeakPolarHBondContact CD1-O 3.32Å; I50-I71 HydrophobicContact CD1-CD1 3.79Å; I50-I71 HydrophobicContact CD1-CG1 3.63Å; I50-I71 HydrophobicContact CG1-CD1 4.19Å; I50-I71 HydrophobicContact CG1-CG1 4.01Å; I50-F138 HydrophobicContact CD1-CE1 3.83Å; I50-F138 HydrophobicContact CD1-CZ 3.91Å
51	T	96.5	Very high	96.9	Very high	56 Å²	56	59.4 Å²	59.4	34%	0.344	32%	0.32	S	S	.	.	H	α-helix	trans	-67.4	-46.9	175.6	-60.7	0	0	0	0	111.1	A47 N48 I49 R54 E55	A47-T51 VanDerWaalsContact O-CB 3.25Å; A47-T51 WeakPolarHBondContact O-CB 3.49Å; A47-T51 PolarHBondContact O-N 2.94Å; A47-T51 PolarHBondContact O-OG1 3.47Å; N48-T51 PolarHBondContact O-N 2.97Å; I49-T51 VanDerWaalsContact C-N 3.29Å; I49-T51 PolarHBondContact O-N 3.02Å; T51-R54 WeakPolarHBondContact O-CB 3.44Å; T51-R54 PolarHBondContact O-N 2.93Å; T51-E55 WeakPolarHBondContact O-CG 3.32Å; T51-E55 PolarHBondContact O-N 3.44Å
52	Q	97.2	Very high	96.9	Very high	80 Å²	80	62.8 Å²	62.8	37%	0.374	33%	0.326	S	S	.	.	H	α-helix	trans	-64	-40.9	176.2	-70.1	-176.6	26.2	0	0	111.8	N48 I49 R54 E55 L56 M107	N48-Q52 WeakPolarHBondContact O-CG 3.17Å; N48-Q52 PolarHBondContact O-N 2.57Å; I49-Q52 PolarHBondContact O-N 2.98Å; Q52-R54 PolarHBondContact O-N 2.59Å; Q52-E55 PolarHBondContact O-N 3.08Å; Q52-L56 PolarHBondContact O-N 3.28Å; Q52-M107 HydrophobicContact CB-CE 4.41Å; Q52-M107 HydrophobicContact CB-SD 4Å
53	A	97.7	Very high	96.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-46.4	173.7	0	0	0	0	0	111.7	I49 L56 I57 I71 L104 M107 F138	I49-A53 WeakPolarHBondContact O-CB 3.24Å; I49-A53 PolarHBondContact O-N 3.42Å; A53-L56 PolarHBondContact O-N 3.45Å; A53-I57 VanDerWaalsContact O-CG1 3.3Å; A53-I57 WeakPolarHBondContact O-CG1 3.46Å; A53-I57 PolarHBondContact O-N 3.23Å; A53-I71 HydrophobicContact CB-CD1 3.72Å; A53-L104 HydrophobicContact CB-CD2 3.88Å; A53-M107 HydrophobicContact CB-CE 3.78Å; A53-F138 HydrophobicContact CB-CE2 4.03Å; A53-F138 HydrophobicContact CB-CZ 3.72Å
54	R	97.1	Very high	96.8	Very high	76 Å²	76	60.1 Å²	60.1	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-46.4	176.6	-177.6	-157.4	66.9	105.9	5.4	111.7	I50 T51 Q52 L56 I57 E58 P63 L66 I71	I50-R54 WeakPolarHBondContact O-CB 3.38Å; I50-R54 PolarHBondContact O-N 3.48Å; T51-R54 WeakPolarHBondContact O-CB 3.44Å; T51-R54 PolarHBondContact O-N 2.93Å; Q52-R54 PolarHBondContact O-N 2.59Å; R54-L56 VanDerWaalsContact C-N 3.26Å; R54-L56 PolarHBondContact O-N 3.32Å; R54-I57 PolarHBondContact O-N 2.92Å; R54-I57 VanDerWaalsContact O-N 3.16Å; R54-E58 HydrophobicContact CG-CG 4.45Å; R54-E58 IonicContact CZ-OE1 3.59Å; R54-E58 IonicContact CZ-OE2 3.68Å; R54-E58 IonicContact NE-OE1 3.66Å; R54-E58 IonicContact NH1-OE1 3.36Å; R54-E58 PolarHBondContact NH1-OE1 3.45Å; R54-E58 IonicContact NH1-OE2 2.65Å; R54-E58 PolarHBondContact NH1-OE2 3.28Å; R54-E58 IonicContact NH2-OE2 3.71Å; R54-E58 WeakPolarHBondContact O-CG 3.35Å; R54-E58 PolarHBondContact O-N 2.96Å; R54-P63 HydrophobicContact CG-CB 4.4Å; R54-P63 HydrophobicContact CG-CG 4.31Å; R54-L66 HydrophobicContact CB-CD1 4.12Å; R54-L66 HydrophobicContact CG-CD1 4.29Å; R54-I71 HydrophobicContact CB-CD1 4.01Å
55	E	96.8	Very high	96.7	Very high	90 Å²	90	54.6 Å²	54.6	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-35.1	179.5	-74.2	171.7	-178.4	0	0	112.6	T51 Q52 Q59	T51-E55 WeakPolarHBondContact O-CG 3.32Å; T51-E55 PolarHBondContact O-N 3.44Å; Q52-E55 PolarHBondContact O-N 3.08Å; E55-Q59 WeakPolarHBondContact O-CG 3.32Å; E55-Q59 PolarHBondContact O-NE2 2.86Å
56	L	96.6	Very high	96.4	Very high	46 Å²	46	55.2 Å²	55.2	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-45.9	173.2	-174.9	60.8	0	0	0	111.4	Q52 A53 R54 E58 Q59 M103 L104	Q52-L56 PolarHBondContact O-N 3.28Å; A53-L56 PolarHBondContact O-N 3.45Å; R54-L56 VanDerWaalsContact C-N 3.26Å; R54-L56 PolarHBondContact O-N 3.32Å; L56-E58 VanDerWaalsContact C-N 3.28Å; L56-E58 PolarHBondContact O-N 3.47Å; L56-Q59 PolarHBondContact O-N 2.85Å; L56-Q59 VanDerWaalsContact O-N 3.14Å; L56-M103 HydrophobicContact CD2-CE 3.63Å; L56-M103 HydrophobicContact CD2-CG 3.96Å; L56-M103 HydrophobicContact CD2-SD 3.88Å; L56-M103 HydrophobicContact CG-CE 4Å; L56-M103 HydrophobicContact CG-SD 4.28Å; L56-L104 HydrophobicContact CD2-CD2 4.15Å
57	I	96.9	Very high	95.9	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-35.9	177.7	-67.6	-65.7	0	0	0	111.8	A53 R54 Q59 I60 G61 P63 C73	A53-I57 VanDerWaalsContact O-CG1 3.3Å; A53-I57 WeakPolarHBondContact O-CG1 3.46Å; A53-I57 PolarHBondContact O-N 3.23Å; R54-I57 PolarHBondContact O-N 2.92Å; R54-I57 VanDerWaalsContact O-N 3.16Å; I57-Q59 PolarHBondContact O-N 3.49Å; I57-I60 HydrophobicContact CD1-CD1 4.23Å; I57-I60 PolarHBondContact O-N 3.07Å; I57-G61 CarbonylContact O-C 3.6Å; I57-G61 WeakPolarHBondContact O-CA 3.44Å; I57-G61 PolarHBondContact O-N 3.31Å; I57-P63 HydrophobicContact CG2-CB 4.41Å; I57-C73 HydrophobicContact CG2-CB 3.6Å
58	E	97	Very high	95.5	Very high	84 Å²	84	57.8 Å²	57.8	39%	0.393	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-24.1	176.9	-77.3	178.1	170.7	0	0	113.9	R54 L56 P63	R54-E58 HydrophobicContact CG-CG 4.45Å; R54-E58 IonicContact CZ-OE1 3.59Å; R54-E58 IonicContact CZ-OE2 3.68Å; R54-E58 IonicContact NE-OE1 3.66Å; R54-E58 IonicContact NH1-OE1 3.36Å; R54-E58 PolarHBondContact NH1-OE1 3.45Å; R54-E58 IonicContact NH1-OE2 2.65Å; R54-E58 PolarHBondContact NH1-OE2 3.28Å; R54-E58 IonicContact NH2-OE2 3.71Å; R54-E58 WeakPolarHBondContact O-CG 3.35Å; R54-E58 PolarHBondContact O-N 2.96Å; L56-E58 VanDerWaalsContact C-N 3.28Å; L56-E58 PolarHBondContact O-N 3.47Å; E58-P63 HydrophobicContact CG-CG 3.47Å; E58-P63 VanDerWaalsContact CG-CG 3.47Å; E58-P63 WeakPolarHBondContact OE1-CG 3.35Å
59	Q	96.7	Very high	95.1	Very high	153 Å²	153	61.1 Å²	61.1	72%	0.715	31%	0.305	S	S	*	.	H	α-helix	trans	-82.7	-23.6	178.1	-66.9	171.8	59.3	0	0	112.7	E55 L56 I57	E55-Q59 WeakPolarHBondContact O-CG 3.32Å; E55-Q59 PolarHBondContact O-NE2 2.86Å; L56-Q59 PolarHBondContact O-N 2.85Å; L56-Q59 VanDerWaalsContact O-N 3.14Å; I57-Q59 PolarHBondContact O-N 3.49Å
60	I	95.5	Very high	94.9	Very high	48 Å²	48	61.9 Å²	61.9	25%	0.246	32%	0.316	C	S	.	.	H	α-helix	trans	-114.9	-11.6	-174.1	63.4	166.4	0	0	0	113.8	I57 L75 P76 F79 M103	I57-I60 HydrophobicContact CD1-CD1 4.23Å; I57-I60 PolarHBondContact O-N 3.07Å; I60-L75 HydrophobicContact CD1-CD2 4.08Å; I60-L75 HydrophobicContact CG1-CD2 4.03Å; I60-P76 VanDerWaalsContact O-CD 3.29Å; I60-P76 WeakPolarHBondContact O-CD 3.36Å; I60-F79 HydrophobicContact CB-CE2 4.08Å; I60-F79 HydrophobicContact CD1-CE1 4.28Å; I60-F79 HydrophobicContact CD1-CE2 3.92Å; I60-F79 HydrophobicContact CD1-CZ 3.59Å; I60-F79 HydrophobicContact CG2-CE2 4.42Å; I60-M103 HydrophobicContact CD1-CE 3.69Å; I60-M103 HydrophobicContact CD1-SD 4.14Å
61	G	96.3	Very high	94.9	Very high	19 Å²	19	63.2 Å²	63.2	20%	0.196	32%	0.323	C	S	.	.	S	Bend	trans	-167	-151.8	-176.8	0	0	0	0	0	112	I57 V74	I57-G61 CarbonylContact O-C 3.6Å; I57-G61 WeakPolarHBondContact O-CA 3.44Å; I57-G61 PolarHBondContact O-N 3.31Å; G61-V74 WeakPolarHBondContact CA-O 3.48Å
62	R	97	Very high	94.9	Very high	180 Å²	180	62.7 Å²	62.7	68%	0.679	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	114.7	-177.9	-62.9	173	62.8	-172.9	-1	110.6	C73 V74	R62-C73 WeakPolarHBondContact O-CA 3.43Å; R62-C73 WeakPolarHBondContact O-CB 3.48Å; R62-V74 HydrophobicContact CB-CG2 3.8Å; R62-V74 PolarHBondContact N-O 3.41Å; R62-V74 PolarHBondContact O-N 3.1Å
63	P	96.2	Very high	94.9	Very high	38 Å²	38	61 Å²	61	25%	0.247	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	139.2	168.8	31.6	-35.3	0	0	0	110	R54 I57 E58 I71	R54-P63 HydrophobicContact CG-CB 4.4Å; R54-P63 HydrophobicContact CG-CG 4.31Å; I57-P63 HydrophobicContact CG2-CB 4.41Å; E58-P63 HydrophobicContact CG-CG 3.47Å; E58-P63 VanDerWaalsContact CG-CG 3.47Å; E58-P63 WeakPolarHBondContact OE1-CG 3.35Å; P63-I71 HydrophobicContact CB-CG2 4.18Å
64	L	94.7	Very high	94.8	Very high	47 Å²	47	64.4 Å²	64.4	25%	0.246	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-50.9	-178.7	-60.1	-176.6	0	0	0	111.2	W72 V74 M147 L149	L64-W72 HydrophobicContact CB-CB 4.42Å; L64-W72 PolarHBondContact N-O 2.81Å; L64-V74 HydrophobicContact CD1-CG1 3.81Å; L64-V74 HydrophobicContact CD2-CG2 4.33Å; L64-V74 HydrophobicContact CG-CG1 4.48Å; L64-M147 HydrophobicContact CB-SD 4.41Å; L64-M147 HydrophobicContact CD1-SD 3.77Å; L64-L149 HydrophobicContact CB-CD1 4.19Å; L64-L149 HydrophobicContact CB-CD2 4.23Å; L64-L149 HydrophobicContact CD1-CD1 4.11Å
65	E	93.8	Very high	94.8	Very high	18 Å²	18	63.3 Å²	63.3	8%	0.084	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	144.6	-179.2	-177.6	68.7	175.9	0	0	109.8	W72 M147 L149 K160 K161 Y163	E65-W72 HydrophobicContact CB-CB 4.25Å; E65-W72 PolarHBondContact N-O 2.78Å; E65-W72 PolarHBondContact O-N 2.68Å; E65-M147 HydrophobicContact CB-CE 4.43Å; E65-L149 HydrophobicContact CB-CD2 3.9Å; E65-K160 VanDerWaalsContact OE1-CA 3.25Å; E65-K160 WeakPolarHBondContact OE1-CA 3.3Å; E65-K161 PolarHBondContact OE1-N 3.04Å; E65-Y163 HydrophobicContact CG-CD1 4.13Å; E65-Y163 HydrophobicContact CG-CE1 4.14Å
66	L	92.4	Very high	94.8	Very high	62 Å²	62	62.1 Å²	62.1	33%	0.325	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.2	175.8	-173.2	162.6	0	0	0	108.3	I50 R54 G70 I71	I50-L66 HydrophobicContact CG1-CD1 4Å; I50-L66 HydrophobicContact CG1-CD2 4.05Å; I50-L66 HydrophobicContact CG1-CG 3.96Å; I50-L66 HydrophobicContact CG2-CD1 4.42Å; I50-L66 HydrophobicContact CG2-CD2 4.19Å; R54-L66 HydrophobicContact CB-CD1 4.12Å; R54-L66 HydrophobicContact CG-CD1 4.29Å; L66-G70 WeakPolarHBondContact CA-O 3.43Å; L66-I71 HydrophobicContact CD1-CG1 4.34Å; L66-I71 HydrophobicContact CG-CG1 4.24Å
67	D	86.9	Confident	94.6	Very high	30 Å²	30	68.2 Å²	68.2	16%	0.16	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	102.1	178.5	-165.9	13.6	0	0	0	110.6	D69 G70 K161	D67-D69 PolarHBondContact O-N 3.41Å; D67-G70 PolarHBondContact N-O 3.3Å; D67-G70 PolarHBondContact O-N 3.15Å; D67-K161 IonicContact OD1-NZ 3.57Å; D67-K161 PolarHBondContact OD1-NZ 3.49Å; D67-K161 IonicContact OD2-NZ 2.86Å
68	T	86.6	Confident	94.6	Very high	103 Å²	103	73.5 Å²	73.5	63%	0.632	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	-70.2	177.3	-62.3	0	0	0	0	115.5
69	D	90.3	Very high	94.5	Very high	127 Å²	127	71.7 Å²	71.7	68%	0.679	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	-2.3	-173.7	57.1	-10.2	0	0	0	113.2	I50 D67	I50-D69 WeakPolarHBondContact CD1-O 3.32Å; D67-D69 PolarHBondContact O-N 3.41Å
70	G	94.4	Very high	94.4	Very high	30 Å²	30	67 Å²	67	31%	0.309	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	148.1	178.2	0	0	0	0	0	113.9	L66 D67	L66-G70 WeakPolarHBondContact CA-O 3.43Å; D67-G70 PolarHBondContact N-O 3.3Å; D67-G70 PolarHBondContact O-N 3.15Å
71	I	95.9	Very high	94.2	Very high	36 Å²	36	68.7 Å²	68.7	19%	0.185	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	117.3	173.1	-58.7	167.9	0	0	0	108.5	I50 A53 R54 P63 L66 C73	I50-I71 HydrophobicContact CD1-CD1 3.79Å; I50-I71 HydrophobicContact CD1-CG1 3.63Å; I50-I71 HydrophobicContact CG1-CD1 4.19Å; I50-I71 HydrophobicContact CG1-CG1 4.01Å; A53-I71 HydrophobicContact CB-CD1 3.72Å; R54-I71 HydrophobicContact CB-CD1 4.01Å; P63-I71 HydrophobicContact CB-CG2 4.18Å; L66-I71 HydrophobicContact CD1-CG1 4.34Å; L66-I71 HydrophobicContact CG-CG1 4.24Å; I71-C73 HydrophobicContact CG2-CB 4.22Å
72	W	96.6	Very high	94.1	Very high	44 Å²	44	71.7 Å²	71.7	17%	0.167	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	125.8	162.7	-71.7	100.3	0	0	0	108.6	L64 E65 Y144 M147 Y163 V165	L64-W72 HydrophobicContact CB-CB 4.42Å; L64-W72 PolarHBondContact N-O 2.81Å; E65-W72 HydrophobicContact CB-CB 4.25Å; E65-W72 PolarHBondContact N-O 2.78Å; E65-W72 PolarHBondContact O-N 2.68Å; W72-Y144 HydrophobicContact CH2-CD2 4.23Å; W72-Y144 AromaticContact CH2-CE2 3.67Å; W72-Y144 HydrophobicContact CH2-CE2 3.67Å; W72-Y144 AromaticContact CZ3-CD2 3.63Å; W72-Y144 HydrophobicContact CZ3-CD2 3.63Å; W72-Y144 AromaticContact CZ3-CE2 3.48Å; W72-Y144 HydrophobicContact CZ3-CE2 3.48Å; W72-Y144 VanDerWaalsContact CZ3-CE2 3.48Å; W72-M147 HydrophobicContact CB-CE 3.61Å; W72-M147 HydrophobicContact CB-SD 3.79Å; W72-M147 HydrophobicContact CD2-CE 3.74Å; W72-M147 HydrophobicContact CD2-SD 3.99Å; W72-M147 HydrophobicContact CE3-CE 4.27Å; W72-M147 HydrophobicContact CE3-SD 3.92Å; W72-M147 HydrophobicContact CG-CE 3.41Å; W72-M147 VanDerWaalsContact CG-CE 3.41Å; W72-M147 HydrophobicContact CG-SD 3.95Å; W72-Y163 HydrophobicContact CZ2-CE2 4.34Å; W72-Y163 AromaticContact NE1-CE2 3.64Å; W72-Y163 AromaticContact NE1-CZ 3.61Å; W72-V165 HydrophobicContact CE3-CG2 4.33Å; W72-V165 HydrophobicContact CH2-CB 4.27Å; W72-V165 HydrophobicContact CH2-CG1 3.93Å; W72-V165 HydrophobicContact CH2-CG2 3.72Å; W72-V165 HydrophobicContact CZ2-CG2 3.98Å; W72-V165 HydrophobicContact CZ3-CG1 3.89Å; W72-V165 HydrophobicContact CZ3-CG2 3.89Å
73	C	96.8	Very high	94	Very high	45 Å²	45	67.8 Å²	67.8	30%	0.304	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	162.2	179.6	66.5	0	0	0	0	111.9	I57 R62 I71	I57-C73 HydrophobicContact CG2-CB 3.6Å; R62-C73 WeakPolarHBondContact O-CA 3.43Å; R62-C73 WeakPolarHBondContact O-CB 3.48Å; I71-C73 HydrophobicContact CG2-CB 4.22Å
74	V	96.8	Very high	93.9	Very high	71 Å²	71	70.1 Å²	70.1	43%	0.43	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.4	167.2	-68.6	0	0	0	0	108.9	G61 R62 L64	G61-V74 WeakPolarHBondContact CA-O 3.48Å; R62-V74 HydrophobicContact CB-CG2 3.8Å; R62-V74 PolarHBondContact N-O 3.41Å; R62-V74 PolarHBondContact O-N 3.1Å; L64-V74 HydrophobicContact CD1-CG1 3.81Å; L64-V74 HydrophobicContact CD2-CG2 4.33Å; L64-V74 HydrophobicContact CG-CG1 4.48Å
75	L	96.4	Very high	93.9	Very high	53 Å²	53	73.2 Å²	73.2	28%	0.277	41%	0.407	S	S	.	.			trans	-108.3	154.7	173.2	-59.4	-178.6	0	0	0	109	I60 F79 P100	I60-L75 HydrophobicContact CD1-CD2 4.08Å; I60-L75 HydrophobicContact CG1-CD2 4.03Å; L75-F79 HydrophobicContact CB-CB 4.3Å; L75-F79 HydrophobicContact CB-CG 4.46Å; L75-F79 HydrophobicContact CD1-CD1 3.84Å; L75-F79 HydrophobicContact CD1-CE1 4.09Å; L75-F79 HydrophobicContact CD1-CG 4.46Å; L75-P100 HydrophobicContact CD1-CB 4.34Å; L75-P100 HydrophobicContact CD1-CG 4.15Å
76	P	96.6	Very high	93.9	Very high	66 Å²	66	81.3 Å²	81.3	43%	0.429	44%	0.442	S	S	.	.			trans	-55.7	141.8	172.9	-24.4	34	0	0	0	111.5	I60 S78 F79	I60-P76 VanDerWaalsContact O-CD 3.29Å; I60-P76 WeakPolarHBondContact O-CD 3.36Å; P76-S78 PolarHBondContact O-N 3.27Å; P76-S78 VanDerWaalsContact O-N 3.1Å; P76-F79 HydrophobicContact CB-CB 4.48Å; P76-F79 WeakPolarHBondContact O-CB 3.23Å; P76-F79 PolarHBondContact O-N 2.9Å
77	N	93.7	Very high	93.9	Very high	174 Å²	174	81 Å²	81	93%	0.93	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.2	178.8	-172.5	61.4	0	0	0	113.5	F79	N77-F79 VanDerWaalsContact C-N 3.3Å
78	S	95.6	Very high	94.2	Very high	115 Å²	115	86.7 Å²	86.7	80%	0.804	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-1	174.9	60.1	0	0	0	0	113.7	P76	P76-S78 PolarHBondContact O-N 3.27Å; P76-S78 VanDerWaalsContact O-N 3.1Å
79	F	95.8	Very high	94.4	Very high	47 Å²	47	86 Å²	86	21%	0.206	47%	0.471	C	S	.	.	S	Bend	trans	-71.6	140.7	-179.3	-167.3	-93.9	0	0	0	110.5	I60 L75 P76 N77 E81 Y99 P100	I60-F79 HydrophobicContact CB-CE2 4.08Å; I60-F79 HydrophobicContact CD1-CE1 4.28Å; I60-F79 HydrophobicContact CD1-CE2 3.92Å; I60-F79 HydrophobicContact CD1-CZ 3.59Å; I60-F79 HydrophobicContact CG2-CE2 4.42Å; L75-F79 HydrophobicContact CB-CB 4.3Å; L75-F79 HydrophobicContact CB-CG 4.46Å; L75-F79 HydrophobicContact CD1-CD1 3.84Å; L75-F79 HydrophobicContact CD1-CE1 4.09Å; L75-F79 HydrophobicContact CD1-CG 4.46Å; P76-F79 HydrophobicContact CB-CB 4.48Å; P76-F79 WeakPolarHBondContact O-CB 3.23Å; P76-F79 PolarHBondContact O-N 2.9Å; N77-F79 VanDerWaalsContact C-N 3.3Å; F79-E81 PolarHBondContact O-N 3.24Å; F79-Y99 AromaticContact CE1-CD1 3.86Å; F79-Y99 HydrophobicContact CE1-CD1 3.86Å; F79-Y99 HydrophobicContact CE1-CE1 4.1Å; F79-Y99 HydrophobicContact CZ-CD1 4.17Å; F79-Y99 AromaticContact CZ-CE1 3.91Å; F79-Y99 HydrophobicContact CZ-CE1 3.91Å; F79-P100 HydrophobicContact CD1-CG 4.33Å; F79-P100 HydrophobicContact CE1-CG 4.04Å
80	P	94.5	Very high	94.4	Very high	55 Å²	55	86.6 Å²	86.6	36%	0.357	48%	0.479	S	S	.	.			trans	-62.6	126.2	180	-20.5	32	0	0	0	111.9	F83 Y99 P100	P80-F83 HydrophobicContact CB-CE2 3.76Å; P80-F83 HydrophobicContact CB-CZ 3.85Å; P80-Y99 HydrophobicContact CB-CD1 3.88Å; P80-Y99 HydrophobicContact CB-CE1 4.42Å; P80-Y99 HydrophobicContact CB-CG 4.14Å; P80-Y99 HydrophobicContact CG-CD1 4.38Å; P80-Y99 HydrophobicContact CG-CE1 4.46Å; P80-P100 WeakPolarHBondContact O-CD 3.29Å
81	E	91.1	Very high	94.2	Very high	82 Å²	82	94.3 Å²	94.3	38%	0.383	50%	0.504	S	S	.	.			trans	-108.1	-96.2	-179.1	-167.4	-164.4	-134.7	0	0	111	F79 Y99 P143	F79-E81 PolarHBondContact O-N 3.24Å; E81-Y99 WeakPolarHBondContact O-CB 3.44Å; E81-Y99 PolarHBondContact O-N 2.94Å; E81-P143 VanDerWaalsContact OE1-CD 3.23Å; E81-P143 WeakPolarHBondContact OE1-CD 3.44Å; E81-P143 WeakPolarHBondContact OE1-CG 3.45Å
82	N	94.4	Very high	93.9	Very high	82 Å²	82	99.4 Å²	99.4	44%	0.439	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.4	-173	-69.2	-56	0	0	0	112.6	T96 I97 S98	N82-T96 HydrophobicContact CB-CG2 4.08Å; N82-I97 WeakPolarHBondContact CA-O 3.5Å; N82-S98 WeakPolarHBondContact OD1-CA 3.44Å
83	F	93.9	Very high	93.6	Very high	98 Å²	98	101 Å²	101	43%	0.43	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	136.5	172.4	-66	-86.7	0	0	0	110.9	P80 F85 T96 I97 Y99	P80-F83 HydrophobicContact CB-CE2 3.76Å; P80-F83 HydrophobicContact CB-CZ 3.85Å; F83-F85 HydrophobicContact CB-CD2 4.4Å; F83-F85 HydrophobicContact CB-CE2 3.67Å; F83-F85 HydrophobicContact CB-CZ 4.12Å; F83-T96 CarbonylContact O-C 3.58Å; F83-T96 WeakPolarHBondContact O-CA 3.4Å; F83-I97 PolarHBondContact N-O 2.95Å; F83-I97 PolarHBondContact O-N 3.39Å; F83-Y99 HydrophobicContact CE2-CD2 4.28Å; F83-Y99 HydrophobicContact CE2-CG 4.2Å
