A0A077ZLT5_TRITR Loading...

TraN domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLT5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 588 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	39.7	Very low	58.3	Low	246 Å²	246	130.7 Å²	130.7	100%	1.212	71%	0.707	S	S	*	*				0	92	0	-72.4	173.6	173.9	0	0	107.6
2	A	47.2	Very low	59.8	Low	101 Å²	101	125 Å²	125	84%	0.835	69%	0.69	S	S	*	*			trans	-110.8	93.5	169.6	0	0	0	0	0	105.5	A4	A2-A4 PolarHBondContact O-N 3.33Å; A2-A4 VanDerWaalsContact O-N 3.13Å
3	Q	46.8	Very low	60.9	Low	189 Å²	189	118.6 Å²	118.6	88%	0.883	67%	0.671	S	S	*	*			trans	-66	109.5	170.7	-79.3	174.9	-11	0	0	106.3	D5	Q3-D5 PolarHBondContact O-N 2.88Å
4	A	48.9	Very low	62.1	Low	92 Å²	92	113.1 Å²	113.1	76%	0.76	64%	0.643	S	S	*	*			trans	-61.1	107.5	168	0	0	0	0	0	107.1	A2 S6	A2-A4 PolarHBondContact O-N 3.33Å; A2-A4 VanDerWaalsContact O-N 3.13Å; A4-S6 PolarHBondContact O-N 3.35Å
5	D	52.7	Low	63.3	Low	104 Å²	104	112.7 Å²	112.7	56%	0.556	64%	0.639	S	S	*	*			trans	-73.4	91.8	-178	-173	-1.3	0	0	0	108.8	Q3 N7 S8	Q3-D5 PolarHBondContact O-N 2.88Å; D5-N7 PolarHBondContact O-N 3.13Å; D5-N7 VanDerWaalsContact OD1-CB 3.3Å; D5-N7 WeakPolarHBondContact OD1-CB 3.21Å; D5-N7 PolarHBondContact OD1-N 3.14Å; D5-S8 PolarHBondContact O-N 2.91Å; D5-S8 PolarHBondContact O-OG 2.84Å
6	S	55.3	Low	64.2	Low	93 Å²	93	113.8 Å²	113.8	65%	0.65	64%	0.635	S	S	*	*	H	α-helix	trans	-51.1	-18.8	179.5	64.4	0	0	0	0	114.3	A4 S8 Y10	A4-S6 PolarHBondContact O-N 3.35Å; S6-S8 VanDerWaalsContact C-N 3.35Å; S6-Y10 PolarHBondContact O-N 3.02Å
7	N	63.7	Low	64.7	Low	95 Å²	95	110.3 Å²	110.3	51%	0.508	62%	0.623	S	S	.	*	H	α-helix	trans	-75.9	-26.1	179.8	-143.8	14.9	0	0	0	112.4	D5 R11	D5-N7 PolarHBondContact O-N 3.13Å; D5-N7 VanDerWaalsContact OD1-CB 3.3Å; D5-N7 WeakPolarHBondContact OD1-CB 3.21Å; D5-N7 PolarHBondContact OD1-N 3.14Å; N7-R11 PolarHBondContact O-N 3.14Å
8	S	68.5	Low	65.2	Low	65 Å²	65	111.2 Å²	111.2	46%	0.455	62%	0.621	S	S	.	*	H	α-helix	trans	-73.9	-40.8	176	66	0	0	0	0	111.8	D5 S6 R11 A12	D5-S8 PolarHBondContact O-N 2.91Å; D5-S8 PolarHBondContact O-OG 2.84Å; S6-S8 VanDerWaalsContact C-N 3.35Å; S8-R11 PolarHBondContact O-N 3.02Å; S8-A12 PolarHBondContact O-N 3.41Å
9	D	68.8	Low	65.5	Low	114 Å²	114	112.7 Å²	112.7	61%	0.61	62%	0.623	S	S	*	*	H	α-helix	trans	-66.6	-41.4	178	-68.4	-28	0	0	0	112.2	R11 A12 G13	D9-R11 PolarHBondContact O-N 2.91Å; D9-A12 PolarHBondContact O-N 2.91Å; D9-G13 PolarHBondContact O-N 2.89Å
10	Y	73.9	Confident	65.6	Low	170 Å²	170	110.9 Å²	110.9	67%	0.667	61%	0.611	S	S	*	*	H	α-helix	trans	-62.7	-42.4	176.1	178.3	-95.9	0	0	0	112.2	S6 G13 S14	S6-Y10 PolarHBondContact O-N 3.02Å; Y10-G13 PolarHBondContact O-N 3.49Å; Y10-S14 WeakPolarHBondContact O-CB 3.45Å; Y10-S14 PolarHBondContact O-N 2.84Å
11	R	76	Confident	65.6	Low	169 Å²	169	113.5 Å²	113.5	64%	0.638	62%	0.617	S	S	*	*	H	α-helix	trans	-63.1	-45.9	176.5	-90.7	-179	164.2	151.7	-3.2	111.9	N7 S8 D9 G13 S14 D15	N7-R11 PolarHBondContact O-N 3.14Å; S8-R11 PolarHBondContact O-N 3.02Å; D9-R11 PolarHBondContact O-N 2.91Å; R11-G13 VanDerWaalsContact C-N 3.29Å; R11-G13 PolarHBondContact O-N 2.82Å; R11-S14 PolarHBondContact O-N 3.35Å; R11-D15 WeakPolarHBondContact O-CB 3.5Å; R11-D15 PolarHBondContact O-N 2.87Å
12	A	76	Confident	66.7	Low	62 Å²	62	103.4 Å²	103.4	51%	0.512	58%	0.576	S	S	.	*	H	α-helix	trans	-58.5	-42.2	175.9	0	0	0	0	0	111.8	S8 D9 F16	S8-A12 PolarHBondContact O-N 3.41Å; D9-A12 PolarHBondContact O-N 2.91Å; A12-F16 VanDerWaalsContact O-CB 3.27Å; A12-F16 WeakPolarHBondContact O-CB 3.38Å; A12-F16 PolarHBondContact O-N 3.22Å
13	G	74.2	Confident	67.4	Low	42 Å²	42	103.6 Å²	103.6	43%	0.433	56%	0.559	S	S	.	*	H	α-helix	trans	-65.6	-42.2	176.1	0	0	0	0	0	113.8	D9 Y10 R11 A17	D9-G13 PolarHBondContact O-N 2.89Å; Y10-G13 PolarHBondContact O-N 3.49Å; R11-G13 VanDerWaalsContact C-N 3.29Å; R11-G13 PolarHBondContact O-N 2.82Å; G13-A17 WeakPolarHBondContact O-CB 3.29Å; G13-A17 PolarHBondContact O-N 2.81Å
14	S	77.8	Confident	68.1	Low	41 Å²	41	96.8 Å²	96.8	29%	0.287	54%	0.54	S	S	.	.	H	α-helix	trans	-67	-44.8	177.7	175.1	0	0	0	0	112.3	Y10 R11 F16 A17 H18	Y10-S14 WeakPolarHBondContact O-CB 3.45Å; Y10-S14 PolarHBondContact O-N 2.84Å; R11-S14 PolarHBondContact O-N 3.35Å; S14-F16 VanDerWaalsContact C-N 3.34Å; S14-A17 PolarHBondContact O-N 3.2Å; S14-H18 PolarHBondContact O-N 3.36Å
15	D	79.6	Confident	68.7	Low	108 Å²	108	95.9 Å²	95.9	58%	0.578	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-41.2	179	-71.3	-17.4	0	0	0	110.6	R11 H18 Q19	R11-D15 WeakPolarHBondContact O-CB 3.5Å; R11-D15 PolarHBondContact O-N 2.87Å; D15-H18 PolarHBondContact O-N 2.96Å; D15-Q19 WeakPolarHBondContact O-CB 3.26Å; D15-Q19 PolarHBondContact O-N 3.21Å
16	F	77.8	Confident	69.1	Low	130 Å²	130	94.4 Å²	94.4	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-58.6	-52.1	171.2	-177.5	-111.5	0	0	0	110.8	A12 S14 H18 Q19 I20	A12-F16 VanDerWaalsContact O-CB 3.27Å; A12-F16 WeakPolarHBondContact O-CB 3.38Å; A12-F16 PolarHBondContact O-N 3.22Å; S14-F16 VanDerWaalsContact C-N 3.34Å; F16-H18 VanDerWaalsContact C-N 3.27Å; F16-H18 PolarHBondContact O-N 3.45Å; F16-Q19 WeakPolarHBondContact O-CA 3.46Å; F16-Q19 WeakPolarHBondContact O-CB 3.41Å; F16-Q19 PolarHBondContact O-N 2.88Å; F16-I20 HydrophobicContact CD1-CD1 3.56Å; F16-I20 HydrophobicContact CD1-CG1 4.24Å; F16-I20 HydrophobicContact CE1-CD1 3.23Å; F16-I20 HydrophobicContact CE1-CG1 4.18Å; F16-I20 HydrophobicContact CE2-CD1 4.34Å; F16-I20 HydrophobicContact CG-CD1 4.26Å; F16-I20 HydrophobicContact CG-CG1 4.47Å; F16-I20 HydrophobicContact CZ-CD1 3.67Å; F16-I20 HydrophobicContact CZ-CG1 4.33Å; F16-I20 WeakPolarHBondContact O-CG1 3.2Å; F16-I20 PolarHBondContact O-N 2.95Å
17	A	73.2	Confident	69.4	Low	54 Å²	54	94.4 Å²	94.4	45%	0.446	53%	0.526	S	S	.	.	H	α-helix	trans	-56.3	-39.9	178.5	0	0	0	0	0	112.7	G13 S14 K21	G13-A17 WeakPolarHBondContact O-CB 3.29Å; G13-A17 PolarHBondContact O-N 2.81Å; S14-A17 PolarHBondContact O-N 3.2Å; A17-K21 WeakPolarHBondContact O-CB 3.4Å; A17-K21 PolarHBondContact O-N 2.98Å
18	H	74	Confident	69.3	Low	126 Å²	126	95.6 Å²	95.6	58%	0.583	53%	0.531	S	S	*	.	H	α-helix	trans	-66.9	-35.7	174.5	-100.1	-70.3	0	0	0	113.1	S14 D15 F16 K21	S14-H18 PolarHBondContact O-N 3.36Å; D15-H18 PolarHBondContact O-N 2.96Å; F16-H18 VanDerWaalsContact C-N 3.27Å; F16-H18 PolarHBondContact O-N 3.45Å; H18-K21 PolarHBondContact O-N 2.92Å
19	Q	70.3	Confident	69.2	Low	141 Å²	141	101 Å²	101	66%	0.659	55%	0.549	S	S	*	.	H	α-helix	trans	-68.3	-37	178.2	-134	177	10.3	0	0	112.6	D15 F16 Q23	D15-Q19 WeakPolarHBondContact O-CB 3.26Å; D15-Q19 PolarHBondContact O-N 3.21Å; F16-Q19 WeakPolarHBondContact O-CA 3.46Å; F16-Q19 WeakPolarHBondContact O-CB 3.41Å; F16-Q19 PolarHBondContact O-N 2.88Å; Q19-Q23 PolarHBondContact O-NE2 2.82Å
20	I	68.3	Low	69.1	Low	75 Å²	75	98.6 Å²	98.6	39%	0.385	55%	0.552	S	S	.	*	H	α-helix	trans	-83.2	-18.7	176.5	10.3	171.1	0	0	0	112.8	F16 G22 Q23	F16-I20 HydrophobicContact CD1-CD1 3.56Å; F16-I20 HydrophobicContact CD1-CG1 4.24Å; F16-I20 HydrophobicContact CE1-CD1 3.23Å; F16-I20 HydrophobicContact CE1-CG1 4.18Å; F16-I20 HydrophobicContact CE2-CD1 4.34Å; F16-I20 HydrophobicContact CG-CD1 4.26Å; F16-I20 HydrophobicContact CG-CG1 4.47Å; F16-I20 HydrophobicContact CZ-CD1 3.67Å; F16-I20 HydrophobicContact CZ-CG1 4.33Å; F16-I20 WeakPolarHBondContact O-CG1 3.2Å; F16-I20 PolarHBondContact O-N 2.95Å; I20-G22 PolarHBondContact O-N 3.13Å; I20-Q23 PolarHBondContact O-N 2.74Å; I20-Q23 VanDerWaalsContact O-N 3.08Å
21	K	64.8	Low	69.2	Low	166 Å²	166	95.5 Å²	95.5	72%	0.722	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	99.5	177.8	-169.5	178	-176.3	178.9	0	110	A17 H18	A17-K21 WeakPolarHBondContact O-CB 3.4Å; A17-K21 PolarHBondContact O-N 2.98Å; H18-K21 PolarHBondContact O-N 2.92Å
22	G	61.8	Low	69.2	Low	34 Å²	34	92.7 Å²	92.7	35%	0.351	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.8	-20	178.1	0	0	0	0	0	114.4	I20 G24 S25 S26	I20-G22 PolarHBondContact O-N 3.13Å; G22-G24 VanDerWaalsContact C-N 3.34Å; G22-G24 PolarHBondContact O-N 3.28Å; G22-S25 WeakPolarHBondContact CA-OG 3.37Å; G22-S25 PolarHBondContact O-N 2.83Å; G22-S25 PolarHBondContact O-OG 2.92Å; G22-S26 PolarHBondContact O-N 3.33Å; G22-S26 PolarHBondContact O-OG 3.23Å; G22-S26 VanDerWaalsContact O-OG 3.14Å
23	Q	63.9	Low	69.3	Low	105 Å²	105	91.2 Å²	91.2	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-37.8	179.3	-72	-171.4	-3.2	0	0	112.5	Q19 I20 S26 S27	Q19-Q23 PolarHBondContact O-NE2 2.82Å; I20-Q23 PolarHBondContact O-N 2.74Å; I20-Q23 VanDerWaalsContact O-N 3.08Å; Q23-S26 PolarHBondContact O-OG 2.95Å; Q23-S26 VanDerWaalsContact O-OG 3.08Å; Q23-S27 WeakPolarHBondContact O-CB 3.42Å; Q23-S27 PolarHBondContact O-N 3.14Å; Q23-S27 PolarHBondContact O-OG 2.83Å
24	G	61.1	Low	69.4	Low	46 Å²	46	95.1 Å²	95.1	47%	0.474	53%	0.526	S	S	.	.	H	α-helix	trans	-64.6	-44.7	176.3	0	0	0	0	0	112.4	G22 S27 I28	G22-G24 VanDerWaalsContact C-N 3.34Å; G22-G24 PolarHBondContact O-N 3.28Å; G24-S27 PolarHBondContact O-N 2.84Å; G24-I28 WeakPolarHBondContact O-CG1 3.4Å; G24-I28 PolarHBondContact O-N 2.88Å
25	S	60.3	Low	69.6	Low	73 Å²	73	99.8 Å²	99.8	51%	0.51	54%	0.544	S	S	.	.	H	α-helix	trans	-67.9	-38.4	180	34.2	0	0	0	0	113.5	G22 S27 I28 Q29	G22-S25 WeakPolarHBondContact CA-OG 3.37Å; G22-S25 PolarHBondContact O-N 2.83Å; G22-S25 PolarHBondContact O-OG 2.92Å; S25-S27 VanDerWaalsContact C-N 3.33Å; S25-I28 PolarHBondContact O-N 3.18Å; S25-Q29 PolarHBondContact O-N 2.9Å
26	S	61.3	Low	69.6	Low	74 Å²	74	98 Å²	98	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-69.7	-31.7	177.6	54.3	0	0	0	0	112.5	G22 Q23 I28	G22-S26 PolarHBondContact O-N 3.33Å; G22-S26 PolarHBondContact O-OG 3.23Å; G22-S26 VanDerWaalsContact O-OG 3.14Å; Q23-S26 PolarHBondContact O-OG 2.95Å; Q23-S26 VanDerWaalsContact O-OG 3.08Å; S26-I28 VanDerWaalsContact C-N 3.27Å; S26-I28 PolarHBondContact O-N 2.98Å
27	S	62.6	Low	69.7	Low	92 Å²	92	95.6 Å²	95.6	64%	0.643	53%	0.531	S	S	*	.	H	α-helix	trans	-66.2	-28.5	176.5	-56.4	0	0	0	0	113	Q23 G24 S25	Q23-S27 WeakPolarHBondContact O-CB 3.42Å; Q23-S27 PolarHBondContact O-N 3.14Å; Q23-S27 PolarHBondContact O-OG 2.83Å; G24-S27 PolarHBondContact O-N 2.84Å; S25-S27 VanDerWaalsContact C-N 3.33Å
28	I	61.9	Low	69.9	Low	121 Å²	121	99.1 Å²	99.1	62%	0.621	55%	0.55	S	S	*	*	H	α-helix	trans	-92.6	-24.9	-175.2	-60.3	169	0	0	0	112.2	G24 S25 S26 G30 F31	G24-I28 WeakPolarHBondContact O-CG1 3.4Å; G24-I28 PolarHBondContact O-N 2.88Å; S25-I28 PolarHBondContact O-N 3.18Å; S26-I28 VanDerWaalsContact C-N 3.27Å; S26-I28 PolarHBondContact O-N 2.98Å; I28-G30 PolarHBondContact O-N 2.9Å; I28-F31 WeakPolarHBondContact O-CB 3.15Å; I28-F31 PolarHBondContact O-N 3.34Å
29	Q	66	Low	70.1	Confident	177 Å²	177	97 Å²	97	83%	0.827	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-21.2	-177.4	-86.7	-176.3	-12.7	0	0	114.5	S25	S25-Q29 PolarHBondContact O-N 2.9Å
30	G	67	Low	70.5	Confident	65 Å²	65	94.8 Å²	94.8	67%	0.67	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	3.5	176.2	0	0	0	0	0	115.1	I28 K32	I28-G30 PolarHBondContact O-N 2.9Å; G30-K32 PolarHBondContact O-N 2.92Å; G30-K32 VanDerWaalsContact O-N 3.16Å
31	F	75.6	Confident	71.2	Confident	104 Å²	104	95.7 Å²	95.7	46%	0.456	55%	0.554	S	S	.	*			trans	-71.4	112.7	-174.6	-176.1	-105.1	0	0	0	110.8	I28 P33 I37	I28-F31 WeakPolarHBondContact O-CB 3.15Å; I28-F31 PolarHBondContact O-N 3.34Å; F31-P33 HydrophobicContact CD1-CG 4.04Å; F31-P33 HydrophobicContact CE1-CB 4.05Å; F31-P33 HydrophobicContact CE1-CG 3.83Å; F31-P33 WeakPolarHBondContact O-CD 3.37Å; F31-I37 HydrophobicContact CE1-CD1 4.06Å; F31-I37 HydrophobicContact CZ-CD1 3.82Å; F31-I37 HydrophobicContact CZ-CG1 3.83Å
32	K	76.7	Confident	71.8	Confident	111 Å²	111	90.5 Å²	90.5	48%	0.483	54%	0.542	S	S	.	.			trans	-101.8	105.3	171	-69	174.6	177	173.5	0	109	G30 Q34 E35 S36	G30-K32 PolarHBondContact O-N 2.92Å; G30-K32 VanDerWaalsContact O-N 3.16Å; K32-Q34 PolarHBondContact O-N 2.89Å; K32-Q34 VanDerWaalsContact O-N 3.14Å; K32-E35 HydrophobicContact CB-CB 4.32Å; K32-E35 HydrophobicContact CB-CG 4.19Å; K32-E35 VanDerWaalsContact CD-CD 3.41Å; K32-E35 HydrophobicContact CD-CG 4.32Å; K32-E35 WeakPolarHBondContact CD-OE1 3.21Å; K32-E35 IonicContact NZ-OE1 2.85Å; K32-E35 PolarHBondContact NZ-OE1 3.37Å; K32-E35 IonicContact NZ-OE2 2.7Å; K32-E35 PolarHBondContact O-N 2.79Å; K32-S36 PolarHBondContact O-N 2.88Å
33	P	76.9	Confident	72.5	Confident	30 Å²	30	94.6 Å²	94.6	20%	0.195	56%	0.556	C	S	.	*	H	α-helix	trans	-55.3	-36.3	-175.8	-24.6	31.8	0	0	0	113.3	F31 E35 S36 I37 Y40	F31-P33 HydrophobicContact CD1-CG 4.04Å; F31-P33 HydrophobicContact CE1-CB 4.05Å; F31-P33 HydrophobicContact CE1-CG 3.83Å; F31-P33 WeakPolarHBondContact O-CD 3.37Å; P33-E35 PolarHBondContact O-N 3.44Å; P33-S36 PolarHBondContact O-N 2.78Å; P33-I37 HydrophobicContact CB-CD1 4.23Å; P33-I37 WeakPolarHBondContact O-CB 3.11Å; P33-I37 PolarHBondContact O-N 2.66Å; P33-Y40 HydrophobicContact CB-CD1 4.04Å; P33-Y40 HydrophobicContact CB-CD2 3.53Å; P33-Y40 HydrophobicContact CB-CE1 3.92Å; P33-Y40 HydrophobicContact CB-CE2 3.4Å; P33-Y40 VanDerWaalsContact CB-CE2 3.4Å; P33-Y40 HydrophobicContact CB-CG 3.84Å; P33-Y40 HydrophobicContact CG-CE2 4.14Å
34	Q	77.2	Confident	73.2	Confident	125 Å²	125	91.8 Å²	91.8	58%	0.584	55%	0.547	S	S	*	.	H	α-helix	trans	-60.7	-29.4	179.5	-60.1	80.2	-0.8	0	0	112.9	K32 Y40	K32-Q34 PolarHBondContact O-N 2.89Å; K32-Q34 VanDerWaalsContact O-N 3.14Å; Q34-Y40 HydrophobicContact CB-CD1 4.37Å; Q34-Y40 HydrophobicContact CG-CD1 3.75Å; Q34-Y40 HydrophobicContact CG-CE1 3.84Å
35	E	81	Confident	73.9	Confident	139 Å²	139	96.1 Å²	96.1	65%	0.65	56%	0.559	S	S	*	*	H	α-helix	trans	-92.5	-20.6	-178.3	-64.3	176.7	-167.2	0	0	112.1	K32 P33	K32-E35 HydrophobicContact CB-CB 4.32Å; K32-E35 HydrophobicContact CB-CG 4.19Å; K32-E35 VanDerWaalsContact CD-CD 3.41Å; K32-E35 HydrophobicContact CD-CG 4.32Å; K32-E35 WeakPolarHBondContact CD-OE1 3.21Å; K32-E35 IonicContact NZ-OE1 2.85Å; K32-E35 PolarHBondContact NZ-OE1 3.37Å; K32-E35 IonicContact NZ-OE2 2.7Å; K32-E35 PolarHBondContact O-N 2.79Å; P33-E35 PolarHBondContact O-N 3.44Å
36	S	80.8	Confident	74.6	Confident	70 Å²	70	98.5 Å²	98.5	49%	0.49	56%	0.563	S	S	.	*	H	α-helix	trans	-115.9	-21.5	-169.1	-59.2	0	0	0	0	115.1	K32 P33	K32-S36 PolarHBondContact O-N 2.88Å; P33-S36 PolarHBondContact O-N 2.78Å
37	I	79.1	Confident	75.2	Confident	79 Å²	79	98.3 Å²	98.3	41%	0.405	56%	0.558	S	S	.	*	S	Bend	trans	-111.9	106.8	-177.3	-57.9	177.6	0	0	0	108.6	F31 P33 G39 Y40	F31-I37 HydrophobicContact CE1-CD1 4.06Å; F31-I37 HydrophobicContact CZ-CD1 3.82Å; F31-I37 HydrophobicContact CZ-CG1 3.83Å; P33-I37 HydrophobicContact CB-CD1 4.23Å; P33-I37 WeakPolarHBondContact O-CB 3.11Å; P33-I37 PolarHBondContact O-N 2.66Å; I37-G39 PolarHBondContact O-N 3.27Å; I37-Y40 HydrophobicContact CD1-CD2 4.48Å; I37-Y40 VanDerWaalsContact O-CB 3.26Å; I37-Y40 WeakPolarHBondContact O-CB 3.26Å; I37-Y40 PolarHBondContact O-N 3.24Å
