A0A2K6CLA5_MACNE Loading...

non-specific serine/threonine protein kinase

Component of the EKC/KEOPS complex that is required for the formation of a threonylcarbamoyl group on adenosine at position 37 (t(6)A37) in tRNAs that read codons beginning with adenine. The complex is probably involved in the transfer of the threonylcarbamoyl moiety of threonylcarbamoyl-AMP (TC-AMP) to the N6 group of A37. TP53RK has ATPase activity in the context of the EKC/KEOPS complex and likely plays a supporting role to the catalytic subunit OSGEP. Atypical protein kinase that phosphorylates 'Ser-15' of p53/TP53 protein and may therefore participate in its activation.

AlphaFold DB , UniProt , Accession A0A2K6CLA5, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene TP53RK, Length 253 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.2	Very low	44.7	Very low	249 Å²	249	138 Å²	138	100%	1.227	87%	0.865	S	S	*	*				0	110.4	0	-81.7	-159	-178.2	0	0	109.1
2	A	37.6	Very low	45	Very low	104 Å²	104	131.9 Å²	131.9	86%	0.86	85%	0.849	S	S	*	*			trans	-169.5	110.9	150.7	0	0	0	0	0	106.7
3	A	40.6	Very low	45.8	Very low	104 Å²	104	136.1 Å²	136.1	86%	0.86	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-71.1	126.1	-177.4	0	0	0	0	0	110.6	R5	A3-R5 PolarHBondContact O-N 2.87Å
4	A	41.4	Very low	46.6	Very low	102 Å²	102	139.2 Å²	139.2	84%	0.843	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-76.6	119.6	167.6	0	0	0	0	0	108.8
5	R	41.3	Very low	47.3	Very low	246 Å²	246	135.2 Å²	135.2	93%	0.928	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-59.8	131.9	175.8	-86	176.3	161.3	-169	-5.6	110.7	A3	A3-R5 PolarHBondContact O-N 2.87Å
6	A	49.4	Very low	48.7	Very low	102 Å²	102	130.8 Å²	130.8	84%	0.843	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.9	164.2	0	0	0	0	0	110
7	A	44	Very low	50	Low	98 Å²	98	129.5 Å²	129.5	81%	0.81	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-92.5	117.2	161.8	0	0	0	0	0	107.5
8	A	51.5	Low	51.3	Low	87 Å²	87	131.6 Å²	131.6	72%	0.719	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.8	145.6	168.3	0	0	0	0	0	109.4	D10	A8-D10 PolarHBondContact O-N 3.21Å
9	P	44	Very low	52.7	Low	132 Å²	132	127.2 Å²	127.2	86%	0.857	78%	0.781	S	S	*	*			trans	-85.3	103.2	160.1	32.1	-22.2	0	0	0	107.1
10	D	51.9	Low	54.1	Low	137 Å²	137	127.3 Å²	127.3	73%	0.733	77%	0.772	S	S	*	*			trans	-118.5	88.9	163	-172.1	25	0	0	0	107.2	A8	A8-D10 PolarHBondContact O-N 3.21Å
11	D	43.4	Very low	55.3	Low	157 Å²	157	124.1 Å²	124.1	84%	0.84	76%	0.759	S	S	*	*			trans	-132.4	66.1	162.2	-73.2	-46.3	0	0	0	106.6	E13	D11-E13 PolarHBondContact O-N 3.27Å
12	G	49.3	Very low	57	Low	65 Å²	65	115.5 Å²	115.5	67%	0.67	72%	0.717	S	S	*	*			trans	-68.8	76.2	157.4	0	0	0	0	0	109.1	E14	G12-E14 PolarHBondContact O-N 3.21Å
13	E	54.7	Low	59.2	Low	186 Å²	186	113.2 Å²	113.2	87%	0.869	70%	0.699	S	S	*	*			trans	-60.5	106.8	166.2	-108.8	-177.8	166.8	0	0	107.6	D11	D11-E13 PolarHBondContact O-N 3.27Å
14	E	56.8	Low	61.4	Low	180 Å²	180	110.1 Å²	110.1	84%	0.841	67%	0.673	S	S	*	*			trans	-51.2	130.4	169.7	-74.6	-173.9	159.1	0	0	108.3	G12 A16	G12-E14 PolarHBondContact O-N 3.21Å; E14-A16 PolarHBondContact O-N 3.19Å; E14-A16 VanDerWaalsContact O-N 3.11Å
15	P	57	Low	63.4	Low	79 Å²	79	106.1 Å²	106.1	51%	0.513	64%	0.64	S	S	.	*			trans	-57.8	125.2	-178.9	22.4	-30.9	0	0	0	108.7	A19 E20	P15-A19 HydrophobicContact CB-CB 4.11Å; P15-E20 HydrophobicContact CG-CG 4.18Å
16	A	69.7	Low	65.6	Low	64 Å²	64	100.3 Å²	100.3	53%	0.529	62%	0.618	S	S	.	*			trans	-45	142.5	179.2	0	0	0	0	0	110.8	E14 E18 A19	E14-A16 PolarHBondContact O-N 3.19Å; E14-A16 VanDerWaalsContact O-N 3.11Å; A16-E18 PolarHBondContact O-N 3.05Å; A16-A19 WeakPolarHBondContact O-CA 3.33Å; A16-A19 VanDerWaalsContact O-CB 3.31Å; A16-A19 WeakPolarHBondContact O-CB 3.45Å; A16-A19 PolarHBondContact O-N 2.94Å
17	P	71.6	Confident	67.4	Low	110 Å²	110	100.3 Å²	100.3	71%	0.714	60%	0.601	S	S	*	*	H	α-helix	trans	-53.9	-24.6	-170.3	14.4	-28.7	0	0	0	114.8	A21	P17-A21 WeakPolarHBondContact O-CB 3.19Å; P17-A21 PolarHBondContact O-N 3.28Å
18	E	73.3	Confident	69.5	Low	166 Å²	166	103 Å²	103	78%	0.776	59%	0.59	S	S	*	*	H	α-helix	trans	-68	-35.4	172.5	-64	-171.8	165.4	0	0	113.8	A16 L22	A16-E18 PolarHBondContact O-N 3.05Å; E18-L22 WeakPolarHBondContact O-CB 3.41Å; E18-L22 PolarHBondContact O-N 3.41Å
19	A	76.9	Confident	71.3	Confident	49 Å²	49	99.6 Å²	99.6	41%	0.405	56%	0.561	S	S	.	*	H	α-helix	trans	-70.3	-40.4	178.9	0	0	0	0	0	111.7	P15 A16 L22 A23	P15-A19 HydrophobicContact CB-CB 4.11Å; A16-A19 WeakPolarHBondContact O-CA 3.33Å; A16-A19 VanDerWaalsContact O-CB 3.31Å; A16-A19 WeakPolarHBondContact O-CB 3.45Å; A16-A19 PolarHBondContact O-N 2.94Å; A19-L22 PolarHBondContact O-N 2.87Å; A19-A23 WeakPolarHBondContact O-CB 3.5Å; A19-A23 PolarHBondContact O-N 3.47Å
20	E	81.6	Confident	73.5	Confident	129 Å²	129	95.4 Å²	95.4	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-63.2	-47.1	172.2	-90.5	-166.4	143.3	0	0	112	P15 L22 A23 A24	P15-E20 HydrophobicContact CG-CG 4.18Å; E20-L22 PolarHBondContact O-N 2.88Å; E20-A23 PolarHBondContact O-N 3.19Å; E20-A23 VanDerWaalsContact O-N 3.15Å; E20-A24 WeakPolarHBondContact O-CB 3.35Å; E20-A24 PolarHBondContact O-N 3.26Å
21	A	80.3	Confident	75.4	Confident	60 Å²	60	96.7 Å²	96.7	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-58.6	-39.3	177.7	0	0	0	0	0	111.8	P17 A25	P17-A21 WeakPolarHBondContact O-CB 3.19Å; P17-A21 PolarHBondContact O-N 3.28Å; A21-A25 WeakPolarHBondContact O-CB 2.86Å; A21-A25 PolarHBondContact O-N 2.83Å
22	L	81.2	Confident	77.7	Confident	68 Å²	68	92.9 Å²	92.9	36%	0.356	51%	0.506	S	S	.	.	H	α-helix	trans	-67.9	-41.6	176.5	-172.2	69.2	0	0	0	112.3	E18 A19 E20 A25 R26 A107	E18-L22 WeakPolarHBondContact O-CB 3.41Å; E18-L22 PolarHBondContact O-N 3.41Å; A19-L22 PolarHBondContact O-N 2.87Å; E20-L22 PolarHBondContact O-N 2.88Å; L22-A25 PolarHBondContact O-N 3.01Å; L22-R26 WeakPolarHBondContact O-CG 3.48Å; L22-R26 PolarHBondContact O-N 2.97Å; L22-A107 HydrophobicContact CD1-CB 3.43Å; L22-A107 VanDerWaalsContact CD1-CB 3.43Å
23	A	83.8	Confident	79.8	Confident	57 Å²	57	90.1 Å²	90.1	47%	0.471	48%	0.476	S	S	.	.	H	α-helix	trans	-63.1	-46.9	176.2	0	0	0	0	0	111.3	A19 E20 A25 R26 E27	A19-A23 WeakPolarHBondContact O-CB 3.5Å; A19-A23 PolarHBondContact O-N 3.47Å; E20-A23 PolarHBondContact O-N 3.19Å; E20-A23 VanDerWaalsContact O-N 3.15Å; A23-A25 VanDerWaalsContact C-N 3.31Å; A23-A25 PolarHBondContact O-N 3.13Å; A23-R26 PolarHBondContact O-N 3.33Å; A23-E27 PolarHBondContact O-N 3.13Å
24	A	85.9	Confident	81.6	Confident	38 Å²	38	90.2 Å²	90.2	31%	0.314	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-38.8	176	0	0	0	0	0	112	E20 E27 R28	E20-A24 WeakPolarHBondContact O-CB 3.35Å; E20-A24 PolarHBondContact O-N 3.26Å; A24-E27 PolarHBondContact O-N 2.69Å; A24-R28 WeakPolarHBondContact O-CG 3.46Å; A24-R28 PolarHBondContact O-N 2.91Å; A24-R28 PolarHBondContact O-NH1 3.42Å
25	A	84.6	Confident	83.3	Confident	19 Å²	19	85.1 Å²	85.1	16%	0.157	46%	0.463	C	S	.	.	H	α-helix	trans	-62.7	-45.1	174.5	0	0	0	0	0	112.3	A21 L22 A23 E27 R28 S29 A107	A21-A25 WeakPolarHBondContact O-CB 2.86Å; A21-A25 PolarHBondContact O-N 2.83Å; L22-A25 PolarHBondContact O-N 3.01Å; A23-A25 VanDerWaalsContact C-N 3.31Å; A23-A25 PolarHBondContact O-N 3.13Å; A25-E27 VanDerWaalsContact C-N 3.32Å; A25-E27 PolarHBondContact O-N 2.98Å; A25-R28 PolarHBondContact O-N 3.23Å; A25-S29 PolarHBondContact O-N 3.29Å; A25-S29 PolarHBondContact O-OG 3.33Å; A25-A107 HydrophobicContact CB-CB 3.97Å
26	R	86.3	Confident	85.1	Confident	123 Å²	123	82.7 Å²	82.7	46%	0.464	45%	0.446	S	S	.	.	H	α-helix	trans	-62.2	-39.2	176.3	-74	171.8	174.4	170	2.3	112.4	L22 A23 S29 S30 A107	L22-R26 WeakPolarHBondContact O-CG 3.48Å; L22-R26 PolarHBondContact O-N 2.97Å; A23-R26 PolarHBondContact O-N 3.33Å; R26-S29 PolarHBondContact O-N 2.9Å; R26-S30 VanDerWaalsContact O-CB 3.28Å; R26-S30 WeakPolarHBondContact O-CB 3.46Å; R26-S30 PolarHBondContact O-N 3.47Å; R26-A107 WeakPolarHBondContact CG-O 3.22Å; R26-A107 PolarHBondContact NE-O 2.93Å
27	E	88.2	Confident	86.4	Confident	103 Å²	103	84.8 Å²	84.8	48%	0.481	45%	0.445	S	S	.	.	H	α-helix	trans	-65.7	-44.7	177.6	-161.8	-162.8	147.4	0	0	111.3	A23 A24 A25 S29 S30 R31	A23-E27 PolarHBondContact O-N 3.13Å; A24-E27 PolarHBondContact O-N 2.69Å; A25-E27 VanDerWaalsContact C-N 3.32Å; A25-E27 PolarHBondContact O-N 2.98Å; E27-S29 PolarHBondContact O-N 3.15Å; E27-S30 WeakPolarHBondContact O-CB 3.44Å; E27-S30 PolarHBondContact O-N 2.98Å; E27-R31 WeakPolarHBondContact O-CB 3.45Å; E27-R31 PolarHBondContact O-N 3.07Å; E27-R31 IonicContact OE1-CZ 2.76Å; E27-R31 IonicContact OE1-NH2 3.12Å; E27-R31 PolarHBondContact OE1-NH2 3.01Å
28	R	87.9	Confident	87.6	Confident	153 Å²	153	83.7 Å²	83.7	58%	0.577	43%	0.432	S	S	*	.	H	α-helix	trans	-57.8	-47.8	175.3	-73.4	-171.1	-60.2	-90.7	4.4	111.6	A24 A25 R31 F32	A24-R28 WeakPolarHBondContact O-CG 3.46Å; A24-R28 PolarHBondContact O-N 2.91Å; A24-R28 PolarHBondContact O-NH1 3.42Å; A25-R28 PolarHBondContact O-N 3.23Å; R28-R31 PolarHBondContact O-N 2.66Å; R28-F32 PolarHBondContact O-N 3.4Å
29	S	89.4	Confident	88.6	Confident	16 Å²	16	79 Å²	79	11%	0.112	42%	0.415	C	S	.	.	H	α-helix	trans	-63.8	-41.8	177.1	-68.9	0	0	0	0	111.6	A25 R26 E27 R31 F32 L33 D105 S108	A25-S29 PolarHBondContact O-N 3.29Å; A25-S29 PolarHBondContact O-OG 3.33Å; R26-S29 PolarHBondContact O-N 2.9Å; E27-S29 PolarHBondContact O-N 3.15Å; S29-R31 VanDerWaalsContact C-N 3.33Å; S29-R31 PolarHBondContact O-N 3.15Å; S29-F32 PolarHBondContact O-N 3.4Å; S29-L33 WeakPolarHBondContact O-CB 3.48Å; S29-L33 VanDerWaalsContact O-CG 3.23Å; S29-L33 WeakPolarHBondContact O-CG 3.46Å; S29-L33 PolarHBondContact O-N 3.06Å; S29-D105 PolarHBondContact OG-OD2 3.39Å; S29-S108 WeakPolarHBondContact CB-OG 3.2Å; S29-S108 PolarHBondContact OG-OG 3.47Å
30	S	89.6	Confident	89.3	Confident	45 Å²	45	83.3 Å²	83.3	32%	0.315	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-40.2	174.8	177.6	0	0	0	0	112.9	R26 E27 R34	R26-S30 VanDerWaalsContact O-CB 3.28Å; R26-S30 WeakPolarHBondContact O-CB 3.46Å; R26-S30 PolarHBondContact O-N 3.47Å; E27-S30 WeakPolarHBondContact O-CB 3.44Å; E27-S30 PolarHBondContact O-N 2.98Å; S30-R34 WeakPolarHBondContact O-CG 3.49Å; S30-R34 PolarHBondContact O-N 3.3Å; S30-R34 PolarHBondContact O-NE 2.96Å; S30-R34 PolarHBondContact OG-NH2 3.27Å
31	R	91.8	Very high	89.8	Confident	164 Å²	164	82.7 Å²	82.7	62%	0.619	42%	0.422	S	S	*	.	H	α-helix	trans	-67.8	-43.4	176.2	-167.8	-179.4	-61.4	170.1	2.4	111.4	E27 R28 S29 R34	E27-R31 WeakPolarHBondContact O-CB 3.45Å; E27-R31 PolarHBondContact O-N 3.07Å; E27-R31 IonicContact OE1-CZ 2.76Å; E27-R31 IonicContact OE1-NH2 3.12Å; E27-R31 PolarHBondContact OE1-NH2 3.01Å; R28-R31 PolarHBondContact O-N 2.66Å; S29-R31 VanDerWaalsContact C-N 3.33Å; S29-R31 PolarHBondContact O-N 3.15Å; R31-R34 PolarHBondContact O-N 2.69Å
32	F	92.1	Very high	90.2	Very high	76 Å²	76	81.5 Å²	81.5	33%	0.333	42%	0.415	S	S	.	.	H	α-helix	trans	-59.9	-49.9	175.7	179.9	-100.3	0	0	0	111.6	R28 S29 R34 G35 L36 F52 Y112	R28-F32 PolarHBondContact O-N 3.4Å; S29-F32 PolarHBondContact O-N 3.4Å; F32-R34 VanDerWaalsContact C-N 3.26Å; F32-R34 PolarHBondContact O-N 3.31Å; F32-G35 PolarHBondContact O-N 3.47Å; F32-G35 VanDerWaalsContact O-N 3.07Å; F32-L36 HydrophobicContact CD1-CD1 4.15Å; F32-L36 HydrophobicContact CE1-CD1 3.74Å; F32-L36 HydrophobicContact CE1-CD2 4.23Å; F32-L36 HydrophobicContact CE1-CG 4.32Å; F32-L36 HydrophobicContact CZ-CD1 4.46Å; F32-L36 HydrophobicContact CZ-CD2 4.15Å; F32-F52 HydrophobicContact CE1-CD2 4.41Å; F32-F52 HydrophobicContact CZ-CD2 4.13Å; F32-Y112 HydrophobicContact CD1-CE1 4.05Å; F32-Y112 HydrophobicContact CE1-CD1 4.49Å; F32-Y112 AromaticContact CE1-CE1 3.67Å; F32-Y112 HydrophobicContact CE1-CE1 3.67Å
33	L	92.9	Very high	90.4	Very high	8 Å²	8	82 Å²	82	4%	0.042	43%	0.429	C	S	.	.	H	α-helix	trans	-61.8	-30.9	-179.2	-68.6	177	0	0	0	113.4	S29 G35 L36 F48 I59 H61	S29-L33 WeakPolarHBondContact O-CB 3.48Å; S29-L33 VanDerWaalsContact O-CG 3.23Å; S29-L33 WeakPolarHBondContact O-CG 3.46Å; S29-L33 PolarHBondContact O-N 3.06Å; L33-G35 PolarHBondContact O-N 3.11Å; L33-L36 HydrophobicContact CD2-CD1 3.9Å; L33-L36 WeakPolarHBondContact O-CB 3.43Å; L33-L36 PolarHBondContact O-N 3.17Å; L33-F48 HydrophobicContact CB-CE2 4.49Å; L33-F48 HydrophobicContact CB-CZ 4.41Å; L33-F48 HydrophobicContact CD1-CE2 4.27Å; L33-F48 HydrophobicContact CD2-CD2 3.89Å; L33-F48 HydrophobicContact CD2-CE2 4.19Å; L33-F48 HydrophobicContact CD2-CG 4.32Å; L33-I59 HydrophobicContact CD2-CB 4.14Å; L33-I59 HydrophobicContact CD2-CG2 3.61Å; L33-H61 HydrophobicContact CD1-CB 3.89Å; L33-H61 WeakPolarHBondContact CD1-ND1 3.44Å
34	R	91.8	Very high	90.4	Very high	188 Å²	188	82 Å²	82	71%	0.709	42%	0.419	S	S	*	.	H	α-helix	trans	-65.8	-23.9	176.3	-84.2	-176.4	-103	-152.6	-0.9	113.6	S30 R31 F32 L36	S30-R34 WeakPolarHBondContact O-CG 3.49Å; S30-R34 PolarHBondContact O-N 3.3Å; S30-R34 PolarHBondContact O-NE 2.96Å; S30-R34 PolarHBondContact OG-NH2 3.27Å; R31-R34 PolarHBondContact O-N 2.69Å; F32-R34 VanDerWaalsContact C-N 3.26Å; F32-R34 PolarHBondContact O-N 3.31Å; R34-L36 VanDerWaalsContact C-N 3.28Å
35	G	92.6	Very high	90.7	Very high	72 Å²	72	80.8 Å²	80.8	74%	0.742	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	2.7	175.2	0	0	0	0	0	114.1	F32 L33	F32-G35 PolarHBondContact O-N 3.47Å; F32-G35 VanDerWaalsContact O-N 3.07Å; L33-G35 PolarHBondContact O-N 3.11Å
36	L	95.6	Very high	91.2	Very high	28 Å²	28	83.8 Å²	83.8	15%	0.147	42%	0.416	C	S	.	.	S	Bend	trans	-104.9	158.7	-177.9	-54.8	-178.8	0	0	0	111.6	F32 L33 R34 L38 F48 I59	F32-L36 HydrophobicContact CD1-CD1 4.15Å; F32-L36 HydrophobicContact CE1-CD1 3.74Å; F32-L36 HydrophobicContact CE1-CD2 4.23Å; F32-L36 HydrophobicContact CE1-CG 4.32Å; F32-L36 HydrophobicContact CZ-CD1 4.46Å; F32-L36 HydrophobicContact CZ-CD2 4.15Å; L33-L36 HydrophobicContact CD2-CD1 3.9Å; L33-L36 WeakPolarHBondContact O-CB 3.43Å; L33-L36 PolarHBondContact O-N 3.17Å; R34-L36 VanDerWaalsContact C-N 3.28Å; L36-L38 PolarHBondContact O-N 3.37Å; L36-F48 HydrophobicContact CB-CB 3.88Å; L36-F48 HydrophobicContact CB-CD1 4.19Å; L36-F48 HydrophobicContact CB-CG 4.39Å; L36-F48 HydrophobicContact CD1-CB 3.85Å; L36-I59 HydrophobicContact CD1-CB 4.36Å; L36-I59 HydrophobicContact CD1-CD1 3.58Å; L36-I59 HydrophobicContact CD1-CG1 3.95Å
37	E	96.8	Very high	91.6	Very high	109 Å²	109	79.6 Å²	79.6	51%	0.509	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.5	173.7	-175.6	-167.4	158.9	0	0	109.7	V39 F48 R49	E37-V39 PolarHBondContact O-N 2.96Å; E37-F48 CarbonylContact O-C 3.43Å; E37-F48 WeakPolarHBondContact O-CA 3.33Å; E37-R49 HydrophobicContact CB-CB 4.41Å; E37-R49 PolarHBondContact N-O 3.4Å; E37-R49 PolarHBondContact O-N 3.04Å; E37-R49 IonicContact OE1-NH1 3.7Å
38	L	96.6	Very high	92.1	Very high	86 Å²	86	75.6 Å²	75.6	45%	0.45	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	112.1	171.4	178.6	67.4	0	0	0	109.4	L36 R46 F48	L36-L38 PolarHBondContact O-N 3.37Å; L38-R46 HydrophobicContact CD1-CB 3.93Å; L38-R46 HydrophobicContact CD1-CG 4.24Å; L38-F48 HydrophobicContact CB-CD1 4.23Å; L38-F48 HydrophobicContact CB-CE1 4.2Å; L38-F48 HydrophobicContact CD1-CD1 4.08Å; L38-F48 HydrophobicContact CD1-CE1 3.77Å; L38-F48 HydrophobicContact CD1-CZ 4.03Å
39	V	94.1	Very high	92.5	Very high	69 Å²	69	72.9 Å²	72.9	42%	0.418	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-45.4	179.7	-179.7	0	0	0	0	111.2	E37 V47 R49	E37-V39 PolarHBondContact O-N 2.96Å; V39-V47 PolarHBondContact N-O 3.34Å; V39-R49 HydrophobicContact CG2-CB 3.44Å; V39-R49 VanDerWaalsContact CG2-CB 3.44Å
40	K	92.4	Very high	92.9	Very high	139 Å²	139	73.2 Å²	73.2	60%	0.604	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.3	139.7	-174.8	-169.4	174.5	-178.8	179.9	0	111.2	R46 V47	K40-R46 WeakPolarHBondContact O-CA 3.41Å; K40-V47 HydrophobicContact CB-CB 4.35Å; K40-V47 PolarHBondContact N-O 3.22Å; K40-V47 PolarHBondContact O-N 2.98Å
41	Q	92.5	Very high	93.2	Very high	116 Å²	116	78.9 Å²	78.9	54%	0.542	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	115.1	168.3	-178.4	168.6	-71.1	0	0	109.5	R46	Q41-R46 HydrophobicContact CB-CG 4.37Å; Q41-R46 HydrophobicContact CG-CG 3.98Å
42	G	87.9	Confident	93.4	Very high	35 Å²	35	72.4 Å²	72.4	36%	0.361	37%	0.372	S	S	.	.			trans	-98.8	-176.2	171.6	0	0	0	0	0	112.2	E44 A45	G42-E44 VanDerWaalsContact C-N 3.3Å; G42-E44 PolarHBondContact O-N 3.35Å; G42-A45 PolarHBondContact N-O 3.33Å
43	A	85	Confident	93.5	Very high	77 Å²	77	76.9 Å²	76.9	64%	0.636	39%	0.394	S	S	*	.	S	Bend	trans	-65	-32.5	177.3	0	0	0	0	0	112.5	F63 K65	A43-F63 VanDerWaalsContact O-CZ 3.23Å; A43-F63 WeakPolarHBondContact O-CZ 3.49Å; A43-K65 WeakPolarHBondContact O-CE 3.45Å; A43-K65 PolarHBondContact O-NZ 2.96Å
44	E	83.8	Confident	93.5	Very high	58 Å²	58	79 Å²	79	27%	0.271	42%	0.418	S	S	.	.	S	Bend	trans	-118.3	-10	-173.4	-61.3	-161.4	136	0	0	114.7	G42 R62 R68 R80	G42-E44 VanDerWaalsContact C-N 3.3Å; G42-E44 PolarHBondContact O-N 3.35Å; E44-R62 WeakPolarHBondContact O-CA 3.47Å; E44-R62 IonicContact OE2-NH1 3.83Å; E44-R68 IonicContact OE1-NH2 2.81Å; E44-R68 PolarHBondContact OE1-NH2 2.93Å; E44-R80 IonicContact OE1-CZ 3.76Å; E44-R80 IonicContact OE1-NH1 2.64Å; E44-R80 PolarHBondContact OE1-NH1 2.92Å; E44-R80 IonicContact OE1-NH2 2.9Å; E44-R80 IonicContact OE2-CZ 3.77Å; E44-R80 IonicContact OE2-NH1 3.26Å; E44-R80 PolarHBondContact OE2-NH1 3.17Å
45	A	92.3	Very high	93.8	Very high	12 Å²	12	76.5 Å²	76.5	10%	0.099	41%	0.408	C	S	.	.			trans	-151.4	153.5	-176.4	0	0	0	0	0	112.3	G42 K60 H61 R62	G42-A45 PolarHBondContact N-O 3.33Å; A45-K60 HydrophobicContact CB-CG 4Å; A45-H61 CarbonylContact C-O 3.55Å; A45-H61 VanDerWaalsContact CA-O 3.22Å; A45-H61 WeakPolarHBondContact CA-O 3.32Å; A45-R62 HydrophobicContact CB-CG 4.12Å
46	R	95.1	Very high	94	Very high	82 Å²	82	73.9 Å²	73.9	31%	0.309	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.2	164.7	-68.3	177.7	-175.5	116.4	0.2	108.7	L38 K40 Q41 F48 K60 H61 F63	L38-R46 HydrophobicContact CD1-CB 3.93Å; L38-R46 HydrophobicContact CD1-CG 4.24Å; K40-R46 WeakPolarHBondContact O-CA 3.41Å; Q41-R46 HydrophobicContact CB-CG 4.37Å; Q41-R46 HydrophobicContact CG-CG 3.98Å; R46-F48 HydrophobicContact CB-CD2 4.24Å; R46-F48 HydrophobicContact CB-CE2 3.43Å; R46-F48 VanDerWaalsContact CB-CE2 3.43Å; R46-F48 HydrophobicContact CB-CZ 3.76Å; R46-F48 HydrophobicContact CG-CZ 4.47Å; R46-K60 CarbonylContact O-C 3.53Å; R46-K60 WeakPolarHBondContact O-CA 3.48Å; R46-H61 PolarHBondContact N-O 3.42Å; R46-H61 PolarHBondContact O-N 3.36Å; R46-F63 HydrophobicContact CG-CD1 4.16Å; R46-F63 HydrophobicContact CG-CE1 4.17Å
47	V	96.3	Very high	94.1	Very high	35 Å²	35	72.5 Å²	72.5	21%	0.212	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.1	177.3	-177.2	0	0	0	0	107.7	V39 K40 V58 I59 K60	V39-V47 PolarHBondContact N-O 3.34Å; K40-V47 HydrophobicContact CB-CB 4.35Å; K40-V47 PolarHBondContact N-O 3.22Å; K40-V47 PolarHBondContact O-N 2.98Å; V47-V58 HydrophobicContact CG1-CG1 3.43Å; V47-V58 VanDerWaalsContact CG1-CG1 3.43Å; V47-I59 WeakPolarHBondContact CA-O 3.13Å; V47-K60 HydrophobicContact CG2-CG 4.41Å
