A0A087XT49_POEFO Loading...

Adenine nucleotide translocase lysine methyltransferase

AlphaFold DB , UniProt , Accession A0A087XT49, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 227 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.9	Low	57.3	Low	231 Å²	231	120.4 Å²	120.4	100%	1.138	65%	0.652	S	S	*	*				0	128.7	0	-79.6	172.7	167.9	0	0	105.8
2	D	52.8	Low	57.4	Low	156 Å²	156	116.9 Å²	116.9	83%	0.834	63%	0.633	S	S	*	*			trans	84.5	82.2	163.3	-42.4	-30.6	0	0	0	117.5
3	D	56.9	Low	57.3	Low	147 Å²	147	116.9 Å²	116.9	79%	0.786	63%	0.631	S	S	*	*			trans	-136.9	40.5	162.8	-156.9	16.9	0	0	0	111.1
4	D	56	Low	57.2	Low	114 Å²	114	123.4 Å²	123.4	61%	0.61	64%	0.642	S	S	*	*			trans	-116.4	1.8	-178.5	-71.8	-53.8	0	0	0	113.6	D7 E8	D4-D7 PolarHBondContact O-N 2.74Å; D4-E8 PolarHBondContact O-N 2.93Å
5	A	61.4	Low	57.1	Low	72 Å²	72	122.5 Å²	122.5	60%	0.595	64%	0.644	S	S	*	*	H	α-helix	trans	-63.1	-38.5	-174.1	0	0	0	0	0	116.2	V9	A5-V9 WeakPolarHBondContact O-CG2 3.36Å
6	P	56.4	Low	57.2	Low	65 Å²	65	125.4 Å²	125.4	42%	0.422	64%	0.644	S	S	.	*	H	α-helix	trans	-72.8	-35.8	-179.6	26.4	-30.3	0	0	0	111.7	V9 F10	P6-V9 PolarHBondContact O-N 2.95Å; P6-F10 WeakPolarHBondContact O-CD2 2.98Å; P6-F10 PolarHBondContact O-N 3.05Å
7	D	59.8	Low	57.3	Low	104 Å²	104	128.7 Å²	128.7	56%	0.556	66%	0.655	S	S	*	*	H	α-helix	trans	-73.3	-32.2	-175.1	-71.2	-30.2	0	0	0	112.5	D4 T11	D4-D7 PolarHBondContact O-N 2.74Å; D7-T11 WeakPolarHBondContact O-CB 3.15Å; D7-T11 WeakPolarHBondContact O-CG2 3.27Å; D7-T11 PolarHBondContact O-N 3.17Å; D7-T11 PolarHBondContact O-OG1 2.68Å
8	E	59.7	Low	57.5	Low	140 Å²	140	126.8 Å²	126.8	65%	0.654	65%	0.646	S	S	*	*	H	α-helix	trans	-65	-39.1	170	-79.1	-163.2	148.2	0	0	112.5	D4 T11 D12	D4-E8 PolarHBondContact O-N 2.93Å; E8-T11 VanDerWaalsContact CA-OG1 3.26Å; E8-T11 WeakPolarHBondContact CA-OG1 3.43Å; E8-T11 PolarHBondContact O-N 3.09Å; E8-T11 PolarHBondContact O-OG1 3.33Å; E8-T11 VanDerWaalsContact O-OG1 3.06Å; E8-D12 PolarHBondContact O-N 2.98Å
9	V	60.3	Low	58.3	Low	90 Å²	90	122.1 Å²	122.1	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-69.2	-40.1	178.1	176.7	0	0	0	0	111.1	A5 P6 T11 L13	A5-V9 WeakPolarHBondContact O-CG2 3.36Å; P6-V9 PolarHBondContact O-N 2.95Å; V9-T11 VanDerWaalsContact C-N 3.34Å; V9-L13 HydrophobicContact CG1-CD1 4.46Å; V9-L13 PolarHBondContact O-N 2.66Å
10	F	57.2	Low	59.1	Low	132 Å²	132	118.9 Å²	118.9	58%	0.579	63%	0.631	S	S	*	*	H	α-helix	trans	-70.9	-27.8	176.1	-78.2	-67.9	0	0	0	113.1	P6 R14	P6-F10 WeakPolarHBondContact O-CD2 2.98Å; P6-F10 PolarHBondContact O-N 3.05Å; F10-R14 PolarHBondContact O-N 3.16Å
11	T	59.1	Low	59.6	Low	73 Å²	73	122.6 Å²	122.6	45%	0.448	64%	0.636	S	S	.	*	H	α-helix	trans	-80.2	-36	176.4	45.1	0	0	0	0	112.7	D7 E8 V9 L13 R14 T15	D7-T11 WeakPolarHBondContact O-CB 3.15Å; D7-T11 WeakPolarHBondContact O-CG2 3.27Å; D7-T11 PolarHBondContact O-N 3.17Å; D7-T11 PolarHBondContact O-OG1 2.68Å; E8-T11 VanDerWaalsContact CA-OG1 3.26Å; E8-T11 WeakPolarHBondContact CA-OG1 3.43Å; E8-T11 PolarHBondContact O-N 3.09Å; E8-T11 PolarHBondContact O-OG1 3.33Å; E8-T11 VanDerWaalsContact O-OG1 3.06Å; V9-T11 VanDerWaalsContact C-N 3.34Å; T11-L13 VanDerWaalsContact C-N 3.31Å; T11-L13 PolarHBondContact O-N 3.28Å; T11-R14 PolarHBondContact O-N 2.87Å; T11-R14 VanDerWaalsContact O-N 3.11Å; T11-T15 PolarHBondContact O-N 3.46Å; T11-T15 PolarHBondContact O-OG1 3.12Å
12	D	58.2	Low	60.9	Low	79 Å²	79	112.3 Å²	112.3	42%	0.422	59%	0.589	S	S	.	*	H	α-helix	trans	-65.8	-32.2	172	-169.4	50.5	0	0	0	112.4	E8 R14 T15 R16	E8-D12 PolarHBondContact O-N 2.98Å; D12-R14 VanDerWaalsContact C-N 3.3Å; D12-R14 PolarHBondContact O-N 3.26Å; D12-T15 PolarHBondContact O-OG1 3.09Å; D12-R16 IonicContact OD2-CZ 3.2Å; D12-R16 IonicContact OD2-NE 2.94Å; D12-R16 IonicContact OD2-NH2 2.66Å; D12-R16 PolarHBondContact OD2-NH2 2.95Å
13	L	56.3	Low	62.1	Low	117 Å²	117	108.9 Å²	108.9	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-69.1	-26.9	172.2	-82.9	164.8	0	0	0	113.1	V9 T11	V9-L13 HydrophobicContact CG1-CD1 4.46Å; V9-L13 PolarHBondContact O-N 2.66Å; T11-L13 VanDerWaalsContact C-N 3.31Å; T11-L13 PolarHBondContact O-N 3.28Å
14	R	56.2	Low	63.2	Low	207 Å²	207	106.3 Å²	106.3	78%	0.781	56%	0.563	S	S	*	*	H	α-helix	trans	-85.1	-25.6	-176.2	-170.8	177.9	-70.8	169.7	-0.1	113	F10 T11 D12	F10-R14 PolarHBondContact O-N 3.16Å; T11-R14 PolarHBondContact O-N 2.87Å; T11-R14 VanDerWaalsContact O-N 3.11Å; D12-R14 VanDerWaalsContact C-N 3.3Å; D12-R14 PolarHBondContact O-N 3.26Å
15	T	55.3	Low	64.4	Low	110 Å²	110	106.7 Å²	106.7	68%	0.675	56%	0.561	S	S	*	*	H	α-helix	trans	-90.1	-13.2	-176.5	46.8	0	0	0	0	114.1	T11 D12 H17	T11-T15 PolarHBondContact O-N 3.46Å; T11-T15 PolarHBondContact O-OG1 3.12Å; D12-T15 PolarHBondContact O-OG1 3.09Å; T15-H17 PolarHBondContact O-N 2.76Å; T15-H17 VanDerWaalsContact O-N 3.14Å
16	R	58.6	Low	65.6	Low	169 Å²	169	107.7 Å²	107.7	64%	0.638	56%	0.556	S	S	*	*	S	Bend	trans	-77.6	100.7	173.4	-67.5	-175.9	-172.1	-157.6	5.5	110.1	D12 L18	D12-R16 IonicContact OD2-CZ 3.2Å; D12-R16 IonicContact OD2-NE 2.94Å; D12-R16 IonicContact OD2-NH2 2.66Å; D12-R16 PolarHBondContact OD2-NH2 2.95Å; R16-L18 VanDerWaalsContact C-N 3.32Å; R16-L18 PolarHBondContact O-N 2.82Å
17	H	59.2	Low	66.9	Low	182 Å²	182	107.4 Å²	107.4	84%	0.843	56%	0.559	S	S	*	*			trans	-59.6	96.4	168.7	-172.2	-81.9	0	0	0	108.9	T15 G19	T15-H17 PolarHBondContact O-N 2.76Å; T15-H17 VanDerWaalsContact O-N 3.14Å; H17-G19 PolarHBondContact O-N 2.82Å
18	L	60.1	Low	68.1	Low	95 Å²	95	105.5 Å²	105.5	50%	0.497	56%	0.558	S	S	.	*			trans	-60.3	96.7	176.8	-82	146.1	0	0	0	108.3	R16 V23 I26	R16-L18 VanDerWaalsContact C-N 3.32Å; R16-L18 PolarHBondContact O-N 2.82Å; L18-V23 HydrophobicContact CB-CG2 4.27Å; L18-I26 HydrophobicContact CD1-CD1 4.23Å; L18-I26 HydrophobicContact CD2-CD1 3.61Å
19	G	73.3	Confident	69.4	Low	36 Å²	36	100.8 Å²	100.8	37%	0.371	55%	0.546	S	S	.	.			trans	-56.7	159.5	170.6	0	0	0	0	0	110.2	H17 W21 G22 V23	H17-G19 PolarHBondContact O-N 2.82Å; G19-W21 PolarHBondContact O-N 2.78Å; G19-G22 WeakPolarHBondContact O-CA 3.41Å; G19-G22 PolarHBondContact O-N 2.86Å; G19-V23 PolarHBondContact O-N 3.49Å
20	G	73.9	Confident	70.7	Confident	59 Å²	59	100.4 Å²	100.4	61%	0.608	54%	0.544	S	S	*	.	H	α-helix	trans	-49.7	-30.3	-177	0	0	0	0	0	113.8	V23 V24	G20-V23 PolarHBondContact O-N 3.08Å; G20-V24 VanDerWaalsContact O-CG2 3.3Å; G20-V24 WeakPolarHBondContact O-CG2 3.42Å; G20-V24 PolarHBondContact O-N 3.15Å; G20-V24 VanDerWaalsContact O-N 3.08Å
21	W	71.2	Confident	72.3	Confident	197 Å²	197	96.1 Å²	96.1	75%	0.746	54%	0.537	S	S	*	.	H	α-helix	trans	-64.2	-40.4	173.3	-160	-93.9	0	0	0	114.4	G19 V24 Q25	G19-W21 PolarHBondContact O-N 2.78Å; W21-V24 PolarHBondContact O-N 3.5Å; W21-Q25 WeakPolarHBondContact O-CG 3.31Å; W21-Q25 PolarHBondContact O-N 3.29Å
22	G	76.6	Confident	73.8	Confident	14 Å²	14	98.8 Å²	98.8	14%	0.144	55%	0.548	C	S	.	.	H	α-helix	trans	-68	-37.1	176.5	0	0	0	0	0	112.4	G19 Q25 I26	G19-G22 WeakPolarHBondContact O-CA 3.41Å; G19-G22 PolarHBondContact O-N 2.86Å; G22-Q25 PolarHBondContact O-N 3.49Å; G22-I26 WeakPolarHBondContact O-CG1 3.5Å; G22-I26 PolarHBondContact O-N 2.9Å
23	V	77.9	Confident	75.3	Confident	84 Å²	84	97.8 Å²	97.8	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-64.6	-42.2	173.7	-179.6	0	0	0	0	110.9	L18 G19 G20 I26 A27	L18-V23 HydrophobicContact CB-CG2 4.27Å; G19-V23 PolarHBondContact O-N 3.49Å; G20-V23 PolarHBondContact O-N 3.08Å; V23-I26 PolarHBondContact O-N 2.86Å; V23-A27 WeakPolarHBondContact O-CB 3.29Å; V23-A27 PolarHBondContact O-N 2.77Å
24	V	81.2	Confident	77	Confident	94 Å²	94	96.4 Å²	96.4	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-62.8	-42.2	175.6	170.6	0	0	0	0	111.5	G20 W21 A27 A28	G20-V24 VanDerWaalsContact O-CG2 3.3Å; G20-V24 WeakPolarHBondContact O-CG2 3.42Å; G20-V24 PolarHBondContact O-N 3.15Å; G20-V24 VanDerWaalsContact O-N 3.08Å; W21-V24 PolarHBondContact O-N 3.5Å; V24-A27 PolarHBondContact O-N 2.7Å; V24-A28 WeakPolarHBondContact O-CB 3.33Å; V24-A28 PolarHBondContact O-N 3.17Å
25	Q	81.3	Confident	78.4	Confident	121 Å²	121	93.6 Å²	93.6	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-64.3	-41.9	177.4	-74.8	176.7	-40.1	0	0	112.5	W21 G22 G29	W21-Q25 WeakPolarHBondContact O-CG 3.31Å; W21-Q25 PolarHBondContact O-N 3.29Å; G22-Q25 PolarHBondContact O-N 3.49Å; Q25-G29 PolarHBondContact O-N 2.93Å
26	I	85.3	Confident	79.8	Confident	94 Å²	94	91.2 Å²	91.2	48%	0.482	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-44.5	176.4	-68.5	170.2	0	0	0	110.7	L18 G22 V23 G29 T30	L18-I26 HydrophobicContact CD1-CD1 4.23Å; L18-I26 HydrophobicContact CD2-CD1 3.61Å; G22-I26 WeakPolarHBondContact O-CG1 3.5Å; G22-I26 PolarHBondContact O-N 2.9Å; V23-I26 PolarHBondContact O-N 2.86Å; I26-G29 PolarHBondContact O-N 2.67Å; I26-T30 PolarHBondContact O-N 2.76Å; I26-T30 PolarHBondContact O-OG1 3.24Å
27	A	83.4	Confident	81.1	Confident	59 Å²	59	89 Å²	89	49%	0.488	53%	0.527	S	S	.	.	H	α-helix	trans	-64.8	-41.7	179.1	0	0	0	0	0	112.1	V23 V24 T30 G31	V23-A27 WeakPolarHBondContact O-CB 3.29Å; V23-A27 PolarHBondContact O-N 2.77Å; V24-A27 PolarHBondContact O-N 2.7Å; A27-T30 PolarHBondContact O-OG1 3.48Å; A27-G31 PolarHBondContact O-N 3.37Å
28	A	85.8	Confident	82.4	Confident	64 Å²	64	88 Å²	88	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-43.1	175.2	0	0	0	0	0	111.8	V24 G31 L32	V24-A28 WeakPolarHBondContact O-CB 3.33Å; V24-A28 PolarHBondContact O-N 3.17Å; A28-G31 PolarHBondContact O-N 3Å; A28-L32 WeakPolarHBondContact O-CB 3.23Å; A28-L32 PolarHBondContact O-N 3.35Å
29	G	87.4	Confident	83.4	Confident	41 Å²	41	83.9 Å²	83.9	42%	0.423	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-46.4	179	0	0	0	0	0	113.1	Q25 I26 L32 A33	Q25-G29 PolarHBondContact O-N 2.93Å; I26-G29 PolarHBondContact O-N 2.67Å; G29-L32 PolarHBondContact O-N 3.05Å; G29-A33 WeakPolarHBondContact O-CB 3.46Å; G29-A33 PolarHBondContact O-N 3.41Å
30	T	86.8	Confident	83.4	Confident	82 Å²	82	84.5 Å²	84.5	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-39.4	175.9	40.4	0	0	0	0	111.8	I26 A27 L32 A33 V34	I26-T30 PolarHBondContact O-N 2.76Å; I26-T30 PolarHBondContact O-OG1 3.24Å; A27-T30 PolarHBondContact O-OG1 3.48Å; T30-L32 PolarHBondContact O-N 3.41Å; T30-A33 PolarHBondContact O-N 3.04Å; T30-V34 WeakPolarHBondContact O-CB 3.28Å; T30-V34 VanDerWaalsContact O-CG2 3.28Å; T30-V34 WeakPolarHBondContact O-CG2 3.24Å; T30-V34 PolarHBondContact O-N 3.18Å
31	G	90.8	Very high	83.3	Confident	41 Å²	41	86.8 Å²	86.8	42%	0.423	50%	0.504	S	S	.	.	H	α-helix	trans	-58.5	-45.6	172.3	0	0	0	0	0	112.7	A27 A28 V34 Y35	A27-G31 PolarHBondContact O-N 3.37Å; A28-G31 PolarHBondContact O-N 3Å; G31-V34 PolarHBondContact O-N 3.27Å; G31-Y35 VanDerWaalsContact O-CB 3.32Å; G31-Y35 WeakPolarHBondContact O-CB 3.15Å; G31-Y35 PolarHBondContact O-N 2.91Å
32	L	91.9	Very high	83	Confident	129 Å²	129	81.3 Å²	81.3	68%	0.675	49%	0.489	S	S	*	.	H	α-helix	trans	-64	-42.7	176.9	-164.9	86.8	0	0	0	111.7	A28 G29 T30 Y35 A36	A28-L32 WeakPolarHBondContact O-CB 3.23Å; A28-L32 PolarHBondContact O-N 3.35Å; G29-L32 PolarHBondContact O-N 3.05Å; T30-L32 PolarHBondContact O-N 3.41Å; L32-Y35 PolarHBondContact O-N 3.48Å; L32-A36 VanDerWaalsContact O-CB 3.3Å; L32-A36 WeakPolarHBondContact O-CB 3.4Å; L32-A36 PolarHBondContact O-N 3.25Å
33	A	88.7	Confident	82.2	Confident	59 Å²	59	87.1 Å²	87.1	49%	0.488	51%	0.513	S	S	.	.	H	α-helix	trans	-65.8	-43.4	178.6	0	0	0	0	0	112.1	G29 T30 Y35 A36 M37	G29-A33 WeakPolarHBondContact O-CB 3.46Å; G29-A33 PolarHBondContact O-N 3.41Å; T30-A33 PolarHBondContact O-N 3.04Å; A33-Y35 VanDerWaalsContact C-N 3.35Å; A33-A36 PolarHBondContact O-N 3.22Å; A33-M37 VanDerWaalsContact O-CB 3.32Å; A33-M37 WeakPolarHBondContact O-CB 3.32Å; A33-M37 PolarHBondContact O-N 3.49Å
34	V	91.2	Very high	80.7	Confident	88 Å²	88	88 Å²	88	53%	0.533	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-41.9	174.7	171.5	0	0	0	0	110.6	T30 G31 M37 W38	T30-V34 WeakPolarHBondContact O-CB 3.28Å; T30-V34 VanDerWaalsContact O-CG2 3.28Å; T30-V34 WeakPolarHBondContact O-CG2 3.24Å; T30-V34 PolarHBondContact O-N 3.18Å; G31-V34 PolarHBondContact O-N 3.27Å; V34-M37 PolarHBondContact O-N 2.96Å; V34-W38 WeakPolarHBondContact O-CB 3.44Å; V34-W38 PolarHBondContact O-N 2.89Å
35	Y	86.6	Confident	79.4	Confident	148 Å²	148	86 Å²	86	58%	0.58	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-45	175.6	-179.4	-98.1	0	0	0	112	G31 L32 A33 M37 W38 A39	G31-Y35 VanDerWaalsContact O-CB 3.32Å; G31-Y35 WeakPolarHBondContact O-CB 3.15Å; G31-Y35 PolarHBondContact O-N 2.91Å; L32-Y35 PolarHBondContact O-N 3.48Å; A33-Y35 VanDerWaalsContact C-N 3.35Å; Y35-M37 VanDerWaalsContact C-N 3.33Å; Y35-M37 PolarHBondContact O-N 3.43Å; Y35-W38 PolarHBondContact O-N 3.38Å; Y35-A39 WeakPolarHBondContact O-CB 3.41Å; Y35-A39 PolarHBondContact O-N 3.43Å
36	A	85.7	Confident	78	Confident	59 Å²	59	87.5 Å²	87.5	49%	0.488	52%	0.524	S	S	.	.	H	α-helix	trans	-64.9	-37	177.9	0	0	0	0	0	112	L32 A33 G40	L32-A36 VanDerWaalsContact O-CB 3.3Å; L32-A36 WeakPolarHBondContact O-CB 3.4Å; L32-A36 PolarHBondContact O-N 3.25Å; A33-A36 PolarHBondContact O-N 3.22Å; A36-G40 PolarHBondContact O-N 3.48Å
37	M	85.8	Confident	76.6	Confident	124 Å²	124	91 Å²	91	61%	0.611	53%	0.531	S	S	*	.	H	α-helix	trans	-67.9	-47	173.1	-175.8	-179.7	69.6	0	0	111.4	A33 V34 Y35 A39 G40 V41	A33-M37 VanDerWaalsContact O-CB 3.32Å; A33-M37 WeakPolarHBondContact O-CB 3.32Å; A33-M37 PolarHBondContact O-N 3.49Å; V34-M37 PolarHBondContact O-N 2.96Å; Y35-M37 VanDerWaalsContact C-N 3.33Å; Y35-M37 PolarHBondContact O-N 3.43Å; M37-A39 VanDerWaalsContact C-N 3.35Å; M37-A39 PolarHBondContact O-N 3.3Å; M37-G40 PolarHBondContact O-N 3.04Å; M37-V41 HydrophobicContact CG-CG2 4.45Å; M37-V41 WeakPolarHBondContact O-CB 3.47Å; M37-V41 WeakPolarHBondContact O-CG2 3.33Å; M37-V41 PolarHBondContact O-N 3.46Å
38	W	85.8	Confident	75.2	Confident	159 Å²	159	97.4 Å²	97.4	60%	0.602	54%	0.543	S	S	*	.	H	α-helix	trans	-61.6	-43.7	177.1	-171	91.5	0	0	0	111.4	V34 Y35 L42	V34-W38 WeakPolarHBondContact O-CB 3.44Å; V34-W38 PolarHBondContact O-N 2.89Å; Y35-W38 PolarHBondContact O-N 3.38Å; W38-L42 HydrophobicContact CD2-CD1 3.51Å; W38-L42 HydrophobicContact CD2-CG 4.46Å; W38-L42 HydrophobicContact CE3-CD1 3.86Å; W38-L42 HydrophobicContact CG-CD1 4.18Å; W38-L42 HydrophobicContact CH2-CD1 3.53Å; W38-L42 HydrophobicContact CZ2-CD1 3.15Å; W38-L42 HydrophobicContact CZ3-CD1 3.87Å; W38-L42 VanDerWaalsContact O-CB 3.3Å; W38-L42 WeakPolarHBondContact O-CB 3.5Å; W38-L42 WeakPolarHBondContact O-CG 3.31Å; W38-L42 PolarHBondContact O-N 3.46Å
39	A	80.1	Confident	73.8	Confident	10 Å²	10	95 Å²	95	8%	0.083	52%	0.521	C	S	.	.	H	α-helix	trans	-63.9	-47.6	173	0	0	0	0	0	111.1	Y35 M37 V41 L42 Q43	Y35-A39 WeakPolarHBondContact O-CB 3.41Å; Y35-A39 PolarHBondContact O-N 3.43Å; M37-A39 VanDerWaalsContact C-N 3.35Å; M37-A39 PolarHBondContact O-N 3.3Å; A39-V41 VanDerWaalsContact C-N 3.32Å; A39-V41 PolarHBondContact O-N 3.47Å; A39-L42 PolarHBondContact O-N 3.01Å; A39-Q43 HydrophobicContact CB-CG 4.48Å; A39-Q43 VanDerWaalsContact O-CA 3.26Å; A39-Q43 WeakPolarHBondContact O-CA 3.38Å; A39-Q43 WeakPolarHBondContact O-CB 3.5Å; A39-Q43 WeakPolarHBondContact O-CG 3.49Å; A39-Q43 PolarHBondContact O-N 3.39Å