84	V	95.2	Very high	93.5	Very high	88 Å²	88	105.8 Å²	105.8	53%	0.533	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107	111	178	-176.7	0	0	0	0	110	K94	V84-K94 HydrophobicContact CG1-CB 4.03Å; V84-K94 HydrophobicContact CG1-CD 4.11Å; V84-K94 HydrophobicContact CG1-CG 4.24Å
85	F	93.8	Very high	93.3	Very high	112 Å²	112	105 Å²	105	49%	0.491	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	134.3	176	-64.7	-87	0	0	0	110.5	F83 K94 V95 I97	F83-F85 HydrophobicContact CB-CD2 4.4Å; F83-F85 HydrophobicContact CB-CE2 3.67Å; F83-F85 HydrophobicContact CB-CZ 4.12Å; F85-K94 CarbonylContact O-C 3.56Å; F85-K94 VanDerWaalsContact O-CA 3.3Å; F85-K94 WeakPolarHBondContact O-CA 3.37Å; F85-V95 PolarHBondContact N-O 3.46Å; F85-V95 PolarHBondContact O-N 3.3Å; F85-I97 HydrophobicContact CD2-CB 4.36Å; F85-I97 HydrophobicContact CD2-CD1 3.63Å; F85-I97 HydrophobicContact CD2-CG1 3.92Å; F85-I97 HydrophobicContact CE2-CB 4.1Å; F85-I97 HydrophobicContact CE2-CD1 3.63Å; F85-I97 HydrophobicContact CE2-CG1 4.04Å
86	K	94.1	Very high	93.1	Very high	188 Å²	188	106.9 Å²	106.9	82%	0.817	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.5	133.3	171.1	-64.8	-179.8	-175.9	175.2	0	108.9	P93	K86-P93 WeakPolarHBondContact CA-O 3.33Å
87	T	92.9	Very high	93	Very high	54 Å²	54	107 Å²	107	33%	0.331	56%	0.562	S	S	.	*			trans	-114.5	161.3	178.4	92	0	0	0	0	111	N89 K92 P93 V95	T87-N89 VanDerWaalsContact C-N 3.26Å; T87-N89 WeakPolarHBondContact OG1-CB 3.48Å; T87-N89 PolarHBondContact OG1-N 3.36Å; T87-K92 PolarHBondContact OG1-O 2.84Å; T87-P93 PolarHBondContact N-O 3.11Å; T87-V95 HydrophobicContact CG2-CB 4.33Å; T87-V95 HydrophobicContact CG2-CG2 3.64Å
88	T	93.1	Very high	93.1	Very high	151 Å²	151	99.9 Å²	99.9	93%	0.926	53%	0.526	S	S	*	.	S	Bend	trans	-81.3	-5.9	171.9	52.6	0	0	0	0	112.7	V90	T88-V90 PolarHBondContact O-N 2.93Å
89	N	91.2	Very high	93.1	Very high	88 Å²	88	99.5 Å²	99.5	47%	0.471	51%	0.508	S	S	.	.			trans	-79.4	114.8	-179.8	-173.7	-23.7	0	0	0	110.4	T87 K91 K92 P93	T87-N89 VanDerWaalsContact C-N 3.26Å; T87-N89 WeakPolarHBondContact OG1-CB 3.48Å; T87-N89 PolarHBondContact OG1-N 3.36Å; N89-K91 PolarHBondContact O-N 2.97Å; N89-K91 VanDerWaalsContact O-N 3.14Å; N89-K91 PolarHBondContact OD1-N 3.46Å; N89-K92 CarbonylContact O-C 3.15Å; N89-K92 PolarHBondContact O-N 3.31Å; N89-P93 WeakPolarHBondContact O-CA 3.29Å
90	V	89.6	Confident	93.1	Very high	139 Å²	139	97.9 Å²	97.9	84%	0.842	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.3	-179.3	-174.2	0	0	0	0	112.7	T88	T88-V90 PolarHBondContact O-N 2.93Å
91	K	90.4	Very high	93.2	Very high	193 Å²	193	95.4 Å²	95.4	84%	0.839	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-24.7	-179.5	-66.5	-175	178.7	-179.4	0	113.8	N89	N89-K91 PolarHBondContact O-N 2.97Å; N89-K91 VanDerWaalsContact O-N 3.14Å; N89-K91 PolarHBondContact OD1-N 3.46Å
92	K	89	Confident	93.4	Very high	142 Å²	142	93 Å²	93	62%	0.617	48%	0.481	S	S	*	.			trans	-135.1	68.3	178.2	-80.1	-169	174.3	-176	0	109.8	T87 N89 K94	T87-K92 PolarHBondContact OG1-O 2.84Å; N89-K92 CarbonylContact O-C 3.15Å; N89-K92 PolarHBondContact O-N 3.31Å; K92-K94 PolarHBondContact O-N 3.28Å; K92-K94 VanDerWaalsContact O-N 3.13Å
93	P	90.9	Very high	93.6	Very high	78 Å²	78	90.9 Å²	90.9	51%	0.506	47%	0.469	S	S	.	.	S	Bend	trans	-66.1	-18.8	-173.4	27.5	-35.9	0	0	0	113	K86 T87 N89	K86-P93 WeakPolarHBondContact CA-O 3.33Å; T87-P93 PolarHBondContact N-O 3.11Å; N89-P93 WeakPolarHBondContact O-CA 3.29Å
94	K	93.8	Very high	93.7	Very high	145 Å²	145	87 Å²	87	63%	0.63	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.9	174.9	-64.7	-179.6	-178.4	178.8	0	109.9	V84 F85 K92	V84-K94 HydrophobicContact CG1-CB 4.03Å; V84-K94 HydrophobicContact CG1-CD 4.11Å; V84-K94 HydrophobicContact CG1-CG 4.24Å; F85-K94 CarbonylContact O-C 3.56Å; F85-K94 VanDerWaalsContact O-CA 3.3Å; F85-K94 WeakPolarHBondContact O-CA 3.37Å; K92-K94 PolarHBondContact O-N 3.28Å; K92-K94 VanDerWaalsContact O-N 3.13Å
95	V	92.7	Very high	93.9	Very high	55 Å²	55	84.5 Å²	84.5	33%	0.333	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.5	172.3	175.7	0	0	0	0	107.8	F85 T87 I97	F85-V95 PolarHBondContact N-O 3.46Å; F85-V95 PolarHBondContact O-N 3.3Å; T87-V95 HydrophobicContact CG2-CB 4.33Å; T87-V95 HydrophobicContact CG2-CG2 3.64Å; V95-I97 HydrophobicContact CG1-CG1 4.13Å
96	T	93.5	Very high	94.1	Very high	92 Å²	92	83.7 Å²	83.7	56%	0.564	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.3	173.1	-54.2	0	0	0	0	108.7	N82 F83	N82-T96 HydrophobicContact CB-CG2 4.08Å; F83-T96 CarbonylContact O-C 3.58Å; F83-T96 WeakPolarHBondContact O-CA 3.4Å
97	I	93.4	Very high	94.2	Very high	68 Å²	68	76.1 Å²	76.1	35%	0.349	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.6	175.9	-60.1	-176.1	0	0	0	107.9	N82 F83 F85 V95 Y99 A102	N82-I97 WeakPolarHBondContact CA-O 3.5Å; F83-I97 PolarHBondContact N-O 2.95Å; F83-I97 PolarHBondContact O-N 3.39Å; F85-I97 HydrophobicContact CD2-CB 4.36Å; F85-I97 HydrophobicContact CD2-CD1 3.63Å; F85-I97 HydrophobicContact CD2-CG1 3.92Å; F85-I97 HydrophobicContact CE2-CB 4.1Å; F85-I97 HydrophobicContact CE2-CD1 3.63Å; F85-I97 HydrophobicContact CE2-CG1 4.04Å; V95-I97 HydrophobicContact CG1-CG1 4.13Å; I97-Y99 PolarHBondContact O-N 3.44Å; I97-A102 HydrophobicContact CG2-CB 3.84Å
98	S	95.8	Very high	94.5	Very high	26 Å²	26	73.6 Å²	73.6	18%	0.182	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	115.4	165.6	174.9	0	0	0	0	108.5	N82 G101 A102 V140	N82-S98 WeakPolarHBondContact OD1-CA 3.44Å; S98-G101 PolarHBondContact O-N 3.49Å; S98-G101 PolarHBondContact OG-N 3.03Å; S98-A102 WeakPolarHBondContact O-CB 3.4Å; S98-A102 PolarHBondContact O-N 2.67Å; S98-V140 WeakPolarHBondContact OG-CG2 3.41Å
99	Y	96	Very high	94.7	Very high	106 Å²	106	73.2 Å²	73.2	42%	0.416	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-45.4	178.8	179.3	-96.4	0	0	0	112.8	F79 P80 E81 F83 I97 G101 A102 M103	F79-Y99 AromaticContact CE1-CD1 3.86Å; F79-Y99 HydrophobicContact CE1-CD1 3.86Å; F79-Y99 HydrophobicContact CE1-CE1 4.1Å; F79-Y99 HydrophobicContact CZ-CD1 4.17Å; F79-Y99 AromaticContact CZ-CE1 3.91Å; F79-Y99 HydrophobicContact CZ-CE1 3.91Å; P80-Y99 HydrophobicContact CB-CD1 3.88Å; P80-Y99 HydrophobicContact CB-CE1 4.42Å; P80-Y99 HydrophobicContact CB-CG 4.14Å; P80-Y99 HydrophobicContact CG-CD1 4.38Å; P80-Y99 HydrophobicContact CG-CE1 4.46Å; E81-Y99 WeakPolarHBondContact O-CB 3.44Å; E81-Y99 PolarHBondContact O-N 2.94Å; F83-Y99 HydrophobicContact CE2-CD2 4.28Å; F83-Y99 HydrophobicContact CE2-CG 4.2Å; I97-Y99 PolarHBondContact O-N 3.44Å; Y99-G101 VanDerWaalsContact C-N 3.3Å; Y99-G101 PolarHBondContact O-N 3.2Å; Y99-A102 PolarHBondContact O-N 3.06Å; Y99-M103 VanDerWaalsContact O-CB 3.31Å; Y99-M103 WeakPolarHBondContact O-CB 3.48Å; Y99-M103 PolarHBondContact O-N 3.42Å
100	P	95.8	Very high	95	Very high	13 Å²	13	76.6 Å²	76.6	8%	0.084	39%	0.387	C	S	.	.	H	α-helix	trans	-57.5	-43.1	173.3	-21.4	30.2	0	0	0	112.5	L75 F79 P80 M103 L104 V140	L75-P100 HydrophobicContact CD1-CB 4.34Å; L75-P100 HydrophobicContact CD1-CG 4.15Å; F79-P100 HydrophobicContact CD1-CG 4.33Å; F79-P100 HydrophobicContact CE1-CG 4.04Å; P80-P100 WeakPolarHBondContact O-CD 3.29Å; P100-M103 PolarHBondContact O-N 2.79Å; P100-L104 WeakPolarHBondContact O-CG 3.41Å; P100-L104 PolarHBondContact O-N 2.99Å; P100-L104 VanDerWaalsContact O-N 3.11Å; P100-V140 HydrophobicContact CB-CG2 4.43Å
101	G	96.3	Very high	95.3	Very high	4 Å²	4	72.3 Å²	72.3	4%	0.041	37%	0.37	C	S	.	.	H	α-helix	trans	-65.2	-45.8	177.9	0	0	0	0	0	112.4	S98 Y99 M103 L104 N105	S98-G101 PolarHBondContact O-N 3.49Å; S98-G101 PolarHBondContact OG-N 3.03Å; Y99-G101 VanDerWaalsContact C-N 3.3Å; Y99-G101 PolarHBondContact O-N 3.2Å; G101-M103 PolarHBondContact O-N 3.41Å; G101-L104 PolarHBondContact O-N 3.06Å; G101-N105 WeakPolarHBondContact O-CB 3.46Å; G101-N105 PolarHBondContact O-N 3.32Å; G101-N105 PolarHBondContact O-ND2 3.21Å; G101-N105 VanDerWaalsContact O-ND2 3.16Å
102	A	96.8	Very high	95.7	Very high	32 Å²	32	65 Å²	65	26%	0.264	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-41.9	177.3	0	0	0	0	0	112.1	I97 S98 Y99 N105 I106	I97-A102 HydrophobicContact CG2-CB 3.84Å; S98-A102 WeakPolarHBondContact O-CB 3.4Å; S98-A102 PolarHBondContact O-N 2.67Å; Y99-A102 PolarHBondContact O-N 3.06Å; A102-N105 PolarHBondContact O-N 3.41Å; A102-I106 WeakPolarHBondContact O-CG1 3.43Å; A102-I106 PolarHBondContact O-N 2.92Å
103	M	96.6	Very high	96.1	Very high	37 Å²	37	60 Å²	60	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-58.1	-50.1	176.1	179.8	-166.1	68.3	0	0	111.3	L56 I60 Y99 P100 G101 N105 I106 M107	L56-M103 HydrophobicContact CD2-CE 3.63Å; L56-M103 HydrophobicContact CD2-CG 3.96Å; L56-M103 HydrophobicContact CD2-SD 3.88Å; L56-M103 HydrophobicContact CG-CE 4Å; L56-M103 HydrophobicContact CG-SD 4.28Å; I60-M103 HydrophobicContact CD1-CE 3.69Å; I60-M103 HydrophobicContact CD1-SD 4.14Å; Y99-M103 VanDerWaalsContact O-CB 3.31Å; Y99-M103 WeakPolarHBondContact O-CB 3.48Å; Y99-M103 PolarHBondContact O-N 3.42Å; P100-M103 PolarHBondContact O-N 2.79Å; G101-M103 PolarHBondContact O-N 3.41Å; M103-N105 VanDerWaalsContact C-N 3.34Å; M103-N105 PolarHBondContact O-N 2.9Å; M103-I106 PolarHBondContact O-N 2.83Å; M103-M107 PolarHBondContact O-N 3.32Å
104	L	97.6	Very high	96.5	Very high	16 Å²	16	59.7 Å²	59.7	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-64.2	-38.8	177.2	-69.2	173.7	0	0	0	112	A53 L56 P100 G101 I106 M107 V108 F138	A53-L104 HydrophobicContact CB-CD2 3.88Å; L56-L104 HydrophobicContact CD2-CD2 4.15Å; P100-L104 WeakPolarHBondContact O-CG 3.41Å; P100-L104 PolarHBondContact O-N 2.99Å; P100-L104 VanDerWaalsContact O-N 3.11Å; G101-L104 PolarHBondContact O-N 3.06Å; L104-I106 PolarHBondContact O-N 3.21Å; L104-M107 HydrophobicContact CD2-CE 4.14Å; L104-M107 WeakPolarHBondContact O-CB 3.38Å; L104-M107 PolarHBondContact O-N 3.38Å; L104-V108 WeakPolarHBondContact O-CG2 3.34Å; L104-V108 PolarHBondContact O-N 3.37Å; L104-F138 HydrophobicContact CB-CB 4.25Å; L104-F138 HydrophobicContact CB-CD2 3.69Å; L104-F138 HydrophobicContact CB-CE2 4.34Å; L104-F138 HydrophobicContact CB-CG 4.13Å; L104-F138 HydrophobicContact CD1-CB 4.41Å; L104-F138 HydrophobicContact CD1-CD1 4.45Å; L104-F138 HydrophobicContact CD1-CD2 4.34Å; L104-F138 HydrophobicContact CD1-CG 4.15Å
105	N	97.9	Very high	96.7	Very high	36 Å²	36	57.5 Å²	57.5	19%	0.193	31%	0.31	C	S	.	.	H	α-helix	trans	-68.8	-31.5	179.6	-72.8	-24.4	0	0	0	113.3	G101 A102 M103 K109 F137 F138	G101-N105 WeakPolarHBondContact O-CB 3.46Å; G101-N105 PolarHBondContact O-N 3.32Å; G101-N105 PolarHBondContact O-ND2 3.21Å; G101-N105 VanDerWaalsContact O-ND2 3.16Å; A102-N105 PolarHBondContact O-N 3.41Å; M103-N105 VanDerWaalsContact C-N 3.34Å; M103-N105 PolarHBondContact O-N 2.9Å; N105-K109 VanDerWaalsContact O-CB 3.3Å; N105-K109 WeakPolarHBondContact O-CB 3.46Å; N105-K109 PolarHBondContact O-N 3.36Å; N105-F137 WeakPolarHBondContact OD1-CA 3.48Å; N105-F138 PolarHBondContact ND2-O 2.99Å; N105-F138 PolarHBondContact OD1-N 3.39Å
106	I	97.8	Very high	97	Very high	95 Å²	95	62.4 Å²	62.4	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-65.5	-46.3	171.1	-70.2	165.1	0	0	0	110	A102 M103 L104 V108 K109 E110	A102-I106 WeakPolarHBondContact O-CG1 3.43Å; A102-I106 PolarHBondContact O-N 2.92Å; M103-I106 PolarHBondContact O-N 2.83Å; L104-I106 PolarHBondContact O-N 3.21Å; I106-V108 VanDerWaalsContact C-N 3.33Å; I106-V108 PolarHBondContact O-N 3.14Å; I106-K109 PolarHBondContact O-N 3.27Å; I106-K109 VanDerWaalsContact O-N 3.16Å; I106-E110 HydrophobicContact CG2-CG 4.36Å; I106-E110 WeakPolarHBondContact O-CG 3.34Å; I106-E110 PolarHBondContact O-N 3.17Å
107	M	97.7	Very high	97.2	Very high	29 Å²	29	62.8 Å²	62.8	14%	0.143	32%	0.321	C	S	.	.	H	α-helix	trans	-57.5	-45.7	175.7	173	-83.3	-67.3	0	0	111.6	Q52 A53 M103 L104 K109 E110 G111 F112 F138	Q52-M107 HydrophobicContact CB-CE 4.41Å; Q52-M107 HydrophobicContact CB-SD 4Å; A53-M107 HydrophobicContact CB-CE 3.78Å; M103-M107 PolarHBondContact O-N 3.32Å; L104-M107 HydrophobicContact CD2-CE 4.14Å; L104-M107 WeakPolarHBondContact O-CB 3.38Å; L104-M107 PolarHBondContact O-N 3.38Å; M107-K109 VanDerWaalsContact C-N 3.35Å; M107-K109 PolarHBondContact O-N 3.21Å; M107-E110 PolarHBondContact O-N 2.92Å; M107-G111 PolarHBondContact O-N 3.36Å; M107-F112 HydrophobicContact SD-CE2 4.24Å; M107-F138 HydrophobicContact CE-CE2 4.45Å
108	V	97.9	Very high	97.4	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-43.8	176.6	172	0	0	0	0	111.4	I49 L104 I106 F112 N134 I136 F138	I49-V108 HydrophobicContact CG2-CG2 3.97Å; L104-V108 WeakPolarHBondContact O-CG2 3.34Å; L104-V108 PolarHBondContact O-N 3.37Å; I106-V108 VanDerWaalsContact C-N 3.33Å; I106-V108 PolarHBondContact O-N 3.14Å; V108-F112 WeakPolarHBondContact O-CA 3.45Å; V108-F112 WeakPolarHBondContact O-CB 3.33Å; V108-F112 PolarHBondContact O-N 3.36Å; V108-N134 PolarHBondContact O-ND2 2.87Å; V108-I136 HydrophobicContact CG1-CB 3.7Å; V108-I136 HydrophobicContact CG1-CG2 3.73Å; V108-I136 WeakPolarHBondContact CG1-O 3.34Å; V108-F138 HydrophobicContact CG2-CD2 3.9Å; V108-F138 HydrophobicContact CG2-CE2 3.69Å
109	K	97.9	Very high	97.5	Very high	143 Å²	143	69 Å²	69	62%	0.622	35%	0.345	S	S	*	.	H	α-helix	trans	-62.2	-45.8	178.6	-175.9	-175.7	175.3	-170.4	0	111.8	N105 I106 M107 T113	N105-K109 VanDerWaalsContact O-CB 3.3Å; N105-K109 WeakPolarHBondContact O-CB 3.46Å; N105-K109 PolarHBondContact O-N 3.36Å; I106-K109 PolarHBondContact O-N 3.27Å; I106-K109 VanDerWaalsContact O-N 3.16Å; M107-K109 VanDerWaalsContact C-N 3.35Å; M107-K109 PolarHBondContact O-N 3.21Å; K109-T113 VanDerWaalsContact O-CB 3.32Å; K109-T113 WeakPolarHBondContact O-CB 3.47Å; K109-T113 PolarHBondContact O-N 3.16Å; K109-T113 PolarHBondContact O-OG1 3Å
110	E	97.1	Very high	97.6	Very high	160 Å²	160	67.2 Å²	67.2	75%	0.748	34%	0.343	S	S	*	.	H	α-helix	trans	-72.2	-36.4	-177.4	-69.9	178.5	175.4	0	0	112.5	I106 M107	I106-E110 HydrophobicContact CG2-CG 4.36Å; I106-E110 WeakPolarHBondContact O-CG 3.34Å; I106-E110 PolarHBondContact O-N 3.17Å; M107-E110 PolarHBondContact O-N 2.92Å
111	G	96.9	Very high	97.6	Very high	48 Å²	48	69.5 Å²	69.5	50%	0.495	36%	0.362	S	S	.	.	H	α-helix	trans	-88	-24.4	-176.7	0	0	0	0	0	115.5	M107	M107-G111 PolarHBondContact O-N 3.36Å
112	F	98	Very high	97.6	Very high	41 Å²	41	73.5 Å²	73.5	18%	0.18	38%	0.38	C	S	.	.	H	α-helix	trans	-135.7	15.5	-163.8	-57.3	-90.4	0	0	0	114.9	T45 N48 I49 M107 V108 N134	T45-F112 HydrophobicContact CG2-CD1 4.11Å; T45-F112 HydrophobicContact CG2-CE1 4.5Å; N48-F112 HydrophobicContact CB-CE1 4.1Å; N48-F112 HydrophobicContact CB-CZ 4.24Å; I49-F112 HydrophobicContact CB-CE2 4.4Å; I49-F112 HydrophobicContact CB-CZ 4.24Å; I49-F112 HydrophobicContact CD1-CD1 4Å; I49-F112 HydrophobicContact CD1-CE1 4.32Å; I49-F112 HydrophobicContact CD1-CG 4.12Å; I49-F112 HydrophobicContact CG1-CD1 3.53Å; I49-F112 HydrophobicContact CG1-CD2 3.77Å; I49-F112 HydrophobicContact CG1-CE1 3.42Å; I49-F112 VanDerWaalsContact CG1-CE1 3.42Å; I49-F112 HydrophobicContact CG1-CE2 3.67Å; I49-F112 HydrophobicContact CG1-CG 3.69Å; I49-F112 HydrophobicContact CG1-CZ 3.49Å; I49-F112 VanDerWaalsContact CG1-CZ 3.49Å; M107-F112 HydrophobicContact SD-CE2 4.24Å; V108-F112 WeakPolarHBondContact O-CA 3.45Å; V108-F112 WeakPolarHBondContact O-CB 3.33Å; V108-F112 PolarHBondContact O-N 3.36Å; F112-N134 PolarHBondContact O-ND2 2.88Å
113	T	98.5	Very high	97.5	Very high	37 Å²	37	75.9 Å²	75.9	23%	0.227	39%	0.393	C	S	.	.			trans	-72.8	134.4	173	-65.9	0	0	0	0	111.4	K109 D115 N134	K109-T113 VanDerWaalsContact O-CB 3.32Å; K109-T113 WeakPolarHBondContact O-CB 3.47Å; K109-T113 PolarHBondContact O-N 3.16Å; K109-T113 PolarHBondContact O-OG1 3Å; T113-D115 PolarHBondContact O-N 3.06Å; T113-N134 HydrophobicContact CG2-CB 4.21Å; T113-N134 PolarHBondContact N-ND2 2.99Å; T113-N134 WeakPolarHBondContact OG1-CB 3.21Å; T113-N134 PolarHBondContact OG1-ND2 2.97Å; T113-N134 VanDerWaalsContact OG1-ND2 3.08Å
114	N	98.4	Very high	97.6	Very high	71 Å²	71	79.1 Å²	79.1	38%	0.38	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	98.5	172.3	178.8	8.9	0	0	0	110.1	Q116 Y117 S132 E133	N114-Q116 PolarHBondContact O-N 3.31Å; N114-Q116 WeakPolarHBondContact OD1-CA 3.34Å; N114-Q116 WeakPolarHBondContact OD1-CB 3.3Å; N114-Q116 PolarHBondContact OD1-N 3.06Å; N114-Y117 PolarHBondContact OD1-N 3.26Å; N114-S132 CarbonylContact O-C 3.55Å; N114-S132 WeakPolarHBondContact O-CA 3.36Å; N114-E133 PolarHBondContact N-O 3.01Å; N114-E133 PolarHBondContact O-N 3.23Å
115	D	98.3	Very high	97.5	Very high	99 Å²	99	81.7 Å²	81.7	53%	0.529	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	0.9	177	-63.5	-52.3	0	0	0	114.3	T113 T130 S132	T113-D115 PolarHBondContact O-N 3.06Å; D115-T130 WeakPolarHBondContact O-CG2 3.5Å; D115-S132 VanDerWaalsContact OD1-CB 3.23Å; D115-S132 WeakPolarHBondContact OD1-CB 3.47Å; D115-S132 PolarHBondContact OD1-OG 3.37Å
116	Q	98.3	Very high	97.4	Very high	157 Å²	157	85.9 Å²	85.9	73%	0.734	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	12.3	-174.9	-57.8	-178.2	-32.9	0	0	112.7	N114 Q118	N114-Q116 PolarHBondContact O-N 3.31Å; N114-Q116 WeakPolarHBondContact OD1-CA 3.34Å; N114-Q116 WeakPolarHBondContact OD1-CB 3.3Å; N114-Q116 PolarHBondContact OD1-N 3.06Å; Q116-Q118 PolarHBondContact O-N 3.08Å
117	Y	98.3	Very high	97.4	Very high	100 Å²	100	84.6 Å²	84.6	39%	0.392	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	119.2	-178.4	-159.9	-74.8	0	0	0	110.3	N114 T130 R131 E133	N114-Y117 PolarHBondContact OD1-N 3.26Å; Y117-T130 CarbonylContact O-C 3.4Å; Y117-T130 WeakPolarHBondContact O-CA 3.33Å; Y117-R131 VanDerWaalsContact CB-O 3.29Å; Y117-R131 WeakPolarHBondContact CB-O 3.3Å; Y117-R131 PolarHBondContact N-O 3.02Å; Y117-R131 PolarHBondContact O-N 3.36Å; Y117-E133 HydrophobicContact CD2-CB 3.78Å; Y117-E133 HydrophobicContact CD2-CG 3.96Å; Y117-E133 HydrophobicContact CE2-CG 4.29Å; Y117-E133 HydrophobicContact CG-CB 3.84Å; Y117-E133 HydrophobicContact CG-CG 4.37Å
118	Q	97.8	Very high	97.4	Very high	120 Å²	120	89.2 Å²	89.2	56%	0.561	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.6	179.8	-67	179.7	31.1	0	0	110.8	Q116 Y128 V129	Q116-Q118 PolarHBondContact O-N 3.08Å; Q118-Y128 HydrophobicContact CB-CD1 4.33Å; Q118-V129 WeakPolarHBondContact CA-O 3.45Å