48	F	97.5	Very high	94.2	Very high	20 Å²	20	68.8 Å²	68.8	9%	0.088	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	151.3	179.6	-58.1	-93.6	0	0	0	110.5	L33 L36 E37 L38 R46 V58 I59 H61	L33-F48 HydrophobicContact CB-CE2 4.49Å; L33-F48 HydrophobicContact CB-CZ 4.41Å; L33-F48 HydrophobicContact CD1-CE2 4.27Å; L33-F48 HydrophobicContact CD2-CD2 3.89Å; L33-F48 HydrophobicContact CD2-CE2 4.19Å; L33-F48 HydrophobicContact CD2-CG 4.32Å; L36-F48 HydrophobicContact CB-CB 3.88Å; L36-F48 HydrophobicContact CB-CD1 4.19Å; L36-F48 HydrophobicContact CB-CG 4.39Å; L36-F48 HydrophobicContact CD1-CB 3.85Å; E37-F48 CarbonylContact O-C 3.43Å; E37-F48 WeakPolarHBondContact O-CA 3.33Å; L38-F48 HydrophobicContact CB-CD1 4.23Å; L38-F48 HydrophobicContact CB-CE1 4.2Å; L38-F48 HydrophobicContact CD1-CD1 4.08Å; L38-F48 HydrophobicContact CD1-CE1 3.77Å; L38-F48 HydrophobicContact CD1-CZ 4.03Å; R46-F48 HydrophobicContact CB-CD2 4.24Å; R46-F48 HydrophobicContact CB-CE2 3.43Å; R46-F48 VanDerWaalsContact CB-CE2 3.43Å; R46-F48 HydrophobicContact CB-CZ 3.76Å; R46-F48 HydrophobicContact CG-CZ 4.47Å; F48-V58 CarbonylContact O-C 3.54Å; F48-V58 VanDerWaalsContact O-CA 3.29Å; F48-V58 WeakPolarHBondContact O-CA 3.44Å; F48-I59 HydrophobicContact CB-CB 4.34Å; F48-I59 PolarHBondContact N-O 2.84Å; F48-I59 PolarHBondContact O-N 2.69Å; F48-H61 HydrophobicContact CD2-CB 4.43Å; F48-H61 HydrophobicContact CE2-CB 3.93Å
49	R	97.3	Very high	94.2	Very high	95 Å²	95	64.7 Å²	64.7	36%	0.358	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	142.6	173.1	172.6	-173.8	-75	151.4	-9.1	109.7	E37 V39 E115	E37-R49 HydrophobicContact CB-CB 4.41Å; E37-R49 PolarHBondContact N-O 3.4Å; E37-R49 PolarHBondContact O-N 3.04Å; E37-R49 IonicContact OE1-NH1 3.7Å; V39-R49 HydrophobicContact CG2-CB 3.44Å; V39-R49 VanDerWaalsContact CG2-CB 3.44Å; R49-E115 WeakPolarHBondContact CD-OE1 3.26Å; R49-E115 IonicContact CZ-OE1 3.47Å; R49-E115 IonicContact NE-OE1 3.66Å; R49-E115 PolarHBondContact NE-OE1 3.42Å; R49-E115 IonicContact NH2-OE1 2.7Å
50	G	96.6	Very high	94.3	Very high	23 Å²	23	62 Å²	62	24%	0.237	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.4	-144.6	170.8	0	0	0	0	0	111.8	A57	G50-A57 PolarHBondContact N-O 3.07Å; G50-A57 PolarHBondContact O-N 3.09Å
51	R	96.4	Very high	94.4	Very high	164 Å²	164	57.1 Å²	57.1	62%	0.619	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.7	178.2	-69.4	-174.3	178	-94	-5.8	111.8	G54 R55	R51-G54 PolarHBondContact NH1-O 3.31Å; R51-R55 CarbonylContact C-O 3.54Å; R51-R55 WeakPolarHBondContact CA-O 3.24Å
52	F	96	Very high	94.4	Very high	29 Å²	29	52.6 Å²	52.6	13%	0.127	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.3	170.6	-177.2	-105.2	0	0	0	109.1	F32 G54 R55 A57 F102 F103 Y112	F32-F52 HydrophobicContact CE1-CD2 4.41Å; F32-F52 HydrophobicContact CZ-CD2 4.13Å; F52-G54 PolarHBondContact O-N 2.89Å; F52-R55 PolarHBondContact N-O 3.41Å; F52-R55 PolarHBondContact O-N 2.99Å; F52-A57 HydrophobicContact CB-CB 3.72Å; F52-F102 HydrophobicContact CD1-CB 3.9Å; F52-F102 HydrophobicContact CD1-CD2 4.24Å; F52-F102 HydrophobicContact CD1-CG 4.5Å; F52-F102 HydrophobicContact CE1-CB 4.1Å; F52-F103 HydrophobicContact CE1-CB 3.77Å; F52-F103 HydrophobicContact CZ-CB 3.73Å; F52-F103 HydrophobicContact CZ-CD1 4.07Å; F52-F103 HydrophobicContact CZ-CG 4.1Å; F52-Y112 HydrophobicContact CB-CD1 4.41Å; F52-Y112 AromaticContact CD2-CD1 3.51Å; F52-Y112 HydrophobicContact CD2-CD1 3.51Å; F52-Y112 AromaticContact CD2-CE1 3.79Å; F52-Y112 HydrophobicContact CD2-CE1 3.79Å; F52-Y112 HydrophobicContact CD2-CG 4.43Å; F52-Y112 AromaticContact CE2-CD1 3.81Å; F52-Y112 HydrophobicContact CE2-CD1 3.81Å; F52-Y112 AromaticContact CE2-CE1 3.92Å; F52-Y112 HydrophobicContact CE2-CE1 3.92Å; F52-Y112 HydrophobicContact CE2-CG 4.46Å; F52-Y112 AromaticContact CG-CD1 3.9Å; F52-Y112 HydrophobicContact CG-CD1 3.9Å; F52-Y112 HydrophobicContact CZ-CD1 4.43Å
53	Q	93.7	Very high	94.5	Very high	170 Å²	170	52.7 Å²	52.7	79%	0.794	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	44.8	-174.7	-59.2	-175.6	-1	0	0	113	R55	Q53-R55 VanDerWaalsContact C-N 3.26Å; Q53-R55 PolarHBondContact O-N 3.36Å
54	G	94.3	Very high	94.6	Very high	53 Å²	53	53.2 Å²	53.2	55%	0.546	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-8.7	179.5	0	0	0	0	0	115.6	R51 F52	R51-G54 PolarHBondContact NH1-O 3.31Å; F52-G54 PolarHBondContact O-N 2.89Å
55	R	96.5	Very high	94.7	Very high	134 Å²	134	52.8 Å²	52.8	51%	0.506	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	143.1	-177.4	-57.7	172.6	66.6	-176.5	3.8	111.5	R51 F52 Q53 A57 F102	R51-R55 CarbonylContact C-O 3.54Å; R51-R55 WeakPolarHBondContact CA-O 3.24Å; F52-R55 PolarHBondContact N-O 3.41Å; F52-R55 PolarHBondContact O-N 2.99Å; Q53-R55 VanDerWaalsContact C-N 3.26Å; Q53-R55 PolarHBondContact O-N 3.36Å; R55-A57 PolarHBondContact O-N 3.25Å; R55-F102 HydrophobicContact CB-CE2 4.19Å; R55-F102 HydrophobicContact CB-CZ 4.41Å
56	A	97.6	Very high	94.5	Very high	17 Å²	17	56.4 Å²	56.4	14%	0.14	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	128.7	172.6	0	0	0	0	0	110.2	F102 E115 E117	A56-F102 WeakPolarHBondContact O-CE2 3.42Å; A56-E115 HydrophobicContact CB-CB 4.04Å; A56-E115 PolarHBondContact O-N 2.67Å; A56-E117 HydrophobicContact CB-CG 4.12Å
57	A	98.1	Very high	94.1	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	143.8	-168	0	0	0	0	0	112.8	G50 F52 R55 I59 F102 M113	G50-A57 PolarHBondContact N-O 3.07Å; G50-A57 PolarHBondContact O-N 3.09Å; F52-A57 HydrophobicContact CB-CB 3.72Å; R55-A57 PolarHBondContact O-N 3.25Å; A57-I59 HydrophobicContact CB-CD1 4.06Å; A57-F102 HydrophobicContact CB-CD2 4.14Å; A57-F102 HydrophobicContact CB-CE2 3.99Å; A57-M113 CarbonylContact C-O 3.47Å; A57-M113 VanDerWaalsContact CA-O 3.27Å; A57-M113 WeakPolarHBondContact CA-O 3.01Å
58	V	97.7	Very high	93.8	Very high	31 Å²	31	61.2 Å²	61.2	19%	0.188	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.5	165	174.7	0	0	0	0	108.6	V47 F48 M113 E115	V47-V58 HydrophobicContact CG1-CG1 3.43Å; V47-V58 VanDerWaalsContact CG1-CG1 3.43Å; F48-V58 CarbonylContact O-C 3.54Å; F48-V58 VanDerWaalsContact O-CA 3.29Å; F48-V58 WeakPolarHBondContact O-CA 3.44Å; V58-M113 HydrophobicContact CB-CG 4.07Å; V58-M113 HydrophobicContact CG1-CG 4.47Å; V58-M113 PolarHBondContact N-O 2.86Å; V58-M113 WeakPolarHBondContact O-CG 3.23Å; V58-M113 PolarHBondContact O-N 2.86Å; V58-E115 HydrophobicContact CG2-CB 4.02Å; V58-E115 HydrophobicContact CG2-CG 4.18Å
59	I	97.4	Very high	93.6	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.7	179.4	-52.9	72.7	0	0	0	108.8	L33 L36 V47 F48 A57 C110 L111 Y112	L33-I59 HydrophobicContact CD2-CB 4.14Å; L33-I59 HydrophobicContact CD2-CG2 3.61Å; L36-I59 HydrophobicContact CD1-CB 4.36Å; L36-I59 HydrophobicContact CD1-CD1 3.58Å; L36-I59 HydrophobicContact CD1-CG1 3.95Å; V47-I59 WeakPolarHBondContact CA-O 3.13Å; F48-I59 HydrophobicContact CB-CB 4.34Å; F48-I59 PolarHBondContact N-O 2.84Å; F48-I59 PolarHBondContact O-N 2.69Å; A57-I59 HydrophobicContact CB-CD1 4.06Å; I59-C110 HydrophobicContact CG2-CB 4.22Å; I59-L111 WeakPolarHBondContact CA-O 3.27Å; I59-Y112 HydrophobicContact CB-CD1 4.3Å; I59-Y112 HydrophobicContact CB-CE1 4.44Å; I59-Y112 HydrophobicContact CD1-CD1 4.48Å; I59-Y112 HydrophobicContact CG1-CD1 3.39Å; I59-Y112 HydrophobicContact CG1-CE1 3.69Å; I59-Y112 HydrophobicContact CG1-CG 4.13Å; I59-Y112 HydrophobicContact CG2-CD1 3.93Å; I59-Y112 HydrophobicContact CG2-CD2 4.31Å; I59-Y112 HydrophobicContact CG2-CE1 3.81Å; I59-Y112 HydrophobicContact CG2-CE2 4.2Å; I59-Y112 HydrophobicContact CG2-CG 4.16Å
60	K	96.2	Very high	93.2	Very high	13 Å²	13	66.8 Å²	66.8	6%	0.057	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	109.1	175.6	-173.3	172.2	-177.5	170.8	0	109.5	A45 R46 V47 E84 C110 L111 M113 D183	A45-K60 HydrophobicContact CB-CG 4Å; R46-K60 CarbonylContact O-C 3.53Å; R46-K60 WeakPolarHBondContact O-CA 3.48Å; V47-K60 HydrophobicContact CG2-CG 4.41Å; K60-E84 WeakPolarHBondContact CD-OE1 3.36Å; K60-E84 WeakPolarHBondContact CE-OE1 3.46Å; K60-E84 IonicContact NZ-OE1 3.83Å; K60-E84 PolarHBondContact NZ-OE1 3.15Å; K60-E84 IonicContact NZ-OE2 3.27Å; K60-C110 CarbonylContact O-C 3.58Å; K60-C110 WeakPolarHBondContact O-CA 3.32Å; K60-L111 HydrophobicContact CB-CB 4.48Å; K60-L111 PolarHBondContact N-O 3.45Å; K60-L111 PolarHBondContact O-N 3.34Å; K60-M113 HydrophobicContact CB-CE 3.76Å; K60-M113 HydrophobicContact CD-CE 4.43Å; K60-D183 IonicContact NZ-OD1 3.84Å; K60-D183 PolarHBondContact NZ-OD1 3.32Å; K60-D183 IonicContact NZ-OD2 3.9Å; K60-D183 PolarHBondContact NZ-OD2 2.84Å
61	H	95.1	Very high	92.8	Very high	36 Å²	36	68.8 Å²	68.8	17%	0.167	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	115.3	177.6	175.1	-158.4	0	0	0	110.2	L33 A45 R46 F48 S108 C110	L33-H61 HydrophobicContact CD1-CB 3.89Å; L33-H61 WeakPolarHBondContact CD1-ND1 3.44Å; A45-H61 CarbonylContact C-O 3.55Å; A45-H61 VanDerWaalsContact CA-O 3.22Å; A45-H61 WeakPolarHBondContact CA-O 3.32Å; R46-H61 PolarHBondContact N-O 3.42Å; R46-H61 PolarHBondContact O-N 3.36Å; F48-H61 HydrophobicContact CD2-CB 4.43Å; F48-H61 HydrophobicContact CE2-CB 3.93Å; H61-S108 PolarHBondContact CD2-O 2.96Å; H61-S108 PolarHBondContact NE2-O 2.8Å; H61-C110 PolarHBondContact CD2-SG 3.4Å; H61-C110 VanDerWaalsContact CG-SG 3.6Å
62	R	92	Very high	92.5	Very high	21 Å²	21	64.2 Å²	64.2	8%	0.079	36%	0.355	C	S	.	.			trans	-89.2	106.8	173.7	-67.4	177.3	176.6	-81.9	0.8	109.7	E44 A45 E84 N109	E44-R62 WeakPolarHBondContact O-CA 3.47Å; E44-R62 IonicContact OE2-NH1 3.83Å; A45-R62 HydrophobicContact CB-CG 4.12Å; R62-E84 IonicContact CZ-OE2 2.94Å; R62-E84 IonicContact NE-OE2 3.97Å; R62-E84 PolarHBondContact NE-OE2 3.01Å; R62-E84 IonicContact NH2-OE2 2.71Å; R62-E84 PolarHBondContact NH2-OE2 2.98Å; R62-N109 HydrophobicContact CB-CB 4.09Å; R62-N109 PolarHBondContact N-O 2.95Å; R62-N109 WeakPolarHBondContact O-CB 3.46Å
63	F	89.3	Confident	92.1	Very high	36 Å²	36	63.7 Å²	63.7	16%	0.158	35%	0.353	C	S	.	.			trans	-84.3	145.1	-178	55.9	-92.9	0	0	0	111.3	A43 R46 K65	A43-F63 VanDerWaalsContact O-CZ 3.23Å; A43-F63 WeakPolarHBondContact O-CZ 3.49Å; R46-F63 HydrophobicContact CG-CD1 4.16Å; R46-F63 HydrophobicContact CG-CE1 4.17Å; F63-K65 HydrophobicContact CE2-CD 4.28Å
64	P	87.8	Confident	91.8	Very high	89 Å²	89	58.2 Å²	58.2	58%	0.578	34%	0.337	S	S	*	.			trans	-67	145.7	-178	27	-34	0	0	0	112	E73	P64-E73 VanDerWaalsContact CA-OE1 3.23Å; P64-E73 WeakPolarHBondContact CA-OE1 3.39Å; P64-E73 HydrophobicContact CB-CG 3.83Å
65	K	86.5	Confident	91.5	Very high	49 Å²	49	64.1 Å²	64.1	21%	0.213	34%	0.343	C	S	.	.			trans	-95.2	115.8	172	-68.7	-58.1	-169	167.1	0	111.6	A43 F63 Y67 R68 E73	A43-K65 WeakPolarHBondContact O-CE 3.45Å; A43-K65 PolarHBondContact O-NZ 2.96Å; F63-K65 HydrophobicContact CE2-CD 4.28Å; K65-Y67 HydrophobicContact CB-CD1 3.79Å; K65-Y67 HydrophobicContact CB-CE1 3.44Å; K65-Y67 VanDerWaalsContact CB-CE1 3.44Å; K65-Y67 HydrophobicContact CD-CD1 4.5Å; K65-Y67 HydrophobicContact CD-CE1 3.81Å; K65-Y67 HydrophobicContact CG-CD1 4.43Å; K65-Y67 HydrophobicContact CG-CE1 3.66Å; K65-Y67 PolarHBondContact O-N 3.44Å; K65-R68 HydrophobicContact CB-CG 4.21Å; K65-R68 PolarHBondContact O-N 3.24Å; K65-E73 PolarHBondContact N-OE1 3.02Å
66	G	86.8	Confident	91.1	Very high	88 Å²	88	60 Å²	60	91%	0.907	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-17	-176.9	0	0	0	0	0	115.6	R68	G66-R68 VanDerWaalsContact C-N 3.34Å
67	Y	87.8	Confident	90.6	Very high	174 Å²	174	59.4 Å²	59.4	68%	0.682	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-9.4	175.8	68.5	-98.1	0	0	0	113.8	K65	K65-Y67 HydrophobicContact CB-CD1 3.79Å; K65-Y67 HydrophobicContact CB-CE1 3.44Å; K65-Y67 VanDerWaalsContact CB-CE1 3.44Å; K65-Y67 HydrophobicContact CD-CD1 4.5Å; K65-Y67 HydrophobicContact CD-CE1 3.81Å; K65-Y67 HydrophobicContact CG-CD1 4.43Å; K65-Y67 HydrophobicContact CG-CE1 3.66Å; K65-Y67 PolarHBondContact O-N 3.44Å
68	R	90.5	Very high	90	Very high	44 Å²	44	66.6 Å²	66.6	17%	0.166	35%	0.354	C	S	.	.	S	Bend	trans	-99.1	144.1	-179.4	-63.1	172.7	-170.8	156.9	1.3	110.1	E44 K65 G66 E73	E44-R68 IonicContact OE1-NH2 2.81Å; E44-R68 PolarHBondContact OE1-NH2 2.93Å; K65-R68 HydrophobicContact CB-CG 4.21Å; K65-R68 PolarHBondContact O-N 3.24Å; G66-R68 VanDerWaalsContact C-N 3.34Å; R68-E73 HydrophobicContact CB-CB 4.3Å; R68-E73 WeakPolarHBondContact CD-OE2 3.47Å; R68-E73 IonicContact CZ-OE2 3.7Å; R68-E73 IonicContact NE-OE2 3.74Å; R68-E73 IonicContact NH1-OE1 3.23Å; R68-E73 PolarHBondContact NH1-OE1 2.7Å; R68-E73 IonicContact NH1-OE2 2.84Å; R68-E73 PolarHBondContact NH1-OE2 2.79Å
69	H	92.6	Very high	89.7	Confident	131 Å²	131	73.3 Å²	73.3	61%	0.606	38%	0.376	S	S	*	.			trans	-56.5	133.2	174.9	-172.8	-84.4	0	0	0	110.9	A71 L72 E73	H69-A71 VanDerWaalsContact C-N 3.32Å; H69-A71 PolarHBondContact ND1-N 3.14Å; H69-A71 PolarHBondContact O-N 2.87Å; H69-L72 HydrophobicContact CB-CB 4.28Å; H69-L72 WeakPolarHBondContact O-CA 3.35Å; H69-L72 WeakPolarHBondContact O-CB 3.38Å; H69-L72 PolarHBondContact O-N 2.99Å; H69-E73 PolarHBondContact O-N 3.45Å
70	P	88.6	Confident	89.3	Confident	101 Å²	101	76.3 Å²	76.3	66%	0.656	39%	0.387	S	S	*	.	H	α-helix	trans	-53	-43	-172.9	-29.9	35.3	0	0	0	114.6	L72 E73 A74	P70-L72 PolarHBondContact O-N 3.37Å; P70-E73 PolarHBondContact O-N 2.91Å; P70-A74 WeakPolarHBondContact O-CB 3.33Å; P70-A74 PolarHBondContact O-N 2.88Å
71	A	88.9	Confident	89.1	Confident	65 Å²	65	75.7 Å²	75.7	54%	0.537	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-37.4	177.5	0	0	0	0	0	113	H69 R75	H69-A71 VanDerWaalsContact C-N 3.32Å; H69-A71 PolarHBondContact ND1-N 3.14Å; H69-A71 PolarHBondContact O-N 2.87Å; A71-R75 WeakPolarHBondContact O-CB 3.48Å; A71-R75 PolarHBondContact O-N 3.47Å
72	L	88.8	Confident	89	Confident	67 Å²	67	75.1 Å²	75.1	35%	0.351	38%	0.384	S	S	.	.	H	α-helix	trans	-67.7	-42.8	175.5	178.4	65	0	0	0	110.1	H69 P70 R75 L76	H69-L72 HydrophobicContact CB-CB 4.28Å; H69-L72 WeakPolarHBondContact O-CA 3.35Å; H69-L72 WeakPolarHBondContact O-CB 3.38Å; H69-L72 PolarHBondContact O-N 2.99Å; P70-L72 PolarHBondContact O-N 3.37Å; L72-R75 PolarHBondContact O-N 3.37Å; L72-L76 HydrophobicContact CD1-CD1 4.01Å; L72-L76 HydrophobicContact CD1-CG 4.04Å; L72-L76 HydrophobicContact CD2-CD1 4.28Å; L72-L76 HydrophobicContact CG-CD1 3.76Å; L72-L76 HydrophobicContact CG-CG 4.21Å; L72-L76 WeakPolarHBondContact O-CB 3.37Å; L72-L76 VanDerWaalsContact O-CG 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3.28Å
73	E	88.9	Confident	89	Confident	18 Å²	18	76.8 Å²	76.8	8%	0.084	39%	0.392	C	S	.	.	H	α-helix	trans	-67.1	-42.8	-178.4	-172.9	62.9	172.6	0	0	112.3	P64 K65 R68 H69 P70 R75 L76 G77	P64-E73 VanDerWaalsContact CA-OE1 3.23Å; P64-E73 WeakPolarHBondContact CA-OE1 3.39Å; P64-E73 HydrophobicContact CB-CG 3.83Å; K65-E73 PolarHBondContact N-OE1 3.02Å; R68-E73 HydrophobicContact CB-CB 4.3Å; R68-E73 WeakPolarHBondContact CD-OE2 3.47Å; R68-E73 IonicContact CZ-OE2 3.7Å; R68-E73 IonicContact NE-OE2 3.74Å; R68-E73 IonicContact NH1-OE1 3.23Å; R68-E73 PolarHBondContact NH1-OE1 2.7Å; R68-E73 IonicContact NH1-OE2 2.84Å; R68-E73 PolarHBondContact NH1-OE2 2.79Å; H69-E73 PolarHBondContact O-N 3.45Å; P70-E73 PolarHBondContact O-N 2.91Å; E73-R75 VanDerWaalsContact C-N 3.3Å; E73-R75 PolarHBondContact O-N 2.97Å; E73-L76 PolarHBondContact O-N 2.94Å; E73-G77 PolarHBondContact O-N 3.44Å
74	A	85.9	Confident	89.3	Confident	56 Å²	56	75.2 Å²	75.2	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-57.9	-44.4	173.4	0	0	0	0	0	111.4	P70 R78	P70-A74 WeakPolarHBondContact O-CB 3.33Å; P70-A74 PolarHBondContact O-N 2.88Å; A74-R78 WeakPolarHBondContact O-CB 3.31Å; A74-R78 PolarHBondContact O-N 3.23Å; A74-R78 VanDerWaalsContact O-N 3.16Å
75	R	88.6	Confident	89.7	Confident	177 Å²	177	71.7 Å²	71.7	67%	0.668	36%	0.363	S	S	*	.	H	α-helix	trans	-66.5	-44.6	178.3	-171.7	173.9	67	169.5	-0	112.3	A71 L72 E73 R79	A71-R75 WeakPolarHBondContact O-CB 3.48Å; A71-R75 PolarHBondContact O-N 3.47Å; L72-R75 PolarHBondContact O-N 3.37Å; E73-R75 VanDerWaalsContact C-N 3.3Å; E73-R75 PolarHBondContact O-N 2.97Å; R75-R79 VanDerWaalsContact O-CB 3.25Å; R75-R79 WeakPolarHBondContact O-CB 3.27Å; R75-R79 PolarHBondContact O-N 2.82Å
76	L	87.9	Confident	90.2	Very high	46 Å²	46	78 Å²	78	24%	0.241	39%	0.386	C	S	.	.	H	α-helix	trans	-66.7	-47.8	179.7	-75.7	175.3	0	0	0	111.8	L72 E73 R78 R79 R80	L72-L76 HydrophobicContact CD1-CD1 4.01Å; L72-L76 HydrophobicContact CD1-CG 4.04Å; L72-L76 HydrophobicContact CD2-CD1 4.28Å; L72-L76 HydrophobicContact CG-CD1 3.76Å; L72-L76 HydrophobicContact CG-CG 4.21Å; L72-L76 WeakPolarHBondContact O-CB 3.37Å; L72-L76 VanDerWaalsContact O-CG 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3.28Å; E73-L76 PolarHBondContact O-N 2.94Å; L76-R78 PolarHBondContact O-N 2.98Å; L76-R79 PolarHBondContact O-N 3.1Å; L76-R80 WeakPolarHBondContact O-CB 3.48Å; L76-R80 WeakPolarHBondContact O-CG 3.38Å; L76-R80 PolarHBondContact O-N 2.8Å
77	G	86.6	Confident	90.7	Very high	6 Å²	6	74 Å²	74	6%	0.062	34%	0.344	C	S	.	.	H	α-helix	trans	-57.5	-48.4	179.1	0	0	0	0	0	111.9	E73 T81	E73-G77 PolarHBondContact O-N 3.44Å; G77-T81 WeakPolarHBondContact O-CB 3.46Å; G77-T81 PolarHBondContact O-N 3.09Å; G77-T81 PolarHBondContact O-OG1 2.97Å
78	R	87.3	Confident	91.2	Very high	151 Å²	151	65.8 Å²	65.8	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-62.4	-49.5	176.5	-172.6	176.9	-177.5	-176.2	1.2	111.6	A74 L76 R80 T81 V82 Y106 N109	A74-R78 WeakPolarHBondContact O-CB 3.31Å; A74-R78 PolarHBondContact O-N 3.23Å; A74-R78 VanDerWaalsContact O-N 3.16Å; L76-R78 PolarHBondContact O-N 2.98Å; R78-R80 PolarHBondContact O-N 3.28Å; R78-T81 PolarHBondContact O-N 3.05Å; R78-V82 HydrophobicContact CG-CG2 4.39Å; R78-V82 WeakPolarHBondContact O-CB 3.31Å; R78-V82 VanDerWaalsContact O-CG2 3.24Å; R78-V82 WeakPolarHBondContact O-CG2 3.25Å; R78-V82 PolarHBondContact O-N 3.32Å; R78-Y106 HydrophobicContact CG-CD1 4.11Å; R78-N109 PolarHBondContact N-OD1 3.25Å
79	R	89.6	Confident	91.5	Very high	171 Å²	171	67.8 Å²	67.8	65%	0.645	33%	0.326	S	S	*	.	H	α-helix	trans	-58.7	-47.1	-178.6	-179.2	177.2	171.9	176.4	-0.9	111.7	R75 L76 V82 Q83	R75-R79 VanDerWaalsContact O-CB 3.25Å; R75-R79 WeakPolarHBondContact O-CB 3.27Å; R75-R79 PolarHBondContact O-N 2.82Å; L76-R79 PolarHBondContact O-N 3.1Å; R79-V82 PolarHBondContact O-N 3.25Å; R79-Q83 WeakPolarHBondContact O-CB 3.25Å; R79-Q83 PolarHBondContact O-N 2.66Å
80	R	90.4	Very high	91.8	Very high	63 Å²	63	65.7 Å²	65.7	24%	0.238	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-45	-179.4	-73	179.1	174.8	-174.5	-2	112	E44 L76 R78 V82 Q83 E84	E44-R80 IonicContact OE1-CZ 3.76Å; E44-R80 IonicContact OE1-NH1 2.64Å; E44-R80 PolarHBondContact OE1-NH1 2.92Å; E44-R80 IonicContact OE1-NH2 2.9Å; E44-R80 IonicContact OE2-CZ 3.77Å; E44-R80 IonicContact OE2-NH1 3.26Å; E44-R80 PolarHBondContact OE2-NH1 3.17Å; L76-R80 WeakPolarHBondContact O-CB 3.48Å; L76-R80 WeakPolarHBondContact O-CG 3.38Å; L76-R80 PolarHBondContact O-N 2.8Å; R78-R80 PolarHBondContact O-N 3.28Å; R80-V82 PolarHBondContact O-N 3.15Å; R80-Q83 PolarHBondContact O-N 3.28Å; R80-E84 WeakPolarHBondContact O-CB 3.46Å; R80-E84 PolarHBondContact O-N 3.38Å
81	T	91.8	Very high	92.1	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-43.2	177.9	-49.9	0	0	0	0	111.6	G77 R78 A85 V104 L111	G77-T81 WeakPolarHBondContact O-CB 3.46Å; G77-T81 PolarHBondContact O-N 3.09Å; G77-T81 PolarHBondContact O-OG1 2.97Å; R78-T81 PolarHBondContact O-N 3.05Å; T81-A85 PolarHBondContact O-N 3.31Å; T81-A85 VanDerWaalsContact O-N 3.15Å; T81-V104 HydrophobicContact CG2-CG1 3.61Å; T81-L111 HydrophobicContact CG2-CB 4.27Å