40	G	73.9	Confident	72.7	Confident	49 Å²	49	96.5 Å²	96.5	51%	0.505	52%	0.524	S	S	.	.	H	α-helix	trans	-63.9	-32.6	178.9	0	0	0	0	0	114.1	A36 M37 P44	A36-G40 PolarHBondContact O-N 3.48Å; M37-G40 PolarHBondContact O-N 3.04Å; G40-P44 VanDerWaalsContact O-CD 3.3Å; G40-P44 WeakPolarHBondContact O-CD 3.4Å
41	V	72.8	Confident	71.3	Confident	106 Å²	106	97 Å²	97	64%	0.642	52%	0.523	S	S	*	.	H	α-helix	trans	-80.3	-35.9	177.7	172.4	0	0	0	0	111.9	M37 A39 P44	M37-V41 HydrophobicContact CG-CG2 4.45Å; M37-V41 WeakPolarHBondContact O-CB 3.47Å; M37-V41 WeakPolarHBondContact O-CG2 3.33Å; M37-V41 PolarHBondContact O-N 3.46Å; A39-V41 VanDerWaalsContact C-N 3.32Å; A39-V41 PolarHBondContact O-N 3.47Å; V41-P44 VanDerWaalsContact O-CD 3.29Å; V41-P44 WeakPolarHBondContact O-CD 3.24Å
42	L	64.1	Low	69.8	Low	82 Å²	82	104.4 Å²	104.4	43%	0.429	54%	0.543	S	S	.	.	H	α-helix	trans	-94.2	-14.5	179.4	-65.1	179.7	0	0	0	114.6	W38 A39 P44	W38-L42 HydrophobicContact CD2-CD1 3.51Å; W38-L42 HydrophobicContact CD2-CG 4.46Å; W38-L42 HydrophobicContact CE3-CD1 3.86Å; W38-L42 HydrophobicContact CG-CD1 4.18Å; W38-L42 HydrophobicContact CH2-CD1 3.53Å; W38-L42 HydrophobicContact CZ2-CD1 3.15Å; W38-L42 HydrophobicContact CZ3-CD1 3.87Å; W38-L42 VanDerWaalsContact O-CB 3.3Å; W38-L42 WeakPolarHBondContact O-CB 3.5Å; W38-L42 WeakPolarHBondContact O-CG 3.31Å; W38-L42 PolarHBondContact O-N 3.46Å; A39-L42 PolarHBondContact O-N 3.01Å; L42-P44 VanDerWaalsContact C-CD 3.4Å
43	Q	60	Low	68.2	Low	136 Å²	136	100.2 Å²	100.2	64%	0.636	52%	0.522	S	S	*	.			trans	-110.1	20.7	-178.4	-53.8	-175	-37.8	0	0	116.7	A39 G45	A39-Q43 HydrophobicContact CB-CG 4.48Å; A39-Q43 VanDerWaalsContact O-CA 3.26Å; A39-Q43 WeakPolarHBondContact O-CA 3.38Å; A39-Q43 WeakPolarHBondContact O-CB 3.5Å; A39-Q43 WeakPolarHBondContact O-CG 3.49Å; A39-Q43 PolarHBondContact O-N 3.39Å; Q43-G45 VanDerWaalsContact C-N 3.35Å; Q43-G45 PolarHBondContact O-N 3.39Å; Q43-G45 VanDerWaalsContact O-N 3.07Å
44	P	46.3	Very low	67.1	Low	102 Å²	102	102.7 Å²	102.7	66%	0.662	52%	0.523	S	S	*	.	S	Bend	trans	-82.5	88.5	162.1	30.9	-20.1	0	0	0	108	G40 V41 L42	G40-P44 VanDerWaalsContact O-CD 3.3Å; G40-P44 WeakPolarHBondContact O-CD 3.4Å; V41-P44 VanDerWaalsContact O-CD 3.29Å; V41-P44 WeakPolarHBondContact O-CD 3.24Å; L42-P44 VanDerWaalsContact C-CD 3.4Å
45	G	53.8	Low	65.9	Low	54 Å²	54	101.2 Å²	101.2	56%	0.557	51%	0.514	S	S	*	.	S	Bend	trans	90.4	17.4	164.9	0	0	0	0	0	118	Q43 R47	Q43-G45 VanDerWaalsContact C-N 3.35Å; Q43-G45 PolarHBondContact O-N 3.39Å; Q43-G45 VanDerWaalsContact O-N 3.07Å; G45-R47 VanDerWaalsContact C-N 3.26Å; G45-R47 PolarHBondContact O-N 3.43Å; G45-R47 VanDerWaalsContact O-N 3.07Å
46	F	52.1	Low	65.4	Low	151 Å²	151	98.7 Å²	98.7	66%	0.662	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-2.8	-169.1	-158.1	-104.4	0	0	0	117
47	R	54.7	Low	65.1	Low	167 Å²	167	100.3 Å²	100.3	63%	0.63	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.1	66.7	170.1	-66.3	-175.8	-172.9	154.2	4.7	112.1	G45 V49	G45-R47 VanDerWaalsContact C-N 3.26Å; G45-R47 PolarHBondContact O-N 3.43Å; G45-R47 VanDerWaalsContact O-N 3.07Å; R47-V49 PolarHBondContact O-N 3.28Å
48	R	55.4	Low	65	Low	194 Å²	194	98.8 Å²	98.8	73%	0.732	50%	0.503	S	S	*	.	S	Bend	trans	-58.2	-24	161.6	-73.8	-172.6	-173.9	157.3	2.9	111.9
49	V	56.4	Low	65	Low	13 Å²	13	93.8 Å²	93.8	8%	0.079	49%	0.492	C	S	.	.	S	Bend	trans	-135.3	133.8	178.9	179.6	0	0	0	0	108.8	R47 L53 L106	R47-V49 PolarHBondContact O-N 3.28Å; V49-L53 HydrophobicContact CG1-CB 3.34Å; V49-L53 HydrophobicContact CG1-CD1 4.44Å; V49-L53 HydrophobicContact CG1-CG 4.39Å; V49-L106 HydrophobicContact CB-CD2 3.87Å; V49-L106 HydrophobicContact CG2-CD1 3.91Å; V49-L106 HydrophobicContact CG2-CD2 3.39Å; V49-L106 HydrophobicContact CG2-CG 4.3Å
50	P	63.4	Low	65.4	Low	74 Å²	74	93.6 Å²	93.6	48%	0.481	49%	0.49	S	S	.	.			trans	-55.7	145.7	177.3	-20.7	28.9	0	0	0	111.6	K52 L53	P50-K52 PolarHBondContact O-N 3.49Å; P50-L53 HydrophobicContact CB-CD1 4.04Å; P50-L53 HydrophobicContact CG-CD1 3.66Å; P50-L53 WeakPolarHBondContact O-CB 3.45Å; P50-L53 PolarHBondContact O-N 3.27Å
51	L	58.8	Low	66.3	Low	93 Å²	93	93 Å²	93	49%	0.487	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-50.4	-33.2	176.3	-81.6	160	0	0	0	113.1	L53 Q54	L51-L53 PolarHBondContact O-N 2.95Å; L51-Q54 WeakPolarHBondContact O-CB 3.43Å; L51-Q54 PolarHBondContact O-N 3.09Å; L51-Q54 VanDerWaalsContact O-N 3.14Å
52	K	57.4	Low	67.3	Low	195 Å²	195	96.9 Å²	96.9	85%	0.848	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-64.7	-17.9	177.5	-64.6	-173.9	177.7	-177.6	0	114.5	P50	P50-K52 PolarHBondContact O-N 3.49Å
53	L	59.9	Low	68.8	Low	42 Å²	42	95.1 Å²	95.1	22%	0.22	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-104.4	0	179	-80.1	132	0	0	0	112.1	V49 P50 L51 V55 W135 V153 L156	V49-L53 HydrophobicContact CG1-CB 3.34Å; V49-L53 HydrophobicContact CG1-CD1 4.44Å; V49-L53 HydrophobicContact CG1-CG 4.39Å; P50-L53 HydrophobicContact CB-CD1 4.04Å; P50-L53 HydrophobicContact CG-CD1 3.66Å; P50-L53 WeakPolarHBondContact O-CB 3.45Å; P50-L53 PolarHBondContact O-N 3.27Å; L51-L53 PolarHBondContact O-N 2.95Å; L53-V55 PolarHBondContact O-N 3.27Å; L53-W135 HydrophobicContact CD2-CZ2 3.64Å; L53-V153 HydrophobicContact CD2-CG2 4.4Å; L53-L156 HydrophobicContact CD2-CD1 4.46Å
54	Q	64	Low	70.5	Confident	110 Å²	110	88.6 Å²	88.6	51%	0.514	45%	0.453	S	S	.	.			trans	-75.9	111.5	172.4	-67.7	-175.5	-6.1	0	0	109.2	L51	L51-Q54 WeakPolarHBondContact O-CB 3.43Å; L51-Q54 PolarHBondContact O-N 3.09Å; L51-Q54 VanDerWaalsContact O-N 3.14Å
55	V	66	Low	72.8	Confident	57 Å²	57	84.1 Å²	84.1	35%	0.345	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-97.2	128.7	176	-177.6	0	0	0	0	108.1	L53 Y57 A150 V153	L53-V55 PolarHBondContact O-N 3.27Å; V55-Y57 PolarHBondContact O-N 3.17Å; V55-A150 HydrophobicContact CB-CB 4.5Å; V55-A150 HydrophobicContact CG1-CB 3.83Å; V55-A150 HydrophobicContact CG2-CB 3.84Å; V55-V153 HydrophobicContact CG2-CG2 3.61Å
56	P	76.3	Confident	74.9	Confident	96 Å²	96	88.5 Å²	88.5	62%	0.623	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-61.9	136.1	173.5	26.2	-33.5	0	0	0	109.7	I58	P56-I58 PolarHBondContact O-N 2.82Å
57	Y	80	Confident	77	Confident	93 Å²	93	82.6 Å²	82.6	37%	0.365	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.5	116.3	176.7	172.7	-109.3	0	0	0	110	V55 P59 D86 L110	V55-Y57 PolarHBondContact O-N 3.17Å; Y57-P59 HydrophobicContact CE1-CB 4.48Å; Y57-P59 HydrophobicContact CE1-CG 4.49Å; Y57-D86 WeakPolarHBondContact OH-CB 3.37Å; Y57-D86 PolarHBondContact OH-OD1 3.25Å; Y57-L110 HydrophobicContact CD1-CD2 3.93Å; Y57-L110 HydrophobicContact CD2-CD1 3.69Å; Y57-L110 HydrophobicContact CD2-CD2 4.03Å; Y57-L110 HydrophobicContact CE1-CD2 4.06Å; Y57-L110 HydrophobicContact CE2-CD1 4.41Å; Y57-L110 HydrophobicContact CE2-CD2 4.17Å; Y57-L110 HydrophobicContact CG-CD1 3.84Å; Y57-L110 HydrophobicContact CG-CD2 3.91Å
58	I	83.6	Confident	79	Confident	91 Å²	91	74.8 Å²	74.8	47%	0.467	37%	0.374	S	S	.	.			trans	-127.2	114.8	171.8	-56.6	173	0	0	0	107	P56 F148 R175	P56-I58 PolarHBondContact O-N 2.82Å; I58-F148 WeakPolarHBondContact O-CE1 3.38Å; I58-R175 VanDerWaalsContact CG2-NH1 3.27Å
59	P	86.8	Confident	81	Confident	55 Å²	55	65.7 Å²	65.7	36%	0.357	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-63.2	140.8	-178.6	21.9	-30.5	0	0	0	111.9	Y57 R88	Y57-P59 HydrophobicContact CE1-CB 4.48Å; Y57-P59 HydrophobicContact CE1-CG 4.49Å; P59-R88 VanDerWaalsContact CB-CZ 3.49Å; P59-R88 VanDerWaalsContact CB-NH2 3.33Å
60	A	88.4	Confident	83	Confident	5 Å²	5	66.8 Å²	66.8	4%	0.041	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-67.2	134.1	170.1	0	0	0	0	0	110.4	Q64 V65 R88 F148	A60-Q64 HydrophobicContact CB-CB 4.48Å; A60-Q64 HydrophobicContact CB-CG 4.21Å; A60-V65 HydrophobicContact CB-CG2 4.06Å; A60-R88 WeakPolarHBondContact O-CD 3.3Å; A60-R88 PolarHBondContact O-NH1 3.2Å; A60-F148 HydrophobicContact CB-CE1 4.48Å; A60-F148 HydrophobicContact CB-CE2 4.43Å; A60-F148 HydrophobicContact CB-CZ 4.39Å
61	S	92.6	Very high	84.5	Confident	36 Å²	36	63.6 Å²	63.6	25%	0.252	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-65	160.7	178.3	81.7	0	0	0	0	111.2	A63 Q64 V65 D192	S61-A63 PolarHBondContact O-N 3Å; S61-A63 PolarHBondContact OG-N 3.29Å; S61-Q64 WeakPolarHBondContact O-CB 3.39Å; S61-Q64 PolarHBondContact O-N 3.43Å; S61-Q64 VanDerWaalsContact O-N 3.16Å; S61-Q64 WeakPolarHBondContact OG-CB 3.44Å; S61-Q64 PolarHBondContact OG-N 3.06Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.35Å; S61-D192 WeakPolarHBondContact CB-OD1 3.47Å; S61-D192 VanDerWaalsContact OG-CG 3.27Å; S61-D192 PolarHBondContact OG-OD1 3.18Å
62	K	93.9	Very high	86.3	Confident	188 Å²	188	59.2 Å²	59.2	82%	0.817	30%	0.302	S	S	*	.	H	α-helix	trans	-58.9	-37.3	174.3	-69.3	-175.2	177.6	-177.8	0	112.1	V65 K66	K62-V65 PolarHBondContact O-N 3.45Å; K62-K66 WeakPolarHBondContact O-CB 3.29Å; K62-K66 PolarHBondContact O-N 3.1Å
63	A	95	Very high	88.1	Confident	45 Å²	45	58.1 Å²	58.1	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-43.6	176.7	0	0	0	0	0	111.1	S61 K66 N67 D192	S61-A63 PolarHBondContact O-N 3Å; S61-A63 PolarHBondContact OG-N 3.29Å; A63-K66 WeakPolarHBondContact O-CB 3.46Å; A63-K66 PolarHBondContact O-N 2.89Å; A63-N67 PolarHBondContact O-N 3.41Å; A63-N67 PolarHBondContact O-ND2 3.19Å; A63-N67 PolarHBondContact O-OD1 3.28Å; A63-D192 HydrophobicContact CB-CB 4.35Å
64	Q	95.1	Very high	89.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-43.9	177.1	-179.9	159	67.1	0	0	112.9	A60 S61 K66 N67 V68 F148 V191 D192	A60-Q64 HydrophobicContact CB-CB 4.48Å; A60-Q64 HydrophobicContact CB-CG 4.21Å; S61-Q64 WeakPolarHBondContact O-CB 3.39Å; S61-Q64 PolarHBondContact O-N 3.43Å; S61-Q64 VanDerWaalsContact O-N 3.16Å; S61-Q64 WeakPolarHBondContact OG-CB 3.44Å; S61-Q64 PolarHBondContact OG-N 3.06Å; Q64-K66 VanDerWaalsContact C-N 3.3Å; Q64-K66 PolarHBondContact O-N 3.03Å; Q64-N67 PolarHBondContact O-N 3Å; Q64-N67 VanDerWaalsContact O-N 3.15Å; Q64-V68 WeakPolarHBondContact O-CG2 3.49Å; Q64-V68 PolarHBondContact O-N 2.85Å; Q64-F148 HydrophobicContact CG-CE2 4.33Å; Q64-V191 PolarHBondContact NE2-O 2.94Å; Q64-D192 HydrophobicContact CB-CB 4.3Å
65	V	96.2	Very high	91.1	Very high	7 Å²	7	58.5 Å²	58.5	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-43.7	175.7	179.3	0	0	0	0	110.4	A60 S61 K62 N67 V68 M69 R88 I89 E92	A60-V65 HydrophobicContact CB-CG2 4.06Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.35Å; K62-V65 PolarHBondContact O-N 3.45Å; V65-N67 VanDerWaalsContact C-N 3.33Å; V65-N67 PolarHBondContact O-N 3.08Å; V65-V68 PolarHBondContact O-N 2.85Å; V65-M69 HydrophobicContact CG1-CE 4.27Å; V65-M69 HydrophobicContact CG1-CG 4.39Å; V65-M69 WeakPolarHBondContact O-CG 3.36Å; V65-M69 PolarHBondContact O-N 3.05Å; V65-R88 HydrophobicContact CG2-CG 4Å; V65-I89 HydrophobicContact CG2-CG1 4.06Å; V65-E92 HydrophobicContact CG1-CB 3.87Å; V65-E92 HydrophobicContact CG1-CG 3.79Å
66	K	96.7	Very high	92.4	Very high	146 Å²	146	61.4 Å²	61.4	64%	0.635	33%	0.328	S	S	*	.	H	α-helix	trans	-59.9	-40.4	174.6	-176.5	-178.8	177.2	-176.3	0	112.6	K62 A63 Q64 M69 T70	K62-K66 WeakPolarHBondContact O-CB 3.29Å; K62-K66 PolarHBondContact O-N 3.1Å; A63-K66 WeakPolarHBondContact O-CB 3.46Å; A63-K66 PolarHBondContact O-N 2.89Å; Q64-K66 VanDerWaalsContact C-N 3.3Å; Q64-K66 PolarHBondContact O-N 3.03Å; K66-M69 PolarHBondContact O-N 3.37Å; K66-T70 WeakPolarHBondContact O-CB 3.4Å; K66-T70 PolarHBondContact O-N 3.28Å; K66-T70 PolarHBondContact O-OG1 2.8Å
67	N	97.1	Very high	93.2	Very high	27 Å²	27	58.4 Å²	58.4	14%	0.144	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-43.6	177.5	-63.9	-21.7	0	0	0	111	A63 Q64 V65 M69 T70 L71 E187 G188 D192 A194	A63-N67 PolarHBondContact O-N 3.41Å; A63-N67 PolarHBondContact O-ND2 3.19Å; A63-N67 PolarHBondContact O-OD1 3.28Å; Q64-N67 PolarHBondContact O-N 3Å; Q64-N67 VanDerWaalsContact O-N 3.15Å; V65-N67 VanDerWaalsContact C-N 3.33Å; V65-N67 PolarHBondContact O-N 3.08Å; N67-M69 PolarHBondContact O-N 3.48Å; N67-T70 WeakPolarHBondContact O-CB 3.24Å; N67-T70 PolarHBondContact O-N 2.91Å; N67-L71 WeakPolarHBondContact O-CG 3.29Å; N67-L71 PolarHBondContact O-N 2.77Å; N67-E187 HydrophobicContact CB-CB 4.1Å; N67-G188 WeakPolarHBondContact ND2-CA 3.32Å; N67-D192 PolarHBondContact ND2-O 3.08Å; N67-A194 HydrophobicContact CB-CB 4.27Å
68	V	96.6	Very high	93.9	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.024	31%	0.306	C	S	.	.	H	α-helix	trans	-58.5	-48.2	173.2	171.3	0	0	0	0	110.9	Q64 V65 T70 L71 V72 I89 T146 V172 A194	Q64-V68 WeakPolarHBondContact O-CG2 3.49Å; Q64-V68 PolarHBondContact O-N 2.85Å; V65-V68 PolarHBondContact O-N 2.85Å; V68-T70 PolarHBondContact O-N 2.84Å; V68-L71 WeakPolarHBondContact O-CB 3.4Å; V68-L71 PolarHBondContact O-N 2.87Å; V68-L71 VanDerWaalsContact O-N 3.14Å; V68-V72 PolarHBondContact O-N 2.91Å; V68-I89 HydrophobicContact CG1-CG2 4.38Å; V68-T146 HydrophobicContact CG1-CG2 3.71Å; V68-V172 HydrophobicContact CB-CG1 4.3Å; V68-V172 HydrophobicContact CG1-CG1 3.95Å; V68-V172 HydrophobicContact CG2-CG1 4.1Å; V68-A194 HydrophobicContact CG2-CB 4.01Å
69	M	97.3	Very high	94.6	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-29.2	177.8	-65.2	-51.2	142.8	0	0	113.1	V65 K66 N67 V72 R73 I89 E92 A93	V65-M69 HydrophobicContact CG1-CE 4.27Å; V65-M69 HydrophobicContact CG1-CG 4.39Å; V65-M69 WeakPolarHBondContact O-CG 3.36Å; V65-M69 PolarHBondContact O-N 3.05Å; K66-M69 PolarHBondContact O-N 3.37Å; N67-M69 PolarHBondContact O-N 3.48Å; M69-V72 WeakPolarHBondContact O-CG2 3.34Å; M69-V72 HydrophobicContact SD-CG2 4.22Å; M69-R73 PolarHBondContact O-N 2.91Å; M69-I89 HydrophobicContact CE-CB 4.44Å; M69-I89 HydrophobicContact CE-CG2 3.68Å; M69-I89 WeakPolarHBondContact CE-O 3.33Å; M69-E92 HydrophobicContact CE-CB 4.04Å; M69-E92 HydrophobicContact CG-CB 4.4Å; M69-A93 HydrophobicContact CE-CB 4.01Å; M69-A93 HydrophobicContact SD-CB 4.2Å
70	T	97.3	Very high	95.1	Very high	36 Å²	36	48.7 Å²	48.7	22%	0.221	27%	0.268	C	S	.	.	H	α-helix	trans	-70.8	-39.1	174.9	-59.3	0	0	0	0	111.2	K66 N67 V68 R73 E187	K66-T70 WeakPolarHBondContact O-CB 3.4Å; K66-T70 PolarHBondContact O-N 3.28Å; K66-T70 PolarHBondContact O-OG1 2.8Å; N67-T70 WeakPolarHBondContact O-CB 3.24Å; N67-T70 PolarHBondContact O-N 2.91Å; V68-T70 PolarHBondContact O-N 2.84Å; T70-R73 WeakPolarHBondContact O-CB 3.28Å; T70-R73 PolarHBondContact O-N 3.12Å; T70-E187 HydrophobicContact CG2-CG 4.35Å
71	L	96.8	Very high	95.5	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-66.9	-35.4	177.8	-74	173.1	0	0	0	113.4	N67 V68 R73 V172 R185 E187 A194 A196	N67-L71 WeakPolarHBondContact O-CG 3.29Å; N67-L71 PolarHBondContact O-N 2.77Å; V68-L71 WeakPolarHBondContact O-CB 3.4Å; V68-L71 PolarHBondContact O-N 2.87Å; V68-L71 VanDerWaalsContact O-N 3.14Å; L71-R73 VanDerWaalsContact C-N 3.31Å; L71-V172 HydrophobicContact CB-CG1 4.19Å; L71-V172 HydrophobicContact CB-CG2 4.08Å; L71-V172 HydrophobicContact CD1-CG1 3.67Å; L71-R185 HydrophobicContact CD2-CB 3.64Å; L71-E187 HydrophobicContact CD1-CB 4.26Å; L71-E187 HydrophobicContact CD1-CG 4.5Å; L71-E187 HydrophobicContact CD2-CB 4.02Å; L71-E187 HydrophobicContact CD2-CG 3.39Å; L71-E187 HydrophobicContact CG-CB 3.93Å; L71-E187 HydrophobicContact CG-CG 3.69Å; L71-A194 HydrophobicContact CD1-CB 3.52Å; L71-A196 HydrophobicContact CB-CB 4.21Å; L71-A196 HydrophobicContact CD1-CB 4.25Å; L71-A196 HydrophobicContact CD2-CB 3.89Å; L71-A196 HydrophobicContact CG-CB 4.35Å