119	E	97.3	Very high	97.4	Very high	104 Å²	104	93 Å²	93	49%	0.486	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.4	178.1	-168.7	167.7	-179.6	0	0	109.9	A121 Y128 V129 R131	E119-A121 PolarHBondContact O-N 3.43Å; E119-Y128 WeakPolarHBondContact O-CA 3.48Å; E119-V129 PolarHBondContact N-O 3.48Å; E119-V129 PolarHBondContact O-N 3.32Å; E119-R131 IonicContact OE2-CZ 2.66Å; E119-R131 IonicContact OE2-NE 3.59Å; E119-R131 PolarHBondContact OE2-NE 2.79Å; E119-R131 VanDerWaalsContact OE2-NE 3.17Å; E119-R131 IonicContact OE2-NH2 3.66Å
120	L	97.4	Very high	97.4	Very high	70 Å²	70	90.2 Å²	90.2	37%	0.366	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	107.7	-179.3	-179.2	67.2	0	0	0	109	P123 Y128	L120-P123 HydrophobicContact CD2-CB 4.05Å; L120-P123 HydrophobicContact CD2-CG 4.02Å; L120-P123 HydrophobicContact CG-CG 4.35Å; L120-Y128 HydrophobicContact CB-CD1 4.16Å; L120-Y128 HydrophobicContact CB-CE1 3.76Å; L120-Y128 HydrophobicContact CD1-CD1 4.44Å; L120-Y128 HydrophobicContact CD1-CD2 4.18Å; L120-Y128 HydrophobicContact CD1-CE1 4.04Å; L120-Y128 HydrophobicContact CD1-CE2 3.74Å; L120-Y128 HydrophobicContact CG-CE1 4.49Å
121	A	96.4	Very high	97.5	Very high	60 Å²	60	86.9 Å²	86.9	50%	0.496	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-39.6	-178.6	0	0	0	0	0	112.1	E119 T127 V129	E119-A121 PolarHBondContact O-N 3.43Å; A121-T127 PolarHBondContact N-O 2.95Å; A121-V129 HydrophobicContact CB-CB 4.48Å; A121-V129 HydrophobicContact CB-CG2 3.61Å
122	E	96.3	Very high	97.5	Very high	88 Å²	88	88 Å²	88	41%	0.411	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	105.5	178.7	-177.8	53.4	-113.2	0	0	110.3	S124 S125 L126 T127	E122-S124 VanDerWaalsContact C-N 3.31Å; E122-S124 VanDerWaalsContact CD-OG 3.29Å; E122-S124 WeakPolarHBondContact CG-OG 3.46Å; E122-S124 PolarHBondContact O-N 2.83Å; E122-S124 WeakPolarHBondContact OE1-CB 3.27Å; E122-S124 PolarHBondContact OE1-N 3.38Å; E122-S124 PolarHBondContact OE1-OG 2.84Å; E122-S125 WeakPolarHBondContact CB-OG 3.36Å; E122-S125 WeakPolarHBondContact CG-OG 3.48Å; E122-L126 WeakPolarHBondContact O-CA 3.46Å; E122-L126 PolarHBondContact O-N 2.96Å; E122-T127 PolarHBondContact N-O 3.38Å; E122-T127 PolarHBondContact O-N 3.5Å
123	P	95.8	Very high	97.5	Very high	83 Å²	83	89 Å²	89	54%	0.539	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-32.3	-178.7	-24.4	34.6	0	0	0	114.1	L120 L126	L120-P123 HydrophobicContact CD2-CB 4.05Å; L120-P123 HydrophobicContact CD2-CG 4.02Å; L120-P123 HydrophobicContact CG-CG 4.35Å; P123-L126 PolarHBondContact O-N 2.86Å
124	S	96.9	Very high	97.5	Very high	105 Å²	105	88.9 Å²	88.9	73%	0.734	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-37.7	-176	61.1	0	0	0	0	112.8	E122	E122-S124 VanDerWaalsContact C-N 3.31Å; E122-S124 VanDerWaalsContact CD-OG 3.29Å; E122-S124 WeakPolarHBondContact CG-OG 3.46Å; E122-S124 PolarHBondContact O-N 2.83Å; E122-S124 WeakPolarHBondContact OE1-CB 3.27Å; E122-S124 PolarHBondContact OE1-N 3.38Å; E122-S124 PolarHBondContact OE1-OG 2.84Å
125	S	96.6	Very high	97.4	Very high	69 Å²	69	90 Å²	90	48%	0.483	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	4.1	177.4	60.3	0	0	0	0	113.5	E122 T127	E122-S125 WeakPolarHBondContact CB-OG 3.36Å; E122-S125 WeakPolarHBondContact CG-OG 3.48Å; S125-T127 PolarHBondContact O-N 3.26Å; S125-T127 PolarHBondContact O-OG1 3.46Å; S125-T127 PolarHBondContact OG-OG1 2.97Å
126	L	96.6	Very high	97.4	Very high	125 Å²	125	88.5 Å²	88.5	65%	0.654	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	40	-174.7	-59.4	175.7	0	0	0	112.6	E122 P123 Y128	E122-L126 WeakPolarHBondContact O-CA 3.46Å; E122-L126 PolarHBondContact O-N 2.96Å; P123-L126 PolarHBondContact O-N 2.86Å; L126-Y128 WeakPolarHBondContact O-CD2 3.48Å
127	T	97.5	Very high	97.3	Very high	68 Å²	68	87.6 Å²	87.6	42%	0.417	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.6	-177.4	-57.6	0	0	0	0	110.7	A121 E122 S125	A121-T127 PolarHBondContact N-O 2.95Å; E122-T127 PolarHBondContact N-O 3.38Å; E122-T127 PolarHBondContact O-N 3.5Å; S125-T127 PolarHBondContact O-N 3.26Å; S125-T127 PolarHBondContact O-OG1 3.46Å; S125-T127 PolarHBondContact OG-OG1 2.97Å
128	Y	97.9	Very high	97.3	Very high	125 Å²	125	84.5 Å²	84.5	49%	0.49	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	148	179.4	-70.4	-97.4	0	0	0	111.1	Q118 E119 L120 L126	Q118-Y128 HydrophobicContact CB-CD1 4.33Å; E119-Y128 WeakPolarHBondContact O-CA 3.48Å; L120-Y128 HydrophobicContact CB-CD1 4.16Å; L120-Y128 HydrophobicContact CB-CE1 3.76Å; L120-Y128 HydrophobicContact CD1-CD1 4.44Å; L120-Y128 HydrophobicContact CD1-CD2 4.18Å; L120-Y128 HydrophobicContact CD1-CE1 4.04Å; L120-Y128 HydrophobicContact CD1-CE2 3.74Å; L120-Y128 HydrophobicContact CG-CE1 4.49Å; L126-Y128 WeakPolarHBondContact O-CD2 3.48Å
129	V	97.9	Very high	97.2	Very high	81 Å²	81	87.6 Å²	87.6	49%	0.491	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.9	171.4	178.6	0	0	0	0	108.5	Q118 E119 A121	Q118-V129 WeakPolarHBondContact CA-O 3.45Å; E119-V129 PolarHBondContact N-O 3.48Å; E119-V129 PolarHBondContact O-N 3.32Å; A121-V129 HydrophobicContact CB-CB 4.48Å; A121-V129 HydrophobicContact CB-CG2 3.61Å
130	T	98.3	Very high	97	Very high	83 Å²	83	86.2 Å²	86.2	51%	0.509	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	136.2	173.7	-52.9	0	0	0	0	109.8	D115 Y117	D115-T130 WeakPolarHBondContact O-CG2 3.5Å; Y117-T130 CarbonylContact O-C 3.4Å; Y117-T130 WeakPolarHBondContact O-CA 3.33Å
131	R	97.6	Very high	96.7	Very high	90 Å²	90	88.7 Å²	88.7	34%	0.34	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	155.4	174.4	66	-172.9	-170.9	78.1	1.5	110.9	Y117 E119 E133	Y117-R131 VanDerWaalsContact CB-O 3.29Å; Y117-R131 WeakPolarHBondContact CB-O 3.3Å; Y117-R131 PolarHBondContact N-O 3.02Å; Y117-R131 PolarHBondContact O-N 3.36Å; E119-R131 IonicContact OE2-CZ 2.66Å; E119-R131 IonicContact OE2-NE 3.59Å; E119-R131 PolarHBondContact OE2-NE 2.79Å; E119-R131 VanDerWaalsContact OE2-NE 3.17Å; E119-R131 IonicContact OE2-NH2 3.66Å; R131-E133 IonicContact CZ-OE1 2.97Å; R131-E133 IonicContact CZ-OE2 2.6Å; R131-E133 IonicContact NH1-OE1 3.4Å; R131-E133 PolarHBondContact NH1-OE1 3.48Å; R131-E133 IonicContact NH1-OE2 3.17Å; R131-E133 PolarHBondContact NH1-OE2 3.39Å; R131-E133 IonicContact NH2-OE1 3.84Å; R131-E133 PolarHBondContact NH2-OE1 3.04Å; R131-E133 IonicContact NH2-OE2 3.27Å
132	S	97.9	Very high	96.4	Very high	73 Å²	73	87.4 Å²	87.4	51%	0.51	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	130.1	167.2	-55.4	0	0	0	0	109.8	N114 D115	N114-S132 CarbonylContact O-C 3.55Å; N114-S132 WeakPolarHBondContact O-CA 3.36Å; D115-S132 VanDerWaalsContact OD1-CB 3.23Å; D115-S132 WeakPolarHBondContact OD1-CB 3.47Å; D115-S132 PolarHBondContact OD1-OG 3.37Å
133	E	98	Very high	96.2	Very high	62 Å²	62	86.7 Å²	86.7	29%	0.29	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.5	177.7	-175.7	72.1	138	0	0	111.3	N114 Y117 R131	N114-E133 PolarHBondContact N-O 3.01Å; N114-E133 PolarHBondContact O-N 3.23Å; Y117-E133 HydrophobicContact CD2-CB 3.78Å; Y117-E133 HydrophobicContact CD2-CG 3.96Å; Y117-E133 HydrophobicContact CE2-CG 4.29Å; Y117-E133 HydrophobicContact CG-CB 3.84Å; Y117-E133 HydrophobicContact CG-CG 4.37Å; R131-E133 IonicContact CZ-OE1 2.97Å; R131-E133 IonicContact CZ-OE2 2.6Å; R131-E133 IonicContact NH1-OE1 3.4Å; R131-E133 PolarHBondContact NH1-OE1 3.48Å; R131-E133 IonicContact NH1-OE2 3.17Å; R131-E133 PolarHBondContact NH1-OE2 3.39Å; R131-E133 IonicContact NH2-OE1 3.84Å; R131-E133 PolarHBondContact NH2-OE1 3.04Å; R131-E133 IonicContact NH2-OE2 3.27Å
134	N	97.9	Very high	96.3	Very high	34 Å²	34	85.4 Å²	85.4	18%	0.182	47%	0.47	C	S	.	.			trans	-153.8	120.8	168.9	-165.3	-23.7	0	0	0	109.5	V108 F112 T113 I136	V108-N134 PolarHBondContact O-ND2 2.87Å; F112-N134 PolarHBondContact O-ND2 2.88Å; T113-N134 HydrophobicContact CG2-CB 4.21Å; T113-N134 PolarHBondContact N-ND2 2.99Å; T113-N134 WeakPolarHBondContact OG1-CB 3.21Å; T113-N134 PolarHBondContact OG1-ND2 2.97Å; T113-N134 VanDerWaalsContact OG1-ND2 3.08Å; N134-I136 WeakPolarHBondContact OD1-CB 3.32Å; N134-I136 PolarHBondContact OD1-N 3.03Å
135	S	97.1	Very high	96.2	Very high	95 Å²	95	85 Å²	85	66%	0.664	46%	0.459	S	S	*	.			trans	-119.9	18.6	179.6	54.4	0	0	0	0	112.5	F137	S135-F137 WeakPolarHBondContact O-CD2 3.46Å
136	I	97.7	Very high	96.2	Very high	66 Å²	66	83 Å²	83	34%	0.338	45%	0.447	S	S	.	.			trans	-94.4	120.2	-178.9	-52.1	174.5	0	0	0	108.8	I49 V108 N134	I49-I136 HydrophobicContact CD1-CD1 3.79Å; I49-I136 HydrophobicContact CD1-CG2 4.33Å; V108-I136 HydrophobicContact CG1-CB 3.7Å; V108-I136 HydrophobicContact CG1-CG2 3.73Å; V108-I136 WeakPolarHBondContact CG1-O 3.34Å; N134-I136 WeakPolarHBondContact OD1-CB 3.32Å; N134-I136 PolarHBondContact OD1-N 3.03Å
137	F	97.2	Very high	96.2	Very high	139 Å²	139	79.2 Å²	79.2	61%	0.61	43%	0.426	S	S	*	.			trans	-137.6	135.3	179.2	-57.1	-80.9	0	0	0	110.7	N105 S135	N105-F137 WeakPolarHBondContact OD1-CA 3.48Å; S135-F137 WeakPolarHBondContact O-CD2 3.46Å
138	F	97.1	Very high	96.1	Very high	35 Å²	35	77.1 Å²	77.1	15%	0.154	41%	0.412	C	S	.	.			trans	-75.8	138.4	158.6	-75.7	-78.9	0	0	0	109.9	I49 I50 A53 L104 N105 M107 V108	I49-F138 HydrophobicContact CG2-CE2 4Å; I49-F138 HydrophobicContact CG2-CZ 4.1Å; I50-F138 HydrophobicContact CD1-CE1 3.83Å; I50-F138 HydrophobicContact CD1-CZ 3.91Å; A53-F138 HydrophobicContact CB-CE2 4.03Å; A53-F138 HydrophobicContact CB-CZ 3.72Å; L104-F138 HydrophobicContact CB-CB 4.25Å; L104-F138 HydrophobicContact CB-CD2 3.69Å; L104-F138 HydrophobicContact CB-CE2 4.34Å; L104-F138 HydrophobicContact CB-CG 4.13Å; L104-F138 HydrophobicContact CD1-CB 4.41Å; L104-F138 HydrophobicContact CD1-CD1 4.45Å; L104-F138 HydrophobicContact CD1-CD2 4.34Å; L104-F138 HydrophobicContact CD1-CG 4.15Å; N105-F138 PolarHBondContact ND2-O 2.99Å; N105-F138 PolarHBondContact OD1-N 3.39Å; M107-F138 HydrophobicContact CE-CE2 4.45Å; V108-F138 HydrophobicContact CG2-CD2 3.9Å; V108-F138 HydrophobicContact CG2-CE2 3.69Å
139	E	95.1	Very high	95.9	Very high	185 Å²	185	74.2 Å²	74.2	86%	0.864	41%	0.405	S	S	*	.			trans	-112.7	140.8	166.3	-64.8	-175.3	166.3	0	0	108
140	V	94.4	Very high	95.7	Very high	74 Å²	74	72.3 Å²	72.3	45%	0.448	39%	0.394	S	S	.	.			trans	-99.5	129.2	178.4	177.8	0	0	0	0	108.1	S98 P100	S98-V140 WeakPolarHBondContact OG-CG2 3.41Å; P100-V140 HydrophobicContact CB-CG2 4.43Å
141	D	91.6	Very high	95.3	Very high	123 Å²	123	72.7 Å²	72.7	66%	0.658	41%	0.405	S	S	*	.			trans	-122.9	130.2	175.9	-174	21.1	0	0	0	109.1	Y144	D141-Y144 WeakPolarHBondContact O-CE2 2.97Å; D141-Y144 PolarHBondContact OD1-OH 3.33Å; D141-Y144 PolarHBondContact OD2-OH 3.34Å
142	G	88.5	Confident	94.9	Very high	33 Å²	33	70 Å²	70	34%	0.34	40%	0.4	S	S	.	.			trans	124	-173.8	-164.8	0	0	0	0	0	113.2
143	P	93.5	Very high	94.5	Very high	72 Å²	72	76.8 Å²	76.8	47%	0.468	42%	0.421	S	S	.	.			cis	-73.4	157.4	6.9	31.1	-31.8	0	0	0	112.3	E81	E81-P143 VanDerWaalsContact OE1-CD 3.23Å; E81-P143 WeakPolarHBondContact OE1-CD 3.44Å; E81-P143 WeakPolarHBondContact OE1-CG 3.45Å
144	Y	96.1	Very high	93.9	Very high	57 Å²	57	79.1 Å²	79.1	22%	0.224	43%	0.432	C	S	.	.			trans	-113.9	152	-177.8	-72.4	-72.4	0	0	0	111	W72 D141 V165 N167 A173	W72-Y144 HydrophobicContact CH2-CD2 4.23Å; W72-Y144 AromaticContact CH2-CE2 3.67Å; W72-Y144 HydrophobicContact CH2-CE2 3.67Å; W72-Y144 AromaticContact CZ3-CD2 3.63Å; W72-Y144 HydrophobicContact CZ3-CD2 3.63Å; W72-Y144 AromaticContact CZ3-CE2 3.48Å; W72-Y144 HydrophobicContact CZ3-CE2 3.48Å; W72-Y144 VanDerWaalsContact CZ3-CE2 3.48Å; D141-Y144 WeakPolarHBondContact O-CE2 2.97Å; D141-Y144 PolarHBondContact OD1-OH 3.33Å; D141-Y144 PolarHBondContact OD2-OH 3.34Å; Y144-V165 HydrophobicContact CD1-CG1 3.48Å; Y144-V165 VanDerWaalsContact CD1-CG1 3.48Å; Y144-V165 HydrophobicContact CD2-CG1 3.94Å; Y144-V165 HydrophobicContact CE1-CG1 3.83Å; Y144-V165 HydrophobicContact CE2-CG1 4.27Å; Y144-V165 HydrophobicContact CG-CG1 3.5Å; Y144-N167 WeakPolarHBondContact CE1-OD1 3.44Å; Y144-A173 HydrophobicContact CD1-CB 4.14Å; Y144-A173 HydrophobicContact CE1-CB 3.58Å
145	L	95.5	Very high	93.3	Very high	96 Å²	96	86.9 Å²	86.9	50%	0.503	47%	0.467	S	S	.	.	S	Bend	trans	-69.5	-48.1	179.2	179.8	61.1	0	0	0	111.9	F166 N167 L201	L145-F166 HydrophobicContact CB-CB 4.5Å; L145-F166 PolarHBondContact N-O 3.13Å; L145-N167 WeakPolarHBondContact CB-O 3.31Å; L145-N167 WeakPolarHBondContact CD2-O 3.45Å; L145-L201 HydrophobicContact CD2-CD2 4.12Å
146	A	96.1	Very high	92.6	Very high	27 Å²	27	86.3 Å²	86.3	22%	0.223	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	147.8	-173.6	0	0	0	0	0	111.5	I148 V165 F166 L201	A146-I148 HydrophobicContact CB-CD1 4.27Å; A146-V165 WeakPolarHBondContact O-CA 3.42Å; A146-F166 HydrophobicContact CB-CB 4.45Å; A146-F166 HydrophobicContact CB-CD2 4.45Å; A146-F166 PolarHBondContact O-N 3.32Å; A146-L201 HydrophobicContact CB-CD2 3.97Å
147	M	96.5	Very high	92	Very high	45 Å²	45	89.2 Å²	89.2	22%	0.222	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.3	170.2	-177.6	179.9	-170.4	0	0	109.5	L64 E65 W72 L149 Y163 A164 V165	L64-M147 HydrophobicContact CB-SD 4.41Å; L64-M147 HydrophobicContact CD1-SD 3.77Å; E65-M147 HydrophobicContact CB-CE 4.43Å; W72-M147 HydrophobicContact CB-CE 3.61Å; W72-M147 HydrophobicContact CB-SD 3.79Å; W72-M147 HydrophobicContact CD2-CE 3.74Å; W72-M147 HydrophobicContact CD2-SD 3.99Å; W72-M147 HydrophobicContact CE3-CE 4.27Å; W72-M147 HydrophobicContact CE3-SD 3.92Å; W72-M147 HydrophobicContact CG-CE 3.41Å; W72-M147 VanDerWaalsContact CG-CE 3.41Å; W72-M147 HydrophobicContact CG-SD 3.95Å; M147-L149 HydrophobicContact CE-CD1 4.11Å; M147-L149 HydrophobicContact CE-CD2 3.9Å; M147-L149 HydrophobicContact CE-CG 4.01Å; M147-L149 HydrophobicContact CG-CD1 3.81Å; M147-L149 HydrophobicContact CG-CG 4.38Å; M147-L149 HydrophobicContact SD-CD1 3.95Å; M147-Y163 HydrophobicContact CE-CD1 4.31Å; M147-Y163 HydrophobicContact CE-CD2 4.23Å; M147-Y163 HydrophobicContact CE-CG 3.82Å; M147-A164 CarbonylContact C-O 3.54Å; M147-A164 VanDerWaalsContact CA-O 3.32Å; M147-A164 WeakPolarHBondContact CA-O 3.18Å; M147-V165 HydrophobicContact CB-CG2 4.46Å; M147-V165 HydrophobicContact CE-CG2 4.45Å; M147-V165 HydrophobicContact CG-CG2 3.98Å; M147-V165 HydrophobicContact SD-CG2 4.49Å
148	I	96.1	Very high	91.2	Very high	24 Å²	24	90.7 Å²	90.7	12%	0.123	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.5	-179.7	-59.6	75.3	0	0	0	108.3	A146 Y163 A164 F166 F200	A146-I148 HydrophobicContact CB-CD1 4.27Å; I148-Y163 VanDerWaalsContact O-CA 3.3Å; I148-Y163 WeakPolarHBondContact O-CA 3.44Å; I148-A164 HydrophobicContact CB-CB 4.44Å; I148-A164 PolarHBondContact N-O 3.34Å; I148-A164 PolarHBondContact O-N 3.27Å; I148-F166 HydrophobicContact CD1-CD2 3.83Å; I148-F166 HydrophobicContact CD1-CE2 3.73Å; I148-F200 HydrophobicContact CD1-CB 4.17Å; I148-F200 HydrophobicContact CD1-CG 4.47Å; I148-F200 HydrophobicContact CG1-CB 4Å; I148-F200 HydrophobicContact CG1-CD1 4.12Å; I148-F200 HydrophobicContact CG1-CD2 3.92Å; I148-F200 HydrophobicContact CG1-CE2 4.41Å; I148-F200 HydrophobicContact CG1-CG 3.76Å; I148-F200 HydrophobicContact CG2-CD2 4.23Å; I148-F200 HydrophobicContact CG2-CE1 4.43Å; I148-F200 HydrophobicContact CG2-CE2 3.88Å; I148-F200 HydrophobicContact CG2-CZ 4.01Å
149	L	94.5	Very high	90.8	Very high	64 Å²	64	91.9 Å²	91.9	34%	0.335	50%	0.5	S	S	.	.			trans	-115.1	128.2	174.9	-58.9	99.7	0	0	0	110	L64 E65 M147	L64-L149 HydrophobicContact CB-CD1 4.19Å; L64-L149 HydrophobicContact CB-CD2 4.23Å; L64-L149 HydrophobicContact CD1-CD1 4.11Å; E65-L149 HydrophobicContact CB-CD2 3.9Å; M147-L149 HydrophobicContact CE-CD1 4.11Å; M147-L149 HydrophobicContact CE-CD2 3.9Å; M147-L149 HydrophobicContact CE-CG 4.01Å; M147-L149 HydrophobicContact CG-CD1 3.81Å; M147-L149 HydrophobicContact CG-CG 4.38Å; M147-L149 HydrophobicContact SD-CD1 3.95Å
150	P	93.1	Very high	90.4	Very high	41 Å²	41	90.8 Å²	90.8	27%	0.266	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-79.2	147.1	176.3	33.4	-31.5	0	0	0	111.4	L159 R162 F178	P150-L159 HydrophobicContact CB-CD1 4.12Å; P150-L159 HydrophobicContact CG-CB 4.43Å; P150-L159 HydrophobicContact CG-CD1 4.11Å; P150-R162 WeakPolarHBondContact CD-O 3.38Å; P150-R162 HydrophobicContact CG-CB 3.66Å; P150-F178 HydrophobicContact CB-CE1 4.5Å; P150-F178 HydrophobicContact CB-CZ 4.46Å; P150-F178 HydrophobicContact CG-CE1 4.12Å; P150-F178 HydrophobicContact CG-CZ 3.86Å
151	A	89.8	Confident	90.1	Very high	91 Å²	91	92.3 Å²	92.3	75%	0.752	49%	0.493	S	S	*	.	B	Isolated β-bridge	trans	-88.4	151.6	171.5	0	0	0	0	0	111.7	L159	A151-L159 VanDerWaalsContact O-CD1 3.28Å; A151-L159 WeakPolarHBondContact O-CD1 3.34Å
152	S	89.4	Confident	90.2	Very high	33 Å²	33	89.8 Å²	89.8	23%	0.231	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-71.2	154.8	170.5	-173.7	0	0	0	0	110.9	E154 K157	S152-E154 VanDerWaalsContact C-N 3.27Å; S152-E154 PolarHBondContact OG-N 2.69Å; S152-E154 VanDerWaalsContact OG-N 3.09Å; S152-K157 WeakPolarHBondContact CB-O 3.37Å
153	K	88.4	Confident	90.5	Very high	217 Å²	217	88.6 Å²	88.6	94%	0.943	46%	0.46	S	S	*	.	S	Bend	trans	-73.5	-23.5	167.2	-63.4	-175.3	-179.4	-176.2	0	112.4
154	E	86.8	Confident	90.6	Very high	110 Å²	110	85.1 Å²	85.1	51%	0.514	44%	0.437	S	S	.	.	S	Bend	trans	-90.4	128.2	178.7	-65.8	-179.5	-151.3	0	0	110.2	S152 K157	S152-E154 VanDerWaalsContact C-N 3.27Å; S152-E154 PolarHBondContact OG-N 2.69Å; S152-E154 VanDerWaalsContact OG-N 3.09Å; E154-K157 HydrophobicContact CB-CB 4.25Å; E154-K157 HydrophobicContact CB-CD 4.14Å; E154-K157 HydrophobicContact CB-CG 4.28Å; E154-K157 PolarHBondContact O-N 3.47Å; E154-K157 WeakPolarHBondContact OE2-CD 3.1Å; E154-K157 WeakPolarHBondContact OE2-CE 3.4Å; E154-K157 IonicContact OE2-NZ 2.75Å; E154-K157 PolarHBondContact OE2-NZ 3Å
155	E	84.1	Confident	90.6	Very high	197 Å²	197	82.4 Å²	82.4	92%	0.921	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	137.8	177.5	-170.2	176.9	-178	0	0	111.3	K157	E155-K157 PolarHBondContact O-N 3.46Å; E155-K157 VanDerWaalsContact O-N 3.1Å