38	P	77.3	Confident	75.7	Confident	129 Å²	129	99.8 Å²	99.8	84%	0.838	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	130.3	174.4	-24.1	33.6	0	0	0	111	Y40	P38-Y40 VanDerWaalsContact C-N 3.28Å; P38-Y40 PolarHBondContact O-N 3.06Å
39	G	77.5	Confident	76.3	Confident	82 Å²	82	98.2 Å²	98.2	85%	0.845	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	11.8	-178.8	0	0	0	0	0	114.7	I37 N41	I37-G39 PolarHBondContact O-N 3.27Å; G39-N41 PolarHBondContact O-N 2.89Å
40	Y	80	Confident	76.3	Confident	94 Å²	94	97.8 Å²	97.8	37%	0.369	53%	0.532	S	S	.	.			trans	-58.2	116.8	174.2	178.3	-93.3	0	0	0	111	P33 Q34 I37 P38 A42	P33-Y40 HydrophobicContact CB-CD1 4.04Å; P33-Y40 HydrophobicContact CB-CD2 3.53Å; P33-Y40 HydrophobicContact CB-CE1 3.92Å; P33-Y40 HydrophobicContact CB-CE2 3.4Å; P33-Y40 VanDerWaalsContact CB-CE2 3.4Å; P33-Y40 HydrophobicContact CB-CG 3.84Å; P33-Y40 HydrophobicContact CG-CE2 4.14Å; Q34-Y40 HydrophobicContact CB-CD1 4.37Å; Q34-Y40 HydrophobicContact CG-CD1 3.75Å; Q34-Y40 HydrophobicContact CG-CE1 3.84Å; I37-Y40 HydrophobicContact CD1-CD2 4.48Å; I37-Y40 VanDerWaalsContact O-CB 3.26Å; I37-Y40 WeakPolarHBondContact O-CB 3.26Å; I37-Y40 PolarHBondContact O-N 3.24Å; P38-Y40 VanDerWaalsContact C-N 3.28Å; P38-Y40 PolarHBondContact O-N 3.06Å; Y40-A42 HydrophobicContact CE1-CB 4.03Å
41	N	81.7	Confident	76.1	Confident	93 Å²	93	97.2 Å²	97.2	50%	0.497	53%	0.526	S	S	.	.			trans	-116.1	126	167.9	-178.1	-0.1	0	0	0	107.1	G39 N43 P44	G39-N41 PolarHBondContact O-N 2.89Å; N41-N43 PolarHBondContact ND2-O 3.43Å; N41-N43 PolarHBondContact O-N 3.38Å; N41-N43 PolarHBondContact OD1-N 3.45Å; N41-N43 PolarHBondContact OD1-O 3.1Å; N41-P44 WeakPolarHBondContact O-CD 3.34Å
42	A	78.1	Confident	75.6	Confident	57 Å²	57	93.6 Å²	93.6	47%	0.471	52%	0.518	S	S	.	.	S	Bend	trans	-69.4	-23.3	176.1	0	0	0	0	0	112.2	Y40	Y40-A42 HydrophobicContact CE1-CB 4.03Å
43	N	76.6	Confident	74.9	Confident	121 Å²	121	95.1 Å²	95.1	65%	0.647	54%	0.536	S	S	*	.	S	Bend	trans	-130.9	69.1	-177.8	-62.3	-32.4	0	0	0	110.6	N41	N41-N43 PolarHBondContact ND2-O 3.43Å; N41-N43 PolarHBondContact O-N 3.38Å; N41-N43 PolarHBondContact OD1-N 3.45Å; N41-N43 PolarHBondContact OD1-O 3.1Å
44	P	78.6	Confident	74.1	Confident	46 Å²	46	100 Å²	100	30%	0.299	57%	0.566	S	S	.	*			trans	-63.7	149.1	172.7	28	-32.8	0	0	0	110.3	N41 E46 T47	N41-P44 WeakPolarHBondContact O-CD 3.34Å; P44-E46 WeakPolarHBondContact CB-OE2 3.38Å; P44-E46 PolarHBondContact O-N 3.16Å; P44-E46 VanDerWaalsContact O-N 3.07Å; P44-T47 HydrophobicContact CG-CG2 3.98Å; P44-T47 VanDerWaalsContact O-CB 3.32Å; P44-T47 WeakPolarHBondContact O-CB 3.45Å; P44-T47 VanDerWaalsContact O-CG2 3.31Å; P44-T47 WeakPolarHBondContact O-CG2 3.35Å; P44-T47 PolarHBondContact O-N 3.19Å; P44-T47 PolarHBondContact O-OG1 3.19Å
45	D	75.8	Confident	73.3	Confident	137 Å²	137	96.4 Å²	96.4	73%	0.733	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-58.6	-26.4	-177.5	-72.3	-23.2	0	0	0	111.8	T47 K48	D45-T47 PolarHBondContact O-N 3.21Å; D45-K48 WeakPolarHBondContact O-CG 3.48Å; D45-K48 PolarHBondContact O-N 2.93Å
46	E	75	Confident	72	Confident	123 Å²	123	94.3 Å²	94.3	58%	0.575	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-65.8	-11.7	175.4	-62	81	179.8	0	0	113.6	P44 K48 Y49	P44-E46 WeakPolarHBondContact CB-OE2 3.38Å; P44-E46 PolarHBondContact O-N 3.16Å; P44-E46 VanDerWaalsContact O-N 3.07Å; E46-K48 PolarHBondContact O-N 3.35Å; E46-K48 VanDerWaalsContact O-N 3.15Å; E46-Y49 HydrophobicContact CB-CD2 4.1Å; E46-Y49 HydrophobicContact CG-CD2 4.4Å; E46-Y49 HydrophobicContact CG-CE2 4.48Å; E46-Y49 WeakPolarHBondContact O-CB 3.29Å; E46-Y49 PolarHBondContact O-N 2.89Å
47	T	73.5	Confident	70.9	Confident	70 Å²	70	93.3 Å²	93.3	43%	0.429	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-55.7	-28.9	172.6	46.1	0	0	0	0	112.4	P44 D45 Y49 Y50	P44-T47 HydrophobicContact CG-CG2 3.98Å; P44-T47 VanDerWaalsContact O-CB 3.32Å; P44-T47 WeakPolarHBondContact O-CB 3.45Å; P44-T47 VanDerWaalsContact O-CG2 3.31Å; P44-T47 WeakPolarHBondContact O-CG2 3.35Å; P44-T47 PolarHBondContact O-N 3.19Å; P44-T47 PolarHBondContact O-OG1 3.19Å; D45-T47 PolarHBondContact O-N 3.21Å; T47-Y49 PolarHBondContact O-N 3.36Å; T47-Y50 PolarHBondContact O-N 2.82Å
48	K	74.1	Confident	70	Confident	122 Å²	122	93.1 Å²	93.1	53%	0.53	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-61.9	-21.6	174.4	73.5	-177.4	166.9	152.7	0	114	D45 E46 D64	D45-K48 WeakPolarHBondContact O-CG 3.48Å; D45-K48 PolarHBondContact O-N 2.93Å; E46-K48 PolarHBondContact O-N 3.35Å; E46-K48 VanDerWaalsContact O-N 3.15Å; K48-D64 IonicContact NZ-OD2 3.78Å; K48-D64 PolarHBondContact NZ-OD2 2.83Å
49	Y	72.9	Confident	69.2	Low	89 Å²	89	88.6 Å²	88.6	35%	0.349	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-90.4	-16.4	176.7	-53.6	-53.1	0	0	0	112.8	E46 T47 L61 D64	E46-Y49 HydrophobicContact CB-CD2 4.1Å; E46-Y49 HydrophobicContact CG-CD2 4.4Å; E46-Y49 HydrophobicContact CG-CE2 4.48Å; E46-Y49 WeakPolarHBondContact O-CB 3.29Å; E46-Y49 PolarHBondContact O-N 2.89Å; T47-Y49 PolarHBondContact O-N 3.36Å; Y49-L61 HydrophobicContact CD1-CB 4.01Å; Y49-L61 HydrophobicContact CD1-CD1 4.25Å; Y49-L61 HydrophobicContact CE1-CB 4.38Å; Y49-L61 HydrophobicContact CE1-CD1 4.18Å; Y49-D64 HydrophobicContact CE1-CB 4.41Å; Y49-D64 VanDerWaalsContact CE1-OD2 3.26Å; Y49-D64 WeakPolarHBondContact CE1-OD2 3.31Å; Y49-D64 PolarHBondContact OH-OD2 2.8Å
50	Y	67	Low	68.9	Low	167 Å²	167	85.9 Å²	85.9	66%	0.655	52%	0.523	S	S	*	.			trans	-104.2	96.5	-178.8	-175.6	-102.2	0	0	0	110.4	T47 G52	T47-Y50 PolarHBondContact O-N 2.82Å; Y50-G52 VanDerWaalsContact C-N 3.26Å; Y50-G52 PolarHBondContact O-N 3.25Å
51	G	63.4	Low	68.6	Low	54 Å²	54	86.3 Å²	86.3	56%	0.557	53%	0.531	S	S	*	.			trans	-82.7	6.8	176.5	0	0	0	0	0	114.9	A55	G51-A55 WeakPolarHBondContact O-CB 3.24Å
52	G	63.7	Low	68	Low	27 Å²	27	87.6 Å²	87.6	28%	0.278	53%	0.532	S	S	.	.			trans	82.6	175.4	-173.4	0	0	0	0	0	113.9	Y50 T54 A55	Y50-G52 VanDerWaalsContact C-N 3.26Å; Y50-G52 PolarHBondContact O-N 3.25Å; G52-T54 PolarHBondContact O-N 3.03Å; G52-T54 VanDerWaalsContact O-N 3.08Å; G52-A55 PolarHBondContact O-N 3.06Å
53	V	62.5	Low	67.8	Low	143 Å²	143	90 Å²	90	87%	0.867	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-12.2	-176.1	-64.1	0	0	0	0	114.3
54	T	60.9	Low	68	Low	133 Å²	133	86.9 Å²	86.9	82%	0.816	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-7.4	179.7	48.8	0	0	0	0	113.8	G52 G56	G52-T54 PolarHBondContact O-N 3.03Å; G52-T54 VanDerWaalsContact O-N 3.08Å; T54-G56 PolarHBondContact O-N 3.45Å
55	A	59.8	Low	67.7	Low	50 Å²	50	86.7 Å²	86.7	41%	0.413	53%	0.527	S	S	.	.			trans	-77.6	111.7	178.7	0	0	0	0	0	111	G51 G52 G57	G51-A55 WeakPolarHBondContact O-CB 3.24Å; G52-A55 PolarHBondContact O-N 3.06Å; A55-G57 PolarHBondContact O-N 2.81Å; A55-G57 VanDerWaalsContact O-N 3.08Å
56	G	54.2	Low	67.3	Low	95 Å²	95	84.6 Å²	84.6	98%	0.979	52%	0.519	S	S	*	.			trans	-76.7	22.9	178.3	0	0	0	0	0	115.2	T54	T54-G56 PolarHBondContact O-N 3.45Å
57	G	57.1	Low	67.4	Low	49 Å²	49	82.4 Å²	82.4	51%	0.505	51%	0.514	S	S	.	.			trans	-157.2	126.1	-172.2	0	0	0	0	0	115.2	A55 G59	A55-G57 PolarHBondContact O-N 2.81Å; A55-G57 VanDerWaalsContact O-N 3.08Å; G57-G59 PolarHBondContact O-N 2.82Å
58	D	60.1	Low	67.6	Low	74 Å²	74	84.5 Å²	84.5	40%	0.396	52%	0.519	S	S	.	.			trans	-78.7	27.7	165.8	58.5	-17.2	0	0	0	112.5	G60 L61 K62	D58-G60 VanDerWaalsContact C-N 3.29Å; D58-G60 PolarHBondContact O-N 2.82Å; D58-L61 PolarHBondContact O-N 2.83Å; D58-K62 VanDerWaalsContact CG-CE 3.49Å; D58-K62 VanDerWaalsContact CG-NZ 3.34Å; D58-K62 PolarHBondContact O-N 2.81Å; D58-K62 WeakPolarHBondContact OD1-CD 3.41Å; D58-K62 VanDerWaalsContact OD1-CE 3.22Å; D58-K62 WeakPolarHBondContact OD1-CE 3.31Å; D58-K62 IonicContact OD1-NZ 2.69Å; D58-K62 PolarHBondContact OD1-NZ 3.08Å; D58-K62 WeakPolarHBondContact OD2-CE 3.11Å; D58-K62 IonicContact OD2-NZ 3.21Å; D58-K62 PolarHBondContact OD2-NZ 2.8Å; D58-K62 VanDerWaalsContact OD2-NZ 3.16Å
59	G	61.1	Low	67.3	Low	34 Å²	34	85.5 Å²	85.5	35%	0.351	52%	0.52	S	S	.	.	H	α-helix	trans	-57.7	-36.7	-167.8	0	0	0	0	0	114.2	G57 N63	G57-G59 PolarHBondContact O-N 2.82Å; G59-N63 WeakPolarHBondContact O-CB 3.31Å; G59-N63 PolarHBondContact O-N 2.89Å; G59-N63 PolarHBondContact O-ND2 2.88Å
60	G	70.9	Confident	67.1	Low	26 Å²	26	84.6 Å²	84.6	27%	0.268	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-44.8	174.8	0	0	0	0	0	112.5	D58 N63 D64	D58-G60 VanDerWaalsContact C-N 3.29Å; D58-G60 PolarHBondContact O-N 2.82Å; G60-N63 PolarHBondContact O-N 2.73Å; G60-D64 WeakPolarHBondContact O-CB 3.45Å; G60-D64 PolarHBondContact O-N 3.28Å
61	L	74.1	Confident	67.4	Low	102 Å²	102	80.5 Å²	80.5	53%	0.534	52%	0.523	S	S	.	.	H	α-helix	trans	-69	-39.8	-179.5	-169.6	69.3	0	0	0	111.3	Y49 D58 G65	Y49-L61 HydrophobicContact CD1-CB 4.01Å; Y49-L61 HydrophobicContact CD1-CD1 4.25Å; Y49-L61 HydrophobicContact CE1-CB 4.38Å; Y49-L61 HydrophobicContact CE1-CD1 4.18Å; D58-L61 PolarHBondContact O-N 2.83Å; L61-G65 PolarHBondContact O-N 2.8Å
62	K	68.4	Low	67.9	Low	120 Å²	120	78.2 Å²	78.2	52%	0.522	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-46.7	174.2	-79.2	177.9	172.7	147	0	111.9	D58 G65 T66	D58-K62 VanDerWaalsContact CG-CE 3.49Å; D58-K62 VanDerWaalsContact CG-NZ 3.34Å; D58-K62 PolarHBondContact O-N 2.81Å; D58-K62 WeakPolarHBondContact OD1-CD 3.41Å; D58-K62 VanDerWaalsContact OD1-CE 3.22Å; D58-K62 WeakPolarHBondContact OD1-CE 3.31Å; D58-K62 IonicContact OD1-NZ 2.69Å; D58-K62 PolarHBondContact OD1-NZ 3.08Å; D58-K62 WeakPolarHBondContact OD2-CE 3.11Å; D58-K62 IonicContact OD2-NZ 3.21Å; D58-K62 PolarHBondContact OD2-NZ 2.8Å; D58-K62 VanDerWaalsContact OD2-NZ 3.16Å; K62-G65 PolarHBondContact O-N 3.03Å; K62-T66 WeakPolarHBondContact O-CB 3.11Å; K62-T66 PolarHBondContact O-N 2.82Å; K62-T66 PolarHBondContact O-OG1 2.96Å
63	N	73.5	Confident	68.4	Low	108 Å²	108	84.7 Å²	84.7	58%	0.578	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-43.9	179.9	-73.9	-13.3	0	0	0	111.8	G59 G60 T66 T67	G59-N63 WeakPolarHBondContact O-CB 3.31Å; G59-N63 PolarHBondContact O-N 2.89Å; G59-N63 PolarHBondContact O-ND2 2.88Å; G60-N63 PolarHBondContact O-N 2.73Å; N63-T66 PolarHBondContact O-N 3.37Å; N63-T67 WeakPolarHBondContact O-CB 3.24Å; N63-T67 PolarHBondContact O-N 2.71Å; N63-T67 PolarHBondContact O-OG1 3.18Å
64	D	80.5	Confident	68.6	Low	56 Å²	56	82.7 Å²	82.7	30%	0.299	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-41.3	178.3	-71.5	-8.7	0	0	0	111	K48 Y49 G60 T66 T67 E68	K48-D64 IonicContact NZ-OD2 3.78Å; K48-D64 PolarHBondContact NZ-OD2 2.83Å; Y49-D64 HydrophobicContact CE1-CB 4.41Å; Y49-D64 VanDerWaalsContact CE1-OD2 3.26Å; Y49-D64 WeakPolarHBondContact CE1-OD2 3.31Å; Y49-D64 PolarHBondContact OH-OD2 2.8Å; G60-D64 WeakPolarHBondContact O-CB 3.45Å; G60-D64 PolarHBondContact O-N 3.28Å; D64-T66 VanDerWaalsContact C-N 3.34Å; D64-T66 PolarHBondContact O-N 2.85Å; D64-T67 PolarHBondContact O-N 3.2Å; D64-E68 WeakPolarHBondContact O-CB 3.45Å; D64-E68 PolarHBondContact O-N 2.98Å
65	G	72.4	Confident	68.5	Low	42 Å²	42	76.5 Å²	76.5	43%	0.433	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-39	173.9	0	0	0	0	0	113	L61 K62 W69	L61-G65 PolarHBondContact O-N 2.8Å; K62-G65 PolarHBondContact O-N 3.03Å; G65-W69 WeakPolarHBondContact O-CB 3.44Å; G65-W69 PolarHBondContact O-N 3.26Å
66	T	69.2	Low	68.6	Low	92 Å²	92	79.4 Å²	79.4	56%	0.564	48%	0.477	S	S	*	.	H	α-helix	trans	-69.1	-38.1	176	-47.5	0	0	0	0	111.1	K62 N63 D64 W69 A70	K62-T66 WeakPolarHBondContact O-CB 3.11Å; K62-T66 PolarHBondContact O-N 2.82Å; K62-T66 PolarHBondContact O-OG1 2.96Å; N63-T66 PolarHBondContact O-N 3.37Å; D64-T66 VanDerWaalsContact C-N 3.34Å; D64-T66 PolarHBondContact O-N 2.85Å; T66-W69 PolarHBondContact O-N 3.37Å; T66-A70 WeakPolarHBondContact O-CB 3.23Å; T66-A70 PolarHBondContact O-N 2.66Å
67	T	77.1	Confident	68.7	Low	77 Å²	77	78.9 Å²	78.9	47%	0.472	46%	0.455	S	S	.	.	H	α-helix	trans	-67	-43.7	176.2	-57.5	0	0	0	0	111.1	N63 D64 A70 T71	N63-T67 WeakPolarHBondContact O-CB 3.24Å; N63-T67 PolarHBondContact O-N 2.71Å; N63-T67 PolarHBondContact O-OG1 3.18Å; D64-T67 PolarHBondContact O-N 3.2Å; T67-A70 PolarHBondContact O-N 2.77Å; T67-T71 WeakPolarHBondContact O-CB 3.47Å; T67-T71 PolarHBondContact O-N 2.81Å; T67-T71 PolarHBondContact O-OG1 2.88Å
68	E	77.7	Confident	68.6	Low	114 Å²	114	80 Å²	80	53%	0.533	45%	0.448	S	S	.	.	H	α-helix	trans	-65.6	-39.4	176.1	-173	58.3	-149.8	0	0	111.2	D64 A70 T71 G72	D64-E68 WeakPolarHBondContact O-CB 3.45Å; D64-E68 PolarHBondContact O-N 2.98Å; E68-A70 VanDerWaalsContact C-N 3.31Å; E68-A70 PolarHBondContact O-N 2.82Å; E68-T71 PolarHBondContact O-N 2.99Å; E68-G72 WeakPolarHBondContact O-CA 3.42Å; E68-G72 PolarHBondContact O-N 3.23Å; E68-G72 VanDerWaalsContact OE1-CA 3.31Å; E68-G72 WeakPolarHBondContact OE1-CA 3.3Å
69	W	66.9	Low	68.5	Low	144 Å²	144	79.6 Å²	79.6	55%	0.545	45%	0.449	S	S	.	.	H	α-helix	trans	-61.3	-39.4	172.2	-174.5	-91.6	0	0	0	112.3	G65 T66 G75 I78	G65-W69 WeakPolarHBondContact O-CB 3.44Å; G65-W69 PolarHBondContact O-N 3.26Å; T66-W69 PolarHBondContact O-N 3.37Å; W69-G75 VanDerWaalsContact O-CA 3.29Å; W69-G75 WeakPolarHBondContact O-CA 3.5Å; W69-I78 HydrophobicContact CH2-CB 4.19Å; W69-I78 HydrophobicContact CH2-CD1 3.48Å; W69-I78 VanDerWaalsContact CH2-CD1 3.48Å; W69-I78 HydrophobicContact CH2-CG1 4.42Å; W69-I78 HydrophobicContact CH2-CG2 3.73Å; W69-I78 HydrophobicContact CZ2-CB 4.39Å; W69-I78 HydrophobicContact CZ2-CD1 4.44Å; W69-I78 HydrophobicContact CZ2-CG2 3.84Å; W69-I78 HydrophobicContact CZ3-CD1 3.54Å
70	A	69.3	Low	68.2	Low	70 Å²	70	83.2 Å²	83.2	58%	0.579	46%	0.457	S	S	*	.	H	α-helix	trans	-78	-32.6	-178.9	0	0	0	0	0	113.6	T66 T67 E68	T66-A70 WeakPolarHBondContact O-CB 3.23Å; T66-A70 PolarHBondContact O-N 2.66Å; T67-A70 PolarHBondContact O-N 2.77Å; E68-A70 VanDerWaalsContact C-N 3.31Å; E68-A70 PolarHBondContact O-N 2.82Å
71	T	72.4	Confident	67.4	Low	80 Å²	80	86 Å²	86	49%	0.491	47%	0.472	S	S	.	.	H	α-helix	trans	-118	-24.4	-168	64.3	0	0	0	0	114.5	T67 E68 K76	T67-T71 WeakPolarHBondContact O-CB 3.47Å; T67-T71 PolarHBondContact O-N 2.81Å; T67-T71 PolarHBondContact O-OG1 2.88Å; E68-T71 PolarHBondContact O-N 2.99Å; T71-K76 VanDerWaalsContact O-CE 3.29Å; T71-K76 WeakPolarHBondContact O-CE 3.48Å; T71-K76 PolarHBondContact O-NZ 2.84Å