72	V	96.1	Very high	95.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.2	176.3	-57.5	0	0	0	0	113.2	V68 M69 G74 R75 F98 L170 V172	V68-V72 PolarHBondContact O-N 2.91Å; M69-V72 WeakPolarHBondContact O-CG2 3.34Å; M69-V72 HydrophobicContact SD-CG2 4.22Å; V72-G74 PolarHBondContact O-N 3.47Å; V72-R75 WeakPolarHBondContact O-CB 3.24Å; V72-R75 PolarHBondContact O-N 2.93Å; V72-F98 HydrophobicContact CB-CE2 4.33Å; V72-F98 HydrophobicContact CB-CZ 3.88Å; V72-F98 HydrophobicContact CG2-CE2 3.7Å; V72-F98 HydrophobicContact CG2-CZ 3.77Å; V72-L170 HydrophobicContact CG1-CD2 4.27Å; V72-V172 HydrophobicContact CG1-CB 4.49Å; V72-V172 HydrophobicContact CG1-CG2 3.62Å
73	R	94.4	Very high	95.6	Very high	172 Å²	172	38.6 Å²	38.6	65%	0.649	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	133.2	-177.8	-172.9	-176.8	-65.3	-172.1	1.5	111	M69 T70 L71 R75	M69-R73 PolarHBondContact O-N 2.91Å; T70-R73 WeakPolarHBondContact O-CB 3.28Å; T70-R73 PolarHBondContact O-N 3.12Å; L71-R73 VanDerWaalsContact C-N 3.31Å; R73-R75 VanDerWaalsContact C-N 3.29Å
74	G	92.9	Very high	95.5	Very high	77 Å²	77	36.7 Å²	36.7	79%	0.794	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.9	-4.1	-178.3	0	0	0	0	0	113.8	V72	V72-G74 PolarHBondContact O-N 3.47Å
75	R	94.5	Very high	95.4	Very high	84 Å²	84	36.9 Å²	36.9	32%	0.317	21%	0.209	S	C	.	.			trans	-87.3	156.4	165.7	-57.8	-154.6	63.7	118.7	-1	110.6	V72 R73 F98 N144 D168 L170	V72-R75 WeakPolarHBondContact O-CB 3.24Å; V72-R75 PolarHBondContact O-N 2.93Å; R73-R75 VanDerWaalsContact C-N 3.29Å; R75-F98 HydrophobicContact CB-CE1 4.13Å; R75-F98 HydrophobicContact CB-CZ 4.22Å; R75-N144 WeakPolarHBondContact CB-OD1 3.49Å; R75-N144 WeakPolarHBondContact CD-OD1 3.46Å; R75-N144 PolarHBondContact NE-OD1 2.75Å; R75-D168 PolarHBondContact NH1-O 3.14Å; R75-D168 PolarHBondContact NH2-O 2.86Å; R75-L170 VanDerWaalsContact CD-CD2 3.46Å; R75-L170 HydrophobicContact CG-CD2 4.43Å
76	T	93.2	Very high	95.3	Very high	117 Å²	117	37 Å²	37	72%	0.718	21%	0.209	S	C	*	.			trans	-134.3	171.4	179.5	59.2	0	0	0	0	109.8	N144	T76-N144 PolarHBondContact O-ND2 2.92Å; T76-N144 VanDerWaalsContact O-ND2 3.09Å
77	G	93.3	Very high	95.2	Very high	34 Å²	34	30.1 Å²	30.1	35%	0.351	18%	0.179	S	C	.	.	S	Bend	trans	95.9	-147.1	177.1	0	0	0	0	0	113.2	S99	G77-S99 CarbonylContact C-O 3.53Å; G77-S99 PolarHBondContact O-N 3.02Å
78	D	94.9	Very high	95.2	Very high	31 Å²	31	32.3 Å²	32.3	17%	0.166	19%	0.186	C	C	.	.			trans	-76.3	149.4	-177.1	69	-31.3	0	0	0	112	P100 C142 K143 N144	D78-P100 CarbonylContact C-O 3.6Å; D78-P100 VanDerWaalsContact CA-O 3.29Å; D78-P100 WeakPolarHBondContact CA-O 3.5Å; D78-P100 HydrophobicContact CB-CG 3.92Å; D78-C142 WeakPolarHBondContact OD2-CA 3.44Å; D78-K143 PolarHBondContact OD1-N 2.89Å; D78-N144 VanDerWaalsContact O-CB 3.31Å; D78-N144 WeakPolarHBondContact O-CB 3.36Å; D78-N144 PolarHBondContact O-ND2 3.02Å
79	L	97.6	Very high	95.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.8	170.1	-173.2	147	0	0	0	110	A93 F98 P100 A101 V102 N144 T146	L79-A93 HydrophobicContact CB-CB 4.42Å; L79-A93 HydrophobicContact CD1-CB 3.79Å; L79-A93 HydrophobicContact CD2-CB 3.71Å; L79-A93 HydrophobicContact CG-CB 4.18Å; L79-F98 HydrophobicContact CB-CB 3.83Å; L79-F98 HydrophobicContact CB-CD1 3.88Å; L79-F98 HydrophobicContact CB-CG 3.9Å; L79-F98 HydrophobicContact CD1-CD1 4.13Å; L79-F98 HydrophobicContact CD1-CD2 4.06Å; L79-F98 HydrophobicContact CD1-CE1 4.29Å; L79-F98 HydrophobicContact CD1-CE2 4.23Å; L79-F98 HydrophobicContact CD1-CG 4.01Å; L79-F98 HydrophobicContact CD1-CZ 4.35Å; L79-P100 PolarHBondContact N-O 3.42Å; L79-A101 WeakPolarHBondContact O-CA 3.29Å; L79-V102 PolarHBondContact O-N 2.89Å; L79-N144 WeakPolarHBondContact CA-O 3.47Å; L79-N144 HydrophobicContact CB-CB 4.34Å; L79-N144 HydrophobicContact CD1-CB 4.36Å; L79-N144 HydrophobicContact CG-CB 4.31Å; L79-T146 HydrophobicContact CD1-CG2 4.2Å; L79-T146 HydrophobicContact CD2-CG2 4.19Å; L79-T146 HydrophobicContact CG-CG2 4.42Å
80	V	97.7	Very high	95.2	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.024	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127	179.4	174.2	0	0	0	0	110.4	L82 V102 Y104 L139 C142 N144 V145 T146	V80-L82 HydrophobicContact CG1-CD2 3.79Å; V80-L82 HydrophobicContact CG1-CG 4.42Å; V80-V102 CarbonylContact C-O 3.54Å; V80-V102 VanDerWaalsContact CA-O 3.32Å; V80-V102 WeakPolarHBondContact CA-O 3.5Å; V80-V102 HydrophobicContact CG2-CB 4.41Å; V80-Y104 HydrophobicContact CG1-CD2 3.56Å; V80-Y104 HydrophobicContact CG1-CE2 3.52Å; V80-L139 HydrophobicContact CG1-CD2 4.38Å; V80-C142 HydrophobicContact CG2-CB 4.33Å; V80-N144 PolarHBondContact N-O 3.08Å; V80-V145 CarbonylContact O-C 3.51Å; V80-V145 VanDerWaalsContact O-CA 3.28Å; V80-V145 WeakPolarHBondContact O-CA 3.4Å; V80-T146 PolarHBondContact O-N 2.96Å
81	D	97.2	Very high	95.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115	175.3	-166.2	31.4	0	0	0	110.5	S84 I89 V90 V102 Y104 T146	D81-S84 VanDerWaalsContact OD2-CA 3.25Å; D81-S84 WeakPolarHBondContact OD2-CA 3.39Å; D81-S84 WeakPolarHBondContact OD2-CB 3.35Å; D81-I89 WeakPolarHBondContact OD2-CB 3.24Å; D81-V90 HydrophobicContact CB-CG2 3.41Å; D81-V90 VanDerWaalsContact CB-CG2 3.41Å; D81-V102 PolarHBondContact N-O 2.97Å; D81-Y104 PolarHBondContact O-N 3.48Å; D81-T146 WeakPolarHBondContact CA-O 3.44Å; D81-T146 VanDerWaalsContact CA-OG1 3.32Å; D81-T146 WeakPolarHBondContact CA-OG1 3.36Å; D81-T146 VanDerWaalsContact CB-OG1 3.29Å; D81-T146 WeakPolarHBondContact CB-OG1 3.46Å; D81-T146 WeakPolarHBondContact OD1-CB 3.41Å; D81-T146 PolarHBondContact OD1-OG1 3.2Å
82	L	95.6	Very high	95.2	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.3	179.4	-52.8	176.5	0	0	0	109.7	V80 Y104 L134 L139 V145 T146 V147 L157 L161	V80-L82 HydrophobicContact CG1-CD2 3.79Å; V80-L82 HydrophobicContact CG1-CG 4.42Å; L82-Y104 HydrophobicContact CD2-CD2 4Å; L82-L134 HydrophobicContact CD2-CB 4.36Å; L82-L139 HydrophobicContact CD1-CD1 4.02Å; L82-L139 HydrophobicContact CD2-CD2 4.08Å; L82-V145 HydrophobicContact CD1-CG1 3.83Å; L82-V145 HydrophobicContact CG-CG1 4.03Å; L82-T146 PolarHBondContact N-O 2.89Å; L82-V147 HydrophobicContact CB-CG1 4.07Å; L82-V147 HydrophobicContact CD1-CG1 3.95Å; L82-V147 HydrophobicContact CG-CG1 4.27Å; L82-L157 HydrophobicContact CD1-CD1 4.22Å; L82-L157 HydrophobicContact CD1-CD2 4.19Å; L82-L161 HydrophobicContact CD1-CD2 4.05Å
83	G	93	Very high	95.2	Very high	16 Å²	16	35 Å²	35	17%	0.165	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	50.8	-171.5	0	0	0	0	0	111.9	G85 Y104	G83-G85 PolarHBondContact O-N 3.4Å; G83-G85 VanDerWaalsContact O-N 3.11Å; G83-Y104 VanDerWaalsContact CA-O 3.29Å; G83-Y104 WeakPolarHBondContact CA-O 3.48Å; G83-Y104 PolarHBondContact N-O 3.44Å
84	S	93	Very high	95.4	Very high	6 Å²	6	29.6 Å²	29.6	4%	0.042	18%	0.176	C	C	.	.			trans	-66.8	-15	-168.1	66.3	0	0	0	0	115.4	D81 D86 G87 Y104	D81-S84 VanDerWaalsContact OD2-CA 3.25Å; D81-S84 WeakPolarHBondContact OD2-CA 3.39Å; D81-S84 WeakPolarHBondContact OD2-CB 3.35Å; S84-D86 PolarHBondContact O-N 2.73Å; S84-G87 WeakPolarHBondContact O-CA 3.27Å; S84-G87 PolarHBondContact O-N 3.48Å; S84-Y104 PolarHBondContact N-O 3.35Å
85	G	92.7	Very high	95.5	Very high	4 Å²	4	31 Å²	31	4%	0.041	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	-120.3	178	0	0	0	0	0	112.8	G83 G87 E105 L110	G83-G85 PolarHBondContact O-N 3.4Å; G83-G85 VanDerWaalsContact O-N 3.11Å; G85-G87 PolarHBondContact O-N 3.06Å; G85-E105 PolarHBondContact N-OE2 2.96Å; G85-L110 CarbonylContact O-C 3.57Å
86	D	94.1	Very high	95.5	Very high	9 Å²	9	32 Å²	32	5%	0.048	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	9.7	176.4	70	-41.6	0	0	0	114.3	Y57 S84 R88 L113 A114 H117	Y57-D86 WeakPolarHBondContact OH-CB 3.37Å; Y57-D86 PolarHBondContact OH-OD1 3.25Å; S84-D86 PolarHBondContact O-N 2.73Å; D86-R88 VanDerWaalsContact C-N 3.3Å; D86-R88 PolarHBondContact O-N 3.13Å; D86-R88 IonicContact OD1-CZ 2.7Å; D86-R88 IonicContact OD1-NE 3.81Å; D86-R88 PolarHBondContact OD1-NE 3.21Å; D86-R88 IonicContact OD1-NH2 3.64Å; D86-R88 IonicContact OD2-CZ 3.72Å; D86-R88 IonicContact OD2-NE 2.95Å; D86-R88 PolarHBondContact OD2-NE 2.79Å; D86-R88 IonicContact OD2-NH2 3.68Å; D86-R88 PolarHBondContact OD2-NH2 3.03Å; D86-L113 HydrophobicContact CB-CD2 3.91Å; D86-L113 HydrophobicContact CB-CG 4.26Å; D86-A114 WeakPolarHBondContact O-CA 3.32Å; D86-H117 PolarHBondContact O-ND1 2.64Å; D86-H117 IonicContact OD2-CE1 3.65Å; D86-H117 IonicContact OD2-ND1 2.77Å
87	G	94.9	Very high	95.6	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.01	17%	0.166	C	C	.	.	S	Bend	trans	76.9	9	169.3	0	0	0	0	0	115.5	S84 G85 I89 V90 L91 Y129	S84-G87 WeakPolarHBondContact O-CA 3.27Å; S84-G87 PolarHBondContact O-N 3.48Å; G85-G87 PolarHBondContact O-N 3.06Å; G87-I89 PolarHBondContact O-N 3.07Å; G87-V90 PolarHBondContact O-N 3.32Å; G87-L91 WeakPolarHBondContact O-CB 3.39Å; G87-L91 PolarHBondContact O-N 2.98Å; G87-Y129 PolarHBondContact O-OH 2.8Å
88	R	96.4	Very high	95.7	Very high	74 Å²	74	28.1 Å²	28.1	28%	0.279	15%	0.151	S	C	.	.	H	α-helix	trans	-61.8	-39.1	-174.3	68	-178.6	65.4	-163.1	-7.2	113.5	P59 A60 V65 D86 L91 E92	P59-R88 VanDerWaalsContact CB-CZ 3.49Å; P59-R88 VanDerWaalsContact CB-NH2 3.33Å; A60-R88 WeakPolarHBondContact O-CD 3.3Å; A60-R88 PolarHBondContact O-NH1 3.2Å; V65-R88 HydrophobicContact CG2-CG 4Å; D86-R88 VanDerWaalsContact C-N 3.3Å; D86-R88 PolarHBondContact O-N 3.13Å; D86-R88 IonicContact OD1-CZ 2.7Å; D86-R88 IonicContact OD1-NE 3.81Å; D86-R88 PolarHBondContact OD1-NE 3.21Å; D86-R88 IonicContact OD1-NH2 3.64Å; D86-R88 IonicContact OD2-CZ 3.72Å; D86-R88 IonicContact OD2-NE 2.95Å; D86-R88 PolarHBondContact OD2-NE 2.79Å; D86-R88 IonicContact OD2-NH2 3.68Å; D86-R88 PolarHBondContact OD2-NH2 3.03Å; R88-L91 PolarHBondContact O-N 2.87Å; R88-E92 WeakPolarHBondContact O-CB 3.38Å; R88-E92 WeakPolarHBondContact O-CG 3.43Å; R88-E92 PolarHBondContact O-N 3.23Å
89	I	96.7	Very high	95.7	Very high	9 Å²	9	30.2 Å²	30.2	5%	0.046	17%	0.168	C	C	.	.	H	α-helix	trans	-67.5	-46.2	179.5	-65.9	175.1	0	0	0	110	V65 V68 M69 D81 G87 L91 E92 A93 T146 F148	V65-I89 HydrophobicContact CG2-CG1 4.06Å; V68-I89 HydrophobicContact CG1-CG2 4.38Å; M69-I89 HydrophobicContact CE-CB 4.44Å; M69-I89 HydrophobicContact CE-CG2 3.68Å; M69-I89 WeakPolarHBondContact CE-O 3.33Å; D81-I89 WeakPolarHBondContact OD2-CB 3.24Å; G87-I89 PolarHBondContact O-N 3.07Å; I89-L91 VanDerWaalsContact C-N 3.33Å; I89-L91 PolarHBondContact O-N 3.37Å; I89-E92 PolarHBondContact O-N 3.37Å; I89-A93 VanDerWaalsContact O-CB 3.29Å; I89-A93 WeakPolarHBondContact O-CB 3.48Å; I89-A93 PolarHBondContact O-N 3.2Å; I89-T146 HydrophobicContact CG2-CG2 4.2Å; I89-F148 HydrophobicContact CD1-CB 4.47Å
90	V	97.3	Very high	95.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-42.6	177.1	-177.8	0	0	0	0	111.6	D81 G87 A93 Y94 A101 V127 Y129	D81-V90 HydrophobicContact CB-CG2 3.41Å; D81-V90 VanDerWaalsContact CB-CG2 3.41Å; G87-V90 PolarHBondContact O-N 3.32Å; V90-A93 PolarHBondContact O-N 2.94Å; V90-Y94 PolarHBondContact O-N 2.91Å; V90-A101 HydrophobicContact CG1-CB 3.85Å; V90-V127 HydrophobicContact CG1-CB 4.13Å; V90-V127 HydrophobicContact CG1-CG1 4.34Å; V90-Y129 HydrophobicContact CB-CE1 3.74Å; V90-Y129 HydrophobicContact CG1-CE1 3.93Å; V90-Y129 HydrophobicContact CG2-CE1 4Å
91	L	97.1	Very high	95.6	Very high	20 Å²	20	33.8 Å²	33.8	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-45.5	179.8	-176.2	62.9	0	0	0	111.3	G87 R88 I89 Y94 Q95 A118 A121 C123	G87-L91 WeakPolarHBondContact O-CB 3.39Å; G87-L91 PolarHBondContact O-N 2.98Å; R88-L91 PolarHBondContact O-N 2.87Å; I89-L91 VanDerWaalsContact C-N 3.33Å; I89-L91 PolarHBondContact O-N 3.37Å; L91-Y94 PolarHBondContact O-N 2.98Å; L91-Q95 WeakPolarHBondContact O-CG 3.35Å; L91-Q95 PolarHBondContact O-N 3.33Å; L91-A118 HydrophobicContact CD1-CB 4.42Å; L91-A121 HydrophobicContact CD1-CB 4.09Å; L91-A121 HydrophobicContact CD2-CB 3.83Å; L91-C123 HydrophobicContact CD1-CB 3.53Å
92	E	96.9	Very high	95.6	Very high	76 Å²	76	34.5 Å²	34.5	36%	0.355	20%	0.195	S	C	.	.	H	α-helix	trans	-66.3	-39.8	177.1	-71.3	-83.9	177.9	0	0	111.4	V65 M69 R88 I89 Y94 Q95 H96	V65-E92 HydrophobicContact CG1-CB 3.87Å; V65-E92 HydrophobicContact CG1-CG 3.79Å; M69-E92 HydrophobicContact CE-CB 4.04Å; M69-E92 HydrophobicContact CG-CB 4.4Å; R88-E92 WeakPolarHBondContact O-CB 3.38Å; R88-E92 WeakPolarHBondContact O-CG 3.43Å; R88-E92 PolarHBondContact O-N 3.23Å; I89-E92 PolarHBondContact O-N 3.37Å; E92-Y94 VanDerWaalsContact C-N 3.33Å; E92-Y94 PolarHBondContact O-N 3.46Å; E92-Q95 PolarHBondContact O-N 3.17Å; E92-H96 WeakPolarHBondContact O-CB 3.44Å; E92-H96 PolarHBondContact O-CD2 3.35Å; E92-H96 PolarHBondContact O-N 2.98Å
93	A	96.9	Very high	95.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-45.4	173	0	0	0	0	0	111.8	M69 L79 I89 V90 Q95 H96 G97 F98	M69-A93 HydrophobicContact CE-CB 4.01Å; M69-A93 HydrophobicContact SD-CB 4.2Å; L79-A93 HydrophobicContact CB-CB 4.42Å; L79-A93 HydrophobicContact CD1-CB 3.79Å; L79-A93 HydrophobicContact CD2-CB 3.71Å; L79-A93 HydrophobicContact CG-CB 4.18Å; I89-A93 VanDerWaalsContact O-CB 3.29Å; I89-A93 WeakPolarHBondContact O-CB 3.48Å; I89-A93 PolarHBondContact O-N 3.2Å; V90-A93 PolarHBondContact O-N 2.94Å; A93-Q95 VanDerWaalsContact C-N 3.34Å; A93-Q95 PolarHBondContact O-N 3.36Å; A93-H96 CarbonylContact O-C 3.54Å; A93-H96 WeakPolarHBondContact O-CA 3.42Å; A93-H96 WeakPolarHBondContact O-CB 3.34Å; A93-H96 PolarHBondContact O-N 3.49Å; A93-H96 VanDerWaalsContact O-N 3.1Å; A93-G97 PolarHBondContact O-N 3.38Å; A93-F98 HydrophobicContact CB-CB 4.28Å; A93-F98 HydrophobicContact CB-CD2 4.15Å; A93-F98 HydrophobicContact CB-CG 4.5Å; A93-F98 WeakPolarHBondContact O-CB 3.25Å; A93-F98 WeakPolarHBondContact O-CD2 3.22Å; A93-F98 PolarHBondContact O-N 3.45Å; A93-F98 VanDerWaalsContact O-N 3.08Å
94	Y	97.1	Very high	95.9	Very high	59 Å²	59	34.7 Å²	34.7	23%	0.231	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-42.4	176	177.9	-101.7	0	0	0	112.3	V90 L91 E92 H96 G97 C123 K126 V127	V90-Y94 PolarHBondContact O-N 2.91Å; L91-Y94 PolarHBondContact O-N 2.98Å; E92-Y94 VanDerWaalsContact C-N 3.33Å; E92-Y94 PolarHBondContact O-N 3.46Å; Y94-H96 PolarHBondContact O-N 3.27Å; Y94-G97 PolarHBondContact O-N 2.95Å; Y94-C123 HydrophobicContact CD1-CB 4.36Å; Y94-C123 HydrophobicContact CE1-CB 4.5Å; Y94-K126 HydrophobicContact CD1-CB 4.47Å; Y94-K126 HydrophobicContact CE1-CB 3.82Å; Y94-K126 HydrophobicContact CE1-CD 3.87Å; Y94-K126 HydrophobicContact CE1-CG 4.33Å; Y94-K126 HydrophobicContact CE2-CB 3.86Å; Y94-K126 VanDerWaalsContact CZ-CB 3.49Å; Y94-K126 VanDerWaalsContact OH-CD 3.24Å; Y94-K126 WeakPolarHBondContact OH-CD 3.4Å; Y94-K126 WeakPolarHBondContact OH-CG 3.42Å; Y94-V127 VanDerWaalsContact CB-CG1 3.42Å; Y94-V127 HydrophobicContact CD1-CG1 4.1Å; Y94-V127 HydrophobicContact CD2-CG1 4.16Å; Y94-V127 HydrophobicContact CG-CG1 3.61Å
95	Q	94.7	Very high	95.9	Very high	106 Å²	106	35.7 Å²	35.7	50%	0.495	20%	0.195	S	C	.	.	H	α-helix	trans	-63.3	-27.4	175.2	-69.7	173.6	0.3	0	0	112.7	L91 E92 A93 G97	L91-Q95 WeakPolarHBondContact O-CG 3.35Å; L91-Q95 PolarHBondContact O-N 3.33Å; E92-Q95 PolarHBondContact O-N 3.17Å; A93-Q95 VanDerWaalsContact C-N 3.34Å; A93-Q95 PolarHBondContact O-N 3.36Å; Q95-G97 VanDerWaalsContact C-N 3.28Å