156	G	82.8	Confident	90.6	Very high	84 Å²	84	78.2 Å²	78.2	87%	0.866	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	-3.7	178.9	0	0	0	0	0	115.6
157	K	85.1	Confident	90.6	Very high	127 Å²	127	79.6 Å²	79.6	55%	0.552	41%	0.408	S	S	*	.			trans	-98.7	136.4	175.2	-65.1	-165.5	-172.6	168.9	0	111.3	S152 E154 E155	S152-K157 WeakPolarHBondContact CB-O 3.37Å; E154-K157 HydrophobicContact CB-CB 4.25Å; E154-K157 HydrophobicContact CB-CD 4.14Å; E154-K157 HydrophobicContact CB-CG 4.28Å; E154-K157 PolarHBondContact O-N 3.47Å; E154-K157 WeakPolarHBondContact OE2-CD 3.1Å; E154-K157 WeakPolarHBondContact OE2-CE 3.4Å; E154-K157 IonicContact OE2-NZ 2.75Å; E154-K157 PolarHBondContact OE2-NZ 3Å; E155-K157 PolarHBondContact O-N 3.46Å; E155-K157 VanDerWaalsContact O-N 3.1Å
158	K	81.6	Confident	90.4	Very high	169 Å²	169	84.4 Å²	84.4	74%	0.735	43%	0.43	S	S	*	.	B	Isolated β-bridge	trans	-98.3	142	171.4	-65.5	-174.6	178.5	-175.3	0	110.1	K160	K158-K160 PolarHBondContact O-N 3.5Å
159	L	86.9	Confident	90.2	Very high	61 Å²	61	89.4 Å²	89.4	32%	0.319	46%	0.457	S	S	.	.			trans	-82.5	103.3	169.8	-70.7	176.1	0	0	0	109	P150 A151	P150-L159 HydrophobicContact CB-CD1 4.12Å; P150-L159 HydrophobicContact CG-CB 4.43Å; P150-L159 HydrophobicContact CG-CD1 4.11Å; A151-L159 VanDerWaalsContact O-CD1 3.28Å; A151-L159 WeakPolarHBondContact O-CD1 3.34Å
160	K	87.3	Confident	90.2	Very high	161 Å²	161	87.7 Å²	87.7	70%	0.7	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	153	177.3	-61.8	-172.6	178.6	-172.9	0	111.6	E65 K158 R162	E65-K160 VanDerWaalsContact OE1-CA 3.25Å; E65-K160 WeakPolarHBondContact OE1-CA 3.3Å; K158-K160 PolarHBondContact O-N 3.5Å; K160-R162 VanDerWaalsContact C-N 3.26Å; K160-R162 PolarHBondContact O-N 3.17Å
161	K	89.2	Confident	90.2	Very high	106 Å²	106	87.9 Å²	87.9	46%	0.461	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	30.5	174.3	-52.6	-179.1	-174.6	-97.3	0	114.2	E65 D67 K176 G177	E65-K161 PolarHBondContact OE1-N 3.04Å; D67-K161 IonicContact OD1-NZ 3.57Å; D67-K161 PolarHBondContact OD1-NZ 3.49Å; D67-K161 IonicContact OD2-NZ 2.86Å; K161-K176 CarbonylContact O-C 3.53Å; K161-G177 WeakPolarHBondContact O-CA 3.37Å
162	R	92.8	Very high	90.3	Very high	71 Å²	71	87.3 Å²	87.3	27%	0.268	44%	0.441	S	S	.	.			trans	-129.1	110.9	173.3	-64.7	-171.8	-176.9	-136.7	-0.7	109.9	P150 K160 K176 F178 E179	P150-R162 WeakPolarHBondContact CD-O 3.38Å; P150-R162 HydrophobicContact CG-CB 3.66Å; K160-R162 VanDerWaalsContact C-N 3.26Å; K160-R162 PolarHBondContact O-N 3.17Å; R162-K176 WeakPolarHBondContact CA-O 3.45Å; R162-F178 HydrophobicContact CB-CZ 4.38Å; R162-E179 IonicContact CZ-OE1 2.88Å; R162-E179 IonicContact NH1-OE1 2.85Å; R162-E179 PolarHBondContact NH1-OE1 3.42Å; R162-E179 IonicContact NH1-OE2 3.68Å; R162-E179 IonicContact NH2-OE1 3.79Å
163	Y	94.2	Very high	90.5	Very high	7 Å²	7	87.6 Å²	87.6	3%	0.027	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	153.5	179.3	46.4	-97.8	0	0	0	111.5	E65 W72 M147 I148 V165 E174 K176	E65-Y163 HydrophobicContact CG-CD1 4.13Å; E65-Y163 HydrophobicContact CG-CE1 4.14Å; W72-Y163 HydrophobicContact CZ2-CE2 4.34Å; W72-Y163 AromaticContact NE1-CE2 3.64Å; W72-Y163 AromaticContact NE1-CZ 3.61Å; M147-Y163 HydrophobicContact CE-CD1 4.31Å; M147-Y163 HydrophobicContact CE-CD2 4.23Å; M147-Y163 HydrophobicContact CE-CG 3.82Å; I148-Y163 VanDerWaalsContact O-CA 3.3Å; I148-Y163 WeakPolarHBondContact O-CA 3.44Å; Y163-V165 HydrophobicContact CD2-CG2 4.15Å; Y163-E174 HydrophobicContact CE2-CG 4.17Å; Y163-K176 HydrophobicContact CD1-CB 4.26Å; Y163-K176 HydrophobicContact CD2-CB 3.83Å; Y163-K176 HydrophobicContact CE1-CB 3.97Å; Y163-K176 HydrophobicContact CE1-CG 4.11Å; Y163-K176 HydrophobicContact CE2-CB 3.49Å; Y163-K176 VanDerWaalsContact CE2-CB 3.49Å; Y163-K176 HydrophobicContact CE2-CG 4.17Å; Y163-K176 HydrophobicContact CG-CB 4.2Å; Y163-K176 PolarHBondContact N-O 3.42Å; Y163-K176 PolarHBondContact O-N 2.75Å
164	A	95.6	Very high	90.6	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.4	171.8	0	0	0	0	0	108.5	M147 I148 F166 E174 L175 F178 F197	M147-A164 CarbonylContact C-O 3.54Å; M147-A164 VanDerWaalsContact CA-O 3.32Å; M147-A164 WeakPolarHBondContact CA-O 3.18Å; I148-A164 HydrophobicContact CB-CB 4.44Å; I148-A164 PolarHBondContact N-O 3.34Å; I148-A164 PolarHBondContact O-N 3.27Å; A164-F166 HydrophobicContact CB-CE2 4.36Å; A164-E174 WeakPolarHBondContact CA-O 3.48Å; A164-L175 HydrophobicContact CB-CD1 3.54Å; A164-F178 HydrophobicContact CB-CE2 4.44Å; A164-F197 HydrophobicContact CB-CD1 3.77Å; A164-F197 HydrophobicContact CB-CE1 3.76Å; A164-F197 HydrophobicContact CB-CG 4.32Å; A164-F197 HydrophobicContact CB-CZ 4.28Å
165	V	96.1	Very high	90.9	Very high	0 Å²	0	76 Å²	76	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.2	-176.8	-176.7	0	0	0	0	109	W72 Y144 A146 M147 Y163 A173 E174	W72-V165 HydrophobicContact CE3-CG2 4.33Å; W72-V165 HydrophobicContact CH2-CB 4.27Å; W72-V165 HydrophobicContact CH2-CG1 3.93Å; W72-V165 HydrophobicContact CH2-CG2 3.72Å; W72-V165 HydrophobicContact CZ2-CG2 3.98Å; W72-V165 HydrophobicContact CZ3-CG1 3.89Å; W72-V165 HydrophobicContact CZ3-CG2 3.89Å; Y144-V165 HydrophobicContact CD1-CG1 3.48Å; Y144-V165 VanDerWaalsContact CD1-CG1 3.48Å; Y144-V165 HydrophobicContact CD2-CG1 3.94Å; Y144-V165 HydrophobicContact CE1-CG1 3.83Å; Y144-V165 HydrophobicContact CE2-CG1 4.27Å; Y144-V165 HydrophobicContact CG-CG1 3.5Å; A146-V165 WeakPolarHBondContact O-CA 3.42Å; M147-V165 HydrophobicContact CB-CG2 4.46Å; M147-V165 HydrophobicContact CE-CG2 4.45Å; M147-V165 HydrophobicContact CG-CG2 3.98Å; M147-V165 HydrophobicContact SD-CG2 4.49Å; Y163-V165 HydrophobicContact CD2-CG2 4.15Å; V165-A173 HydrophobicContact CB-CB 4.44Å; V165-A173 HydrophobicContact CG1-CB 4.25Å; V165-A173 WeakPolarHBondContact O-CB 3.3Å; V165-A173 PolarHBondContact O-N 2.98Å; V165-E174 HydrophobicContact CB-CB 4.43Å; V165-E174 PolarHBondContact N-O 3.45Å; V165-E174 PolarHBondContact O-N 3.11Å
166	F	96.3	Very high	91.3	Very high	8 Å²	8	70.4 Å²	70.4	4%	0.035	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.6	-177.9	-69.5	-87.1	0	0	0	111.8	L145 A146 I148 A164 G170 S171 L172 F197 L201	L145-F166 HydrophobicContact CB-CB 4.5Å; L145-F166 PolarHBondContact N-O 3.13Å; A146-F166 HydrophobicContact CB-CB 4.45Å; A146-F166 HydrophobicContact CB-CD2 4.45Å; A146-F166 PolarHBondContact O-N 3.32Å; I148-F166 HydrophobicContact CD1-CD2 3.83Å; I148-F166 HydrophobicContact CD1-CE2 3.73Å; A164-F166 HydrophobicContact CB-CE2 4.36Å; F166-G170 WeakPolarHBondContact CD1-O 3.34Å; F166-S171 WeakPolarHBondContact CA-O 3.05Å; F166-L172 HydrophobicContact CD1-CB 4.35Å; F166-L172 HydrophobicContact CD1-CD1 4.26Å; F166-L172 HydrophobicContact CE1-CB 4.13Å; F166-L172 HydrophobicContact CE1-CD1 3.83Å; F166-L172 HydrophobicContact CE2-CD1 4.33Å; F166-L172 HydrophobicContact CZ-CD1 3.89Å; F166-F197 HydrophobicContact CE2-CB 4.47Å; F166-F197 HydrophobicContact CZ-CB 3.94Å; F166-F197 WeakPolarHBondContact CZ-O 3.24Å; F166-L201 HydrophobicContact CB-CD2 4.15Å; F166-L201 HydrophobicContact CD1-CD1 3.71Å; F166-L201 HydrophobicContact CD1-CD2 4.38Å; F166-L201 HydrophobicContact CD1-CG 4.41Å; F166-L201 HydrophobicContact CD2-CD2 3.99Å; F166-L201 HydrophobicContact CE1-CD1 3.89Å; F166-L201 HydrophobicContact CE1-CG 4.47Å; F166-L201 HydrophobicContact CE2-CD2 4.43Å; F166-L201 HydrophobicContact CG-CD1 4.1Å; F166-L201 HydrophobicContact CG-CD2 3.93Å; F166-L201 HydrophobicContact CG-CG 4.43Å; F166-L201 HydrophobicContact CZ-CD1 4.43Å
167	N	95.1	Very high	91.6	Very high	55 Å²	55	67.9 Å²	67.9	29%	0.294	34%	0.341	S	S	.	.			trans	-71.6	165.1	171.9	-68.5	-42.6	0	0	0	111.3	Y144 L145 D169 G170 S171 A173	Y144-N167 WeakPolarHBondContact CE1-OD1 3.44Å; L145-N167 WeakPolarHBondContact CB-O 3.31Å; L145-N167 WeakPolarHBondContact CD2-O 3.45Å; N167-D169 VanDerWaalsContact CB-OD1 3.24Å; N167-D169 WeakPolarHBondContact CB-OD1 3.49Å; N167-D169 PolarHBondContact O-N 3.03Å; N167-G170 WeakPolarHBondContact O-CA 3.36Å; N167-G170 PolarHBondContact O-N 3.24Å; N167-S171 PolarHBondContact N-O 2.82Å; N167-S171 PolarHBondContact ND2-OG 2.96Å; N167-A173 WeakPolarHBondContact OD1-CB 3.3Å
168	E	93	Very high	91.9	Very high	147 Å²	147	62.6 Å²	62.6	69%	0.687	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-30	175.8	-68.2	-166.7	158.9	0	0	114	G170	E168-G170 PolarHBondContact O-N 3.4Å
169	D	93.1	Very high	92.4	Very high	129 Å²	129	56 Å²	56	69%	0.69	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	1.1	176.1	71.2	-8.3	0	0	0	113.7	N167 S171	N167-D169 VanDerWaalsContact CB-OD1 3.24Å; N167-D169 WeakPolarHBondContact CB-OD1 3.49Å; N167-D169 PolarHBondContact O-N 3.03Å; D169-S171 VanDerWaalsContact C-N 3.28Å; D169-S171 PolarHBondContact O-N 3.11Å; D169-S171 WeakPolarHBondContact OD1-CB 3.48Å; D169-S171 PolarHBondContact OD1-N 3.36Å; D169-S171 PolarHBondContact OD1-OG 2.83Å; D169-S171 PolarHBondContact OD2-OG 3.48Å
170	G	92.9	Very high	92.4	Very high	27 Å²	27	55 Å²	55	28%	0.278	29%	0.287	S	S	.	.	S	Bend	trans	80.8	0.7	-177.2	0	0	0	0	0	114.3	F166 N167 E168 L201	F166-G170 WeakPolarHBondContact CD1-O 3.34Å; N167-G170 WeakPolarHBondContact O-CA 3.36Å; N167-G170 PolarHBondContact O-N 3.24Å; E168-G170 PolarHBondContact O-N 3.4Å; G170-L201 WeakPolarHBondContact O-CD1 3.39Å
171	S	93.4	Very high	92.3	Very high	46 Å²	46	54.3 Å²	54.3	32%	0.322	28%	0.283	S	S	.	.			trans	-72.2	148.1	174.8	69.2	0	0	0	0	111.6	F166 N167 D169 A173	F166-S171 WeakPolarHBondContact CA-O 3.05Å; N167-S171 PolarHBondContact N-O 2.82Å; N167-S171 PolarHBondContact ND2-OG 2.96Å; D169-S171 VanDerWaalsContact C-N 3.28Å; D169-S171 PolarHBondContact O-N 3.11Å; D169-S171 WeakPolarHBondContact OD1-CB 3.48Å; D169-S171 PolarHBondContact OD1-N 3.36Å; D169-S171 PolarHBondContact OD1-OG 2.83Å; D169-S171 PolarHBondContact OD2-OG 3.48Å; S171-A173 PolarHBondContact O-N 3.4Å
172	L	92.9	Very high	92	Very high	78 Å²	78	55.3 Å²	55.3	41%	0.408	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	111.9	177.8	-177.8	71.3	0	0	0	110.1	F166 L175	F166-L172 HydrophobicContact CD1-CB 4.35Å; F166-L172 HydrophobicContact CD1-CD1 4.26Å; F166-L172 HydrophobicContact CE1-CB 4.13Å; F166-L172 HydrophobicContact CE1-CD1 3.83Å; F166-L172 HydrophobicContact CE2-CD1 4.33Å; F166-L172 HydrophobicContact CZ-CD1 3.89Å; L172-L175 HydrophobicContact CD1-CB 4.27Å; L172-L175 HydrophobicContact CD2-CB 3.96Å; L172-L175 HydrophobicContact CD2-CD2 3.99Å; L172-L175 HydrophobicContact CG-CB 4.38Å
173	A	92.7	Very high	91.2	Very high	39 Å²	39	64.1 Å²	64.1	32%	0.322	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-56.1	-179.9	0	0	0	0	0	111.6	Y144 V165 N167 S171	Y144-A173 HydrophobicContact CD1-CB 4.14Å; Y144-A173 HydrophobicContact CE1-CB 3.58Å; V165-A173 HydrophobicContact CB-CB 4.44Å; V165-A173 HydrophobicContact CG1-CB 4.25Å; V165-A173 WeakPolarHBondContact O-CB 3.3Å; V165-A173 PolarHBondContact O-N 2.98Å; N167-A173 WeakPolarHBondContact OD1-CB 3.3Å; S171-A173 PolarHBondContact O-N 3.4Å
174	E	91.6	Very high	90.4	Very high	61 Å²	61	64.7 Å²	64.7	29%	0.285	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.3	177.7	-171.7	167.7	-173	0	0	111.1	Y163 A164 V165 K176	Y163-E174 HydrophobicContact CE2-CG 4.17Å; A164-E174 WeakPolarHBondContact CA-O 3.48Å; V165-E174 HydrophobicContact CB-CB 4.43Å; V165-E174 PolarHBondContact N-O 3.45Å; V165-E174 PolarHBondContact O-N 3.11Å; E174-K176 IonicContact OE1-NZ 3.4Å; E174-K176 PolarHBondContact OE1-NZ 3.13Å
175	L	92.8	Very high	89.9	Confident	23 Å²	23	66.9 Å²	66.9	12%	0.12	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	111.9	173.2	-173.7	64.8	0	0	0	110.1	A164 L172 F178 V180 K181 F197	A164-L175 HydrophobicContact CB-CD1 3.54Å; L172-L175 HydrophobicContact CD1-CB 4.27Å; L172-L175 HydrophobicContact CD2-CB 3.96Å; L172-L175 HydrophobicContact CD2-CD2 3.99Å; L172-L175 HydrophobicContact CG-CB 4.38Å; L175-F178 HydrophobicContact CD1-CB 4.41Å; L175-F178 HydrophobicContact CD1-CD2 3.49Å; L175-F178 VanDerWaalsContact CD1-CD2 3.49Å; L175-F178 HydrophobicContact CD1-CE2 4.13Å; L175-F178 HydrophobicContact CD1-CG 4.29Å; L175-F178 HydrophobicContact CG-CD2 4.31Å; L175-V180 HydrophobicContact CD2-CG1 3.31Å; L175-V180 HydrophobicContact CG-CG1 4.29Å; L175-K181 HydrophobicContact CB-CG 4.43Å; L175-K181 HydrophobicContact CD2-CG 4.07Å; L175-K181 HydrophobicContact CG-CG 4.25Å; L175-F197 HydrophobicContact CD1-CD2 4.1Å; L175-F197 HydrophobicContact CD1-CE2 3.66Å; L175-F197 HydrophobicContact CD1-CZ 3.99Å; L175-F197 HydrophobicContact CD2-CE2 4.44Å
176	K	91.6	Very high	89.6	Confident	79 Å²	79	69.3 Å²	69.3	34%	0.343	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.5	-172.3	-157	69	154.9	-136.3	0	111.9	K161 R162 Y163 E174 F178	K161-K176 CarbonylContact O-C 3.53Å; R162-K176 WeakPolarHBondContact CA-O 3.45Å; Y163-K176 HydrophobicContact CD1-CB 4.26Å; Y163-K176 HydrophobicContact CD2-CB 3.83Å; Y163-K176 HydrophobicContact CE1-CB 3.97Å; Y163-K176 HydrophobicContact CE1-CG 4.11Å; Y163-K176 HydrophobicContact CE2-CB 3.49Å; Y163-K176 VanDerWaalsContact CE2-CB 3.49Å; Y163-K176 HydrophobicContact CE2-CG 4.17Å; Y163-K176 HydrophobicContact CG-CB 4.2Å; Y163-K176 PolarHBondContact N-O 3.42Å; Y163-K176 PolarHBondContact O-N 2.75Å; E174-K176 IonicContact OE1-NZ 3.4Å; E174-K176 PolarHBondContact OE1-NZ 3.13Å; K176-F178 WeakPolarHBondContact O-CD2 3.27Å; K176-F178 PolarHBondContact O-N 3.26Å
177	G	89.2	Confident	89.2	Confident	31 Å²	31	72.8 Å²	72.8	32%	0.32	37%	0.365	S	S	.	.	S	Bend	trans	70.9	-4.8	166.2	0	0	0	0	0	117.1	K161	K161-G177 WeakPolarHBondContact O-CA 3.37Å
178	F	92.2	Very high	89.1	Confident	16 Å²	16	71 Å²	71	7%	0.07	36%	0.355	C	S	.	.			trans	-81.4	148.9	175.7	-70.3	-74.4	0	0	0	112.9	P150 R162 A164 L175 K176 V180 K181 F197	P150-F178 HydrophobicContact CB-CE1 4.5Å; P150-F178 HydrophobicContact CB-CZ 4.46Å; P150-F178 HydrophobicContact CG-CE1 4.12Å; P150-F178 HydrophobicContact CG-CZ 3.86Å; R162-F178 HydrophobicContact CB-CZ 4.38Å; A164-F178 HydrophobicContact CB-CE2 4.44Å; L175-F178 HydrophobicContact CD1-CB 4.41Å; L175-F178 HydrophobicContact CD1-CD2 3.49Å; L175-F178 VanDerWaalsContact CD1-CD2 3.49Å; L175-F178 HydrophobicContact CD1-CE2 4.13Å; L175-F178 HydrophobicContact CD1-CG 4.29Å; L175-F178 HydrophobicContact CG-CD2 4.31Å; K176-F178 WeakPolarHBondContact O-CD2 3.27Å; K176-F178 PolarHBondContact O-N 3.26Å; F178-V180 HydrophobicContact CB-CG1 4.07Å; F178-V180 PolarHBondContact O-N 3.49Å; F178-K181 PolarHBondContact O-N 3.03Å; F178-K181 VanDerWaalsContact O-N 3.11Å; F178-F197 HydrophobicContact CB-CE2 4.44Å; F178-F197 HydrophobicContact CB-CZ 4.48Å; F178-F197 HydrophobicContact CD1-CE2 4.42Å; F178-F197 AromaticContact CD1-CZ 3.74Å; F178-F197 HydrophobicContact CD1-CZ 3.74Å; F178-F197 HydrophobicContact CD2-CE1 4.48Å; F178-F197 HydrophobicContact CD2-CE2 4.17Å; F178-F197 AromaticContact CD2-CZ 3.6Å; F178-F197 HydrophobicContact CD2-CZ 3.6Å; F178-F197 HydrophobicContact CE1-CE1 4.35Å; F178-F197 AromaticContact CE1-CZ 3.71Å; F178-F197 HydrophobicContact CE1-CZ 3.71Å; F178-F197 HydrophobicContact CE2-CE1 4Å; F178-F197 HydrophobicContact CE2-CE2 4.49Å; F178-F197 AromaticContact CE2-CZ 3.53Å; F178-F197 HydrophobicContact CE2-CZ 3.53Å; F178-F197 HydrophobicContact CG-CE2 4.1Å; F178-F197 AromaticContact CG-CZ 3.68Å; F178-F197 HydrophobicContact CG-CZ 3.68Å; F178-F197 AromaticContact CZ-CE1 3.94Å; F178-F197 HydrophobicContact CZ-CE1 3.94Å; F178-F197 AromaticContact CZ-CZ 3.59Å; F178-F197 HydrophobicContact CZ-CZ 3.59Å
179	E	90.6	Very high	89.1	Confident	32 Å²	32	67 Å²	67	15%	0.15	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-58.4	-30.9	-175.7	-70.4	71.6	-163.4	0	0	112.4	R162 K181 R182 E185 I189 K190 Q193	R162-E179 IonicContact CZ-OE1 2.88Å; R162-E179 IonicContact NH1-OE1 2.85Å; R162-E179 PolarHBondContact NH1-OE1 3.42Å; R162-E179 IonicContact NH1-OE2 3.68Å; R162-E179 IonicContact NH2-OE1 3.79Å; E179-K181 VanDerWaalsContact C-N 3.25Å; E179-K181 PolarHBondContact O-N 2.77Å; E179-R182 WeakPolarHBondContact O-CB 3.23Å; E179-R182 PolarHBondContact O-N 2.6Å; E179-E185 HydrophobicContact CB-CB 4.13Å; E179-E185 HydrophobicContact CB-CG 4.06Å; E179-E185 HydrophobicContact CG-CB 4.33Å; E179-E185 HydrophobicContact CG-CG 4.01Å; E179-I189 HydrophobicContact CB-CG2 4.2Å; E179-I189 HydrophobicContact CG-CG2 4.45Å; E179-K190 WeakPolarHBondContact O-CE 3.32Å; E179-Q193 PolarHBondContact OE2-NE2 2.97Å
180	V	88.8	Confident	89.1	Confident	39 Å²	39	62.4 Å²	62.4	24%	0.236	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-56.6	-32.2	174.7	64.3	0	0	0	0	114.3	L175 F178 K190 Q193	L175-V180 HydrophobicContact CD2-CG1 3.31Å; L175-V180 HydrophobicContact CG-CG1 4.29Å; F178-V180 HydrophobicContact CB-CG1 4.07Å; F178-V180 PolarHBondContact O-N 3.49Å; V180-K190 HydrophobicContact CB-CB 4.37Å; V180-K190 HydrophobicContact CG2-CB 4.46Å; V180-Q193 HydrophobicContact CB-CB 4.41Å
181	K	84.6	Confident	89	Confident	146 Å²	146	63.8 Å²	63.8	64%	0.635	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-89.2	-7.8	175.7	-74.1	-74.3	-173.7	178.9	0	113.3	L175 F178 E179	L175-K181 HydrophobicContact CB-CG 4.43Å; L175-K181 HydrophobicContact CD2-CG 4.07Å; L175-K181 HydrophobicContact CG-CG 4.25Å; F178-K181 PolarHBondContact O-N 3.03Å; F178-K181 VanDerWaalsContact O-N 3.11Å; E179-K181 VanDerWaalsContact C-N 3.25Å; E179-K181 PolarHBondContact O-N 2.77Å
182	R	83.4	Confident	89.1	Confident	127 Å²	127	64.6 Å²	64.6	48%	0.479	31%	0.31	S	S	.	.	S	Bend	trans	-86	142.8	-177.5	-61.4	-177.2	114.2	-164.4	8.2	110.8	E179 E185 K190	E179-R182 WeakPolarHBondContact O-CB 3.23Å; E179-R182 PolarHBondContact O-N 2.6Å; R182-E185 HydrophobicContact CB-CG 3.95Å; R182-E185 IonicContact CZ-OE1 2.7Å; R182-E185 IonicContact NH1-OE1 3.16Å; R182-E185 PolarHBondContact NH1-OE1 2.97Å; R182-K190 PolarHBondContact O-NZ 3.46Å
183	R	75.3	Confident	89.2	Confident	256 Å²	256	61.8 Å²	61.8	97%	0.966	30%	0.295	S	S	*	.	S	Bend	trans	-74.1	129.1	168.1	-66.2	-177.4	-179.6	-178.7	-0.6	108
184	G	76.6	Confident	89.1	Confident	19 Å²	19	62.4 Å²	62.4	20%	0.196	30%	0.297	C	S	.	.	S	Bend	trans	80	-157.5	-167.6	0	0	0	0	0	112.9	K190 N243	G184-K190 WeakPolarHBondContact O-CE 3.25Å; G184-K190 PolarHBondContact O-NZ 2.87Å; G184-N243 WeakPolarHBondContact CA-O 3.25Å