82	V	91.6	Very high	92.6	Very high	24 Å²	24	63.2 Å²	63.2	15%	0.145	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-44.4	175.5	172.2	0	0	0	0	111.5	R78 R79 R80 A85 R86 Y106	R78-V82 HydrophobicContact CG-CG2 4.39Å; R78-V82 WeakPolarHBondContact O-CB 3.31Å; R78-V82 VanDerWaalsContact O-CG2 3.24Å; R78-V82 WeakPolarHBondContact O-CG2 3.25Å; R78-V82 PolarHBondContact O-N 3.32Å; R79-V82 PolarHBondContact O-N 3.25Å; R80-V82 PolarHBondContact O-N 3.15Å; V82-A85 PolarHBondContact O-N 3.45Å; V82-R86 HydrophobicContact CG1-CG 4.32Å; V82-R86 WeakPolarHBondContact O-CB 3.45Å; V82-R86 VanDerWaalsContact O-CG 3.3Å; V82-R86 WeakPolarHBondContact O-CG 3.38Å; V82-R86 PolarHBondContact O-N 2.94Å; V82-Y106 HydrophobicContact CG2-CD1 4.05Å; V82-Y106 HydrophobicContact CG2-CE1 3.3Å
83	Q	93.1	Very high	92.9	Very high	56 Å²	56	69.8 Å²	69.8	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-45.5	-177.9	-177.5	166.1	18.8	0	0	111.5	R79 R80 R86 A87 S187	R79-Q83 WeakPolarHBondContact O-CB 3.25Å; R79-Q83 PolarHBondContact O-N 2.66Å; R80-Q83 PolarHBondContact O-N 3.28Å; Q83-R86 PolarHBondContact O-N 3.33Å; Q83-A87 WeakPolarHBondContact O-CB 3.27Å; Q83-A87 PolarHBondContact O-N 3.35Å; Q83-S187 WeakPolarHBondContact CG-O 3.2Å; Q83-S187 PolarHBondContact NE2-O 3.2Å
84	E	95.4	Very high	93.3	Very high	3 Å²	3	69.9 Å²	69.9	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-46.5	176.5	-173.3	168.9	-171.6	0	0	111.7	K60 R62 R80 R86 A87 L88 L111 F184	K60-E84 WeakPolarHBondContact CD-OE1 3.36Å; K60-E84 WeakPolarHBondContact CE-OE1 3.46Å; K60-E84 IonicContact NZ-OE1 3.83Å; K60-E84 PolarHBondContact NZ-OE1 3.15Å; K60-E84 IonicContact NZ-OE2 3.27Å; R62-E84 IonicContact CZ-OE2 2.94Å; R62-E84 IonicContact NE-OE2 3.97Å; R62-E84 PolarHBondContact NE-OE2 3.01Å; R62-E84 IonicContact NH2-OE2 2.71Å; R62-E84 PolarHBondContact NH2-OE2 2.98Å; R80-E84 WeakPolarHBondContact O-CB 3.46Å; R80-E84 PolarHBondContact O-N 3.38Å; E84-R86 VanDerWaalsContact C-N 3.33Å; E84-R86 PolarHBondContact O-N 3.08Å; E84-A87 PolarHBondContact O-N 3.26Å; E84-L88 WeakPolarHBondContact O-CG 3.22Å; E84-L88 PolarHBondContact O-N 3.03Å; E84-L111 HydrophobicContact CB-CD2 4.2Å; E84-L111 HydrophobicContact CG-CD2 3.68Å; E84-F184 HydrophobicContact CG-CB 4.12Å
85	A	96.8	Very high	93.8	Very high	14 Å²	14	69.5 Å²	69.5	12%	0.116	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-40.5	176.2	0	0	0	0	0	112.6	T81 V82 L89 V101 V104 L111	T81-A85 PolarHBondContact O-N 3.31Å; T81-A85 VanDerWaalsContact O-N 3.15Å; V82-A85 PolarHBondContact O-N 3.45Å; A85-L89 PolarHBondContact O-N 2.75Å; A85-L89 VanDerWaalsContact O-N 3.14Å; A85-V101 HydrophobicContact CB-CG2 4.4Å; A85-V104 HydrophobicContact CB-CG2 3.92Å; A85-L111 HydrophobicContact CB-CD1 3.9Å
86	R	96.4	Very high	94.2	Very high	182 Å²	182	61.3 Å²	61.3	69%	0.687	27%	0.271	S	S	*	.	H	α-helix	trans	-68.2	-38.5	177.3	-75	177	179.2	179.9	0.1	112.3	V82 Q83 E84 L89 R90	V82-R86 HydrophobicContact CG1-CG 4.32Å; V82-R86 WeakPolarHBondContact O-CB 3.45Å; V82-R86 VanDerWaalsContact O-CG 3.3Å; V82-R86 WeakPolarHBondContact O-CG 3.38Å; V82-R86 PolarHBondContact O-N 2.94Å; Q83-R86 PolarHBondContact O-N 3.33Å; E84-R86 VanDerWaalsContact C-N 3.33Å; E84-R86 PolarHBondContact O-N 3.08Å; R86-L89 PolarHBondContact O-N 3.45Å; R86-R90 WeakPolarHBondContact O-CB 3.41Å; R86-R90 PolarHBondContact O-N 3.43Å
87	A	97.7	Very high	94.7	Very high	3 Å²	3	62 Å²	62	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-46.6	177	0	0	0	0	0	111.4	Q83 E84 L89 R90 C91 L158 F184 S187	Q83-A87 WeakPolarHBondContact O-CB 3.27Å; Q83-A87 PolarHBondContact O-N 3.35Å; E84-A87 PolarHBondContact O-N 3.26Å; A87-L89 VanDerWaalsContact C-N 3.34Å; A87-L89 PolarHBondContact O-N 2.98Å; A87-R90 WeakPolarHBondContact O-CB 3.37Å; A87-R90 PolarHBondContact O-N 3.37Å; A87-R90 VanDerWaalsContact O-N 3.12Å; A87-C91 PolarHBondContact O-N 3.28Å; A87-L158 HydrophobicContact CB-CD1 3.97Å; A87-F184 HydrophobicContact CB-CB 3.58Å; A87-F184 HydrophobicContact CB-CD1 3.77Å; A87-F184 HydrophobicContact CB-CG 3.74Å; A87-S187 VanDerWaalsContact CB-OG 3.27Å; A87-S187 WeakPolarHBondContact CB-OG 3.38Å
88	L	97.9	Very high	95.2	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-55.4	-47.9	173.8	-71.9	170.9	0	0	0	111.8	E84 R90 C91 R92 A98 V101 L111 M113 F184	E84-L88 WeakPolarHBondContact O-CG 3.22Å; E84-L88 PolarHBondContact O-N 3.03Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 2.98Å; L88-C91 PolarHBondContact O-N 3.4Å; L88-R92 WeakPolarHBondContact O-CG 3.47Å; L88-R92 PolarHBondContact O-N 3.41Å; L88-R92 VanDerWaalsContact O-N 3.1Å; L88-A98 HydrophobicContact CD2-CB 3.89Å; L88-V101 HydrophobicContact CB-CG2 4.06Å; L88-V101 HydrophobicContact CD1-CG2 3.65Å; L88-L111 HydrophobicContact CD1-CD2 4.07Å; L88-M113 HydrophobicContact CD1-SD 4.42Å; L88-F184 HydrophobicContact CD2-CD2 3.59Å; L88-F184 HydrophobicContact CD2-CE2 3.93Å; L88-F184 HydrophobicContact CG-CD2 4.1Å
89	L	97.1	Very high	95.7	Very high	87 Å²	87	54.8 Å²	54.8	46%	0.455	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-39.8	177.5	-179.7	61.3	0	0	0	112.2	A85 R86 A87 R92 R93	A85-L89 PolarHBondContact O-N 2.75Å; A85-L89 VanDerWaalsContact O-N 3.14Å; R86-L89 PolarHBondContact O-N 3.45Å; A87-L89 VanDerWaalsContact C-N 3.34Å; A87-L89 PolarHBondContact O-N 2.98Å; L89-R92 PolarHBondContact O-N 3.09Å; L89-R93 HydrophobicContact CD1-CG 4.46Å; L89-R93 WeakPolarHBondContact O-CG 3.49Å; L89-R93 PolarHBondContact O-N 3.28Å
90	R	97.5	Very high	96.1	Very high	86 Å²	86	48.6 Å²	48.6	33%	0.325	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-45.3	178.1	-170.8	174.2	-173.1	135.8	-0.2	111.4	R86 A87 L88 R92 R93 A94 E156 I189	R86-R90 WeakPolarHBondContact O-CB 3.41Å; R86-R90 PolarHBondContact O-N 3.43Å; A87-R90 WeakPolarHBondContact O-CB 3.37Å; A87-R90 PolarHBondContact O-N 3.37Å; A87-R90 VanDerWaalsContact O-N 3.12Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 2.98Å; R90-R92 VanDerWaalsContact C-N 3.33Å; R90-R92 PolarHBondContact O-N 3.04Å; R90-R93 PolarHBondContact O-N 3.34Å; R90-A94 PolarHBondContact O-N 3.33Å; R90-E156 PolarHBondContact NE-O 3.5Å; R90-E156 PolarHBondContact NH2-O 3.08Å; R90-I189 VanDerWaalsContact NH1-CD1 3.3Å
91	C	96.9	Very high	96.5	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-53.2	-51.3	172.4	-78.1	0	0	0	0	111.4	A87 L88 R93 A94 G95 I96 A98 L158 F184	A87-C91 PolarHBondContact O-N 3.28Å; L88-C91 PolarHBondContact O-N 3.4Å; C91-R93 PolarHBondContact O-N 2.61Å; C91-A94 CarbonylContact O-C 3.52Å; C91-A94 WeakPolarHBondContact O-CA 3.49Å; C91-A94 WeakPolarHBondContact O-CB 3.38Å; C91-A94 PolarHBondContact O-N 2.86Å; C91-A94 VanDerWaalsContact O-N 3.08Å; C91-G95 PolarHBondContact O-N 3.4Å; C91-I96 CarbonylContact C-O 3.51Å; C91-I96 HydrophobicContact CB-CB 4.05Å; C91-I96 HydrophobicContact CB-CG2 4.29Å; C91-I96 WeakPolarHBondContact O-CA 3.33Å; C91-I96 WeakPolarHBondContact O-CB 3.44Å; C91-I96 PolarHBondContact O-N 3.01Å; C91-A98 HydrophobicContact CB-CB 3.86Å; C91-L158 WeakPolarHBondContact SG-CD2 3.41Å; C91-F184 WeakPolarHBondContact SG-CZ 3.41Å
92	R	97.3	Very high	96.7	Very high	113 Å²	113	49.6 Å²	49.6	43%	0.426	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-41.2	-178.8	-68.1	-168.1	69.2	100.3	0	112.9	L88 L89 R90 A94 G95 I96 A98 V100 E114	L88-R92 WeakPolarHBondContact O-CG 3.47Å; L88-R92 PolarHBondContact O-N 3.41Å; L88-R92 VanDerWaalsContact O-N 3.1Å; L89-R92 PolarHBondContact O-N 3.09Å; R90-R92 VanDerWaalsContact C-N 3.33Å; R90-R92 PolarHBondContact O-N 3.04Å; R92-A94 PolarHBondContact O-N 3.19Å; R92-G95 PolarHBondContact O-N 2.93Å; R92-I96 WeakPolarHBondContact CA-O 3.48Å; R92-I96 PolarHBondContact N-O 3.44Å; R92-A98 WeakPolarHBondContact CD-O 3.45Å; R92-A98 HydrophobicContact CG-CB 4.15Å; R92-A98 PolarHBondContact NH1-O 3.44Å; R92-V100 VanDerWaalsContact NH1-CG2 3.33Å; R92-E114 IonicContact NH1-OE2 2.75Å
93	R	96.9	Very high	97	Very high	205 Å²	205	53 Å²	53	77%	0.774	26%	0.256	S	S	*	.	H	α-helix	trans	-62.4	-31.4	175.5	-76.4	179.6	174	-177	-2.3	112.7	L89 R90 C91 G95	L89-R93 HydrophobicContact CD1-CG 4.46Å; L89-R93 WeakPolarHBondContact O-CG 3.49Å; L89-R93 PolarHBondContact O-N 3.28Å; R90-R93 PolarHBondContact O-N 3.34Å; C91-R93 PolarHBondContact O-N 2.61Å; R93-G95 PolarHBondContact O-N 3.28Å
94	A	96.1	Very high	97.1	Very high	20 Å²	20	51.5 Å²	51.5	17%	0.165	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	6.2	173.4	0	0	0	0	0	113.6	R90 C91 R92 I96 R152 E156	R90-A94 PolarHBondContact O-N 3.33Å; C91-A94 CarbonylContact O-C 3.52Å; C91-A94 WeakPolarHBondContact O-CA 3.49Å; C91-A94 WeakPolarHBondContact O-CB 3.38Å; C91-A94 PolarHBondContact O-N 2.86Å; C91-A94 VanDerWaalsContact O-N 3.08Å; R92-A94 PolarHBondContact O-N 3.19Å; A94-I96 HydrophobicContact CB-CD1 4.18Å; A94-I96 HydrophobicContact CB-CG1 4.25Å; A94-I96 PolarHBondContact O-N 3.47Å; A94-R152 WeakPolarHBondContact O-CD 3.45Å; A94-E156 HydrophobicContact CB-CG 3.62Å
95	G	96.6	Very high	96.9	Very high	48 Å²	48	52 Å²	52	50%	0.495	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	22.6	-175.6	0	0	0	0	0	113.5	C91 R92 R93 R152	C91-G95 PolarHBondContact O-N 3.4Å; R92-G95 PolarHBondContact O-N 2.93Å; R93-G95 PolarHBondContact O-N 3.28Å; G95-R152 PolarHBondContact O-NH1 3.27Å
96	I	97.7	Very high	96.5	Very high	6 Å²	6	56.6 Å²	56.6	3%	0.031	27%	0.268	C	S	.	.			trans	-93.2	127	170.8	-56.7	168.6	0	0	0	107.5	C91 R92 A94 A98 V149 R152 M153 L181	C91-I96 CarbonylContact C-O 3.51Å; C91-I96 HydrophobicContact CB-CB 4.05Å; C91-I96 HydrophobicContact CB-CG2 4.29Å; C91-I96 WeakPolarHBondContact O-CA 3.33Å; C91-I96 WeakPolarHBondContact O-CB 3.44Å; C91-I96 PolarHBondContact O-N 3.01Å; R92-I96 WeakPolarHBondContact CA-O 3.48Å; R92-I96 PolarHBondContact N-O 3.44Å; A94-I96 HydrophobicContact CB-CD1 4.18Å; A94-I96 HydrophobicContact CB-CG1 4.25Å; A94-I96 PolarHBondContact O-N 3.47Å; I96-A98 PolarHBondContact O-N 3.3Å; I96-V149 HydrophobicContact CG2-CG1 3.9Å; I96-R152 HydrophobicContact CD1-CB 4.08Å; I96-R152 HydrophobicContact CD1-CG 4.16Å; I96-R152 HydrophobicContact CG1-CB 4.24Å; I96-R152 HydrophobicContact CG1-CG 4.15Å; I96-M153 HydrophobicContact CD1-CB 3.82Å; I96-M153 HydrophobicContact CD1-CG 4.46Å; I96-L181 HydrophobicContact CG2-CD1 3.89Å; I96-L181 HydrophobicContact CG2-CG 4.18Å
97	S	97.8	Very high	96	Very high	60 Å²	60	48.7 Å²	48.7	42%	0.42	24%	0.242	S	C	.	.			trans	-65.4	125.2	176.7	-58.3	0	0	0	0	110.2	I179 V180 L181	S97-I179 WeakPolarHBondContact CB-O 3.45Å; S97-V180 WeakPolarHBondContact O-CA 3.28Å; S97-L181 PolarHBondContact O-N 3.23Å
98	A	97.9	Very high	95.6	Very high	1 Å²	1	49 Å²	49	1%	0.008	24%	0.244	C	C	.	.			trans	-152.2	153.5	174.9	0	0	0	0	0	108.1	L88 C91 R92 I96 V100	L88-A98 HydrophobicContact CD2-CB 3.89Å; C91-A98 HydrophobicContact CB-CB 3.86Å; R92-A98 WeakPolarHBondContact CD-O 3.45Å; R92-A98 HydrophobicContact CG-CB 4.15Å; R92-A98 PolarHBondContact NH1-O 3.44Å; I96-A98 PolarHBondContact O-N 3.3Å; A98-V100 PolarHBondContact O-N 3.25Å
99	P	98.1	Very high	95.4	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.026	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-53	137.9	-179.6	-29.5	35.6	0	0	0	113.7	V101 M113 E114 I116 L181 I182	P99-V101 PolarHBondContact O-N 3.07Å; P99-M113 HydrophobicContact CB-CB 4.02Å; P99-M113 HydrophobicContact CB-CG 4.15Å; P99-M113 HydrophobicContact CB-SD 4.23Å; P99-M113 HydrophobicContact CG-SD 4.43Å; P99-E114 HydrophobicContact CB-CB 4.26Å; P99-I116 HydrophobicContact CG-CD1 4.36Å; P99-I116 HydrophobicContact CG-CG1 4.4Å; P99-L181 VanDerWaalsContact CD-O 3.28Å; P99-L181 WeakPolarHBondContact CD-O 3.35Å; P99-I182 HydrophobicContact CG-CG2 3.79Å
100	V	97.7	Very high	95.3	Very high	42 Å²	42	45.7 Å²	45.7	26%	0.255	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-66.3	129.5	168.1	177.7	0	0	0	0	109.5	R92 A98 F102 M113 E114	R92-V100 VanDerWaalsContact NH1-CG2 3.33Å; A98-V100 PolarHBondContact O-N 3.25Å; V100-F102 HydrophobicContact CB-CD1 4.42Å; V100-F102 HydrophobicContact CB-CE1 3.98Å; V100-F102 HydrophobicContact CG1-CD1 3.97Å; V100-F102 HydrophobicContact CG1-CE1 3.91Å; V100-M113 CarbonylContact O-C 3.52Å; V100-M113 VanDerWaalsContact O-CA 3.22Å; V100-M113 WeakPolarHBondContact O-CA 3.47Å; V100-E114 HydrophobicContact CB-CB 4.11Å; V100-E114 WeakPolarHBondContact CG2-OE2 3.48Å; V100-E114 PolarHBondContact N-OE2 2.85Å; V100-E114 PolarHBondContact O-N 2.86Å
101	V	97.8	Very high	95.2	Very high	45 Å²	45	41.7 Å²	41.7	27%	0.273	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	122.8	170.8	178.6	0	0	0	0	109	A85 L88 P99 V104 L111	A85-V101 HydrophobicContact CB-CG2 4.4Å; L88-V101 HydrophobicContact CB-CG2 4.06Å; L88-V101 HydrophobicContact CD1-CG2 3.65Å; P99-V101 PolarHBondContact O-N 3.07Å; V101-V104 HydrophobicContact CG1-CG2 3.76Å; V101-L111 HydrophobicContact CG1-CD1 3.72Å; V101-L111 HydrophobicContact CG2-CD1 4.28Å
102	F	97.4	Very high	95.3	Very high	40 Å²	40	42 Å²	42	18%	0.175	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-44.1	176.6	-60.3	-22.9	0	0	0	111.9	F52 R55 A56 A57 V100 Y112 E114	F52-F102 HydrophobicContact CD1-CB 3.9Å; F52-F102 HydrophobicContact CD1-CD2 4.24Å; F52-F102 HydrophobicContact CD1-CG 4.5Å; F52-F102 HydrophobicContact CE1-CB 4.1Å; R55-F102 HydrophobicContact CB-CE2 4.19Å; R55-F102 HydrophobicContact CB-CZ 4.41Å; A56-F102 WeakPolarHBondContact O-CE2 3.42Å; A57-F102 HydrophobicContact CB-CD2 4.14Å; A57-F102 HydrophobicContact CB-CE2 3.99Å; V100-F102 HydrophobicContact CB-CD1 4.42Å; V100-F102 HydrophobicContact CB-CE1 3.98Å; V100-F102 HydrophobicContact CG1-CD1 3.97Å; V100-F102 HydrophobicContact CG1-CE1 3.91Å; F102-Y112 PolarHBondContact N-O 3.04Å; F102-E114 HydrophobicContact CE1-CB 4.07Å; F102-E114 VanDerWaalsContact CZ-CA 3.41Å; F102-E114 HydrophobicContact CZ-CB 3.75Å; F102-E114 HydrophobicContact CZ-CG 4.36Å
103	F	96	Very high	95.3	Very high	96 Å²	96	37.3 Å²	37.3	42%	0.421	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	147.7	-175.6	180	-123.6	0	0	0	111.2	F52 D105 Y112	F52-F103 HydrophobicContact CE1-CB 3.77Å; F52-F103 HydrophobicContact CZ-CB 3.73Å; F52-F103 HydrophobicContact CZ-CD1 4.07Å; F52-F103 HydrophobicContact CZ-CG 4.1Å; F103-D105 HydrophobicContact CD1-CB 4.31Å; F103-D105 HydrophobicContact CE1-CB 3.67Å; F103-D105 HydrophobicContact CZ-CB 4.25Å; F103-Y112 HydrophobicContact CB-CD2 4.12Å; F103-Y112 HydrophobicContact CB-CG 4.21Å; F103-Y112 AromaticContact CD1-CD2 3.64Å; F103-Y112 HydrophobicContact CD1-CD2 3.64Å; F103-Y112 AromaticContact CD1-CE2 3.7Å; F103-Y112 HydrophobicContact CD1-CE2 3.7Å; F103-Y112 HydrophobicContact CD1-CG 4.31Å; F103-Y112 HydrophobicContact CE1-CE2 4.24Å; F103-Y112 HydrophobicContact CG-CD2 4.31Å; F103-Y112 PolarHBondContact N-O 3.43Å; F103-Y112 WeakPolarHBondContact O-CB 3.31Å; F103-Y112 PolarHBondContact O-N 2.86Å
104	V	95.4	Very high	95.4	Very high	24 Å²	24	29.7 Å²	29.7	15%	0.145	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	109.3	175	-168.1	0	0	0	0	108.5	T81 A85 V101 Y106 L111	T81-V104 HydrophobicContact CG2-CG1 3.61Å; A85-V104 HydrophobicContact CB-CG2 3.92Å; V101-V104 HydrophobicContact CG1-CG2 3.76Å; V104-Y106 HydrophobicContact CB-CE1 4.16Å; V104-Y106 HydrophobicContact CG1-CD1 3.92Å; V104-Y106 HydrophobicContact CG1-CE1 3.32Å; V104-L111 HydrophobicContact CG2-CD1 3.81Å
105	D	92.6	Very high	95.4	Very high	13 Å²	13	30.2 Å²	30.2	7%	0.07	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	102.9	175.9	179.9	-0.8	0	0	0	109.6	S29 F103 A107 S108 N109 C110 Y112	S29-D105 PolarHBondContact OG-OD2 3.39Å; F103-D105 HydrophobicContact CD1-CB 4.31Å; F103-D105 HydrophobicContact CE1-CB 3.67Å; F103-D105 HydrophobicContact CZ-CB 4.25Å; D105-A107 VanDerWaalsContact C-N 3.34Å; D105-A107 WeakPolarHBondContact OD1-CA 3.34Å; D105-A107 VanDerWaalsContact OD1-CB 3.28Å; D105-A107 WeakPolarHBondContact OD1-CB 3.48Å; D105-A107 PolarHBondContact OD1-N 3.29Å; D105-S108 PolarHBondContact OD1-N 3.1Å; D105-S108 VanDerWaalsContact OD1-N 3.14Å; D105-S108 WeakPolarHBondContact OD2-CB 3.28Å; D105-S108 PolarHBondContact OD2-OG 3.45Å; D105-N109 CarbonylContact O-C 3.56Å; D105-N109 VanDerWaalsContact O-CA 3.26Å; D105-N109 WeakPolarHBondContact O-CA 3.28Å; D105-N109 PolarHBondContact O-N 3.08Å; D105-C110 HydrophobicContact CB-CB 4.07Å; D105-C110 PolarHBondContact N-O 2.87Å; D105-C110 PolarHBondContact O-N 3.47Å; D105-Y112 HydrophobicContact CB-CE2 3.99Å
106	Y	87.8	Confident	95.5	Very high	111 Å²	111	28.6 Å²	28.6	44%	0.435	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-22.1	176.4	-55.7	-58.4	0	0	0	113.6	R78 V82 V104	R78-Y106 HydrophobicContact CG-CD1 4.11Å; V82-Y106 HydrophobicContact CG2-CD1 4.05Å; V82-Y106 HydrophobicContact CG2-CE1 3.3Å; V104-Y106 HydrophobicContact CB-CE1 4.16Å; V104-Y106 HydrophobicContact CG1-CD1 3.92Å; V104-Y106 HydrophobicContact CG1-CE1 3.32Å
107	A	86.3	Confident	95.4	Very high	16 Å²	16	34.2 Å²	34.2	13%	0.132	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-40.2	179.5	0	0	0	0	0	111	L22 A25 R26 D105	L22-A107 HydrophobicContact CD1-CB 3.43Å; L22-A107 VanDerWaalsContact CD1-CB 3.43Å; A25-A107 HydrophobicContact CB-CB 3.97Å; R26-A107 WeakPolarHBondContact CG-O 3.22Å; R26-A107 PolarHBondContact NE-O 2.93Å; D105-A107 VanDerWaalsContact C-N 3.34Å; D105-A107 WeakPolarHBondContact OD1-CA 3.34Å; D105-A107 VanDerWaalsContact OD1-CB 3.28Å; D105-A107 WeakPolarHBondContact OD1-CB 3.48Å; D105-A107 PolarHBondContact OD1-N 3.29Å
108	S	89.6	Confident	95.2	Very high	10 Å²	10	34.5 Å²	34.5	7%	0.07	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	6.9	-175.2	-37.9	0	0	0	0	113.1	S29 H61 D105 C110	S29-S108 WeakPolarHBondContact CB-OG 3.2Å; S29-S108 PolarHBondContact OG-OG 3.47Å; H61-S108 PolarHBondContact CD2-O 2.96Å; H61-S108 PolarHBondContact NE2-O 2.8Å; D105-S108 PolarHBondContact OD1-N 3.1Å; D105-S108 VanDerWaalsContact OD1-N 3.14Å; D105-S108 WeakPolarHBondContact OD2-CB 3.28Å; D105-S108 PolarHBondContact OD2-OG 3.45Å; S108-C110 VanDerWaalsContact C-N 3.26Å; S108-C110 PolarHBondContact O-N 3.29Å; S108-C110 PolarHBondContact O-SG 3.03Å
109	N	92.2	Very high	95.2	Very high	19 Å²	19	36.1 Å²	36.1	10%	0.102	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	47.7	-175.7	-60	-54.1	0	0	0	112.7	R62 R78 D105	R62-N109 HydrophobicContact CB-CB 4.09Å; R62-N109 PolarHBondContact N-O 2.95Å; R62-N109 WeakPolarHBondContact O-CB 3.46Å; R78-N109 PolarHBondContact N-OD1 3.25Å; D105-N109 CarbonylContact O-C 3.56Å; D105-N109 VanDerWaalsContact O-CA 3.26Å; D105-N109 WeakPolarHBondContact O-CA 3.28Å; D105-N109 PolarHBondContact O-N 3.08Å
110	C	94.9	Very high	95.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.9	179.1	-65.7	0	0	0	0	110.8	I59 K60 H61 D105 S108 Y112	I59-C110 HydrophobicContact CG2-CB 4.22Å; K60-C110 CarbonylContact O-C 3.58Å; K60-C110 WeakPolarHBondContact O-CA 3.32Å; H61-C110 PolarHBondContact CD2-SG 3.4Å; H61-C110 VanDerWaalsContact CG-SG 3.6Å; D105-C110 HydrophobicContact CB-CB 4.07Å; D105-C110 PolarHBondContact N-O 2.87Å; D105-C110 PolarHBondContact O-N 3.47Å; S108-C110 VanDerWaalsContact C-N 3.26Å; S108-C110 PolarHBondContact O-N 3.29Å; S108-C110 PolarHBondContact O-SG 3.03Å; C110-Y112 HydrophobicContact CB-CD2 4.24Å; C110-Y112 HydrophobicContact CB-CE2 3.52Å
111	L	96.9	Very high	95.1	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117	172.3	-178	61.9	0	0	0	109	I59 K60 T81 E84 A85 L88 V101 V104 M113	I59-L111 WeakPolarHBondContact CA-O 3.27Å; K60-L111 HydrophobicContact CB-CB 4.48Å; K60-L111 PolarHBondContact N-O 3.45Å; K60-L111 PolarHBondContact O-N 3.34Å; T81-L111 HydrophobicContact CG2-CB 4.27Å; E84-L111 HydrophobicContact CB-CD2 4.2Å; E84-L111 HydrophobicContact CG-CD2 3.68Å; A85-L111 HydrophobicContact CB-CD1 3.9Å; L88-L111 HydrophobicContact CD1-CD2 4.07Å; V101-L111 HydrophobicContact CG1-CD1 3.72Å; V101-L111 HydrophobicContact CG2-CD1 4.28Å; V104-L111 HydrophobicContact CG2-CD1 3.81Å; L111-M113 HydrophobicContact CB-CE 4.33Å; L111-M113 HydrophobicContact CD2-CE 3.84Å; L111-M113 HydrophobicContact CG-CE 3.93Å