96	H	95	Very high	95.8	Very high	107 Å²	107	38.9 Å²	38.9	50%	0.495	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	4.4	174	-81.3	-121.7	0	0	0	114.1	E92 A93 Y94 F98	E92-H96 WeakPolarHBondContact O-CB 3.44Å; E92-H96 PolarHBondContact O-CD2 3.35Å; E92-H96 PolarHBondContact O-N 2.98Å; A93-H96 CarbonylContact O-C 3.54Å; A93-H96 WeakPolarHBondContact O-CA 3.42Å; A93-H96 WeakPolarHBondContact O-CB 3.34Å; A93-H96 PolarHBondContact O-N 3.49Å; A93-H96 VanDerWaalsContact O-N 3.1Å; Y94-H96 PolarHBondContact O-N 3.27Å; H96-F98 HydrophobicContact CB-CD2 4.33Å; H96-F98 HydrophobicContact CB-CE2 4.49Å
97	G	95.2	Very high	95.5	Very high	61 Å²	61	41.5 Å²	41.5	63%	0.629	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.2	7.3	173.3	0	0	0	0	0	115.4	A93 Y94 Q95	A93-G97 PolarHBondContact O-N 3.38Å; Y94-G97 PolarHBondContact O-N 2.95Å; Q95-G97 VanDerWaalsContact C-N 3.28Å
98	F	96.6	Very high	95.4	Very high	7 Å²	7	43.4 Å²	43.4	3%	0.031	24%	0.238	C	C	.	.			trans	-74.8	129.9	172.2	-69.1	-84.3	0	0	0	110.7	V72 R75 L79 A93 H96 N144	V72-F98 HydrophobicContact CB-CE2 4.33Å; V72-F98 HydrophobicContact CB-CZ 3.88Å; V72-F98 HydrophobicContact CG2-CE2 3.7Å; V72-F98 HydrophobicContact CG2-CZ 3.77Å; R75-F98 HydrophobicContact CB-CE1 4.13Å; R75-F98 HydrophobicContact CB-CZ 4.22Å; L79-F98 HydrophobicContact CB-CB 3.83Å; L79-F98 HydrophobicContact CB-CD1 3.88Å; L79-F98 HydrophobicContact CB-CG 3.9Å; L79-F98 HydrophobicContact CD1-CD1 4.13Å; L79-F98 HydrophobicContact CD1-CD2 4.06Å; L79-F98 HydrophobicContact CD1-CE1 4.29Å; L79-F98 HydrophobicContact CD1-CE2 4.23Å; L79-F98 HydrophobicContact CD1-CG 4.01Å; L79-F98 HydrophobicContact CD1-CZ 4.35Å; A93-F98 HydrophobicContact CB-CB 4.28Å; A93-F98 HydrophobicContact CB-CD2 4.15Å; A93-F98 HydrophobicContact CB-CG 4.5Å; A93-F98 WeakPolarHBondContact O-CB 3.25Å; A93-F98 WeakPolarHBondContact O-CD2 3.22Å; A93-F98 PolarHBondContact O-N 3.45Å; A93-F98 VanDerWaalsContact O-N 3.08Å; H96-F98 HydrophobicContact CB-CD2 4.33Å; H96-F98 HydrophobicContact CB-CE2 4.49Å; F98-N144 HydrophobicContact CE1-CB 4.43Å
99	S	94.9	Very high	95.1	Very high	76 Å²	76	48.3 Å²	48.3	53%	0.531	26%	0.256	S	S	.	.	S	Bend	trans	-156.6	127.1	178.3	-178.2	0	0	0	0	110.2	G77	G77-S99 CarbonylContact C-O 3.53Å; G77-S99 PolarHBondContact O-N 3.02Å
100	P	95.8	Very high	94.9	Very high	78 Å²	78	48.8 Å²	48.8	51%	0.506	26%	0.259	S	S	.	.	S	Bend	cis	-71.4	142.1	-2	28.9	-35.3	0	0	0	113.2	D78 L79 V102	D78-P100 CarbonylContact C-O 3.6Å; D78-P100 VanDerWaalsContact CA-O 3.29Å; D78-P100 WeakPolarHBondContact CA-O 3.5Å; D78-P100 HydrophobicContact CB-CG 3.92Å; L79-P100 PolarHBondContact N-O 3.42Å; P100-V102 HydrophobicContact CB-CG2 4.32Å
101	A	97.2	Very high	94.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.3	170.9	0	0	0	0	0	109.7	L79 V90 V127 S128	L79-A101 WeakPolarHBondContact O-CA 3.29Å; V90-A101 HydrophobicContact CG1-CB 3.85Å; A101-V127 HydrophobicContact CB-CG1 4.3Å; A101-S128 PolarHBondContact O-N 3.26Å
102	V	97.4	Very high	94.8	Very high	14 Å²	14	54.8 Å²	54.8	9%	0.085	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.4	-171.4	-171.6	0	0	0	0	111.1	L79 V80 D81 P100 Y104 S128 R130	L79-V102 PolarHBondContact O-N 2.89Å; V80-V102 CarbonylContact C-O 3.54Å; V80-V102 VanDerWaalsContact CA-O 3.32Å; V80-V102 WeakPolarHBondContact CA-O 3.5Å; V80-V102 HydrophobicContact CG2-CB 4.41Å; D81-V102 PolarHBondContact N-O 2.97Å; P100-V102 HydrophobicContact CB-CG2 4.32Å; V102-Y104 HydrophobicContact CG1-CD2 4.36Å; V102-Y104 HydrophobicContact CG1-CE1 4.42Å; V102-Y104 HydrophobicContact CG1-CE2 3.79Å; V102-S128 CarbonylContact C-O 3.5Å; V102-S128 VanDerWaalsContact CA-O 3.29Å; V102-S128 WeakPolarHBondContact CA-O 3.43Å; V102-R130 HydrophobicContact CG1-CG 4.38Å
103	G	97.1	Very high	94.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.3	172	0	0	0	0	0	112	S128 Y129 R130	G103-S128 PolarHBondContact N-O 2.87Å; G103-Y129 WeakPolarHBondContact O-CA 3.43Å; G103-R130 PolarHBondContact O-N 2.95Å
104	Y	96.4	Very high	94.6	Very high	20 Å²	20	54.3 Å²	54.3	8%	0.078	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.8	172.3	-66.1	-78.5	0	0	0	109.9	V80 D81 L82 G83 S84 V102 R130 E132 V137	V80-Y104 HydrophobicContact CG1-CD2 3.56Å; V80-Y104 HydrophobicContact CG1-CE2 3.52Å; D81-Y104 PolarHBondContact O-N 3.48Å; L82-Y104 HydrophobicContact CD2-CD2 4Å; G83-Y104 VanDerWaalsContact CA-O 3.29Å; G83-Y104 WeakPolarHBondContact CA-O 3.48Å; G83-Y104 PolarHBondContact N-O 3.44Å; S84-Y104 PolarHBondContact N-O 3.35Å; V102-Y104 HydrophobicContact CG1-CD2 4.36Å; V102-Y104 HydrophobicContact CG1-CE1 4.42Å; V102-Y104 HydrophobicContact CG1-CE2 3.79Å; Y104-R130 HydrophobicContact CD1-CB 3.8Å; Y104-R130 HydrophobicContact CE1-CB 3.9Å; Y104-R130 HydrophobicContact CE1-CG 4.27Å; Y104-E132 HydrophobicContact CD1-CB 4.07Å; Y104-E132 WeakPolarHBondContact CE1-OE2 3.18Å; Y104-V137 HydrophobicContact CD1-CG1 4.48Å; Y104-V137 HydrophobicContact CD1-CG2 3.53Å; Y104-V137 HydrophobicContact CD2-CG1 4.22Å; Y104-V137 HydrophobicContact CD2-CG2 4.3Å; Y104-V137 HydrophobicContact CE1-CB 4.42Å; Y104-V137 HydrophobicContact CE1-CG1 3.91Å; Y104-V137 HydrophobicContact CE1-CG2 3.55Å; Y104-V137 HydrophobicContact CE2-CG1 3.63Å; Y104-V137 HydrophobicContact CE2-CG2 4.34Å; Y104-V137 HydrophobicContact CG-CG2 3.91Å; Y104-V137 VanDerWaalsContact CZ-CG1 3.44Å
105	E	94	Very high	94.6	Very high	27 Å²	27	57.2 Å²	57.2	13%	0.126	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	138.9	-179.9	173.5	54.4	-115.8	0	0	110.2	G85 N107 L110 V111 R130 Q131 E132	G85-E105 PolarHBondContact N-OE2 2.96Å; E105-N107 HydrophobicContact CG-CB 4.44Å; E105-N107 PolarHBondContact OE1-N 3.41Å; E105-L110 HydrophobicContact CG-CB 3.82Å; E105-L110 HydrophobicContact CG-CD1 4.45Å; E105-V111 HydrophobicContact CB-CG2 3.71Å; E105-V111 HydrophobicContact CG-CG2 3.9Å; E105-R130 PolarHBondContact N-O 3.15Å; E105-R130 VanDerWaalsContact N-O 3.08Å; E105-Q131 CarbonylContact O-C 3.51Å; E105-Q131 VanDerWaalsContact O-CA 3.24Å; E105-Q131 WeakPolarHBondContact O-CA 3.46Å; E105-E132 PolarHBondContact O-N 3.34Å
106	L	90.4	Very high	94.7	Very high	71 Å²	71	57.1 Å²	57.1	37%	0.372	29%	0.288	S	S	.	.	S	Bend	trans	-81.7	-36.2	-178	-169.9	75.8	0	0	0	111.5	V49 P108 D133	V49-L106 HydrophobicContact CB-CD2 3.87Å; V49-L106 HydrophobicContact CG2-CD1 3.91Å; V49-L106 HydrophobicContact CG2-CD2 3.39Å; V49-L106 HydrophobicContact CG2-CG 4.3Å; L106-P108 WeakPolarHBondContact O-CD 3.19Å; L106-D133 HydrophobicContact CD1-CB 4.19Å
107	N	88.6	Confident	94.7	Very high	65 Å²	65	54 Å²	54	35%	0.348	27%	0.274	S	S	.	.			trans	-77.4	114.5	-174.8	-173.9	-20.2	0	0	0	111.4	E105 W109 L110 V111	E105-N107 HydrophobicContact CG-CB 4.44Å; E105-N107 PolarHBondContact OE1-N 3.41Å; N107-W109 PolarHBondContact O-N 3.46Å; N107-W109 WeakPolarHBondContact OD1-CB 3.35Å; N107-W109 PolarHBondContact OD1-N 3.38Å; N107-L110 HydrophobicContact CB-CB 4.14Å; N107-L110 HydrophobicContact CB-CD1 3.91Å; N107-L110 HydrophobicContact CB-CG 4.02Å; N107-L110 PolarHBondContact O-N 2.83Å; N107-L110 VanDerWaalsContact O-N 3.15Å; N107-V111 PolarHBondContact O-N 3.02Å; N107-V111 VanDerWaalsContact O-N 3.09Å
108	P	90.8	Very high	94.8	Very high	41 Å²	41	51.1 Å²	51.1	27%	0.266	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-30.3	-179.2	22.6	-32.1	0	0	0	113.5	L106 R112	L106-P108 WeakPolarHBondContact O-CD 3.19Å; P108-R112 VanDerWaalsContact O-CG 3.27Å; P108-R112 WeakPolarHBondContact O-CG 3.36Å; P108-R112 PolarHBondContact O-N 3.15Å
109	W	91.3	Very high	94.8	Very high	176 Å²	176	58.7 Å²	58.7	67%	0.667	27%	0.273	S	S	*	.	H	α-helix	trans	-70.5	-39.9	179.2	-62	108.6	0	0	0	111.9	N107 R112 L113	N107-W109 PolarHBondContact O-N 3.46Å; N107-W109 WeakPolarHBondContact OD1-CB 3.35Å; N107-W109 PolarHBondContact OD1-N 3.38Å; W109-R112 PolarHBondContact O-N 3.17Å; W109-L113 WeakPolarHBondContact O-CB 3.29Å; W109-L113 PolarHBondContact O-N 3.5Å
110	L	93.2	Very high	94.9	Very high	19 Å²	19	63.6 Å²	63.6	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-68	-40.7	175.4	-68.4	178.7	0	0	0	111.1	Y57 G85 E105 N107 R112 L113 A114	Y57-L110 HydrophobicContact CD1-CD2 3.93Å; Y57-L110 HydrophobicContact CD2-CD1 3.69Å; Y57-L110 HydrophobicContact CD2-CD2 4.03Å; Y57-L110 HydrophobicContact CE1-CD2 4.06Å; Y57-L110 HydrophobicContact CE2-CD1 4.41Å; Y57-L110 HydrophobicContact CE2-CD2 4.17Å; Y57-L110 HydrophobicContact CG-CD1 3.84Å; Y57-L110 HydrophobicContact CG-CD2 3.91Å; G85-L110 CarbonylContact O-C 3.57Å; E105-L110 HydrophobicContact CG-CB 3.82Å; E105-L110 HydrophobicContact CG-CD1 4.45Å; N107-L110 HydrophobicContact CB-CB 4.14Å; N107-L110 HydrophobicContact CB-CD1 3.91Å; N107-L110 HydrophobicContact CB-CG 4.02Å; N107-L110 PolarHBondContact O-N 2.83Å; N107-L110 VanDerWaalsContact O-N 3.15Å; L110-R112 VanDerWaalsContact C-N 3.32Å; L110-R112 PolarHBondContact O-N 2.89Å; L110-L113 WeakPolarHBondContact O-CB 3.49Å; L110-L113 PolarHBondContact O-N 3.39Å; L110-L113 VanDerWaalsContact O-N 3.15Å; L110-A114 WeakPolarHBondContact O-CB 3.45Å; L110-A114 PolarHBondContact O-N 3.18Å
111	V	95.3	Very high	94.8	Very high	3 Å²	3	62 Å²	62	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-42.9	173	174.3	0	0	0	0	111.5	E105 N107 A114 R115 Q131	E105-V111 HydrophobicContact CB-CG2 3.71Å; E105-V111 HydrophobicContact CG-CG2 3.9Å; N107-V111 PolarHBondContact O-N 3.02Å; N107-V111 VanDerWaalsContact O-N 3.09Å; V111-A114 PolarHBondContact O-N 3.09Å; V111-R115 VanDerWaalsContact O-CG 3.3Å; V111-R115 WeakPolarHBondContact O-CG 3.34Å; V111-R115 PolarHBondContact O-N 3.14Å; V111-Q131 HydrophobicContact CG2-CB 4.09Å; V111-Q131 HydrophobicContact CG2-CG 4.36Å
112	R	95.1	Very high	94.7	Very high	144 Å²	144	64.4 Å²	64.4	54%	0.543	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-43.8	175.3	-73.2	170.2	-175.4	173.4	-0.6	111.5	P108 W109 L110 R115 F116	P108-R112 VanDerWaalsContact O-CG 3.27Å; P108-R112 WeakPolarHBondContact O-CG 3.36Å; P108-R112 PolarHBondContact O-N 3.15Å; W109-R112 PolarHBondContact O-N 3.17Å; L110-R112 VanDerWaalsContact C-N 3.32Å; L110-R112 PolarHBondContact O-N 2.89Å; R112-R115 PolarHBondContact O-N 3.31Å; R112-F116 PolarHBondContact O-N 2.89Å
113	L	95.1	Very high	94.6	Very high	65 Å²	65	64.2 Å²	64.2	34%	0.34	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-43.5	176.2	-178.9	62.5	0	0	0	111.8	D86 W109 L110 R115 F116 H117	D86-L113 HydrophobicContact CB-CD2 3.91Å; D86-L113 HydrophobicContact CB-CG 4.26Å; W109-L113 WeakPolarHBondContact O-CB 3.29Å; W109-L113 PolarHBondContact O-N 3.5Å; L110-L113 WeakPolarHBondContact O-CB 3.49Å; L110-L113 PolarHBondContact O-N 3.39Å; L110-L113 VanDerWaalsContact O-N 3.15Å; L113-R115 PolarHBondContact O-N 3.24Å; L113-F116 WeakPolarHBondContact O-CB 3.28Å; L113-F116 PolarHBondContact O-N 2.91Å; L113-H117 PolarHBondContact O-N 2.86Å
114	A	96.1	Very high	94.3	Very high	0 Å²	0	70 Å²	70	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.2	-44.4	176.3	0	0	0	0	0	112	D86 L110 V111 F116 H117 A118 Y129	D86-A114 WeakPolarHBondContact O-CA 3.32Å; L110-A114 WeakPolarHBondContact O-CB 3.45Å; L110-A114 PolarHBondContact O-N 3.18Å; V111-A114 PolarHBondContact O-N 3.09Å; A114-F116 VanDerWaalsContact C-N 3.33Å; A114-F116 PolarHBondContact O-N 2.99Å; A114-H117 PolarHBondContact O-N 2.91Å; A114-A118 PolarHBondContact O-N 2.84Å; A114-Y129 HydrophobicContact CB-CD1 3.75Å; A114-Y129 HydrophobicContact CB-CD2 3.95Å; A114-Y129 HydrophobicContact CB-CE1 3.83Å; A114-Y129 HydrophobicContact CB-CE2 4Å; A114-Y129 HydrophobicContact CB-CG 3.81Å; A114-Y129 WeakPolarHBondContact O-CE2 3.5Å
115	R	96.3	Very high	94	Very high	120 Å²	120	72.6 Å²	72.6	45%	0.453	36%	0.356	S	S	.	.	H	α-helix	trans	-62.1	-39.9	174.2	-72	172.9	-178	175	0.9	112.1	V111 R112 L113 A118 W119 Y129	V111-R115 VanDerWaalsContact O-CG 3.3Å; V111-R115 WeakPolarHBondContact O-CG 3.34Å; V111-R115 PolarHBondContact O-N 3.14Å; R112-R115 PolarHBondContact O-N 3.31Å; L113-R115 PolarHBondContact O-N 3.24Å; R115-A118 PolarHBondContact O-N 3.23Å; R115-W119 WeakPolarHBondContact O-CB 3.3Å; R115-W119 PolarHBondContact O-N 3.01Å; R115-Y129 HydrophobicContact CG-CD2 3.95Å; R115-Y129 PolarHBondContact NH2-O 3.18Å
116	F	96.5	Very high	94	Very high	105 Å²	105	76.7 Å²	76.7	46%	0.461	37%	0.374	S	S	.	.	H	α-helix	trans	-64	-43.4	174.6	175.3	-102.5	0	0	0	111.8	R112 L113 A114 W119 R120	R112-F116 PolarHBondContact O-N 2.89Å; L113-F116 WeakPolarHBondContact O-CB 3.28Å; L113-F116 PolarHBondContact O-N 2.91Å; A114-F116 VanDerWaalsContact C-N 3.33Å; A114-F116 PolarHBondContact O-N 2.99Å; F116-W119 HydrophobicContact CD2-CE3 4.03Å; F116-W119 HydrophobicContact CD2-CZ3 4.4Å; F116-W119 AromaticContact CE2-CE3 3.93Å; F116-W119 HydrophobicContact CE2-CE3 3.93Å; F116-W119 AromaticContact CE2-CZ3 3.87Å; F116-W119 HydrophobicContact CE2-CZ3 3.87Å; F116-W119 PolarHBondContact O-N 3.07Å; F116-R120 WeakPolarHBondContact O-CB 3.29Å; F116-R120 PolarHBondContact O-N 2.77Å
117	H	95.9	Very high	94.3	Very high	41 Å²	41	73.9 Å²	73.9	19%	0.19	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-44.8	174.9	-72.1	166.8	0	0	0	112.5	D86 L113 A114 W119 R120 A121	D86-H117 PolarHBondContact O-ND1 2.64Å; D86-H117 IonicContact OD2-CE1 3.65Å; D86-H117 IonicContact OD2-ND1 2.77Å; L113-H117 PolarHBondContact O-N 2.86Å; A114-H117 PolarHBondContact O-N 2.91Å; H117-W119 VanDerWaalsContact C-N 3.35Å; H117-R120 PolarHBondContact O-N 3.24Å; H117-A121 WeakPolarHBondContact O-CB 3.37Å; H117-A121 PolarHBondContact O-N 2.8Å
118	A	96.4	Very high	94.7	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.008	36%	0.357	C	S	.	.	H	α-helix	trans	-65.4	-37.3	175.8	0	0	0	0	0	112.7	L91 A114 R115 A121 G122 C123 H124 V127 Y129	L91-A118 HydrophobicContact CD1-CB 4.42Å; A114-A118 PolarHBondContact O-N 2.84Å; R115-A118 PolarHBondContact O-N 3.23Å; A118-A121 CarbonylContact O-C 3.5Å; A118-A121 PolarHBondContact O-N 2.85Å; A118-G122 PolarHBondContact O-N 3.07Å; A118-C123 HydrophobicContact CB-CB 4.46Å; A118-C123 CarbonylContact O-C 3.59Å; A118-C123 WeakPolarHBondContact O-CA 3.27Å; A118-C123 PolarHBondContact O-N 2.86Å; A118-H124 PolarHBondContact O-N 2.88Å; A118-V127 HydrophobicContact CB-CG2 3.49Å; A118-V127 VanDerWaalsContact CB-CG2 3.49Å; A118-Y129 HydrophobicContact CB-CE2 3.74Å
119	W	96.9	Very high	95	Very high	166 Å²	166	71.4 Å²	71.4	63%	0.629	35%	0.347	S	S	*	.	H	α-helix	trans	-62	-49.3	172.8	175	79.6	0	0	0	112	R115 F116 H117 A121 G122 H124	R115-W119 WeakPolarHBondContact O-CB 3.3Å; R115-W119 PolarHBondContact O-N 3.01Å; F116-W119 HydrophobicContact CD2-CE3 4.03Å; F116-W119 HydrophobicContact CD2-CZ3 4.4Å; F116-W119 AromaticContact CE2-CE3 3.93Å; F116-W119 HydrophobicContact CE2-CE3 3.93Å; F116-W119 AromaticContact CE2-CZ3 3.87Å; F116-W119 HydrophobicContact CE2-CZ3 3.87Å; F116-W119 PolarHBondContact O-N 3.07Å; H117-W119 VanDerWaalsContact C-N 3.35Å; W119-A121 PolarHBondContact O-N 3.24Å; W119-G122 PolarHBondContact O-N 2.82Å; W119-H124 HydrophobicContact CB-CB 4.37Å
120	R	96.6	Very high	95.2	Very high	179 Å²	179	68.2 Å²	68.2	68%	0.675	33%	0.334	S	S	*	.	H	α-helix	trans	-59.1	-31.1	176.1	-171.3	-179	66.6	143.2	-1.1	112.6	F116 H117 G122	F116-R120 WeakPolarHBondContact O-CB 3.29Å; F116-R120 PolarHBondContact O-N 2.77Å; H117-R120 PolarHBondContact O-N 3.24Å; R120-G122 VanDerWaalsContact C-N 3.35Å