185	E	85.9	Confident	89.2	Confident	47 Å²	47	61.3 Å²	61.3	22%	0.22	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.5	162.2	-169.7	-47.2	-71.8	-178.6	0	0	113.8	E179 R182 Q187	E179-E185 HydrophobicContact CB-CB 4.13Å; E179-E185 HydrophobicContact CB-CG 4.06Å; E179-E185 HydrophobicContact CG-CB 4.33Å; E179-E185 HydrophobicContact CG-CG 4.01Å; R182-E185 HydrophobicContact CB-CG 3.95Å; R182-E185 IonicContact CZ-OE1 2.7Å; R182-E185 IonicContact NH1-OE1 3.16Å; R182-E185 PolarHBondContact NH1-OE1 2.97Å; E185-Q187 PolarHBondContact O-N 3.26Å
186	L	89.7	Confident	89.3	Confident	51 Å²	51	60.9 Å²	60.9	27%	0.267	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	122.9	-176.5	-175	62.3	0	0	0	111.1	L188 I189 K190 L239 I240	L186-L188 VanDerWaalsContact C-N 3.29Å; L186-L188 HydrophobicContact CD2-CB 4.24Å; L186-L188 HydrophobicContact CD2-CD2 4.49Å; L186-L188 HydrophobicContact CG-CB 4.03Å; L186-L188 PolarHBondContact O-N 3.49Å; L186-I189 HydrophobicContact CB-CB 4.5Å; L186-I189 HydrophobicContact CB-CG1 4.09Å; L186-I189 HydrophobicContact CD2-CG1 4Å; L186-I189 HydrophobicContact CG-CG1 4.31Å; L186-I189 PolarHBondContact O-N 3.06Å; L186-K190 PolarHBondContact O-N 2.96Å; L186-L239 WeakPolarHBondContact CD1-O 3.17Å; L186-I240 VanDerWaalsContact CD1-O 3.25Å; L186-I240 WeakPolarHBondContact CD1-O 3.42Å
187	Q	88.8	Confident	89.5	Confident	80 Å²	80	57.8 Å²	57.8	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-38.4	-174.9	-174.6	63.1	5.8	0	0	112.6	E185 I189 K190 I191 E238	E185-Q187 PolarHBondContact O-N 3.26Å; Q187-I189 VanDerWaalsContact C-N 3.27Å; Q187-I189 PolarHBondContact O-N 3.28Å; Q187-K190 WeakPolarHBondContact O-CB 3.2Å; Q187-K190 PolarHBondContact O-N 2.88Å; Q187-K190 VanDerWaalsContact O-N 3.09Å; Q187-I191 HydrophobicContact CG-CD1 3.98Å; Q187-I191 WeakPolarHBondContact O-CG1 3.42Å; Q187-I191 PolarHBondContact O-N 3.36Å; Q187-I191 VanDerWaalsContact O-N 3.07Å; Q187-E238 VanDerWaalsContact CB-O 3.25Å; Q187-E238 WeakPolarHBondContact CB-O 3.32Å
188	L	92.4	Very high	89.6	Confident	17 Å²	17	62.2 Å²	62.2	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-49.4	-47	171.9	-178	71.4	0	0	0	112.4	L186 K190 I191 F192 W220 L224 L239	L186-L188 VanDerWaalsContact C-N 3.29Å; L186-L188 HydrophobicContact CD2-CB 4.24Å; L186-L188 HydrophobicContact CD2-CD2 4.49Å; L186-L188 HydrophobicContact CG-CB 4.03Å; L186-L188 PolarHBondContact O-N 3.49Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 2.91Å; L188-I191 PolarHBondContact O-N 3.21Å; L188-F192 VanDerWaalsContact O-CB 3.27Å; L188-F192 WeakPolarHBondContact O-CB 3.25Å; L188-F192 PolarHBondContact O-N 2.82Å; L188-W220 HydrophobicContact CD1-CD2 4.36Å; L188-W220 HydrophobicContact CD1-CE3 3.33Å; L188-W220 HydrophobicContact CD1-CH2 4.23Å; L188-W220 HydrophobicContact CD1-CZ3 3.25Å; L188-L224 HydrophobicContact CD2-CD1 4.31Å; L188-L224 HydrophobicContact CD2-CD2 3.85Å; L188-L224 HydrophobicContact CD2-CG 4.43Å; L188-L239 WeakPolarHBondContact CB-O 3.28Å; L188-L239 HydrophobicContact CD1-CB 4.48Å; L188-L239 PolarHBondContact N-O 3.18Å
189	I	93.4	Very high	89.8	Confident	63 Å²	63	61.5 Å²	61.5	32%	0.323	29%	0.29	S	S	.	.	H	α-helix	trans	-68.3	-36	-178	-62.4	-61.5	0	0	0	111.1	E179 L186 Q187 Q193	E179-I189 HydrophobicContact CB-CG2 4.2Å; E179-I189 HydrophobicContact CG-CG2 4.45Å; L186-I189 HydrophobicContact CB-CB 4.5Å; L186-I189 HydrophobicContact CB-CG1 4.09Å; L186-I189 HydrophobicContact CD2-CG1 4Å; L186-I189 HydrophobicContact CG-CG1 4.31Å; L186-I189 PolarHBondContact O-N 3.06Å; Q187-I189 VanDerWaalsContact C-N 3.27Å; Q187-I189 PolarHBondContact O-N 3.28Å; I189-Q193 HydrophobicContact CG2-CG 4.31Å; I189-Q193 WeakPolarHBondContact O-CB 3.5Å; I189-Q193 VanDerWaalsContact O-CG 3.23Å; I189-Q193 WeakPolarHBondContact O-CG 3.45Å; I189-Q193 PolarHBondContact O-N 2.66Å
190	K	91.7	Very high	90	Very high	33 Å²	33	61.9 Å²	61.9	14%	0.143	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-46.4	177.2	-60.2	-168.8	178.5	-175.8	0	111.7	E179 V180 R182 G184 L186 Q187 L188 Q193 S194	E179-K190 WeakPolarHBondContact O-CE 3.32Å; V180-K190 HydrophobicContact CB-CB 4.37Å; V180-K190 HydrophobicContact CG2-CB 4.46Å; R182-K190 PolarHBondContact O-NZ 3.46Å; G184-K190 WeakPolarHBondContact O-CE 3.25Å; G184-K190 PolarHBondContact O-NZ 2.87Å; L186-K190 PolarHBondContact O-N 2.96Å; Q187-K190 WeakPolarHBondContact O-CB 3.2Å; Q187-K190 PolarHBondContact O-N 2.88Å; Q187-K190 VanDerWaalsContact O-N 3.09Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 2.91Å; K190-Q193 PolarHBondContact O-N 3.03Å; K190-S194 PolarHBondContact O-N 3.22Å; K190-S194 PolarHBondContact O-OG 3.43Å; K190-S194 VanDerWaalsContact O-OG 3.13Å
191	I	92.2	Very high	90.4	Very high	56 Å²	56	62.9 Å²	62.9	29%	0.287	30%	0.295	S	S	.	.	H	α-helix	trans	-68.2	-41.8	-179.9	-60.8	167.1	0	0	0	110.1	Q187 L188 Q193 S194 S195 W220 L239	Q187-I191 HydrophobicContact CG-CD1 3.98Å; Q187-I191 WeakPolarHBondContact O-CG1 3.42Å; Q187-I191 PolarHBondContact O-N 3.36Å; Q187-I191 VanDerWaalsContact O-N 3.07Å; L188-I191 PolarHBondContact O-N 3.21Å; I191-Q193 PolarHBondContact O-N 3.29Å; I191-S194 PolarHBondContact O-N 3.44Å; I191-S195 WeakPolarHBondContact O-CB 3.33Å; I191-S195 PolarHBondContact O-N 3.28Å; I191-S195 PolarHBondContact O-OG 3.47Å; I191-W220 HydrophobicContact CB-CH2 4.32Å; I191-W220 HydrophobicContact CB-CZ2 4.23Å; I191-W220 HydrophobicContact CG2-CH2 3.79Å; I191-W220 HydrophobicContact CG2-CZ2 3.49Å; I191-W220 VanDerWaalsContact CG2-CZ2 3.49Å; I191-L239 HydrophobicContact CD1-CD2 3.38Å
192	F	94.9	Very high	90.9	Very high	63 Å²	63	61.6 Å²	61.6	28%	0.276	29%	0.289	S	S	.	.	H	α-helix	trans	-55.1	-50.3	172.5	172.8	-115.6	0	0	0	111.5	L188 S194 S195 V196 A217 W220	L188-F192 VanDerWaalsContact O-CB 3.27Å; L188-F192 WeakPolarHBondContact O-CB 3.25Å; L188-F192 PolarHBondContact O-N 2.82Å; F192-S194 PolarHBondContact O-N 3.07Å; F192-S195 PolarHBondContact O-N 3.09Å; F192-V196 HydrophobicContact CD2-CG2 3.69Å; F192-V196 HydrophobicContact CE1-CG2 4.15Å; F192-V196 HydrophobicContact CE2-CG2 3.25Å; F192-V196 HydrophobicContact CG-CG2 4.32Å; F192-V196 HydrophobicContact CZ-CG2 3.53Å; F192-V196 WeakPolarHBondContact O-CB 3.32Å; F192-V196 WeakPolarHBondContact O-CG2 3.3Å; F192-V196 PolarHBondContact O-N 3.11Å; F192-A217 HydrophobicContact CE2-CB 4.33Å; F192-W220 HydrophobicContact CD2-CB 4.23Å; F192-W220 AromaticContact CD2-CD1 3.44Å; F192-W220 VanDerWaalsContact CD2-CD1 3.44Å; F192-W220 AromaticContact CD2-CG 3.88Å; F192-W220 HydrophobicContact CD2-CG 3.88Å
193	Q	94.3	Very high	91.5	Very high	20 Å²	20	57.8 Å²	57.8	9%	0.093	29%	0.29	C	S	.	.	H	α-helix	trans	-58.8	-48.8	179	-80	177.3	-7	0	0	112.3	E179 V180 I189 K190 I191 S195 V196 F197	E179-Q193 PolarHBondContact OE2-NE2 2.97Å; V180-Q193 HydrophobicContact CB-CB 4.41Å; I189-Q193 HydrophobicContact CG2-CG 4.31Å; I189-Q193 WeakPolarHBondContact O-CB 3.5Å; I189-Q193 VanDerWaalsContact O-CG 3.23Å; I189-Q193 WeakPolarHBondContact O-CG 3.45Å; I189-Q193 PolarHBondContact O-N 2.66Å; K190-Q193 PolarHBondContact O-N 3.03Å; I191-Q193 PolarHBondContact O-N 3.29Å; Q193-S195 VanDerWaalsContact C-N 3.29Å; Q193-S195 PolarHBondContact O-N 3.33Å; Q193-V196 PolarHBondContact O-N 3.22Å; Q193-F197 HydrophobicContact CB-CD2 4.31Å; Q193-F197 HydrophobicContact CB-CE2 3.87Å; Q193-F197 HydrophobicContact CG-CE2 4.38Å; Q193-F197 WeakPolarHBondContact O-CD2 3.25Å; Q193-F197 VanDerWaalsContact O-CG 3.31Å; Q193-F197 WeakPolarHBondContact O-CG 3.46Å; Q193-F197 PolarHBondContact O-N 2.99Å
194	S	91.4	Very high	92.4	Very high	51 Å²	51	50.7 Å²	50.7	36%	0.357	28%	0.279	S	S	.	.	H	α-helix	trans	-55.6	-46.6	176.4	-58.7	0	0	0	0	111.7	K190 I191 F192 V196 F197 E198	K190-S194 PolarHBondContact O-N 3.22Å; K190-S194 PolarHBondContact O-OG 3.43Å; K190-S194 VanDerWaalsContact O-OG 3.13Å; I191-S194 PolarHBondContact O-N 3.44Å; F192-S194 PolarHBondContact O-N 3.07Å; S194-V196 PolarHBondContact O-N 3.22Å; S194-F197 PolarHBondContact O-N 2.65Å; S194-E198 PolarHBondContact O-N 3.34Å
195	S	93.1	Very high	93.4	Very high	38 Å²	38	52.6 Å²	52.6	27%	0.266	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-39.3	-178.6	-51.6	0	0	0	0	112.5	I191 F192 Q193 A199	I191-S195 WeakPolarHBondContact O-CB 3.33Å; I191-S195 PolarHBondContact O-N 3.28Å; I191-S195 PolarHBondContact O-OG 3.47Å; F192-S195 PolarHBondContact O-N 3.09Å; Q193-S195 VanDerWaalsContact C-N 3.29Å; Q193-S195 PolarHBondContact O-N 3.33Å; S195-A199 PolarHBondContact O-N 3.16Å
196	V	95.4	Very high	93.9	Very high	15 Å²	15	55.7 Å²	55.7	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-41	-179.7	162.4	0	0	0	0	111.6	F192 Q193 S194 E198 A199 F200 V213 V216	F192-V196 HydrophobicContact CD2-CG2 3.69Å; F192-V196 HydrophobicContact CE1-CG2 4.15Å; F192-V196 HydrophobicContact CE2-CG2 3.25Å; F192-V196 HydrophobicContact CG-CG2 4.32Å; F192-V196 HydrophobicContact CZ-CG2 3.53Å; F192-V196 WeakPolarHBondContact O-CB 3.32Å; F192-V196 WeakPolarHBondContact O-CG2 3.3Å; F192-V196 PolarHBondContact O-N 3.11Å; Q193-V196 PolarHBondContact O-N 3.22Å; S194-V196 PolarHBondContact O-N 3.22Å; V196-E198 VanDerWaalsContact C-N 3.32Å; V196-E198 PolarHBondContact O-N 2.92Å; V196-A199 WeakPolarHBondContact O-CB 2.84Å; V196-A199 PolarHBondContact O-N 2.68Å; V196-A199 VanDerWaalsContact O-N 3.08Å; V196-F200 HydrophobicContact CG1-CD2 3.96Å; V196-F200 HydrophobicContact CG1-CE2 3.44Å; V196-F200 VanDerWaalsContact CG1-CE2 3.44Å; V196-F200 HydrophobicContact CG1-CZ 4.36Å; V196-F200 WeakPolarHBondContact O-CD2 3.12Å; V196-F200 PolarHBondContact O-N 2.9Å; V196-V213 HydrophobicContact CG1-CG1 4.03Å; V196-V216 HydrophobicContact CG2-CB 4.36Å; V196-V216 HydrophobicContact CG2-CG1 3.78Å
197	F	94.9	Very high	94.2	Very high	14 Å²	14	59.9 Å²	59.9	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-40.3	179.3	-70.4	-46.7	0	0	0	112.4	A164 F166 L175 F178 Q193 S194 A199 F200	A164-F197 HydrophobicContact CB-CD1 3.77Å; A164-F197 HydrophobicContact CB-CE1 3.76Å; A164-F197 HydrophobicContact CB-CG 4.32Å; A164-F197 HydrophobicContact CB-CZ 4.28Å; F166-F197 HydrophobicContact CE2-CB 4.47Å; F166-F197 HydrophobicContact CZ-CB 3.94Å; F166-F197 WeakPolarHBondContact CZ-O 3.24Å; L175-F197 HydrophobicContact CD1-CD2 4.1Å; L175-F197 HydrophobicContact CD1-CE2 3.66Å; L175-F197 HydrophobicContact CD1-CZ 3.99Å; L175-F197 HydrophobicContact CD2-CE2 4.44Å; F178-F197 HydrophobicContact CB-CE2 4.44Å; F178-F197 HydrophobicContact CB-CZ 4.48Å; F178-F197 HydrophobicContact CD1-CE2 4.42Å; F178-F197 AromaticContact CD1-CZ 3.74Å; F178-F197 HydrophobicContact CD1-CZ 3.74Å; F178-F197 HydrophobicContact CD2-CE1 4.48Å; F178-F197 HydrophobicContact CD2-CE2 4.17Å; F178-F197 AromaticContact CD2-CZ 3.6Å; F178-F197 HydrophobicContact CD2-CZ 3.6Å; F178-F197 HydrophobicContact CE1-CE1 4.35Å; F178-F197 AromaticContact CE1-CZ 3.71Å; F178-F197 HydrophobicContact CE1-CZ 3.71Å; F178-F197 HydrophobicContact CE2-CE1 4Å; F178-F197 HydrophobicContact CE2-CE2 4.49Å; F178-F197 AromaticContact CE2-CZ 3.53Å; F178-F197 HydrophobicContact CE2-CZ 3.53Å; F178-F197 HydrophobicContact CG-CE2 4.1Å; F178-F197 AromaticContact CG-CZ 3.68Å; F178-F197 HydrophobicContact CG-CZ 3.68Å; F178-F197 AromaticContact CZ-CE1 3.94Å; F178-F197 HydrophobicContact CZ-CE1 3.94Å; F178-F197 AromaticContact CZ-CZ 3.59Å; F178-F197 HydrophobicContact CZ-CZ 3.59Å; Q193-F197 HydrophobicContact CB-CD2 4.31Å; Q193-F197 HydrophobicContact CB-CE2 3.87Å; Q193-F197 HydrophobicContact CG-CE2 4.38Å; Q193-F197 WeakPolarHBondContact O-CD2 3.25Å; Q193-F197 VanDerWaalsContact O-CG 3.31Å; Q193-F197 WeakPolarHBondContact O-CG 3.46Å; Q193-F197 PolarHBondContact O-N 2.99Å; S194-F197 PolarHBondContact O-N 2.65Å; F197-A199 VanDerWaalsContact C-N 3.32Å; F197-A199 PolarHBondContact O-N 2.86Å; F197-F200 HydrophobicContact CD1-CD2 4.4Å; F197-F200 PolarHBondContact O-N 3.31Å
198	E	91.8	Very high	94.7	Very high	123 Å²	123	60.6 Å²	60.6	58%	0.575	33%	0.326	S	S	*	.	H	α-helix	trans	-66.1	-34	172.9	-68.4	178	-171	0	0	112.7	S194 V196 F200 L201	S194-E198 PolarHBondContact O-N 3.34Å; V196-E198 VanDerWaalsContact C-N 3.32Å; V196-E198 PolarHBondContact O-N 2.92Å; E198-F200 VanDerWaalsContact C-N 3.28Å; E198-F200 PolarHBondContact O-N 2.91Å; E198-L201 PolarHBondContact O-N 3.39Å
199	A	95.8	Very high	94.9	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-68.4	-25.4	178.7	0	0	0	0	0	113.3	S195 V196 F197 L201 K202 V213 V216	S195-A199 PolarHBondContact O-N 3.16Å; V196-A199 WeakPolarHBondContact O-CB 2.84Å; V196-A199 PolarHBondContact O-N 2.68Å; V196-A199 VanDerWaalsContact O-N 3.08Å; F197-A199 VanDerWaalsContact C-N 3.32Å; F197-A199 PolarHBondContact O-N 2.86Å; A199-L201 PolarHBondContact O-N 2.96Å; A199-K202 WeakPolarHBondContact O-CB 3.36Å; A199-K202 PolarHBondContact O-N 2.9Å; A199-K202 VanDerWaalsContact O-N 3.1Å; A199-V213 HydrophobicContact CB-CG2 3.99Å; A199-V216 HydrophobicContact CB-CG2 3.85Å
200	F	96.7	Very high	95.1	Very high	41 Å²	41	64.4 Å²	64.4	18%	0.18	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.6	174.7	-82.3	-70.8	0	0	0	113.8	I148 V196 F197 E198 V209 Y210 V213	I148-F200 HydrophobicContact CD1-CB 4.17Å; I148-F200 HydrophobicContact CD1-CG 4.47Å; I148-F200 HydrophobicContact CG1-CB 4Å; I148-F200 HydrophobicContact CG1-CD1 4.12Å; I148-F200 HydrophobicContact CG1-CD2 3.92Å; I148-F200 HydrophobicContact CG1-CE2 4.41Å; I148-F200 HydrophobicContact CG1-CG 3.76Å; I148-F200 HydrophobicContact CG2-CD2 4.23Å; I148-F200 HydrophobicContact CG2-CE1 4.43Å; I148-F200 HydrophobicContact CG2-CE2 3.88Å; I148-F200 HydrophobicContact CG2-CZ 4.01Å; V196-F200 HydrophobicContact CG1-CD2 3.96Å; V196-F200 HydrophobicContact CG1-CE2 3.44Å; V196-F200 VanDerWaalsContact CG1-CE2 3.44Å; V196-F200 HydrophobicContact CG1-CZ 4.36Å; V196-F200 WeakPolarHBondContact O-CD2 3.12Å; V196-F200 PolarHBondContact O-N 2.9Å; F197-F200 HydrophobicContact CD1-CD2 4.4Å; F197-F200 PolarHBondContact O-N 3.31Å; E198-F200 VanDerWaalsContact C-N 3.28Å; E198-F200 PolarHBondContact O-N 2.91Å; F200-V209 HydrophobicContact CD1-CG1 3.97Å; F200-V209 WeakPolarHBondContact O-CG1 3.27Å; F200-Y210 HydrophobicContact CE1-CE1 4.17Å; F200-V213 HydrophobicContact CD1-CG2 3.69Å; F200-V213 HydrophobicContact CD2-CG2 4.07Å; F200-V213 HydrophobicContact CE1-CG2 3.8Å; F200-V213 HydrophobicContact CE2-CG1 4.42Å; F200-V213 HydrophobicContact CE2-CG2 4.19Å; F200-V213 HydrophobicContact CG-CG2 3.83Å; F200-V213 HydrophobicContact CZ-CG1 4.15Å; F200-V213 HydrophobicContact CZ-CG2 4.05Å
201	L	95.9	Very high	95.4	Very high	59 Å²	59	64.4 Å²	64.4	31%	0.309	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	0.1	176.4	-55.8	-176.3	0	0	0	113.2	L145 A146 F166 G170 E198 A199	L145-L201 HydrophobicContact CD2-CD2 4.12Å; A146-L201 HydrophobicContact CB-CD2 3.97Å; F166-L201 HydrophobicContact CB-CD2 4.15Å; F166-L201 HydrophobicContact CD1-CD1 3.71Å; F166-L201 HydrophobicContact CD1-CD2 4.38Å; F166-L201 HydrophobicContact CD1-CG 4.41Å; F166-L201 HydrophobicContact CD2-CD2 3.99Å; F166-L201 HydrophobicContact CE1-CD1 3.89Å; F166-L201 HydrophobicContact CE1-CG 4.47Å; F166-L201 HydrophobicContact CE2-CD2 4.43Å; F166-L201 HydrophobicContact CG-CD1 4.1Å; F166-L201 HydrophobicContact CG-CD2 3.93Å; F166-L201 HydrophobicContact CG-CG 4.43Å; F166-L201 HydrophobicContact CZ-CD1 4.43Å; G170-L201 WeakPolarHBondContact O-CD1 3.39Å; E198-L201 PolarHBondContact O-N 3.39Å; A199-L201 PolarHBondContact O-N 2.96Å
202	K	95.8	Very high	95.7	Very high	119 Å²	119	63.1 Å²	63.1	52%	0.517	34%	0.344	S	S	.	.	S	Bend	trans	-103.4	120.5	-175.8	-61.7	179	-175.6	172.4	0	110.7	A199 V209 S212	A199-K202 WeakPolarHBondContact O-CB 3.36Å; A199-K202 PolarHBondContact O-N 2.9Å; A199-K202 VanDerWaalsContact O-N 3.1Å; K202-V209 VanDerWaalsContact O-CA 3.27Å; K202-V209 WeakPolarHBondContact O-CA 3.27Å; K202-V209 WeakPolarHBondContact O-CG2 3.48Å; K202-S212 PolarHBondContact O-OG 3.29Å
203	G	94.6	Very high	95.8	Very high	48 Å²	48	61 Å²	61	50%	0.495	34%	0.336	S	S	.	.			trans	124.7	160.1	178.5	0	0	0	0	0	111.6
204	S	94.8	Very high	96	Very high	106 Å²	106	62 Å²	62	74%	0.741	35%	0.348	S	S	*	.	S	Bend	trans	-107.4	-21.1	179.7	67	0	0	0	0	113	E208	S204-E208 WeakPolarHBondContact CB-OE2 3.35Å; S204-E208 PolarHBondContact N-OE2 3.46Å; S204-E208 PolarHBondContact OG-OE2 3.35Å
205	T	97.3	Very high	96.3	Very high	60 Å²	60	67 Å²	67	37%	0.368	36%	0.363	S	S	.	.	S	Bend	trans	-118.1	163.7	172	85.2	0	0	0	0	111.5	E207 E208 V209	T205-E207 VanDerWaalsContact CB-OE2 3.3Å; T205-E207 WeakPolarHBondContact CB-OE2 3.31Å; T205-E207 PolarHBondContact O-N 3.07Å; T205-E207 PolarHBondContact OG1-N 3.11Å; T205-E207 PolarHBondContact OG1-OE2 3.42Å; T205-E208 PolarHBondContact N-OE2 3.1Å; T205-E208 PolarHBondContact O-N 2.88Å; T205-E208 PolarHBondContact OG1-N 3.23Å; T205-V209 WeakPolarHBondContact O-CG2 3.46Å; T205-V209 PolarHBondContact O-N 3.49Å
206	L	96.3	Very high	96.5	Very high	111 Å²	111	66.6 Å²	66.6	58%	0.581	36%	0.359	S	S	*	.	H	α-helix	trans	-60	-37.7	179	-170.7	61.4	0	0	0	111.5	V209 Y210	L206-V209 PolarHBondContact O-N 3.02Å; L206-Y210 HydrophobicContact CD1-CD2 3.93Å; L206-Y210 HydrophobicContact CD1-CE2 3.62Å; L206-Y210 HydrophobicContact CD2-CE2 4.47Å; L206-Y210 HydrophobicContact CG-CD2 3.91Å; L206-Y210 HydrophobicContact CG-CE2 3.89Å; L206-Y210 VanDerWaalsContact O-CD2 3.3Å; L206-Y210 WeakPolarHBondContact O-CD2 3.33Å; L206-Y210 PolarHBondContact O-N 3.06Å
207	E	97.6	Very high	96.5	Very high	140 Å²	140	67.2 Å²	67.2	65%	0.654	37%	0.366	S	S	*	.	H	α-helix	trans	-65.4	-43.3	177.4	-59.1	73.3	-160.2	0	0	111.7	T205 V209 Y210 G211	T205-E207 VanDerWaalsContact CB-OE2 3.3Å; T205-E207 WeakPolarHBondContact CB-OE2 3.31Å; T205-E207 PolarHBondContact O-N 3.07Å; T205-E207 PolarHBondContact OG1-N 3.11Å; T205-E207 PolarHBondContact OG1-OE2 3.42Å; E207-V209 VanDerWaalsContact C-N 3.34Å; E207-Y210 PolarHBondContact O-N 2.88Å; E207-G211 PolarHBondContact O-N 3.46Å