112	Y	97.6	Very high	95.1	Very high	6 Å²	6	35.6 Å²	35.6	2%	0.024	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.2	179	-60.8	-110.7	0	0	0	108.1	F32 F52 I59 F102 F103 D105 C110	F32-Y112 HydrophobicContact CD1-CE1 4.05Å; F32-Y112 HydrophobicContact CE1-CD1 4.49Å; F32-Y112 AromaticContact CE1-CE1 3.67Å; F32-Y112 HydrophobicContact CE1-CE1 3.67Å; F52-Y112 HydrophobicContact CB-CD1 4.41Å; F52-Y112 AromaticContact CD2-CD1 3.51Å; F52-Y112 HydrophobicContact CD2-CD1 3.51Å; F52-Y112 AromaticContact CD2-CE1 3.79Å; F52-Y112 HydrophobicContact CD2-CE1 3.79Å; F52-Y112 HydrophobicContact CD2-CG 4.43Å; F52-Y112 AromaticContact CE2-CD1 3.81Å; F52-Y112 HydrophobicContact CE2-CD1 3.81Å; F52-Y112 AromaticContact CE2-CE1 3.92Å; F52-Y112 HydrophobicContact CE2-CE1 3.92Å; F52-Y112 HydrophobicContact CE2-CG 4.46Å; F52-Y112 AromaticContact CG-CD1 3.9Å; F52-Y112 HydrophobicContact CG-CD1 3.9Å; F52-Y112 HydrophobicContact CZ-CD1 4.43Å; I59-Y112 HydrophobicContact CB-CD1 4.3Å; I59-Y112 HydrophobicContact CB-CE1 4.44Å; I59-Y112 HydrophobicContact CD1-CD1 4.48Å; I59-Y112 HydrophobicContact CG1-CD1 3.39Å; I59-Y112 HydrophobicContact CG1-CE1 3.69Å; I59-Y112 HydrophobicContact CG1-CG 4.13Å; I59-Y112 HydrophobicContact CG2-CD1 3.93Å; I59-Y112 HydrophobicContact CG2-CD2 4.31Å; I59-Y112 HydrophobicContact CG2-CE1 3.81Å; I59-Y112 HydrophobicContact CG2-CE2 4.2Å; I59-Y112 HydrophobicContact CG2-CG 4.16Å; F102-Y112 PolarHBondContact N-O 3.04Å; F103-Y112 HydrophobicContact CB-CD2 4.12Å; F103-Y112 HydrophobicContact CB-CG 4.21Å; F103-Y112 AromaticContact CD1-CD2 3.64Å; F103-Y112 HydrophobicContact CD1-CD2 3.64Å; F103-Y112 AromaticContact CD1-CE2 3.7Å; F103-Y112 HydrophobicContact CD1-CE2 3.7Å; F103-Y112 HydrophobicContact CD1-CG 4.31Å; F103-Y112 HydrophobicContact CE1-CE2 4.24Å; F103-Y112 HydrophobicContact CG-CD2 4.31Å; F103-Y112 PolarHBondContact N-O 3.43Å; F103-Y112 WeakPolarHBondContact O-CB 3.31Å; F103-Y112 PolarHBondContact O-N 2.86Å; D105-Y112 HydrophobicContact CB-CE2 3.99Å; C110-Y112 HydrophobicContact CB-CD2 4.24Å; C110-Y112 HydrophobicContact CB-CE2 3.52Å
113	M	98.1	Very high	95.1	Very high	16 Å²	16	39.4 Å²	39.4	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	162.2	-174.9	66.8	-167.9	103.2	0	0	112.1	A57 V58 K60 L88 P99 V100 L111 E115	A57-M113 CarbonylContact C-O 3.47Å; A57-M113 VanDerWaalsContact CA-O 3.27Å; A57-M113 WeakPolarHBondContact CA-O 3.01Å; V58-M113 HydrophobicContact CB-CG 4.07Å; V58-M113 HydrophobicContact CG1-CG 4.47Å; V58-M113 PolarHBondContact N-O 2.86Å; V58-M113 WeakPolarHBondContact O-CG 3.23Å; V58-M113 PolarHBondContact O-N 2.86Å; K60-M113 HydrophobicContact CB-CE 3.76Å; K60-M113 HydrophobicContact CD-CE 4.43Å; L88-M113 HydrophobicContact CD1-SD 4.42Å; P99-M113 HydrophobicContact CB-CB 4.02Å; P99-M113 HydrophobicContact CB-CG 4.15Å; P99-M113 HydrophobicContact CB-SD 4.23Å; P99-M113 HydrophobicContact CG-SD 4.43Å; V100-M113 CarbonylContact O-C 3.52Å; V100-M113 VanDerWaalsContact O-CA 3.22Å; V100-M113 WeakPolarHBondContact O-CA 3.47Å; L111-M113 HydrophobicContact CB-CE 4.33Å; L111-M113 HydrophobicContact CD2-CE 3.84Å; L111-M113 HydrophobicContact CG-CE 3.93Å; M113-E115 PolarHBondContact O-N 2.68Å
114	E	98.3	Very high	95.1	Very high	45 Å²	45	38.8 Å²	38.8	21%	0.21	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	131	173.7	-178.4	-174.7	-172.6	0	0	111.2	R92 P99 V100 F102 I116	R92-E114 IonicContact NH1-OE2 2.75Å; P99-E114 HydrophobicContact CB-CB 4.26Å; V100-E114 HydrophobicContact CB-CB 4.11Å; V100-E114 WeakPolarHBondContact CG2-OE2 3.48Å; V100-E114 PolarHBondContact N-OE2 2.85Å; V100-E114 PolarHBondContact O-N 2.86Å; F102-E114 HydrophobicContact CE1-CB 4.07Å; F102-E114 VanDerWaalsContact CZ-CA 3.41Å; F102-E114 HydrophobicContact CZ-CB 3.75Å; F102-E114 HydrophobicContact CZ-CG 4.36Å; E114-I116 HydrophobicContact CG-CD1 4.05Å
115	E	97.6	Very high	95.2	Very high	30 Å²	30	39.9 Å²	39.9	14%	0.14	21%	0.21	C	C	.	.			trans	-78.7	127.1	162.1	-179.5	169.7	-163.8	0	0	109.9	R49 A56 V58 M113 E117	R49-E115 WeakPolarHBondContact CD-OE1 3.26Å; R49-E115 IonicContact CZ-OE1 3.47Å; R49-E115 IonicContact NE-OE1 3.66Å; R49-E115 PolarHBondContact NE-OE1 3.42Å; R49-E115 IonicContact NH2-OE1 2.7Å; A56-E115 HydrophobicContact CB-CB 4.04Å; A56-E115 PolarHBondContact O-N 2.67Å; V58-E115 HydrophobicContact CG2-CB 4.02Å; V58-E115 HydrophobicContact CG2-CG 4.18Å; M113-E115 PolarHBondContact O-N 2.68Å; E115-E117 VanDerWaalsContact C-N 3.33Å; E115-E117 HydrophobicContact CG-CG 4.09Å; E115-E117 PolarHBondContact O-N 3.04Å; E115-E117 VanDerWaalsContact O-N 3.1Å
116	I	97.3	Very high	95.3	Very high	15 Å²	15	39.4 Å²	39.4	8%	0.077	21%	0.208	C	C	.	.			trans	-84.7	83.2	173.1	-45.8	-58.9	0	0	0	108	P99 E114 S119 L169 K171 V180	P99-I116 HydrophobicContact CG-CD1 4.36Å; P99-I116 HydrophobicContact CG-CG1 4.4Å; E114-I116 HydrophobicContact CG-CD1 4.05Å; I116-S119 VanDerWaalsContact O-CB 3.31Å; I116-S119 WeakPolarHBondContact O-CB 3.11Å; I116-S119 PolarHBondContact O-N 3.38Å; I116-S119 PolarHBondContact O-OG 3Å; I116-L169 HydrophobicContact CB-CD1 4.11Å; I116-L169 HydrophobicContact CG1-CD1 4.09Å; I116-K171 HydrophobicContact CG2-CB 4.12Å; I116-K171 HydrophobicContact CG2-CD 4.23Å; I116-K171 HydrophobicContact CG2-CG 3.99Å; I116-V180 HydrophobicContact CD1-CG1 4.14Å; I116-V180 HydrophobicContact CG1-CG1 4.1Å; I116-V180 HydrophobicContact CG2-CG2 4.25Å
117	E	95.2	Very high	95.6	Very high	124 Å²	124	38 Å²	38	58%	0.579	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	139.8	-175.3	-66.4	179.5	102.4	0	0	112.3	A56 E115 S119	A56-E117 HydrophobicContact CB-CG 4.12Å; E115-E117 VanDerWaalsContact C-N 3.33Å; E115-E117 HydrophobicContact CG-CG 4.09Å; E115-E117 PolarHBondContact O-N 3.04Å; E115-E117 VanDerWaalsContact O-N 3.1Å; E117-S119 PolarHBondContact O-N 3.33Å; E117-S119 VanDerWaalsContact O-N 3.15Å
118	G	94.8	Very high	95.9	Very high	65 Å²	65	39.9 Å²	39.9	67%	0.67	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.6	6.8	179.9	0	0	0	0	0	115.1	P172	G118-P172 WeakPolarHBondContact O-CD 3.27Å
119	S	96.8	Very high	96	Very high	35 Å²	35	39.9 Å²	39.9	25%	0.245	22%	0.217	C	C	.	.			trans	-74.3	152.8	177.4	62.5	0	0	0	0	113	I116 E117 L170	I116-S119 VanDerWaalsContact O-CB 3.31Å; I116-S119 WeakPolarHBondContact O-CB 3.11Å; I116-S119 PolarHBondContact O-N 3.38Å; I116-S119 PolarHBondContact O-OG 3Å; E117-S119 PolarHBondContact O-N 3.33Å; E117-S119 VanDerWaalsContact O-N 3.15Å; S119-L170 WeakPolarHBondContact CA-O 3.49Å; S119-L170 VanDerWaalsContact CB-O 3.25Å; S119-L170 WeakPolarHBondContact CB-O 3.43Å
120	V	97.4	Very high	95.9	Very high	52 Å²	52	40.9 Å²	40.9	32%	0.315	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	151.5	171	-61.8	0	0	0	0	109.1	Y125 L169 L170 L174	V120-Y125 HydrophobicContact CG2-CD2 4.47Å; V120-L169 CarbonylContact O-C 3.54Å; V120-L169 WeakPolarHBondContact O-CA 3.32Å; V120-L170 HydrophobicContact CG2-CB 4.1Å; V120-L170 PolarHBondContact N-O 3Å; V120-L170 PolarHBondContact O-N 2.87Å; V120-L174 HydrophobicContact CG2-CD1 4.29Å; V120-L174 HydrophobicContact CG2-CD2 3.78Å
121	T	97.8	Very high	95.7	Very high	29 Å²	29	46.6 Å²	46.6	18%	0.178	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	148.4	173.6	74.7	0	0	0	0	109.9	R123 D124 Y125 M168 L169	T121-R123 PolarHBondContact O-N 3.18Å; T121-D124 PolarHBondContact O-N 2.88Å; T121-D124 VanDerWaalsContact O-N 3.15Å; T121-D124 PolarHBondContact OG1-N 2.61Å; T121-D124 PolarHBondContact OG1-OD2 2.7Å; T121-Y125 PolarHBondContact O-N 3.28Å; T121-M168 WeakPolarHBondContact CA-O 3.08Å; T121-L169 HydrophobicContact CG2-CD2 3.94Å
122	V	97.8	Very high	95.3	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-32.3	172.9	166.1	0	0	0	0	110.4	I126 L142 I146 T165 M168 L170	V122-I126 HydrophobicContact CG1-CD1 3.69Å; V122-I126 HydrophobicContact CG1-CG1 4.32Å; V122-I126 WeakPolarHBondContact O-CB 3.43Å; V122-I126 WeakPolarHBondContact O-CD1 3.18Å; V122-I126 VanDerWaalsContact O-CG1 3.22Å; V122-I126 WeakPolarHBondContact O-CG1 3.47Å; V122-I126 PolarHBondContact O-N 2.7Å; V122-L142 HydrophobicContact CG1-CD2 4.22Å; V122-I146 HydrophobicContact CG1-CD1 4.03Å; V122-T165 WeakPolarHBondContact CB-O 3.33Å; V122-T165 HydrophobicContact CG1-CG2 4.17Å; V122-T165 PolarHBondContact N-O 3.3Å; V122-M168 HydrophobicContact CB-CB 3.93Å; V122-M168 HydrophobicContact CG2-CB 3.52Å; V122-M168 PolarHBondContact N-O 2.95Å; V122-L170 HydrophobicContact CG2-CD1 4.39Å; V122-L170 HydrophobicContact CG2-CD2 4.24Å; V122-L170 HydrophobicContact CG2-CG 3.88Å
123	R	96.9	Very high	94.7	Very high	120 Å²	120	56.9 Å²	56.9	45%	0.453	30%	0.304	S	S	.	.	H	α-helix	trans	-57.1	-55.3	172.4	179.8	-173.8	170.9	-143.8	-2.4	111.6	T121 Y125 I126 Q127 T165 S166 H211	T121-R123 PolarHBondContact O-N 3.18Å; R123-Y125 VanDerWaalsContact C-N 3.31Å; R123-Y125 PolarHBondContact O-N 3.14Å; R123-I126 PolarHBondContact O-N 3.34Å; R123-Q127 PolarHBondContact O-N 2.93Å; R123-Q127 VanDerWaalsContact O-N 3.08Å; R123-T165 PolarHBondContact N-O 3.39Å; R123-S166 VanDerWaalsContact CD-OG 3.3Å; R123-S166 WeakPolarHBondContact CD-OG 3.04Å; R123-H211 PolarHBondContact O-CE1 2.85Å
124	D	96.2	Very high	93.8	Very high	83 Å²	83	64.1 Å²	64.1	44%	0.444	34%	0.335	S	S	.	.	H	α-helix	trans	-67.3	-36.4	-175.3	-56.4	-34.6	0	0	0	110.9	T121 Q127 S128	T121-D124 PolarHBondContact O-N 2.88Å; T121-D124 VanDerWaalsContact O-N 3.15Å; T121-D124 PolarHBondContact OG1-N 2.61Å; T121-D124 PolarHBondContact OG1-OD2 2.7Å; D124-Q127 PolarHBondContact O-N 3.12Å; D124-S128 PolarHBondContact O-N 3.42Å; D124-S128 PolarHBondContact O-OG 3.18Å
125	Y	96.3	Very high	93.2	Very high	47 Å²	47	65 Å²	65	18%	0.184	34%	0.344	C	S	.	.	H	α-helix	trans	-62.3	-44.1	174.5	-178.6	-88.9	0	0	0	112.9	V120 T121 R123 Q127 S128 T129 L139 L142 L170 L174 L177	V120-Y125 HydrophobicContact CG2-CD2 4.47Å; T121-Y125 PolarHBondContact O-N 3.28Å; R123-Y125 VanDerWaalsContact C-N 3.31Å; R123-Y125 PolarHBondContact O-N 3.14Å; Y125-Q127 VanDerWaalsContact C-N 3.33Å; Y125-S128 PolarHBondContact O-OG 3.04Å; Y125-S128 VanDerWaalsContact O-OG 3.06Å; Y125-T129 WeakPolarHBondContact O-CB 3.24Å; Y125-T129 PolarHBondContact O-N 2.73Å; Y125-T129 PolarHBondContact O-OG1 3.39Å; Y125-L139 HydrophobicContact CD1-CD2 4.5Å; Y125-L139 HydrophobicContact CE1-CD2 4.25Å; Y125-L142 HydrophobicContact CD1-CD2 3.78Å; Y125-L142 HydrophobicContact CE1-CD2 4.03Å; Y125-L170 HydrophobicContact CD1-CD1 3.73Å; Y125-L170 HydrophobicContact CD2-CD1 3.66Å; Y125-L170 HydrophobicContact CE1-CD1 4.27Å; Y125-L170 HydrophobicContact CE2-CD1 4.19Å; Y125-L170 HydrophobicContact CG-CD1 3.4Å; Y125-L170 VanDerWaalsContact CG-CD1 3.4Å; Y125-L174 HydrophobicContact CD2-CD1 4.14Å; Y125-L174 HydrophobicContact CE2-CB 4.17Å; Y125-L174 HydrophobicContact CE2-CD1 4.19Å; Y125-L177 HydrophobicContact CE1-CD2 4.38Å
126	I	95.1	Very high	92.5	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-46.1	176.3	-72.9	165.7	0	0	0	109.8	V122 R123 T129 M130 L139 L142 T165 F207 H211	V122-I126 HydrophobicContact CG1-CD1 3.69Å; V122-I126 HydrophobicContact CG1-CG1 4.32Å; V122-I126 WeakPolarHBondContact O-CB 3.43Å; V122-I126 WeakPolarHBondContact O-CD1 3.18Å; V122-I126 VanDerWaalsContact O-CG1 3.22Å; V122-I126 WeakPolarHBondContact O-CG1 3.47Å; V122-I126 PolarHBondContact O-N 2.7Å; R123-I126 PolarHBondContact O-N 3.34Å; I126-T129 PolarHBondContact O-N 3.03Å; I126-M130 HydrophobicContact CG2-CG 4.33Å; I126-M130 WeakPolarHBondContact O-CB 3.25Å; I126-M130 VanDerWaalsContact O-CG 3.27Å; I126-M130 WeakPolarHBondContact O-CG 3.3Å; I126-M130 PolarHBondContact O-N 3.11Å; I126-L139 HydrophobicContact CB-CD1 4.39Å; I126-L139 HydrophobicContact CG1-CD1 4.25Å; I126-L139 HydrophobicContact CG1-CD2 4.14Å; I126-L139 HydrophobicContact CG2-CD1 3.75Å; I126-L142 HydrophobicContact CD1-CD2 4.12Å; I126-L142 HydrophobicContact CG1-CD2 3.65Å; I126-T165 HydrophobicContact CD1-CG2 4.15Å; I126-F207 HydrophobicContact CD1-CE2 3.59Å; I126-F207 HydrophobicContact CD1-CZ 3.93Å; I126-H211 HydrophobicContact CG2-CB 4.09Å; I126-H211 WeakPolarHBondContact CG2-ND1 3.49Å
127	Q	93.6	Very high	92	Very high	82 Å²	82	70.5 Å²	70.5	38%	0.383	37%	0.371	S	S	.	.	H	α-helix	trans	-58.9	-51.3	179.2	-175.3	63.8	33.9	0	0	111.5	R123 D124 Y125 T129 M130 E131	R123-Q127 PolarHBondContact O-N 2.93Å; R123-Q127 VanDerWaalsContact O-N 3.08Å; D124-Q127 PolarHBondContact O-N 3.12Å; Y125-Q127 VanDerWaalsContact C-N 3.33Å; Q127-T129 VanDerWaalsContact C-N 3.34Å; Q127-T129 PolarHBondContact O-N 3.44Å; Q127-M130 PolarHBondContact O-N 3.29Å; Q127-E131 PolarHBondContact NE2-OE1 3.06Å; Q127-E131 WeakPolarHBondContact O-CG 3.42Å; Q127-E131 PolarHBondContact O-N 3.43Å
128	S	93.1	Very high	91.6	Very high	55 Å²	55	66.1 Å²	66.1	39%	0.385	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-37.3	-178.6	64.9	0	0	0	0	113	D124 Y125 T132	D124-S128 PolarHBondContact O-N 3.42Å; D124-S128 PolarHBondContact O-OG 3.18Å; Y125-S128 PolarHBondContact O-OG 3.04Å; Y125-S128 VanDerWaalsContact O-OG 3.06Å; S128-T132 WeakPolarHBondContact O-CB 3.43Å; S128-T132 PolarHBondContact O-N 3.1Å; S128-T132 PolarHBondContact O-OG1 3.14Å
129	T	92.2	Very high	91.6	Very high	10 Å²	10	63 Å²	63	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-42.7	178.3	-53.1	0	0	0	0	110.7	Y125 I126 Q127 E131 T132 E133 S138 L139	Y125-T129 WeakPolarHBondContact O-CB 3.24Å; Y125-T129 PolarHBondContact O-N 2.73Å; Y125-T129 PolarHBondContact O-OG1 3.39Å; I126-T129 PolarHBondContact O-N 3.03Å; Q127-T129 VanDerWaalsContact C-N 3.34Å; Q127-T129 PolarHBondContact O-N 3.44Å; T129-E131 VanDerWaalsContact C-N 3.34Å; T129-E131 PolarHBondContact O-N 2.84Å; T129-T132 PolarHBondContact O-N 3.08Å; T129-E133 HydrophobicContact CG2-CG 4.35Å; T129-E133 WeakPolarHBondContact O-CB 3.5Å; T129-E133 PolarHBondContact O-N 3.39Å; T129-S138 WeakPolarHBondContact CG2-OG 3.41Å; T129-L139 HydrophobicContact CG2-CD2 3.84Å; T129-L139 HydrophobicContact CG2-CG 4.46Å
130	M	90.3	Very high	91.5	Very high	40 Å²	40	64.1 Å²	64.1	20%	0.197	33%	0.33	C	S	.	.	H	α-helix	trans	-66.2	-35.3	177.8	-73	-59.3	-62.1	0	0	112.7	I126 Q127 T132 K134 P136 L139 T214	I126-M130 HydrophobicContact CG2-CG 4.33Å; I126-M130 WeakPolarHBondContact O-CB 3.25Å; I126-M130 VanDerWaalsContact O-CG 3.27Å; I126-M130 WeakPolarHBondContact O-CG 3.3Å; I126-M130 PolarHBondContact O-N 3.11Å; Q127-M130 PolarHBondContact O-N 3.29Å; M130-T132 VanDerWaalsContact C-N 3.34Å; M130-K134 VanDerWaalsContact O-CA 3.24Å; M130-K134 WeakPolarHBondContact O-CA 3.17Å; M130-K134 PolarHBondContact O-N 3.38Å; M130-K134 VanDerWaalsContact O-N 3.11Å; M130-P136 HydrophobicContact CE-CG 4.02Å; M130-L139 HydrophobicContact CG-CD1 3.89Å; M130-L139 HydrophobicContact SD-CD1 3.76Å; M130-T214 HydrophobicContact CE-CG2 4.4Å; M130-T214 HydrophobicContact SD-CG2 4.43Å
131	E	89.5	Confident	91.4	Very high	120 Å²	120	66.8 Å²	66.8	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-65.9	-37.3	174.6	-74.3	171.3	-177.1	0	0	112.4	Q127 T129	Q127-E131 PolarHBondContact NE2-OE1 3.06Å; Q127-E131 WeakPolarHBondContact O-CG 3.42Å; Q127-E131 PolarHBondContact O-N 3.43Å; T129-E131 VanDerWaalsContact C-N 3.34Å; T129-E131 PolarHBondContact O-N 2.84Å
132	T	89	Confident	91.4	Very high	116 Å²	116	65.6 Å²	65.6	71%	0.712	34%	0.335	S	S	*	.	H	α-helix	trans	-84.2	-53.4	-175.5	-53.5	0	0	0	0	112.3	S128 T129 M130	S128-T132 WeakPolarHBondContact O-CB 3.43Å; S128-T132 PolarHBondContact O-N 3.1Å; S128-T132 PolarHBondContact O-OG1 3.14Å; T129-T132 PolarHBondContact O-N 3.08Å; M130-T132 VanDerWaalsContact C-N 3.34Å
133	E	84.8	Confident	91.3	Very high	108 Å²	108	65.7 Å²	65.7	51%	0.505	34%	0.336	S	S	.	.	H	α-helix	trans	-91.9	-18.8	-171.6	-62.2	-169.6	-147	0	0	113.1	T129 T135 S138	T129-E133 HydrophobicContact CG2-CG 4.35Å; T129-E133 WeakPolarHBondContact O-CB 3.5Å; T129-E133 PolarHBondContact O-N 3.39Å; E133-T135 PolarHBondContact O-N 3.04Å; E133-T135 PolarHBondContact O-OG1 2.82Å; E133-S138 WeakPolarHBondContact OE2-CB 3.44Å
134	K	80.9	Confident	91.4	Very high	169 Å²	169	65.3 Å²	65.3	74%	0.735	34%	0.338	S	S	*	.			trans	52.6	15.2	178	-58.3	-178.4	-178.6	176.9	0	115.2	M130	M130-K134 VanDerWaalsContact O-CA 3.24Å; M130-K134 WeakPolarHBondContact O-CA 3.17Å; M130-K134 PolarHBondContact O-N 3.38Å; M130-K134 VanDerWaalsContact O-N 3.11Å
135	T	84.6	Confident	91.5	Very high	63 Å²	63	63 Å²	63	39%	0.387	33%	0.327	S	S	.	.			trans	-129.1	123.6	-179	58.5	0	0	0	0	109.8	E133 Q137 S138	E133-T135 PolarHBondContact O-N 3.04Å; E133-T135 PolarHBondContact O-OG1 2.82Å; T135-Q137 PolarHBondContact O-N 3.41Å; T135-Q137 VanDerWaalsContact O-N 3.15Å; T135-S138 WeakPolarHBondContact O-CB 3.37Å; T135-S138 PolarHBondContact O-N 3.03Å; T135-S138 PolarHBondContact O-OG 3.05Å
136	P	83.4	Confident	91.6	Very high	26 Å²	26	61 Å²	61	17%	0.169	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-60.1	-23	177.2	-24.8	33.4	0	0	0	114	M130 S138 L139 V217	M130-P136 HydrophobicContact CE-CG 4.02Å; P136-S138 PolarHBondContact O-N 2.76Å; P136-L139 WeakPolarHBondContact O-CB 3.47Å; P136-L139 PolarHBondContact O-N 3.42Å; P136-L139 VanDerWaalsContact O-N 3.07Å; P136-V217 HydrophobicContact CB-CG2 3.69Å; P136-V217 WeakPolarHBondContact O-CG2 3.46Å
137	Q	85.5	Confident	91.8	Very high	134 Å²	134	61 Å²	61	63%	0.626	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-60.7	-30	180	-70.7	77.6	4.4	0	0	112.7	T135 L139 S140	T135-Q137 PolarHBondContact O-N 3.41Å; T135-Q137 VanDerWaalsContact O-N 3.15Å; Q137-L139 PolarHBondContact O-N 3.48Å; Q137-S140 WeakPolarHBondContact O-CB 3.46Å; Q137-S140 PolarHBondContact O-N 3.39Å
138	S	87.8	Confident	92	Very high	32 Å²	32	60.6 Å²	60.6	22%	0.224	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-53.8	-32.5	173.4	62.4	0	0	0	0	113.1	T129 E133 T135 P136 S140	T129-S138 WeakPolarHBondContact CG2-OG 3.41Å; E133-S138 WeakPolarHBondContact OE2-CB 3.44Å; T135-S138 WeakPolarHBondContact O-CB 3.37Å; T135-S138 PolarHBondContact O-N 3.03Å; T135-S138 PolarHBondContact O-OG 3.05Å; P136-S138 PolarHBondContact O-N 2.76Å; S138-S140 VanDerWaalsContact C-N 3.33Å; S138-S140 PolarHBondContact O-N 3.24Å
139	L	94.3	Very high	92.3	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-87.6	1.6	-177.8	-59.8	172.9	0	0	0	113.5	Y125 I126 T129 M130 P136 Q137 N141 L142 A143 V217	Y125-L139 HydrophobicContact CD1-CD2 4.5Å; Y125-L139 HydrophobicContact CE1-CD2 4.25Å; I126-L139 HydrophobicContact CB-CD1 4.39Å; I126-L139 HydrophobicContact CG1-CD1 4.25Å; I126-L139 HydrophobicContact CG1-CD2 4.14Å; I126-L139 HydrophobicContact CG2-CD1 3.75Å; T129-L139 HydrophobicContact CG2-CD2 3.84Å; T129-L139 HydrophobicContact CG2-CG 4.46Å; M130-L139 HydrophobicContact CG-CD1 3.89Å; M130-L139 HydrophobicContact SD-CD1 3.76Å; P136-L139 WeakPolarHBondContact O-CB 3.47Å; P136-L139 PolarHBondContact O-N 3.42Å; P136-L139 VanDerWaalsContact O-N 3.07Å; Q137-L139 PolarHBondContact O-N 3.48Å; L139-N141 VanDerWaalsContact C-N 3.32Å; L139-N141 PolarHBondContact O-N 3.3Å; L139-L142 HydrophobicContact CD2-CD2 4.09Å; L139-L142 WeakPolarHBondContact O-CB 3.37Å; L139-L142 PolarHBondContact O-N 2.82Å; L139-L142 VanDerWaalsContact O-N 3.15Å; L139-A143 PolarHBondContact O-N 2.96Å; L139-V217 HydrophobicContact CB-CG1 3.77Å; L139-V217 HydrophobicContact CB-CG2 4.11Å; L139-V217 HydrophobicContact CD1-CG2 4.3Å