72	G	74.6	Confident	66.5	Low	7 Å²	7	88.8 Å²	88.8	7%	0.072	48%	0.48	C	S	.	.	S	Bend	trans	-69.1	158	-180	0	0	0	0	0	113.4	E68 T74 G75 K76	E68-G72 WeakPolarHBondContact O-CA 3.42Å; E68-G72 PolarHBondContact O-N 3.23Å; E68-G72 VanDerWaalsContact OE1-CA 3.31Å; E68-G72 WeakPolarHBondContact OE1-CA 3.3Å; G72-T74 PolarHBondContact O-N 2.92Å; G72-G75 PolarHBondContact O-N 2.87Å; G72-K76 WeakPolarHBondContact O-CG 3.28Å; G72-K76 PolarHBondContact O-N 3.09Å
73	E	73	Confident	65.8	Low	163 Å²	163	89.9 Å²	89.9	76%	0.762	49%	0.489	S	S	*	.	H	α-helix	trans	-66.2	-38.6	-175.8	-165.4	163	-165.9	0	0	112	T77	E73-T77 WeakPolarHBondContact O-CB 3.36Å; E73-T77 PolarHBondContact O-N 3.08Å; E73-T77 PolarHBondContact O-OG1 2.86Å
74	T	66.4	Low	64.8	Low	101 Å²	101	89.8 Å²	89.8	62%	0.62	49%	0.488	S	S	*	.	H	α-helix	trans	-64.1	-47.1	175.6	-52.9	0	0	0	0	112	G72 K76 T77 I78	G72-T74 PolarHBondContact O-N 2.92Å; T74-K76 PolarHBondContact O-N 2.9Å; T74-T77 WeakPolarHBondContact O-CB 3.25Å; T74-T77 PolarHBondContact O-N 3.38Å; T74-I78 HydrophobicContact CG2-CD1 4.16Å; T74-I78 WeakPolarHBondContact O-CG1 3.21Å; T74-I78 PolarHBondContact O-N 2.77Å
75	G	60	Low	63.4	Low	3 Å²	3	90.7 Å²	90.7	3%	0.031	49%	0.49	C	S	.	.	H	α-helix	trans	-64.7	-38.6	179.7	0	0	0	0	0	112.8	W69 G72 I78 T79	W69-G75 VanDerWaalsContact O-CA 3.29Å; W69-G75 WeakPolarHBondContact O-CA 3.5Å; G72-G75 PolarHBondContact O-N 2.87Å; G75-I78 PolarHBondContact O-N 3.07Å; G75-T79 WeakPolarHBondContact O-CB 3.29Å; G75-T79 PolarHBondContact O-N 3.15Å; G75-T79 PolarHBondContact O-OG1 2.72Å
76	K	61.4	Low	62.5	Low	111 Å²	111	91.4 Å²	91.4	48%	0.483	49%	0.486	S	S	.	.	H	α-helix	trans	-60	-47.1	169.4	-75.6	171.8	-179.5	151.8	0	112	T71 G72 T74 I78 T79 E80	T71-K76 VanDerWaalsContact O-CE 3.29Å; T71-K76 WeakPolarHBondContact O-CE 3.48Å; T71-K76 PolarHBondContact O-NZ 2.84Å; G72-K76 WeakPolarHBondContact O-CG 3.28Å; G72-K76 PolarHBondContact O-N 3.09Å; T74-K76 PolarHBondContact O-N 2.9Å; K76-I78 VanDerWaalsContact C-N 3.34Å; K76-I78 PolarHBondContact O-N 2.88Å; K76-T79 PolarHBondContact O-N 3.42Å; K76-E80 WeakPolarHBondContact O-CB 3.31Å; K76-E80 WeakPolarHBondContact O-CG 3.35Å; K76-E80 PolarHBondContact O-N 2.95Å
77	T	55.5	Low	61.8	Low	83 Å²	83	96 Å²	96	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-60	-43.3	179.2	-56.6	0	0	0	0	111.7	E73 T74 S81	E73-T77 WeakPolarHBondContact O-CB 3.36Å; E73-T77 PolarHBondContact O-N 3.08Å; E73-T77 PolarHBondContact O-OG1 2.86Å; T74-T77 WeakPolarHBondContact O-CB 3.25Å; T74-T77 PolarHBondContact O-N 3.38Å; T77-S81 VanDerWaalsContact O-CB 3.26Å; T77-S81 WeakPolarHBondContact O-CB 3.06Å; T77-S81 PolarHBondContact O-N 3.17Å
78	I	56.3	Low	60.9	Low	72 Å²	72	96.4 Å²	96.4	37%	0.369	50%	0.498	S	S	.	.	H	α-helix	trans	-65.7	-43.2	176.4	-65.3	168.7	0	0	0	110.7	W69 T74 G75 K76 S81 F82	W69-I78 HydrophobicContact CH2-CB 4.19Å; W69-I78 HydrophobicContact CH2-CD1 3.48Å; W69-I78 VanDerWaalsContact CH2-CD1 3.48Å; W69-I78 HydrophobicContact CH2-CG1 4.42Å; W69-I78 HydrophobicContact CH2-CG2 3.73Å; W69-I78 HydrophobicContact CZ2-CB 4.39Å; W69-I78 HydrophobicContact CZ2-CD1 4.44Å; W69-I78 HydrophobicContact CZ2-CG2 3.84Å; W69-I78 HydrophobicContact CZ3-CD1 3.54Å; T74-I78 HydrophobicContact CG2-CD1 4.16Å; T74-I78 WeakPolarHBondContact O-CG1 3.21Å; T74-I78 PolarHBondContact O-N 2.77Å; G75-I78 PolarHBondContact O-N 3.07Å; K76-I78 VanDerWaalsContact C-N 3.34Å; K76-I78 PolarHBondContact O-N 2.88Å; I78-S81 WeakPolarHBondContact O-CB 3.34Å; I78-S81 PolarHBondContact O-N 3.03Å; I78-F82 WeakPolarHBondContact O-CB 3.36Å; I78-F82 PolarHBondContact O-N 2.88Å
79	T	57.1	Low	59.8	Low	67 Å²	67	97.4 Å²	97.4	41%	0.411	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-45.4	178.5	-56.7	0	0	0	0	111.3	G75 K76 S81 F82 M83	G75-T79 WeakPolarHBondContact O-CB 3.29Å; G75-T79 PolarHBondContact O-N 3.15Å; G75-T79 PolarHBondContact O-OG1 2.72Å; K76-T79 PolarHBondContact O-N 3.42Å; T79-S81 VanDerWaalsContact C-N 3.33Å; T79-S81 PolarHBondContact O-N 3.25Å; T79-F82 PolarHBondContact O-N 2.95Å; T79-M83 HydrophobicContact CG2-CG 4.26Å; T79-M83 WeakPolarHBondContact O-CB 3.36Å; T79-M83 WeakPolarHBondContact O-CG 3.29Å; T79-M83 PolarHBondContact O-N 2.86Å
80	E	54.7	Low	59.5	Low	110 Å²	110	95.7 Å²	95.7	51%	0.514	51%	0.506	S	S	.	.	H	α-helix	trans	-61.3	-41.9	174.6	-75.4	178.7	175.8	0	0	111.2	K76 F82 M83 N84	K76-E80 WeakPolarHBondContact O-CB 3.31Å; K76-E80 WeakPolarHBondContact O-CG 3.35Å; K76-E80 PolarHBondContact O-N 2.95Å; E80-F82 PolarHBondContact O-N 2.98Å; E80-M83 PolarHBondContact O-N 2.97Å; E80-N84 VanDerWaalsContact O-CB 3.23Å; E80-N84 WeakPolarHBondContact O-CB 3.31Å; E80-N84 VanDerWaalsContact O-CG 3.28Å; E80-N84 PolarHBondContact O-N 2.83Å; E80-N84 PolarHBondContact O-ND2 2.73Å
81	S	54.8	Low	59.3	Low	85 Å²	85	93.3 Å²	93.3	59%	0.594	49%	0.485	S	S	*	.	H	α-helix	trans	-59	-46	173.2	-178.7	0	0	0	0	111.7	T77 I78 T79 K85	T77-S81 VanDerWaalsContact O-CB 3.26Å; T77-S81 WeakPolarHBondContact O-CB 3.06Å; T77-S81 PolarHBondContact O-N 3.17Å; I78-S81 WeakPolarHBondContact O-CB 3.34Å; I78-S81 PolarHBondContact O-N 3.03Å; T79-S81 VanDerWaalsContact C-N 3.33Å; T79-S81 PolarHBondContact O-N 3.25Å; S81-K85 WeakPolarHBondContact O-CB 3.3Å; S81-K85 PolarHBondContact O-N 3.36Å
82	F	54.4	Low	59.1	Low	160 Å²	160	93.5 Å²	93.5	70%	0.702	49%	0.488	S	S	*	.	H	α-helix	trans	-65.5	-41.2	177.7	-170.1	-90.9	0	0	0	112.6	I78 T79 E80 K85	I78-F82 WeakPolarHBondContact O-CB 3.36Å; I78-F82 PolarHBondContact O-N 2.88Å; T79-F82 PolarHBondContact O-N 2.95Å; E80-F82 PolarHBondContact O-N 2.98Å; F82-K85 WeakPolarHBondContact O-CB 3.42Å; F82-K85 PolarHBondContact O-N 2.91Å
83	M	54.5	Low	58.8	Low	142 Å²	142	99.3 Å²	99.3	70%	0.7	52%	0.517	S	S	*	.	H	α-helix	trans	-72	-33.8	-179.4	-69.7	-65.7	-72.1	0	0	112.9	T79 E80	T79-M83 HydrophobicContact CG2-CG 4.26Å; T79-M83 WeakPolarHBondContact O-CB 3.36Å; T79-M83 WeakPolarHBondContact O-CG 3.29Å; T79-M83 PolarHBondContact O-N 2.86Å; E80-M83 PolarHBondContact O-N 2.97Å
84	N	52.3	Low	58.7	Low	106 Å²	106	91.6 Å²	91.6	57%	0.567	48%	0.481	S	S	*	.	H	α-helix	trans	-89.8	-6.2	177.7	-65.1	-30.8	0	0	0	112.8	E80	E80-N84 VanDerWaalsContact O-CB 3.23Å; E80-N84 WeakPolarHBondContact O-CB 3.31Å; E80-N84 VanDerWaalsContact O-CG 3.28Å; E80-N84 PolarHBondContact O-N 2.83Å; E80-N84 PolarHBondContact O-ND2 2.73Å
85	K	51.9	Low	58.9	Low	76 Å²	76	88.3 Å²	88.3	33%	0.33	46%	0.462	S	S	.	.	S	Bend	trans	-58.3	128.3	172	-164.1	-173.2	-179.8	-166.5	0	108.4	S81 F82 K87 D88	S81-K85 WeakPolarHBondContact O-CB 3.3Å; S81-K85 PolarHBondContact O-N 3.36Å; F82-K85 WeakPolarHBondContact O-CB 3.42Å; F82-K85 PolarHBondContact O-N 2.91Å; K85-K87 PolarHBondContact O-N 2.92Å; K85-D88 IonicContact NZ-OD1 3.18Å; K85-D88 IonicContact NZ-OD2 2.78Å; K85-D88 PolarHBondContact NZ-OD2 2.92Å
86	P	53.7	Low	59.4	Low	56 Å²	56	91.9 Å²	91.9	36%	0.364	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-51.4	133.3	167.6	-22.4	31.8	0	0	0	108.9	D88 L137	P86-D88 PolarHBondContact O-N 3.4Å; P86-L137 HydrophobicContact CG-CD2 4.13Å
87	K	54.4	Low	59.9	Low	189 Å²	189	88.9 Å²	88.9	82%	0.822	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-55.8	125.9	179.9	-66.5	-177.5	179	-177.8	0	109	K85 I89	K85-K87 PolarHBondContact O-N 2.92Å; K87-I89 HydrophobicContact CB-CG1 4.28Å; K87-I89 PolarHBondContact O-N 2.9Å
88	D	57	Low	60.7	Low	85 Å²	85	88.5 Å²	88.5	46%	0.455	46%	0.458	S	S	.	.			trans	-69.1	99.4	165.3	-65.6	-35	0	0	0	106.5	K85 P86 L90	K85-D88 IonicContact NZ-OD1 3.18Å; K85-D88 IonicContact NZ-OD2 2.78Å; K85-D88 PolarHBondContact NZ-OD2 2.92Å; P86-D88 PolarHBondContact O-N 3.4Å; D88-L90 PolarHBondContact O-N 3.24Å; D88-L90 VanDerWaalsContact O-N 3.14Å
89	I	56.2	Low	61.3	Low	136 Å²	136	87 Å²	87	70%	0.697	45%	0.452	S	S	*	.			trans	-84	89.9	178.9	-55	170.8	0	0	0	106.6	K87 S91	K87-I89 HydrophobicContact CB-CG1 4.28Å; K87-I89 PolarHBondContact O-N 2.9Å; I89-S91 PolarHBondContact O-N 2.71Å; I89-S91 VanDerWaalsContact O-N 3.15Å
90	L	60.2	Low	61.9	Low	108 Å²	108	85.7 Å²	85.7	57%	0.565	45%	0.452	S	S	*	.			trans	-64.2	109.8	157.4	-76.2	163	0	0	0	106.6	D88 P92 F96 T347	D88-L90 PolarHBondContact O-N 3.24Å; D88-L90 VanDerWaalsContact O-N 3.14Å; L90-P92 WeakPolarHBondContact O-CD 3.31Å; L90-F96 HydrophobicContact CD2-CZ 4.4Å; L90-T347 HydrophobicContact CD2-CG2 3.66Å
91	S	65.5	Low	62.9	Low	19 Å²	19	85.5 Å²	85.5	13%	0.133	45%	0.447	C	S	.	.			trans	-65.9	125.1	177.5	-177	0	0	0	0	109.2	I89 D93 A94 I97 P344	I89-S91 PolarHBondContact O-N 2.71Å; I89-S91 VanDerWaalsContact O-N 3.15Å; S91-D93 PolarHBondContact O-N 2.85Å; S91-D93 VanDerWaalsContact O-N 3.14Å; S91-D93 PolarHBondContact OG-N 3.01Å; S91-A94 WeakPolarHBondContact O-CB 3.47Å; S91-A94 PolarHBondContact O-N 3.31Å; S91-I97 WeakPolarHBondContact O-CD1 3.38Å; S91-P344 WeakPolarHBondContact OG-CB 3.39Å
92	P	67.7	Low	63.7	Low	85 Å²	85	83.3 Å²	83.3	55%	0.552	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.8	170.3	-21	32.8	0	0	0	112.8	L90 A94 R101	L90-P92 WeakPolarHBondContact O-CD 3.31Å; P92-A94 VanDerWaalsContact C-N 3.32Å; P92-R101 PolarHBondContact O-NH2 2.79Å
93	D	68.8	Low	64.5	Low	128 Å²	128	79.2 Å²	79.2	68%	0.684	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	4.2	177.3	-53.9	-39	0	0	0	112.4	S91	S91-D93 PolarHBondContact O-N 2.85Å; S91-D93 VanDerWaalsContact O-N 3.14Å; S91-D93 PolarHBondContact OG-N 3.01Å
94	A	69.7	Low	65.2	Low	1 Å²	1	77.5 Å²	77.5	1%	0.008	41%	0.414	C	S	.	.			trans	-58.8	130.7	177.1	0	0	0	0	0	110.1	S91 P92 F96 I97	S91-A94 WeakPolarHBondContact O-CB 3.47Å; S91-A94 PolarHBondContact O-N 3.31Å; P92-A94 VanDerWaalsContact C-N 3.32Å; A94-F96 VanDerWaalsContact C-N 3.27Å; A94-F96 HydrophobicContact CB-CD1 3.69Å; A94-F96 HydrophobicContact CB-CE1 3.35Å; A94-F96 HydrophobicContact CB-CZ 4.1Å; A94-F96 PolarHBondContact O-N 3.11Å; A94-F96 VanDerWaalsContact O-N 3.16Å; A94-I97 HydrophobicContact CB-CD1 4.21Å; A94-I97 HydrophobicContact CB-CG1 4.28Å; A94-I97 WeakPolarHBondContact O-CB 3.19Å; A94-I97 PolarHBondContact O-N 2.84Å
95	P	71.4	Confident	66.1	Low	33 Å²	33	78.4 Å²	78.4	21%	0.214	42%	0.418	C	S	.	.	H	α-helix	trans	-60.1	-33	-169.5	-20.9	30.1	0	0	0	113.8	I97 Q98 T99 A345 E372	P95-I97 VanDerWaalsContact C-N 3.26Å; P95-I97 PolarHBondContact O-N 2.92Å; P95-Q98 WeakPolarHBondContact O-CA 3.3Å; P95-Q98 VanDerWaalsContact O-CB 3.3Å; P95-Q98 WeakPolarHBondContact O-CB 3.34Å; P95-Q98 PolarHBondContact O-N 2.95Å; P95-T99 PolarHBondContact O-N 2.79Å; P95-T99 PolarHBondContact O-OG1 2.95Å; P95-A345 HydrophobicContact CG-CB 4.06Å; P95-E372 WeakPolarHBondContact CB-OE2 3.37Å
96	F	70.3	Confident	66.9	Low	77 Å²	77	79 Å²	79	34%	0.338	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-30.6	176.3	73.9	-94.7	0	0	0	113.7	L90 A94 Q98 T99 G100 Y128 E372	L90-F96 HydrophobicContact CD2-CZ 4.4Å; A94-F96 VanDerWaalsContact C-N 3.27Å; A94-F96 HydrophobicContact CB-CD1 3.69Å; A94-F96 HydrophobicContact CB-CE1 3.35Å; A94-F96 HydrophobicContact CB-CZ 4.1Å; A94-F96 PolarHBondContact O-N 3.11Å; A94-F96 VanDerWaalsContact O-N 3.16Å; F96-Q98 VanDerWaalsContact C-N 3.31Å; F96-T99 PolarHBondContact O-N 3.29Å; F96-G100 PolarHBondContact O-N 2.87Å; F96-Y128 WeakPolarHBondContact CB-OH 3.34Å; F96-E372 WeakPolarHBondContact CB-OE2 3.06Å; F96-E372 PolarHBondContact N-OE2 2.6Å
97	I	71.9	Confident	67.5	Low	49 Å²	49	78.4 Å²	78.4	25%	0.251	42%	0.418	S	S	.	.	H	α-helix	trans	-68.7	-38.3	174.2	-55.8	179.2	0	0	0	109.3	S91 A94 P95 T99 G100 R101	S91-I97 WeakPolarHBondContact O-CD1 3.38Å; A94-I97 HydrophobicContact CB-CD1 4.21Å; A94-I97 HydrophobicContact CB-CG1 4.28Å; A94-I97 WeakPolarHBondContact O-CB 3.19Å; A94-I97 PolarHBondContact O-N 2.84Å; P95-I97 VanDerWaalsContact C-N 3.26Å; P95-I97 PolarHBondContact O-N 2.92Å; I97-T99 VanDerWaalsContact C-N 3.33Å; I97-T99 PolarHBondContact O-N 3.4Å; I97-G100 PolarHBondContact O-N 3.18Å; I97-R101 VanDerWaalsContact CG2-CZ 3.44Å; I97-R101 PolarHBondContact O-N 2.63Å
98	Q	73	Confident	68	Low	74 Å²	74	76.4 Å²	76.4	35%	0.346	42%	0.416	S	S	.	.	H	α-helix	trans	-64.7	-38.4	176.4	-167.6	57	32.3	0	0	111.5	P95 F96 G100 R101 D102	P95-Q98 WeakPolarHBondContact O-CA 3.3Å; P95-Q98 VanDerWaalsContact O-CB 3.3Å; P95-Q98 WeakPolarHBondContact O-CB 3.34Å; P95-Q98 PolarHBondContact O-N 2.95Å; F96-Q98 VanDerWaalsContact C-N 3.31Å; Q98-G100 VanDerWaalsContact C-N 3.3Å; Q98-G100 PolarHBondContact O-N 2.92Å; Q98-R101 CarbonylContact O-C 3.51Å; Q98-R101 WeakPolarHBondContact O-CA 3.34Å; Q98-R101 WeakPolarHBondContact O-CB 3.42Å; Q98-R101 PolarHBondContact O-N 3.13Å; Q98-R101 VanDerWaalsContact O-N 3.08Å; Q98-D102 PolarHBondContact NE2-OD1 2.93Å; Q98-D102 WeakPolarHBondContact O-CB 3.36Å; Q98-D102 PolarHBondContact O-N 2.02Å
99	T	67.8	Low	68.2	Low	41 Å²	41	75.4 Å²	75.4	25%	0.252	42%	0.416	S	S	.	.	H	α-helix	trans	-57.6	-43.4	173.3	-56.5	0	0	0	0	111.7	P95 F96 I97 R101 D102 V103	P95-T99 PolarHBondContact O-N 2.79Å; P95-T99 PolarHBondContact O-OG1 2.95Å; F96-T99 PolarHBondContact O-N 3.29Å; I97-T99 VanDerWaalsContact C-N 3.33Å; I97-T99 PolarHBondContact O-N 3.4Å; T99-R101 PolarHBondContact O-N 2.71Å; T99-D102 PolarHBondContact O-N 2.92Å; T99-V103 WeakPolarHBondContact O-CG2 3.32Å; T99-V103 PolarHBondContact O-N 3.16Å
100	G	70.1	Confident	68.5	Low	40 Å²	40	74.3 Å²	74.3	41%	0.412	41%	0.411	S	S	.	.	H	α-helix	trans	-60.1	-44	173.8	0	0	0	0	0	112.5	F96 I97 Q98 V103 V104	F96-G100 PolarHBondContact O-N 2.87Å; I97-G100 PolarHBondContact O-N 3.18Å; Q98-G100 VanDerWaalsContact C-N 3.3Å; Q98-G100 PolarHBondContact O-N 2.92Å; G100-V103 PolarHBondContact O-N 3.06Å; G100-V104 WeakPolarHBondContact O-CG2 3.49Å; G100-V104 PolarHBondContact O-N 3.1Å; G100-V104 VanDerWaalsContact O-N 3.09Å
101	R	75.7	Confident	68.7	Low	106 Å²	106	75.3 Å²	75.3	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-64.4	-40.7	175.2	-71.8	-168.7	-93	-102.2	3.2	112.6	P92 I97 Q98 T99 V103 V104 N105	P92-R101 PolarHBondContact O-NH2 2.79Å; I97-R101 VanDerWaalsContact CG2-CZ 3.44Å; I97-R101 PolarHBondContact O-N 2.63Å; Q98-R101 CarbonylContact O-C 3.51Å; Q98-R101 WeakPolarHBondContact O-CA 3.34Å; Q98-R101 WeakPolarHBondContact O-CB 3.42Å; Q98-R101 PolarHBondContact O-N 3.13Å; Q98-R101 VanDerWaalsContact O-N 3.08Å; T99-R101 PolarHBondContact O-N 2.71Å; R101-V103 VanDerWaalsContact C-N 3.32Å; R101-V103 PolarHBondContact O-N 2.04Å; R101-V104 PolarHBondContact O-N 2.67Å; R101-N105 WeakPolarHBondContact O-CB 3.29Å; R101-N105 PolarHBondContact O-N 2.85Å; R101-N105 PolarHBondContact O-ND2 2.9Å
102	D	71.7	Confident	68.1	Low	39 Å²	39	77.1 Å²	77.1	21%	0.209	44%	0.443	C	S	.	.	H	α-helix	trans	-67.9	-32.6	179.7	-65.4	-17.3	0	0	0	111.7	Q98 T99 R106	Q98-D102 PolarHBondContact NE2-OD1 2.93Å; Q98-D102 WeakPolarHBondContact O-CB 3.36Å; Q98-D102 PolarHBondContact O-N 2.02Å; T99-D102 PolarHBondContact O-N 2.92Å; D102-R106 VanDerWaalsContact O-CB 3.3Å; D102-R106 WeakPolarHBondContact O-CB 3.5Å; D102-R106 VanDerWaalsContact O-CG 3.28Å; D102-R106 WeakPolarHBondContact O-CG 3.36Å; D102-R106 PolarHBondContact O-N 2.98Å; D102-R106 VanDerWaalsContact O-N 3.14Å; D102-R106 PolarHBondContact O-NE 2.83Å