121	A	95	Very high	95.2	Very high	43 Å²	43	71.6 Å²	71.6	36%	0.355	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	6.1	177.4	0	0	0	0	0	114.2	L91 H117 A118 W119 C123	L91-A121 HydrophobicContact CD1-CB 4.09Å; L91-A121 HydrophobicContact CD2-CB 3.83Å; H117-A121 WeakPolarHBondContact O-CB 3.37Å; H117-A121 PolarHBondContact O-N 2.8Å; A118-A121 CarbonylContact O-C 3.5Å; A118-A121 PolarHBondContact O-N 2.85Å; W119-A121 PolarHBondContact O-N 3.24Å; A121-C123 PolarHBondContact O-N 3.22Å; A121-C123 VanDerWaalsContact O-N 3.17Å; A121-C123 PolarHBondContact O-SG 3.14Å; A121-C123 VanDerWaalsContact O-SG 3.37Å
122	G	95	Very high	95.1	Very high	52 Å²	52	75.3 Å²	75.3	54%	0.536	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	17.5	-178.1	0	0	0	0	0	114.3	A118 W119 R120	A118-G122 PolarHBondContact O-N 3.07Å; W119-G122 PolarHBondContact O-N 2.82Å; R120-G122 VanDerWaalsContact C-N 3.35Å
123	C	94.4	Very high	94.9	Very high	10 Å²	10	69.9 Å²	69.9	7%	0.068	35%	0.349	C	S	.	.			trans	-104.7	12.4	-179.1	-64.1	0	0	0	0	112.4	L91 Y94 A118 A121 G125 K126 V127	L91-C123 HydrophobicContact CD1-CB 3.53Å; Y94-C123 HydrophobicContact CD1-CB 4.36Å; Y94-C123 HydrophobicContact CE1-CB 4.5Å; A118-C123 HydrophobicContact CB-CB 4.46Å; A118-C123 CarbonylContact O-C 3.59Å; A118-C123 WeakPolarHBondContact O-CA 3.27Å; A118-C123 PolarHBondContact O-N 2.86Å; A121-C123 PolarHBondContact O-N 3.22Å; A121-C123 VanDerWaalsContact O-N 3.17Å; A121-C123 PolarHBondContact O-SG 3.14Å; A121-C123 VanDerWaalsContact O-SG 3.37Å; C123-G125 PolarHBondContact O-N 3.31Å; C123-K126 WeakPolarHBondContact O-CB 3.33Å; C123-K126 PolarHBondContact O-N 2.83Å; C123-K126 VanDerWaalsContact O-N 3.12Å; C123-V127 PolarHBondContact O-N 3.35Å
124	H	90.9	Very high	94.6	Very high	123 Å²	123	67.9 Å²	67.9	57%	0.569	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	135.1	175.5	-166	75	0	0	0	111	A118 W119 K126	A118-H124 PolarHBondContact O-N 2.88Å; W119-H124 HydrophobicContact CB-CB 4.37Å; H124-K126 PolarHBondContact O-N 3.39Å; H124-K126 VanDerWaalsContact O-N 3.09Å
125	G	90.6	Very high	94.4	Very high	73 Å²	73	71 Å²	71	75%	0.753	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	-13.2	-177.2	0	0	0	0	0	115.3	C123	C123-G125 PolarHBondContact O-N 3.31Å
126	K	93.4	Very high	94.1	Very high	114 Å²	114	73.7 Å²	73.7	50%	0.496	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-33.6	175.9	-68.8	161.1	162.6	-176.5	0	112.5	Y94 C123 H124	Y94-K126 HydrophobicContact CD1-CB 4.47Å; Y94-K126 HydrophobicContact CE1-CB 3.82Å; Y94-K126 HydrophobicContact CE1-CD 3.87Å; Y94-K126 HydrophobicContact CE1-CG 4.33Å; Y94-K126 HydrophobicContact CE2-CB 3.86Å; Y94-K126 VanDerWaalsContact CZ-CB 3.49Å; Y94-K126 VanDerWaalsContact OH-CD 3.24Å; Y94-K126 WeakPolarHBondContact OH-CD 3.4Å; Y94-K126 WeakPolarHBondContact OH-CG 3.42Å; C123-K126 WeakPolarHBondContact O-CB 3.33Å; C123-K126 PolarHBondContact O-N 2.83Å; C123-K126 VanDerWaalsContact O-N 3.12Å; H124-K126 PolarHBondContact O-N 3.39Å; H124-K126 VanDerWaalsContact O-N 3.09Å
127	V	96.7	Very high	93.9	Very high	12 Å²	12	69 Å²	69	7%	0.073	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	145.6	170.8	-60.6	0	0	0	0	110.4	V90 Y94 A101 A118 C123 Y129	V90-V127 HydrophobicContact CG1-CB 4.13Å; V90-V127 HydrophobicContact CG1-CG1 4.34Å; Y94-V127 VanDerWaalsContact CB-CG1 3.42Å; Y94-V127 HydrophobicContact CD1-CG1 4.1Å; Y94-V127 HydrophobicContact CD2-CG1 4.16Å; Y94-V127 HydrophobicContact CG-CG1 3.61Å; A101-V127 HydrophobicContact CB-CG1 4.3Å; A118-V127 HydrophobicContact CB-CG2 3.49Å; A118-V127 VanDerWaalsContact CB-CG2 3.49Å; C123-V127 PolarHBondContact O-N 3.35Å; V127-Y129 HydrophobicContact CB-CE2 4.43Å; V127-Y129 HydrophobicContact CG2-CD2 4.3Å; V127-Y129 HydrophobicContact CG2-CE2 3.5Å
128	S	96.5	Very high	93.8	Very high	44 Å²	44	72 Å²	72	31%	0.308	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.2	-178.3	169.7	0	0	0	0	111	A101 V102 G103	A101-S128 PolarHBondContact O-N 3.26Å; V102-S128 CarbonylContact C-O 3.5Å; V102-S128 VanDerWaalsContact CA-O 3.29Å; V102-S128 WeakPolarHBondContact CA-O 3.43Å; G103-S128 PolarHBondContact N-O 2.87Å
129	Y	97.1	Very high	93.7	Very high	10 Å²	10	71.9 Å²	71.9	4%	0.039	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.7	170.4	-58.3	-72	0	0	0	110.6	G87 V90 G103 A114 R115 A118 V127	G87-Y129 PolarHBondContact O-OH 2.8Å; V90-Y129 HydrophobicContact CB-CE1 3.74Å; V90-Y129 HydrophobicContact CG1-CE1 3.93Å; V90-Y129 HydrophobicContact CG2-CE1 4Å; G103-Y129 WeakPolarHBondContact O-CA 3.43Å; A114-Y129 HydrophobicContact CB-CD1 3.75Å; A114-Y129 HydrophobicContact CB-CD2 3.95Å; A114-Y129 HydrophobicContact CB-CE1 3.83Å; A114-Y129 HydrophobicContact CB-CE2 4Å; A114-Y129 HydrophobicContact CB-CG 3.81Å; A114-Y129 WeakPolarHBondContact O-CE2 3.5Å; R115-Y129 HydrophobicContact CG-CD2 3.95Å; R115-Y129 PolarHBondContact NH2-O 3.18Å; A118-Y129 HydrophobicContact CB-CE2 3.74Å; V127-Y129 HydrophobicContact CB-CE2 4.43Å; V127-Y129 HydrophobicContact CG2-CD2 4.3Å; V127-Y129 HydrophobicContact CG2-CE2 3.5Å
130	R	95.9	Very high	93.6	Very high	108 Å²	108	66.5 Å²	66.5	41%	0.408	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.3	-175.8	-63.7	-173.2	179.7	-170.5	3.7	110.8	V102 G103 Y104 E105 E132	V102-R130 HydrophobicContact CG1-CG 4.38Å; G103-R130 PolarHBondContact O-N 2.95Å; Y104-R130 HydrophobicContact CD1-CB 3.8Å; Y104-R130 HydrophobicContact CE1-CB 3.9Å; Y104-R130 HydrophobicContact CE1-CG 4.27Å; E105-R130 PolarHBondContact N-O 3.15Å; E105-R130 VanDerWaalsContact N-O 3.08Å; R130-E132 HydrophobicContact CB-CG 4.28Å; R130-E132 PolarHBondContact O-N 3.06Å
131	Q	94.5	Very high	93.4	Very high	91 Å²	91	66.2 Å²	66.2	43%	0.425	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	79.1	175.3	-170.1	-165.5	-17.4	0	0	109.6	E105 V111	E105-Q131 CarbonylContact O-C 3.51Å; E105-Q131 VanDerWaalsContact O-CA 3.24Å; E105-Q131 WeakPolarHBondContact O-CA 3.46Å; V111-Q131 HydrophobicContact CG2-CB 4.09Å; V111-Q131 HydrophobicContact CG2-CG 4.36Å
132	E	92.7	Very high	93.3	Very high	81 Å²	81	64.7 Å²	64.7	38%	0.379	34%	0.34	S	S	.	.			trans	-138.2	155.5	-174.4	-66.3	173.4	-153.9	0	0	111	Y104 E105 R130 L134 V137	Y104-E132 HydrophobicContact CD1-CB 4.07Å; Y104-E132 WeakPolarHBondContact CE1-OE2 3.18Å; E105-E132 PolarHBondContact O-N 3.34Å; R130-E132 HydrophobicContact CB-CG 4.28Å; R130-E132 PolarHBondContact O-N 3.06Å; E132-L134 PolarHBondContact O-N 2.84Å; E132-V137 HydrophobicContact CB-CG2 4.46Å
133	D	90.2	Very high	93.3	Very high	30 Å²	30	66.4 Å²	66.4	16%	0.16	33%	0.332	C	S	.	.			trans	-77.3	119.9	173.6	-177.6	0.7	0	0	0	109.5	L106 W135 K136 V137	L106-D133 HydrophobicContact CD1-CB 4.19Å; D133-W135 PolarHBondContact O-N 3.03Å; D133-W135 PolarHBondContact OD1-N 3.32Å; D133-W135 VanDerWaalsContact OD1-N 3.12Å; D133-K136 HydrophobicContact CB-CD 4.34Å; D133-K136 HydrophobicContact CB-CG 4.29Å; D133-K136 PolarHBondContact O-N 3.29Å; D133-V137 PolarHBondContact O-N 2.95Å
134	L	89.9	Confident	93.5	Very high	22 Å²	22	66 Å²	66	12%	0.115	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.8	179.7	67.5	86.1	0	0	0	113.2	L82 E132 K136 L149 L157 K160	L82-L134 HydrophobicContact CD2-CB 4.36Å; E132-L134 PolarHBondContact O-N 2.84Å; L134-K136 VanDerWaalsContact C-N 3.3Å; L134-K136 PolarHBondContact O-N 3.43Å; L134-L149 HydrophobicContact CD2-CD1 3.92Å; L134-L157 HydrophobicContact CD1-CD1 3.89Å; L134-K160 VanDerWaalsContact O-CE 3.24Å; L134-K160 WeakPolarHBondContact O-CE 3.32Å
135	W	90	Very high	93.8	Very high	67 Å²	67	60.2 Å²	60.2	25%	0.254	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.4	178.1	-59.3	111.9	0	0	0	113.2	L53 D133 V153 L156 L157 K160	L53-W135 HydrophobicContact CD2-CZ2 3.64Å; D133-W135 PolarHBondContact O-N 3.03Å; D133-W135 PolarHBondContact OD1-N 3.32Å; D133-W135 VanDerWaalsContact OD1-N 3.12Å; W135-V153 HydrophobicContact CH2-CG1 4.47Å; W135-V153 HydrophobicContact CZ2-CG1 3.95Å; W135-L156 HydrophobicContact CH2-CB 3.48Å; W135-L156 VanDerWaalsContact CH2-CB 3.48Å; W135-L156 HydrophobicContact CZ2-CB 4.23Å; W135-L156 HydrophobicContact CZ3-CB 4.16Å; W135-L157 HydrophobicContact CH2-CB 3.95Å; W135-L157 HydrophobicContact CH2-CD1 4.44Å; W135-L157 HydrophobicContact CZ3-CB 4.27Å; W135-L157 HydrophobicContact CZ3-CD1 4.15Å; W135-K160 HydrophobicContact CE3-CD 3.89Å; W135-K160 HydrophobicContact CZ3-CB 4.35Å; W135-K160 HydrophobicContact CZ3-CD 4.42Å; W135-K160 WeakPolarHBondContact O-CE 3.17Å; W135-K160 PolarHBondContact O-NZ 3.38Å
136	K	90.5	Very high	94.1	Very high	176 Å²	176	56.8 Å²	56.8	77%	0.765	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-10.5	-175.9	-60	-175.3	-177	-176.8	0	113.4	D133 L134	D133-K136 HydrophobicContact CB-CD 4.34Å; D133-K136 HydrophobicContact CB-CG 4.29Å; D133-K136 PolarHBondContact O-N 3.29Å; L134-K136 VanDerWaalsContact C-N 3.3Å; L134-K136 PolarHBondContact O-N 3.43Å
137	V	92.4	Very high	94.2	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.036	24%	0.244	C	C	.	.	S	Bend	trans	-70.1	134.9	177.4	179.1	0	0	0	0	109.3	Y104 E132 D133 L139 K160	Y104-V137 HydrophobicContact CD1-CG1 4.48Å; Y104-V137 HydrophobicContact CD1-CG2 3.53Å; Y104-V137 HydrophobicContact CD2-CG1 4.22Å; Y104-V137 HydrophobicContact CD2-CG2 4.3Å; Y104-V137 HydrophobicContact CE1-CB 4.42Å; Y104-V137 HydrophobicContact CE1-CG1 3.91Å; Y104-V137 HydrophobicContact CE1-CG2 3.55Å; Y104-V137 HydrophobicContact CE2-CG1 3.63Å; Y104-V137 HydrophobicContact CE2-CG2 4.34Å; Y104-V137 HydrophobicContact CG-CG2 3.91Å; Y104-V137 VanDerWaalsContact CZ-CG1 3.44Å; E132-V137 HydrophobicContact CB-CG2 4.46Å; D133-V137 PolarHBondContact O-N 2.95Å; V137-L139 HydrophobicContact CB-CD2 4.45Å; V137-L139 HydrophobicContact CG1-CD2 3.76Å; V137-L139 HydrophobicContact CG1-CG 4.44Å; V137-K160 PolarHBondContact O-NZ 3.18Å
138	D	93.5	Very high	94	Very high	103 Å²	103	52.6 Å²	52.6	55%	0.551	25%	0.248	S	C	*	.			trans	-79.6	117.1	169.5	176	15.7	0	0	0	109.8	S140	D138-S140 VanDerWaalsContact CG-OG 3.29Å; D138-S140 WeakPolarHBondContact OD1-CB 3.46Å; D138-S140 PolarHBondContact OD1-N 3.11Å; D138-S140 PolarHBondContact OD1-OG 2.9Å; D138-S140 PolarHBondContact OD2-OG 3.25Å
139	L	94.8	Very high	93.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.239	C	C	.	.			trans	-103.4	5.5	-179.3	-57.4	174.6	0	0	0	113	V80 L82 V137 K141 C142 L161 E164 L165	V80-L139 HydrophobicContact CG1-CD2 4.38Å; L82-L139 HydrophobicContact CD1-CD1 4.02Å; L82-L139 HydrophobicContact CD2-CD2 4.08Å; V137-L139 HydrophobicContact CB-CD2 4.45Å; V137-L139 HydrophobicContact CG1-CD2 3.76Å; V137-L139 HydrophobicContact CG1-CG 4.44Å; L139-K141 PolarHBondContact O-N 2.93Å; L139-K141 VanDerWaalsContact O-N 3.09Å; L139-C142 WeakPolarHBondContact O-CB 3.38Å; L139-C142 PolarHBondContact O-N 3.39Å; L139-L161 HydrophobicContact CD1-CD2 3.46Å; L139-L161 VanDerWaalsContact CD1-CD2 3.46Å; L139-E164 HydrophobicContact CB-CB 4.25Å; L139-E164 PolarHBondContact N-OE2 3.06Å; L139-L165 HydrophobicContact CB-CD2 3.81Å
140	S	94.2	Very high	93.3	Very high	53 Å²	53	52 Å²	52	37%	0.371	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.4	-172.7	62.1	0	0	0	0	115.5	D138 E164	D138-S140 VanDerWaalsContact CG-OG 3.29Å; D138-S140 WeakPolarHBondContact OD1-CB 3.46Å; D138-S140 PolarHBondContact OD1-N 3.11Å; D138-S140 PolarHBondContact OD1-OG 2.9Å; D138-S140 PolarHBondContact OD2-OG 3.25Å; S140-E164 VanDerWaalsContact CA-O 3.27Å; S140-E164 WeakPolarHBondContact CA-O 3.47Å
141	K	92.6	Very high	92.8	Very high	173 Å²	173	49.9 Å²	49.9	75%	0.752	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-3.6	-179.5	-61.5	-179	-176	176	0	113.4	L139	L139-K141 PolarHBondContact O-N 2.93Å; L139-K141 VanDerWaalsContact O-N 3.09Å
142	C	93.9	Very high	92.5	Very high	11 Å²	11	49 Å²	49	7%	0.074	25%	0.25	C	C	.	.			trans	-83.8	122.5	-171.3	-62.7	0	0	0	0	111.4	D78 V80 L139 V145 L165 P166	D78-C142 WeakPolarHBondContact OD2-CA 3.44Å; V80-C142 HydrophobicContact CG2-CB 4.33Å; L139-C142 WeakPolarHBondContact O-CB 3.38Å; L139-C142 PolarHBondContact O-N 3.39Å; C142-V145 HydrophobicContact CB-CG2 4.04Å; C142-L165 HydrophobicContact CB-CD2 4.34Å; C142-P166 WeakPolarHBondContact O-CD 3.41Å
143	K	94.9	Very high	92.3	Very high	88 Å²	88	45.5 Å²	45.5	38%	0.383	23%	0.233	S	C	.	.	S	Bend	trans	-96.2	-29.3	-178.8	-63.6	-168.8	178.1	-142.5	0	114.1	D78 D168 A169 L170	D78-K143 PolarHBondContact OD1-N 2.89Å; K143-D168 WeakPolarHBondContact CE-OD2 3.12Å; K143-D168 IonicContact NZ-OD2 3.67Å; K143-D168 PolarHBondContact NZ-OD2 3.21Å; K143-A169 CarbonylContact O-C 3.52Å; K143-A169 VanDerWaalsContact O-CA 3.23Å; K143-A169 WeakPolarHBondContact O-CA 3.4Å; K143-L170 PolarHBondContact O-N 3.15Å
144	N	97.6	Very high	92.3	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.5	178.4	-47.6	-74.4	0	0	0	108.7	R75 T76 D78 L79 V80 F98	R75-N144 WeakPolarHBondContact CB-OD1 3.49Å; R75-N144 WeakPolarHBondContact CD-OD1 3.46Å; R75-N144 PolarHBondContact NE-OD1 2.75Å; T76-N144 PolarHBondContact O-ND2 2.92Å; T76-N144 VanDerWaalsContact O-ND2 3.09Å; D78-N144 VanDerWaalsContact O-CB 3.31Å; D78-N144 WeakPolarHBondContact O-CB 3.36Å; D78-N144 PolarHBondContact O-ND2 3.02Å; L79-N144 WeakPolarHBondContact CA-O 3.47Å; L79-N144 HydrophobicContact CB-CB 4.34Å; L79-N144 HydrophobicContact CD1-CB 4.36Å; L79-N144 HydrophobicContact CG-CB 4.31Å; V80-N144 PolarHBondContact N-O 3.08Å; F98-N144 HydrophobicContact CE1-CB 4.43Å
145	V	97.8	Very high	92.3	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.9	-178.4	-178.5	0	0	0	0	109.6	V80 L82 C142 V147 L165 L170 V171 V172	V80-V145 CarbonylContact O-C 3.51Å; V80-V145 VanDerWaalsContact O-CA 3.28Å; V80-V145 WeakPolarHBondContact O-CA 3.4Å; L82-V145 HydrophobicContact CD1-CG1 3.83Å; L82-V145 HydrophobicContact CG-CG1 4.03Å; C142-V145 HydrophobicContact CB-CG2 4.04Å; V145-V147 HydrophobicContact CG1-CG1 4.03Å; V145-L165 HydrophobicContact CG2-CD1 4.45Å; V145-L165 HydrophobicContact CG2-CD2 3.79Å; V145-L170 PolarHBondContact N-O 3.32Å; V145-V171 HydrophobicContact CB-CG2 4.47Å; V145-V171 CarbonylContact O-C 3.54Å; V145-V171 WeakPolarHBondContact O-CA 3.46Å; V145-V172 PolarHBondContact O-N 2.69Å
146	T	97.4	Very high	92.3	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	140.8	171.1	57.6	0	0	0	0	109.9	V68 L79 V80 D81 L82 I89 V172	V68-T146 HydrophobicContact CG1-CG2 3.71Å; L79-T146 HydrophobicContact CD1-CG2 4.2Å; L79-T146 HydrophobicContact CD2-CG2 4.19Å; L79-T146 HydrophobicContact CG-CG2 4.42Å; V80-T146 PolarHBondContact O-N 2.96Å; D81-T146 WeakPolarHBondContact CA-O 3.44Å; D81-T146 VanDerWaalsContact CA-OG1 3.32Å; D81-T146 WeakPolarHBondContact CA-OG1 3.36Å; D81-T146 VanDerWaalsContact CB-OG1 3.29Å; D81-T146 WeakPolarHBondContact CB-OG1 3.46Å; D81-T146 WeakPolarHBondContact OD1-CB 3.41Å; D81-T146 PolarHBondContact OD1-OG1 3.2Å; L82-T146 PolarHBondContact N-O 2.89Å; I89-T146 HydrophobicContact CG2-CG2 4.2Å; T146-V172 CarbonylContact C-O 3.5Å; T146-V172 WeakPolarHBondContact CA-O 3.47Å; T146-V172 HydrophobicContact CG2-CB 4.36Å
147	V	95.8	Very high	92.4	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.4	179	-55.3	0	0	0	0	110.4	L82 V145 L154 L157 V172 A173 G174 F178	L82-V147 HydrophobicContact CB-CG1 4.07Å; L82-V147 HydrophobicContact CD1-CG1 3.95Å; L82-V147 HydrophobicContact CG-CG1 4.27Å; V145-V147 HydrophobicContact CG1-CG1 4.03Å; V147-L154 HydrophobicContact CB-CD2 4.47Å; V147-L154 HydrophobicContact CG2-CD2 3.87Å; V147-L157 HydrophobicContact CB-CD2 4.45Å; V147-L157 HydrophobicContact CG1-CD2 3.96Å; V147-V172 PolarHBondContact N-O 2.99Å; V147-A173 HydrophobicContact CG2-CB 3.68Å; V147-A173 WeakPolarHBondContact O-CA 3.35Å; V147-G174 PolarHBondContact O-N 3.17Å; V147-F178 HydrophobicContact CG2-CE2 3.82Å; V147-F178 HydrophobicContact CG2-CZ 3.84Å