140	S	94.2	Very high	92.5	Very high	58 Å²	58	58.7 Å²	58.7	41%	0.406	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-41.3	-175.3	-171.9	0	0	0	0	112.6	Q137 S138 A143 K144	Q137-S140 WeakPolarHBondContact O-CB 3.46Å; Q137-S140 PolarHBondContact O-N 3.39Å; S138-S140 VanDerWaalsContact C-N 3.33Å; S138-S140 PolarHBondContact O-N 3.24Å; S140-A143 PolarHBondContact O-N 2.97Å; S140-K144 WeakPolarHBondContact O-CB 3.37Å; S140-K144 PolarHBondContact O-N 3.37Å
141	N	96.1	Very high	92.9	Very high	108 Å²	108	56.9 Å²	56.9	58%	0.578	29%	0.294	S	S	*	.	H	α-helix	trans	-66	-41.1	177.2	-72.8	-27.8	0	0	0	111.6	L139 K144 T145 L177	L139-N141 VanDerWaalsContact C-N 3.32Å; L139-N141 PolarHBondContact O-N 3.3Å; N141-K144 WeakPolarHBondContact O-CB 3.4Å; N141-K144 PolarHBondContact O-N 3.38Å; N141-T145 PolarHBondContact O-N 3.46Å; N141-T145 PolarHBondContact O-OG1 3.46Å; N141-L177 HydrophobicContact CB-CD1 3.69Å
142	L	97.1	Very high	93.4	Very high	3 Å²	3	57 Å²	57	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-48.6	175.6	175.3	66.3	0	0	0	111.1	V122 Y125 I126 L139 K144 T145 I146 L170 L177 I179	V122-L142 HydrophobicContact CG1-CD2 4.22Å; Y125-L142 HydrophobicContact CD1-CD2 3.78Å; Y125-L142 HydrophobicContact CE1-CD2 4.03Å; I126-L142 HydrophobicContact CD1-CD2 4.12Å; I126-L142 HydrophobicContact CG1-CD2 3.65Å; L139-L142 HydrophobicContact CD2-CD2 4.09Å; L139-L142 WeakPolarHBondContact O-CB 3.37Å; L139-L142 PolarHBondContact O-N 2.82Å; L139-L142 VanDerWaalsContact O-N 3.15Å; L142-K144 VanDerWaalsContact C-N 3.26Å; L142-K144 PolarHBondContact O-N 2.88Å; L142-T145 PolarHBondContact O-N 3.36Å; L142-T145 VanDerWaalsContact O-N 3.13Å; L142-I146 HydrophobicContact CD1-CD1 4.09Å; L142-I146 HydrophobicContact CD1-CG1 4.22Å; L142-I146 HydrophobicContact CG-CD1 3.88Å; L142-I146 HydrophobicContact CG-CG1 4.41Å; L142-I146 VanDerWaalsContact O-CG1 3.31Å; L142-I146 WeakPolarHBondContact O-CG1 3.45Å; L142-I146 PolarHBondContact O-N 2.9Å; L142-L170 HydrophobicContact CD1-CD1 4.26Å; L142-L170 HydrophobicContact CD1-CD2 4.09Å; L142-L177 HydrophobicContact CB-CD1 4.46Å; L142-L177 HydrophobicContact CB-CD2 4.34Å; L142-L177 HydrophobicContact CD1-CD2 4.18Å; L142-I179 HydrophobicContact CD1-CD1 4.34Å
143	A	97.5	Very high	93.8	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-56.4	-42.5	176.4	0	0	0	0	0	112	L139 S140 I146 G147 V217 A220 F221	L139-A143 PolarHBondContact O-N 2.96Å; S140-A143 PolarHBondContact O-N 2.97Å; A143-I146 PolarHBondContact O-N 3.11Å; A143-G147 PolarHBondContact O-N 2.64Å; A143-V217 HydrophobicContact CB-CG1 3.73Å; A143-V217 VanDerWaalsContact CB-O 3.27Å; A143-V217 WeakPolarHBondContact CB-O 3.42Å; A143-A220 HydrophobicContact CB-CB 4.09Å; A143-F221 HydrophobicContact CB-CB 4.09Å; A143-F221 WeakPolarHBondContact O-CA 3.41Å
144	K	98.2	Very high	94.5	Very high	113 Å²	113	46.4 Å²	46.4	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-60.4	-47.8	175.9	-173.2	-176.8	178.7	-177.2	0	111.4	S140 N141 L142 G147 Q148 S224	S140-K144 WeakPolarHBondContact O-CB 3.37Å; S140-K144 PolarHBondContact O-N 3.37Å; N141-K144 WeakPolarHBondContact O-CB 3.4Å; N141-K144 PolarHBondContact O-N 3.38Å; L142-K144 VanDerWaalsContact C-N 3.26Å; L142-K144 PolarHBondContact O-N 2.88Å; K144-G147 PolarHBondContact O-N 3.39Å; K144-Q148 WeakPolarHBondContact O-CG 3.37Å; K144-Q148 PolarHBondContact O-N 2.83Å; K144-S224 WeakPolarHBondContact CG-OG 3.38Å; K144-S224 PolarHBondContact O-OG 3.48Å
145	T	98.3	Very high	95.3	Very high	34 Å²	34	39.8 Å²	39.8	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-42.6	-179.9	-52	0	0	0	0	111.8	N141 L142 G147 Q148 V149 I179	N141-T145 PolarHBondContact O-N 3.46Å; N141-T145 PolarHBondContact O-OG1 3.46Å; L142-T145 PolarHBondContact O-N 3.36Å; L142-T145 VanDerWaalsContact O-N 3.13Å; T145-G147 VanDerWaalsContact C-N 3.27Å; T145-G147 PolarHBondContact O-N 3.14Å; T145-Q148 PolarHBondContact O-N 2.88Å; T145-V149 WeakPolarHBondContact O-CG2 3.47Å; T145-V149 PolarHBondContact O-N 2.79Å; T145-I179 HydrophobicContact CG2-CD1 3.73Å; T145-I179 HydrophobicContact CG2-CG1 4.26Å
146	I	98.4	Very high	95.9	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-44.4	173.8	-62.6	165.8	0	0	0	109.7	V122 L142 A143 Q148 V149 L150 M168 I179 F221	V122-I146 HydrophobicContact CG1-CD1 4.03Å; L142-I146 HydrophobicContact CD1-CD1 4.09Å; L142-I146 HydrophobicContact CD1-CG1 4.22Å; L142-I146 HydrophobicContact CG-CD1 3.88Å; L142-I146 HydrophobicContact CG-CG1 4.41Å; L142-I146 VanDerWaalsContact O-CG1 3.31Å; L142-I146 WeakPolarHBondContact O-CG1 3.45Å; L142-I146 PolarHBondContact O-N 2.9Å; A143-I146 PolarHBondContact O-N 3.11Å; I146-Q148 VanDerWaalsContact C-N 3.35Å; I146-Q148 PolarHBondContact O-N 3Å; I146-V149 PolarHBondContact O-N 3.43Å; I146-L150 HydrophobicContact CG2-CD1 3.91Å; I146-L150 HydrophobicContact CG2-CG 4.25Å; I146-L150 WeakPolarHBondContact O-CG 3.49Å; I146-L150 PolarHBondContact O-N 3.39Å; I146-M168 HydrophobicContact CG1-SD 4.35Å; I146-M168 HydrophobicContact CG2-CE 4.15Å; I146-M168 HydrophobicContact CG2-SD 3.98Å; I146-I179 HydrophobicContact CB-CD1 4.12Å; I146-I179 HydrophobicContact CG1-CD1 3.4Å; I146-I179 VanDerWaalsContact CG1-CD1 3.4Å; I146-F221 HydrophobicContact CB-CD2 3.96Å; I146-F221 HydrophobicContact CB-CE2 4.31Å; I146-F221 HydrophobicContact CG2-CD2 3.67Å; I146-F221 HydrophobicContact CG2-CE2 3.61Å
147	G	98.4	Very high	96.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-44.7	178.8	0	0	0	0	0	112.9	A143 K144 T145 A151 F221	A143-G147 PolarHBondContact O-N 2.64Å; K144-G147 PolarHBondContact O-N 3.39Å; T145-G147 VanDerWaalsContact C-N 3.27Å; T145-G147 PolarHBondContact O-N 3.14Å; G147-A151 WeakPolarHBondContact O-CB 3.35Å; G147-A151 PolarHBondContact O-N 3.12Å; G147-F221 VanDerWaalsContact CA-CD2 3.41Å; G147-F221 VanDerWaalsContact CA-CE2 3.42Å; G147-F221 VanDerWaalsContact N-CD2 3.31Å
148	Q	98.6	Very high	97.1	Very high	75 Å²	75	35 Å²	35	35%	0.35	18%	0.177	S	C	.	.	H	α-helix	trans	-66.6	-44.2	178	-71.6	169.6	-11.3	0	0	112.4	K144 T145 I146 R152 S228	K144-Q148 WeakPolarHBondContact O-CG 3.37Å; K144-Q148 PolarHBondContact O-N 2.83Å; T145-Q148 PolarHBondContact O-N 2.88Å; I146-Q148 VanDerWaalsContact C-N 3.35Å; I146-Q148 PolarHBondContact O-N 3Å; Q148-R152 PolarHBondContact O-N 3.06Å; Q148-R152 VanDerWaalsContact O-N 3.07Å; Q148-S228 WeakPolarHBondContact CG-OG 3.38Å
149	V	98.4	Very high	97.7	Very high	24 Å²	24	33.6 Å²	33.6	15%	0.145	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-47.6	-179.6	167.3	0	0	0	0	110.9	I96 T145 I146 R152 M153 I179 L181	I96-V149 HydrophobicContact CG2-CG1 3.9Å; T145-V149 WeakPolarHBondContact O-CG2 3.47Å; T145-V149 PolarHBondContact O-N 2.79Å; I146-V149 PolarHBondContact O-N 3.43Å; V149-R152 PolarHBondContact O-N 3.18Å; V149-M153 PolarHBondContact O-N 2.78Å; V149-I179 HydrophobicContact CG2-CB 4.39Å; V149-L181 HydrophobicContact CG1-CD1 3.92Å; V149-L181 HydrophobicContact CG1-CD2 4.14Å; V149-L181 HydrophobicContact CG1-CG 4.02Å
150	L	98.4	Very high	97.8	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-72.3	-34	-179.7	-65.4	-174.1	0	0	0	112.7	I146 R152 M153 H154 L163 M168 L181 L203 F221 Y225	I146-L150 HydrophobicContact CG2-CD1 3.91Å; I146-L150 HydrophobicContact CG2-CG 4.25Å; I146-L150 WeakPolarHBondContact O-CG 3.49Å; I146-L150 PolarHBondContact O-N 3.39Å; L150-R152 VanDerWaalsContact C-N 3.3Å; L150-R152 PolarHBondContact O-N 3.09Å; L150-M153 HydrophobicContact CD2-CE 3.94Å; L150-M153 HydrophobicContact CD2-SD 4.26Å; L150-M153 PolarHBondContact O-N 3.32Å; L150-H154 WeakPolarHBondContact O-CB 3.29Å; L150-H154 PolarHBondContact O-N 3.4Å; L150-L163 HydrophobicContact CD1-CD1 3.93Å; L150-L163 HydrophobicContact CD1-CD2 4.5Å; L150-L163 HydrophobicContact CD2-CD1 4.14Å; L150-L163 HydrophobicContact CD2-CD2 3.78Å; L150-M168 HydrophobicContact CD1-CE 3.96Å; L150-M168 HydrophobicContact CD2-CE 4.36Å; L150-L181 HydrophobicContact CD2-CD1 4.21Å; L150-L181 HydrophobicContact CD2-CD2 4.34Å; L150-L203 HydrophobicContact CD1-CD2 3.47Å; L150-L203 VanDerWaalsContact CD1-CD2 3.47Å; L150-F221 HydrophobicContact CB-CE2 4.39Å; L150-F221 HydrophobicContact CD1-CE2 3.78Å; L150-F221 HydrophobicContact CD1-CZ 3.79Å; L150-F221 HydrophobicContact CG-CE2 4.45Å; L150-Y225 HydrophobicContact CB-CD2 4.34Å; L150-Y225 HydrophobicContact CB-CE2 4.47Å
151	A	98.5	Very high	97.9	Very high	1 Å²	1	32 Å²	32	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-56.8	-45.8	170	0	0	0	0	0	111.4	G147 H154 D155 Y225	G147-A151 WeakPolarHBondContact O-CB 3.35Å; G147-A151 PolarHBondContact O-N 3.12Å; A151-H154 PolarHBondContact O-N 3.48Å; A151-D155 WeakPolarHBondContact O-CB 3.3Å; A151-D155 PolarHBondContact O-N 3.37Å; A151-Y225 VanDerWaalsContact CA-CE2 3.43Å; A151-Y225 HydrophobicContact CB-CD2 3.84Å; A151-Y225 HydrophobicContact CB-CE2 4.06Å; A151-Y225 HydrophobicContact CB-CG 4.37Å
152	R	98.4	Very high	97.9	Very high	123 Å²	123	29.6 Å²	29.6	46%	0.464	15%	0.147	S	C	.	.	H	α-helix	trans	-64.3	-42.3	177.3	-163.2	-179.9	-56.7	171.2	-2.1	112	A94 G95 I96 Q148 V149 L150 H154 D155 E156	A94-R152 WeakPolarHBondContact O-CD 3.45Å; G95-R152 PolarHBondContact O-NH1 3.27Å; I96-R152 HydrophobicContact CD1-CB 4.08Å; I96-R152 HydrophobicContact CD1-CG 4.16Å; I96-R152 HydrophobicContact CG1-CB 4.24Å; I96-R152 HydrophobicContact CG1-CG 4.15Å; Q148-R152 PolarHBondContact O-N 3.06Å; Q148-R152 VanDerWaalsContact O-N 3.07Å; V149-R152 PolarHBondContact O-N 3.18Å; L150-R152 VanDerWaalsContact C-N 3.3Å; L150-R152 PolarHBondContact O-N 3.09Å; R152-H154 VanDerWaalsContact C-N 3.35Å; R152-H154 PolarHBondContact O-N 2.95Å; R152-D155 PolarHBondContact O-N 2.99Å; R152-E156 WeakPolarHBondContact O-CG 3.3Å; R152-E156 PolarHBondContact O-N 3Å
153	M	98.3	Very high	97.8	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-58.8	-47.3	176.8	-170.2	-173.7	72.9	0	0	111.4	I96 V149 L150 E156 L158 H160 L163 L181 F184	I96-M153 HydrophobicContact CD1-CB 3.82Å; I96-M153 HydrophobicContact CD1-CG 4.46Å; V149-M153 PolarHBondContact O-N 2.78Å; L150-M153 HydrophobicContact CD2-CE 3.94Å; L150-M153 HydrophobicContact CD2-SD 4.26Å; L150-M153 PolarHBondContact O-N 3.32Å; M153-E156 WeakPolarHBondContact O-CB 3.17Å; M153-E156 PolarHBondContact O-N 2.68Å; M153-L158 HydrophobicContact CG-CB 4.03Å; M153-L158 HydrophobicContact CG-CD2 4.02Å; M153-L158 HydrophobicContact CG-CG 4.02Å; M153-L158 PolarHBondContact O-N 3.35Å; M153-H160 HydrophobicContact CE-CB 3.84Å; M153-H160 HydrophobicContact SD-CB 4.05Å; M153-L163 HydrophobicContact CE-CD1 4.21Å; M153-L163 HydrophobicContact CE-CD2 4.31Å; M153-L181 HydrophobicContact SD-CD1 3.76Å; M153-F184 HydrophobicContact SD-CE1 4.04Å; M153-F184 HydrophobicContact SD-CZ 4.47Å
154	H	98.6	Very high	97.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-71.8	-30.2	178.9	-75.5	176.1	0	0	0	113.5	L150 A151 R152 E156 D157 L158 K196 D199 Y225	L150-H154 WeakPolarHBondContact O-CB 3.29Å; L150-H154 PolarHBondContact O-N 3.4Å; A151-H154 PolarHBondContact O-N 3.48Å; R152-H154 VanDerWaalsContact C-N 3.35Å; R152-H154 PolarHBondContact O-N 2.95Å; H154-E156 PolarHBondContact O-N 3.02Å; H154-D157 PolarHBondContact O-N 3.14Å; H154-L158 PolarHBondContact CD2-O 3.13Å; H154-K196 HydrophobicContact CB-CD 4.03Å; H154-K196 HydrophobicContact CB-CG 4.18Å; H154-K196 PolarHBondContact CE1-O 3.02Å; H154-K196 WeakPolarHBondContact O-CE 3.4Å; H154-K196 PolarHBondContact O-NZ 2.87Å; H154-D199 IonicContact NE2-OD2 2.95Å; H154-D199 PolarHBondContact NE2-OD2 3.49Å; H154-Y225 HydrophobicContact CB-CE2 4.34Å; H154-Y225 WeakPolarHBondContact CB-OH 3.46Å; H154-Y225 AromaticContact ND1-CE2 3.48Å; H154-Y225 WeakPolarHBondContact ND1-CE2 3.23Å; H154-Y225 AromaticContact ND1-CZ 3.53Å; H154-Y225 PolarHBondContact ND1-OH 2.86Å
155	D	97.8	Very high	97.7	Very high	30 Å²	30	25.5 Å²	25.5	16%	0.16	13%	0.131	C	C	.	.	H	α-helix	trans	-66	-31.4	174.4	-83.3	-1.1	0	0	0	111.5	A151 R152 D157 S229 K230 K231	A151-D155 WeakPolarHBondContact O-CB 3.3Å; A151-D155 PolarHBondContact O-N 3.37Å; R152-D155 PolarHBondContact O-N 2.99Å; D155-D157 PolarHBondContact O-N 3.02Å; D155-S229 WeakPolarHBondContact OD1-CB 3.38Å; D155-S229 PolarHBondContact OD1-OG 3.46Å; D155-S229 WeakPolarHBondContact OD2-CA 3.41Å; D155-K230 PolarHBondContact OD1-N 3Å; D155-K230 PolarHBondContact OD2-N 2.82Å; D155-K231 PolarHBondContact O-NZ 3.01Å; D155-K231 VanDerWaalsContact O-NZ 3.14Å
156	E	97.3	Very high	97.6	Very high	86 Å²	86	25.7 Å²	25.7	40%	0.402	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	9.2	170.3	-67.5	-63.3	142.9	0	0	114	R90 A94 R152 M153 H154 L158	R90-E156 PolarHBondContact NE-O 3.5Å; R90-E156 PolarHBondContact NH2-O 3.08Å; A94-E156 HydrophobicContact CB-CG 3.62Å; R152-E156 WeakPolarHBondContact O-CG 3.3Å; R152-E156 PolarHBondContact O-N 3Å; M153-E156 WeakPolarHBondContact O-CB 3.17Å; M153-E156 PolarHBondContact O-N 2.68Å; H154-E156 PolarHBondContact O-N 3.02Å; E156-L158 PolarHBondContact O-N 2.87Å; E156-L158 VanDerWaalsContact O-N 3.1Å
157	D	97.7	Very high	97.6	Very high	33 Å²	33	26.1 Å²	26.1	18%	0.176	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	27.6	178.6	-57.9	-39.7	0	0	0	113.1	H154 D155 I189 S190 A191 K196 K231	H154-D157 PolarHBondContact O-N 3.14Å; D155-D157 PolarHBondContact O-N 3.02Å; D157-I189 CarbonylContact O-C 3.59Å; D157-I189 VanDerWaalsContact O-CA 3.3Å; D157-I189 WeakPolarHBondContact O-CA 3.43Å; D157-I189 WeakPolarHBondContact O-CG2 3.34Å; D157-S190 WeakPolarHBondContact CA-O 3.44Å; D157-S190 WeakPolarHBondContact CB-O 3.5Å; D157-S190 PolarHBondContact O-N 2.99Å; D157-A191 HydrophobicContact CB-CB 4.44Å; D157-A191 WeakPolarHBondContact OD1-CA 3.3Å; D157-K196 IonicContact OD1-NZ 3.38Å; D157-K196 PolarHBondContact OD1-NZ 2.8Å; D157-K231 IonicContact OD1-NZ 3.51Å; D157-K231 PolarHBondContact OD1-NZ 3.38Å; D157-K231 IonicContact OD2-NZ 3.45Å; D157-K231 PolarHBondContact OD2-NZ 3.37Å
158	L	98.1	Very high	97.6	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.4	173.1	177.2	62.1	0	0	0	109.3	A87 C91 M153 H154 E156 F184 I189	A87-L158 HydrophobicContact CB-CD1 3.97Å; C91-L158 WeakPolarHBondContact SG-CD2 3.41Å; M153-L158 HydrophobicContact CG-CB 4.03Å; M153-L158 HydrophobicContact CG-CD2 4.02Å; M153-L158 HydrophobicContact CG-CG 4.02Å; M153-L158 PolarHBondContact O-N 3.35Å; H154-L158 PolarHBondContact CD2-O 3.13Å; E156-L158 PolarHBondContact O-N 2.87Å; E156-L158 VanDerWaalsContact O-N 3.1Å; L158-F184 HydrophobicContact CD2-CD1 4.36Å; L158-F184 HydrophobicContact CD2-CE1 3.89Å; L158-F184 HydrophobicContact CG-CE1 4.39Å; L158-I189 HydrophobicContact CB-CD1 4.33Å; L158-I189 HydrophobicContact CD1-CD1 3.7Å
159	I	98.4	Very high	97.6	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.015	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.5	173	-48	-56.5	0	0	0	107.4	S187 F188 D195 K196 D199	I159-S187 CarbonylContact O-C 3.6Å; I159-S187 WeakPolarHBondContact O-CA 3.12Å; I159-S187 WeakPolarHBondContact O-CB 3.39Å; I159-F188 HydrophobicContact CB-CD1 4.2Å; I159-F188 HydrophobicContact CB-CD2 4.35Å; I159-F188 HydrophobicContact CB-CE1 3.93Å; I159-F188 HydrophobicContact CB-CE2 4.11Å; I159-F188 HydrophobicContact CB-CG 4.4Å; I159-F188 HydrophobicContact CB-CZ 3.89Å; I159-F188 HydrophobicContact CG1-CD2 4.26Å; I159-F188 HydrophobicContact CG1-CE2 3.87Å; I159-F188 HydrophobicContact CG1-CZ 4.03Å; I159-F188 HydrophobicContact CG2-CD1 4.38Å; I159-F188 HydrophobicContact CG2-CE1 3.69Å; I159-F188 HydrophobicContact CG2-CE2 4.4Å; I159-F188 HydrophobicContact CG2-CZ 3.71Å; I159-F188 PolarHBondContact N-O 3.38Å; I159-F188 PolarHBondContact O-N 2.7Å; I159-D195 HydrophobicContact CD1-CB 4.05Å; I159-D195 HydrophobicContact CG1-CB 3.96Å; I159-K196 HydrophobicContact CD1-CB 4.33Å; I159-K196 HydrophobicContact CD1-CG 3.44Å; I159-K196 VanDerWaalsContact CD1-CG 3.44Å; I159-D199 HydrophobicContact CG2-CB 3.91Å; I159-D199 WeakPolarHBondContact CG2-OD2 3.36Å
160	H	98.1	Very high	97.5	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.119	C	C	.	.			trans	-81.3	-39.9	179.6	-175.7	-58.1	0	0	0	111.2	M153 D162 L163 I182 D183 F184 L186 S187 D199	M153-H160 HydrophobicContact CE-CB 3.84Å; M153-H160 HydrophobicContact SD-CB 4.05Å; H160-D162 PolarHBondContact CE1-O 3.25Å; H160-D162 PolarHBondContact ND1-N 3.34Å; H160-D162 PolarHBondContact O-N 2.85Å; H160-L163 HydrophobicContact CB-CD2 3.51Å; H160-L163 HydrophobicContact CB-CG 3.71Å; H160-L163 VanDerWaalsContact CG-CD2 3.49Å; H160-I182 PolarHBondContact NE2-O 2.75Å; H160-D183 PolarHBondContact CE1-O 2.91Å; H160-F184 HydrophobicContact CB-CE1 4.34Å; H160-F184 AromaticContact CD2-CE1 3.69Å; H160-F184 AromaticContact CD2-CZ 3.93Å; H160-L186 CarbonylContact O-C 3.52Å; H160-S187 WeakPolarHBondContact O-CA 3.2Å; H160-S187 PolarHBondContact O-N 3.24Å; H160-S187 VanDerWaalsContact O-N 3.15Å; H160-D199 PolarHBondContact N-OD2 3.17Å
161	G	96.1	Very high	97.4	Very high	26 Å²	26	26.8 Å²	26.8	27%	0.268	14%	0.137	S	C	.	.	S	Bend	trans	77.9	1.2	173.9	0	0	0	0	0	115	D199	G161-D199 WeakPolarHBondContact CA-OD1 3.33Å; G161-D199 PolarHBondContact N-OD1 3.39Å
162	D	95.7	Very high	97.2	Very high	56 Å²	56	29.5 Å²	29.5	30%	0.299	16%	0.155	S	C	.	.	S	Bend	trans	-155.2	46.2	176.1	-168.5	34.4	0	0	0	110.2	H160 T164 N167 L186	H160-D162 PolarHBondContact CE1-O 3.25Å; H160-D162 PolarHBondContact ND1-N 3.34Å; H160-D162 PolarHBondContact O-N 2.85Å; D162-T164 PolarHBondContact O-N 3.14Å; D162-T164 VanDerWaalsContact O-N 3.09Å; D162-N167 PolarHBondContact O-ND2 3.27Å; D162-N167 PolarHBondContact OD2-ND2 2.71Å; D162-L186 HydrophobicContact CB-CD1 4.29Å
163	L	95.5	Very high	97.1	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.152	C	C	.	.			trans	-67.8	112	-179.5	-73.7	177.6	0	0	0	110.9	L150 M153 H160 M168 D199 L203	L150-L163 HydrophobicContact CD1-CD1 3.93Å; L150-L163 HydrophobicContact CD1-CD2 4.5Å; L150-L163 HydrophobicContact CD2-CD1 4.14Å; L150-L163 HydrophobicContact CD2-CD2 3.78Å; M153-L163 HydrophobicContact CE-CD1 4.21Å; M153-L163 HydrophobicContact CE-CD2 4.31Å; H160-L163 HydrophobicContact CB-CD2 3.51Å; H160-L163 HydrophobicContact CB-CG 3.71Å; H160-L163 VanDerWaalsContact CG-CD2 3.49Å; L163-M168 HydrophobicContact CD2-CE 4.15Å; L163-D199 HydrophobicContact CD1-CB 4.09Å; L163-D199 VanDerWaalsContact CD1-CG 3.42Å; L163-D199 WeakPolarHBondContact CD1-OD2 3.47Å; L163-L203 HydrophobicContact CB-CB 3.89Å; L163-L203 HydrophobicContact CB-CD1 4.34Å; L163-L203 WeakPolarHBondContact O-CA 3.13Å
164	T	96.4	Very high	96.8	Very high	29 Å²	29	29 Å²	29	18%	0.178	16%	0.164	C	C	.	.			trans	-138.1	160.1	171.8	72.1	0	0	0	0	109.6	D162 S166 N167 A206	D162-T164 PolarHBondContact O-N 3.14Å; D162-T164 VanDerWaalsContact O-N 3.09Å; T164-S166 PolarHBondContact O-N 3.31Å; T164-S166 PolarHBondContact OG1-N 3.27Å; T164-N167 PolarHBondContact O-N 3.42Å; T164-N167 PolarHBondContact OG1-N 3.15Å; T164-N167 PolarHBondContact OG1-ND2 2.89Å; T164-A206 HydrophobicContact CG2-CB 3.95Å
165	T	96.9	Very high	96.4	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.5	175	51.3	0	0	0	0	113.1	V122 R123 I126 F207 H211	V122-T165 WeakPolarHBondContact CB-O 3.33Å; V122-T165 HydrophobicContact CG1-CG2 4.17Å; V122-T165 PolarHBondContact N-O 3.3Å; R123-T165 PolarHBondContact N-O 3.39Å; I126-T165 HydrophobicContact CD1-CG2 4.15Å; T165-F207 HydrophobicContact CG2-CD2 3.43Å; T165-F207 VanDerWaalsContact CG2-CD2 3.43Å; T165-F207 HydrophobicContact CG2-CE2 3.87Å; T165-F207 HydrophobicContact CG2-CG 4.43Å; T165-H211 PolarHBondContact OG1-NE2 2.96Å