103	V	70.2	Confident	67.3	Low	73 Å²	73	79 Å²	79	44%	0.442	45%	0.448	S	S	.	.	H	α-helix	trans	-68.7	-44.7	171.7	171.1	0	0	0	0	110.5	T99 G100 R101 N105 R106 A107 I110	T99-V103 WeakPolarHBondContact O-CG2 3.32Å; T99-V103 PolarHBondContact O-N 3.16Å; G100-V103 PolarHBondContact O-N 3.06Å; R101-V103 VanDerWaalsContact C-N 3.32Å; R101-V103 PolarHBondContact O-N 2.04Å; V103-N105 VanDerWaalsContact C-N 3.34Å; V103-N105 PolarHBondContact O-N 3.37Å; V103-R106 CarbonylContact O-C 3.56Å; V103-R106 PolarHBondContact O-N 3.19Å; V103-A107 PolarHBondContact O-N 3.39Å; V103-I110 HydrophobicContact CG1-CD1 4.21Å
104	V	70.5	Confident	66.5	Low	106 Å²	106	79.9 Å²	79.9	64%	0.642	46%	0.458	S	S	*	.	H	α-helix	trans	-59.1	-45.6	175.5	171.3	0	0	0	0	111.1	G100 R101 R106 A107	G100-V104 WeakPolarHBondContact O-CG2 3.49Å; G100-V104 PolarHBondContact O-N 3.1Å; G100-V104 VanDerWaalsContact O-N 3.09Å; R101-V104 PolarHBondContact O-N 2.67Å; V104-R106 PolarHBondContact O-N 2.62Å; V104-A107 WeakPolarHBondContact O-CB 3.31Å; V104-A107 PolarHBondContact O-N 2.76Å
105	N	71.5	Confident	65.7	Low	125 Å²	125	81.9 Å²	81.9	67%	0.668	48%	0.479	S	S	*	.	H	α-helix	trans	-67.6	-23.4	179.3	-68	-23.2	0	0	0	113.3	R101 V103	R101-N105 WeakPolarHBondContact O-CB 3.29Å; R101-N105 PolarHBondContact O-N 2.85Å; R101-N105 PolarHBondContact O-ND2 2.9Å; V103-N105 VanDerWaalsContact C-N 3.34Å; V103-N105 PolarHBondContact O-N 3.37Å
106	R	67.9	Low	64.9	Low	90 Å²	90	89.2 Å²	89.2	34%	0.34	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	3.1	178	-71.7	-176.6	-74.7	179.6	-8	113.6	D102 V103 V104 D108 S109 I110	D102-R106 VanDerWaalsContact O-CB 3.3Å; D102-R106 WeakPolarHBondContact O-CB 3.5Å; D102-R106 VanDerWaalsContact O-CG 3.28Å; D102-R106 WeakPolarHBondContact O-CG 3.36Å; D102-R106 PolarHBondContact O-N 2.98Å; D102-R106 VanDerWaalsContact O-N 3.14Å; D102-R106 PolarHBondContact O-NE 2.83Å; V103-R106 CarbonylContact O-C 3.56Å; V103-R106 PolarHBondContact O-N 3.19Å; V104-R106 PolarHBondContact O-N 2.62Å; R106-D108 VanDerWaalsContact C-N 3.26Å; R106-D108 PolarHBondContact O-N 2.79Å; R106-S109 PolarHBondContact O-N 3.31Å; R106-S109 PolarHBondContact O-OG 3.09Å; R106-I110 HydrophobicContact CB-CD1 4.34Å; R106-I110 WeakPolarHBondContact O-CG1 3.47Å; R106-I110 PolarHBondContact O-N 2.83Å
107	A	66.7	Low	64.5	Low	43 Å²	43	93.1 Å²	93.1	36%	0.355	53%	0.53	S	S	.	.	H	α-helix	trans	-52.4	-43.7	-174.4	0	0	0	0	0	112.3	V103 V104 S109 I110 V111	V103-A107 PolarHBondContact O-N 3.39Å; V104-A107 WeakPolarHBondContact O-CB 3.31Å; V104-A107 PolarHBondContact O-N 2.76Å; A107-S109 VanDerWaalsContact C-N 3.31Å; A107-S109 PolarHBondContact O-N 3.1Å; A107-I110 PolarHBondContact O-N 3.3Å; A107-V111 WeakPolarHBondContact O-CG2 3.46Å; A107-V111 PolarHBondContact O-N 3.19Å; A107-V111 VanDerWaalsContact O-N 3.11Å
108	D	63.6	Low	64.3	Low	146 Å²	146	94 Å²	94	78%	0.781	54%	0.539	S	S	*	.	H	α-helix	trans	-60.6	-38.6	178.1	-66	-24.7	0	0	0	112.8	R106 G112	R106-D108 VanDerWaalsContact C-N 3.26Å; R106-D108 PolarHBondContact O-N 2.79Å; D108-G112 WeakPolarHBondContact O-CA 3.45Å; D108-G112 PolarHBondContact O-N 2.91Å
109	S	62.9	Low	64	Low	64 Å²	64	92.9 Å²	92.9	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-73.2	-31.4	178.4	70.5	0	0	0	0	113	R106 A107	R106-S109 PolarHBondContact O-N 3.31Å; R106-S109 PolarHBondContact O-OG 3.09Å; A107-S109 VanDerWaalsContact C-N 3.31Å; A107-S109 PolarHBondContact O-N 3.1Å
110	I	62.4	Low	64.1	Low	114 Å²	114	94.4 Å²	94.4	59%	0.585	56%	0.557	S	S	*	*	H	α-helix	trans	-69.8	-38.7	178.3	-65.2	168.4	0	0	0	110.4	V103 R106 A107	V103-I110 HydrophobicContact CG1-CD1 4.21Å; R106-I110 HydrophobicContact CB-CD1 4.34Å; R106-I110 WeakPolarHBondContact O-CG1 3.47Å; R106-I110 PolarHBondContact O-N 2.83Å; A107-I110 PolarHBondContact O-N 3.3Å
111	V	63.1	Low	64.1	Low	129 Å²	129	96.2 Å²	96.2	78%	0.782	55%	0.554	S	S	*	*	H	α-helix	trans	-93.2	-27.9	-176.6	-165	0	0	0	0	112.3	A107	A107-V111 WeakPolarHBondContact O-CG2 3.46Å; A107-V111 PolarHBondContact O-N 3.19Å; A107-V111 VanDerWaalsContact O-N 3.11Å
112	G	54.4	Low	64	Low	57 Å²	57	97 Å²	97	59%	0.588	56%	0.563	S	S	*	*	H	α-helix	trans	-106.6	-11.3	-162	0	0	0	0	0	118	D108	D108-G112 WeakPolarHBondContact O-CA 3.45Å; D108-G112 PolarHBondContact O-N 2.91Å
113	N	50.4	Low	63.9	Low	123 Å²	123	97.5 Å²	97.5	66%	0.658	56%	0.564	S	S	*	*			trans	-120.1	86.6	-169.1	-141.9	2.7	0	0	0	113.4
114	T	52.5	Low	64	Low	147 Å²	147	95.9 Å²	95.9	90%	0.902	56%	0.556	S	S	*	*			trans	-95.6	12.7	175	42.7	0	0	0	0	113.6
115	G	52.8	Low	64	Low	43 Å²	43	95.9 Å²	95.9	44%	0.443	55%	0.545	S	S	.	.	S	Bend	trans	-70.1	146.2	178	0	0	0	0	0	113.2	Q117	G115-Q117 PolarHBondContact O-N 2.86Å
116	Q	53.9	Low	64.3	Low	188 Å²	188	91.6 Å²	91.6	88%	0.879	53%	0.525	S	S	*	.	S	Bend	trans	-63	9.4	174.4	-85.8	179.6	-29.9	0	0	115	C118	Q116-C118 PolarHBondContact O-N 2.87Å
117	Q	61.8	Low	64.7	Low	159 Å²	159	89.2 Å²	89.2	74%	0.743	52%	0.518	S	S	*	.			trans	-77.1	118.5	179.4	-81.4	169.7	-55	0	0	110.2	G115 S119	G115-Q117 PolarHBondContact O-N 2.86Å; Q117-S119 PolarHBondContact O-N 3.43Å
118	C	66.7	Low	65.4	Low	67 Å²	67	93 Å²	93	45%	0.453	52%	0.523	S	S	.	.			trans	-59.5	127.7	166.9	-65.1	0	0	0	0	109.7	Q116 M380 V381 C382	Q116-C118 PolarHBondContact O-N 2.87Å; C118-M380 HydrophobicContact CB-CE 3.58Å; C118-V381 VanDerWaalsContact CA-O 3.27Å; C118-V381 WeakPolarHBondContact CA-O 3.36Å; C118-C382 HydrophobicContact CB-CB 4.17Å; C118-C382 WeakPolarHBondContact CB-SG 3.39Å; C118-C382 WeakPolarHBondContact SG-CB 3.33Å; C118-C382 CovalentContact SG-SG 2.04Å; C118-C382 PolarHBondContact SG-SG 3.21Å
119	S	68	Low	66.3	Low	50 Å²	50	87.6 Å²	87.6	35%	0.35	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.8	172.7	55.9	0	0	0	0	109.9	Q117 Q121 V381	Q117-S119 PolarHBondContact O-N 3.43Å; S119-Q121 PolarHBondContact O-N 3.13Å; S119-Q121 PolarHBondContact OG-NE2 2.94Å; S119-Q121 VanDerWaalsContact OG-NE2 3.17Å; S119-V381 PolarHBondContact N-O 3.24Å; S119-V381 VanDerWaalsContact N-O 3.1Å; S119-V381 PolarHBondContact O-N 2.9Å
120	A	69.3	Low	67.4	Low	74 Å²	74	88.2 Å²	88.2	61%	0.612	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	120.8	168.5	0	0	0	0	0	107.8	V379 M380	A120-V379 CarbonylContact C-O 3.5Å; A120-V379 WeakPolarHBondContact CA-O 3.4Å; A120-M380 VanDerWaalsContact CA-SD 3.51Å; A120-M380 HydrophobicContact CB-SD 3.64Å
121	Q	70.7	Confident	68.5	Low	77 Å²	77	85.2 Å²	85.2	36%	0.36	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.6	177.2	-60.2	-171.7	11.3	0	0	109.4	S119 V379 V381	S119-Q121 PolarHBondContact O-N 3.13Å; S119-Q121 PolarHBondContact OG-NE2 2.94Å; S119-Q121 VanDerWaalsContact OG-NE2 3.17Å; Q121-V379 HydrophobicContact CB-CG2 4.15Å; Q121-V379 PolarHBondContact N-O 3.29Å; Q121-V379 WeakPolarHBondContact O-CG2 3.39Å; Q121-V379 PolarHBondContact O-N 2.8Å; Q121-V379 VanDerWaalsContact O-O 3.12Å; Q121-V381 HydrophobicContact CB-CG2 4.22Å; Q121-V381 HydrophobicContact CG-CG2 4Å
122	E	72.9	Confident	69.6	Low	124 Å²	124	80.8 Å²	80.8	58%	0.579	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	114.8	167.5	-167.3	169.7	-172.6	0	0	107.5
123	I	69.9	Low	71.3	Confident	48 Å²	48	78.4 Å²	78.4	25%	0.246	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	142	167.6	59.3	162.8	0	0	0	108.5	S376 G377 V379 C393 A396 Q397	I123-S376 VanDerWaalsContact O-CA 3.28Å; I123-S376 WeakPolarHBondContact O-CA 3.05Å; I123-G377 PolarHBondContact N-O 3.19Å; I123-G377 VanDerWaalsContact N-O 3.12Å; I123-G377 PolarHBondContact O-N 2.73Å; I123-V379 HydrophobicContact CB-CG2 4.22Å; I123-V379 HydrophobicContact CD1-CG1 3.49Å; I123-V379 VanDerWaalsContact CD1-CG1 3.49Å; I123-V379 HydrophobicContact CD1-CG2 4.38Å; I123-V379 HydrophobicContact CG1-CB 4.4Å; I123-V379 HydrophobicContact CG1-CG1 3.6Å; I123-V379 HydrophobicContact CG1-CG2 3.93Å; I123-V379 HydrophobicContact CG2-CG2 3.46Å; I123-V379 VanDerWaalsContact CG2-CG2 3.46Å; I123-C393 HydrophobicContact CD1-CB 4.01Å; I123-C393 HydrophobicContact CG1-CB 4.23Å; I123-A396 HydrophobicContact CD1-CB 4.23Å; I123-Q397 HydrophobicContact CD1-CG 4.41Å
124	S	71.7	Confident	73.1	Confident	39 Å²	39	73.4 Å²	73.4	27%	0.273	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135.4	173.7	59.9	0	0	0	0	109.7	K374 T375	S124-K374 WeakPolarHBondContact OG-CE 3.38Å; S124-T375 CarbonylContact C-O 3.5Å; S124-T375 WeakPolarHBondContact CA-O 2.96Å
125	R	70.2	Confident	74.9	Confident	106 Å²	106	67.7 Å²	67.7	40%	0.4	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.3	169.4	-177.5	166.2	-177.7	159.4	-3	109.5	K374 T375 A396 Q397	R125-K374 WeakPolarHBondContact O-CA 3.39Å; R125-T375 PolarHBondContact N-O 2.85Å; R125-T375 PolarHBondContact O-N 3.36Å; R125-A396 HydrophobicContact CB-CB 4.17Å; R125-A396 WeakPolarHBondContact CD-O 3.3Å; R125-A396 PolarHBondContact NH1-O 2.84Å; R125-Q397 PolarHBondContact NH1-O 3.26Å
126	S	78.4	Confident	76.7	Confident	36 Å²	36	66 Å²	66	25%	0.252	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.2	175.4	-58.2	0	0	0	0	108.7	E372 S373	S126-E372 WeakPolarHBondContact CB-OE1 3.32Å; S126-E372 PolarHBondContact OG-OE1 3.25Å; S126-S373 WeakPolarHBondContact CA-O 3.43Å
127	E	76.3	Confident	78.3	Confident	39 Å²	39	58.2 Å²	58.2	18%	0.182	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	140.5	169.1	-69.5	-179.9	176.4	0	0	108.4	E372 S373 G399 Q400	E127-E372 CarbonylContact O-C 3.49Å; E127-E372 WeakPolarHBondContact O-CA 3.31Å; E127-S373 PolarHBondContact N-O 3.44Å; E127-S373 PolarHBondContact O-N 2.95Å; E127-G399 WeakPolarHBondContact OE1-CA 3.49Å; E127-Q400 PolarHBondContact OE1-N 2.81Å; E127-Q400 VanDerWaalsContact OE1-N 3.1Å
128	Y	82.4	Confident	79.5	Confident	122 Å²	122	55.5 Å²	55.5	48%	0.478	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.5	-179.1	-67.3	-92.8	0	0	0	109.1	F96 C371 E372	F96-Y128 WeakPolarHBondContact CB-OH 3.34Å; Y128-C371 WeakPolarHBondContact CA-O 3.35Å; Y128-E372 HydrophobicContact CD1-CB 4.07Å; Y128-E372 HydrophobicContact CE1-CB 3.71Å; Y128-E372 HydrophobicContact CE1-CG 3.96Å
129	T	81.8	Confident	80.4	Confident	33 Å²	33	52.7 Å²	52.7	20%	0.202	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.9	175.7	-59.3	0	0	0	0	109.3	Y131 C371 T553	T129-Y131 HydrophobicContact CG2-CD2 4.29Å; T129-Y131 HydrophobicContact CG2-CE1 4.3Å; T129-Y131 HydrophobicContact CG2-CE2 3.63Å; T129-Y131 WeakPolarHBondContact O-CD2 3.21Å; T129-Y131 WeakPolarHBondContact O-CE2 3.26Å; T129-C371 PolarHBondContact N-O 3.24Å; T129-C371 PolarHBondContact O-N 2.93Å; T129-T553 HydrophobicContact CG2-CG2 3.93Å
130	N	85.1	Confident	81.2	Confident	78 Å²	78	54.2 Å²	54.2	42%	0.417	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.7	177.6	-69	-18.2	0	0	0	110	T368 Y369 S370	N130-T368 HydrophobicContact CB-CG2 3.91Å; N130-Y369 CarbonylContact C-O 3.6Å; N130-Y369 VanDerWaalsContact CA-O 3.29Å; N130-Y369 WeakPolarHBondContact CA-O 3.34Å; N130-S370 WeakPolarHBondContact OD1-CA 3.25Å; N130-S370 WeakPolarHBondContact OD1-CB 3.13Å; N130-S370 PolarHBondContact OD1-OG 3.11Å
131	Y	86.4	Confident	82.1	Confident	50 Å²	50	51.7 Å²	51.7	20%	0.196	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123.1	177.8	-63.1	-92.3	0	0	0	109.7	T129 Y340 T368 Y369 C371 T553	T129-Y131 HydrophobicContact CG2-CD2 4.29Å; T129-Y131 HydrophobicContact CG2-CE1 4.3Å; T129-Y131 HydrophobicContact CG2-CE2 3.63Å; T129-Y131 WeakPolarHBondContact O-CD2 3.21Å; T129-Y131 WeakPolarHBondContact O-CE2 3.26Å; Y131-Y340 AromaticContact CD1-CE1 3.61Å; Y131-Y340 HydrophobicContact CD1-CE1 3.61Å; Y131-Y340 AromaticContact CD1-CZ 3.63Å; Y131-Y340 VanDerWaalsContact CD1-OH 3.24Å; Y131-Y340 WeakPolarHBondContact CD1-OH 3.35Å; Y131-Y340 HydrophobicContact CD2-CD1 4.24Å; Y131-Y340 AromaticContact CD2-CE1 3.92Å; Y131-Y340 HydrophobicContact CD2-CE1 3.92Å; Y131-Y340 HydrophobicContact CE1-CE1 4.25Å; Y131-Y340 HydrophobicContact CG-CD1 4.08Å; Y131-Y340 AromaticContact CG-CE1 3.41Å; Y131-Y340 HydrophobicContact CG-CE1 3.41Å; Y131-Y340 VanDerWaalsContact CG-CE1 3.41Å; Y131-Y340 HydrophobicContact CG-CE2 4.37Å; Y131-Y340 AromaticContact CG-CZ 3.59Å; Y131-T368 WeakPolarHBondContact O-CA 3.46Å; Y131-Y369 PolarHBondContact N-O 2.81Å; Y131-Y369 PolarHBondContact O-N 3.13Å; Y131-C371 HydrophobicContact CD2-CB 4.06Å; Y131-C371 HydrophobicContact CE2-CB 3.86Å; Y131-T553 HydrophobicContact CD1-CG2 3.32Å; Y131-T553 HydrophobicContact CE1-CG2 3.23Å; Y131-T553 HydrophobicContact CG-CG2 4.17Å
132	T	86.2	Confident	83	Confident	36 Å²	36	54 Å²	54	22%	0.221	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	135.2	174.7	-54.3	0	0	0	0	110.7	A367 T368 N554	T132-A367 CarbonylContact C-O 3.53Å; T132-A367 WeakPolarHBondContact CA-O 3.43Å; T132-T368 PolarHBondContact OG1-OG1 2.94Å; T132-N554 PolarHBondContact O-ND2 2.03Å
133	C	89.4	Confident	84	Confident	7 Å²	7	48 Å²	48	5%	0.047	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	171.4	-177	61.7	0	0	0	0	111.8	C337 Y340 Y366 A367	C133-C337 VanDerWaalsContact C-SG 3.51Å; C133-C337 HydrophobicContact CB-CB 3.91Å; C133-C337 WeakPolarHBondContact CB-SG 3.15Å; C133-C337 WeakPolarHBondContact SG-CA 3.5Å; C133-C337 WeakPolarHBondContact SG-CB 3.36Å; C133-C337 CovalentContact SG-SG 2.02Å; C133-C337 PolarHBondContact SG-SG 3.14Å; C133-Y340 HydrophobicContact CB-CD2 4.1Å; C133-Y340 HydrophobicContact CB-CE2 3.94Å; C133-Y366 CarbonylContact O-C 3.57Å; C133-Y366 WeakPolarHBondContact O-CA 3.05Å; C133-A367 PolarHBondContact N-O 3.18Å; C133-A367 PolarHBondContact O-N 2.93Å; C133-A367 PolarHBondContact SG-O 3.3Å; C133-A367 VanDerWaalsContact SG-O 3.36Å
134	E	89.7	Confident	85.2	Confident	19 Å²	19	48.3 Å²	48.3	9%	0.089	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.6	-176.9	-84.2	-175.9	-142.2	0	0	110.2	T336 H364 Y366 S482 Q515	E134-T336 PolarHBondContact N-OG1 3.32Å; E134-T336 PolarHBondContact O-N 3.14Å; E134-T336 PolarHBondContact O-OG1 3.04Å; E134-H364 WeakPolarHBondContact CB-NE2 3.37Å; E134-H364 WeakPolarHBondContact CG-NE2 3.37Å; E134-H364 IonicContact OE2-CE1 2.85Å; E134-H364 IonicContact OE2-NE2 2.71Å; E134-H364 PolarHBondContact OE2-NE2 3.18Å; E134-H364 VanDerWaalsContact OE2-NE2 3.12Å; E134-Y366 HydrophobicContact CG-CD1 3.51Å; E134-Y366 HydrophobicContact CG-CE1 3.5Å; E134-Y366 VanDerWaalsContact CG-CE1 3.5Å; E134-Y366 WeakPolarHBondContact OE1-CE1 3.49Å; E134-S482 WeakPolarHBondContact OE2-CB 3.4Å; E134-S482 PolarHBondContact OE2-OG 3.48Å; E134-Q515 PolarHBondContact OE1-NE2 3.18Å