208	E	98	Very high	96.6	Very high	94 Å²	94	70.7 Å²	70.7	44%	0.439	39%	0.386	S	S	.	.	H	α-helix	trans	-65.4	-38.5	176.3	-69	-179.1	163.2	0	0	112.1	S204 T205 G211 S212	S204-E208 WeakPolarHBondContact CB-OE2 3.35Å; S204-E208 PolarHBondContact N-OE2 3.46Å; S204-E208 PolarHBondContact OG-OE2 3.35Å; T205-E208 PolarHBondContact N-OE2 3.1Å; T205-E208 PolarHBondContact O-N 2.88Å; T205-E208 PolarHBondContact OG1-N 3.23Å; E208-G211 PolarHBondContact O-N 3.36Å; E208-S212 PolarHBondContact O-N 3.43Å; E208-S212 PolarHBondContact O-OG 3.01Å; E208-S212 VanDerWaalsContact O-OG 3.06Å
209	V	97.8	Very high	96.8	Very high	21 Å²	21	71.2 Å²	71.2	13%	0.127	38%	0.383	C	S	.	.	H	α-helix	trans	-62.3	-52.6	175.1	171.8	0	0	0	0	110.7	F200 K202 T205 L206 E207 G211 S212 V213	F200-V209 HydrophobicContact CD1-CG1 3.97Å; F200-V209 WeakPolarHBondContact O-CG1 3.27Å; K202-V209 VanDerWaalsContact O-CA 3.27Å; K202-V209 WeakPolarHBondContact O-CA 3.27Å; K202-V209 WeakPolarHBondContact O-CG2 3.48Å; T205-V209 WeakPolarHBondContact O-CG2 3.46Å; T205-V209 PolarHBondContact O-N 3.49Å; L206-V209 PolarHBondContact O-N 3.02Å; E207-V209 VanDerWaalsContact C-N 3.34Å; V209-G211 VanDerWaalsContact C-N 3.27Å; V209-G211 PolarHBondContact O-N 3.12Å; V209-S212 WeakPolarHBondContact O-CB 3.5Å; V209-S212 PolarHBondContact O-N 3.24Å; V209-S212 VanDerWaalsContact O-N 3.11Å; V209-V213 WeakPolarHBondContact O-CG2 3.33Å; V209-V213 PolarHBondContact O-N 3.32Å
210	Y	97.8	Very high	96.8	Very high	139 Å²	139	72.6 Å²	72.6	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-32.4	176.5	-83.5	-69.6	0	0	0	112.7	F200 L206 E207 S212 V213 A214	F200-Y210 HydrophobicContact CE1-CE1 4.17Å; L206-Y210 HydrophobicContact CD1-CD2 3.93Å; L206-Y210 HydrophobicContact CD1-CE2 3.62Å; L206-Y210 HydrophobicContact CD2-CE2 4.47Å; L206-Y210 HydrophobicContact CG-CD2 3.91Å; L206-Y210 HydrophobicContact CG-CE2 3.89Å; L206-Y210 VanDerWaalsContact O-CD2 3.3Å; L206-Y210 WeakPolarHBondContact O-CD2 3.33Å; L206-Y210 PolarHBondContact O-N 3.06Å; E207-Y210 PolarHBondContact O-N 2.88Å; Y210-S212 VanDerWaalsContact C-N 3.35Å; Y210-V213 PolarHBondContact O-N 3.46Å; Y210-A214 VanDerWaalsContact O-CB 3.24Å; Y210-A214 WeakPolarHBondContact O-CB 3.16Å; Y210-A214 PolarHBondContact O-N 2.89Å
211	G	98.1	Very high	96.7	Very high	33 Å²	33	74.1 Å²	74.1	34%	0.34	40%	0.398	S	S	.	.	H	α-helix	trans	-63.3	-38.5	171.9	0	0	0	0	0	112.9	E207 E208 V209 K215	E207-G211 PolarHBondContact O-N 3.46Å; E208-G211 PolarHBondContact O-N 3.36Å; V209-G211 VanDerWaalsContact C-N 3.27Å; V209-G211 PolarHBondContact O-N 3.12Å; G211-K215 WeakPolarHBondContact O-CG 3.47Å; G211-K215 PolarHBondContact O-N 3.33Å
212	S	97.6	Very high	96.7	Very high	29 Å²	29	76.3 Å²	76.3	20%	0.203	41%	0.41	C	S	.	.	H	α-helix	trans	-68.1	-42.2	175	-64.1	0	0	0	0	112.1	K202 E208 V209 Y210 K215	K202-S212 PolarHBondContact O-OG 3.29Å; E208-S212 PolarHBondContact O-N 3.43Å; E208-S212 PolarHBondContact O-OG 3.01Å; E208-S212 VanDerWaalsContact O-OG 3.06Å; V209-S212 WeakPolarHBondContact O-CB 3.5Å; V209-S212 PolarHBondContact O-N 3.24Å; V209-S212 VanDerWaalsContact O-N 3.11Å; Y210-S212 VanDerWaalsContact C-N 3.35Å; S212-K215 PolarHBondContact O-N 3.46Å
213	V	97.5	Very high	96.5	Very high	18 Å²	18	71.7 Å²	71.7	11%	0.109	39%	0.392	C	S	.	.	H	α-helix	trans	-65.4	-41.1	175.4	173.3	0	0	0	0	111.4	V196 A199 F200 V209 Y210 K215 V216 A217	V196-V213 HydrophobicContact CG1-CG1 4.03Å; A199-V213 HydrophobicContact CB-CG2 3.99Å; F200-V213 HydrophobicContact CD1-CG2 3.69Å; F200-V213 HydrophobicContact CD2-CG2 4.07Å; F200-V213 HydrophobicContact CE1-CG2 3.8Å; F200-V213 HydrophobicContact CE2-CG1 4.42Å; F200-V213 HydrophobicContact CE2-CG2 4.19Å; F200-V213 HydrophobicContact CG-CG2 3.83Å; F200-V213 HydrophobicContact CZ-CG1 4.15Å; F200-V213 HydrophobicContact CZ-CG2 4.05Å; V209-V213 WeakPolarHBondContact O-CG2 3.33Å; V209-V213 PolarHBondContact O-N 3.32Å; Y210-V213 PolarHBondContact O-N 3.46Å; V213-K215 VanDerWaalsContact C-N 3.34Å; V213-K215 PolarHBondContact O-N 3.46Å; V213-V216 WeakPolarHBondContact O-CB 3.49Å; V213-V216 PolarHBondContact O-N 3.18Å; V213-V216 VanDerWaalsContact O-N 3.13Å; V213-A217 PolarHBondContact O-N 2.92Å
214	A	97.7	Very high	96.5	Very high	42 Å²	42	74 Å²	74	35%	0.347	39%	0.392	S	S	.	.	H	α-helix	trans	-58.9	-43.4	178.1	0	0	0	0	0	111.8	Y210 V216 A217 D218	Y210-A214 VanDerWaalsContact O-CB 3.24Å; Y210-A214 WeakPolarHBondContact O-CB 3.16Å; Y210-A214 PolarHBondContact O-N 2.89Å; A214-V216 VanDerWaalsContact C-N 3.27Å; A214-V216 PolarHBondContact O-N 3.36Å; A214-A217 CarbonylContact O-C 3.58Å; A214-A217 WeakPolarHBondContact O-CA 3.42Å; A214-A217 WeakPolarHBondContact O-CB 3.39Å; A214-A217 PolarHBondContact O-N 3.02Å; A214-D218 PolarHBondContact O-N 3.1Å
215	K	97.5	Very high	96.4	Very high	155 Å²	155	77.8 Å²	77.8	67%	0.674	39%	0.391	S	S	*	.	H	α-helix	trans	-56.8	-39	175.4	-71.2	171.6	-176.7	175.4	0	113.1	G211 S212 V213 Y219	G211-K215 WeakPolarHBondContact O-CG 3.47Å; G211-K215 PolarHBondContact O-N 3.33Å; S212-K215 PolarHBondContact O-N 3.46Å; V213-K215 VanDerWaalsContact C-N 3.34Å; V213-K215 PolarHBondContact O-N 3.46Å; K215-Y219 PolarHBondContact O-N 2.82Å; K215-Y219 VanDerWaalsContact O-N 3.11Å
216	V	96.9	Very high	96.3	Very high	30 Å²	30	78 Å²	78	18%	0.182	40%	0.395	C	S	.	.	H	α-helix	trans	-68	-43	175.6	178	0	0	0	0	110.3	V196 A199 V213 A214 Y219 W220	V196-V216 HydrophobicContact CG2-CB 4.36Å; V196-V216 HydrophobicContact CG2-CG1 3.78Å; A199-V216 HydrophobicContact CB-CG2 3.85Å; V213-V216 WeakPolarHBondContact O-CB 3.49Å; V213-V216 PolarHBondContact O-N 3.18Å; V213-V216 VanDerWaalsContact O-N 3.13Å; A214-V216 VanDerWaalsContact C-N 3.27Å; A214-V216 PolarHBondContact O-N 3.36Å; V216-Y219 PolarHBondContact O-N 3.2Å; V216-W220 PolarHBondContact O-N 2.81Å
217	A	96.6	Very high	96.1	Very high	28 Å²	28	81.1 Å²	81.1	23%	0.231	40%	0.404	C	S	.	.	H	α-helix	trans	-61.2	-46.3	176.5	0	0	0	0	0	112.3	F192 V213 A214 Y219 W220 L221	F192-A217 HydrophobicContact CE2-CB 4.33Å; V213-A217 PolarHBondContact O-N 2.92Å; A214-A217 CarbonylContact O-C 3.58Å; A214-A217 WeakPolarHBondContact O-CA 3.42Å; A214-A217 WeakPolarHBondContact O-CB 3.39Å; A214-A217 PolarHBondContact O-N 3.02Å; A217-Y219 PolarHBondContact O-N 3.32Å; A217-W220 PolarHBondContact O-N 2.98Å; A217-L221 WeakPolarHBondContact O-CG 3.43Å; A217-L221 PolarHBondContact O-N 3.35Å
218	D	97.4	Very high	95.9	Very high	88 Å²	88	74.9 Å²	74.9	47%	0.471	38%	0.377	S	S	.	.	H	α-helix	trans	-61.6	-42.6	179.2	-68.1	-23.9	0	0	0	111.4	A214 W220 L221 D222	A214-D218 PolarHBondContact O-N 3.1Å; D218-W220 VanDerWaalsContact C-N 3.35Å; D218-W220 PolarHBondContact O-N 3.45Å; D218-L221 WeakPolarHBondContact O-CB 3.37Å; D218-L221 PolarHBondContact O-N 2.92Å; D218-D222 WeakPolarHBondContact O-CB 3.36Å; D218-D222 PolarHBondContact O-N 3.23Å
219	Y	95.3	Very high	95.5	Very high	134 Å²	134	74.2 Å²	74.2	53%	0.525	39%	0.387	S	S	.	.	H	α-helix	trans	-54.7	-48.4	173.8	171	-96	0	0	0	112.4	K215 V216 A217 D222 V223	K215-Y219 PolarHBondContact O-N 2.82Å; K215-Y219 VanDerWaalsContact O-N 3.11Å; V216-Y219 PolarHBondContact O-N 3.2Å; A217-Y219 PolarHBondContact O-N 3.32Å; Y219-D222 PolarHBondContact O-N 2.93Å; Y219-V223 HydrophobicContact CE1-CG2 4.22Å; Y219-V223 WeakPolarHBondContact O-CG2 3.47Å; Y219-V223 PolarHBondContact O-N 2.95Å; Y219-V223 VanDerWaalsContact O-N 3.1Å
220	W	95	Very high	95.1	Very high	29 Å²	29	81.2 Å²	81.2	11%	0.11	42%	0.424	C	S	.	.	H	α-helix	trans	-71.1	-31.4	180	-75.7	104.9	0	0	0	112.7	L188 I191 F192 V216 A217 D218 L224 L239	L188-W220 HydrophobicContact CD1-CD2 4.36Å; L188-W220 HydrophobicContact CD1-CE3 3.33Å; L188-W220 HydrophobicContact CD1-CH2 4.23Å; L188-W220 HydrophobicContact CD1-CZ3 3.25Å; I191-W220 HydrophobicContact CB-CH2 4.32Å; I191-W220 HydrophobicContact CB-CZ2 4.23Å; I191-W220 HydrophobicContact CG2-CH2 3.79Å; I191-W220 HydrophobicContact CG2-CZ2 3.49Å; I191-W220 VanDerWaalsContact CG2-CZ2 3.49Å; F192-W220 HydrophobicContact CD2-CB 4.23Å; F192-W220 AromaticContact CD2-CD1 3.44Å; F192-W220 VanDerWaalsContact CD2-CD1 3.44Å; F192-W220 AromaticContact CD2-CG 3.88Å; F192-W220 HydrophobicContact CD2-CG 3.88Å; V216-W220 PolarHBondContact O-N 2.81Å; A217-W220 PolarHBondContact O-N 2.98Å; D218-W220 VanDerWaalsContact C-N 3.35Å; D218-W220 PolarHBondContact O-N 3.45Å; W220-L224 WeakPolarHBondContact O-CG 3.41Å; W220-L224 PolarHBondContact O-N 2.7Å; W220-L239 HydrophobicContact CH2-CD2 4.45Å; W220-L239 HydrophobicContact CZ3-CD1 4.29Å
221	L	95.4	Very high	94.9	Very high	74 Å²	74	76 Å²	76	39%	0.387	41%	0.405	S	S	.	.	H	α-helix	trans	-65	-43	171	-72.7	173.7	0	0	0	111.2	A217 D218 V223 L224 Y225	A217-L221 WeakPolarHBondContact O-CG 3.43Å; A217-L221 PolarHBondContact O-N 3.35Å; D218-L221 WeakPolarHBondContact O-CB 3.37Å; D218-L221 PolarHBondContact O-N 2.92Å; L221-V223 VanDerWaalsContact C-N 3.34Å; L221-V223 PolarHBondContact O-N 3.03Å; L221-L224 PolarHBondContact O-N 3.17Å; L221-L224 VanDerWaalsContact O-N 3.1Å; L221-Y225 HydrophobicContact CB-CD2 4.17Å; L221-Y225 HydrophobicContact CB-CE2 4.19Å; L221-Y225 HydrophobicContact CD2-CE2 4.19Å; L221-Y225 WeakPolarHBondContact O-CD2 3.37Å; L221-Y225 PolarHBondContact O-N 3.31Å
222	D	95.2	Very high	94.7	Very high	105 Å²	105	78 Å²	78	56%	0.561	41%	0.412	S	S	*	.	H	α-helix	trans	-61.8	-41.4	177.7	-74.8	-19.6	0	0	0	111.7	D218 Y219 L224 Y225 S226	D218-D222 WeakPolarHBondContact O-CB 3.36Å; D218-D222 PolarHBondContact O-N 3.23Å; Y219-D222 PolarHBondContact O-N 2.93Å; D222-L224 VanDerWaalsContact C-N 3.29Å; D222-L224 PolarHBondContact O-N 2.98Å; D222-Y225 PolarHBondContact O-N 3.05Å; D222-S226 WeakPolarHBondContact O-CB 3.48Å; D222-S226 PolarHBondContact O-N 3.4Å; D222-S226 PolarHBondContact O-OG 2.86Å
223	V	93.1	Very high	94.3	Very high	22 Å²	22	82.2 Å²	82.2	13%	0.133	43%	0.432	C	S	.	.	H	α-helix	trans	-57.3	-43.6	172.7	172.4	0	0	0	0	110.9	Y219 L221 S226 K227 A228 M231	Y219-V223 HydrophobicContact CE1-CG2 4.22Å; Y219-V223 WeakPolarHBondContact O-CG2 3.47Å; Y219-V223 PolarHBondContact O-N 2.95Å; Y219-V223 VanDerWaalsContact O-N 3.1Å; L221-V223 VanDerWaalsContact C-N 3.34Å; L221-V223 PolarHBondContact O-N 3.03Å; V223-S226 PolarHBondContact O-OG 3.24Å; V223-K227 PolarHBondContact O-N 3.02Å; V223-A228 HydrophobicContact CG1-CB 4.18Å; V223-A228 PolarHBondContact O-N 3.01Å; V223-M231 HydrophobicContact CG1-CE 4.22Å
224	L	93	Very high	93.9	Very high	95 Å²	95	85.2 Å²	85.2	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-71.1	-44.3	179.4	-68.5	175	0	0	0	113	L188 W220 L221 D222 K227	L188-L224 HydrophobicContact CD2-CD1 4.31Å; L188-L224 HydrophobicContact CD2-CD2 3.85Å; L188-L224 HydrophobicContact CD2-CG 4.43Å; W220-L224 WeakPolarHBondContact O-CG 3.41Å; W220-L224 PolarHBondContact O-N 2.7Å; L221-L224 PolarHBondContact O-N 3.17Å; L221-L224 VanDerWaalsContact O-N 3.1Å; D222-L224 VanDerWaalsContact C-N 3.29Å; D222-L224 PolarHBondContact O-N 2.98Å; L224-K227 WeakPolarHBondContact O-CA 3.06Å; L224-K227 PolarHBondContact O-N 3.19Å; L224-K227 VanDerWaalsContact O-N 3.09Å
225	Y	94.3	Very high	93.5	Very high	186 Å²	186	87.6 Å²	87.6	73%	0.729	46%	0.458	S	S	*	.	H	α-helix	trans	-71.6	-35.4	-178	-78.6	-61.1	0	0	0	112.9	L221 D222 K227	L221-Y225 HydrophobicContact CB-CD2 4.17Å; L221-Y225 HydrophobicContact CB-CE2 4.19Å; L221-Y225 HydrophobicContact CD2-CE2 4.19Å; L221-Y225 WeakPolarHBondContact O-CD2 3.37Å; L221-Y225 PolarHBondContact O-N 3.31Å; D222-Y225 PolarHBondContact O-N 3.05Å; Y225-K227 PolarHBondContact O-N 2.88Å
226	S	94.9	Very high	93.2	Very high	64 Å²	64	82.1 Å²	82.1	45%	0.448	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-2.5	170.5	66	0	0	0	0	113	D222 V223 A228 A229	D222-S226 WeakPolarHBondContact O-CB 3.48Å; D222-S226 PolarHBondContact O-N 3.4Å; D222-S226 PolarHBondContact O-OG 2.86Å; V223-S226 PolarHBondContact O-OG 3.24Å; S226-A228 PolarHBondContact O-N 2.95Å; S226-A229 WeakPolarHBondContact O-CB 3.01Å; S226-A229 PolarHBondContact O-N 3.18Å
227	K	92.2	Very high	92.7	Very high	177 Å²	177	82.8 Å²	82.8	77%	0.77	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	33.5	-173.9	-55.2	175.7	-177.1	169.9	0	112.3	V223 L224 Y225 A229	V223-K227 PolarHBondContact O-N 3.02Å; L224-K227 WeakPolarHBondContact O-CA 3.06Å; L224-K227 PolarHBondContact O-N 3.19Å; L224-K227 VanDerWaalsContact O-N 3.09Å; Y225-K227 PolarHBondContact O-N 2.88Å; K227-A229 PolarHBondContact O-N 3.21Å
228	A	91.8	Very high	92.3	Very high	10 Å²	10	87 Å²	87	8%	0.083	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	37.2	-177.8	0	0	0	0	0	113.6	V223 S226 N230 M231 L236	V223-A228 HydrophobicContact CG1-CB 4.18Å; V223-A228 PolarHBondContact O-N 3.01Å; S226-A228 PolarHBondContact O-N 2.95Å; A228-N230 PolarHBondContact O-N 3.42Å; A228-M231 HydrophobicContact CB-CB 3.91Å; A228-M231 HydrophobicContact CB-SD 4.2Å; A228-M231 WeakPolarHBondContact O-CB 3.5Å; A228-M231 PolarHBondContact O-N 2.92Å; A228-L236 HydrophobicContact CB-CD1 3.68Å; A228-L236 HydrophobicContact CB-CD2 4.42Å
229	A	91.1	Very high	91.9	Very high	79 Å²	79	83.4 Å²	83.4	65%	0.653	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.9	-172.6	0	0	0	0	0	115.1	S226 K227	S226-A229 WeakPolarHBondContact O-CB 3.01Å; S226-A229 PolarHBondContact O-N 3.18Å; K227-A229 PolarHBondContact O-N 3.21Å
230	N	89.3	Confident	91.7	Very high	169 Å²	169	80 Å²	80	90%	0.904	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	10.5	-179.9	-61.2	-33.2	0	0	0	113.3	A228	A228-N230 PolarHBondContact O-N 3.42Å
231	M	92.1	Very high	91.3	Very high	30 Å²	30	79 Å²	79	15%	0.148	42%	0.42	C	S	.	.	S	Bend	trans	-102.1	137.3	-178.2	-173.8	174.4	-79.6	0	0	110.4	V223 A228 E235 L236 L239	V223-M231 HydrophobicContact CG1-CE 4.22Å; A228-M231 HydrophobicContact CB-CB 3.91Å; A228-M231 HydrophobicContact CB-SD 4.2Å; A228-M231 WeakPolarHBondContact O-CB 3.5Å; A228-M231 PolarHBondContact O-N 2.92Å; M231-E235 HydrophobicContact CE-CG 4.46Å; M231-E235 HydrophobicContact CG-CB 3.91Å; M231-E235 HydrophobicContact CG-CG 3.99Å; M231-E235 HydrophobicContact SD-CB 4.32Å; M231-E235 HydrophobicContact SD-CG 3.97Å; M231-L236 HydrophobicContact CG-CB 4.34Å; M231-L236 HydrophobicContact SD-CB 4.06Å; M231-L236 HydrophobicContact SD-CD1 4.35Å; M231-L239 HydrophobicContact CE-CD1 3.54Å; M231-L239 HydrophobicContact SD-CD1 3.47Å; M231-L239 WeakPolarHBondContact SD-CD1 3.33Å
232	P	93.8	Very high	90.8	Very high	74 Å²	74	76.7 Å²	76.7	48%	0.481	41%	0.407	S	S	.	.			trans	-59.2	141	172.2	-21.8	33	0	0	0	111.7	S234 E235 L236	P232-S234 PolarHBondContact O-N 3.41Å; P232-E235 PolarHBondContact O-N 2.85Å; P232-L236 PolarHBondContact O-N 3.01Å
233	D	89.7	Confident	90.3	Very high	117 Å²	117	74.6 Å²	74.6	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-53	-42	-179.5	-74.8	-6.7	0	0	0	112.4	E235 L236 F237	D233-E235 VanDerWaalsContact C-N 3.34Å; D233-E235 PolarHBondContact O-N 2.99Å; D233-L236 PolarHBondContact O-N 3.34Å; D233-F237 HydrophobicContact CB-CD2 4.31Å; D233-F237 HydrophobicContact CB-CE2 4.28Å; D233-F237 WeakPolarHBondContact O-CB 3.43Å; D233-F237 WeakPolarHBondContact O-CD2 3.18Å; D233-F237 PolarHBondContact O-N 2.87Å
234	S	89.3	Confident	89.8	Confident	82 Å²	82	78.3 Å²	78.3	57%	0.573	41%	0.407	S	S	*	.	H	α-helix	trans	-58.3	-44.1	179.1	53.8	0	0	0	0	112.7	P232 E238	P232-S234 PolarHBondContact O-N 3.41Å; S234-E238 WeakPolarHBondContact O-CG 2.94Å; S234-E238 PolarHBondContact O-N 2.95Å; S234-E238 VanDerWaalsContact O-N 3.16Å
235	E	89.6	Confident	89.3	Confident	91 Å²	91	78 Å²	78	43%	0.425	41%	0.413	S	S	.	.	H	α-helix	trans	-69.2	-43.1	177.8	-174.5	-178.2	171.5	0	0	110.7	M231 P232 D233 F237 E238 L239	M231-E235 HydrophobicContact CE-CG 4.46Å; M231-E235 HydrophobicContact CG-CB 3.91Å; M231-E235 HydrophobicContact CG-CG 3.99Å; M231-E235 HydrophobicContact SD-CB 4.32Å; M231-E235 HydrophobicContact SD-CG 3.97Å; P232-E235 PolarHBondContact O-N 2.85Å; D233-E235 VanDerWaalsContact C-N 3.34Å; D233-E235 PolarHBondContact O-N 2.99Å; E235-F237 VanDerWaalsContact C-N 3.34Å; E235-F237 PolarHBondContact O-N 3.49Å; E235-E238 PolarHBondContact O-N 3.09Å; E235-L239 WeakPolarHBondContact O-CG 2.9Å; E235-L239 PolarHBondContact O-N 2.88Å
236	L	90.7	Very high	88.9	Confident	40 Å²	40	69.6 Å²	69.6	21%	0.209	38%	0.381	C	S	.	.	H	α-helix	trans	-57.9	-47.6	176.8	177.3	59.4	0	0	0	111.3	A228 M231 P232 D233 E238 L239 I240	A228-L236 HydrophobicContact CB-CD1 3.68Å; A228-L236 HydrophobicContact CB-CD2 4.42Å; M231-L236 HydrophobicContact CG-CB 4.34Å; M231-L236 HydrophobicContact SD-CB 4.06Å; M231-L236 HydrophobicContact SD-CD1 4.35Å; P232-L236 PolarHBondContact O-N 3.01Å; D233-L236 PolarHBondContact O-N 3.34Å; L236-E238 VanDerWaalsContact C-N 3.31Å; L236-E238 PolarHBondContact O-N 2.86Å; L236-L239 PolarHBondContact O-N 2.92Å; L236-I240 HydrophobicContact CD1-CD1 4.43Å; L236-I240 HydrophobicContact CD1-CG2 3.76Å; L236-I240 HydrophobicContact CG-CD1 4.24Å; L236-I240 WeakPolarHBondContact O-CG1 3.36Å; L236-I240 PolarHBondContact O-N 2.68Å