166	S	96.1	Very high	96.2	Very high	39 Å²	39	40.8 Å²	40.8	27%	0.273	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.2	173.5	-59.8	0	0	0	0	113.2	R123 T164 M168	R123-S166 VanDerWaalsContact CD-OG 3.3Å; R123-S166 WeakPolarHBondContact CD-OG 3.04Å; T164-S166 PolarHBondContact O-N 3.31Å; T164-S166 PolarHBondContact OG1-N 3.27Å; S166-M168 VanDerWaalsContact C-N 3.28Å
167	N	97.3	Very high	96.1	Very high	15 Å²	15	37.6 Å²	37.6	8%	0.08	20%	0.204	C	C	.	.	S	Bend	trans	-93.8	14.5	175.6	-68.3	-21.9	0	0	0	112.3	D162 T164 I182	D162-N167 PolarHBondContact O-ND2 3.27Å; D162-N167 PolarHBondContact OD2-ND2 2.71Å; T164-N167 PolarHBondContact O-N 3.42Å; T164-N167 PolarHBondContact OG1-N 3.15Å; T164-N167 PolarHBondContact OG1-ND2 2.89Å; N167-I182 HydrophobicContact CB-CG1 4.44Å; N167-I182 VanDerWaalsContact O-CG1 3.26Å; N167-I182 WeakPolarHBondContact O-CG1 3.05Å; N167-I182 PolarHBondContact O-N 3.07Å
168	M	98.4	Very high	96.1	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130	173.8	-56.6	178	-168.4	0	0	108.5	T121 V122 I146 L150 L163 S166 I179 L181 L203	T121-M168 WeakPolarHBondContact CA-O 3.08Å; V122-M168 HydrophobicContact CB-CB 3.93Å; V122-M168 HydrophobicContact CG2-CB 3.52Å; V122-M168 PolarHBondContact N-O 2.95Å; I146-M168 HydrophobicContact CG1-SD 4.35Å; I146-M168 HydrophobicContact CG2-CE 4.15Å; I146-M168 HydrophobicContact CG2-SD 3.98Å; L150-M168 HydrophobicContact CD1-CE 3.96Å; L150-M168 HydrophobicContact CD2-CE 4.36Å; L163-M168 HydrophobicContact CD2-CE 4.15Å; S166-M168 VanDerWaalsContact C-N 3.28Å; M168-I179 HydrophobicContact CB-CG2 4.26Å; M168-L181 HydrophobicContact CG-CD2 3.83Å; M168-L203 HydrophobicContact CE-CD1 3.97Å; M168-L203 HydrophobicContact CE-CD2 4.12Å
169	L	98.3	Very high	96.1	Very high	22 Å²	22	39.2 Å²	39.2	12%	0.115	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.5	176.8	-56.1	178.1	0	0	0	110	I116 V120 T121 I179 V180 I182	I116-L169 HydrophobicContact CB-CD1 4.11Å; I116-L169 HydrophobicContact CG1-CD1 4.09Å; V120-L169 CarbonylContact O-C 3.54Å; V120-L169 WeakPolarHBondContact O-CA 3.32Å; T121-L169 HydrophobicContact CG2-CD2 3.94Å; L169-I179 CarbonylContact O-C 3.43Å; L169-I179 VanDerWaalsContact O-CA 3.31Å; L169-I179 WeakPolarHBondContact O-CA 3.17Å; L169-V180 HydrophobicContact CB-CB 4.28Å; L169-V180 PolarHBondContact N-O 3.49Å; L169-V180 PolarHBondContact O-N 2.85Å; L169-I182 HydrophobicContact CD1-CD1 4.08Å; L169-I182 HydrophobicContact CD1-CG2 3.75Å; L169-I182 HydrophobicContact CD2-CD1 4.03Å; L169-I182 HydrophobicContact CG-CD1 3.93Å; L169-I182 HydrophobicContact CG-CG1 4.33Å; L169-I182 HydrophobicContact CG-CG2 4.11Å
170	L	98.3	Very high	96.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.2	166.5	-69.1	173.9	0	0	0	108.7	S119 V120 V122 Y125 L142 L174 L177 I179	S119-L170 WeakPolarHBondContact CA-O 3.49Å; S119-L170 VanDerWaalsContact CB-O 3.25Å; S119-L170 WeakPolarHBondContact CB-O 3.43Å; V120-L170 HydrophobicContact CG2-CB 4.1Å; V120-L170 PolarHBondContact N-O 3Å; V120-L170 PolarHBondContact O-N 2.87Å; V122-L170 HydrophobicContact CG2-CD1 4.39Å; V122-L170 HydrophobicContact CG2-CD2 4.24Å; V122-L170 HydrophobicContact CG2-CG 3.88Å; Y125-L170 HydrophobicContact CD1-CD1 3.73Å; Y125-L170 HydrophobicContact CD2-CD1 3.66Å; Y125-L170 HydrophobicContact CE1-CD1 4.27Å; Y125-L170 HydrophobicContact CE2-CD1 4.19Å; Y125-L170 HydrophobicContact CG-CD1 3.4Å; Y125-L170 VanDerWaalsContact CG-CD1 3.4Å; L142-L170 HydrophobicContact CD1-CD1 4.26Å; L142-L170 HydrophobicContact CD1-CD2 4.09Å; L170-L174 HydrophobicContact CB-CD2 3.92Å; L170-L177 HydrophobicContact CD1-CD2 4.5Å; L170-I179 HydrophobicContact CD2-CG1 3.69Å
171	K	95.8	Very high	96.1	Very high	90 Å²	90	39.2 Å²	39.2	39%	0.391	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.5	175.2	-171.3	177.7	179.4	170.7	0	109.5	I116 N178 V180	I116-K171 HydrophobicContact CG2-CB 4.12Å; I116-K171 HydrophobicContact CG2-CD 4.23Å; I116-K171 HydrophobicContact CG2-CG 3.99Å; K171-N178 HydrophobicContact CB-CB 4.18Å; K171-N178 PolarHBondContact N-O 2.92Å; K171-V180 HydrophobicContact CB-CG2 4.22Å
172	P	94.1	Very high	96.1	Very high	58 Å²	58	39.9 Å²	39.9	38%	0.377	21%	0.21	S	C	.	.	S	Bend	trans	-62.1	150.7	174.3	25.9	-34.6	0	0	0	111.3	G118	G118-P172 WeakPolarHBondContact O-CD 3.27Å
173	P	95.6	Very high	96.1	Very high	61 Å²	61	39.6 Å²	39.6	40%	0.396	21%	0.209	S	C	.	.	S	Bend	cis	-74.1	139.3	-3.2	32.4	-35.6	0	0	0	112	E175 Q176	P173-E175 VanDerWaalsContact C-N 3.25Å; P173-E175 WeakPolarHBondContact CB-OE2 3.48Å; P173-E175 PolarHBondContact O-N 3.38Å; P173-Q176 HydrophobicContact CG-CG 3.92Å; P173-Q176 PolarHBondContact O-N 2.84Å
174	L	92.5	Very high	96.1	Very high	51 Å²	51	39.6 Å²	39.6	27%	0.267	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-67.8	-26.1	-166.9	-61.4	-177.8	0	0	0	113	V120 Y125 L170 Q176 L177	V120-L174 HydrophobicContact CG2-CD1 4.29Å; V120-L174 HydrophobicContact CG2-CD2 3.78Å; Y125-L174 HydrophobicContact CD2-CD1 4.14Å; Y125-L174 HydrophobicContact CE2-CB 4.17Å; Y125-L174 HydrophobicContact CE2-CD1 4.19Å; L170-L174 HydrophobicContact CB-CD2 3.92Å; L174-Q176 PolarHBondContact O-N 3.34Å; L174-L177 WeakPolarHBondContact O-CD2 3.42Å; L174-L177 PolarHBondContact O-N 3.09Å
175	E	89.9	Confident	95.9	Very high	159 Å²	159	38.5 Å²	38.5	74%	0.743	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-62.6	-24	178.8	-55.5	75.9	-166.4	0	0	112	P173 L177	P173-E175 VanDerWaalsContact C-N 3.25Å; P173-E175 WeakPolarHBondContact CB-OE2 3.48Å; P173-E175 PolarHBondContact O-N 3.38Å; E175-L177 VanDerWaalsContact C-N 3.29Å
176	Q	93.6	Very high	95.8	Very high	119 Å²	119	42.7 Å²	42.7	56%	0.556	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-79.6	-13	175.9	-66.4	179.8	7.8	0	0	113	P173 L174 N178	P173-Q176 HydrophobicContact CG-CG 3.92Å; P173-Q176 PolarHBondContact O-N 2.84Å; L174-Q176 PolarHBondContact O-N 3.34Å; Q176-N178 PolarHBondContact O-N 2.97Å; Q176-N178 PolarHBondContact OE1-ND2 3.45Å
177	L	95.7	Very high	95.8	Very high	19 Å²	19	40.9 Å²	40.9	10%	0.099	21%	0.212	C	C	.	.			trans	51.4	41.3	-179.3	-58.3	171.9	0	0	0	112.7	Y125 N141 L142 L170 L174 E175 I179	Y125-L177 HydrophobicContact CE1-CD2 4.38Å; N141-L177 HydrophobicContact CB-CD1 3.69Å; L142-L177 HydrophobicContact CB-CD1 4.46Å; L142-L177 HydrophobicContact CB-CD2 4.34Å; L142-L177 HydrophobicContact CD1-CD2 4.18Å; L170-L177 HydrophobicContact CD1-CD2 4.5Å; L174-L177 WeakPolarHBondContact O-CD2 3.42Å; L174-L177 PolarHBondContact O-N 3.09Å; E175-L177 VanDerWaalsContact C-N 3.29Å; L177-I179 PolarHBondContact O-N 3.19Å
178	N	96.5	Very high	95.8	Very high	63 Å²	63	43.6 Å²	43.6	34%	0.337	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	90.2	-179.4	-72.8	-35	0	0	0	110.7	K171 Q176	K171-N178 HydrophobicContact CB-CB 4.18Å; K171-N178 PolarHBondContact N-O 2.92Å; Q176-N178 PolarHBondContact O-N 2.97Å; Q176-N178 PolarHBondContact OE1-ND2 3.45Å
179	I	98.2	Very high	95.8	Very high	7 Å²	7	48 Å²	48	4%	0.036	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	126.9	-179.3	-62.2	169.3	0	0	0	110.5	S97 L142 T145 I146 V149 M168 L169 L170 L177 L181	S97-I179 WeakPolarHBondContact CB-O 3.45Å; L142-I179 HydrophobicContact CD1-CD1 4.34Å; T145-I179 HydrophobicContact CG2-CD1 3.73Å; T145-I179 HydrophobicContact CG2-CG1 4.26Å; I146-I179 HydrophobicContact CB-CD1 4.12Å; I146-I179 HydrophobicContact CG1-CD1 3.4Å; I146-I179 VanDerWaalsContact CG1-CD1 3.4Å; V149-I179 HydrophobicContact CG2-CB 4.39Å; M168-I179 HydrophobicContact CB-CG2 4.26Å; L169-I179 CarbonylContact O-C 3.43Å; L169-I179 VanDerWaalsContact O-CA 3.31Å; L169-I179 WeakPolarHBondContact O-CA 3.17Å; L170-I179 HydrophobicContact CD2-CG1 3.69Å; L177-I179 PolarHBondContact O-N 3.19Å; I179-L181 HydrophobicContact CG2-CD2 4.11Å
180	V	98.6	Very high	95.7	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.03	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.4	170.7	-171.8	0	0	0	0	108.9	S97 I116 L169 K171 I182	S97-V180 WeakPolarHBondContact O-CA 3.28Å; I116-V180 HydrophobicContact CD1-CG1 4.14Å; I116-V180 HydrophobicContact CG1-CG1 4.1Å; I116-V180 HydrophobicContact CG2-CG2 4.25Å; L169-V180 HydrophobicContact CB-CB 4.28Å; L169-V180 PolarHBondContact N-O 3.49Å; L169-V180 PolarHBondContact O-N 2.85Å; K171-V180 HydrophobicContact CB-CG2 4.22Å; V180-I182 HydrophobicContact CG1-CG2 4.45Å
181	L	98.4	Very high	95.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	136.2	174.8	-59.5	-176.2	0	0	0	110.6	I96 S97 P99 V149 L150 M153 M168 I179 F184	I96-L181 HydrophobicContact CG2-CD1 3.89Å; I96-L181 HydrophobicContact CG2-CG 4.18Å; S97-L181 PolarHBondContact O-N 3.23Å; P99-L181 VanDerWaalsContact CD-O 3.28Å; P99-L181 WeakPolarHBondContact CD-O 3.35Å; V149-L181 HydrophobicContact CG1-CD1 3.92Å; V149-L181 HydrophobicContact CG1-CD2 4.14Å; V149-L181 HydrophobicContact CG1-CG 4.02Å; L150-L181 HydrophobicContact CD2-CD1 4.21Å; L150-L181 HydrophobicContact CD2-CD2 4.34Å; M153-L181 HydrophobicContact SD-CD1 3.76Å; M168-L181 HydrophobicContact CG-CD2 3.83Å; I179-L181 HydrophobicContact CG2-CD2 4.11Å; L181-F184 HydrophobicContact CB-CE2 3.85Å; L181-F184 HydrophobicContact CB-CZ 3.7Å; L181-F184 HydrophobicContact CD1-CZ 4.07Å
182	I	97.2	Very high	95.8	Very high	39 Å²	39	51.4 Å²	51.4	20%	0.2	28%	0.278	C	S	.	.			trans	-133.1	167	-179.7	62.9	163.5	0	0	0	111	P99 H160 N167 L169 V180	P99-I182 HydrophobicContact CG-CG2 3.79Å; H160-I182 PolarHBondContact NE2-O 2.75Å; N167-I182 HydrophobicContact CB-CG1 4.44Å; N167-I182 VanDerWaalsContact O-CG1 3.26Å; N167-I182 WeakPolarHBondContact O-CG1 3.05Å; N167-I182 PolarHBondContact O-N 3.07Å; L169-I182 HydrophobicContact CD1-CD1 4.08Å; L169-I182 HydrophobicContact CD1-CG2 3.75Å; L169-I182 HydrophobicContact CD2-CD1 4.03Å; L169-I182 HydrophobicContact CG-CD1 3.93Å; L169-I182 HydrophobicContact CG-CG1 4.33Å; L169-I182 HydrophobicContact CG-CG2 4.11Å; V180-I182 HydrophobicContact CG1-CG2 4.45Å
183	D	94.9	Very high	96	Very high	51 Å²	51	51 Å²	51	27%	0.273	28%	0.276	S	S	.	.			trans	58.5	68.4	177.9	-155	-25.5	0	0	0	115.5	K60 H160 G185	K60-D183 IonicContact NZ-OD1 3.84Å; K60-D183 PolarHBondContact NZ-OD1 3.32Å; K60-D183 IonicContact NZ-OD2 3.9Å; K60-D183 PolarHBondContact NZ-OD2 2.84Å; H160-D183 PolarHBondContact CE1-O 2.91Å; D183-G185 PolarHBondContact O-N 3.14Å; D183-G185 VanDerWaalsContact O-N 3.11Å; D183-G185 PolarHBondContact OD1-N 3.11Å; D183-G185 VanDerWaalsContact OD1-N 3.14Å
184	F	95.9	Very high	96.1	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	27%	0.268	C	S	.	.			trans	-83.1	29.4	171.5	-73.1	-87.7	0	0	0	112.7	E84 A87 L88 C91 M153 L158 H160 L181 L186 S187	E84-F184 HydrophobicContact CG-CB 4.12Å; A87-F184 HydrophobicContact CB-CB 3.58Å; A87-F184 HydrophobicContact CB-CD1 3.77Å; A87-F184 HydrophobicContact CB-CG 3.74Å; L88-F184 HydrophobicContact CD2-CD2 3.59Å; L88-F184 HydrophobicContact CD2-CE2 3.93Å; L88-F184 HydrophobicContact CG-CD2 4.1Å; C91-F184 WeakPolarHBondContact SG-CZ 3.41Å; M153-F184 HydrophobicContact SD-CE1 4.04Å; M153-F184 HydrophobicContact SD-CZ 4.47Å; L158-F184 HydrophobicContact CD2-CD1 4.36Å; L158-F184 HydrophobicContact CD2-CE1 3.89Å; L158-F184 HydrophobicContact CG-CE1 4.39Å; H160-F184 HydrophobicContact CB-CE1 4.34Å; H160-F184 AromaticContact CD2-CE1 3.69Å; H160-F184 AromaticContact CD2-CZ 3.93Å; L181-F184 HydrophobicContact CB-CE2 3.85Å; L181-F184 HydrophobicContact CB-CZ 3.7Å; L181-F184 HydrophobicContact CD1-CZ 4.07Å; F184-L186 VanDerWaalsContact C-N 3.25Å; F184-L186 PolarHBondContact O-N 2.86Å; F184-S187 WeakPolarHBondContact CB-OG 3.49Å; F184-S187 VanDerWaalsContact O-CB 3.28Å; F184-S187 WeakPolarHBondContact O-CB 3.27Å; F184-S187 PolarHBondContact O-N 2.9Å; F184-S187 VanDerWaalsContact O-N 3.12Å; F184-S187 PolarHBondContact O-OG 3.12Å
185	G	92.1	Very high	96.4	Very high	6 Å²	6	50 Å²	50	6%	0.062	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.2	-171.7	0	0	0	0	0	115.4	D183	D183-G185 PolarHBondContact O-N 3.14Å; D183-G185 VanDerWaalsContact O-N 3.11Å; D183-G185 PolarHBondContact OD1-N 3.11Å; D183-G185 VanDerWaalsContact OD1-N 3.14Å
186	L	93.8	Very high	96.8	Very high	89 Å²	89	42.5 Å²	42.5	47%	0.466	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	7.5	175.9	-59.2	-176.6	0	0	0	112.6	H160 D162 F184	H160-L186 CarbonylContact O-C 3.52Å; D162-L186 HydrophobicContact CB-CD1 4.29Å; F184-L186 VanDerWaalsContact C-N 3.25Å; F184-L186 PolarHBondContact O-N 2.86Å
187	S	96.8	Very high	97	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.007	20%	0.204	C	C	.	.			trans	-66.9	153.7	-174.5	68.6	0	0	0	0	112.7	Q83 A87 I159 H160 F184	Q83-S187 WeakPolarHBondContact CG-O 3.2Å; Q83-S187 PolarHBondContact NE2-O 3.2Å; A87-S187 VanDerWaalsContact CB-OG 3.27Å; A87-S187 WeakPolarHBondContact CB-OG 3.38Å; I159-S187 CarbonylContact O-C 3.6Å; I159-S187 WeakPolarHBondContact O-CA 3.12Å; I159-S187 WeakPolarHBondContact O-CB 3.39Å; H160-S187 WeakPolarHBondContact O-CA 3.2Å; H160-S187 PolarHBondContact O-N 3.24Å; H160-S187 VanDerWaalsContact O-N 3.15Å; F184-S187 WeakPolarHBondContact CB-OG 3.49Å; F184-S187 VanDerWaalsContact O-CB 3.28Å; F184-S187 WeakPolarHBondContact O-CB 3.27Å; F184-S187 PolarHBondContact O-N 2.9Å; F184-S187 VanDerWaalsContact O-N 3.12Å; F184-S187 PolarHBondContact O-OG 3.12Å
188	F	97.1	Very high	97.1	Very high	73 Å²	73	38.7 Å²	38.7	32%	0.32	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	166.5	173.7	60.3	-82.6	0	0	0	110.9	I159 D195	I159-F188 HydrophobicContact CB-CD1 4.2Å; I159-F188 HydrophobicContact CB-CD2 4.35Å; I159-F188 HydrophobicContact CB-CE1 3.93Å; I159-F188 HydrophobicContact CB-CE2 4.11Å; I159-F188 HydrophobicContact CB-CG 4.4Å; I159-F188 HydrophobicContact CB-CZ 3.89Å; I159-F188 HydrophobicContact CG1-CD2 4.26Å; I159-F188 HydrophobicContact CG1-CE2 3.87Å; I159-F188 HydrophobicContact CG1-CZ 4.03Å; I159-F188 HydrophobicContact CG2-CD1 4.38Å; I159-F188 HydrophobicContact CG2-CE1 3.69Å; I159-F188 HydrophobicContact CG2-CE2 4.4Å; I159-F188 HydrophobicContact CG2-CZ 3.71Å; I159-F188 PolarHBondContact N-O 3.38Å; I159-F188 PolarHBondContact O-N 2.7Å; F188-D195 HydrophobicContact CE2-CB 3.99Å; F188-D195 HydrophobicContact CZ-CB 3.98Å
189	I	97.6	Very high	97.2	Very high	94 Å²	94	35.8 Å²	35.8	48%	0.482	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.4	177.2	-56.8	-52.2	0	0	0	108.6	R90 D157 L158	R90-I189 VanDerWaalsContact NH1-CD1 3.3Å; D157-I189 CarbonylContact O-C 3.59Å; D157-I189 VanDerWaalsContact O-CA 3.3Å; D157-I189 WeakPolarHBondContact O-CA 3.43Å; D157-I189 WeakPolarHBondContact O-CG2 3.34Å; L158-I189 HydrophobicContact CB-CD1 4.33Å; L158-I189 HydrophobicContact CD1-CD1 3.7Å
190	S	98.1	Very high	97.2	Very high	15 Å²	15	35.5 Å²	35.5	11%	0.105	20%	0.199	C	C	.	.			trans	-153.8	130.8	173.4	-175.7	0	0	0	0	111.9	D157 L192 D195 K196	D157-S190 WeakPolarHBondContact CA-O 3.44Å; D157-S190 WeakPolarHBondContact CB-O 3.5Å; D157-S190 PolarHBondContact O-N 2.99Å; S190-L192 VanDerWaalsContact C-N 3.3Å; S190-L192 WeakPolarHBondContact OG-CB 3.43Å; S190-L192 PolarHBondContact OG-N 3.15Å; S190-L192 VanDerWaalsContact OG-N 3.13Å; S190-D195 WeakPolarHBondContact CB-OD2 3.5Å; S190-D195 PolarHBondContact OG-OD2 3.36Å; S190-K196 WeakPolarHBondContact O-CE 3.44Å
191	A	97.6	Very high	97.1	Very high	64 Å²	64	37.3 Å²	37.3	53%	0.529	21%	0.205	S	C	.	.			trans	-84.4	-7.8	171.7	0	0	0	0	0	112.7	D157	D157-A191 HydrophobicContact CB-CB 4.44Å; D157-A191 WeakPolarHBondContact OD1-CA 3.3Å
192	L	98.3	Very high	97	Very high	105 Å²	105	39.7 Å²	39.7	55%	0.55	22%	0.22	S	C	.	.			trans	-68.7	130.1	-174.2	-61	179.3	0	0	0	110.8	S190 E194 D195	S190-L192 VanDerWaalsContact C-N 3.3Å; S190-L192 WeakPolarHBondContact OG-CB 3.43Å; S190-L192 PolarHBondContact OG-N 3.15Å; S190-L192 VanDerWaalsContact OG-N 3.13Å; L192-E194 PolarHBondContact O-N 2.93Å; L192-D195 PolarHBondContact O-N 3.38Å
193	P	98.2	Very high	97	Very high	50 Å²	50	38 Å²	38	33%	0.325	21%	0.211	S	C	.	.	H	α-helix	trans	-60.6	-26.6	172.6	-25.6	35.1	0	0	0	113.8	G197 P234 V235	P193-G197 PolarHBondContact O-N 3.31Å; P193-P234 HydrophobicContact CB-CB 4.13Å; P193-P234 HydrophobicContact CG-CB 4.02Å; P193-P234 HydrophobicContact CG-CG 4.48Å; P193-V235 HydrophobicContact CB-CG2 4.24Å
194	E	97.9	Very high	97.1	Very high	49 Å²	49	36.7 Å²	36.7	23%	0.229	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-51.8	175.5	179.2	76.2	175.2	0	0	111.5	L192 K196 G197 V198 K238 R245	L192-E194 PolarHBondContact O-N 2.93Å; E194-K196 VanDerWaalsContact C-N 3.28Å; E194-K196 PolarHBondContact O-N 3.46Å; E194-G197 PolarHBondContact O-N 2.88Å; E194-G197 VanDerWaalsContact O-N 3.09Å; E194-V198 WeakPolarHBondContact O-CG2 3.46Å; E194-V198 PolarHBondContact O-N 2.64Å; E194-K238 VanDerWaalsContact CA-CG 3.42Å; E194-K238 HydrophobicContact CB-CG 4.04Å; E194-K238 WeakPolarHBondContact OE2-CD 3.49Å; E194-K238 WeakPolarHBondContact OE2-CE 3.45Å; E194-K238 WeakPolarHBondContact OE2-CG 3.4Å; E194-K238 IonicContact OE2-NZ 2.85Å; E194-K238 PolarHBondContact OE2-NZ 3.19Å; E194-R245 VanDerWaalsContact CD-NH2 3.34Å; E194-R245 IonicContact OE1-CZ 3.19Å; E194-R245 VanDerWaalsContact OE1-CZ 3.27Å; E194-R245 IonicContact OE1-NH1 3.38Å; E194-R245 PolarHBondContact OE1-NH1 3.02Å; E194-R245 IonicContact OE1-NH2 2.7Å; E194-R245 PolarHBondContact OE1-NH2 3.11Å; E194-R245 IonicContact OE2-CZ 2.81Å; E194-R245 IonicContact OE2-NH1 2.8Å; E194-R245 IonicContact OE2-NH2 3.96Å; E194-R245 PolarHBondContact OE2-NH2 2.87Å
195	D	98.3	Very high	97.1	Very high	40 Å²	40	42.1 Å²	42.1	21%	0.214	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-38.5	-176.5	-62.9	-36.3	0	0	0	111.4	I159 F188 S190 L192 V198 D199	I159-D195 HydrophobicContact CD1-CB 4.05Å; I159-D195 HydrophobicContact CG1-CB 3.96Å; F188-D195 HydrophobicContact CE2-CB 3.99Å; F188-D195 HydrophobicContact CZ-CB 3.98Å; S190-D195 WeakPolarHBondContact CB-OD2 3.5Å; S190-D195 PolarHBondContact OG-OD2 3.36Å; L192-D195 PolarHBondContact O-N 3.38Å; D195-V198 PolarHBondContact O-N 2.76Å; D195-D199 PolarHBondContact O-N 2.89Å
196	K	98.4	Very high	97.1	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-41.2	174.5	-61.8	170.9	-174.3	-172.1	0	111.6	H154 D157 I159 S190 E194 D199 L200 V235	H154-K196 HydrophobicContact CB-CD 4.03Å; H154-K196 HydrophobicContact CB-CG 4.18Å; H154-K196 PolarHBondContact CE1-O 3.02Å; H154-K196 WeakPolarHBondContact O-CE 3.4Å; H154-K196 PolarHBondContact O-NZ 2.87Å; D157-K196 IonicContact OD1-NZ 3.38Å; D157-K196 PolarHBondContact OD1-NZ 2.8Å; I159-K196 HydrophobicContact CD1-CB 4.33Å; I159-K196 HydrophobicContact CD1-CG 3.44Å; I159-K196 VanDerWaalsContact CD1-CG 3.44Å; S190-K196 WeakPolarHBondContact O-CE 3.44Å; E194-K196 VanDerWaalsContact C-N 3.28Å; E194-K196 PolarHBondContact O-N 3.46Å; K196-D199 PolarHBondContact O-N 2.79Å; K196-L200 WeakPolarHBondContact O-CG 3.49Å; K196-L200 PolarHBondContact O-N 3.15Å; K196-V235 HydrophobicContact CB-CB 4.4Å; K196-V235 HydrophobicContact CB-CG1 3.66Å; K196-V235 HydrophobicContact CB-CG2 3.81Å; K196-V235 HydrophobicContact CD-CG2 3.71Å; K196-V235 HydrophobicContact CG-CG2 4.38Å
197	G	98.1	Very high	97.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-39.8	176.1	0	0	0	0	0	112.2	P193 E194 Y201	P193-G197 PolarHBondContact O-N 3.31Å; E194-G197 PolarHBondContact O-N 2.88Å; E194-G197 VanDerWaalsContact O-N 3.09Å; G197-Y201 WeakPolarHBondContact O-CB 3.21Å; G197-Y201 PolarHBondContact O-N 2.95Å