135	R	90	Very high	86.4	Confident	26 Å²	26	49.9 Å²	49.9	10%	0.098	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	154.3	177.8	68.4	179.2	-171.2	173.2	3.3	113.2	D333 K334 C337 H364 E365 Y369	R135-D333 WeakPolarHBondContact CB-O 3.46Å; R135-K334 WeakPolarHBondContact CB-O 3.47Å; R135-C337 HydrophobicContact CB-CB 4.31Å; R135-H364 WeakPolarHBondContact O-CA 3.43Å; R135-H364 PolarHBondContact O-CE1 3.05Å; R135-H364 PolarHBondContact O-ND1 3.08Å; R135-E365 HydrophobicContact CG-CG 3.82Å; R135-E365 IonicContact CZ-OE1 2.73Å; R135-E365 PolarHBondContact N-O 3.3Å; R135-E365 VanDerWaalsContact N-O 3.07Å; R135-E365 IonicContact NE-OE1 3.72Å; R135-E365 PolarHBondContact NE-OE1 3.32Å; R135-E365 IonicContact NH2-OE1 3.19Å; R135-E365 PolarHBondContact NH2-OE1 2.75Å; R135-E365 PolarHBondContact O-N 2.94Å; R135-Y369 PolarHBondContact NH1-OH 3.49Å; R135-Y369 VanDerWaalsContact NH1-OH 3.07Å
136	D	89.5	Confident	87.7	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.8	172.8	-73.6	-19.1	0	0	0	111.5	A332 D333 H364 R500	D136-A332 WeakPolarHBondContact O-CA 3.45Å; D136-D333 HydrophobicContact CB-CB 3.9Å; D136-D333 PolarHBondContact N-O 3.33Å; D136-D333 PolarHBondContact O-N 3.45Å; D136-H364 IonicContact OD1-CE1 3.65Å; D136-H364 IonicContact OD1-CG 2.81Å; D136-H364 IonicContact OD1-ND1 3.76Å; D136-H364 PolarHBondContact OD1-ND1 3.23Å; D136-R500 VanDerWaalsContact CG-NH1 3.33Å; D136-R500 VanDerWaalsContact CG-NH2 3.27Å; D136-R500 IonicContact OD1-CZ 2.95Å; D136-R500 IonicContact OD1-NH1 2.63Å; D136-R500 PolarHBondContact OD1-NH1 2.88Å; D136-R500 IonicContact OD1-NH2 2.71Å; D136-R500 PolarHBondContact OD1-NH2 3.36Å; D136-R500 IonicContact OD2-CZ 2.65Å; D136-R500 IonicContact OD2-NH1 2.69Å; D136-R500 PolarHBondContact OD2-NH1 3.38Å; D136-R500 VanDerWaalsContact OD2-NH1 3.16Å; D136-R500 IonicContact OD2-NH2 3.08Å; D136-R500 PolarHBondContact OD2-NH2 2.75Å; D136-R500 VanDerWaalsContact OD2-NH2 3.14Å
137	L	88.9	Confident	88.6	Confident	25 Å²	25	45.9 Å²	45.9	13%	0.131	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-87.3	157.6	175.8	-63.1	-179.9	0	0	0	111.8	P86 Q330 C362 L363 E365	P86-L137 HydrophobicContact CG-CD2 4.13Å; L137-Q330 PolarHBondContact O-NE2 3.07Å; L137-C362 HydrophobicContact CD1-CB 3.83Å; L137-L363 PolarHBondContact N-O 3.06Å; L137-E365 HydrophobicContact CD1-CG 4.42Å; L137-E365 HydrophobicContact CD2-CG 4.13Å; L137-E365 HydrophobicContact CG-CG 4.2Å
138	Q	86.6	Confident	89.4	Confident	101 Å²	101	50 Å²	50	47%	0.472	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-74	131.8	167.6	179.7	162.2	-53.8	0	0	109.2	E140 V328 Q330 A332	Q138-E140 HydrophobicContact CG-CG 4.32Å; Q138-E140 PolarHBondContact NE2-OE1 2.95Å; Q138-V328 HydrophobicContact CG-CG1 4.11Å; Q138-V328 HydrophobicContact CG-CG2 4.43Å; Q138-Q330 CarbonylContact C-O 3.59Å; Q138-Q330 VanDerWaalsContact CA-O 3.3Å; Q138-Q330 WeakPolarHBondContact CA-O 3.19Å; Q138-A332 HydrophobicContact CB-CB 4.15Å
139	V	84.7	Confident	90	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.7	177.7	-176.2	0	0	0	0	108.2	Q141 V328 T329 Q330 A361 L363	V139-Q141 HydrophobicContact CG1-CG 4.37Å; V139-V328 WeakPolarHBondContact O-CA 3.31Å; V139-T329 PolarHBondContact O-N 3.07Å; V139-T329 PolarHBondContact O-OG1 3.48Å; V139-Q330 HydrophobicContact CB-CB 3.95Å; V139-Q330 HydrophobicContact CG2-CB 3.93Å; V139-Q330 PolarHBondContact N-O 3.42Å; V139-Q330 PolarHBondContact O-N 2.88Å; V139-A361 HydrophobicContact CG1-CB 4.12Å; V139-L363 HydrophobicContact CG1-CD2 4.5Å; V139-L363 HydrophobicContact CG2-CD2 3.58Å
140	E	86.4	Confident	90.7	Very high	82 Å²	82	46.1 Å²	46.1	38%	0.383	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	135.3	174.8	-63.8	-168.4	167.2	0	0	110	Q138 T326 Y327 V328	Q138-E140 HydrophobicContact CG-CG 4.32Å; Q138-E140 PolarHBondContact NE2-OE1 2.95Å; E140-T326 HydrophobicContact CB-CG2 3.99Å; E140-T326 HydrophobicContact CG-CG2 4.34Å; E140-Y327 CarbonylContact C-O 3.54Å; E140-Y327 WeakPolarHBondContact CA-O 3.29Å; E140-V328 HydrophobicContact CG-CG2 4Å
141	Q	86.9	Confident	91.1	Very high	21 Å²	21	44 Å²	44	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	156.1	174.5	-62.5	-175.6	-85.7	0	0	108.6	V139 F286 Y327 T329 E359	V139-Q141 HydrophobicContact CG1-CG 4.37Å; Q141-F286 HydrophobicContact CB-CD1 3.56Å; Q141-F286 HydrophobicContact CB-CE1 3.45Å; Q141-F286 VanDerWaalsContact CB-CE1 3.45Å; Q141-F286 HydrophobicContact CB-CG 4.21Å; Q141-F286 HydrophobicContact CB-CZ 4Å; Q141-F286 HydrophobicContact CG-CD1 4.41Å; Q141-Y327 PolarHBondContact N-O 2.91Å; Q141-Y327 PolarHBondContact O-N 2.65Å; Q141-T329 HydrophobicContact CB-CG2 4.12Å; Q141-T329 HydrophobicContact CG-CG2 4.22Å; Q141-T329 VanDerWaalsContact OE1-CG2 3.3Å; Q141-T329 PolarHBondContact OE1-OG1 2.99Å; Q141-E359 PolarHBondContact NE2-OE1 2.96Å
142	Y	89.9	Confident	91.3	Very high	125 Å²	125	47.7 Å²	47.7	49%	0.49	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.3	-175.2	57	-91.7	0	0	0	112.6	T144 P285 R324 D325	Y142-T144 HydrophobicContact CD2-CG2 4.26Å; Y142-P285 WeakPolarHBondContact O-CD 3.42Å; Y142-R324 HydrophobicContact CD2-CG 4.45Å; Y142-R324 HydrophobicContact CG-CG 4.34Å; Y142-D325 CarbonylContact C-O 3.49Å; Y142-D325 WeakPolarHBondContact CA-O 3.18Å
143	C	93.4	Very high	91.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	147.4	163.6	-66.5	0	0	0	0	109.2	S283 C284 R324 D325 Y327	C143-S283 CarbonylContact C-O 3.56Å; C143-S283 WeakPolarHBondContact CA-O 3.47Å; C143-C284 HydrophobicContact CB-CB 4.15Å; C143-C284 WeakPolarHBondContact CB-SG 3.44Å; C143-C284 WeakPolarHBondContact SG-CB 3.5Å; C143-C284 CovalentContact SG-SG 2.04Å; C143-C284 PolarHBondContact SG-SG 2.83Å; C143-R324 WeakPolarHBondContact O-CA 3Å; C143-D325 HydrophobicContact CB-CB 4.41Å; C143-D325 PolarHBondContact N-O 3.39Å; C143-D325 PolarHBondContact O-N 2.84Å; C143-Y327 HydrophobicContact CB-CE2 4.13Å
144	T	96.1	Very high	91	Very high	53 Å²	53	50.9 Å²	50.9	33%	0.325	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	138.2	170.3	57	0	0	0	0	110	Y142 E282 S283 Y323	Y142-T144 HydrophobicContact CD2-CG2 4.26Å; T144-E282 CarbonylContact O-C 3.47Å; T144-E282 WeakPolarHBondContact O-CA 3.07Å; T144-S283 PolarHBondContact N-O 3.39Å; T144-S283 PolarHBondContact O-N 3.07Å; T144-Y323 WeakPolarHBondContact CA-O 3.46Å
145	R	96.4	Very high	90.6	Very high	72 Å²	72	54.2 Å²	54.2	27%	0.272	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.2	173.6	-67.9	-172.9	-69.6	148.5	-2.1	109.1	W280 S281 E282 A322 Y323 D325	R145-W280 HydrophobicContact CB-CE3 3.89Å; R145-W280 HydrophobicContact CB-CZ3 4.16Å; R145-S281 CarbonylContact C-O 3.01Å; R145-S281 VanDerWaalsContact CA-O 3.31Å; R145-S281 WeakPolarHBondContact CA-O 3.28Å; R145-E282 HydrophobicContact CG-CB 3.87Å; R145-E282 HydrophobicContact CG-CG 3.7Å; R145-A322 CarbonylContact O-C 3.52Å; R145-A322 WeakPolarHBondContact O-CA 3.48Å; R145-Y323 PolarHBondContact N-O 3.24Å; R145-Y323 PolarHBondContact O-N 3.2Å; R145-D325 IonicContact CZ-OD2 3.76Å; R145-D325 IonicContact NE-OD2 2.66Å; R145-D325 PolarHBondContact NE-OD2 3.11Å; R145-D325 IonicContact NH2-OD1 2.71Å; R145-D325 PolarHBondContact NH2-OD1 2.99Å; R145-D325 IonicContact NH2-OD2 3.6Å; R145-D325 PolarHBondContact NH2-OD2 3.17Å
146	T	97.4	Very high	90.3	Very high	59 Å²	59	55.3 Å²	55.3	36%	0.362	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.4	178.7	-53.5	0	0	0	0	109.9	W280 S281 A322	T146-W280 VanDerWaalsContact C-CE3 3.48Å; T146-W280 WeakPolarHBondContact O-CA 3.27Å; T146-S281 PolarHBondContact N-O 3.18Å; T146-S281 PolarHBondContact O-N 3.35Å; T146-S281 PolarHBondContact O-OG 2.93Å; T146-A322 HydrophobicContact CG2-CB 4.41Å
147	A	96.8	Very high	90.2	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	139.6	174.4	0	0	0	0	0	110.8	V278 V279 W280 R305 W321	A147-V278 HydrophobicContact CB-CG1 3.44Å; A147-V278 VanDerWaalsContact CB-CG1 3.44Å; A147-V279 WeakPolarHBondContact CA-O 3.45Å; A147-W280 HydrophobicContact CB-CD2 3.73Å; A147-W280 HydrophobicContact CB-CE3 3.71Å; A147-W280 HydrophobicContact CB-CH2 3.52Å; A147-W280 HydrophobicContact CB-CZ2 3.55Å; A147-W280 HydrophobicContact CB-CZ3 3.61Å; A147-R305 PolarHBondContact O-NH1 3.37Å; A147-W321 HydrophobicContact CB-CE3 3.58Å; A147-W321 HydrophobicContact CB-CZ3 4.04Å; A147-W321 WeakPolarHBondContact CB-O 3.31Å; A147-W321 PolarHBondContact N-O 2.87Å
148	R	94.6	Very high	90.3	Very high	126 Å²	126	62.3 Å²	62.3	48%	0.475	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.7	168.7	38.9	179.9	169	119.7	-7.3	109.1	E150 V278 V279	R148-E150 IonicContact CZ-OE1 2.69Å; R148-E150 IonicContact NH1-OE1 3.08Å; R148-E150 PolarHBondContact NH1-OE1 2.81Å; R148-V278 WeakPolarHBondContact O-CA 3.35Å; R148-V279 HydrophobicContact CG-CB 4.29Å; R148-V279 WeakPolarHBondContact CG-O 2.9Å; R148-V279 PolarHBondContact N-O 2.96Å; R148-V279 PolarHBondContact O-N 3.12Å
149	M	94.7	Very high	90.7	Very high	18 Å²	18	62.1 Å²	62.1	9%	0.089	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.9	175.7	-177	-175.2	159.8	0	0	108.4	L151 P276 Y277 R305 L307 Y314 M316 W321	M149-L151 HydrophobicContact CE-CD2 4.12Å; M149-P276 HydrophobicContact CE-CB 3.35Å; M149-P276 HydrophobicContact CE-CG 4.31Å; M149-P276 HydrophobicContact CG-CB 4.43Å; M149-Y277 WeakPolarHBondContact CA-O 3.3Å; M149-R305 HydrophobicContact SD-CB 4.28Å; M149-L307 HydrophobicContact CB-CD1 4.17Å; M149-L307 HydrophobicContact CE-CB 4Å; M149-L307 HydrophobicContact CE-CD1 4.01Å; M149-L307 HydrophobicContact CE-CG 3.95Å; M149-L307 HydrophobicContact CG-CD1 3.81Å; M149-L307 HydrophobicContact CG-CG 4.27Å; M149-L307 WeakPolarHBondContact O-CD1 3.26Å; M149-L307 HydrophobicContact SD-CD1 4.1Å; M149-L307 HydrophobicContact SD-CG 3.93Å; M149-Y314 WeakPolarHBondContact CE-O 3.2Å; M149-M316 HydrophobicContact CE-CB 4.26Å; M149-M316 HydrophobicContact CG-CB 4.43Å; M149-M316 HydrophobicContact SD-CB 3.93Å; M149-W321 HydrophobicContact CB-CH2 4.17Å; M149-W321 HydrophobicContact CB-CZ3 4.32Å
150	E	95.7	Very high	91.2	Very high	55 Å²	55	68 Å²	68	26%	0.257	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	164.7	175.2	-68.4	-176	-173.8	0	0	110.1	R148 P276 Y277 V279	R148-E150 IonicContact CZ-OE1 2.69Å; R148-E150 IonicContact NH1-OE1 3.08Å; R148-E150 PolarHBondContact NH1-OE1 2.81Å; E150-P276 CarbonylContact O-C 3.5Å; E150-P276 VanDerWaalsContact O-CA 3.31Å; E150-P276 WeakPolarHBondContact O-CA 3.26Å; E150-Y277 HydrophobicContact CB-CD1 4.38Å; E150-Y277 HydrophobicContact CB-CE1 3.75Å; E150-Y277 HydrophobicContact CB-CE2 3.97Å; E150-Y277 VanDerWaalsContact CB-CZ 3.49Å; E150-Y277 PolarHBondContact N-O 3.36Å; E150-Y277 PolarHBondContact O-N 2.9Å; E150-Y277 PolarHBondContact OE2-OH 3.26Å; E150-V279 HydrophobicContact CG-CG2 4.29Å
151	L	93.1	Very high	91.8	Very high	32 Å²	32	67.5 Å²	67.5	17%	0.168	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.8	-178.1	-67.6	-178.3	0	0	0	110.5	M149 Y274 P276 L307 K309 Y314	M149-L151 HydrophobicContact CE-CD2 4.12Å; L151-Y274 HydrophobicContact CB-CD1 4.28Å; L151-Y274 HydrophobicContact CB-CG 4.46Å; L151-P276 HydrophobicContact CD2-CB 3.89Å; L151-L307 HydrophobicContact CD1-CB 4.15Å; L151-L307 HydrophobicContact CD2-CD1 4.42Å; L151-L307 HydrophobicContact CG-CB 4.35Å; L151-L307 HydrophobicContact CG-CD1 3.96Å; L151-K309 HydrophobicContact CD1-CB 3.59Å; L151-K309 HydrophobicContact CD1-CD 3.82Å; L151-K309 HydrophobicContact CD1-CG 4.35Å; L151-Y314 HydrophobicContact CD1-CD2 3.9Å; L151-Y314 HydrophobicContact CD1-CE2 4.42Å; L151-Y314 HydrophobicContact CD1-CG 4.43Å; L151-Y314 HydrophobicContact CD2-CD1 4.41Å; L151-Y314 HydrophobicContact CD2-CD2 4.14Å; L151-Y314 HydrophobicContact CD2-CG 3.82Å
152	Q	92.1	Very high	92.3	Very high	129 Å²	129	67.4 Å²	67.4	60%	0.603	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.6	173.3	-168.4	173.5	29.9	0	0	109.7	Y274 T275 Y277	Q152-Y274 VanDerWaalsContact O-CA 3.26Å; Q152-Y274 WeakPolarHBondContact O-CA 2.94Å; Q152-T275 PolarHBondContact N-O 3.28Å; Q152-T275 PolarHBondContact O-N 2.71Å; Q152-Y277 HydrophobicContact CB-CD1 3.87Å; Q152-Y277 HydrophobicContact CB-CE1 3.7Å
153	G	87.3	Confident	92.7	Very high	56 Å²	56	67.2 Å²	67.2	58%	0.577	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	137.7	176.9	0	0	0	0	0	112.3
154	S	81.5	Confident	92.8	Very high	53 Å²	53	69 Å²	69	37%	0.371	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.9	175.6	170.1	0	0	0	0	109.3	S273	S154-S273 WeakPolarHBondContact CA-O 3.42Å; S154-S273 PolarHBondContact N-O 3.15Å; S154-S273 PolarHBondContact O-N 2.87Å
155	T	80.6	Confident	92.7	Very high	89 Å²	89	68.1 Å²	68.1	55%	0.546	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.3	171.4	-55.9	0	0	0	0	108.4	K270	T155-K270 HydrophobicContact CG2-CD 4.42Å; T155-K270 HydrophobicContact CG2-CG 4.28Å
156	T	83.1	Confident	92.6	Very high	49 Å²	49	64.7 Å²	64.7	30%	0.301	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	168.5	166.5	60.3	0	0	0	0	109.7	K271 S273	T156-K271 PolarHBondContact N-O 3.29Å; T156-K271 VanDerWaalsContact N-O 3.08Å; T156-K271 PolarHBondContact O-N 3.28Å; T156-K271 PolarHBondContact OG1-O 3.35Å; T156-S273 WeakPolarHBondContact OG1-CB 3.28Å
157	W	87.6	Confident	92.3	Very high	129 Å²	129	62.7 Å²	62.7	49%	0.489	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.5	-179.1	-59.6	93.1	0	0	0	109	R268 V269 K270	W157-R268 HydrophobicContact CB-CG 3.98Å; W157-R268 HydrophobicContact CD2-CG 4.03Å; W157-R268 HydrophobicContact CE3-CG 3.55Å; W157-R268 HydrophobicContact CG-CG 4.25Å; W157-R268 HydrophobicContact CZ3-CG 4.25Å; W157-V269 WeakPolarHBondContact CA-O 3.36Å; W157-K270 HydrophobicContact CE3-CB 4.48Å; W157-K270 HydrophobicContact CE3-CG 3.8Å; W157-K270 HydrophobicContact CH2-CD 4.11Å; W157-K270 VanDerWaalsContact CH2-CE 3.45Å; W157-K270 HydrophobicContact CH2-CG 3.5Å; W157-K270 VanDerWaalsContact CH2-CG 3.5Å; W157-K270 HydrophobicContact CZ2-CG 4.19Å; W157-K270 HydrophobicContact CZ3-CB 4.32Å; W157-K270 HydrophobicContact CZ3-CD 4.31Å; W157-K270 HydrophobicContact CZ3-CG 3.26Å
158	E	92	Very high	92.1	Very high	52 Å²	52	70.2 Å²	70.2	24%	0.243	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.1	167.4	67.5	175.3	-145.1	0	0	109.9	R160 V269 K271	E158-R160 IonicContact OE1-CZ 3.74Å; E158-R160 IonicContact OE1-NE 3.76Å; E158-R160 PolarHBondContact OE1-NE 3.39Å; E158-R160 IonicContact OE1-NH2 3.63Å; E158-R160 PolarHBondContact OE1-NH2 3.11Å; E158-V269 HydrophobicContact CG-CG2 3.4Å; E158-V269 VanDerWaalsContact CG-CG2 3.4Å; E158-V269 PolarHBondContact N-O 2.8Å; E158-V269 VanDerWaalsContact N-O 3.09Å; E158-V269 WeakPolarHBondContact O-CG2 3.33Å; E158-V269 PolarHBondContact O-N 2.04Å; E158-K271 WeakPolarHBondContact OE2-CD 3.36Å; E158-K271 IonicContact OE2-NZ 3.71Å; E158-K271 PolarHBondContact OE2-NZ 3.48Å