237	F	86.9	Confident	88.4	Confident	44 Å²	44	71.3 Å²	71.3	19%	0.193	39%	0.393	C	S	.	.	H	α-helix	trans	-62.5	-37.8	178.5	-83	-67.6	0	0	0	112.4	D233 E235 S241 I286 W303	D233-F237 HydrophobicContact CB-CD2 4.31Å; D233-F237 HydrophobicContact CB-CE2 4.28Å; D233-F237 WeakPolarHBondContact O-CB 3.43Å; D233-F237 WeakPolarHBondContact O-CD2 3.18Å; D233-F237 PolarHBondContact O-N 2.87Å; E235-F237 VanDerWaalsContact C-N 3.34Å; E235-F237 PolarHBondContact O-N 3.49Å; F237-S241 WeakPolarHBondContact O-CB 3.08Å; F237-S241 PolarHBondContact O-N 3.16Å; F237-S241 PolarHBondContact O-OG 2.69Å; F237-I286 HydrophobicContact CD1-CG2 4.46Å; F237-I286 HydrophobicContact CE1-CD1 4.11Å; F237-W303 HydrophobicContact CB-CD2 4.49Å; F237-W303 HydrophobicContact CB-CH2 4.5Å; F237-W303 HydrophobicContact CB-CZ2 4.46Å; F237-W303 HydrophobicContact CD1-CD2 4.03Å; F237-W303 AromaticContact CD1-CE3 3.44Å; F237-W303 HydrophobicContact CD1-CE3 3.44Å; F237-W303 VanDerWaalsContact CD1-CE3 3.44Å; F237-W303 HydrophobicContact CD1-CH2 4.4Å; F237-W303 AromaticContact CD1-CZ3 3.68Å; F237-W303 HydrophobicContact CD1-CZ3 3.68Å; F237-W303 AromaticContact CD2-CE3 3.97Å; F237-W303 HydrophobicContact CD2-CE3 3.97Å; F237-W303 AromaticContact CD2-CH2 3.41Å; F237-W303 HydrophobicContact CD2-CH2 3.41Å; F237-W303 VanDerWaalsContact CD2-CH2 3.41Å; F237-W303 HydrophobicContact CD2-CZ2 4.16Å; F237-W303 AromaticContact CD2-CZ3 3.32Å; F237-W303 HydrophobicContact CD2-CZ3 3.32Å; F237-W303 HydrophobicContact CE1-CD2 4.45Å; F237-W303 AromaticContact CE1-CE3 3.46Å; F237-W303 HydrophobicContact CE1-CE3 3.46Å; F237-W303 VanDerWaalsContact CE1-CE3 3.46Å; F237-W303 AromaticContact CE1-CZ3 3.54Å; F237-W303 HydrophobicContact CE1-CZ3 3.54Å; F237-W303 HydrophobicContact CE2-CE3 4.03Å; F237-W303 AromaticContact CE2-CH2 3.67Å; F237-W303 HydrophobicContact CE2-CH2 3.67Å; F237-W303 AromaticContact CE2-CZ3 3.23Å; F237-W303 HydrophobicContact CE2-CZ3 3.23Å; F237-W303 HydrophobicContact CG-CD2 4.15Å; F237-W303 AromaticContact CG-CE3 3.72Å; F237-W303 HydrophobicContact CG-CE3 3.72Å; F237-W303 AromaticContact CG-CH2 3.86Å; F237-W303 HydrophobicContact CG-CH2 3.86Å; F237-W303 HydrophobicContact CG-CZ2 4.27Å; F237-W303 AromaticContact CG-CZ3 3.59Å; F237-W303 HydrophobicContact CG-CZ3 3.59Å; F237-W303 AromaticContact CZ-CE3 3.79Å; F237-W303 HydrophobicContact CZ-CE3 3.79Å; F237-W303 HydrophobicContact CZ-CH2 4.24Å; F237-W303 AromaticContact CZ-CZ3 3.34Å; F237-W303 HydrophobicContact CZ-CZ3 3.34Å
238	E	87.3	Confident	88.1	Confident	118 Å²	118	67.9 Å²	67.9	55%	0.551	38%	0.375	S	S	*	.	H	α-helix	trans	-60.2	-47	172.6	-74.9	-176.7	179.6	0	0	111.9	Q187 S234 E235 L236 S241	Q187-E238 VanDerWaalsContact CB-O 3.25Å; Q187-E238 WeakPolarHBondContact CB-O 3.32Å; S234-E238 WeakPolarHBondContact O-CG 2.94Å; S234-E238 PolarHBondContact O-N 2.95Å; S234-E238 VanDerWaalsContact O-N 3.16Å; E235-E238 PolarHBondContact O-N 3.09Å; L236-E238 VanDerWaalsContact C-N 3.31Å; L236-E238 PolarHBondContact O-N 2.86Å; E238-S241 PolarHBondContact O-OG 3.27Å
239	L	89.8	Confident	87.9	Confident	11 Å²	11	70.9 Å²	70.9	6%	0.058	39%	0.386	C	S	.	.	H	α-helix	trans	-64.7	-46.4	-179.2	-67.9	179.2	0	0	0	113.4	L186 L188 I191 W220 M231 E235 L236	L186-L239 WeakPolarHBondContact CD1-O 3.17Å; L188-L239 WeakPolarHBondContact CB-O 3.28Å; L188-L239 HydrophobicContact CD1-CB 4.48Å; L188-L239 PolarHBondContact N-O 3.18Å; I191-L239 HydrophobicContact CD1-CD2 3.38Å; W220-L239 HydrophobicContact CH2-CD2 4.45Å; W220-L239 HydrophobicContact CZ3-CD1 4.29Å; M231-L239 HydrophobicContact CE-CD1 3.54Å; M231-L239 HydrophobicContact SD-CD1 3.47Å; M231-L239 WeakPolarHBondContact SD-CD1 3.33Å; E235-L239 WeakPolarHBondContact O-CG 2.9Å; E235-L239 PolarHBondContact O-N 2.88Å; L236-L239 PolarHBondContact O-N 2.92Å
240	I	90.9	Very high	87.6	Confident	63 Å²	63	68.6 Å²	68.6	32%	0.323	36%	0.363	S	S	.	.	H	α-helix	trans	-89.1	-11.1	-172.4	72.8	178.6	0	0	0	113.5	L186 L236 I286	L186-I240 VanDerWaalsContact CD1-O 3.25Å; L186-I240 WeakPolarHBondContact CD1-O 3.42Å; L236-I240 HydrophobicContact CD1-CD1 4.43Å; L236-I240 HydrophobicContact CD1-CG2 3.76Å; L236-I240 HydrophobicContact CG-CD1 4.24Å; L236-I240 WeakPolarHBondContact O-CG1 3.36Å; L236-I240 PolarHBondContact O-N 2.68Å; I240-I286 HydrophobicContact CD1-CG2 4.2Å; I240-I286 HydrophobicContact CG1-CG2 3.89Å
241	S	87	Confident	87.4	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.063	35%	0.351	C	S	.	.			trans	-74.8	137	176.4	68.1	0	0	0	0	111.3	F237 E238 R284	F237-S241 WeakPolarHBondContact O-CB 3.08Å; F237-S241 PolarHBondContact O-N 3.16Å; F237-S241 PolarHBondContact O-OG 2.69Å; E238-S241 PolarHBondContact O-OG 3.27Å; S241-R284 PolarHBondContact OG-NE 3.42Å; S241-R284 PolarHBondContact OG-NH2 2.99Å
242	E	85.8	Confident	87.2	Confident	25 Å²	25	70 Å²	70	12%	0.117	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.6	168.5	-169.9	178.8	175.9	0	0	108.5	R244 R284 Y285	E242-R244 HydrophobicContact CG-CG 4.42Å; E242-R244 IonicContact OE1-CZ 3.98Å; E242-R244 IonicContact OE1-NE 2.77Å; E242-R244 PolarHBondContact OE1-NE 3.39Å; E242-R244 IonicContact OE1-NH2 2.63Å; E242-R244 PolarHBondContact OE1-NH2 3.42Å; E242-R284 WeakPolarHBondContact O-CA 3.49Å; E242-Y285 HydrophobicContact CB-CE1 4.47Å; E242-Y285 HydrophobicContact CB-CE2 4.06Å; E242-Y285 PolarHBondContact N-O 2.88Å; E242-Y285 PolarHBondContact O-N 3Å; E242-Y285 PolarHBondContact OE1-OH 2.82Å; E242-Y285 PolarHBondContact OE2-OH 3.1Å
243	N	83.4	Confident	86.7	Confident	61 Å²	61	67.9 Å²	67.9	33%	0.326	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.2	173.4	-170	2.4	0	0	0	110	G184 S282	G184-N243 WeakPolarHBondContact CA-O 3.25Å; N243-S282 VanDerWaalsContact CG-OG 3.27Å; N243-S282 PolarHBondContact ND2-OG 3.09Å; N243-S282 PolarHBondContact OD1-OG 3.47Å
244	R	82.7	Confident	86.4	Confident	99 Å²	99	64.7 Å²	64.7	37%	0.374	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126	172.7	-68.6	-168.2	179.6	-157.7	-3.8	111	E242 S260 C283 Y285	E242-R244 HydrophobicContact CG-CG 4.42Å; E242-R244 IonicContact OE1-CZ 3.98Å; E242-R244 IonicContact OE1-NE 2.77Å; E242-R244 PolarHBondContact OE1-NE 3.39Å; E242-R244 IonicContact OE1-NH2 2.63Å; E242-R244 PolarHBondContact OE1-NH2 3.42Å; R244-S260 VanDerWaalsContact CB-OG 3.25Å; R244-S260 WeakPolarHBondContact CB-OG 3.5Å; R244-C283 PolarHBondContact N-O 3.17Å; R244-C283 WeakPolarHBondContact O-CB 3.37Å; R244-C283 PolarHBondContact O-N 3.25Å; R244-Y285 HydrophobicContact CG-CE1 4.34Å; R244-Y285 PolarHBondContact NE-OH 3.32Å
245	S	83.6	Confident	86.2	Confident	90 Å²	90	69.8 Å²	69.8	63%	0.629	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	136.9	174.4	-50	0	0	0	0	111.6	L281	S245-L281 CarbonylContact C-O 3.57Å; S245-L281 WeakPolarHBondContact CA-O 3.23Å
246	M	84.5	Confident	85.9	Confident	8 Å²	8	70.9 Å²	70.9	4%	0.039	36%	0.363	C	S	.	.			trans	-88.4	130	172.8	-66	-174.8	57.8	0	0	110.4	L250 Y253 I261 A264 G280 L281	M246-L250 HydrophobicContact CE-CD1 4.03Å; M246-Y253 HydrophobicContact CB-CE2 4.46Å; M246-Y253 HydrophobicContact CE-CD2 3.46Å; M246-Y253 VanDerWaalsContact CE-CD2 3.46Å; M246-Y253 HydrophobicContact CE-CE2 3.26Å; M246-Y253 HydrophobicContact CE-CG 4.46Å; M246-I261 HydrophobicContact CE-CG1 4.31Å; M246-A264 HydrophobicContact CE-CB 4.46Å; M246-A264 HydrophobicContact SD-CB 3.62Å; M246-G280 WeakPolarHBondContact O-CA 3.26Å; M246-G280 PolarHBondContact O-N 3.43Å; M246-L281 PolarHBondContact N-O 3.24Å; M246-L281 HydrophobicContact SD-CD2 4.47Å
247	S	84.5	Confident	85.5	Confident	100 Å²	100	76.8 Å²	76.8	70%	0.699	39%	0.387	S	S	*	.	S	Bend	trans	-84.2	-19.7	-177.2	55.4	0	0	0	0	114.2	Y253	S247-Y253 PolarHBondContact N-OH 3.25Å; S247-Y253 PolarHBondContact OG-OH 3.01Å; S247-Y253 VanDerWaalsContact OG-OH 3.13Å
248	R	86.8	Confident	85.3	Confident	105 Å²	105	76.6 Å²	76.6	40%	0.396	39%	0.391	S	S	.	.	S	Bend	trans	-127.7	173.7	178.6	-59.3	-176.8	-65.3	164.8	6.6	109.8	D252 Y253	R248-D252 HydrophobicContact CB-CB 3.99Å; R248-D252 PolarHBondContact NH1-O 2.85Å; R248-D252 PolarHBondContact NH2-O 3.42Å; R248-Y253 HydrophobicContact CB-CE2 3.79Å; R248-Y253 PolarHBondContact N-OH 3Å; R248-Y253 WeakPolarHBondContact O-CE2 3.47Å
249	K	87.6	Confident	85.1	Confident	74 Å²	74	72 Å²	72	32%	0.322	37%	0.371	S	S	.	.			trans	-69.9	157.9	174.9	-60.4	-178.8	175.3	-163.2	0	110.5	E251 D252 Y253 K277 A279	K249-E251 VanDerWaalsContact C-N 3.26Å; K249-E251 HydrophobicContact CB-CG 3.92Å; K249-E251 HydrophobicContact CD-CG 4.5Å; K249-E251 VanDerWaalsContact CD-OE1 3.31Å; K249-E251 WeakPolarHBondContact CD-OE1 3.25Å; K249-E251 IonicContact NZ-OE1 3.18Å; K249-E251 PolarHBondContact O-N 3.01Å; K249-D252 PolarHBondContact N-OD2 3.09Å; K249-D252 PolarHBondContact O-N 2.64Å; K249-Y253 WeakPolarHBondContact O-CD2 3.47Å; K249-Y253 WeakPolarHBondContact O-CE2 3.34Å; K249-K277 VanDerWaalsContact CD-O 3.24Å; K249-K277 WeakPolarHBondContact CD-O 3.2Å; K249-K277 WeakPolarHBondContact CE-O 3.21Å; K249-K277 PolarHBondContact NZ-O 3.17Å; K249-A279 HydrophobicContact CG-CB 4.4Å
250	L	85.1	Confident	84.8	Confident	30 Å²	30	72.1 Å²	72.1	16%	0.157	37%	0.373	C	S	.	.	S	Bend	trans	-58.8	-38.4	-179.5	-177.8	58.4	0	0	0	112.4	M246 D252 Y253 I261 A264 K265 V276	M246-L250 HydrophobicContact CE-CD1 4.03Å; L250-D252 VanDerWaalsContact C-N 3.32Å; L250-D252 PolarHBondContact O-N 3.43Å; L250-Y253 PolarHBondContact O-N 2.7Å; L250-I261 HydrophobicContact CD1-CG2 3.99Å; L250-A264 HydrophobicContact CD1-CB 3.86Å; L250-A264 HydrophobicContact CD2-CB 4.09Å; L250-A264 HydrophobicContact CG-CB 4.48Å; L250-K265 HydrophobicContact CD1-CG 4.25Å; L250-K265 HydrophobicContact CD2-CG 3.98Å; L250-V276 HydrophobicContact CB-CB 4.21Å; L250-V276 HydrophobicContact CD2-CB 4.04Å; L250-V276 HydrophobicContact CD2-CG1 4.1Å; L250-V276 HydrophobicContact CD2-CG2 4.09Å
251	E	84.9	Confident	84.6	Confident	143 Å²	143	69.4 Å²	69.4	67%	0.668	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-61.4	-35.4	178	60.3	-170.7	171.8	0	0	113.4	K249 Y253 G254	K249-E251 VanDerWaalsContact C-N 3.26Å; K249-E251 HydrophobicContact CB-CG 3.92Å; K249-E251 HydrophobicContact CD-CG 4.5Å; K249-E251 VanDerWaalsContact CD-OE1 3.31Å; K249-E251 WeakPolarHBondContact CD-OE1 3.25Å; K249-E251 IonicContact NZ-OE1 3.18Å; K249-E251 PolarHBondContact O-N 3.01Å; E251-Y253 PolarHBondContact O-N 2.77Å; E251-G254 PolarHBondContact O-N 3.36Å
252	D	87.3	Confident	84.5	Confident	85 Å²	85	70.4 Å²	70.4	46%	0.455	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-71.7	-11.7	-177.3	-61.9	-35.3	0	0	0	113.7	R248 K249 L250	R248-D252 HydrophobicContact CB-CB 3.99Å; R248-D252 PolarHBondContact NH1-O 2.85Å; R248-D252 PolarHBondContact NH2-O 3.42Å; K249-D252 PolarHBondContact N-OD2 3.09Å; K249-D252 PolarHBondContact O-N 2.64Å; L250-D252 VanDerWaalsContact C-N 3.32Å; L250-D252 PolarHBondContact O-N 3.43Å
253	Y	84.4	Confident	84.5	Confident	31 Å²	31	69.2 Å²	69.2	12%	0.122	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-88.3	-14.1	178	-71.4	-81.7	0	0	0	113.4	M246 S247 R248 K249 L250 E251 E255 Q256 I261	M246-Y253 HydrophobicContact CB-CE2 4.46Å; M246-Y253 HydrophobicContact CE-CD2 3.46Å; M246-Y253 VanDerWaalsContact CE-CD2 3.46Å; M246-Y253 HydrophobicContact CE-CE2 3.26Å; M246-Y253 HydrophobicContact CE-CG 4.46Å; S247-Y253 PolarHBondContact N-OH 3.25Å; S247-Y253 PolarHBondContact OG-OH 3.01Å; S247-Y253 VanDerWaalsContact OG-OH 3.13Å; R248-Y253 HydrophobicContact CB-CE2 3.79Å; R248-Y253 PolarHBondContact N-OH 3Å; R248-Y253 WeakPolarHBondContact O-CE2 3.47Å; K249-Y253 WeakPolarHBondContact O-CD2 3.47Å; K249-Y253 WeakPolarHBondContact O-CE2 3.34Å; L250-Y253 PolarHBondContact O-N 2.7Å; E251-Y253 PolarHBondContact O-N 2.77Å; Y253-E255 PolarHBondContact O-N 2.93Å; Y253-Q256 WeakPolarHBondContact O-CB 3.46Å; Y253-Q256 VanDerWaalsContact O-CG 3.29Å; Y253-Q256 WeakPolarHBondContact O-CG 3.48Å; Y253-Q256 PolarHBondContact O-N 3.46Å; Y253-Q256 VanDerWaalsContact O-N 3.14Å; Y253-I261 HydrophobicContact CD1-CD1 3.92Å; Y253-I261 HydrophobicContact CD1-CG1 4.43Å; Y253-I261 HydrophobicContact CG-CD1 3.88Å; Y253-I261 HydrophobicContact CG-CG1 4.11Å
254	G	83.4	Confident	84.7	Confident	49 Å²	49	66.3 Å²	66.3	51%	0.505	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	-125.2	178	0	0	0	0	0	113.4	E251	E251-G254 PolarHBondContact O-N 3.36Å
255	E	83.4	Confident	84.9	Confident	190 Å²	190	66.3 Å²	66.3	89%	0.888	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	6	-178.2	-60.3	-163.8	152.2	0	0	114.7	Y253 K257	Y253-E255 PolarHBondContact O-N 2.93Å; E255-K257 PolarHBondContact O-N 3.25Å
256	Q	84.9	Confident	85	Confident	114 Å²	114	66.1 Å²	66.1	53%	0.533	33%	0.333	S	S	.	.			trans	-60.5	136.2	179.3	-67.9	-177.9	3.9	0	0	111	Y253 I261	Y253-Q256 WeakPolarHBondContact O-CB 3.46Å; Y253-Q256 VanDerWaalsContact O-CG 3.29Å; Y253-Q256 WeakPolarHBondContact O-CG 3.48Å; Y253-Q256 PolarHBondContact O-N 3.46Å; Y253-Q256 VanDerWaalsContact O-N 3.14Å; Q256-I261 HydrophobicContact CB-CD1 3.81Å; Q256-I261 WeakPolarHBondContact O-CD1 3.24Å
257	K	81	Confident	85.1	Confident	164 Å²	164	66.9 Å²	66.9	71%	0.713	34%	0.337	S	S	*	.			trans	-102.1	117.8	175.4	-63.9	-172.7	179.9	-173.1	0	109.3	E255	E255-K257 PolarHBondContact O-N 3.25Å
258	S	83.6	Confident	85.2	Confident	40 Å²	40	62.6 Å²	62.6	28%	0.28	31%	0.308	S	S	.	.			trans	-144.7	171.5	174.6	80.8	0	0	0	0	111.3	I261 S262 K300	S258-I261 VanDerWaalsContact OG-CD1 3.32Å; S258-I261 WeakPolarHBondContact OG-CD1 3.31Å; S258-I261 WeakPolarHBondContact OG-CG1 3.17Å; S258-I261 PolarHBondContact OG-N 3.39Å; S258-S262 PolarHBondContact O-OG 3.13Å; S258-K300 PolarHBondContact O-NZ 3.23Å
259	T	81.9	Confident	85.2	Confident	22 Å²	22	65.3 Å²	65.3	14%	0.135	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-51.4	177.4	50.7	0	0	0	0	111.7	I261 T263 Y285 K300	T259-I261 PolarHBondContact O-N 3.21Å; T259-T263 PolarHBondContact O-N 2.97Å; T259-T263 PolarHBondContact O-OG1 3.3Å; T259-Y285 VanDerWaalsContact CB-OH 3.23Å; T259-Y285 WeakPolarHBondContact CB-OH 3.43Å; T259-Y285 HydrophobicContact CG2-CE2 4.43Å; T259-Y285 PolarHBondContact OG1-OH 3.19Å; T259-K300 VanDerWaalsContact C-NZ 3.33Å; T259-K300 WeakPolarHBondContact O-CD 3.39Å; T259-K300 VanDerWaalsContact O-CE 3.25Å; T259-K300 WeakPolarHBondContact O-CE 3.29Å; T259-K300 PolarHBondContact O-NZ 3.18Å
260	S	84.8	Confident	85.1	Confident	13 Å²	13	68.6 Å²	68.6	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-61.7	-39	-179.8	-49.5	0	0	0	0	114.4	R244 T263 A264 C283	R244-S260 VanDerWaalsContact CB-OG 3.25Å; R244-S260 WeakPolarHBondContact CB-OG 3.5Å; S260-T263 PolarHBondContact O-N 3.18Å; S260-A264 WeakPolarHBondContact O-CB 3.39Å; S260-A264 PolarHBondContact O-N 3.27Å; S260-C283 PolarHBondContact O-SG 2.98Å
261	I	86	Confident	85.2	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.026	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-46.2	-177.2	-69.3	164.3	0	0	0	111.2	M246 L250 Y253 Q256 S258 T259 T263 A264 K265	M246-I261 HydrophobicContact CE-CG1 4.31Å; L250-I261 HydrophobicContact CD1-CG2 3.99Å; Y253-I261 HydrophobicContact CD1-CD1 3.92Å; Y253-I261 HydrophobicContact CD1-CG1 4.43Å; Y253-I261 HydrophobicContact CG-CD1 3.88Å; Y253-I261 HydrophobicContact CG-CG1 4.11Å; Q256-I261 HydrophobicContact CB-CD1 3.81Å; Q256-I261 WeakPolarHBondContact O-CD1 3.24Å; S258-I261 VanDerWaalsContact OG-CD1 3.32Å; S258-I261 WeakPolarHBondContact OG-CD1 3.31Å; S258-I261 WeakPolarHBondContact OG-CG1 3.17Å; S258-I261 PolarHBondContact OG-N 3.39Å; T259-I261 PolarHBondContact O-N 3.21Å; I261-T263 VanDerWaalsContact C-N 3.3Å; I261-T263 PolarHBondContact O-N 3.31Å; I261-A264 PolarHBondContact O-N 3.38Å; I261-K265 HydrophobicContact CG2-CD 4.4Å; I261-K265 WeakPolarHBondContact O-CG 3.38Å; I261-K265 PolarHBondContact O-N 3.1Å
262	S	84.9	Confident	85.2	Confident	30 Å²	30	65.9 Å²	65.9	21%	0.21	34%	0.336	C	S	.	.	H	α-helix	trans	-69.7	-30.2	179.4	-32.5	0	0	0	0	112.3	S258 R266 T297 K300	S258-S262 PolarHBondContact O-OG 3.13Å; S262-R266 WeakPolarHBondContact O-CG 3.17Å; S262-R266 PolarHBondContact O-N 3.32Å; S262-T297 PolarHBondContact OG-O 3.49Å; S262-K300 PolarHBondContact OG-NZ 3.39Å
263	T	86.9	Confident	85	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-65.5	-46.2	172.4	-53.9	0	0	0	0	110.5	T259 S260 I261 K265 R266 L267 C283 Y285	T259-T263 PolarHBondContact O-N 2.97Å; T259-T263 PolarHBondContact O-OG1 3.3Å; S260-T263 PolarHBondContact O-N 3.18Å; I261-T263 VanDerWaalsContact C-N 3.3Å; I261-T263 PolarHBondContact O-N 3.31Å; T263-K265 PolarHBondContact O-N 3.23Å; T263-R266 PolarHBondContact O-N 2.89Å; T263-L267 HydrophobicContact CG2-CD1 4.3Å; T263-L267 WeakPolarHBondContact O-CG 3.33Å; T263-L267 PolarHBondContact O-N 3.15Å; T263-C283 HydrophobicContact CG2-CB 3.89Å; T263-Y285 HydrophobicContact CG2-CD1 4.41Å; T263-Y285 WeakPolarHBondContact OG1-CD1 2.91Å
264	A	87.1	Confident	84.8	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.1	-40.2	177.7	0	0	0	0	0	112.9	M246 L250 S260 I261 R266 L267 A268 V276 L281	M246-A264 HydrophobicContact CE-CB 4.46Å; M246-A264 HydrophobicContact SD-CB 3.62Å; L250-A264 HydrophobicContact CD1-CB 3.86Å; L250-A264 HydrophobicContact CD2-CB 4.09Å; L250-A264 HydrophobicContact CG-CB 4.48Å; S260-A264 WeakPolarHBondContact O-CB 3.39Å; S260-A264 PolarHBondContact O-N 3.27Å; I261-A264 PolarHBondContact O-N 3.38Å; A264-R266 VanDerWaalsContact C-N 3.35Å; A264-R266 PolarHBondContact O-N 2.75Å; A264-L267 PolarHBondContact O-N 3.45Å; A264-A268 PolarHBondContact O-N 3.23Å; A264-V276 HydrophobicContact CB-CG1 4.26Å; A264-V276 WeakPolarHBondContact O-CG1 3.09Å; A264-L281 HydrophobicContact CB-CD2 3.71Å
265	K	86.8	Confident	84.6	Confident	98 Å²	98	75.8 Å²	75.8	43%	0.426	37%	0.373	S	S	.	.	H	α-helix	trans	-60	-44.1	175.3	-74.3	-178.1	179.3	-173.2	0	112.1	L250 I261 T263 L267 A268 E269	L250-K265 HydrophobicContact CD1-CG 4.25Å; L250-K265 HydrophobicContact CD2-CG 3.98Å; I261-K265 HydrophobicContact CG2-CD 4.4Å; I261-K265 WeakPolarHBondContact O-CG 3.38Å; I261-K265 PolarHBondContact O-N 3.1Å; T263-K265 PolarHBondContact O-N 3.23Å; K265-L267 VanDerWaalsContact C-N 3.34Å; K265-A268 PolarHBondContact O-N 2.63Å; K265-E269 WeakPolarHBondContact O-CG 3.4Å; K265-E269 PolarHBondContact O-N 2.73Å
266	R	85.5	Confident	84.5	Confident	87 Å²	87	67.5 Å²	67.5	33%	0.328	34%	0.335	S	S	.	.	H	α-helix	trans	-67.7	-35.2	177.2	-71.7	175.5	177.1	-149.4	14.6	112.2	S262 T263 A264 A268 E269 F270 E298 K300 E302	S262-R266 WeakPolarHBondContact O-CG 3.17Å; S262-R266 PolarHBondContact O-N 3.32Å; T263-R266 PolarHBondContact O-N 2.89Å; A264-R266 VanDerWaalsContact C-N 3.35Å; A264-R266 PolarHBondContact O-N 2.75Å; R266-A268 VanDerWaalsContact C-N 3.29Å; R266-A268 PolarHBondContact O-N 2.85Å; R266-E269 PolarHBondContact O-N 2.76Å; R266-F270 WeakPolarHBondContact O-CB 3.09Å; R266-F270 PolarHBondContact O-N 2.88Å; R266-E298 PolarHBondContact NH2-O 3.42Å; R266-K300 VanDerWaalsContact CZ-O 3.27Å; R266-K300 PolarHBondContact NH1-O 3.48Å; R266-K300 PolarHBondContact NH2-O 2.9Å; R266-E302 WeakPolarHBondContact CA-OE1 3.45Å; R266-E302 HydrophobicContact CB-CG 4.4Å; R266-E302 WeakPolarHBondContact CB-OE1 3.13Å