198	V	97.9	Very high	97	Very high	57 Å²	57	41.4 Å²	41.4	35%	0.345	22%	0.224	S	C	.	.	H	α-helix	trans	-66	-42.9	174	173.2	0	0	0	0	111	E194 D195 L200 Y201 V202 V242	E194-V198 WeakPolarHBondContact O-CG2 3.46Å; E194-V198 PolarHBondContact O-N 2.64Å; D195-V198 PolarHBondContact O-N 2.76Å; V198-L200 PolarHBondContact O-N 3.36Å; V198-Y201 WeakPolarHBondContact O-CB 3.42Å; V198-Y201 PolarHBondContact O-N 3.21Å; V198-Y201 VanDerWaalsContact O-N 3.11Å; V198-V202 HydrophobicContact CG1-CG2 4.5Å; V198-V202 WeakPolarHBondContact O-CG2 3.44Å; V198-V202 PolarHBondContact O-N 3.24Å; V198-V242 HydrophobicContact CG2-CG1 4.38Å; V198-V242 HydrophobicContact CG2-CG2 3.83Å
199	D	98.1	Very high	96.7	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-43.2	178	-145.5	19.5	0	0	0	111.4	H154 I159 H160 G161 L163 D195 K196 Y201 V202 L203	H154-D199 IonicContact NE2-OD2 2.95Å; H154-D199 PolarHBondContact NE2-OD2 3.49Å; I159-D199 HydrophobicContact CG2-CB 3.91Å; I159-D199 WeakPolarHBondContact CG2-OD2 3.36Å; H160-D199 PolarHBondContact N-OD2 3.17Å; G161-D199 WeakPolarHBondContact CA-OD1 3.33Å; G161-D199 PolarHBondContact N-OD1 3.39Å; L163-D199 HydrophobicContact CD1-CB 4.09Å; L163-D199 VanDerWaalsContact CD1-CG 3.42Å; L163-D199 WeakPolarHBondContact CD1-OD2 3.47Å; D195-D199 PolarHBondContact O-N 2.89Å; K196-D199 PolarHBondContact O-N 2.79Å; D199-Y201 VanDerWaalsContact C-N 3.32Å; D199-Y201 PolarHBondContact O-N 2.82Å; D199-V202 PolarHBondContact O-N 2.82Å; D199-L203 PolarHBondContact O-N 2.82Å; D199-L203 VanDerWaalsContact O-N 3.14Å
200	L	98.3	Very high	96.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-37	172.7	-68.3	-177	0	0	0	112.6	K196 V198 L203 E204 F221 Y225 V235 L236 L239	K196-L200 WeakPolarHBondContact O-CG 3.49Å; K196-L200 PolarHBondContact O-N 3.15Å; V198-L200 PolarHBondContact O-N 3.36Å; L200-L203 PolarHBondContact O-N 3.07Å; L200-E204 PolarHBondContact O-N 3.26Å; L200-F221 HydrophobicContact CD2-CE1 4.04Å; L200-F221 HydrophobicContact CD2-CZ 3.7Å; L200-Y225 HydrophobicContact CD1-CD1 4.21Å; L200-Y225 HydrophobicContact CD1-CE1 3.93Å; L200-Y225 HydrophobicContact CD1-CE2 4.29Å; L200-Y225 HydrophobicContact CD2-CD2 4.17Å; L200-Y225 HydrophobicContact CD2-CE2 4.06Å; L200-V235 HydrophobicContact CD1-CG1 3.77Å; L200-L236 HydrophobicContact CD1-CD2 4.28Å; L200-L239 HydrophobicContact CB-CD1 4.21Å; L200-L239 HydrophobicContact CB-CD2 4.24Å; L200-L239 HydrophobicContact CD1-CD2 4.33Å
201	Y	97.1	Very high	96.1	Very high	44 Å²	44	40.2 Å²	40.2	17%	0.173	23%	0.231	C	C	.	.	H	α-helix	trans	-68.5	-38.7	177.5	-178.2	-106.5	0	0	0	112.1	G197 V198 D199 L203 E204 K205 L239 V242 R243	G197-Y201 WeakPolarHBondContact O-CB 3.21Å; G197-Y201 PolarHBondContact O-N 2.95Å; V198-Y201 WeakPolarHBondContact O-CB 3.42Å; V198-Y201 PolarHBondContact O-N 3.21Å; V198-Y201 VanDerWaalsContact O-N 3.11Å; D199-Y201 VanDerWaalsContact C-N 3.32Å; D199-Y201 PolarHBondContact O-N 2.82Å; Y201-L203 VanDerWaalsContact C-N 3.31Å; Y201-L203 PolarHBondContact O-N 2.86Å; Y201-E204 WeakPolarHBondContact O-CB 3.14Å; Y201-E204 PolarHBondContact O-N 2.99Å; Y201-K205 HydrophobicContact CD1-CG 4.32Å; Y201-K205 HydrophobicContact CD2-CG 4.48Å; Y201-K205 HydrophobicContact CE1-CD 4.5Å; Y201-K205 HydrophobicContact CE1-CG 3.87Å; Y201-K205 HydrophobicContact CE2-CD 4.05Å; Y201-K205 HydrophobicContact CE2-CG 4.04Å; Y201-K205 WeakPolarHBondContact O-CG 3.24Å; Y201-K205 PolarHBondContact O-N 2.65Å; Y201-L239 HydrophobicContact CD2-CD1 4.25Å; Y201-L239 HydrophobicContact CG-CD1 4.5Å; Y201-V242 HydrophobicContact CD1-CG1 3.64Å; Y201-V242 HydrophobicContact CD2-CG1 4.12Å; Y201-V242 HydrophobicContact CE1-CG1 4.26Å; Y201-V242 HydrophobicContact CG-CG1 3.55Å; Y201-R243 HydrophobicContact CD2-CG 3.83Å; Y201-R243 HydrophobicContact CE2-CB 4.42Å; Y201-R243 HydrophobicContact CE2-CG 3.9Å
202	V	96.3	Very high	95.6	Very high	50 Å²	50	41.3 Å²	41.3	30%	0.303	23%	0.233	S	C	.	.	H	α-helix	trans	-58.7	-46.9	172.8	171.6	0	0	0	0	109.9	V198 D199 K205 A206	V198-V202 HydrophobicContact CG1-CG2 4.5Å; V198-V202 WeakPolarHBondContact O-CG2 3.44Å; V198-V202 PolarHBondContact O-N 3.24Å; D199-V202 PolarHBondContact O-N 2.82Å; V202-K205 PolarHBondContact O-N 2.51Å; V202-A206 WeakPolarHBondContact O-CB 3.41Å; V202-A206 PolarHBondContact O-N 2.77Å
203	L	97.2	Very high	95.1	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-44.7	175.8	-175.5	61.4	0	0	0	112	L150 L163 M168 D199 L200 Y201 K205 A206 F207 F218 F221	L150-L203 HydrophobicContact CD1-CD2 3.47Å; L150-L203 VanDerWaalsContact CD1-CD2 3.47Å; L163-L203 HydrophobicContact CB-CB 3.89Å; L163-L203 HydrophobicContact CB-CD1 4.34Å; L163-L203 WeakPolarHBondContact O-CA 3.13Å; M168-L203 HydrophobicContact CE-CD1 3.97Å; M168-L203 HydrophobicContact CE-CD2 4.12Å; D199-L203 PolarHBondContact O-N 2.82Å; D199-L203 VanDerWaalsContact O-N 3.14Å; L200-L203 PolarHBondContact O-N 3.07Å; Y201-L203 VanDerWaalsContact C-N 3.31Å; Y201-L203 PolarHBondContact O-N 2.86Å; L203-K205 VanDerWaalsContact C-N 3.34Å; L203-K205 PolarHBondContact O-N 2.91Å; L203-A206 PolarHBondContact O-N 3.26Å; L203-F207 WeakPolarHBondContact O-CB 3.38Å; L203-F207 PolarHBondContact O-N 3.46Å; L203-F218 HydrophobicContact CD2-CE2 4.45Å; L203-F218 HydrophobicContact CG-CE2 4.17Å; L203-F221 HydrophobicContact CD2-CE1 4.12Å; L203-F221 HydrophobicContact CD2-CE2 4.32Å; L203-F221 HydrophobicContact CD2-CZ 3.84Å
204	E	96.3	Very high	94.7	Very high	22 Å²	22	39.9 Å²	39.9	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-53.8	-50.6	176.7	178.7	169.8	-122.8	0	0	111.5	L200 Y201 F207 L208 F218 R243	L200-E204 PolarHBondContact O-N 3.26Å; Y201-E204 WeakPolarHBondContact O-CB 3.14Å; Y201-E204 PolarHBondContact O-N 2.99Å; E204-F207 PolarHBondContact O-N 3.46Å; E204-L208 HydrophobicContact CG-CD1 3.92Å; E204-L208 WeakPolarHBondContact O-CB 3.48Å; E204-L208 WeakPolarHBondContact O-CG 3.43Å; E204-L208 PolarHBondContact O-N 3.43Å; E204-F218 HydrophobicContact CB-CD1 4.38Å; E204-F218 HydrophobicContact CB-CE1 3.49Å; E204-F218 VanDerWaalsContact CB-CE1 3.49Å; E204-F218 HydrophobicContact CB-CE2 4.16Å; E204-F218 HydrophobicContact CB-CZ 3.37Å; E204-F218 HydrophobicContact CG-CD1 4.08Å; E204-F218 HydrophobicContact CG-CE1 3.57Å; E204-F218 HydrophobicContact CG-CZ 3.98Å; E204-R243 IonicContact OE1-CZ 2.67Å; E204-R243 VanDerWaalsContact OE1-CZ 3.26Å; E204-R243 IonicContact OE1-NE 3.3Å; E204-R243 PolarHBondContact OE1-NE 2.87Å; E204-R243 VanDerWaalsContact OE1-NE 3.12Å; E204-R243 IonicContact OE1-NH2 3.76Å; E204-R243 PolarHBondContact OE1-NH2 2.74Å; E204-R243 WeakPolarHBondContact OE2-CG 2.73Å; E204-R243 IonicContact OE2-CZ 2.77Å; E204-R243 IonicContact OE2-NE 3.8Å; E204-R243 PolarHBondContact OE2-NE 3.4Å; E204-R243 IonicContact OE2-NH2 2.86Å
205	K	94.8	Very high	94.4	Very high	115 Å²	115	42.2 Å²	42.2	50%	0.5	23%	0.234	S	C	.	.	H	α-helix	trans	-65.7	-43.8	-179.1	-67.7	-54	-56.4	175.1	0	111.9	Y201 V202 L203 S209	Y201-K205 HydrophobicContact CD1-CG 4.32Å; Y201-K205 HydrophobicContact CD2-CG 4.48Å; Y201-K205 HydrophobicContact CE1-CD 4.5Å; Y201-K205 HydrophobicContact CE1-CG 3.87Å; Y201-K205 HydrophobicContact CE2-CD 4.05Å; Y201-K205 HydrophobicContact CE2-CG 4.04Å; Y201-K205 WeakPolarHBondContact O-CG 3.24Å; Y201-K205 PolarHBondContact O-N 2.65Å; V202-K205 PolarHBondContact O-N 2.51Å; L203-K205 VanDerWaalsContact C-N 3.34Å; L203-K205 PolarHBondContact O-N 2.91Å; K205-S209 WeakPolarHBondContact O-CB 3.28Å; K205-S209 PolarHBondContact O-N 2.96Å; K205-S209 VanDerWaalsContact O-N 3.14Å
206	A	93.9	Very high	94.2	Very high	22 Å²	22	43.9 Å²	43.9	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-43.7	177.9	0	0	0	0	0	111.5	T164 V202 L203 S209 T210	T164-A206 HydrophobicContact CG2-CB 3.95Å; V202-A206 WeakPolarHBondContact O-CB 3.41Å; V202-A206 PolarHBondContact O-N 2.77Å; L203-A206 PolarHBondContact O-N 3.26Å; A206-S209 PolarHBondContact O-N 2.94Å; A206-T210 WeakPolarHBondContact O-CB 3.48Å; A206-T210 WeakPolarHBondContact O-CG2 3.21Å; A206-T210 PolarHBondContact O-N 2.71Å; A206-T210 PolarHBondContact O-OG1 2.97Å
207	F	94.3	Very high	94.1	Very high	8 Å²	8	44 Å²	44	4%	0.035	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-55.1	-178.3	-165.5	-82.2	0	0	0	111.1	I126 T165 L203 E204 S209 T210 H211 T214 V217 F218	I126-F207 HydrophobicContact CD1-CE2 3.59Å; I126-F207 HydrophobicContact CD1-CZ 3.93Å; T165-F207 HydrophobicContact CG2-CD2 3.43Å; T165-F207 VanDerWaalsContact CG2-CD2 3.43Å; T165-F207 HydrophobicContact CG2-CE2 3.87Å; T165-F207 HydrophobicContact CG2-CG 4.43Å; L203-F207 WeakPolarHBondContact O-CB 3.38Å; L203-F207 PolarHBondContact O-N 3.46Å; E204-F207 PolarHBondContact O-N 3.46Å; F207-S209 VanDerWaalsContact C-N 3.25Å; F207-S209 PolarHBondContact O-N 3.01Å; F207-T210 PolarHBondContact O-N 3.23Å; F207-T210 PolarHBondContact O-OG1 2.85Å; F207-H211 WeakPolarHBondContact O-CB 3.45Å; F207-H211 PolarHBondContact O-N 3.14Å; F207-T214 WeakPolarHBondContact CE1-OG1 3.39Å; F207-V217 HydrophobicContact CE1-CB 4.27Å; F207-V217 HydrophobicContact CE1-CG1 4.32Å; F207-V217 HydrophobicContact CZ-CB 4.28Å; F207-V217 HydrophobicContact CZ-CG1 3.84Å; F207-F218 HydrophobicContact CB-CD2 4.09Å; F207-F218 HydrophobicContact CB-CE2 4.34Å; F207-F218 HydrophobicContact CD1-CB 4.31Å; F207-F218 HydrophobicContact CD1-CD2 4.03Å; F207-F218 HydrophobicContact CD2-CD2 4.48Å; F207-F218 HydrophobicContact CE1-CB 4.45Å; F207-F218 AromaticContact CG-CD2 3.96Å; F207-F218 HydrophobicContact CG-CD2 3.96Å
208	L	92.4	Very high	93.9	Very high	51 Å²	51	44.3 Å²	44.3	27%	0.267	25%	0.248	S	C	.	.	H	α-helix	trans	-67	-25.9	-178.5	-63.4	176.8	0	0	0	113.1	E204 E215	E204-L208 HydrophobicContact CG-CD1 3.92Å; E204-L208 WeakPolarHBondContact O-CB 3.48Å; E204-L208 WeakPolarHBondContact O-CG 3.43Å; E204-L208 PolarHBondContact O-N 3.43Å; L208-E215 HydrophobicContact CD2-CB 4.49Å; L208-E215 HydrophobicContact CD2-CG 3.97Å
209	S	92.6	Very high	93.8	Very high	100 Å²	100	47.6 Å²	47.6	70%	0.699	26%	0.259	S	S	*	.	H	α-helix	trans	-78.3	-32.1	175.1	-175.8	0	0	0	0	113.2	K205 A206 F207	K205-S209 WeakPolarHBondContact O-CB 3.28Å; K205-S209 PolarHBondContact O-N 2.96Å; K205-S209 VanDerWaalsContact O-N 3.14Å; A206-S209 PolarHBondContact O-N 2.94Å; F207-S209 VanDerWaalsContact C-N 3.25Å; F207-S209 PolarHBondContact O-N 3.01Å
210	T	91	Very high	93.8	Very high	54 Å²	54	48.8 Å²	48.8	33%	0.331	27%	0.269	S	S	.	.	H	α-helix	trans	-91.8	-25.2	-176.9	50.2	0	0	0	0	112.5	A206 F207	A206-T210 WeakPolarHBondContact O-CB 3.48Å; A206-T210 WeakPolarHBondContact O-CG2 3.21Å; A206-T210 PolarHBondContact O-N 2.71Å; A206-T210 PolarHBondContact O-OG1 2.97Å; F207-T210 PolarHBondContact O-N 3.23Å; F207-T210 PolarHBondContact O-OG1 2.85Å
211	H	91.3	Very high	93.8	Very high	4 Å²	4	49 Å²	49	2%	0.019	27%	0.271	C	S	.	.	S	Bend	trans	-128.7	80.6	-174.5	-55.4	-52.4	0	0	0	110.1	R123 I126 T165 F207 T214	R123-H211 PolarHBondContact O-CE1 2.85Å; I126-H211 HydrophobicContact CG2-CB 4.09Å; I126-H211 WeakPolarHBondContact CG2-ND1 3.49Å; T165-H211 PolarHBondContact OG1-NE2 2.96Å; F207-H211 WeakPolarHBondContact O-CB 3.45Å; F207-H211 PolarHBondContact O-N 3.14Å; H211-T214 HydrophobicContact CB-CG2 4.02Å; H211-T214 WeakPolarHBondContact CB-OG1 3.26Å; H211-T214 PolarHBondContact O-OG1 3.05Å
212	P	87.2	Confident	93.8	Very high	86 Å²	86	48.1 Å²	48.1	56%	0.558	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	150.7	-178.4	27.1	-34.3	0	0	0	111.9	T214	P212-T214 VanDerWaalsContact C-N 3.31Å; P212-T214 PolarHBondContact O-N 2.76Å
213	N	86.8	Confident	93.9	Very high	125 Å²	125	53.1 Å²	53.1	67%	0.668	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	29.5	-179.6	-46.6	-58.2	0	0	0	114.6	E215	N213-E215 VanDerWaalsContact CA-OE2 3.24Å; N213-E215 WeakPolarHBondContact CA-OE2 3.44Å
214	T	90.1	Very high	94	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	29%	0.287	C	S	.	.			trans	-118.4	23.1	179.7	65.7	0	0	0	0	113.3	M130 F207 H211 P212 T216 V217 F218	M130-T214 HydrophobicContact CE-CG2 4.4Å; M130-T214 HydrophobicContact SD-CG2 4.43Å; F207-T214 WeakPolarHBondContact CE1-OG1 3.39Å; H211-T214 HydrophobicContact CB-CG2 4.02Å; H211-T214 WeakPolarHBondContact CB-OG1 3.26Å; H211-T214 PolarHBondContact O-OG1 3.05Å; P212-T214 VanDerWaalsContact C-N 3.31Å; P212-T214 PolarHBondContact O-N 2.76Å; T214-T216 VanDerWaalsContact C-N 3.26Å; T214-T216 PolarHBondContact O-N 3.4Å; T214-V217 HydrophobicContact CG2-CG2 4.48Å; T214-V217 WeakPolarHBondContact O-CA 3.41Å; T214-V217 VanDerWaalsContact O-CB 3.25Å; T214-V217 WeakPolarHBondContact O-CB 3.39Å; T214-V217 PolarHBondContact O-N 3.31Å; T214-F218 PolarHBondContact O-N 3.27Å
215	E	93.2	Very high	94.1	Very high	97 Å²	97	52.2 Å²	52.2	45%	0.453	28%	0.282	S	S	.	.	H	α-helix	trans	-54.5	-42.9	179.9	-67.9	75.1	-170.5	0	0	111.8	L208 N213 V217 F218 E219	L208-E215 HydrophobicContact CD2-CB 4.49Å; L208-E215 HydrophobicContact CD2-CG 3.97Å; N213-E215 VanDerWaalsContact CA-OE2 3.24Å; N213-E215 WeakPolarHBondContact CA-OE2 3.44Å; E215-V217 VanDerWaalsContact C-N 3.26Å; E215-V217 PolarHBondContact O-N 2.77Å; E215-F218 PolarHBondContact O-N 2.66Å; E215-F218 VanDerWaalsContact O-N 3.09Å; E215-E219 WeakPolarHBondContact O-CG 3.18Å; E215-E219 PolarHBondContact O-N 3.47Å
216	T	94	Very high	94.3	Very high	75 Å²	75	49.1 Å²	49.1	46%	0.46	28%	0.276	S	S	.	.	H	α-helix	trans	-63.9	-30.3	178.2	56	0	0	0	0	112.9	T214 A220	T214-T216 VanDerWaalsContact C-N 3.26Å; T214-T216 PolarHBondContact O-N 3.4Å; T216-A220 PolarHBondContact O-N 3.3Å
217	V	94.5	Very high	94.4	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.03	30%	0.3	C	S	.	.	H	α-helix	trans	-69.1	-42.5	174.5	-173.5	0	0	0	0	109.6	P136 L139 A143 F207 T214 E215 A220 F221	P136-V217 HydrophobicContact CB-CG2 3.69Å; P136-V217 WeakPolarHBondContact O-CG2 3.46Å; L139-V217 HydrophobicContact CB-CG1 3.77Å; L139-V217 HydrophobicContact CB-CG2 4.11Å; L139-V217 HydrophobicContact CD1-CG2 4.3Å; A143-V217 HydrophobicContact CB-CG1 3.73Å; A143-V217 VanDerWaalsContact CB-O 3.27Å; A143-V217 WeakPolarHBondContact CB-O 3.42Å; F207-V217 HydrophobicContact CE1-CB 4.27Å; F207-V217 HydrophobicContact CE1-CG1 4.32Å; F207-V217 HydrophobicContact CZ-CB 4.28Å; F207-V217 HydrophobicContact CZ-CG1 3.84Å; T214-V217 HydrophobicContact CG2-CG2 4.48Å; T214-V217 WeakPolarHBondContact O-CA 3.41Å; T214-V217 VanDerWaalsContact O-CB 3.25Å; T214-V217 WeakPolarHBondContact O-CB 3.39Å; T214-V217 PolarHBondContact O-N 3.31Å; E215-V217 VanDerWaalsContact C-N 3.26Å; E215-V217 PolarHBondContact O-N 2.77Å; V217-A220 WeakPolarHBondContact O-CB 3.12Å; V217-A220 PolarHBondContact O-N 3.46Å; V217-F221 PolarHBondContact O-N 3.27Å
218	F	95.4	Very high	94.6	Very high	7 Å²	7	55.2 Å²	55.2	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-67.9	-36.9	177.3	-162.1	-100.4	0	0	0	112.4	L203 E204 F207 T214 E215 F221 L222	L203-F218 HydrophobicContact CD2-CE2 4.45Å; L203-F218 HydrophobicContact CG-CE2 4.17Å; E204-F218 HydrophobicContact CB-CD1 4.38Å; E204-F218 HydrophobicContact CB-CE1 3.49Å; E204-F218 VanDerWaalsContact CB-CE1 3.49Å; E204-F218 HydrophobicContact CB-CE2 4.16Å; E204-F218 HydrophobicContact CB-CZ 3.37Å; E204-F218 HydrophobicContact CG-CD1 4.08Å; E204-F218 HydrophobicContact CG-CE1 3.57Å; E204-F218 HydrophobicContact CG-CZ 3.98Å; F207-F218 HydrophobicContact CB-CD2 4.09Å; F207-F218 HydrophobicContact CB-CE2 4.34Å; F207-F218 HydrophobicContact CD1-CB 4.31Å; F207-F218 HydrophobicContact CD1-CD2 4.03Å; F207-F218 HydrophobicContact CD2-CD2 4.48Å; F207-F218 HydrophobicContact CE1-CB 4.45Å; F207-F218 AromaticContact CG-CD2 3.96Å; F207-F218 HydrophobicContact CG-CD2 3.96Å; T214-F218 PolarHBondContact O-N 3.27Å; E215-F218 PolarHBondContact O-N 2.66Å; E215-F218 VanDerWaalsContact O-N 3.09Å; F218-F221 AromaticContact CD2-CD1 3.98Å; F218-F221 HydrophobicContact CD2-CD1 3.98Å; F218-F221 HydrophobicContact CE1-CD1 4.35Å; F218-F221 AromaticContact CE2-CD1 3.6Å; F218-F221 HydrophobicContact CE2-CD1 3.6Å; F218-F221 AromaticContact CE2-CE1 3.86Å; F218-F221 HydrophobicContact CE2-CE1 3.86Å; F218-F221 HydrophobicContact CG-CD1 4.49Å; F218-F221 AromaticContact CZ-CD1 3.79Å; F218-F221 HydrophobicContact CZ-CD1 3.79Å; F218-F221 AromaticContact CZ-CE1 3.82Å; F218-F221 HydrophobicContact CZ-CE1 3.82Å; F218-F221 WeakPolarHBondContact O-CB 3.47Å; F218-F221 PolarHBondContact O-N 2.97Å; F218-L222 HydrophobicContact CD1-CD1 3.98Å; F218-L222 HydrophobicContact CD1-CG 4.15Å; F218-L222 HydrophobicContact CE1-CD1 3.75Å; F218-L222 HydrophobicContact CE1-CD2 4.09Å; F218-L222 HydrophobicContact CE1-CG 3.85Å; F218-L222 HydrophobicContact CZ-CD2 4.38Å; F218-L222 HydrophobicContact CZ-CG 4.48Å; F218-L222 PolarHBondContact O-N 3.14Å
219	E	96	Very high	94.8	Very high	127 Å²	127	53.2 Å²	53.2	59%	0.593	30%	0.304	S	S	*	.	H	α-helix	trans	-61.2	-42.8	171.4	-71.3	177.3	173.1	0	0	112.1	E215 F221 L222 K223	E215-E219 WeakPolarHBondContact O-CG 3.18Å; E215-E219 PolarHBondContact O-N 3.47Å; E219-F221 VanDerWaalsContact C-N 3.3Å; E219-F221 PolarHBondContact O-N 3.43Å; E219-L222 PolarHBondContact O-N 3.4Å; E219-K223 WeakPolarHBondContact O-CB 3.48Å; E219-K223 PolarHBondContact O-N 2.93Å
220	A	97.1	Very high	94.9	Very high	27 Å²	27	57.9 Å²	57.9	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-39.1	174.7	0	0	0	0	0	111.9	A143 T216 V217 K223 S224	A143-A220 HydrophobicContact CB-CB 4.09Å; T216-A220 PolarHBondContact O-N 3.3Å; V217-A220 WeakPolarHBondContact O-CB 3.12Å; V217-A220 PolarHBondContact O-N 3.46Å; A220-K223 PolarHBondContact O-N 3.27Å; A220-S224 PolarHBondContact O-N 2.87Å
221	F	97.8	Very high	95	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-52.1	172.2	157.6	-100.2	0	0	0	111.5	A143 I146 G147 L150 L200 L203 V217 F218 E219 K223 S224 Y225	A143-F221 HydrophobicContact CB-CB 4.09Å; A143-F221 WeakPolarHBondContact O-CA 3.41Å; I146-F221 HydrophobicContact CB-CD2 3.96Å; I146-F221 HydrophobicContact CB-CE2 4.31Å; I146-F221 HydrophobicContact CG2-CD2 3.67Å; I146-F221 HydrophobicContact CG2-CE2 3.61Å; G147-F221 VanDerWaalsContact CA-CD2 3.41Å; G147-F221 VanDerWaalsContact CA-CE2 3.42Å; G147-F221 VanDerWaalsContact N-CD2 3.31Å; L150-F221 HydrophobicContact CB-CE2 4.39Å; L150-F221 HydrophobicContact CD1-CE2 3.78Å; L150-F221 HydrophobicContact CD1-CZ 3.79Å; L150-F221 HydrophobicContact CG-CE2 4.45Å; L200-F221 HydrophobicContact CD2-CE1 4.04Å; L200-F221 HydrophobicContact CD2-CZ 3.7Å; L203-F221 HydrophobicContact CD2-CE1 4.12Å; L203-F221 HydrophobicContact CD2-CE2 4.32Å; L203-F221 HydrophobicContact CD2-CZ 3.84Å; V217-F221 PolarHBondContact O-N 3.27Å; F218-F221 AromaticContact CD2-CD1 3.98Å; F218-F221 HydrophobicContact CD2-CD1 3.98Å; F218-F221 HydrophobicContact CE1-CD1 4.35Å; F218-F221 AromaticContact CE2-CD1 3.6Å; F218-F221 HydrophobicContact CE2-CD1 3.6Å; F218-F221 AromaticContact CE2-CE1 3.86Å; F218-F221 HydrophobicContact CE2-CE1 3.86Å; F218-F221 HydrophobicContact CG-CD1 4.49Å; F218-F221 AromaticContact CZ-CD1 3.79Å; F218-F221 HydrophobicContact CZ-CD1 3.79Å; F218-F221 AromaticContact CZ-CE1 3.82Å; F218-F221 HydrophobicContact CZ-CE1 3.82Å; F218-F221 WeakPolarHBondContact O-CB 3.47Å; F218-F221 PolarHBondContact O-N 2.97Å; E219-F221 VanDerWaalsContact C-N 3.3Å; E219-F221 PolarHBondContact O-N 3.43Å; F221-K223 VanDerWaalsContact C-N 3.3Å; F221-K223 PolarHBondContact O-N 3.29Å; F221-S224 WeakPolarHBondContact O-CB 3.48Å; F221-S224 PolarHBondContact O-N 3.4Å; F221-S224 VanDerWaalsContact O-N 3.14Å; F221-Y225 PolarHBondContact O-N 3.23Å