159	T	94.6	Very high	92.1	Very high	96 Å²	96	66.9 Å²	66.9	59%	0.589	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	131.7	175.7	52.7	0	0	0	0	110.3	V266 V267	T159-V266 HydrophobicContact CG2-CG1 4.14Å; T159-V267 CarbonylContact C-O 3.54Å; T159-V267 WeakPolarHBondContact CA-O 3.28Å
160	R	96	Very high	91.9	Very high	131 Å²	131	71.4 Å²	71.4	49%	0.494	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.2	171.9	-69.2	-71.8	-178	154.8	-0.7	109.2	E158 V186 V267 V269	E158-R160 IonicContact OE1-CZ 3.74Å; E158-R160 IonicContact OE1-NE 3.76Å; E158-R160 PolarHBondContact OE1-NE 3.39Å; E158-R160 IonicContact OE1-NH2 3.63Å; E158-R160 PolarHBondContact OE1-NH2 3.11Å; R160-V186 HydrophobicContact CG-CG1 4.46Å; R160-V267 PolarHBondContact N-O 2.69Å; R160-V267 PolarHBondContact O-N 2.81Å; R160-V269 HydrophobicContact CG-CG1 4.43Å; R160-V269 HydrophobicContact CG-CG2 4.09Å
161	T	97.8	Very high	91.7	Very high	72 Å²	72	70.5 Å²	70.5	44%	0.442	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.6	173.4	-57	0	0	0	0	108.9	E163 R264 L265	T161-E163 HydrophobicContact CG2-CG 4.15Å; T161-R264 HydrophobicContact CG2-CG 3.85Å; T161-L265 CarbonylContact C-O 3.57Å; T161-L265 WeakPolarHBondContact CA-O 3.45Å
162	L	97.7	Very high	91.6	Very high	19 Å²	19	78.6 Å²	78.6	10%	0.099	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126	176.8	-50.8	177.4	0	0	0	108.4	Y164 P185 V186 L236 R264 L265 V267	L162-Y164 HydrophobicContact CB-CE2 3.64Å; L162-P185 HydrophobicContact CD1-CG 4.44Å; L162-P185 HydrophobicContact CD2-CG 3.68Å; L162-V186 HydrophobicContact CD1-CG2 4.01Å; L162-V186 HydrophobicContact CD2-CG2 4.48Å; L162-L236 HydrophobicContact CD1-CD1 3.77Å; L162-R264 CarbonylContact O-C 3.57Å; L162-R264 WeakPolarHBondContact O-CA 3.45Å; L162-L265 HydrophobicContact CB-CB 4.39Å; L162-L265 PolarHBondContact N-O 3.49Å; L162-L265 PolarHBondContact O-N 2.8Å; L162-V267 HydrophobicContact CD1-CG2 3.76Å; L162-V267 HydrophobicContact CG-CG2 4.21Å
163	E	97.4	Very high	91.6	Very high	122 Å²	122	77.9 Å²	77.9	57%	0.57	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.8	-179.9	-66.9	-172.7	156.6	0	0	110.9	T161 L263 R264	T161-E163 HydrophobicContact CG2-CG 4.15Å; E163-L263 CarbonylContact C-O 3.54Å; E163-L263 VanDerWaalsContact CA-O 3.29Å; E163-L263 WeakPolarHBondContact CA-O 3.01Å; E163-R264 HydrophobicContact CG-CB 4.11Å; E163-R264 HydrophobicContact CG-CG 3.92Å; E163-R264 WeakPolarHBondContact OE1-CD 3.41Å; E163-R264 IonicContact OE1-CZ 3.03Å; E163-R264 IonicContact OE1-NE 3.51Å; E163-R264 IonicContact OE1-NH1 3.06Å; E163-R264 PolarHBondContact OE1-NH1 3.24Å
164	Y	96.4	Very high	91.8	Very high	37 Å²	37	78.5 Å²	78.5	15%	0.145	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127	-176.1	-54.6	-76.3	0	0	0	110.4	L162 I182 F242 K262 L263 L265	L162-Y164 HydrophobicContact CB-CE2 3.64Å; Y164-I182 HydrophobicContact CD1-CD1 4.3Å; Y164-I182 HydrophobicContact CD1-CG2 3.71Å; Y164-I182 HydrophobicContact CD2-CD1 4.41Å; Y164-I182 HydrophobicContact CD2-CG2 4.47Å; Y164-I182 HydrophobicContact CE1-CG2 3.31Å; Y164-I182 HydrophobicContact CE2-CG2 4.14Å; Y164-I182 HydrophobicContact CG-CD1 4.02Å; Y164-I182 HydrophobicContact CG-CG2 4.26Å; Y164-F242 HydrophobicContact CD2-CZ 4.19Å; Y164-F242 HydrophobicContact CE2-CE1 4.41Å; Y164-F242 AromaticContact CE2-CZ 3.79Å; Y164-F242 HydrophobicContact CE2-CZ 3.79Å; Y164-K262 CarbonylContact O-C 3.6Å; Y164-K262 VanDerWaalsContact O-CA 3.31Å; Y164-K262 WeakPolarHBondContact O-CA 3.33Å; Y164-L263 HydrophobicContact CD2-CD2 4.27Å; Y164-L263 PolarHBondContact N-O 3.43Å; Y164-L263 PolarHBondContact O-N 2.94Å; Y164-L265 HydrophobicContact CE2-CD1 4.39Å
165	E	95.1	Very high	92.3	Very high	34 Å²	34	83.8 Å²	83.8	16%	0.159	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	104.7	169.1	172	56.7	-112.4	0	0	108.9	S167 Q168 A260 M261 K262	E165-S167 PolarHBondContact O-N 2.89Å; E165-S167 WeakPolarHBondContact OE1-CB 3.45Å; E165-S167 PolarHBondContact OE1-N 2.97Å; E165-S167 PolarHBondContact OE1-OG 2.76Å; E165-Q168 HydrophobicContact CB-CB 4.4Å; E165-Q168 HydrophobicContact CB-CG 4.29Å; E165-Q168 HydrophobicContact CG-CB 4.13Å; E165-Q168 HydrophobicContact CG-CG 3.64Å; E165-Q168 PolarHBondContact O-N 3.39Å; E165-A260 VanDerWaalsContact OE1-CA 3.28Å; E165-A260 WeakPolarHBondContact OE1-CA 3.36Å; E165-M261 PolarHBondContact OE1-N 3.35Å; E165-K262 WeakPolarHBondContact OE2-CE 3.37Å; E165-K262 WeakPolarHBondContact OE2-CG 3.23Å
166	M	93.3	Very high	92.8	Very high	0 Å²	0	81.1 Å²	81.1	0%	0	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-60.9	-34.2	-170.4	-61.5	-63.6	158	0	0	112.6	Q168 L169 V180 I182 H258 M261 L263	M166-Q168 PolarHBondContact O-N 2.91Å; M166-L169 PolarHBondContact O-N 3.4Å; M166-L169 HydrophobicContact SD-CD1 4.27Å; M166-V180 HydrophobicContact SD-CG1 4.2Å; M166-I182 HydrophobicContact CE-CD1 3.52Å; M166-I182 HydrophobicContact SD-CD1 3.67Å; M166-H258 HydrophobicContact CB-CB 4.1Å; M166-H258 WeakPolarHBondContact CB-ND1 3.42Å; M166-M261 WeakPolarHBondContact CB-O 3.32Å; M166-M261 HydrophobicContact CE-CE 4.12Å; M166-M261 HydrophobicContact CG-CB 4.24Å; M166-M261 HydrophobicContact CG-CE 3.72Å; M166-M261 VanDerWaalsContact CG-O 3.3Å; M166-M261 WeakPolarHBondContact CG-O 3.48Å; M166-M261 PolarHBondContact N-O 2.89Å; M166-L263 HydrophobicContact CE-CB 3.45Å; M166-L263 VanDerWaalsContact CE-CB 3.45Å; M166-L263 HydrophobicContact CE-CD2 3.61Å; M166-L263 HydrophobicContact CE-CG 4.17Å
167	S	90.9	Very high	93.4	Very high	17 Å²	17	82 Å²	82	12%	0.119	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-69.4	-12.9	-179.7	65.2	0	0	0	0	114.4	E165 H258 T259	E165-S167 PolarHBondContact O-N 2.89Å; E165-S167 WeakPolarHBondContact OE1-CB 3.45Å; E165-S167 PolarHBondContact OE1-N 2.97Å; E165-S167 PolarHBondContact OE1-OG 2.76Å; S167-H258 WeakPolarHBondContact CB-O 3.39Å; S167-T259 PolarHBondContact N-O 3.5Å
168	Q	93.3	Very high	93.6	Very high	158 Å²	158	77.2 Å²	77.2	74%	0.738	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-98.7	-9	176.9	-67.7	178.6	-1.8	0	0	112.9	E165 M166	E165-Q168 HydrophobicContact CB-CB 4.4Å; E165-Q168 HydrophobicContact CB-CG 4.29Å; E165-Q168 HydrophobicContact CG-CB 4.13Å; E165-Q168 HydrophobicContact CG-CG 3.64Å; E165-Q168 PolarHBondContact O-N 3.39Å; M166-Q168 PolarHBondContact O-N 2.91Å
169	L	93.8	Very high	93.8	Very high	56 Å²	56	76 Å²	76	29%	0.293	39%	0.391	S	S	.	.	S	Bend	trans	-92.3	147.9	-178.4	-65.4	174.4	0	0	0	111.6	M166 A171 V180 I182	M166-L169 PolarHBondContact O-N 3.4Å; M166-L169 HydrophobicContact SD-CD1 4.27Å; L169-A171 PolarHBondContact O-N 3.21Å; L169-V180 HydrophobicContact CB-CG1 3.56Å; L169-V180 HydrophobicContact CD1-CG1 3.68Å; L169-V180 HydrophobicContact CG-CG1 4.29Å; L169-I182 HydrophobicContact CD1-CD1 3.75Å; L169-I182 HydrophobicContact CD1-CG1 3.72Å
170	P	91.5	Very high	93.8	Very high	114 Å²	114	71.5 Å²	71.5	74%	0.74	36%	0.363	S	S	*	.			trans	-64.9	129	175.7	27.3	-33.5	0	0	0	110.1
171	A	89.9	Confident	93.8	Very high	36 Å²	36	68.9 Å²	68.9	30%	0.298	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	146.9	176.5	0	0	0	0	0	110.3	L169 Y178 V179 V180	L169-A171 PolarHBondContact O-N 3.21Å; A171-Y178 HydrophobicContact CB-CD1 3.88Å; A171-V179 CarbonylContact C-O 3.49Å; A171-V179 VanDerWaalsContact CA-O 3.29Å; A171-V179 WeakPolarHBondContact CA-O 3.44Å; A171-V180 HydrophobicContact CB-CG2 3.79Å
172	R	92.3	Very high	93.7	Very high	201 Å²	201	65.9 Å²	65.9	76%	0.758	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	144.7	169.3	-63.8	-177.1	-178.7	-163.3	0	109.2	V174 V179	R172-V174 HydrophobicContact CB-CG2 4.3Å; R172-V179 PolarHBondContact N-O 3.35Å; R172-V179 PolarHBondContact O-N 2.91Å
173	E	91.9	Very high	93.6	Very high	114 Å²	114	69 Å²	69	53%	0.533	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	118.7	168.3	179.8	165.1	-179	0	0	108.7	Q177 V248	E173-Q177 CarbonylContact C-O 3.56Å; E173-Q177 VanDerWaalsContact CA-O 3.31Å; E173-Q177 WeakPolarHBondContact CA-O 3.49Å; E173-V248 HydrophobicContact CB-CG2 4.44Å; E173-V248 HydrophobicContact CG-CG2 3.78Å
174	V	91.3	Very high	93.5	Very high	70 Å²	70	63.3 Å²	63.3	42%	0.424	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	114.1	177.7	-175.3	0	0	0	0	107.2	R172 G176 Q177 V179	R172-V174 HydrophobicContact CB-CG2 4.3Å; V174-G176 VanDerWaalsContact C-N 3.28Å; V174-G176 PolarHBondContact O-N 3.46Å; V174-Q177 PolarHBondContact N-O 3.02Å; V174-Q177 WeakPolarHBondContact O-CB 3.49Å; V174-Q177 PolarHBondContact O-N 2.75Å; V174-V179 HydrophobicContact CB-CG2 4.01Å; V174-V179 HydrophobicContact CG2-CB 4.47Å; V174-V179 HydrophobicContact CG2-CG2 4.19Å
175	N	92.2	Very high	93.5	Very high	164 Å²	164	65.7 Å²	65.7	88%	0.877	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	43.6	178.2	-59.2	-25.7	0	0	0	113.9	Q177	N175-Q177 VanDerWaalsContact C-N 3.27Å; N175-Q177 PolarHBondContact O-N 2.84Å
176	G	91.6	Very high	93.5	Very high	33 Å²	33	65.4 Å²	65.4	34%	0.34	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	8	179.9	0	0	0	0	0	115.2	V174 V248	V174-G176 VanDerWaalsContact C-N 3.28Å; V174-G176 PolarHBondContact O-N 3.46Å; G176-V248 WeakPolarHBondContact O-CG2 3.14Å; G176-V248 PolarHBondContact O-N 3.19Å
177	Q	94	Very high	93.7	Very high	66 Å²	66	69.3 Å²	69.3	31%	0.308	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.6	170.3	-61.6	-69.3	-51.3	0	0	110.3	E173 V174 N175 V179 H246 P247	E173-Q177 CarbonylContact C-O 3.56Å; E173-Q177 VanDerWaalsContact CA-O 3.31Å; E173-Q177 WeakPolarHBondContact CA-O 3.49Å; V174-Q177 PolarHBondContact N-O 3.02Å; V174-Q177 WeakPolarHBondContact O-CB 3.49Å; V174-Q177 PolarHBondContact O-N 2.75Å; N175-Q177 VanDerWaalsContact C-N 3.27Å; N175-Q177 PolarHBondContact O-N 2.84Å; Q177-V179 HydrophobicContact CB-CG2 3.97Å; Q177-H246 CarbonylContact C-O 3.54Å; Q177-H246 WeakPolarHBondContact CA-O 3.27Å; Q177-H246 VanDerWaalsContact OE1-CA 3.23Å; Q177-H246 PolarHBondContact OE1-O 3.24Å; Q177-P247 VanDerWaalsContact OE1-N 3.09Å
178	Y	93.4	Very high	93.9	Very high	30 Å²	30	69.1 Å²	69.1	12%	0.118	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.6	158.9	-88.8	-61.8	0	0	0	107.9	A171 S245 H246 V248 F255	A171-Y178 HydrophobicContact CB-CD1 3.88Å; Y178-S245 WeakPolarHBondContact O-CA 3.25Å; Y178-S245 VanDerWaalsContact O-CB 3.31Å; Y178-S245 WeakPolarHBondContact O-CB 3.42Å; Y178-H246 PolarHBondContact N-O 3.02Å; Y178-H246 PolarHBondContact O-N 3.36Å; Y178-H246 VanDerWaalsContact O-N 3.14Å; Y178-V248 HydrophobicContact CD1-CG2 4.46Å; Y178-V248 HydrophobicContact CD2-CB 4.03Å; Y178-V248 HydrophobicContact CD2-CG1 4.27Å; Y178-V248 HydrophobicContact CD2-CG2 3.58Å; Y178-V248 HydrophobicContact CE2-CB 3.97Å; Y178-V248 HydrophobicContact CE2-CG1 3.67Å; Y178-V248 HydrophobicContact CE2-CG2 3.74Å; Y178-V248 HydrophobicContact CG-CG2 3.94Å; Y178-F255 HydrophobicContact CD2-CB 4Å; Y178-F255 HydrophobicContact CE2-CB 3.91Å; Y178-F255 WeakPolarHBondContact CE2-O 3.16Å; Y178-F255 PolarHBondContact OH-O 2.78Å
179	V	95	Very high	94.1	Very high	26 Å²	26	65.2 Å²	65.2	16%	0.158	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.8	-179.7	-173.7	0	0	0	0	108.8	A171 R172 V174 Q177 T243	A171-V179 CarbonylContact C-O 3.49Å; A171-V179 VanDerWaalsContact CA-O 3.29Å; A171-V179 WeakPolarHBondContact CA-O 3.44Å; R172-V179 PolarHBondContact N-O 3.35Å; R172-V179 PolarHBondContact O-N 2.91Å; V174-V179 HydrophobicContact CB-CG2 4.01Å; V174-V179 HydrophobicContact CG2-CB 4.47Å; V174-V179 HydrophobicContact CG2-CG2 4.19Å; Q177-V179 HydrophobicContact CB-CG2 3.97Å; V179-T243 HydrophobicContact CG1-CG2 3.87Å
180	V	95.9	Very high	94.3	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.006	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.8	167.3	175.1	0	0	0	0	107.4	M166 L169 A171 I182 T243 S244 H258	M166-V180 HydrophobicContact SD-CG1 4.2Å; L169-V180 HydrophobicContact CB-CG1 3.56Å; L169-V180 HydrophobicContact CD1-CG1 3.68Å; L169-V180 HydrophobicContact CG-CG1 4.29Å; A171-V180 HydrophobicContact CB-CG2 3.79Å; V180-I182 HydrophobicContact CG1-CD1 4.28Å; V180-I182 HydrophobicContact CG1-CG1 3.94Å; V180-T243 CarbonylContact O-C 3.59Å; V180-T243 WeakPolarHBondContact O-CA 3.49Å; V180-S244 PolarHBondContact N-O 2.86Å; V180-S244 PolarHBondContact O-N 2.69Å; V180-H258 HydrophobicContact CG2-CB 3.79Å
181	S	94.7	Very high	94.5	Very high	76 Å²	76	61.1 Å²	61.1	53%	0.531	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.7	174.9	-61.4	0	0	0	0	109.7	F242	S181-F242 CarbonylContact C-O 3.53Å; S181-F242 WeakPolarHBondContact CA-O 3.26Å
182	I	95.5	Very high	94.9	Very high	9 Å²	9	62.4 Å²	62.4	5%	0.046	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117.5	-175.1	-60.4	165.8	0	0	0	108.6	Y164 M166 L169 V180 A241 F242	Y164-I182 HydrophobicContact CD1-CD1 4.3Å; Y164-I182 HydrophobicContact CD1-CG2 3.71Å; Y164-I182 HydrophobicContact CD2-CD1 4.41Å; Y164-I182 HydrophobicContact CD2-CG2 4.47Å; Y164-I182 HydrophobicContact CE1-CG2 3.31Å; Y164-I182 HydrophobicContact CE2-CG2 4.14Å; Y164-I182 HydrophobicContact CG-CD1 4.02Å; Y164-I182 HydrophobicContact CG-CG2 4.26Å; M166-I182 HydrophobicContact CE-CD1 3.52Å; M166-I182 HydrophobicContact SD-CD1 3.67Å; L169-I182 HydrophobicContact CD1-CD1 3.75Å; L169-I182 HydrophobicContact CD1-CG1 3.72Å; V180-I182 HydrophobicContact CG1-CD1 4.28Å; V180-I182 HydrophobicContact CG1-CG1 3.94Å; I182-A241 CarbonylContact O-C 3.59Å; I182-A241 WeakPolarHBondContact O-CA 3.28Å; I182-F242 HydrophobicContact CB-CD1 4.3Å; I182-F242 HydrophobicContact CB-CD2 4.35Å; I182-F242 HydrophobicContact CB-CE1 3.84Å; I182-F242 HydrophobicContact CB-CE2 3.9Å; I182-F242 HydrophobicContact CB-CZ 3.63Å; I182-F242 HydrophobicContact CD1-CE2 3.66Å; I182-F242 HydrophobicContact CD1-CZ 3.88Å; I182-F242 HydrophobicContact CG1-CE2 4.32Å; I182-F242 HydrophobicContact CG1-CZ 4.35Å; I182-F242 HydrophobicContact CG2-CD1 4.49Å; I182-F242 HydrophobicContact CG2-CE1 3.64Å; I182-F242 HydrophobicContact CG2-CE2 4.28Å; I182-F242 HydrophobicContact CG2-CZ 3.52Å; I182-F242 PolarHBondContact N-O 2.86Å; I182-F242 VanDerWaalsContact O-CD1 3.31Å; I182-F242 WeakPolarHBondContact O-CD1 3.49Å; I182-F242 PolarHBondContact O-N 2.77Å
183	T	95.4	Very high	95.2	Very high	86 Å²	86	52.9 Å²	52.9	53%	0.528	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122	173.8	-55.8	0	0	0	0	110	G239	T183-G239 VanDerWaalsContact CG2-CA 3.49Å
184	S	96.1	Very high	95.4	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.014	29%	0.292	C	S	.	.			trans	-68.3	133.9	175.4	-177.4	0	0	0	0	110.5	V186 L236 A238 G239 V240	S184-V186 VanDerWaalsContact C-N 3.28Å; S184-V186 PolarHBondContact OG-N 3.08Å; S184-V186 PolarHBondContact OG-O 3.32Å; S184-L236 WeakPolarHBondContact OG-CB 3.48Å; S184-A238 WeakPolarHBondContact O-CA 2.96Å; S184-G239 PolarHBondContact O-N 2.89Å; S184-V240 PolarHBondContact N-O 3.39Å