148	F	92.7	Very high	92.5	Very high	35 Å²	35	38.4 Å²	38.4	15%	0.154	21%	0.212	C	C	.	.			trans	-131.5	75.6	175.4	-165.7	-99.2	0	0	0	110.5	I58 A60 Q64 I89 R175	I58-F148 WeakPolarHBondContact O-CE1 3.38Å; A60-F148 HydrophobicContact CB-CE1 4.48Å; A60-F148 HydrophobicContact CB-CE2 4.43Å; A60-F148 HydrophobicContact CB-CZ 4.39Å; Q64-F148 HydrophobicContact CG-CE2 4.33Å; I89-F148 HydrophobicContact CD1-CB 4.47Å; F148-R175 HydrophobicContact CD2-CB 4.4Å; F148-R175 HydrophobicContact CE2-CB 3.38Å; F148-R175 HydrophobicContact CZ-CB 3.73Å
149	L	89.8	Confident	92.4	Very high	20 Å²	20	40 Å²	40	11%	0.105	21%	0.214	C	C	.	.			trans	-129.4	164.2	-169.6	-64.2	170	0	0	0	112	L134 V153 L154 L157	L134-L149 HydrophobicContact CD2-CD1 3.92Å; L149-V153 HydrophobicContact CB-CB 4.34Å; L149-V153 HydrophobicContact CB-CG1 4.32Å; L149-V153 HydrophobicContact CD1-CG1 3.91Å; L149-L154 HydrophobicContact CB-CD2 4.16Å; L149-L154 HydrophobicContact CB-CG 4.35Å; L149-L157 HydrophobicContact CD1-CD2 3.68Å
150	A	87.7	Confident	92.4	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	22%	0.219	C	C	.	.			trans	-68.1	152.4	176.5	0	0	0	0	0	112	V55 S152 V153 L154	V55-A150 HydrophobicContact CB-CB 4.5Å; V55-A150 HydrophobicContact CG1-CB 3.83Å; V55-A150 HydrophobicContact CG2-CB 3.84Å; A150-S152 VanDerWaalsContact C-N 3.27Å; A150-S152 PolarHBondContact O-N 3.28Å; A150-V153 PolarHBondContact O-N 2.93Å; A150-L154 PolarHBondContact O-N 3.38Å
151	P	87.1	Confident	92.4	Very high	64 Å²	64	38.6 Å²	38.6	42%	0.416	20%	0.201	S	C	.	.	H	α-helix	trans	-53.6	-39.4	-178.9	-28.2	35.3	0	0	0	114.5	V153 L154 S155 F176	P151-V153 PolarHBondContact O-N 2.93Å; P151-L154 PolarHBondContact O-N 3.24Å; P151-S155 PolarHBondContact O-N 3.46Å; P151-S155 VanDerWaalsContact O-N 3.13Å; P151-S155 PolarHBondContact O-OG 3.04Å; P151-F176 HydrophobicContact CG-CB 4.21Å; P151-F176 HydrophobicContact CG-CD1 3.74Å; P151-F176 HydrophobicContact CG-CD2 4.05Å; P151-F176 HydrophobicContact CG-CE1 4.06Å; P151-F176 HydrophobicContact CG-CE2 4.34Å; P151-F176 HydrophobicContact CG-CG 3.73Å; P151-F176 HydrophobicContact CG-CZ 4.35Å
152	S	86.4	Confident	92.5	Very high	73 Å²	73	33.1 Å²	33.1	51%	0.51	18%	0.178	S	C	.	.	H	α-helix	trans	-61	-33.4	178.8	54.5	0	0	0	0	113.2	A150	A150-S152 VanDerWaalsContact C-N 3.27Å; A150-S152 PolarHBondContact O-N 3.28Å
153	V	88.3	Confident	92.4	Very high	6 Å²	6	38.3 Å²	38.3	4%	0.036	21%	0.209	C	C	.	.	H	α-helix	trans	-81.3	-40.1	178	-178.6	0	0	0	0	110.2	L53 V55 W135 L149 A150 P151 S155 L156 L157	L53-V153 HydrophobicContact CD2-CG2 4.4Å; V55-V153 HydrophobicContact CG2-CG2 3.61Å; W135-V153 HydrophobicContact CH2-CG1 4.47Å; W135-V153 HydrophobicContact CZ2-CG1 3.95Å; L149-V153 HydrophobicContact CB-CB 4.34Å; L149-V153 HydrophobicContact CB-CG1 4.32Å; L149-V153 HydrophobicContact CD1-CG1 3.91Å; A150-V153 PolarHBondContact O-N 2.93Å; P151-V153 PolarHBondContact O-N 2.93Å; V153-S155 VanDerWaalsContact C-N 3.31Å; V153-S155 PolarHBondContact O-N 2.97Å; V153-L156 PolarHBondContact O-N 3.06Å; V153-L156 VanDerWaalsContact O-N 3.14Å; V153-L157 WeakPolarHBondContact O-CB 3.41Å; V153-L157 PolarHBondContact O-N 3.28Å
154	L	91.2	Very high	92.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-40.7	178.3	-69.9	176.3	0	0	0	112.3	V147 L149 A150 P151 L156 L157 Q158 F176 F178	V147-L154 HydrophobicContact CB-CD2 4.47Å; V147-L154 HydrophobicContact CG2-CD2 3.87Å; L149-L154 HydrophobicContact CB-CD2 4.16Å; L149-L154 HydrophobicContact CB-CG 4.35Å; A150-L154 PolarHBondContact O-N 3.38Å; P151-L154 PolarHBondContact O-N 3.24Å; L154-L156 VanDerWaalsContact C-N 3.28Å; L154-L156 PolarHBondContact O-N 2.82Å; L154-L157 PolarHBondContact O-N 3.48Å; L154-Q158 WeakPolarHBondContact O-CB 3.05Å; L154-Q158 PolarHBondContact O-N 3.34Å; L154-F176 HydrophobicContact CD1-CB 3.71Å; L154-F178 HydrophobicContact CB-CD1 4.16Å; L154-F178 HydrophobicContact CB-CE1 4.13Å; L154-F178 HydrophobicContact CD2-CD1 4.41Å; L154-F178 HydrophobicContact CD2-CE1 3.79Å; L154-F178 HydrophobicContact CD2-CE2 4.41Å; L154-F178 HydrophobicContact CD2-CZ 3.79Å; L154-F178 WeakPolarHBondContact O-CE1 3.37Å
155	S	89.6	Confident	92.4	Very high	53 Å²	53	37 Å²	37	37%	0.371	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-37.6	177	-56.1	0	0	0	0	113.3	P151 V153	P151-S155 PolarHBondContact O-N 3.46Å; P151-S155 VanDerWaalsContact O-N 3.13Å; P151-S155 PolarHBondContact O-OG 3.04Å; V153-S155 VanDerWaalsContact C-N 3.31Å; V153-S155 PolarHBondContact O-N 2.97Å
156	L	90.8	Very high	92.3	Very high	90 Å²	90	38.4 Å²	38.4	47%	0.471	21%	0.214	S	C	.	.	H	α-helix	trans	-79.2	-39.8	176.9	-66.6	175.2	0	0	0	111.2	L53 W135 V153 L154 Q158 K159	L53-L156 HydrophobicContact CD2-CD1 4.46Å; W135-L156 HydrophobicContact CH2-CB 3.48Å; W135-L156 VanDerWaalsContact CH2-CB 3.48Å; W135-L156 HydrophobicContact CZ2-CB 4.23Å; W135-L156 HydrophobicContact CZ3-CB 4.16Å; V153-L156 PolarHBondContact O-N 3.06Å; V153-L156 VanDerWaalsContact O-N 3.14Å; L154-L156 VanDerWaalsContact C-N 3.28Å; L154-L156 PolarHBondContact O-N 2.82Å; L156-Q158 VanDerWaalsContact C-N 3.27Å; L156-Q158 PolarHBondContact O-N 2.68Å; L156-K159 PolarHBondContact O-N 3.34Å
157	L	92.6	Very high	92.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-35.3	-177.4	-175.9	57.4	0	0	0	111.1	L82 L134 W135 V147 L149 V153 L154 K159 K160 L161 F178	L82-L157 HydrophobicContact CD1-CD1 4.22Å; L82-L157 HydrophobicContact CD1-CD2 4.19Å; L134-L157 HydrophobicContact CD1-CD1 3.89Å; W135-L157 HydrophobicContact CH2-CB 3.95Å; W135-L157 HydrophobicContact CH2-CD1 4.44Å; W135-L157 HydrophobicContact CZ3-CB 4.27Å; W135-L157 HydrophobicContact CZ3-CD1 4.15Å; V147-L157 HydrophobicContact CB-CD2 4.45Å; V147-L157 HydrophobicContact CG1-CD2 3.96Å; L149-L157 HydrophobicContact CD1-CD2 3.68Å; V153-L157 WeakPolarHBondContact O-CB 3.41Å; V153-L157 PolarHBondContact O-N 3.28Å; L154-L157 PolarHBondContact O-N 3.48Å; L157-K159 PolarHBondContact O-N 2.88Å; L157-K160 HydrophobicContact CD1-CB 4.48Å; L157-K160 HydrophobicContact CD1-CD 4.4Å; L157-K160 PolarHBondContact O-N 2.94Å; L157-K160 VanDerWaalsContact O-N 3.08Å; L157-L161 HydrophobicContact CD1-CD2 4.19Å; L157-L161 HydrophobicContact CD1-CG 4.05Å; L157-L161 HydrophobicContact CD2-CD1 4.38Å; L157-L161 HydrophobicContact CG-CD1 3.92Å; L157-L161 HydrophobicContact CG-CD2 4.49Å; L157-L161 HydrophobicContact CG-CG 3.94Å; L157-L161 WeakPolarHBondContact O-CG 3.24Å; L157-L161 PolarHBondContact O-N 3.36Å; L157-F178 HydrophobicContact CB-CE1 4.48Å
158	Q	93.1	Very high	92.1	Very high	8 Å²	8	45.7 Å²	45.7	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-48.2	-46.2	174.6	-164.8	-175.9	-82.6	0	0	112.1	L154 L156 Q162 F178 P179 D180 W181	L154-Q158 WeakPolarHBondContact O-CB 3.05Å; L154-Q158 PolarHBondContact O-N 3.34Å; L156-Q158 VanDerWaalsContact C-N 3.27Å; L156-Q158 PolarHBondContact O-N 2.68Å; Q158-Q162 WeakPolarHBondContact O-CB 3.26Å; Q158-Q162 PolarHBondContact O-N 3.32Å; Q158-F178 HydrophobicContact CB-CD1 3.74Å; Q158-F178 HydrophobicContact CB-CE1 4.07Å; Q158-F178 HydrophobicContact CG-CD1 3.95Å; Q158-P179 VanDerWaalsContact OE1-CD 3.25Å; Q158-D180 PolarHBondContact NE2-OD2 3.28Å; Q158-D180 VanDerWaalsContact OE1-N 3.1Å; Q158-W181 HydrophobicContact CG-CD2 3.9Å; Q158-W181 HydrophobicContact CG-CG 4.14Å; Q158-W181 HydrophobicContact CG-CZ2 3.76Å; Q158-W181 VanDerWaalsContact CG-NE1 3.28Å; Q158-W181 WeakPolarHBondContact O-CZ2 3.41Å
159	K	92.4	Very high	92.3	Very high	137 Å²	137	44 Å²	44	60%	0.596	25%	0.245	S	C	*	.	H	α-helix	trans	-66.3	-43.9	-179.2	-64.7	-179.4	-179.8	-179.8	0	111.8	L156 L157 Q162 V163	L156-K159 PolarHBondContact O-N 3.34Å; L157-K159 PolarHBondContact O-N 2.88Å; K159-Q162 PolarHBondContact O-N 3.37Å; K159-V163 WeakPolarHBondContact O-CG2 3.22Å; K159-V163 PolarHBondContact O-N 2.82Å
160	K	94.4	Very high	92.7	Very high	24 Å²	24	43.8 Å²	43.8	10%	0.104	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-49.6	177.1	178.5	178.6	164.3	77.5	0	110.9	L134 W135 V137 L157 Q162 V163 E164	L134-K160 VanDerWaalsContact O-CE 3.24Å; L134-K160 WeakPolarHBondContact O-CE 3.32Å; W135-K160 HydrophobicContact CE3-CD 3.89Å; W135-K160 HydrophobicContact CZ3-CB 4.35Å; W135-K160 HydrophobicContact CZ3-CD 4.42Å; W135-K160 WeakPolarHBondContact O-CE 3.17Å; W135-K160 PolarHBondContact O-NZ 3.38Å; V137-K160 PolarHBondContact O-NZ 3.18Å; L157-K160 HydrophobicContact CD1-CB 4.48Å; L157-K160 HydrophobicContact CD1-CD 4.4Å; L157-K160 PolarHBondContact O-N 2.94Å; L157-K160 VanDerWaalsContact O-N 3.08Å; K160-Q162 VanDerWaalsContact C-N 3.29Å; K160-Q162 PolarHBondContact O-N 2.79Å; K160-V163 PolarHBondContact O-N 2.83Å; K160-E164 WeakPolarHBondContact CE-OE2 3.32Å; K160-E164 HydrophobicContact CG-CG 4.45Å; K160-E164 WeakPolarHBondContact CG-OE1 3.35Å; K160-E164 IonicContact NZ-OE1 3.52Å; K160-E164 PolarHBondContact NZ-OE1 2.95Å; K160-E164 IonicContact NZ-OE2 2.66Å; K160-E164 PolarHBondContact NZ-OE2 2.88Å; K160-E164 PolarHBondContact O-N 3.02Å
161	L	95.4	Very high	93.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-38.3	179.4	-64.1	-177.8	0	0	0	111.8	L82 L139 L157 V163 L165 V171 F178 W181 M199	L82-L161 HydrophobicContact CD1-CD2 4.05Å; L139-L161 HydrophobicContact CD1-CD2 3.46Å; L139-L161 VanDerWaalsContact CD1-CD2 3.46Å; L157-L161 HydrophobicContact CD1-CD2 4.19Å; L157-L161 HydrophobicContact CD1-CG 4.05Å; L157-L161 HydrophobicContact CD2-CD1 4.38Å; L157-L161 HydrophobicContact CG-CD1 3.92Å; L157-L161 HydrophobicContact CG-CD2 4.49Å; L157-L161 HydrophobicContact CG-CG 3.94Å; L157-L161 WeakPolarHBondContact O-CG 3.24Å; L157-L161 PolarHBondContact O-N 3.36Å; L161-V163 VanDerWaalsContact C-N 3.29Å; L161-V163 PolarHBondContact O-N 3.38Å; L161-L165 HydrophobicContact CB-CD1 3.88Å; L161-L165 HydrophobicContact CB-CG 4.3Å; L161-L165 HydrophobicContact CD2-CD1 3.96Å; L161-L165 HydrophobicContact CD2-CG 4.18Å; L161-L165 HydrophobicContact CG-CD1 4.35Å; L161-L165 VanDerWaalsContact O-CB 3.28Å; L161-L165 WeakPolarHBondContact O-CB 3.41Å; L161-L165 WeakPolarHBondContact O-CG 3.3Å; L161-L165 PolarHBondContact O-N 3.47Å; L161-V171 HydrophobicContact CD1-CG1 3.94Å; L161-V171 HydrophobicContact CD1-CG2 4.37Å; L161-F178 HydrophobicContact CD1-CE1 4.25Å; L161-F178 HydrophobicContact CD1-CE2 4.38Å; L161-F178 HydrophobicContact CD1-CZ 3.63Å; L161-W181 HydrophobicContact CB-CH2 3.79Å; L161-W181 HydrophobicContact CB-CZ2 4.47Å; L161-W181 HydrophobicContact CD1-CH2 4.4Å; L161-M199 WeakPolarHBondContact O-CE 3.38Å
162	Q	93.3	Very high	93.7	Very high	57 Å²	57	39.8 Å²	39.8	27%	0.266	22%	0.216	S	C	.	.	H	α-helix	trans	-63.5	-34.7	177.3	-163.8	170.6	15.6	0	0	113.4	Q158 K159 K160 W181 M199 R203	Q158-Q162 WeakPolarHBondContact O-CB 3.26Å; Q158-Q162 PolarHBondContact O-N 3.32Å; K159-Q162 PolarHBondContact O-N 3.37Å; K160-Q162 VanDerWaalsContact C-N 3.29Å; K160-Q162 PolarHBondContact O-N 2.79Å; Q162-W181 HydrophobicContact CB-CZ2 4.08Å; Q162-M199 HydrophobicContact CB-CE 4.5Å; Q162-R203 PolarHBondContact O-NH2 2.9Å
163	V	93.3	Very high	94.2	Very high	120 Å²	120	36.3 Å²	36.3	73%	0.727	19%	0.192	S	C	*	.	H	α-helix	trans	-82.1	-44	-179.5	173.4	0	0	0	0	111.1	K159 K160 L161	K159-V163 WeakPolarHBondContact O-CG2 3.22Å; K159-V163 PolarHBondContact O-N 2.82Å; K160-V163 PolarHBondContact O-N 2.83Å; L161-V163 VanDerWaalsContact C-N 3.29Å; L161-V163 PolarHBondContact O-N 3.38Å
164	E	95.9	Very high	94.4	Very high	59 Å²	59	36.1 Å²	36.1	28%	0.276	19%	0.191	S	C	.	.	H	α-helix	trans	-90.3	-36.8	-168.1	-68.5	179.5	-159.2	0	0	114	L139 S140 K160	L139-E164 HydrophobicContact CB-CB 4.25Å; L139-E164 PolarHBondContact N-OE2 3.06Å; S140-E164 VanDerWaalsContact CA-O 3.27Å; S140-E164 WeakPolarHBondContact CA-O 3.47Å; K160-E164 WeakPolarHBondContact CE-OE2 3.32Å; K160-E164 HydrophobicContact CG-CG 4.45Å; K160-E164 WeakPolarHBondContact CG-OE1 3.35Å; K160-E164 IonicContact NZ-OE1 3.52Å; K160-E164 PolarHBondContact NZ-OE1 2.95Å; K160-E164 IonicContact NZ-OE2 2.66Å; K160-E164 PolarHBondContact NZ-OE2 2.88Å; K160-E164 PolarHBondContact O-N 3.02Å
165	L	96.6	Very high	94.4	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.016	20%	0.2	C	C	.	.	S	Bend	trans	-69.4	148.7	-171.9	-68.5	178.9	0	0	0	113	L139 C142 V145 L161 A169 V171 M199 R203	L139-L165 HydrophobicContact CB-CD2 3.81Å; C142-L165 HydrophobicContact CB-CD2 4.34Å; V145-L165 HydrophobicContact CG2-CD1 4.45Å; V145-L165 HydrophobicContact CG2-CD2 3.79Å; L161-L165 HydrophobicContact CB-CD1 3.88Å; L161-L165 HydrophobicContact CB-CG 4.3Å; L161-L165 HydrophobicContact CD2-CD1 3.96Å; L161-L165 HydrophobicContact CD2-CG 4.18Å; L161-L165 HydrophobicContact CG-CD1 4.35Å; L161-L165 VanDerWaalsContact O-CB 3.28Å; L161-L165 WeakPolarHBondContact O-CB 3.41Å; L161-L165 WeakPolarHBondContact O-CG 3.3Å; L161-L165 PolarHBondContact O-N 3.47Å; L165-A169 HydrophobicContact CB-CB 4.02Å; L165-A169 HydrophobicContact CD1-CB 4.31Å; L165-A169 HydrophobicContact CD2-CB 4.49Å; L165-V171 HydrophobicContact CD1-CG2 3.26Å; L165-M199 HydrophobicContact CB-CE 4.41Å; L165-M199 HydrophobicContact CB-CG 3.95Å; L165-M199 HydrophobicContact CD1-CG 3.9Å; L165-M199 HydrophobicContact CD1-SD 3.87Å; L165-R203 PolarHBondContact O-NH1 3.49Å; L165-R203 VanDerWaalsContact O-NH1 3.16Å; L165-R203 PolarHBondContact O-NH2 3.43Å
166	P	95.4	Very high	94.6	Very high	31 Å²	31	39.9 Å²	39.9	20%	0.201	20%	0.2	C	C	.	.			trans	-69.7	160.3	171.4	28.8	-31.8	0	0	0	111.5	C142 D168 A169 M199	C142-P166 WeakPolarHBondContact O-CD 3.41Å; P166-D168 VanDerWaalsContact C-N 3.26Å; P166-D168 WeakPolarHBondContact CB-OD1 3.3Å; P166-D168 PolarHBondContact O-N 2.75Å; P166-A169 HydrophobicContact CG-CB 4.01Å; P166-A169 VanDerWaalsContact O-CB 3.24Å; P166-A169 WeakPolarHBondContact O-CB 3.16Å; P166-A169 PolarHBondContact O-N 3.02Å; P166-A169 VanDerWaalsContact O-N 3.15Å; P166-M199 WeakPolarHBondContact O-CB 3.45Å
167	D	93.9	Very high	94.8	Very high	88 Å²	88	38.5 Å²	38.5	47%	0.471	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-35.9	-179.1	-79.8	-35.1	0	0	0	112.7	A169 Q200 R203	D167-A169 PolarHBondContact O-N 3.24Å; D167-Q200 HydrophobicContact CB-CB 4.44Å; D167-Q200 VanDerWaalsContact O-CB 3.32Å; D167-Q200 WeakPolarHBondContact O-CB 3.41Å; D167-Q200 PolarHBondContact O-N 2.77Å; D167-R203 WeakPolarHBondContact OD1-CD 3.43Å; D167-R203 IonicContact OD1-CZ 3.02Å; D167-R203 IonicContact OD1-NE 3.58Å; D167-R203 IonicContact OD1-NH1 2.74Å; D167-R203 PolarHBondContact OD1-NH1 3.48Å
168	D	94.5	Very high	94.9	Very high	69 Å²	69	38.7 Å²	38.7	37%	0.369	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	1.4	-178.9	71.5	-31.6	0	0	0	113.6	R75 K143 P166	R75-D168 PolarHBondContact NH1-O 3.14Å; R75-D168 PolarHBondContact NH2-O 2.86Å; K143-D168 WeakPolarHBondContact CE-OD2 3.12Å; K143-D168 IonicContact NZ-OD2 3.67Å; K143-D168 PolarHBondContact NZ-OD2 3.21Å; P166-D168 VanDerWaalsContact C-N 3.26Å; P166-D168 WeakPolarHBondContact CB-OD1 3.3Å; P166-D168 PolarHBondContact O-N 2.75Å