222	L	98.2	Very high	95.3	Very high	24 Å²	24	59.1 Å²	59.1	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-37.5	180	-70.8	178	0	0	0	112.3	F218 E219 Y225 S226 L236 L239	F218-L222 HydrophobicContact CD1-CD1 3.98Å; F218-L222 HydrophobicContact CD1-CG 4.15Å; F218-L222 HydrophobicContact CE1-CD1 3.75Å; F218-L222 HydrophobicContact CE1-CD2 4.09Å; F218-L222 HydrophobicContact CE1-CG 3.85Å; F218-L222 HydrophobicContact CZ-CD2 4.38Å; F218-L222 HydrophobicContact CZ-CG 4.48Å; F218-L222 PolarHBondContact O-N 3.14Å; E219-L222 PolarHBondContact O-N 3.4Å; L222-Y225 PolarHBondContact O-N 2.87Å; L222-S226 VanDerWaalsContact O-CB 3.32Å; L222-S226 WeakPolarHBondContact O-CB 3.22Å; L222-S226 PolarHBondContact O-N 3.4Å; L222-L236 HydrophobicContact CD2-CD2 4.12Å; L222-L239 HydrophobicContact CD1-CD2 4.3Å; L222-L239 HydrophobicContact CD2-CD2 3.76Å
223	K	98.3	Very high	95.8	Very high	155 Å²	155	65.5 Å²	65.5	67%	0.674	33%	0.326	S	S	*	.	H	α-helix	trans	-61.1	-47.2	173.8	-175.2	177	-179.4	178.5	0	111.1	E219 A220 F221 S226 T227	E219-K223 WeakPolarHBondContact O-CB 3.48Å; E219-K223 PolarHBondContact O-N 2.93Å; A220-K223 PolarHBondContact O-N 3.27Å; F221-K223 VanDerWaalsContact C-N 3.3Å; F221-K223 PolarHBondContact O-N 3.29Å; K223-S226 WeakPolarHBondContact O-CB 3.48Å; K223-S226 PolarHBondContact O-N 3.36Å; K223-T227 PolarHBondContact O-N 3.02Å; K223-T227 VanDerWaalsContact O-N 3.09Å; K223-T227 PolarHBondContact O-OG1 2.99Å
224	S	98.5	Very high	96.3	Very high	7 Å²	7	62.6 Å²	62.6	5%	0.049	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-41.9	177.5	-175	0	0	0	0	112.4	K144 A220 F221 S226 T227 S228	K144-S224 WeakPolarHBondContact CG-OG 3.38Å; K144-S224 PolarHBondContact O-OG 3.48Å; A220-S224 PolarHBondContact O-N 2.87Å; F221-S224 WeakPolarHBondContact O-CB 3.48Å; F221-S224 PolarHBondContact O-N 3.4Å; F221-S224 VanDerWaalsContact O-N 3.14Å; S224-S226 VanDerWaalsContact C-N 3.3Å; S224-S226 PolarHBondContact O-N 3.45Å; S224-T227 PolarHBondContact O-N 3.31Å; S224-T227 PolarHBondContact O-OG1 3.34Å; S224-T227 VanDerWaalsContact O-OG1 3.13Å; S224-S228 VanDerWaalsContact O-CB 3.23Å; S224-S228 WeakPolarHBondContact O-CB 3.25Å; S224-S228 PolarHBondContact O-N 2.9Å; S224-S228 PolarHBondContact O-OG 3.16Å
225	Y	98.7	Very high	96.7	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.3	-45.3	173.3	-178.5	-83.6	0	0	0	110.9	L150 A151 H154 L200 F221 L222 T227 S228 S229 V235 L236	L150-Y225 HydrophobicContact CB-CD2 4.34Å; L150-Y225 HydrophobicContact CB-CE2 4.47Å; A151-Y225 VanDerWaalsContact CA-CE2 3.43Å; A151-Y225 HydrophobicContact CB-CD2 3.84Å; A151-Y225 HydrophobicContact CB-CE2 4.06Å; A151-Y225 HydrophobicContact CB-CG 4.37Å; H154-Y225 HydrophobicContact CB-CE2 4.34Å; H154-Y225 WeakPolarHBondContact CB-OH 3.46Å; H154-Y225 AromaticContact ND1-CE2 3.48Å; H154-Y225 WeakPolarHBondContact ND1-CE2 3.23Å; H154-Y225 AromaticContact ND1-CZ 3.53Å; H154-Y225 PolarHBondContact ND1-OH 2.86Å; L200-Y225 HydrophobicContact CD1-CD1 4.21Å; L200-Y225 HydrophobicContact CD1-CE1 3.93Å; L200-Y225 HydrophobicContact CD1-CE2 4.29Å; L200-Y225 HydrophobicContact CD2-CD2 4.17Å; L200-Y225 HydrophobicContact CD2-CE2 4.06Å; F221-Y225 PolarHBondContact O-N 3.23Å; L222-Y225 PolarHBondContact O-N 2.87Å; Y225-T227 VanDerWaalsContact C-N 3.34Å; Y225-T227 PolarHBondContact O-N 2.85Å; Y225-S228 PolarHBondContact O-N 3.47Å; Y225-S229 PolarHBondContact O-N 2.84Å; Y225-V235 HydrophobicContact CE1-CB 4.44Å; Y225-V235 HydrophobicContact CE1-CG1 4.1Å; Y225-L236 HydrophobicContact CD1-CD2 4.2Å
226	S	98.3	Very high	97	Very high	51 Å²	51	59.6 Å²	59.6	36%	0.357	30%	0.3	S	S	.	.	H	α-helix	trans	-59.3	-41.9	179.8	-167	0	0	0	0	113	L222 K223 S224 A232 L236	L222-S226 VanDerWaalsContact O-CB 3.32Å; L222-S226 WeakPolarHBondContact O-CB 3.22Å; L222-S226 PolarHBondContact O-N 3.4Å; K223-S226 WeakPolarHBondContact O-CB 3.48Å; K223-S226 PolarHBondContact O-N 3.36Å; S224-S226 VanDerWaalsContact C-N 3.3Å; S224-S226 PolarHBondContact O-N 3.45Å; S226-A232 WeakPolarHBondContact O-CB 3.42Å; S226-L236 WeakPolarHBondContact OG-CD1 3.39Å
227	T	98.1	Very high	97.2	Very high	112 Å²	112	62.6 Å²	62.6	69%	0.687	31%	0.307	S	S	*	.	H	α-helix	trans	-80.3	-20.5	-179.7	60.2	0	0	0	0	113.3	K223 S224 Y225	K223-T227 PolarHBondContact O-N 3.02Å; K223-T227 VanDerWaalsContact O-N 3.09Å; K223-T227 PolarHBondContact O-OG1 2.99Å; S224-T227 PolarHBondContact O-N 3.31Å; S224-T227 PolarHBondContact O-OG1 3.34Å; S224-T227 VanDerWaalsContact O-OG1 3.13Å; Y225-T227 VanDerWaalsContact C-N 3.34Å; Y225-T227 PolarHBondContact O-N 2.85Å
228	S	97.7	Very high	97.3	Very high	45 Å²	45	65 Å²	65	32%	0.315	32%	0.317	S	S	.	.	H	α-helix	trans	-96.6	-32.3	-173.5	-54.4	0	0	0	0	113.4	Q148 S224 Y225	Q148-S228 WeakPolarHBondContact CG-OG 3.38Å; S224-S228 VanDerWaalsContact O-CB 3.23Å; S224-S228 WeakPolarHBondContact O-CB 3.25Å; S224-S228 PolarHBondContact O-N 2.9Å; S224-S228 PolarHBondContact O-OG 3.16Å; Y225-S228 PolarHBondContact O-N 3.47Å
229	S	97.1	Very high	97.5	Very high	10 Å²	10	64.7 Å²	64.7	7%	0.07	32%	0.316	C	S	.	.			trans	-87.2	132	-179.3	169.7	0	0	0	0	111.7	D155 Y225 K231 A232	D155-S229 WeakPolarHBondContact OD1-CB 3.38Å; D155-S229 PolarHBondContact OD1-OG 3.46Å; D155-S229 WeakPolarHBondContact OD2-CA 3.41Å; Y225-S229 PolarHBondContact O-N 2.84Å; S229-K231 PolarHBondContact O-N 3.33Å; S229-K231 PolarHBondContact OG-N 3.45Å; S229-K231 VanDerWaalsContact OG-N 3.09Å; S229-A232 WeakPolarHBondContact O-CB 3.4Å; S229-A232 PolarHBondContact O-N 3.46Å; S229-A232 PolarHBondContact OG-N 3.19Å
230	K	93.3	Very high	97.5	Very high	198 Å²	198	62.5 Å²	62.5	86%	0.861	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.9	173	-62.4	175.7	-175.6	174.2	0	112.4	D155	D155-K230 PolarHBondContact OD1-N 3Å; D155-K230 PolarHBondContact OD2-N 2.82Å
231	K	94.2	Very high	97.5	Very high	80 Å²	80	64.4 Å²	64.4	35%	0.348	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	17.5	-176	-61.6	167	179.6	166.7	0	111.8	D155 D157 S229 R233 P234 V235	D155-K231 PolarHBondContact O-NZ 3.01Å; D155-K231 VanDerWaalsContact O-NZ 3.14Å; D157-K231 IonicContact OD1-NZ 3.51Å; D157-K231 PolarHBondContact OD1-NZ 3.38Å; D157-K231 IonicContact OD2-NZ 3.45Å; D157-K231 PolarHBondContact OD2-NZ 3.37Å; S229-K231 PolarHBondContact O-N 3.33Å; S229-K231 PolarHBondContact OG-N 3.45Å; S229-K231 VanDerWaalsContact OG-N 3.09Å; K231-R233 PolarHBondContact O-N 2.94Å; K231-P234 VanDerWaalsContact O-CD 3.25Å; K231-P234 WeakPolarHBondContact O-CD 3.49Å; K231-P234 VanDerWaalsContact O-CG 3.3Å; K231-P234 WeakPolarHBondContact O-CG 3.44Å; K231-V235 WeakPolarHBondContact O-CG2 2.94Å
232	A	97.1	Very high	97.3	Very high	4 Å²	4	64.7 Å²	64.7	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-57.8	-49.7	-172	0	0	0	0	0	114.5	S226 S229 V235 L236	S226-A232 WeakPolarHBondContact O-CB 3.42Å; S229-A232 WeakPolarHBondContact O-CB 3.4Å; S229-A232 PolarHBondContact O-N 3.46Å; S229-A232 PolarHBondContact OG-N 3.19Å; A232-V235 WeakPolarHBondContact O-CB 3.37Å; A232-V235 PolarHBondContact O-N 3.05Å; A232-V235 VanDerWaalsContact O-N 3.08Å; A232-L236 WeakPolarHBondContact O-CG 3.46Å; A232-L236 PolarHBondContact O-N 3.41Å
233	R	97.9	Very high	97.1	Very high	220 Å²	220	65.7 Å²	65.7	83%	0.83	32%	0.317	S	S	*	.	H	α-helix	trans	-52.8	-55.1	-173.3	-69.5	-177.5	-178.9	178.1	0.2	113.9	K231 V235 L236 K237	K231-R233 PolarHBondContact O-N 2.94Å; R233-V235 VanDerWaalsContact C-N 3.28Å; R233-V235 PolarHBondContact O-N 2.8Å; R233-L236 PolarHBondContact O-N 2.63Å; R233-K237 PolarHBondContact O-N 2.94Å
234	P	98	Very high	96.8	Very high	64 Å²	64	64 Å²	64	42%	0.416	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-33.1	178.4	24.9	-34.8	0	0	0	112.6	P193 K231 K238	P193-P234 HydrophobicContact CB-CB 4.13Å; P193-P234 HydrophobicContact CG-CB 4.02Å; P193-P234 HydrophobicContact CG-CG 4.48Å; K231-P234 VanDerWaalsContact O-CD 3.25Å; K231-P234 WeakPolarHBondContact O-CD 3.49Å; K231-P234 VanDerWaalsContact O-CG 3.3Å; K231-P234 WeakPolarHBondContact O-CG 3.44Å; P234-K238 WeakPolarHBondContact O-CB 3.37Å; P234-K238 PolarHBondContact O-N 2.91Å; P234-K238 VanDerWaalsContact O-N 3.11Å
235	V	98.5	Very high	96.4	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-67.3	-46.6	177.9	175.2	0	0	0	0	111.4	P193 K196 L200 Y225 K231 A232 R233 K238 L239	P193-V235 HydrophobicContact CB-CG2 4.24Å; K196-V235 HydrophobicContact CB-CB 4.4Å; K196-V235 HydrophobicContact CB-CG1 3.66Å; K196-V235 HydrophobicContact CB-CG2 3.81Å; K196-V235 HydrophobicContact CD-CG2 3.71Å; K196-V235 HydrophobicContact CG-CG2 4.38Å; L200-V235 HydrophobicContact CD1-CG1 3.77Å; Y225-V235 HydrophobicContact CE1-CB 4.44Å; Y225-V235 HydrophobicContact CE1-CG1 4.1Å; K231-V235 WeakPolarHBondContact O-CG2 2.94Å; A232-V235 WeakPolarHBondContact O-CB 3.37Å; A232-V235 PolarHBondContact O-N 3.05Å; A232-V235 VanDerWaalsContact O-N 3.08Å; R233-V235 VanDerWaalsContact C-N 3.28Å; R233-V235 PolarHBondContact O-N 2.8Å; V235-K238 CarbonylContact O-C 3.34Å; V235-K238 WeakPolarHBondContact O-CA 3.28Å; V235-K238 WeakPolarHBondContact O-CB 3.23Å; V235-K238 PolarHBondContact O-N 2.81Å; V235-K238 VanDerWaalsContact O-N 3.08Å; V235-L239 PolarHBondContact O-N 3.19Å
236	L	98.2	Very high	95.3	Very high	34 Å²	34	71.5 Å²	71.5	18%	0.178	36%	0.355	C	S	.	.	H	α-helix	trans	-67.6	-39.2	-179.8	-66.9	177.9	0	0	0	112	L200 L222 Y225 S226 A232 R233 K238 L239 D240	L200-L236 HydrophobicContact CD1-CD2 4.28Å; L222-L236 HydrophobicContact CD2-CD2 4.12Å; Y225-L236 HydrophobicContact CD1-CD2 4.2Å; S226-L236 WeakPolarHBondContact OG-CD1 3.39Å; A232-L236 WeakPolarHBondContact O-CG 3.46Å; A232-L236 PolarHBondContact O-N 3.41Å; R233-L236 PolarHBondContact O-N 2.63Å; L236-K238 PolarHBondContact O-N 3.4Å; L236-L239 HydrophobicContact CD2-CD2 4.2Å; L236-L239 WeakPolarHBondContact O-CB 3.31Å; L236-L239 PolarHBondContact O-N 3.15Å; L236-D240 PolarHBondContact O-N 3.41Å
237	K	98.1	Very high	93.7	Very high	139 Å²	139	77.9 Å²	77.9	60%	0.604	37%	0.371	S	S	*	.	H	α-helix	trans	-55.2	-42.3	169.7	-179.1	-180	176.3	-177.8	0	110.8	R233 D240 E241	R233-K237 PolarHBondContact O-N 2.94Å; K237-D240 PolarHBondContact O-N 2.81Å; K237-E241 WeakPolarHBondContact CE-OE1 3.23Å; K237-E241 PolarHBondContact O-N 2.98Å; K237-E241 VanDerWaalsContact O-N 3.14Å
238	K	97.9	Very high	91.3	Very high	54 Å²	54	81.1 Å²	81.1	24%	0.235	38%	0.375	C	S	.	.	H	α-helix	trans	-72.3	-36.3	-178.6	-151.4	49.1	149.4	133.8	0	113	E194 P234 V235 L236 D240 E241 V242	E194-K238 VanDerWaalsContact CA-CG 3.42Å; E194-K238 HydrophobicContact CB-CG 4.04Å; E194-K238 WeakPolarHBondContact OE2-CD 3.49Å; E194-K238 WeakPolarHBondContact OE2-CE 3.45Å; E194-K238 WeakPolarHBondContact OE2-CG 3.4Å; E194-K238 IonicContact OE2-NZ 2.85Å; E194-K238 PolarHBondContact OE2-NZ 3.19Å; P234-K238 WeakPolarHBondContact O-CB 3.37Å; P234-K238 PolarHBondContact O-N 2.91Å; P234-K238 VanDerWaalsContact O-N 3.11Å; V235-K238 CarbonylContact O-C 3.34Å; V235-K238 WeakPolarHBondContact O-CA 3.28Å; V235-K238 WeakPolarHBondContact O-CB 3.23Å; V235-K238 PolarHBondContact O-N 2.81Å; V235-K238 VanDerWaalsContact O-N 3.08Å; L236-K238 PolarHBondContact O-N 3.4Å; K238-D240 VanDerWaalsContact C-N 3.29Å; K238-D240 PolarHBondContact O-N 3.29Å; K238-E241 HydrophobicContact CD-CB 4.29Å; K238-E241 WeakPolarHBondContact CD-OE2 3.34Å; K238-E241 WeakPolarHBondContact CE-OE2 3.31Å; K238-E241 IonicContact NZ-OE2 3.81Å; K238-E241 PolarHBondContact NZ-OE2 3.28Å; K238-E241 PolarHBondContact O-N 3.3Å; K238-V242 VanDerWaalsContact O-CG2 3.27Å; K238-V242 WeakPolarHBondContact O-CG2 3.47Å; K238-V242 PolarHBondContact O-N 2.96Å
239	L	97.9	Very high	88.8	Confident	1 Å²	1	89.2 Å²	89.2	1%	0.005	40%	0.399	C	S	.	.	H	α-helix	trans	-55	-44.7	168.7	172.3	61.1	0	0	0	111.1	L200 Y201 L222 V235 L236 E241 V242 R243	L200-L239 HydrophobicContact CB-CD1 4.21Å; L200-L239 HydrophobicContact CB-CD2 4.24Å; L200-L239 HydrophobicContact CD1-CD2 4.33Å; Y201-L239 HydrophobicContact CD2-CD1 4.25Å; Y201-L239 HydrophobicContact CG-CD1 4.5Å; L222-L239 HydrophobicContact CD1-CD2 4.3Å; L222-L239 HydrophobicContact CD2-CD2 3.76Å; V235-L239 PolarHBondContact O-N 3.19Å; L236-L239 HydrophobicContact CD2-CD2 4.2Å; L236-L239 WeakPolarHBondContact O-CB 3.31Å; L236-L239 PolarHBondContact O-N 3.15Å; L239-E241 PolarHBondContact O-N 3.18Å; L239-V242 PolarHBondContact O-N 2.89Å; L239-R243 HydrophobicContact CD1-CG 4.35Å; L239-R243 WeakPolarHBondContact O-CG 3.38Å; L239-R243 PolarHBondContact O-N 3.04Å
240	D	96.9	Very high	86.1	Confident	81 Å²	81	94.6 Å²	94.6	43%	0.433	43%	0.431	S	S	.	.	H	α-helix	trans	-63.9	-41.6	177	-67.2	-31.3	0	0	0	112.6	L236 K237 K238 V242 R243 L244	L236-D240 PolarHBondContact O-N 3.41Å; K237-D240 PolarHBondContact O-N 2.81Å; K238-D240 VanDerWaalsContact C-N 3.29Å; K238-D240 PolarHBondContact O-N 3.29Å; D240-V242 VanDerWaalsContact C-N 3.33Å; D240-V242 PolarHBondContact O-N 3.15Å; D240-R243 WeakPolarHBondContact O-CB 3.45Å; D240-R243 PolarHBondContact O-N 3.34Å; D240-R243 IonicContact OD1-CZ 2.64Å; D240-R243 IonicContact OD1-NH1 2.76Å; D240-R243 PolarHBondContact OD1-NH1 3.39Å; D240-L244 WeakPolarHBondContact O-CG 2.93Å; D240-L244 PolarHBondContact O-N 2.84Å; D240-L244 VanDerWaalsContact O-N 3.07Å
241	E	96.3	Very high	83.5	Confident	67 Å²	67	92.9 Å²	92.9	31%	0.313	43%	0.428	S	S	.	.	H	α-helix	trans	-62.7	-38	172.8	-68.3	174.3	-159.6	0	0	112.4	K237 K238 L239 R245	K237-E241 WeakPolarHBondContact CE-OE1 3.23Å; K237-E241 PolarHBondContact O-N 2.98Å; K237-E241 VanDerWaalsContact O-N 3.14Å; K238-E241 HydrophobicContact CD-CB 4.29Å; K238-E241 WeakPolarHBondContact CD-OE2 3.34Å; K238-E241 WeakPolarHBondContact CE-OE2 3.31Å; K238-E241 IonicContact NZ-OE2 3.81Å; K238-E241 PolarHBondContact NZ-OE2 3.28Å; K238-E241 PolarHBondContact O-N 3.3Å; L239-E241 PolarHBondContact O-N 3.18Å; E241-R245 WeakPolarHBondContact O-CG 3.39Å; E241-R245 PolarHBondContact O-N 2.91Å; E241-R245 PolarHBondContact O-NE 3.3Å
242	V	94.6	Very high	80.9	Confident	13 Å²	13	95.5 Å²	95.5	8%	0.079	45%	0.451	C	S	.	.	H	α-helix	trans	-66.8	-43.5	175.4	173.7	0	0	0	0	110.5	V198 Y201 K238 L239 D240 L244 R245 G246	V198-V242 HydrophobicContact CG2-CG1 4.38Å; V198-V242 HydrophobicContact CG2-CG2 3.83Å; Y201-V242 HydrophobicContact CD1-CG1 3.64Å; Y201-V242 HydrophobicContact CD2-CG1 4.12Å; Y201-V242 HydrophobicContact CE1-CG1 4.26Å; Y201-V242 HydrophobicContact CG-CG1 3.55Å; K238-V242 VanDerWaalsContact O-CG2 3.27Å; K238-V242 WeakPolarHBondContact O-CG2 3.47Å; K238-V242 PolarHBondContact O-N 2.96Å; L239-V242 PolarHBondContact O-N 2.89Å; D240-V242 VanDerWaalsContact C-N 3.33Å; D240-V242 PolarHBondContact O-N 3.15Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.46Å; V242-R245 VanDerWaalsContact CG2-NH2 3.28Å; V242-R245 PolarHBondContact O-N 2.94Å; V242-R245 VanDerWaalsContact O-N 3.15Å; V242-G246 PolarHBondContact O-N 2.84Å
243	R	94.6	Very high	78	Confident	45 Å²	45	102 Å²	102	17%	0.17	52%	0.519	C	S	.	.	H	α-helix	trans	-56.3	-44.8	175.4	-74.7	165.9	169.2	166.9	-7.1	111.7	Y201 E204 L239 D240 R245 G246 R247	Y201-R243 HydrophobicContact CD2-CG 3.83Å; Y201-R243 HydrophobicContact CE2-CB 4.42Å; Y201-R243 HydrophobicContact CE2-CG 3.9Å; E204-R243 IonicContact OE1-CZ 2.67Å; E204-R243 VanDerWaalsContact OE1-CZ 3.26Å; E204-R243 IonicContact OE1-NE 3.3Å; E204-R243 PolarHBondContact OE1-NE 2.87Å; E204-R243 VanDerWaalsContact OE1-NE 3.12Å; E204-R243 IonicContact OE1-NH2 3.76Å; E204-R243 PolarHBondContact OE1-NH2 2.74Å; E204-R243 WeakPolarHBondContact OE2-CG 2.73Å; E204-R243 IonicContact OE2-CZ 2.77Å; E204-R243 IonicContact OE2-NE 3.8Å; E204-R243 PolarHBondContact OE2-NE 3.4Å; E204-R243 IonicContact OE2-NH2 2.86Å; L239-R243 HydrophobicContact CD1-CG 4.35Å; L239-R243 WeakPolarHBondContact O-CG 3.38Å; L239-R243 PolarHBondContact O-N 3.04Å; D240-R243 WeakPolarHBondContact O-CB 3.45Å; D240-R243 PolarHBondContact O-N 3.34Å; D240-R243 IonicContact OD1-CZ 2.64Å; D240-R243 IonicContact OD1-NH1 2.76Å; D240-R243 PolarHBondContact OD1-NH1 3.39Å; R243-R245 VanDerWaalsContact C-N 3.34Å; R243-R245 PolarHBondContact O-N 2.95Å; R243-G246 PolarHBondContact O-N 3.23Å; R243-R247 WeakPolarHBondContact O-CG 3.48Å; R243-R247 PolarHBondContact O-N 3.06Å
244	L	91.1	Very high	77	Confident	118 Å²	118	96.2 Å²	96.2	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-39.4	177.7	-70.2	173.4	0	0	0	112.5	D240 V242	D240-L244 WeakPolarHBondContact O-CG 2.93Å; D240-L244 PolarHBondContact O-N 2.84Å; D240-L244 VanDerWaalsContact O-N 3.07Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.46Å
245	R	89.1	Confident	75.9	Confident	125 Å²	125	97.8 Å²	97.8	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-70.7	-40.6	176.1	-71.2	176.5	-79.7	164.9	-3.7	111.9	E194 E241 V242 R243 R247 K248	E194-R245 VanDerWaalsContact CD-NH2 3.34Å; E194-R245 IonicContact OE1-CZ 3.19Å; E194-R245 VanDerWaalsContact OE1-CZ 3.27Å; E194-R245 IonicContact OE1-NH1 3.38Å; E194-R245 PolarHBondContact OE1-NH1 3.02Å; E194-R245 IonicContact OE1-NH2 2.7Å; E194-R245 PolarHBondContact OE1-NH2 3.11Å; E194-R245 IonicContact OE2-CZ 2.81Å; E194-R245 IonicContact OE2-NH1 2.8Å; E194-R245 IonicContact OE2-NH2 3.96Å; E194-R245 PolarHBondContact OE2-NH2 2.87Å; E241-R245 WeakPolarHBondContact O-CG 3.39Å; E241-R245 PolarHBondContact O-N 2.91Å; E241-R245 PolarHBondContact O-NE 3.3Å; V242-R245 VanDerWaalsContact CG2-NH2 3.28Å; V242-R245 PolarHBondContact O-N 2.94Å; V242-R245 VanDerWaalsContact O-N 3.15Å; R243-R245 VanDerWaalsContact C-N 3.34Å; R243-R245 PolarHBondContact O-N 2.95Å; R245-R247 VanDerWaalsContact C-N 3.28Å; R245-R247 PolarHBondContact O-N 2.93Å; R245-K248 PolarHBondContact O-N 3.17Å
246	G	75.7	Confident	74.7	Confident	41 Å²	41	103.3 Å²	103.3	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-68.6	-22.9	178.6	0	0	0	0	0	114.2	V242 R243 K248	V242-G246 PolarHBondContact O-N 2.84Å; R243-G246 PolarHBondContact O-N 3.23Å; G246-K248 VanDerWaalsContact C-N 3.27Å; G246-K248 PolarHBondContact O-N 3Å
247	R	65.2	Low	73.3	Confident	184 Å²	184	107.4 Å²	107.4	69%	0.694	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-8.4	174.9	-76.4	171.2	-173.2	-164.1	2.1	114.2	R243 R245	R243-R247 WeakPolarHBondContact O-CG 3.48Å; R243-R247 PolarHBondContact O-N 3.06Å; R245-R247 VanDerWaalsContact C-N 3.28Å; R245-R247 PolarHBondContact O-N 2.93Å
248	K	48.9	Very low	71.8	Confident	180 Å²	180	105.4 Å²	105.4	78%	0.783	55%	0.554	S	S	*	*			trans	-112.3	76.8	179.5	-74.2	-169.1	177.3	-175.6	0	113	R245 G246	R245-K248 PolarHBondContact O-N 3.17Å; G246-K248 VanDerWaalsContact C-N 3.27Å; G246-K248 PolarHBondContact O-N 3Å
249	R	45.1	Very low	70	Confident	216 Å²	216	108.8 Å²	108.8	82%	0.815	58%	0.576	S	S	*	*			trans	-156.3	56.5	142.3	-73.2	-158.8	176.6	161.7	-3.1	110.8	M251	R249-M251 PolarHBondContact O-N 2.98Å; R249-M251 VanDerWaalsContact O-N 3.15Å
250	T	40.2	Very low	68	Low	122 Å²	122	116.5 Å²	116.5	75%	0.748	62%	0.616	S	S	*	*			trans	-76.2	86.9	147.3	-30.3	0	0	0	0	105	V252	T250-V252 HydrophobicContact CG2-CG2 3.99Å; T250-V252 PolarHBondContact O-N 3.49Å
251	M	37.4	Very low	65.8	Low	162 Å²	162	119.2 Å²	119.2	80%	0.798	63%	0.63	S	S	*	*			trans	-69.8	85.4	164.7	-80.8	-171.4	-76.7	0	0	106.4	R249 G253	R249-M251 PolarHBondContact O-N 2.98Å; R249-M251 VanDerWaalsContact O-N 3.15Å; M251-G253 VanDerWaalsContact C-N 3.34Å; M251-G253 PolarHBondContact O-N 3.46Å
252	V	39.3	Very low	63.3	Low	135 Å²	135	123.6 Å²	123.6	82%	0.818	66%	0.657	S	S	*	*			trans	-81.9	96.3	154.2	-175.1	0	0	0	0	104.5	T250	T250-V252 HydrophobicContact CG2-CG2 3.99Å; T250-V252 PolarHBondContact O-N 3.49Å
253	G	37.8	Very low	60.4	Low	142 Å²	142	133.6 Å²	133.6	100%	1.464	71%	0.709	S	S	*	*			trans	-117.2	0	157.8	0	0	0	0	0	106.7	M251	M251-G253 VanDerWaalsContact C-N 3.34Å; M251-G253 PolarHBondContact O-N 3.46Å

Retrieved 253 of 253 residues in 46.3 ms (Link to these results)

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