185	P	96.1	Very high	95.7	Very high	86 Å²	86	48 Å²	48	56%	0.558	28%	0.278	S	S	*	.	S	Bend	trans	-78.3	-12.5	171.7	32.1	-34.4	0	0	0	112.8	L162	L162-P185 HydrophobicContact CD1-CG 4.44Å; L162-P185 HydrophobicContact CD2-CG 3.68Å
186	V	95.7	Very high	95.8	Very high	29 Å²	29	41.7 Å²	41.7	18%	0.176	25%	0.247	C	C	.	.	S	Bend	trans	-134	153.9	-172.7	-62.9	0	0	0	0	112.9	R160 L162 S184 T237 A238 V267 V269	R160-V186 HydrophobicContact CG-CG1 4.46Å; L162-V186 HydrophobicContact CD1-CG2 4.01Å; L162-V186 HydrophobicContact CD2-CG2 4.48Å; S184-V186 VanDerWaalsContact C-N 3.28Å; S184-V186 PolarHBondContact OG-N 3.08Å; S184-V186 PolarHBondContact OG-O 3.32Å; V186-T237 CarbonylContact O-C 3.52Å; V186-A238 PolarHBondContact O-N 2.86Å; V186-V267 HydrophobicContact CG2-CB 4.33Å; V186-V267 HydrophobicContact CG2-CG1 4.12Å; V186-V269 HydrophobicContact CB-CG1 3.9Å; V186-V269 HydrophobicContact CG1-CG1 4.48Å; V186-V269 HydrophobicContact CG2-CG1 4.01Å
187	T	96.4	Very high	95.8	Very high	82 Å²	82	41 Å²	41	50%	0.503	23%	0.234	S	C	.	.			trans	-102	121.3	169.6	-60.3	0	0	0	0	109.4	L236 A238 V269	T187-L236 WeakPolarHBondContact CA-O 2.95Å; T187-A238 WeakPolarHBondContact OG1-CB 3.29Å; T187-A238 PolarHBondContact OG1-N 2.93Å; T187-V269 WeakPolarHBondContact O-CG1 3.38Å
188	G	95.9	Very high	95.4	Very high	13 Å²	13	41.8 Å²	41.8	13%	0.134	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178	-178.7	-178.8	0	0	0	0	0	113.9	T235 L236 R268	G188-T235 CarbonylContact O-C 3.57Å; G188-T235 WeakPolarHBondContact O-CA 3Å; G188-L236 PolarHBondContact N-O 3.19Å; G188-L236 PolarHBondContact O-N 3.26Å; G188-R268 VanDerWaalsContact CA-O 3.29Å; G188-R268 WeakPolarHBondContact CA-O 3.44Å
189	E	97.1	Very high	94.8	Very high	76 Å²	76	47 Å²	47	36%	0.355	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.7	179.3	-174.6	-176.5	174.5	0	0	110.2	V191 V267 R268	E189-V191 PolarHBondContact O-N 2.97Å; E189-V267 CarbonylContact O-C 3.58Å; E189-V267 VanDerWaalsContact O-CA 3.31Å; E189-V267 WeakPolarHBondContact O-CA 3.31Å; E189-R268 PolarHBondContact N-O 2.66Å; E189-R268 PolarHBondContact O-N 3.08Å; E189-R268 IonicContact OE1-NH2 3.59Å; E189-R268 IonicContact OE2-CZ 2.73Å; E189-R268 IonicContact OE2-NE 2.66Å; E189-R268 IonicContact OE2-NH2 3.7Å; E189-R268 PolarHBondContact OE2-NH2 3.36Å
190	I	97.6	Very high	93.5	Very high	15 Å²	15	47.6 Å²	47.6	8%	0.077	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	112.4	172.9	-52.7	177.8	0	0	0	107.4	D192 A193 L213 P231 Q233 K234 L236 L265	I190-D192 WeakPolarHBondContact CG2-O 3.45Å; I190-A193 HydrophobicContact CG2-CB 4.02Å; I190-L213 HydrophobicContact CD1-CD1 3.86Å; I190-L213 HydrophobicContact CD1-CD2 4.21Å; I190-P231 HydrophobicContact CD1-CB 4.42Å; I190-P231 HydrophobicContact CD1-CG 4.27Å; I190-P231 HydrophobicContact CG2-CG 4.23Å; I190-Q233 WeakPolarHBondContact CD1-O 3.03Å; I190-K234 PolarHBondContact N-O 3.23Å; I190-L236 HydrophobicContact CD1-CD1 4.5Å; I190-L236 HydrophobicContact CD1-CD2 3.95Å; I190-L236 HydrophobicContact CD1-CG 4Å; I190-L236 HydrophobicContact CG1-CD1 4.42Å; I190-L236 HydrophobicContact CG1-CD2 4.48Å; I190-L236 HydrophobicContact CG1-CG 3.98Å; I190-L265 HydrophobicContact CD1-CD1 4.36Å; I190-L265 HydrophobicContact CG2-CD2 4.25Å
191	V	96.8	Very high	92	Very high	69 Å²	69	58.8 Å²	58.8	42%	0.418	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-21.9	179.5	-65.7	0	0	0	0	112.6	E189 V266 R268	E189-V191 PolarHBondContact O-N 2.97Å; V191-V266 HydrophobicContact CG2-CB 4.16Å; V191-V266 HydrophobicContact CG2-CG1 3.87Å; V191-V266 VanDerWaalsContact CG2-O 3.3Å; V191-V266 WeakPolarHBondContact CG2-O 3.5Å; V191-V266 PolarHBondContact N-O 3.2Å; V191-R268 HydrophobicContact CG1-CB 3.61Å; V191-R268 HydrophobicContact CG2-CB 4.36Å
192	D	97.6	Very high	90.5	Very high	63 Å²	63	58.6 Å²	58.6	34%	0.337	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	140.8	170.1	178.8	59.2	0	0	0	109.5	I190 S228 V266	I190-D192 WeakPolarHBondContact CG2-O 3.45Å; D192-S228 PolarHBondContact OD1-OG 3.42Å; D192-V266 HydrophobicContact CB-CB 4Å; D192-V266 HydrophobicContact CB-CG2 4.07Å; D192-V266 PolarHBondContact N-O 2.62Å; D192-V266 PolarHBondContact O-N 2.77Å
193	A	98.1	Very high	89.1	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.008	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	122.9	176.9	0	0	0	0	0	109.2	I190 S228 F229 P231 L265	I190-A193 HydrophobicContact CG2-CB 4.02Å; A193-S228 CarbonylContact O-C 3.59Å; A193-S228 VanDerWaalsContact O-CA 3.24Å; A193-S228 WeakPolarHBondContact O-CA 3.41Å; A193-F229 HydrophobicContact CB-CD1 4.01Å; A193-F229 HydrophobicContact CB-CE1 3.65Å; A193-F229 HydrophobicContact CB-CE2 4.41Å; A193-F229 HydrophobicContact CB-CZ 3.88Å; A193-F229 WeakPolarHBondContact O-CD1 3.3Å; A193-F229 PolarHBondContact O-N 2.73Å; A193-P231 HydrophobicContact CB-CG 3.49Å; A193-P231 VanDerWaalsContact CB-CG 3.49Å; A193-L265 HydrophobicContact CB-CD2 3.59Å
194	H	97.8	Very high	88.3	Confident	48 Å²	48	68.6 Å²	68.6	22%	0.222	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.9	-177.3	-141.3	86.8	0	0	0	109.4	D226 A227 S228 R264	H194-D226 IonicContact CD2-OD1 2.73Å; H194-D226 PolarHBondContact CD2-OD1 3.31Å; H194-D226 IonicContact NE2-OD1 2.86Å; H194-D226 PolarHBondContact NE2-OD1 3.41Å; H194-A227 WeakPolarHBondContact CA-O 3.49Å; H194-A227 PolarHBondContact NE2-N 3Å; H194-A227 VanDerWaalsContact NE2-N 3.18Å; H194-S228 PolarHBondContact CE1-N 3.26Å; H194-S228 PolarHBondContact CE1-OG 2.93Å; H194-S228 PolarHBondContact ND1-N 2.65Å; H194-S228 PolarHBondContact ND1-OG 2.86Å; H194-R264 HydrophobicContact CB-CB 4.29Å; H194-R264 PolarHBondContact N-O 2.96Å; H194-R264 PolarHBondContact O-N 2.78Å
195	Y	95.9	Very high	87.8	Confident	32 Å²	32	70.8 Å²	70.8	13%	0.125	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	151	168.4	70	-97.5	0	0	0	109.9	W197 L217 A225 D226 A227 F229 K262	Y195-W197 AromaticContact CD2-CE3 3.54Å; Y195-W197 HydrophobicContact CD2-CE3 3.54Å; Y195-W197 AromaticContact CD2-CH2 3.85Å; Y195-W197 HydrophobicContact CD2-CH2 3.85Å; Y195-W197 AromaticContact CD2-CZ3 3.05Å; Y195-W197 HydrophobicContact CD2-CZ3 3.05Å; Y195-W197 AromaticContact CE2-CE3 3.82Å; Y195-W197 HydrophobicContact CE2-CE3 3.82Å; Y195-W197 AromaticContact CE2-CH2 3.26Å; Y195-W197 HydrophobicContact CE2-CH2 3.26Å; Y195-W197 HydrophobicContact CE2-CZ2 4.28Å; Y195-W197 AromaticContact CE2-CZ3 2.99Å; Y195-W197 HydrophobicContact CE2-CZ3 2.99Å; Y195-W197 HydrophobicContact CG-CZ3 4.15Å; Y195-L217 HydrophobicContact CD1-CD1 3.43Å; Y195-L217 VanDerWaalsContact CD1-CD1 3.43Å; Y195-L217 HydrophobicContact CD1-CD2 4.19Å; Y195-L217 HydrophobicContact CD1-CG 4.4Å; Y195-L217 HydrophobicContact CE1-CD1 3.76Å; Y195-L217 HydrophobicContact CE1-CD2 3.78Å; Y195-L217 HydrophobicContact CE1-CG 4.27Å; Y195-L217 HydrophobicContact CG-CD1 3.9Å; Y195-A225 HydrophobicContact CE2-CB 3.78Å; Y195-D226 WeakPolarHBondContact O-CA 3Å; Y195-A227 WeakPolarHBondContact CD1-O 3.36Å; Y195-A227 HydrophobicContact CE1-CB 4.03Å; Y195-A227 HydrophobicContact CE2-CB 4.27Å; Y195-A227 PolarHBondContact N-O 3.49Å; Y195-A227 PolarHBondContact O-N 3.28Å; Y195-F229 AromaticContact CD1-CD1 3.58Å; Y195-F229 HydrophobicContact CD1-CD1 3.58Å; Y195-F229 HydrophobicContact CD1-CE1 4.06Å; Y195-F229 HydrophobicContact CD1-CG 4.25Å; Y195-F229 HydrophobicContact CE1-CB 4.39Å; Y195-F229 HydrophobicContact CE1-CD1 4.28Å; Y195-K262 CarbonylContact C-O 3.5Å; Y195-K262 VanDerWaalsContact CA-O 3.23Å; Y195-K262 WeakPolarHBondContact CA-O 3.2Å
196	S	95.3	Very high	87.4	Confident	33 Å²	33	67 Å²	67	23%	0.231	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.5	169.3	65	0	0	0	0	112.6	A225 D226 M261 K262	S196-A225 CarbonylContact C-O 3.49Å; S196-A225 WeakPolarHBondContact CA-O 3.18Å; S196-A225 VanDerWaalsContact CB-O 3.31Å; S196-A225 WeakPolarHBondContact CB-O 3.5Å; S196-D226 VanDerWaalsContact CB-OD1 3.31Å; S196-D226 WeakPolarHBondContact CB-OD1 3.4Å; S196-M261 CarbonylContact O-C 3.57Å; S196-M261 WeakPolarHBondContact O-CA 3.16Å; S196-K262 PolarHBondContact N-O 2.93Å; S196-K262 PolarHBondContact O-N 2.87Å
197	W	91.5	Very high	87.1	Confident	18 Å²	18	69.6 Å²	69.6	7%	0.068	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.1	165.8	60.9	85	0	0	0	109.1	Y195 S218 W219 Y223 S224 A225 A260 M261	Y195-W197 AromaticContact CD2-CE3 3.54Å; Y195-W197 HydrophobicContact CD2-CE3 3.54Å; Y195-W197 AromaticContact CD2-CH2 3.85Å; Y195-W197 HydrophobicContact CD2-CH2 3.85Å; Y195-W197 AromaticContact CD2-CZ3 3.05Å; Y195-W197 HydrophobicContact CD2-CZ3 3.05Å; Y195-W197 AromaticContact CE2-CE3 3.82Å; Y195-W197 HydrophobicContact CE2-CE3 3.82Å; Y195-W197 AromaticContact CE2-CH2 3.26Å; Y195-W197 HydrophobicContact CE2-CH2 3.26Å; Y195-W197 HydrophobicContact CE2-CZ2 4.28Å; Y195-W197 AromaticContact CE2-CZ3 2.99Å; Y195-W197 HydrophobicContact CE2-CZ3 2.99Å; Y195-W197 HydrophobicContact CG-CZ3 4.15Å; W197-S218 WeakPolarHBondContact CH2-O 3.4Å; W197-W219 AromaticContact CD1-NE1 3.68Å; W197-W219 AromaticContact CD2-CD1 3.35Å; W197-W219 HydrophobicContact CD2-CG 4.48Å; W197-W219 AromaticContact CD2-NE1 3.51Å; W197-W219 AromaticContact CE2-CD1 3.41Å; W197-W219 VanDerWaalsContact CE2-CD1 3.41Å; W197-W219 AromaticContact CE2-NE1 3.74Å; W197-W219 AromaticContact CE3-CD1 3.52Å; W197-W219 AromaticContact CG-CD1 3.89Å; W197-W219 AromaticContact CG-NE1 3.5Å; W197-W219 HydrophobicContact CH2-CB 4.25Å; W197-W219 AromaticContact CH2-CD1 3.83Å; W197-W219 HydrophobicContact CH2-CG 4.38Å; W197-W219 HydrophobicContact CZ2-CB 4.32Å; W197-W219 AromaticContact CZ2-CD1 3.7Å; W197-W219 HydrophobicContact CZ2-CG 4.2Å; W197-W219 AromaticContact CZ3-CD1 3.7Å; W197-W219 AromaticContact NE1-CD1 3.93Å; W197-W219 AromaticContact NE1-NE1 3.82Å; W197-Y223 VanDerWaalsContact CD1-O 3.22Å; W197-Y223 PolarHBondContact NE1-O 3Å; W197-S224 CarbonylContact O-C 3.51Å; W197-S224 WeakPolarHBondContact O-CA 3.28Å; W197-S224 WeakPolarHBondContact O-CB 3.36Å; W197-A225 HydrophobicContact CD2-CB 3.93Å; W197-A225 VanDerWaalsContact CE2-CB 3.47Å; W197-A225 HydrophobicContact CE3-CB 4.22Å; W197-A225 HydrophobicContact CH2-CB 3.7Å; W197-A225 HydrophobicContact CZ2-CB 3.32Å; W197-A225 HydrophobicContact CZ3-CB 4.16Å; W197-A225 PolarHBondContact N-O 3.34Å; W197-A225 PolarHBondContact O-N 3.12Å; W197-A260 WeakPolarHBondContact CB-O 3.31Å; W197-M261 HydrophobicContact CE3-CG 4.2Å
198	S	86.4	Confident	87	Confident	82 Å²	82	66.6 Å²	66.6	57%	0.573	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-91.3	150.9	169	56.6	0	0	0	0	110.2	T200	S198-T200 PolarHBondContact O-N 3.41Å; S198-T200 VanDerWaalsContact O-N 3.13Å
199	R	79.5	Confident	86.9	Confident	139 Å²	139	69.5 Å²	69.5	53%	0.525	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-48.8	122.3	166.9	178.3	-178.2	179.5	-132.7	-0.2	109.2	K222 S224	R199-K222 VanDerWaalsContact CD-O 3.26Å; R199-K222 WeakPolarHBondContact CD-O 2.96Å; R199-K222 WeakPolarHBondContact CG-O 3.05Å; R199-S224 PolarHBondContact N-OG 3.41Å
200	T	68.7	Low	86.8	Confident	39 Å²	39	65.9 Å²	65.9	24%	0.239	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-84.1	161.3	174.7	48	0	0	0	0	109.9	S198 L202 A221 A260	S198-T200 PolarHBondContact O-N 3.41Å; S198-T200 VanDerWaalsContact O-N 3.13Å; T200-L202 PolarHBondContact O-N 3.49Å; T200-A221 PolarHBondContact N-O 2.96Å; T200-A260 HydrophobicContact CG2-CB 4.49Å
201	Y	63.1	Low	86.8	Confident	237 Å²	237	67.6 Å²	67.6	93%	0.929	34%	0.344	S	S	*	.	S	Bend	trans	-60.4	-3.8	178.5	-71.2	-80.5	0	0	0	114.7	Q203	Y201-Q203 PolarHBondContact O-N 2.89Å
202	L	64.2	Low	86.7	Confident	71 Å²	71	64.3 Å²	64.3	37%	0.372	32%	0.324	S	S	.	.			trans	-60.7	100.4	169.6	-69.8	166.9	0	0	0	108.9	T200 K204 A221	T200-L202 PolarHBondContact O-N 3.49Å; L202-K204 PolarHBondContact O-N 2.01Å; L202-K204 VanDerWaalsContact O-N 3.14Å; L202-A221 HydrophobicContact CB-CB 3.96Å; L202-A221 HydrophobicContact CD1-CB 3.91Å
203	Q	66.1	Low	86.7	Confident	173 Å²	173	61.4 Å²	61.4	81%	0.808	31%	0.308	S	S	*	.			trans	-65.7	-13.7	177.7	-66.1	-170.6	-4	0	0	112.9	Y201	Y201-Q203 PolarHBondContact O-N 2.89Å
204	K	77.9	Confident	86.5	Confident	132 Å²	132	63.5 Å²	63.5	57%	0.574	33%	0.33	S	S	*	.	S	Bend	trans	-94.3	142	-179.6	-170.8	175.4	179	177.7	0	111.6	L202	L202-K204 PolarHBondContact O-N 2.01Å; L202-K204 VanDerWaalsContact O-N 3.14Å
205	S	85.7	Confident	86.4	Confident	49 Å²	49	62 Å²	62	34%	0.343	32%	0.324	S	S	.	.			trans	-71	128	169.8	-168.3	0	0	0	0	110.8	N220	S205-N220 VanDerWaalsContact OG-CG 3.27Å; S205-N220 PolarHBondContact OG-ND2 3.21Å; S205-N220 PolarHBondContact OG-OD1 3.08Å
206	V	87.8	Confident	86.5	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.03	35%	0.345	C	S	.	.			trans	-131.4	79.6	177.5	-173.1	0	0	0	0	107.4	W219 N220 A221 V250 F255	V206-W219 HydrophobicContact CB-CZ3 4.44Å; V206-N220 PolarHBondContact N-OD1 2.65Å; V206-A221 HydrophobicContact CB-CB 4.25Å; V206-A221 HydrophobicContact CG2-CB 4.42Å; V206-V250 HydrophobicContact CG1-CB 3.8Å; V206-V250 HydrophobicContact CG1-CG1 3.72Å; V206-F255 HydrophobicContact CG1-CE2 4.43Å; V206-F255 HydrophobicContact CG1-CZ 4.12Å
207	P	90.6	Very high	86.5	Confident	85 Å²	85	63.7 Å²	63.7	55%	0.552	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	133.1	178.8	29.7	-32.9	0	0	0	110.4	W219	P207-W219 WeakPolarHBondContact CA-O 3.5Å
208	M	92.6	Very high	86.6	Confident	19 Å²	19	67.7 Å²	67.7	9%	0.094	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	166.7	172.6	64.3	179.9	-176.2	0	0	111.7	I210 W219 H246 V250 F255 T259	M208-I210 HydrophobicContact CE-CD1 4.38Å; M208-I210 HydrophobicContact CE-CG1 4.25Å; M208-W219 HydrophobicContact CE-CD2 4Å; M208-W219 HydrophobicContact CE-CE3 3.55Å; M208-W219 HydrophobicContact CE-CZ3 3.87Å; M208-W219 HydrophobicContact CG-CB 4.44Å; M208-W219 HydrophobicContact CG-CE3 3.94Å; M208-W219 PolarHBondContact N-O 2.98Å; M208-W219 PolarHBondContact O-N 2.93Å; M208-W219 HydrophobicContact SD-CE3 4.41Å; M208-H246 HydrophobicContact CE-CB 3.94Å; M208-H246 HydrophobicContact SD-CB 4.05Å; M208-V250 HydrophobicContact CB-CG1 4.47Å; M208-V250 HydrophobicContact CB-CG2 3.93Å; M208-V250 HydrophobicContact CG-CG2 4.41Å; M208-V250 HydrophobicContact SD-CG2 3.66Å; M208-F255 HydrophobicContact CE-CE1 4.11Å; M208-F255 HydrophobicContact CE-CE2 4.12Å; M208-F255 HydrophobicContact CE-CZ 3.69Å; M208-F255 HydrophobicContact SD-CE2 3.84Å; M208-F255 HydrophobicContact SD-CZ 3.89Å; M208-T259 HydrophobicContact CE-CG2 3.21Å
209	T	94.4	Very high	86.8	Confident	74 Å²	74	64.2 Å²	64.2	45%	0.454	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.3	172.1	-52.9	0	0	0	0	109.7	P216 L217	T209-P216 HydrophobicContact CG2-CB 3.53Å; T209-L217 CarbonylContact C-O 3.59Å; T209-L217 WeakPolarHBondContact CA-O 3.25Å