169	A	96.8	Very high	94.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.			trans	-71.6	143.4	-179.1	0	0	0	0	0	113.1	K143 L165 P166 D167 M199	K143-A169 CarbonylContact O-C 3.52Å; K143-A169 VanDerWaalsContact O-CA 3.23Å; K143-A169 WeakPolarHBondContact O-CA 3.4Å; L165-A169 HydrophobicContact CB-CB 4.02Å; L165-A169 HydrophobicContact CD1-CB 4.31Å; L165-A169 HydrophobicContact CD2-CB 4.49Å; P166-A169 HydrophobicContact CG-CB 4.01Å; P166-A169 VanDerWaalsContact O-CB 3.24Å; P166-A169 WeakPolarHBondContact O-CB 3.16Å; P166-A169 PolarHBondContact O-N 3.02Å; P166-A169 VanDerWaalsContact O-N 3.15Å; D167-A169 PolarHBondContact O-N 3.24Å; A169-M199 HydrophobicContact CB-CB 4.42Å; A169-M199 HydrophobicContact CB-CG 3.81Å; A169-M199 PolarHBondContact O-N 3.05Å; A169-M199 VanDerWaalsContact O-N 3.08Å
170	L	97.4	Very high	94.6	Very high	16 Å²	16	41.3 Å²	41.3	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.5	169.6	-170.5	78.5	0	0	0	109.5	V72 R75 K143 V145 V172 A196 Y197	V72-L170 HydrophobicContact CG1-CD2 4.27Å; R75-L170 VanDerWaalsContact CD-CD2 3.46Å; R75-L170 HydrophobicContact CG-CD2 4.43Å; K143-L170 PolarHBondContact O-N 3.15Å; V145-L170 PolarHBondContact N-O 3.32Å; L170-V172 HydrophobicContact CD2-CG2 4.06Å; L170-V172 HydrophobicContact CG-CG2 4.34Å; L170-A196 HydrophobicContact CD1-CB 4.26Å; L170-Y197 WeakPolarHBondContact CA-O 3.4Å
171	V	97.8	Very high	94.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130	172.7	-175	0	0	0	0	109	V145 L161 L165 F178 W181 A196 Y197 M199	V145-V171 HydrophobicContact CB-CG2 4.47Å; V145-V171 CarbonylContact O-C 3.54Å; V145-V171 WeakPolarHBondContact O-CA 3.46Å; L161-V171 HydrophobicContact CD1-CG1 3.94Å; L161-V171 HydrophobicContact CD1-CG2 4.37Å; L165-V171 HydrophobicContact CD1-CG2 3.26Å; V171-F178 HydrophobicContact CG1-CE2 3.73Å; V171-F178 HydrophobicContact CG1-CZ 4.29Å; V171-W181 HydrophobicContact CB-CZ3 4.3Å; V171-W181 HydrophobicContact CG1-CZ3 4.46Å; V171-W181 HydrophobicContact CG2-CZ3 4.2Å; V171-A196 CarbonylContact O-C 3.52Å; V171-A196 WeakPolarHBondContact O-CA 2.96Å; V171-Y197 PolarHBondContact N-O 3.24Å; V171-Y197 PolarHBondContact O-N 3.29Å; V171-M199 HydrophobicContact CG2-CG 4.34Å; V171-M199 HydrophobicContact CG2-SD 3.85Å
172	V	97.8	Very high	94.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.1	174.9	180	0	0	0	0	109.9	V68 L71 V72 V145 T146 V147 L170 W195 A196	V68-V172 HydrophobicContact CB-CG1 4.3Å; V68-V172 HydrophobicContact CG1-CG1 3.95Å; V68-V172 HydrophobicContact CG2-CG1 4.1Å; L71-V172 HydrophobicContact CB-CG1 4.19Å; L71-V172 HydrophobicContact CB-CG2 4.08Å; L71-V172 HydrophobicContact CD1-CG1 3.67Å; V72-V172 HydrophobicContact CG1-CB 4.49Å; V72-V172 HydrophobicContact CG1-CG2 3.62Å; V145-V172 PolarHBondContact O-N 2.69Å; T146-V172 CarbonylContact C-O 3.5Å; T146-V172 WeakPolarHBondContact CA-O 3.47Å; T146-V172 HydrophobicContact CG2-CB 4.36Å; V147-V172 PolarHBondContact N-O 2.99Å; L170-V172 HydrophobicContact CD2-CG2 4.06Å; L170-V172 HydrophobicContact CG-CG2 4.34Å; V172-W195 CarbonylContact C-O 3.46Å; V172-W195 VanDerWaalsContact CA-O 3.28Å; V172-W195 WeakPolarHBondContact CA-O 3.26Å; V172-A196 HydrophobicContact CG2-CB 4.12Å
173	A	96.8	Very high	94.5	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	134.6	174.5	0	0	0	0	0	110.6	V147 F176 F178 A194 W195 Y197	V147-A173 HydrophobicContact CG2-CB 3.68Å; V147-A173 WeakPolarHBondContact O-CA 3.35Å; A173-F176 WeakPolarHBondContact CB-O 3.35Å; A173-F178 HydrophobicContact CB-CD2 4.09Å; A173-F178 HydrophobicContact CB-CE2 3.95Å; A173-A194 CarbonylContact O-C 3.51Å; A173-A194 VanDerWaalsContact O-CA 3.24Å; A173-A194 WeakPolarHBondContact O-CA 3.49Å; A173-W195 PolarHBondContact N-O 2.53Å; A173-W195 PolarHBondContact O-N 3.46Å; A173-Y197 HydrophobicContact CB-CE2 4.02Å
174	G	94.4	Very high	94.6	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	149.5	172.8	0	0	0	0	0	112.5	V147 F176	V147-G174 PolarHBondContact O-N 3.17Å; G174-F176 PolarHBondContact O-N 3.13Å
175	R	91.2	Very high	94.6	Very high	52 Å²	52	46.2 Å²	46.2	20%	0.196	25%	0.249	C	C	.	.	S	Bend	trans	61.3	-38.1	-179.9	-178.5	173.5	-81.5	164.8	-7.3	116.8	I58 F148 V191 R193 W195	I58-R175 VanDerWaalsContact CG2-NH1 3.27Å; F148-R175 HydrophobicContact CD2-CB 4.4Å; F148-R175 HydrophobicContact CE2-CB 3.38Å; F148-R175 HydrophobicContact CZ-CB 3.73Å; R175-V191 PolarHBondContact NE-O 2.66Å; R175-R193 WeakPolarHBondContact CA-O 3.4Å; R175-R193 PolarHBondContact N-O 3.2Å; R175-W195 VanDerWaalsContact O-CH2 3.24Å; R175-W195 WeakPolarHBondContact O-CH2 3.49Å; R175-W195 WeakPolarHBondContact O-CZ3 3.32Å
176	F	93.3	Very high	94.6	Very high	81 Å²	81	50.2 Å²	50.2	36%	0.355	27%	0.269	S	S	.	.	S	Bend	trans	-128.8	138	178.2	-59	-69.9	0	0	0	111.2	P151 L154 A173 G174	P151-F176 HydrophobicContact CG-CB 4.21Å; P151-F176 HydrophobicContact CG-CD1 3.74Å; P151-F176 HydrophobicContact CG-CD2 4.05Å; P151-F176 HydrophobicContact CG-CE1 4.06Å; P151-F176 HydrophobicContact CG-CE2 4.34Å; P151-F176 HydrophobicContact CG-CG 3.73Å; P151-F176 HydrophobicContact CG-CZ 4.35Å; L154-F176 HydrophobicContact CD1-CB 3.71Å; A173-F176 WeakPolarHBondContact CB-O 3.35Å; G174-F176 PolarHBondContact O-N 3.13Å
177	P	94.6	Very high	94.7	Very high	61 Å²	61	52.3 Å²	52.3	40%	0.396	28%	0.276	S	S	.	.			trans	-79.1	160.7	175.1	32.3	-33.4	0	0	0	112	W195 Y197	P177-W195 HydrophobicContact CB-CD2 3.94Å; P177-W195 HydrophobicContact CB-CE3 4.5Å; P177-W195 HydrophobicContact CB-CG 4.15Å; P177-W195 HydrophobicContact CB-CZ2 4.19Å; P177-W195 HydrophobicContact CG-CZ2 4.13Å; P177-Y197 WeakPolarHBondContact CA-OH 3.28Å; P177-Y197 WeakPolarHBondContact CB-OH 3.44Å
178	F	94.4	Very high	94.7	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.018	26%	0.264	C	S	.	.			trans	-70.6	133.3	162.6	-77.5	-76.7	0	0	0	110.3	V147 L154 L157 Q158 L161 V171 A173 W181 Y197	V147-F178 HydrophobicContact CG2-CE2 3.82Å; V147-F178 HydrophobicContact CG2-CZ 3.84Å; L154-F178 HydrophobicContact CB-CD1 4.16Å; L154-F178 HydrophobicContact CB-CE1 4.13Å; L154-F178 HydrophobicContact CD2-CD1 4.41Å; L154-F178 HydrophobicContact CD2-CE1 3.79Å; L154-F178 HydrophobicContact CD2-CE2 4.41Å; L154-F178 HydrophobicContact CD2-CZ 3.79Å; L154-F178 WeakPolarHBondContact O-CE1 3.37Å; L157-F178 HydrophobicContact CB-CE1 4.48Å; Q158-F178 HydrophobicContact CB-CD1 3.74Å; Q158-F178 HydrophobicContact CB-CE1 4.07Å; Q158-F178 HydrophobicContact CG-CD1 3.95Å; L161-F178 HydrophobicContact CD1-CE1 4.25Å; L161-F178 HydrophobicContact CD1-CE2 4.38Å; L161-F178 HydrophobicContact CD1-CZ 3.63Å; V171-F178 HydrophobicContact CG1-CE2 3.73Å; V171-F178 HydrophobicContact CG1-CZ 4.29Å; A173-F178 HydrophobicContact CB-CD2 4.09Å; A173-F178 HydrophobicContact CB-CE2 3.95Å; F178-W181 HydrophobicContact CB-CB 3.94Å; F178-W181 HydrophobicContact CB-CD2 4.29Å; F178-W181 HydrophobicContact CB-CE3 4.23Å; F178-W181 HydrophobicContact CB-CG 4.2Å; F178-W181 AromaticContact CD2-CE3 3.89Å; F178-W181 HydrophobicContact CD2-CE3 3.89Å; F178-W181 HydrophobicContact CD2-CZ3 4.21Å; F178-W181 HydrophobicContact CE2-CE3 4.43Å; F178-W181 HydrophobicContact CE2-CZ3 4.3Å; F178-W181 HydrophobicContact CG-CD2 4.43Å; F178-W181 HydrophobicContact CG-CE3 4.02Å; F178-Y197 HydrophobicContact CB-CE1 4.4Å; F178-Y197 AromaticContact CD2-CD2 3.91Å; F178-Y197 HydrophobicContact CD2-CD2 3.91Å; F178-Y197 AromaticContact CD2-CE2 3.62Å; F178-Y197 HydrophobicContact CD2-CE2 3.62Å; F178-Y197 HydrophobicContact CE2-CD2 4.47Å; F178-Y197 HydrophobicContact CE2-CE2 4.41Å; F178-Y197 PolarHBondContact N-OH 2.85Å
179	P	88.9	Confident	94.6	Very high	75 Å²	75	52.6 Å²	52.6	49%	0.487	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-39.4	-170.2	24.1	-34.3	0	0	0	114.6	Q158	Q158-P179 VanDerWaalsContact OE1-CD 3.25Å
180	D	90.1	Very high	94.4	Very high	126 Å²	126	55.2 Å²	55.2	67%	0.674	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	5.9	-173.7	-45.8	-57.6	0	0	0	113.5	Q158	Q158-D180 PolarHBondContact NE2-OD2 3.28Å; Q158-D180 VanDerWaalsContact OE1-N 3.1Å
181	W	93.5	Very high	94	Very high	17 Å²	17	58.8 Å²	58.8	6%	0.064	33%	0.327	C	S	.	.			trans	-106.3	140.7	-177.1	-73	4.4	0	0	0	111.8	Q158 L161 Q162 V171 F178 Y197 M199 Q202	Q158-W181 HydrophobicContact CG-CD2 3.9Å; Q158-W181 HydrophobicContact CG-CG 4.14Å; Q158-W181 HydrophobicContact CG-CZ2 3.76Å; Q158-W181 VanDerWaalsContact CG-NE1 3.28Å; Q158-W181 WeakPolarHBondContact O-CZ2 3.41Å; L161-W181 HydrophobicContact CB-CH2 3.79Å; L161-W181 HydrophobicContact CB-CZ2 4.47Å; L161-W181 HydrophobicContact CD1-CH2 4.4Å; Q162-W181 HydrophobicContact CB-CZ2 4.08Å; V171-W181 HydrophobicContact CB-CZ3 4.3Å; V171-W181 HydrophobicContact CG1-CZ3 4.46Å; V171-W181 HydrophobicContact CG2-CZ3 4.2Å; F178-W181 HydrophobicContact CB-CB 3.94Å; F178-W181 HydrophobicContact CB-CD2 4.29Å; F178-W181 HydrophobicContact CB-CE3 4.23Å; F178-W181 HydrophobicContact CB-CG 4.2Å; F178-W181 AromaticContact CD2-CE3 3.89Å; F178-W181 HydrophobicContact CD2-CE3 3.89Å; F178-W181 HydrophobicContact CD2-CZ3 4.21Å; F178-W181 HydrophobicContact CE2-CE3 4.43Å; F178-W181 HydrophobicContact CE2-CZ3 4.3Å; F178-W181 HydrophobicContact CG-CD2 4.43Å; F178-W181 HydrophobicContact CG-CE3 4.02Å; W181-Y197 HydrophobicContact CB-CD1 3.64Å; W181-Y197 HydrophobicContact CB-CE1 3.69Å; W181-Y197 HydrophobicContact CE3-CD1 4.05Å; W181-Y197 HydrophobicContact CE3-CD2 4.42Å; W181-Y197 AromaticContact CE3-CG 3.86Å; W181-Y197 HydrophobicContact CE3-CG 3.86Å; W181-M199 HydrophobicContact CH2-CE 3.71Å; W181-M199 HydrophobicContact CH2-SD 3.44Å; W181-M199 WeakPolarHBondContact CH2-SD 3.21Å; W181-M199 HydrophobicContact CZ2-CE 3.92Å; W181-M199 HydrophobicContact CZ2-SD 4.19Å; W181-M199 HydrophobicContact CZ3-SD 3.8Å; W181-Q202 HydrophobicContact CB-CG 4.46Å; W181-Q202 HydrophobicContact CD2-CG 3.94Å; W181-Q202 HydrophobicContact CE3-CG 4.28Å; W181-Q202 HydrophobicContact CG-CG 4.03Å
182	S	93.3	Very high	93.8	Very high	69 Å²	69	60.8 Å²	60.8	48%	0.483	34%	0.338	S	S	.	.			trans	-90.5	116.1	176.2	-65	0	0	0	0	110.1	Q202	S182-Q202 PolarHBondContact O-NE2 3.33Å
183	P	95.6	Very high	93.7	Very high	50 Å²	50	64.9 Å²	64.9	33%	0.325	35%	0.354	S	S	.	.			trans	-67.8	139.8	-179.8	29.7	-35.7	0	0	0	110.9	I186 W195 A196 Y197	P183-I186 HydrophobicContact CB-CD1 4.43Å; P183-I186 HydrophobicContact CB-CG1 4.01Å; P183-I186 HydrophobicContact CG-CD1 3.8Å; P183-I186 HydrophobicContact CG-CG1 3.94Å; P183-W195 HydrophobicContact CB-CB 4.16Å; P183-W195 HydrophobicContact CB-CG 4.5Å; P183-A196 CarbonylContact C-O 3.55Å; P183-A196 VanDerWaalsContact CA-O 3.27Å; P183-A196 WeakPolarHBondContact CA-O 3.24Å; P183-Y197 HydrophobicContact CB-CD1 4.19Å; P183-Y197 HydrophobicContact CB-CE1 3.75Å; P183-Y197 HydrophobicContact CG-CE1 4.43Å
184	C	94.6	Very high	93.7	Very high	69 Å²	69	64.9 Å²	64.9	47%	0.466	35%	0.354	S	S	.	.	S	Bend	trans	-82.3	-29.5	173.1	62.9	0	0	0	0	112.2	A196	C184-A196 PolarHBondContact N-O 2.98Å; C184-A196 VanDerWaalsContact SG-C 3.59Å; C184-A196 PolarHBondContact SG-O 3.16Å
185	R	96.1	Very high	93.8	Very high	158 Å²	158	65.8 Å²	65.8	60%	0.596	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.6	148.8	176.5	-63.1	-175.4	-177.6	175.4	-0.3	110.1	L71 A196	L71-R185 HydrophobicContact CD2-CB 3.64Å; R185-A196 HydrophobicContact CB-CB 4.28Å; R185-A196 PolarHBondContact O-N 3Å
186	I	97	Very high	94.1	Very high	86 Å²	86	63.4 Å²	63.4	44%	0.441	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.1	177.7	-53.4	179.5	0	0	0	107.2	P183 R193 A194	P183-I186 HydrophobicContact CB-CD1 4.43Å; P183-I186 HydrophobicContact CB-CG1 4.01Å; P183-I186 HydrophobicContact CG-CD1 3.8Å; P183-I186 HydrophobicContact CG-CG1 3.94Å; I186-R193 HydrophobicContact CG2-CG 3.7Å; I186-A194 WeakPolarHBondContact CA-O 3.32Å
187	E	97.3	Very high	94.3	Very high	76 Å²	76	59.5 Å²	59.5	36%	0.355	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.1	178.6	-73.3	-64.7	168	0	0	111	N67 T70 L71 R193 A194	N67-E187 HydrophobicContact CB-CB 4.1Å; T70-E187 HydrophobicContact CG2-CG 4.35Å; L71-E187 HydrophobicContact CD1-CB 4.26Å; L71-E187 HydrophobicContact CD1-CG 4.5Å; L71-E187 HydrophobicContact CD2-CB 4.02Å; L71-E187 HydrophobicContact CD2-CG 3.39Å; L71-E187 HydrophobicContact CG-CB 3.93Å; L71-E187 HydrophobicContact CG-CG 3.69Å; E187-R193 CarbonylContact O-C 3.52Å; E187-R193 WeakPolarHBondContact O-CA 3.47Å; E187-A194 PolarHBondContact N-O 3.31Å; E187-A194 PolarHBondContact O-N 3.39Å
188	G	94.2	Very high	94.4	Very high	21 Å²	21	58 Å²	58	22%	0.216	32%	0.322	C	S	.	.	S	Bend	trans	79.7	-178.3	179.6	0	0	0	0	0	115.6	N67	N67-G188 WeakPolarHBondContact ND2-CA 3.32Å
189	Q	91.6	Very high	94.4	Very high	141 Å²	141	57.9 Å²	57.9	66%	0.659	32%	0.321	S	S	*	.			trans	-137.6	155.7	-175.6	-64.1	-60.2	-19	0	0	111.7	V191 D192	Q189-V191 PolarHBondContact O-N 3.02Å; Q189-D192 PolarHBondContact O-N 2.94Å
190	G	92.3	Very high	94.6	Very high	55 Å²	55	59.1 Å²	59.1	57%	0.567	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	54.9	-131	177.6	0	0	0	0	0	113	D192 R193	G190-D192 PolarHBondContact O-N 2.67Å; G190-R193 WeakPolarHBondContact O-CB 3.42Å; G190-R193 PolarHBondContact O-N 2.95Å
191	V	89.6	Confident	94.7	Very high	92 Å²	92	55.1 Å²	55.1	56%	0.558	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-70.7	-14.4	-177.1	-62.2	0	0	0	0	114.4	Q64 R175 Q189	Q64-V191 PolarHBondContact NE2-O 2.94Å; R175-V191 PolarHBondContact NE-O 2.66Å; Q189-V191 PolarHBondContact O-N 3.02Å
192	D	92.9	Very high	94.6	Very high	42 Å²	42	54.8 Å²	54.8	23%	0.225	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-99.2	3	-178.7	-64	-38.2	0	0	0	112.8	S61 A63 Q64 N67 Q189 G190	S61-D192 WeakPolarHBondContact CB-OD1 3.47Å; S61-D192 VanDerWaalsContact OG-CG 3.27Å; S61-D192 PolarHBondContact OG-OD1 3.18Å; A63-D192 HydrophobicContact CB-CB 4.35Å; Q64-D192 HydrophobicContact CB-CB 4.3Å; N67-D192 PolarHBondContact ND2-O 3.08Å; Q189-D192 PolarHBondContact O-N 2.94Å; G190-D192 PolarHBondContact O-N 2.67Å
193	R	95.4	Very high	94.4	Very high	86 Å²	86	54.3 Å²	54.3	33%	0.325	29%	0.291	S	S	.	.			trans	-63.1	145.5	178	-168.6	177.5	-73.3	165.3	1.1	111.2	R175 I186 E187 G190 W195	R175-R193 WeakPolarHBondContact CA-O 3.4Å; R175-R193 PolarHBondContact N-O 3.2Å; I186-R193 HydrophobicContact CG2-CG 3.7Å; E187-R193 CarbonylContact O-C 3.52Å; E187-R193 WeakPolarHBondContact O-CA 3.47Å; G190-R193 WeakPolarHBondContact O-CB 3.42Å; G190-R193 PolarHBondContact O-N 2.95Å; R193-W195 HydrophobicContact CB-CH2 3.71Å; R193-W195 HydrophobicContact CB-CZ2 4.12Å; R193-W195 HydrophobicContact CB-CZ3 4.08Å; R193-W195 HydrophobicContact CG-CD2 4.34Å; R193-W195 HydrophobicContact CG-CE3 4.46Å; R193-W195 HydrophobicContact CG-CH2 3.71Å; R193-W195 HydrophobicContact CG-CZ2 3.63Å; R193-W195 HydrophobicContact CG-CZ3 4.12Å; R193-W195 VanDerWaalsContact O-CZ3 3.28Å; R193-W195 WeakPolarHBondContact O-CZ3 3.28Å
194	A	97	Very high	94	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.3	174	0	0	0	0	0	110.3	N67 V68 L71 A173 I186 E187	N67-A194 HydrophobicContact CB-CB 4.27Å; V68-A194 HydrophobicContact CG2-CB 4.01Å; L71-A194 HydrophobicContact CD1-CB 3.52Å; A173-A194 CarbonylContact O-C 3.51Å; A173-A194 VanDerWaalsContact O-CA 3.24Å; A173-A194 WeakPolarHBondContact O-CA 3.49Å; I186-A194 WeakPolarHBondContact CA-O 3.32Å; E187-A194 PolarHBondContact N-O 3.31Å; E187-A194 PolarHBondContact O-N 3.39Å