267	L	85.9	Confident	84.2	Confident	24 Å²	24	67.8 Å²	67.8	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-65.3	-39.5	177.3	-79.7	170.7	0	0	0	109.9	T263 A264 K265 F270 L271 L281 E302	T263-L267 HydrophobicContact CG2-CD1 4.3Å; T263-L267 WeakPolarHBondContact O-CG 3.33Å; T263-L267 PolarHBondContact O-N 3.15Å; A264-L267 PolarHBondContact O-N 3.45Å; K265-L267 VanDerWaalsContact C-N 3.34Å; L267-F270 PolarHBondContact O-N 3.32Å; L267-L271 HydrophobicContact CD2-CD1 3.99Å; L267-L271 WeakPolarHBondContact O-CB 3.25Å; L267-L271 PolarHBondContact O-N 3.2Å; L267-L281 HydrophobicContact CD1-CD2 4.41Å; L267-E302 VanDerWaalsContact CA-OE1 3.26Å; L267-E302 WeakPolarHBondContact CA-OE1 3.41Å; L267-E302 WeakPolarHBondContact CD2-OE2 3.41Å; L267-E302 WeakPolarHBondContact CG-OE1 3.37Å; L267-E302 PolarHBondContact N-OE1 3.27Å
268	A	86.9	Confident	84.2	Confident	10 Å²	10	65.7 Å²	65.7	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-42.4	173.5	0	0	0	0	0	112.1	A264 K265 R266 F270 G272 V276	A264-A268 PolarHBondContact O-N 3.23Å; K265-A268 PolarHBondContact O-N 2.63Å; R266-A268 VanDerWaalsContact C-N 3.29Å; R266-A268 PolarHBondContact O-N 2.85Å; A268-F270 VanDerWaalsContact C-N 3.33Å; A268-F270 PolarHBondContact O-N 3.36Å; A268-G272 CarbonylContact O-C 3.24Å; A268-G272 VanDerWaalsContact O-C 3.24Å; A268-G272 WeakPolarHBondContact O-CA 3.39Å; A268-G272 PolarHBondContact O-N 3.43Å; A268-V276 HydrophobicContact CB-CG1 3.94Å; A268-V276 HydrophobicContact CB-CG2 3.79Å
269	E	86.3	Confident	84.3	Confident	161 Å²	161	66.5 Å²	66.5	75%	0.752	34%	0.34	S	S	*	.	H	α-helix	trans	-63.6	-36.9	175.8	-72.6	168.7	-168	0	0	112.5	K265 R266	K265-E269 WeakPolarHBondContact O-CG 3.4Å; K265-E269 PolarHBondContact O-N 2.73Å; R266-E269 PolarHBondContact O-N 2.76Å
270	F	86.8	Confident	84.3	Confident	144 Å²	144	67.8 Å²	67.8	63%	0.632	36%	0.358	S	S	*	.	H	α-helix	trans	-89.2	-45.3	-174	-174.2	-114	0	0	0	113.8	R266 L267 A268	R266-F270 WeakPolarHBondContact O-CB 3.09Å; R266-F270 PolarHBondContact O-N 2.88Å; L267-F270 PolarHBondContact O-N 3.32Å; A268-F270 VanDerWaalsContact C-N 3.33Å; A268-F270 PolarHBondContact O-N 3.36Å
271	L	86.3	Confident	84.3	Confident	85 Å²	85	68.6 Å²	68.6	45%	0.445	36%	0.361	S	S	.	.	H	α-helix	trans	-105.2	-7.9	-175.5	-59.2	176.4	0	0	0	113.3	L267 M275	L267-L271 HydrophobicContact CD2-CD1 3.99Å; L267-L271 WeakPolarHBondContact O-CB 3.25Å; L267-L271 PolarHBondContact O-N 3.2Å; L271-M275 HydrophobicContact CB-CG 3.88Å; L271-M275 HydrophobicContact CD1-CE 4.35Å; L271-M275 HydrophobicContact CD1-CG 4.45Å
272	G	85.1	Confident	84.2	Confident	30 Å²	30	71.3 Å²	71.3	31%	0.309	38%	0.381	S	S	.	.			trans	98.1	156.3	-179.8	0	0	0	0	0	114.3	A268 Q274 M275	A268-G272 CarbonylContact O-C 3.24Å; A268-G272 VanDerWaalsContact O-C 3.24Å; A268-G272 WeakPolarHBondContact O-CA 3.39Å; A268-G272 PolarHBondContact O-N 3.43Å; G272-Q274 PolarHBondContact O-N 3.18Å; G272-M275 PolarHBondContact O-N 2.92Å
273	D	83.3	Confident	84.2	Confident	118 Å²	118	69.9 Å²	69.9	63%	0.631	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.1	-173.2	-66.4	-33.7	0	0	0	114.8	M275 V276 K277	D273-M275 PolarHBondContact O-N 3.33Å; D273-V276 WeakPolarHBondContact O-CG2 3.32Å; D273-V276 PolarHBondContact O-N 2.7Å; D273-K277 WeakPolarHBondContact O-CG 3.49Å
274	Q	80.7	Confident	84.2	Confident	159 Å²	159	73 Å²	73	74%	0.743	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-63	-29.5	178.3	-66.1	-169.8	-2.9	0	0	112.5	G272 V276	G272-Q274 PolarHBondContact O-N 3.18Å; Q274-V276 PolarHBondContact O-N 2.84Å
275	M	78.5	Confident	84.2	Confident	96 Å²	96	73 Å²	73	47%	0.473	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-70	-16.7	-177.4	-67.5	-61.3	-71.1	0	0	114.2	L271 G272 D273	L271-M275 HydrophobicContact CB-CG 3.88Å; L271-M275 HydrophobicContact CD1-CE 4.35Å; L271-M275 HydrophobicContact CD1-CG 4.45Å; G272-M275 PolarHBondContact O-N 2.92Å; D273-M275 PolarHBondContact O-N 3.33Å
276	V	80.7	Confident	84.3	Confident	17 Å²	17	69.9 Å²	69.9	10%	0.103	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-117.2	8.6	-172.8	-60.9	0	0	0	0	114	L250 A264 A268 D273 Q274 L281	L250-V276 HydrophobicContact CB-CB 4.21Å; L250-V276 HydrophobicContact CD2-CB 4.04Å; L250-V276 HydrophobicContact CD2-CG1 4.1Å; L250-V276 HydrophobicContact CD2-CG2 4.09Å; A264-V276 HydrophobicContact CB-CG1 4.26Å; A264-V276 WeakPolarHBondContact O-CG1 3.09Å; A268-V276 HydrophobicContact CB-CG1 3.94Å; A268-V276 HydrophobicContact CB-CG2 3.79Å; D273-V276 WeakPolarHBondContact O-CG2 3.32Å; D273-V276 PolarHBondContact O-N 2.7Å; Q274-V276 PolarHBondContact O-N 2.84Å; V276-L281 HydrophobicContact CG1-CD2 3.89Å
277	K	78.7	Confident	84.4	Confident	119 Å²	119	69.8 Å²	69.8	52%	0.517	38%	0.375	S	S	.	.	S	Bend	trans	-72.5	-29.4	-176.6	-70	-173.5	178	-178.5	0	113.9	K249 D273	K249-K277 VanDerWaalsContact CD-O 3.24Å; K249-K277 WeakPolarHBondContact CD-O 3.2Å; K249-K277 WeakPolarHBondContact CE-O 3.21Å; K249-K277 PolarHBondContact NZ-O 3.17Å; D273-K277 WeakPolarHBondContact O-CG 3.49Å
278	D	82.8	Confident	84.5	Confident	120 Å²	120	70.3 Å²	70.3	64%	0.642	38%	0.381	S	S	*	.	S	Bend	trans	-103.7	151.6	-175.1	-64.8	-37.9	0	0	0	112
279	A	83.8	Confident	84.5	Confident	57 Å²	57	78.7 Å²	78.7	47%	0.471	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	155.5	170.4	0	0	0	0	0	110	K249	K249-A279 HydrophobicContact CG-CB 4.4Å
280	G	82.2	Confident	84.5	Confident	49 Å²	49	78.7 Å²	78.7	51%	0.505	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	5.8	178.9	0	0	0	0	0	115	M246 S282	M246-G280 WeakPolarHBondContact O-CA 3.26Å; M246-G280 PolarHBondContact O-N 3.43Å; G280-S282 PolarHBondContact O-N 3.26Å
281	L	85.4	Confident	84.4	Confident	31 Å²	31	75.2 Å²	75.2	16%	0.162	40%	0.399	C	S	.	.			trans	-53	127.3	178.6	180	63.9	0	0	0	111.6	S245 M246 A264 L267 V276 C283	S245-L281 CarbonylContact C-O 3.57Å; S245-L281 WeakPolarHBondContact CA-O 3.23Å; M246-L281 PolarHBondContact N-O 3.24Å; M246-L281 HydrophobicContact SD-CD2 4.47Å; A264-L281 HydrophobicContact CB-CD2 3.71Å; L267-L281 HydrophobicContact CD1-CD2 4.41Å; V276-L281 HydrophobicContact CG1-CD2 3.89Å; L281-C283 PolarHBondContact O-N 3.35Å
282	S	84.1	Confident	84.2	Confident	61 Å²	61	77.1 Å²	77.1	43%	0.427	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	102.4	175.4	-156.3	0	0	0	0	109.7	N243 G280 R284	N243-S282 VanDerWaalsContact CG-OG 3.27Å; N243-S282 PolarHBondContact ND2-OG 3.09Å; N243-S282 PolarHBondContact OD1-OG 3.47Å; G280-S282 PolarHBondContact O-N 3.26Å; S282-R284 PolarHBondContact O-N 2.94Å
283	C	85.3	Confident	84	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	101.5	178	-63.9	0	0	0	0	109.9	R244 S260 T263 L281	R244-C283 PolarHBondContact N-O 3.17Å; R244-C283 WeakPolarHBondContact O-CB 3.37Å; R244-C283 PolarHBondContact O-N 3.25Å; S260-C283 PolarHBondContact O-SG 2.98Å; T263-C283 HydrophobicContact CG2-CB 3.89Å; L281-C283 PolarHBondContact O-N 3.35Å
284	R	86.3	Confident	83.9	Confident	67 Å²	67	75.7 Å²	75.7	25%	0.253	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.4	168.8	-167.6	174.5	-174.7	-179.7	-3.3	109.7	S241 E242 S282	S241-R284 PolarHBondContact OG-NE 3.42Å; S241-R284 PolarHBondContact OG-NH2 2.99Å; E242-R284 WeakPolarHBondContact O-CA 3.49Å; S282-R284 PolarHBondContact O-N 2.94Å
285	Y	86.7	Confident	84	Confident	1 Å²	1	71.5 Å²	71.5	0%	0.004	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	162.1	-177.1	62.6	-92.6	0	0	0	112.6	E242 R244 T259 T263 I287	E242-Y285 HydrophobicContact CB-CE1 4.47Å; E242-Y285 HydrophobicContact CB-CE2 4.06Å; E242-Y285 PolarHBondContact N-O 2.88Å; E242-Y285 PolarHBondContact O-N 3Å; E242-Y285 PolarHBondContact OE1-OH 2.82Å; E242-Y285 PolarHBondContact OE2-OH 3.1Å; R244-Y285 HydrophobicContact CG-CE1 4.34Å; R244-Y285 PolarHBondContact NE-OH 3.32Å; T259-Y285 VanDerWaalsContact CB-OH 3.23Å; T259-Y285 WeakPolarHBondContact CB-OH 3.43Å; T259-Y285 HydrophobicContact CG2-CE2 4.43Å; T259-Y285 PolarHBondContact OG1-OH 3.19Å; T263-Y285 HydrophobicContact CG2-CD1 4.41Å; T263-Y285 WeakPolarHBondContact OG1-CD1 2.91Å; Y285-I287 HydrophobicContact CE2-CG1 4.46Å
286	I	89.3	Confident	84.1	Confident	32 Å²	32	70.2 Å²	70.2	16%	0.164	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	162.7	166	59.5	161.9	0	0	0	109.7	F237 I240 K300 S301	F237-I286 HydrophobicContact CD1-CG2 4.46Å; F237-I286 HydrophobicContact CE1-CD1 4.11Å; I240-I286 HydrophobicContact CD1-CG2 4.2Å; I240-I286 HydrophobicContact CG1-CG2 3.89Å; I286-K300 CarbonylContact O-C 3.58Å; I286-K300 WeakPolarHBondContact O-CA 3.04Å; I286-S301 WeakPolarHBondContact CG1-O 3.34Å; I286-S301 PolarHBondContact N-O 3.34Å; I286-S301 PolarHBondContact O-N 3.31Å
287	I	87.7	Confident	84	Confident	84 Å²	84	71.1 Å²	71.1	43%	0.431	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.8	177.3	-60.7	167.4	0	0	0	108.8	Y285 V296 R299	Y285-I287 HydrophobicContact CE2-CG1 4.46Å; I287-V296 HydrophobicContact CD1-CG1 3.72Å; I287-V296 HydrophobicContact CG1-CG1 4.32Å; I287-V296 HydrophobicContact CG2-CG1 4.33Å; I287-R299 CarbonylContact C-O 3.47Å; I287-R299 WeakPolarHBondContact CA-O 3.34Å
288	S	87.6	Confident	83.7	Confident	35 Å²	35	69.5 Å²	69.5	25%	0.245	40%	0.398	C	S	.	.			trans	-78.4	152.7	174.8	62.1	0	0	0	0	111.5	K290 R299	S288-K290 PolarHBondContact OG-O 3.47Å; S288-R299 PolarHBondContact N-O 3.44Å; S288-R299 VanDerWaalsContact O-CB 3.29Å; S288-R299 WeakPolarHBondContact O-CB 3.37Å; S288-R299 PolarHBondContact O-NH1 3.5Å; S288-R299 PolarHBondContact OG-O 2.93Å
289	R	86.4	Confident	83.2	Confident	187 Å²	187	66.4 Å²	66.4	71%	0.706	38%	0.378	S	S	*	.	S	Bend	trans	-70.9	-38.7	171.8	178	175.9	167.6	170.5	-0.6	112.2	E292 R299	R289-E292 HydrophobicContact CG-CG 4.48Å; R289-E292 IonicContact CZ-OE1 3.93Å; R289-E292 IonicContact NE-OE1 2.8Å; R289-E292 PolarHBondContact NE-OE1 3.45Å; R289-E292 IonicContact NH2-OE1 3.84Å; R289-E292 PolarHBondContact NH2-OE1 2.83Å; R289-R299 WeakPolarHBondContact O-CD 3.35Å
290	K	85.9	Confident	82.3	Confident	160 Å²	160	63.8 Å²	63.8	70%	0.696	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-92.2	151.7	-178.6	-67.1	-173.3	177.1	-177	0	111.6	S288	S288-K290 PolarHBondContact OG-O 3.47Å
291	P	85.4	Confident	81.4	Confident	71 Å²	71	63.9 Å²	63.9	46%	0.461	35%	0.349	S	S	.	.	S	Bend	cis	-69.8	136.9	-10	26	-33	0	0	0	112.6	S294 R299	P291-S294 WeakPolarHBondContact CG-OG 3.45Å; P291-S294 PolarHBondContact O-N 3.41Å; P291-R299 WeakPolarHBondContact O-CD 3.12Å
292	E	81.4	Confident	80.2	Confident	125 Å²	125	64 Å²	64	58%	0.584	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	143.7	-179.5	-67.4	-172.8	165.1	0	0	111.1	R289 S294	R289-E292 HydrophobicContact CG-CG 4.48Å; R289-E292 IonicContact CZ-OE1 3.93Å; R289-E292 IonicContact NE-OE1 2.8Å; R289-E292 PolarHBondContact NE-OE1 3.45Å; R289-E292 IonicContact NH2-OE1 3.84Å; R289-E292 PolarHBondContact NH2-OE1 2.83Å; E292-S294 PolarHBondContact O-N 2.81Å
293	G	81.1	Confident	78.8	Confident	88 Å²	88	65 Å²	65	91%	0.907	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-16	-177.4	0	0	0	0	0	115.1
294	S	82.6	Confident	76.6	Confident	31 Å²	31	69.1 Å²	69.1	22%	0.217	37%	0.369	C	S	.	.	S	Bend	trans	-73.4	147.8	176	-70.8	0	0	0	0	112.8	P291 E292 R299	P291-S294 WeakPolarHBondContact CG-OG 3.45Å; P291-S294 PolarHBondContact O-N 3.41Å; E292-S294 PolarHBondContact O-N 2.81Å; S294-R299 PolarHBondContact O-NE 3.01Å
295	P	82.8	Confident	74.4	Confident	71 Å²	71	69 Å²	69	46%	0.461	38%	0.379	S	S	.	.			trans	-52.4	148.8	173.1	-25.7	34.1	0	0	0	112.6	T297 E298 R299	P295-T297 PolarHBondContact O-N 3Å; P295-E298 PolarHBondContact O-N 2.89Å; P295-R299 PolarHBondContact O-N 3.04Å
296	V	80.8	Confident	71.8	Confident	68 Å²	68	74.1 Å²	74.1	41%	0.412	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-31	177.8	175.3	0	0	0	0	111.9	I287 E298 R299	I287-V296 HydrophobicContact CD1-CG1 3.72Å; I287-V296 HydrophobicContact CG1-CG1 4.32Å; I287-V296 HydrophobicContact CG2-CG1 4.33Å; V296-E298 PolarHBondContact O-N 2.58Å; V296-R299 PolarHBondContact O-N 2.76Å
297	T	78	Confident	68.9	Low	37 Å²	37	81.7 Å²	81.7	23%	0.227	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.8	177.2	48.8	0	0	0	0	114.1	S262 P295 K300	S262-T297 PolarHBondContact OG-O 3.49Å; P295-T297 PolarHBondContact O-N 3Å; T297-K300 WeakPolarHBondContact O-CE 3.29Å; T297-K300 PolarHBondContact O-NZ 3.14Å
298	E	71.8	Confident	66.2	Low	84 Å²	84	85.4 Å²	85.4	39%	0.393	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-19.1	-175.4	-66.3	175.7	-170	0	0	112.9	R266 P295 V296 K300	R266-E298 PolarHBondContact NH2-O 3.42Å; P295-E298 PolarHBondContact O-N 2.89Å; V296-E298 PolarHBondContact O-N 2.58Å; E298-K300 PolarHBondContact O-N 3.36Å
299	R	72.4	Confident	65.1	Low	55 Å²	55	88 Å²	88	21%	0.208	50%	0.5	C	S	.	.	S	Bend	trans	-96	47.9	-178	-58.3	-174.6	-74.3	121.5	-13.1	112.9	I287 S288 R289 P291 S294 P295 V296	I287-R299 CarbonylContact C-O 3.47Å; I287-R299 WeakPolarHBondContact CA-O 3.34Å; S288-R299 PolarHBondContact N-O 3.44Å; S288-R299 VanDerWaalsContact O-CB 3.29Å; S288-R299 WeakPolarHBondContact O-CB 3.37Å; S288-R299 PolarHBondContact O-NH1 3.5Å; S288-R299 PolarHBondContact OG-O 2.93Å; R289-R299 WeakPolarHBondContact O-CD 3.35Å; P291-R299 WeakPolarHBondContact O-CD 3.12Å; S294-R299 PolarHBondContact O-NE 3.01Å; P295-R299 PolarHBondContact O-N 3.04Å; V296-R299 PolarHBondContact O-N 2.76Å
300	K	66.1	Low	64	Low	3 Å²	3	82.7 Å²	82.7	1%	0.013	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	157.3	179	-62.9	175.1	-157.9	139.7	0	109.8	S258 T259 S262 R266 I286 T297 E298	S258-K300 PolarHBondContact O-NZ 3.23Å; T259-K300 VanDerWaalsContact C-NZ 3.33Å; T259-K300 WeakPolarHBondContact O-CD 3.39Å; T259-K300 VanDerWaalsContact O-CE 3.25Å; T259-K300 WeakPolarHBondContact O-CE 3.29Å; T259-K300 PolarHBondContact O-NZ 3.18Å; S262-K300 PolarHBondContact OG-NZ 3.39Å; R266-K300 VanDerWaalsContact CZ-O 3.27Å; R266-K300 PolarHBondContact NH1-O 3.48Å; R266-K300 PolarHBondContact NH2-O 2.9Å; I286-K300 CarbonylContact O-C 3.58Å; I286-K300 WeakPolarHBondContact O-CA 3.04Å; T297-K300 WeakPolarHBondContact O-CE 3.29Å; T297-K300 PolarHBondContact O-NZ 3.14Å; E298-K300 PolarHBondContact O-N 3.36Å
301	S	63	Low	62.7	Low	50 Å²	50	78.4 Å²	78.4	35%	0.35	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.9	163.4	-169.3	0	0	0	0	108.3	I286	I286-S301 WeakPolarHBondContact CG1-O 3.34Å; I286-S301 PolarHBondContact N-O 3.34Å; I286-S301 PolarHBondContact O-N 3.31Å
302	E	59.4	Low	61.4	Low	35 Å²	35	78.9 Å²	78.9	16%	0.164	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	150.7	178.2	-63.9	-174.7	171.1	0	0	110.7	R266 L267	R266-E302 WeakPolarHBondContact CA-OE1 3.45Å; R266-E302 HydrophobicContact CB-CG 4.4Å; R266-E302 WeakPolarHBondContact CB-OE1 3.13Å; L267-E302 VanDerWaalsContact CA-OE1 3.26Å; L267-E302 WeakPolarHBondContact CA-OE1 3.41Å; L267-E302 WeakPolarHBondContact CD2-OE2 3.41Å; L267-E302 WeakPolarHBondContact CG-OE1 3.37Å; L267-E302 PolarHBondContact N-OE1 3.27Å
303	W	54	Low	60.2	Low	82 Å²	82	76 Å²	76	31%	0.311	47%	0.473	S	S	.	.			trans	-103.3	120.6	159.5	179.6	-110.4	0	0	0	107.7	F237 S305	F237-W303 HydrophobicContact CB-CD2 4.49Å; F237-W303 HydrophobicContact CB-CH2 4.5Å; F237-W303 HydrophobicContact CB-CZ2 4.46Å; F237-W303 HydrophobicContact CD1-CD2 4.03Å; F237-W303 AromaticContact CD1-CE3 3.44Å; F237-W303 HydrophobicContact CD1-CE3 3.44Å; F237-W303 VanDerWaalsContact CD1-CE3 3.44Å; F237-W303 HydrophobicContact CD1-CH2 4.4Å; F237-W303 AromaticContact CD1-CZ3 3.68Å; F237-W303 HydrophobicContact CD1-CZ3 3.68Å; F237-W303 AromaticContact CD2-CE3 3.97Å; F237-W303 HydrophobicContact CD2-CE3 3.97Å; F237-W303 AromaticContact CD2-CH2 3.41Å; F237-W303 HydrophobicContact CD2-CH2 3.41Å; F237-W303 VanDerWaalsContact CD2-CH2 3.41Å; F237-W303 HydrophobicContact CD2-CZ2 4.16Å; F237-W303 AromaticContact CD2-CZ3 3.32Å; F237-W303 HydrophobicContact CD2-CZ3 3.32Å; F237-W303 HydrophobicContact CE1-CD2 4.45Å; F237-W303 AromaticContact CE1-CE3 3.46Å; F237-W303 HydrophobicContact CE1-CE3 3.46Å; F237-W303 VanDerWaalsContact CE1-CE3 3.46Å; F237-W303 AromaticContact CE1-CZ3 3.54Å; F237-W303 HydrophobicContact CE1-CZ3 3.54Å; F237-W303 HydrophobicContact CE2-CE3 4.03Å; F237-W303 AromaticContact CE2-CH2 3.67Å; F237-W303 HydrophobicContact CE2-CH2 3.67Å; F237-W303 AromaticContact CE2-CZ3 3.23Å; F237-W303 HydrophobicContact CE2-CZ3 3.23Å; F237-W303 HydrophobicContact CG-CD2 4.15Å; F237-W303 AromaticContact CG-CE3 3.72Å; F237-W303 HydrophobicContact CG-CE3 3.72Å; F237-W303 AromaticContact CG-CH2 3.86Å; F237-W303 HydrophobicContact CG-CH2 3.86Å; F237-W303 HydrophobicContact CG-CZ2 4.27Å; F237-W303 AromaticContact CG-CZ3 3.59Å; F237-W303 HydrophobicContact CG-CZ3 3.59Å; F237-W303 AromaticContact CZ-CE3 3.79Å; F237-W303 HydrophobicContact CZ-CE3 3.79Å; F237-W303 HydrophobicContact CZ-CH2 4.24Å; F237-W303 AromaticContact CZ-CZ3 3.34Å; F237-W303 HydrophobicContact CZ-CZ3 3.34Å; W303-S305 PolarHBondContact O-N 2.8Å
304	P	40.9	Very low	58.8	Low	85 Å²	85	75.2 Å²	75.2	55%	0.552	44%	0.444	S	S	*	.			trans	-74.4	79.1	171.1	30.7	-31	0	0	0	108.4	V306	P304-V306 PolarHBondContact O-N 2.75Å; P304-V306 VanDerWaalsContact O-N 3.09Å
305	S	39.8	Very low	57.1	Low	64 Å²	64	78.4 Å²	78.4	45%	0.448	46%	0.46	S	S	.	.			trans	-79.9	79.1	157.7	53.7	0	0	0	0	107.4	W303 E307	W303-S305 PolarHBondContact O-N 2.8Å; S305-E307 VanDerWaalsContact C-N 3.28Å; S305-E307 PolarHBondContact O-N 3.43Å
306	V	31.2	Very low	55.1	Low	110 Å²	110	78.9 Å²	78.9	67%	0.667	46%	0.46	S	S	*	.			trans	-76.6	91.7	156.7	-175.5	0	0	0	0	105.1	P304 A308	P304-V306 PolarHBondContact O-N 2.75Å; P304-V306 VanDerWaalsContact O-N 3.09Å; V306-A308 HydrophobicContact CG1-CB 4.32Å; V306-A308 PolarHBondContact O-N 3.31Å
307	E	29.3	Very low	52.9	Low	190 Å²	190	79.8 Å²	79.8	89%	0.888	46%	0.464	S	S	*	.			trans	-73.5	104.9	150.6	-79.2	-177.9	166.5	0	0	105.6	S305	S305-E307 VanDerWaalsContact C-N 3.28Å; S305-E307 PolarHBondContact O-N 3.43Å
308	A	29.5	Very low	50.7	Low	163 Å²	163	83.7 Å²	83.7	100%	1.347	49%	0.485	S	S	*	.			trans	-90.2	0	157.9	0	0	0	0	0	108.4	V306	V306-A308 HydrophobicContact CG1-CB 4.32Å; V306-A308 PolarHBondContact O-N 3.31Å

Retrieved 308 of 308 residues in 173.3 ms (Link to these results)

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