195	W	97.6	Very high	93.5	Very high	21 Å²	21	58.8 Å²	58.8	8%	0.08	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.6	-175.5	-62.1	-102.3	0	0	0	109.5	V172 A173 R175 P177 P183 R193 Y197	V172-W195 CarbonylContact C-O 3.46Å; V172-W195 VanDerWaalsContact CA-O 3.28Å; V172-W195 WeakPolarHBondContact CA-O 3.26Å; A173-W195 PolarHBondContact N-O 2.53Å; A173-W195 PolarHBondContact O-N 3.46Å; R175-W195 VanDerWaalsContact O-CH2 3.24Å; R175-W195 WeakPolarHBondContact O-CH2 3.49Å; R175-W195 WeakPolarHBondContact O-CZ3 3.32Å; P177-W195 HydrophobicContact CB-CD2 3.94Å; P177-W195 HydrophobicContact CB-CE3 4.5Å; P177-W195 HydrophobicContact CB-CG 4.15Å; P177-W195 HydrophobicContact CB-CZ2 4.19Å; P177-W195 HydrophobicContact CG-CZ2 4.13Å; P183-W195 HydrophobicContact CB-CB 4.16Å; P183-W195 HydrophobicContact CB-CG 4.5Å; R193-W195 HydrophobicContact CB-CH2 3.71Å; R193-W195 HydrophobicContact CB-CZ2 4.12Å; R193-W195 HydrophobicContact CB-CZ3 4.08Å; R193-W195 HydrophobicContact CG-CD2 4.34Å; R193-W195 HydrophobicContact CG-CE3 4.46Å; R193-W195 HydrophobicContact CG-CH2 3.71Å; R193-W195 HydrophobicContact CG-CZ2 3.63Å; R193-W195 HydrophobicContact CG-CZ3 4.12Å; R193-W195 VanDerWaalsContact O-CZ3 3.28Å; R193-W195 WeakPolarHBondContact O-CZ3 3.28Å; W195-Y197 HydrophobicContact CB-CD2 4.43Å; W195-Y197 HydrophobicContact CB-CE2 3.47Å; W195-Y197 VanDerWaalsContact CB-CE2 3.47Å; W195-Y197 WeakPolarHBondContact CB-OH 3.47Å
196	A	97.5	Very high	92.7	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.008	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	142.7	173.5	0	0	0	0	0	111	L71 L170 V171 V172 P183 C184 R185	L71-A196 HydrophobicContact CB-CB 4.21Å; L71-A196 HydrophobicContact CD1-CB 4.25Å; L71-A196 HydrophobicContact CD2-CB 3.89Å; L71-A196 HydrophobicContact CG-CB 4.35Å; L170-A196 HydrophobicContact CD1-CB 4.26Å; V171-A196 CarbonylContact O-C 3.52Å; V171-A196 WeakPolarHBondContact O-CA 2.96Å; V172-A196 HydrophobicContact CG2-CB 4.12Å; P183-A196 CarbonylContact C-O 3.55Å; P183-A196 VanDerWaalsContact CA-O 3.27Å; P183-A196 WeakPolarHBondContact CA-O 3.24Å; C184-A196 PolarHBondContact N-O 2.98Å; C184-A196 VanDerWaalsContact SG-C 3.59Å; C184-A196 PolarHBondContact SG-O 3.16Å; R185-A196 HydrophobicContact CB-CB 4.28Å; R185-A196 PolarHBondContact O-N 3Å
197	Y	97.2	Very high	91.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	125	-177.3	-54.9	-90	0	0	0	109.3	L170 V171 A173 P177 F178 W181 P183 W195	L170-Y197 WeakPolarHBondContact CA-O 3.4Å; V171-Y197 PolarHBondContact N-O 3.24Å; V171-Y197 PolarHBondContact O-N 3.29Å; A173-Y197 HydrophobicContact CB-CE2 4.02Å; P177-Y197 WeakPolarHBondContact CA-OH 3.28Å; P177-Y197 WeakPolarHBondContact CB-OH 3.44Å; F178-Y197 HydrophobicContact CB-CE1 4.4Å; F178-Y197 AromaticContact CD2-CD2 3.91Å; F178-Y197 HydrophobicContact CD2-CD2 3.91Å; F178-Y197 AromaticContact CD2-CE2 3.62Å; F178-Y197 HydrophobicContact CD2-CE2 3.62Å; F178-Y197 HydrophobicContact CE2-CD2 4.47Å; F178-Y197 HydrophobicContact CE2-CE2 4.41Å; F178-Y197 PolarHBondContact N-OH 2.85Å; W181-Y197 HydrophobicContact CB-CD1 3.64Å; W181-Y197 HydrophobicContact CB-CE1 3.69Å; W181-Y197 HydrophobicContact CE3-CD1 4.05Å; W181-Y197 HydrophobicContact CE3-CD2 4.42Å; W181-Y197 AromaticContact CE3-CG 3.86Å; W181-Y197 HydrophobicContact CE3-CG 3.86Å; P183-Y197 HydrophobicContact CB-CD1 4.19Å; P183-Y197 HydrophobicContact CB-CE1 3.75Å; P183-Y197 HydrophobicContact CG-CE1 4.43Å; W195-Y197 HydrophobicContact CB-CD2 4.43Å; W195-Y197 HydrophobicContact CB-CE2 3.47Å; W195-Y197 VanDerWaalsContact CB-CE2 3.47Å; W195-Y197 WeakPolarHBondContact CB-OH 3.47Å
198	S	96.2	Very high	90.5	Very high	30 Å²	30	56.4 Å²	56.4	21%	0.21	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.8	169.9	167.4	0	0	0	0	109.7	Q200 A201 Q202	S198-Q200 VanDerWaalsContact C-N 3.35Å; S198-Q200 PolarHBondContact O-N 3.44Å; S198-A201 PolarHBondContact O-N 3.35Å; S198-Q202 WeakPolarHBondContact O-CG 3.32Å; S198-Q202 PolarHBondContact O-N 3.11Å; S198-Q202 VanDerWaalsContact O-N 3.13Å
199	M	95.1	Very high	89.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64	-39.6	-179.4	-68.5	-50	-59.7	0	0	112.5	L161 Q162 L165 P166 A169 V171 W181 A201 Q202 R203	L161-M199 WeakPolarHBondContact O-CE 3.38Å; Q162-M199 HydrophobicContact CB-CE 4.5Å; L165-M199 HydrophobicContact CB-CE 4.41Å; L165-M199 HydrophobicContact CB-CG 3.95Å; L165-M199 HydrophobicContact CD1-CG 3.9Å; L165-M199 HydrophobicContact CD1-SD 3.87Å; P166-M199 WeakPolarHBondContact O-CB 3.45Å; A169-M199 HydrophobicContact CB-CB 4.42Å; A169-M199 HydrophobicContact CB-CG 3.81Å; A169-M199 PolarHBondContact O-N 3.05Å; A169-M199 VanDerWaalsContact O-N 3.08Å; V171-M199 HydrophobicContact CG2-CG 4.34Å; V171-M199 HydrophobicContact CG2-SD 3.85Å; W181-M199 HydrophobicContact CH2-CE 3.71Å; W181-M199 HydrophobicContact CH2-SD 3.44Å; W181-M199 WeakPolarHBondContact CH2-SD 3.21Å; W181-M199 HydrophobicContact CZ2-CE 3.92Å; W181-M199 HydrophobicContact CZ2-SD 4.19Å; W181-M199 HydrophobicContact CZ3-SD 3.8Å; M199-A201 VanDerWaalsContact C-N 3.32Å; M199-A201 PolarHBondContact O-N 3.22Å; M199-Q202 PolarHBondContact O-N 3.36Å; M199-R203 PolarHBondContact O-N 3.19Å
200	Q	93.5	Very high	88.6	Confident	102 Å²	102	59.6 Å²	59.6	48%	0.477	32%	0.318	S	S	.	.	H	α-helix	trans	-55.3	-47.2	173	-174.9	179.9	24.9	0	0	111.7	D167 S198 Q202 R203 Q204	D167-Q200 HydrophobicContact CB-CB 4.44Å; D167-Q200 VanDerWaalsContact O-CB 3.32Å; D167-Q200 WeakPolarHBondContact O-CB 3.41Å; D167-Q200 PolarHBondContact O-N 2.77Å; S198-Q200 VanDerWaalsContact C-N 3.35Å; S198-Q200 PolarHBondContact O-N 3.44Å; Q200-Q202 PolarHBondContact O-N 2.86Å; Q200-R203 PolarHBondContact O-N 2.96Å; Q200-Q204 VanDerWaalsContact O-CG 3.31Å; Q200-Q204 WeakPolarHBondContact O-CG 3.32Å; Q200-Q204 PolarHBondContact O-N 2.81Å
201	A	91.8	Very high	87.3	Confident	41 Å²	41	59.1 Å²	59.1	34%	0.339	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-40.4	-179.6	0	0	0	0	0	111.8	S198 M199 R203 Q204 H205	S198-A201 PolarHBondContact O-N 3.35Å; M199-A201 VanDerWaalsContact C-N 3.32Å; M199-A201 PolarHBondContact O-N 3.22Å; A201-R203 PolarHBondContact O-N 3.47Å; A201-Q204 PolarHBondContact O-N 3.14Å; A201-H205 WeakPolarHBondContact O-CB 3.32Å; A201-H205 PolarHBondContact O-N 3.26Å
202	Q	90.8	Very high	85.9	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-41.5	177.4	-59.9	-42.4	-43.4	0	0	112.1	W181 S182 S198 M199 Q200 H205 T206	W181-Q202 HydrophobicContact CB-CG 4.46Å; W181-Q202 HydrophobicContact CD2-CG 3.94Å; W181-Q202 HydrophobicContact CE3-CG 4.28Å; W181-Q202 HydrophobicContact CG-CG 4.03Å; S182-Q202 PolarHBondContact O-NE2 3.33Å; S198-Q202 WeakPolarHBondContact O-CG 3.32Å; S198-Q202 PolarHBondContact O-N 3.11Å; S198-Q202 VanDerWaalsContact O-N 3.13Å; M199-Q202 PolarHBondContact O-N 3.36Å; Q200-Q202 PolarHBondContact O-N 2.86Å; Q202-H205 PolarHBondContact O-N 3.45Å; Q202-T206 PolarHBondContact O-N 3.41Å; Q202-T206 PolarHBondContact O-OG1 2.92Å
203	R	90	Very high	84.2	Confident	60 Å²	60	65.8 Å²	65.8	23%	0.226	35%	0.345	C	S	.	.	H	α-helix	trans	-68.9	-42.3	-179.9	-74.9	171	176.3	163.5	4.6	111.7	Q162 L165 D167 M199 Q200 A201 H205 T206 S207	Q162-R203 PolarHBondContact O-NH2 2.9Å; L165-R203 PolarHBondContact O-NH1 3.49Å; L165-R203 VanDerWaalsContact O-NH1 3.16Å; L165-R203 PolarHBondContact O-NH2 3.43Å; D167-R203 WeakPolarHBondContact OD1-CD 3.43Å; D167-R203 IonicContact OD1-CZ 3.02Å; D167-R203 IonicContact OD1-NE 3.58Å; D167-R203 IonicContact OD1-NH1 2.74Å; D167-R203 PolarHBondContact OD1-NH1 3.48Å; M199-R203 PolarHBondContact O-N 3.19Å; Q200-R203 PolarHBondContact O-N 2.96Å; A201-R203 PolarHBondContact O-N 3.47Å; R203-H205 VanDerWaalsContact C-N 3.34Å; R203-H205 PolarHBondContact O-N 3.33Å; R203-T206 WeakPolarHBondContact O-CB 3.47Å; R203-T206 PolarHBondContact O-N 2.66Å; R203-S207 PolarHBondContact O-N 2.9Å; R203-S207 PolarHBondContact O-OG 2.88Å
204	Q	87.5	Confident	82	Confident	108 Å²	108	71.6 Å²	71.6	51%	0.505	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-44.5	174.2	-73.3	175.2	-4.3	0	0	112.2	Q200 A201 T206 S207 Q208	Q200-Q204 VanDerWaalsContact O-CG 3.31Å; Q200-Q204 WeakPolarHBondContact O-CG 3.32Å; Q200-Q204 PolarHBondContact O-N 2.81Å; A201-Q204 PolarHBondContact O-N 3.14Å; Q204-T206 VanDerWaalsContact C-N 3.31Å; Q204-T206 PolarHBondContact O-N 3Å; Q204-S207 PolarHBondContact O-N 3.4Å; Q204-Q208 WeakPolarHBondContact O-CG 3.35Å; Q204-Q208 PolarHBondContact O-N 3.36Å
205	H	82.6	Confident	79.8	Confident	105 Å²	105	76.7 Å²	76.7	49%	0.486	40%	0.4	S	S	.	.	H	α-helix	trans	-63.9	-37.4	177.3	-165.6	-88.7	0	0	0	112.1	A201 Q202 R203 K209	A201-H205 WeakPolarHBondContact O-CB 3.32Å; A201-H205 PolarHBondContact O-N 3.26Å; Q202-H205 PolarHBondContact O-N 3.45Å; R203-H205 VanDerWaalsContact C-N 3.34Å; R203-H205 PolarHBondContact O-N 3.33Å; H205-K209 WeakPolarHBondContact O-CB 3.34Å; H205-K209 PolarHBondContact O-N 3.36Å
206	T	79.4	Confident	77.6	Confident	53 Å²	53	81.7 Å²	81.7	33%	0.325	43%	0.433	S	S	.	.	H	α-helix	trans	-66.8	-42.9	175.9	-54	0	0	0	0	111.6	Q202 R203 Q204 K209 N210	Q202-T206 PolarHBondContact O-N 3.41Å; Q202-T206 PolarHBondContact O-OG1 2.92Å; R203-T206 WeakPolarHBondContact O-CB 3.47Å; R203-T206 PolarHBondContact O-N 2.66Å; Q204-T206 VanDerWaalsContact C-N 3.31Å; Q204-T206 PolarHBondContact O-N 3Å; T206-K209 PolarHBondContact O-N 2.92Å; T206-N210 PolarHBondContact O-N 2.9Å
207	S	75.7	Confident	75.5	Confident	84 Å²	84	86.8 Å²	86.8	59%	0.587	46%	0.463	S	S	*	.	H	α-helix	trans	-64.9	-42.3	176.9	-66.9	0	0	0	0	112.7	R203 Q204 N210 G211	R203-S207 PolarHBondContact O-N 2.9Å; R203-S207 PolarHBondContact O-OG 2.88Å; Q204-S207 PolarHBondContact O-N 3.4Å; S207-N210 PolarHBondContact O-N 3.41Å; S207-G211 PolarHBondContact O-N 2.97Å
208	Q	72.9	Confident	73.2	Confident	132 Å²	132	91.6 Å²	91.6	62%	0.617	49%	0.489	S	S	*	.	H	α-helix	trans	-63.8	-43.2	175.9	-76.5	179	-5.6	0	0	112.1	Q204 N210 G211 N212	Q204-Q208 WeakPolarHBondContact O-CG 3.35Å; Q204-Q208 PolarHBondContact O-N 3.36Å; Q208-N210 VanDerWaalsContact C-N 3.35Å; Q208-N210 PolarHBondContact O-N 3.48Å; Q208-G211 PolarHBondContact O-N 2.97Å; Q208-N212 PolarHBondContact O-N 3.29Å
209	K	73.9	Confident	71.2	Confident	132 Å²	132	96.7 Å²	96.7	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-59.3	-46.1	175.6	-169.7	176.4	-178.3	-179.3	0	111.2	H205 T206 G211 N212 L213	H205-K209 WeakPolarHBondContact O-CB 3.34Å; H205-K209 PolarHBondContact O-N 3.36Å; T206-K209 PolarHBondContact O-N 2.92Å; K209-G211 PolarHBondContact O-N 3.37Å; K209-N212 PolarHBondContact O-N 3.39Å; K209-L213 HydrophobicContact CG-CD1 3.89Å; K209-L213 VanDerWaalsContact O-CD1 3.24Å; K209-L213 WeakPolarHBondContact O-CD1 3.3Å; K209-L213 PolarHBondContact O-N 2.91Å
210	N	70.9	Confident	69.3	Low	98 Å²	98	100.6 Å²	100.6	52%	0.524	54%	0.542	S	S	.	.	H	α-helix	trans	-69.9	-30.5	178.9	-71.5	-6.9	0	0	0	113.4	T206 S207 Q208 L213	T206-N210 PolarHBondContact O-N 2.9Å; S207-N210 PolarHBondContact O-N 3.41Å; Q208-N210 VanDerWaalsContact C-N 3.35Å; Q208-N210 PolarHBondContact O-N 3.48Å; N210-L213 PolarHBondContact O-N 2.76Å
211	G	66	Low	67.2	Low	44 Å²	44	101.8 Å²	101.8	45%	0.454	55%	0.551	S	S	.	*	H	α-helix	trans	-66.2	-42.1	173	0	0	0	0	0	112.6	S207 Q208 K209 L213 R214	S207-G211 PolarHBondContact O-N 2.97Å; Q208-G211 PolarHBondContact O-N 2.97Å; K209-G211 PolarHBondContact O-N 3.37Å; G211-L213 VanDerWaalsContact C-N 3.26Å; G211-L213 PolarHBondContact O-N 3.45Å; G211-R214 PolarHBondContact O-N 3.19Å
212	N	59.6	Low	65.2	Low	151 Å²	151	108.2 Å²	108.2	81%	0.807	57%	0.568	S	S	*	*	H	α-helix	trans	-72.7	-17.1	177.2	-74.1	-3.3	0	0	0	113.8	Q208 K209	Q208-N212 PolarHBondContact O-N 3.29Å; K209-N212 PolarHBondContact O-N 3.39Å
213	L	58.5	Low	63.3	Low	124 Å²	124	116.4 Å²	116.4	65%	0.649	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-4.3	178.1	-95.4	130.9	0	0	0	113.8	K209 N210 G211 P215	K209-L213 HydrophobicContact CG-CD1 3.89Å; K209-L213 VanDerWaalsContact O-CD1 3.24Å; K209-L213 WeakPolarHBondContact O-CD1 3.3Å; K209-L213 PolarHBondContact O-N 2.91Å; N210-L213 PolarHBondContact O-N 2.76Å; G211-L213 VanDerWaalsContact C-N 3.26Å; G211-L213 PolarHBondContact O-N 3.45Å; L213-P215 WeakPolarHBondContact O-CD 3.39Å
214	R	48.2	Very low	61.6	Low	207 Å²	207	120.8 Å²	120.8	78%	0.781	63%	0.63	S	S	*	*	S	Bend	trans	-83.3	115.1	167.5	-73.2	-175.9	179.9	-174.8	-0.5	108.3	G211 T216	G211-R214 PolarHBondContact O-N 3.19Å; R214-T216 PolarHBondContact O-N 2.81Å
215	P	50.3	Low	59.9	Low	108 Å²	108	121.8 Å²	121.8	70%	0.701	64%	0.643	S	S	*	*			trans	-61.2	130.3	168.2	26.7	-31	0	0	0	107.5	L213 V217	L213-P215 WeakPolarHBondContact O-CD 3.39Å; P215-V217 VanDerWaalsContact C-N 3.26Å; P215-V217 PolarHBondContact O-N 3.45Å
216	T	52.6	Low	58.3	Low	125 Å²	125	125.8 Å²	125.8	77%	0.767	66%	0.662	S	S	*	*			trans	-59.8	95.8	163	47.9	0	0	0	0	106.6	R214 N218	R214-T216 PolarHBondContact O-N 2.81Å; T216-N218 VanDerWaalsContact C-N 3.26Å; T216-N218 PolarHBondContact O-N 2.84Å
217	V	52.8	Low	56.6	Low	108 Å²	108	135.5 Å²	135.5	66%	0.655	70%	0.704	S	S	*	*			trans	-65.5	100.9	162.8	179.5	0	0	0	0	104.3	P215 D219 Y222	P215-V217 VanDerWaalsContact C-N 3.26Å; P215-V217 PolarHBondContact O-N 3.45Å; V217-D219 PolarHBondContact O-N 3.32Å; V217-Y222 HydrophobicContact CG1-CE2 4.33Å
218	N	48.6	Very low	55.6	Low	102 Å²	102	138.1 Å²	138.1	55%	0.545	71%	0.71	S	S	.	*			trans	-62.8	122.4	173.2	-94.4	-9.2	0	0	0	107.3	T216 S220 D221	T216-N218 VanDerWaalsContact C-N 3.26Å; T216-N218 PolarHBondContact O-N 2.84Å; N218-S220 PolarHBondContact O-N 3.08Å; N218-D221 PolarHBondContact O-N 2.89Å
219	D	54.2	Low	54.7	Low	137 Å²	137	138.4 Å²	138.4	73%	0.733	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	2.7	176.5	-149.8	20.5	0	0	0	112.8	V217	V217-D219 PolarHBondContact O-N 3.32Å
220	S	54.8	Low	53.7	Low	82 Å²	82	138.8 Å²	138.8	57%	0.573	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-21.7	178.3	-39.1	0	0	0	0	113.7	N218	N218-S220 PolarHBondContact O-N 3.08Å
221	D	51.3	Low	52.7	Low	127 Å²	127	141.2 Å²	141.2	68%	0.679	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-84.7	-10.4	-176.2	-77.5	-22.7	0	0	0	113.7	N218 K223	N218-D221 PolarHBondContact O-N 2.89Å; D221-K223 VanDerWaalsContact C-N 3.34Å
222	Y	48.8	Very low	51.8	Low	176 Å²	176	147.3 Å²	147.3	69%	0.69	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-84.5	-3.3	176.4	-68.7	-74.3	0	0	0	114.2	V217	V217-Y222 HydrophobicContact CG1-CE2 4.33Å
223	K	51.6	Low	51.3	Low	182 Å²	182	147 Å²	147	79%	0.791	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-99.5	0.3	-179.7	-88.1	-164.8	174	-169	0	115.9	D221	D221-K223 VanDerWaalsContact C-N 3.34Å
224	L	53.3	Low	50.8	Low	152 Å²	152	148.6 Å²	148.6	80%	0.796	76%	0.755	S	S	*	*	S	Bend	trans	-106.4	15.1	-177.8	-101.3	153.4	0	0	0	114.7
225	V	52.1	Low	51	Low	128 Å²	128	144.2 Å²	144.2	78%	0.776	75%	0.753	S	S	*	*	S	Bend	trans	-120.7	16.1	178	-163.1	0	0	0	0	112.2
226	Q	48.7	Very low	51.1	Low	189 Å²	189	147.2 Å²	147.2	88%	0.883	76%	0.758	S	S	*	*			trans	-135.2	32.4	173.3	-72.6	-151	7	0	0	114.4
227	E	43.9	Very low	50.9	Low	258 Å²	258	149.2 Å²	149.2	100%	1.206	76%	0.757	S	S	*	*			trans	-126.8	0	159.4	-73.8	-172.6	141.4	0	0	110.6

Retrieved 227 of 227 residues in 185.4 ms (Link to these results)

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