210	I	94.9	Very high	87.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.1	166.1	-59.7	-178	0	0	0	107.2	M208 P216 L217 W219 S245 H246 T259 M261	M208-I210 HydrophobicContact CE-CD1 4.38Å; M208-I210 HydrophobicContact CE-CG1 4.25Å; I210-P216 CarbonylContact O-C 3.6Å; I210-L217 PolarHBondContact N-O 3.01Å; I210-L217 PolarHBondContact O-N 2.93Å; I210-W219 HydrophobicContact CD1-CB 3.49Å; I210-W219 VanDerWaalsContact CD1-CB 3.49Å; I210-W219 VanDerWaalsContact CD1-CD1 3.43Å; I210-W219 HydrophobicContact CD1-CD2 4.26Å; I210-W219 HydrophobicContact CD1-CG 3.44Å; I210-W219 VanDerWaalsContact CD1-CG 3.44Å; I210-W219 HydrophobicContact CG1-CB 3.67Å; I210-W219 HydrophobicContact CG1-CG 4.14Å; I210-S245 CarbonylContact C-O 3.56Å; I210-S245 WeakPolarHBondContact CA-O 3.26Å; I210-H246 HydrophobicContact CG1-CB 4.02Å; I210-T259 HydrophobicContact CD1-CG2 4.41Å; I210-T259 VanDerWaalsContact CD1-OG1 3.26Å; I210-T259 WeakPolarHBondContact CD1-OG1 3.48Å; I210-M261 HydrophobicContact CD1-SD 4.24Å; I210-M261 HydrophobicContact CG2-CE 4.15Å; I210-M261 HydrophobicContact CG2-SD 4.18Å
211	T	97.2	Very high	88.2	Confident	51 Å²	51	57 Å²	57	31%	0.313	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.5	173.7	-57.5	0	0	0	0	109.2	T215 S244 S245	T211-T215 WeakPolarHBondContact CA-O 3.11Å; T211-S244 CarbonylContact O-C 3.59Å; T211-S244 VanDerWaalsContact O-CA 3.29Å; T211-S244 WeakPolarHBondContact O-CA 3.33Å; T211-S245 PolarHBondContact N-O 2.73Å; T211-S245 PolarHBondContact O-N 3.34Å
212	V	96.1	Very high	89.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.6	177.2	62.8	0	0	0	0	110.2	G214 T215 L217 F229 M261 L263	V212-G214 PolarHBondContact O-N 2.85Å; V212-G214 VanDerWaalsContact O-N 3.16Å; V212-T215 PolarHBondContact N-O 2.87Å; V212-T215 WeakPolarHBondContact O-CA 3.27Å; V212-T215 WeakPolarHBondContact O-CB 3.46Å; V212-T215 PolarHBondContact O-N 2.7Å; V212-T215 PolarHBondContact O-OG1 3.04Å; V212-L217 HydrophobicContact CG1-CD1 3.37Å; V212-L217 HydrophobicContact CG1-CG 4.03Å; V212-F229 HydrophobicContact CG1-CE2 3.92Å; V212-F229 HydrophobicContact CG1-CZ 3.79Å; V212-M261 HydrophobicContact CB-CE 4.25Å; V212-M261 HydrophobicContact CG1-CE 4.44Å; V212-M261 HydrophobicContact CG2-CE 4.31Å; V212-L263 HydrophobicContact CG2-CD1 4.28Å; V212-L263 HydrophobicContact CG2-CD2 3.83Å
213	L	96.1	Very high	90.4	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	37.9	-175.7	-67.8	160.5	0	0	0	112.4	I190 T215 F229 P231 V232 Q233 L236 F242 T243 L265	I190-L213 HydrophobicContact CD1-CD1 3.86Å; I190-L213 HydrophobicContact CD1-CD2 4.21Å; L213-T215 PolarHBondContact O-N 2.78Å; L213-T215 PolarHBondContact O-OG1 2.94Å; L213-F229 HydrophobicContact CD1-CZ 4.48Å; L213-P231 HydrophobicContact CB-CB 3.92Å; L213-P231 HydrophobicContact CD1-CB 4.09Å; L213-P231 HydrophobicContact CD1-CG 4.07Å; L213-V232 PolarHBondContact O-N 3.5Å; L213-Q233 HydrophobicContact CB-CB 4.24Å; L213-Q233 HydrophobicContact CD2-CB 4.21Å; L213-Q233 HydrophobicContact CD2-CG 4.32Å; L213-Q233 PolarHBondContact O-N 3.14Å; L213-L236 HydrophobicContact CD2-CD2 3.95Å; L213-F242 HydrophobicContact CD2-CB 3.61Å; L213-F242 HydrophobicContact CD2-CD1 4.21Å; L213-F242 HydrophobicContact CD2-CD2 3.49Å; L213-F242 VanDerWaalsContact CD2-CD2 3.49Å; L213-F242 HydrophobicContact CD2-CE2 4.16Å; L213-F242 HydrophobicContact CD2-CG 3.51Å; L213-F242 HydrophobicContact CG-CD2 3.82Å; L213-F242 HydrophobicContact CG-CE2 4.26Å; L213-F242 HydrophobicContact CG-CG 4.35Å; L213-T243 PolarHBondContact N-O 2.64Å; L213-T243 VanDerWaalsContact N-O 3.1Å; L213-L265 HydrophobicContact CD1-CD1 3.98Å; L213-L265 HydrophobicContact CD1-CD2 3.79Å
214	G	94.1	Very high	91.4	Very high	46 Å²	46	48.7 Å²	48.7	47%	0.474	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	2.1	-175.6	0	0	0	0	0	115.5	V212 V232	V212-G214 PolarHBondContact O-N 2.85Å; V212-G214 VanDerWaalsContact O-N 3.16Å; G214-V232 WeakPolarHBondContact O-CG2 3.35Å
215	T	97.3	Very high	92	Very high	17 Å²	17	43.5 Å²	43.5	10%	0.104	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.3	-173.4	-43.8	0	0	0	0	110.9	T211 V212 L213 L217 F229 P231 V232	T211-T215 WeakPolarHBondContact CA-O 3.11Å; V212-T215 PolarHBondContact N-O 2.87Å; V212-T215 WeakPolarHBondContact O-CA 3.27Å; V212-T215 WeakPolarHBondContact O-CB 3.46Å; V212-T215 PolarHBondContact O-N 2.7Å; V212-T215 PolarHBondContact O-OG1 3.04Å; L213-T215 PolarHBondContact O-N 2.78Å; L213-T215 PolarHBondContact O-OG1 2.94Å; T215-L217 HydrophobicContact CG2-CD2 4.37Å; T215-F229 HydrophobicContact CG2-CD2 3.97Å; T215-P231 VanDerWaalsContact OG1-CA 3.25Å; T215-P231 WeakPolarHBondContact OG1-CA 3.37Å; T215-V232 PolarHBondContact OG1-N 2.74Å
216	P	97	Very high	92.4	Very high	87 Å²	87	46.9 Å²	46.9	57%	0.565	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	125.9	176.6	30.7	-32.6	0	0	0	111	T209 I210	T209-P216 HydrophobicContact CG2-CB 3.53Å; I210-P216 CarbonylContact O-C 3.6Å
217	L	95.4	Very high	92.8	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.063	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.8	177.1	-56.7	-179.1	0	0	0	109.7	Y195 T209 I210 V212 T215 W219 F229	Y195-L217 HydrophobicContact CD1-CD1 3.43Å; Y195-L217 VanDerWaalsContact CD1-CD1 3.43Å; Y195-L217 HydrophobicContact CD1-CD2 4.19Å; Y195-L217 HydrophobicContact CD1-CG 4.4Å; Y195-L217 HydrophobicContact CE1-CD1 3.76Å; Y195-L217 HydrophobicContact CE1-CD2 3.78Å; Y195-L217 HydrophobicContact CE1-CG 4.27Å; Y195-L217 HydrophobicContact CG-CD1 3.9Å; T209-L217 CarbonylContact C-O 3.59Å; T209-L217 WeakPolarHBondContact CA-O 3.25Å; I210-L217 PolarHBondContact N-O 3.01Å; I210-L217 PolarHBondContact O-N 2.93Å; V212-L217 HydrophobicContact CG1-CD1 3.37Å; V212-L217 HydrophobicContact CG1-CG 4.03Å; T215-L217 HydrophobicContact CG2-CD2 4.37Å; L217-W219 PolarHBondContact O-N 3.39Å; L217-F229 HydrophobicContact CD2-CB 4.02Å; L217-F229 HydrophobicContact CD2-CD2 4.07Å; L217-F229 HydrophobicContact CD2-CG 4.02Å
218	S	92.9	Very high	93.1	Very high	102 Å²	102	47.5 Å²	47.5	71%	0.713	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	119.8	176.6	-68.7	0	0	0	0	110.5	W197	W197-S218 WeakPolarHBondContact CH2-O 3.4Å
219	W	92.4	Very high	93.3	Very high	10 Å²	10	47.8 Å²	47.8	4%	0.038	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.1	179.1	-174.1	93.4	0	0	0	111.7	W197 V206 P207 M208 I210 L217 A221 F255 T259	W197-W219 AromaticContact CD1-NE1 3.68Å; W197-W219 AromaticContact CD2-CD1 3.35Å; W197-W219 HydrophobicContact CD2-CG 4.48Å; W197-W219 AromaticContact CD2-NE1 3.51Å; W197-W219 AromaticContact CE2-CD1 3.41Å; W197-W219 VanDerWaalsContact CE2-CD1 3.41Å; W197-W219 AromaticContact CE2-NE1 3.74Å; W197-W219 AromaticContact CE3-CD1 3.52Å; W197-W219 AromaticContact CG-CD1 3.89Å; W197-W219 AromaticContact CG-NE1 3.5Å; W197-W219 HydrophobicContact CH2-CB 4.25Å; W197-W219 AromaticContact CH2-CD1 3.83Å; W197-W219 HydrophobicContact CH2-CG 4.38Å; W197-W219 HydrophobicContact CZ2-CB 4.32Å; W197-W219 AromaticContact CZ2-CD1 3.7Å; W197-W219 HydrophobicContact CZ2-CG 4.2Å; W197-W219 AromaticContact CZ3-CD1 3.7Å; W197-W219 AromaticContact NE1-CD1 3.93Å; W197-W219 AromaticContact NE1-NE1 3.82Å; V206-W219 HydrophobicContact CB-CZ3 4.44Å; P207-W219 WeakPolarHBondContact CA-O 3.5Å; M208-W219 HydrophobicContact CE-CD2 4Å; M208-W219 HydrophobicContact CE-CE3 3.55Å; M208-W219 HydrophobicContact CE-CZ3 3.87Å; M208-W219 HydrophobicContact CG-CB 4.44Å; M208-W219 HydrophobicContact CG-CE3 3.94Å; M208-W219 PolarHBondContact N-O 2.98Å; M208-W219 PolarHBondContact O-N 2.93Å; M208-W219 HydrophobicContact SD-CE3 4.41Å; I210-W219 HydrophobicContact CD1-CB 3.49Å; I210-W219 VanDerWaalsContact CD1-CB 3.49Å; I210-W219 VanDerWaalsContact CD1-CD1 3.43Å; I210-W219 HydrophobicContact CD1-CD2 4.26Å; I210-W219 HydrophobicContact CD1-CG 3.44Å; I210-W219 VanDerWaalsContact CD1-CG 3.44Å; I210-W219 HydrophobicContact CG1-CB 3.67Å; I210-W219 HydrophobicContact CG1-CG 4.14Å; L217-W219 PolarHBondContact O-N 3.39Å; W219-A221 VanDerWaalsContact CH2-CA 3.43Å; W219-A221 HydrophobicContact CH2-CB 3.42Å; W219-A221 VanDerWaalsContact CH2-CB 3.42Å; W219-A221 HydrophobicContact CZ2-CB 4.29Å; W219-A221 HydrophobicContact CZ3-CB 3.71Å; W219-F255 HydrophobicContact CH2-CE1 4.29Å; W219-F255 HydrophobicContact CZ3-CE1 4.39Å; W219-F255 HydrophobicContact CZ3-CZ 4.18Å; W219-T259 HydrophobicContact CD2-CG2 4.06Å; W219-T259 HydrophobicContact CE3-CG2 4.3Å; W219-T259 HydrophobicContact CH2-CG2 3.81Å; W219-T259 HydrophobicContact CZ2-CG2 3.59Å; W219-T259 HydrophobicContact CZ3-CG2 4.17Å
220	N	90.2	Very high	93.4	Very high	25 Å²	25	49.6 Å²	49.6	13%	0.134	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	125.3	174.3	-164.2	-43	0	0	0	111.3	S205 V206 K222 Y223	S205-N220 VanDerWaalsContact OG-CG 3.27Å; S205-N220 PolarHBondContact OG-ND2 3.21Å; S205-N220 PolarHBondContact OG-OD1 3.08Å; V206-N220 PolarHBondContact N-OD1 2.65Å; N220-K222 PolarHBondContact O-N 3.05Å; N220-K222 WeakPolarHBondContact OD1-CB 3.2Å; N220-K222 PolarHBondContact OD1-N 3.15Å; N220-K222 VanDerWaalsContact OD1-N 3.13Å; N220-Y223 HydrophobicContact CB-CD2 3.93Å; N220-Y223 PolarHBondContact O-N 2.97Å; N220-Y223 VanDerWaalsContact O-N 3.14Å; N220-Y223 VanDerWaalsContact O-O 3.09Å
221	A	86.1	Confident	93.5	Very high	1 Å²	1	50 Å²	50	1%	0.008	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-26.1	-178.9	0	0	0	0	0	114.5	T200 L202 V206 W219	T200-A221 PolarHBondContact N-O 2.96Å; L202-A221 HydrophobicContact CB-CB 3.96Å; L202-A221 HydrophobicContact CD1-CB 3.91Å; V206-A221 HydrophobicContact CB-CB 4.25Å; V206-A221 HydrophobicContact CG2-CB 4.42Å; W219-A221 VanDerWaalsContact CH2-CA 3.43Å; W219-A221 HydrophobicContact CH2-CB 3.42Å; W219-A221 VanDerWaalsContact CH2-CB 3.42Å; W219-A221 HydrophobicContact CZ2-CB 4.29Å; W219-A221 HydrophobicContact CZ3-CB 3.71Å
222	K	86.2	Confident	93.5	Very high	92 Å²	92	52.5 Å²	52.5	40%	0.4	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-23.4	-176.6	-172.6	177.5	176.9	-171.8	0	113.4	R199 N220	R199-K222 VanDerWaalsContact CD-O 3.26Å; R199-K222 WeakPolarHBondContact CD-O 2.96Å; R199-K222 WeakPolarHBondContact CG-O 3.05Å; N220-K222 PolarHBondContact O-N 3.05Å; N220-K222 WeakPolarHBondContact OD1-CB 3.2Å; N220-K222 PolarHBondContact OD1-N 3.15Å; N220-K222 VanDerWaalsContact OD1-N 3.13Å
223	Y	86.8	Confident	93.4	Very high	134 Å²	134	55.7 Å²	55.7	53%	0.525	33%	0.332	S	S	.	.	S	Bend	trans	-118.4	150.8	-173.5	-52.9	-58.3	0	0	0	110.9	W197 N220	W197-Y223 VanDerWaalsContact CD1-O 3.22Å; W197-Y223 PolarHBondContact NE1-O 3Å; N220-Y223 HydrophobicContact CB-CD2 3.93Å; N220-Y223 PolarHBondContact O-N 2.97Å; N220-Y223 VanDerWaalsContact O-N 3.14Å; N220-Y223 VanDerWaalsContact O-O 3.09Å
224	S	87.7	Confident	93.5	Very high	80 Å²	80	61.9 Å²	61.9	56%	0.559	36%	0.359	S	S	*	.			trans	-86.7	153.7	164.8	-55.7	0	0	0	0	109.3	W197 R199	W197-S224 CarbonylContact O-C 3.51Å; W197-S224 WeakPolarHBondContact O-CA 3.28Å; W197-S224 WeakPolarHBondContact O-CB 3.36Å; R199-S224 PolarHBondContact N-OG 3.41Å
225	A	91.4	Very high	93.6	Very high	23 Å²	23	63.4 Å²	63.4	19%	0.19	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149.7	168.5	0	0	0	0	0	109.9	Y195 S196 W197	Y195-A225 HydrophobicContact CE2-CB 3.78Å; S196-A225 CarbonylContact C-O 3.49Å; S196-A225 WeakPolarHBondContact CA-O 3.18Å; S196-A225 VanDerWaalsContact CB-O 3.31Å; S196-A225 WeakPolarHBondContact CB-O 3.5Å; W197-A225 HydrophobicContact CD2-CB 3.93Å; W197-A225 VanDerWaalsContact CE2-CB 3.47Å; W197-A225 HydrophobicContact CE3-CB 4.22Å; W197-A225 HydrophobicContact CH2-CB 3.7Å; W197-A225 HydrophobicContact CZ2-CB 3.32Å; W197-A225 HydrophobicContact CZ3-CB 4.16Å; W197-A225 PolarHBondContact N-O 3.34Å; W197-A225 PolarHBondContact O-N 3.12Å
226	D	94.2	Very high	93.6	Very high	120 Å²	120	62.7 Å²	62.7	64%	0.642	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149	102.9	171.2	-162.3	13	0	0	0	105.7	H194 Y195 S196	H194-D226 IonicContact CD2-OD1 2.73Å; H194-D226 PolarHBondContact CD2-OD1 3.31Å; H194-D226 IonicContact NE2-OD1 2.86Å; H194-D226 PolarHBondContact NE2-OD1 3.41Å; Y195-D226 WeakPolarHBondContact O-CA 3Å; S196-D226 VanDerWaalsContact CB-OD1 3.31Å; S196-D226 WeakPolarHBondContact CB-OD1 3.4Å
227	A	95.6	Very high	93.5	Very high	31 Å²	31	61.8 Å²	61.8	26%	0.256	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	146.4	-170.5	0	0	0	0	0	112.8	H194 Y195	H194-A227 WeakPolarHBondContact CA-O 3.49Å; H194-A227 PolarHBondContact NE2-N 3Å; H194-A227 VanDerWaalsContact NE2-N 3.18Å; Y195-A227 WeakPolarHBondContact CD1-O 3.36Å; Y195-A227 HydrophobicContact CE1-CB 4.03Å; Y195-A227 HydrophobicContact CE2-CB 4.27Å; Y195-A227 PolarHBondContact N-O 3.49Å; Y195-A227 PolarHBondContact O-N 3.28Å
228	S	96.9	Very high	93.5	Very high	72 Å²	72	63.4 Å²	63.4	50%	0.503	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	151.9	167.2	-70.1	0	0	0	0	110.8	D192 A193 H194	D192-S228 PolarHBondContact OD1-OG 3.42Å; A193-S228 CarbonylContact O-C 3.59Å; A193-S228 VanDerWaalsContact O-CA 3.24Å; A193-S228 WeakPolarHBondContact O-CA 3.41Å; H194-S228 PolarHBondContact CE1-N 3.26Å; H194-S228 PolarHBondContact CE1-OG 2.93Å; H194-S228 PolarHBondContact ND1-N 2.65Å; H194-S228 PolarHBondContact ND1-OG 2.86Å
229	F	96.9	Very high	93.7	Very high	25 Å²	25	61.4 Å²	61.4	11%	0.11	36%	0.359	C	S	.	.			trans	-143.9	164	172.4	70.5	-73.1	0	0	0	110.3	A193 Y195 V212 L213 T215 L217 P231 L263	A193-F229 HydrophobicContact CB-CD1 4.01Å; A193-F229 HydrophobicContact CB-CE1 3.65Å; A193-F229 HydrophobicContact CB-CE2 4.41Å; A193-F229 HydrophobicContact CB-CZ 3.88Å; A193-F229 WeakPolarHBondContact O-CD1 3.3Å; A193-F229 PolarHBondContact O-N 2.73Å; Y195-F229 AromaticContact CD1-CD1 3.58Å; Y195-F229 HydrophobicContact CD1-CD1 3.58Å; Y195-F229 HydrophobicContact CD1-CE1 4.06Å; Y195-F229 HydrophobicContact CD1-CG 4.25Å; Y195-F229 HydrophobicContact CE1-CB 4.39Å; Y195-F229 HydrophobicContact CE1-CD1 4.28Å; V212-F229 HydrophobicContact CG1-CE2 3.92Å; V212-F229 HydrophobicContact CG1-CZ 3.79Å; L213-F229 HydrophobicContact CD1-CZ 4.48Å; T215-F229 HydrophobicContact CG2-CD2 3.97Å; L217-F229 HydrophobicContact CD2-CB 4.02Å; L217-F229 HydrophobicContact CD2-CD2 4.07Å; L217-F229 HydrophobicContact CD2-CG 4.02Å; F229-P231 HydrophobicContact CD2-CG 4.25Å; F229-P231 HydrophobicContact CE2-CB 4.26Å; F229-P231 HydrophobicContact CE2-CG 3.79Å; F229-P231 HydrophobicContact CZ-CG 4.25Å; F229-P231 WeakPolarHBondContact O-CD 3.16Å; F229-L263 HydrophobicContact CE1-CD1 3.71Å; F229-L263 HydrophobicContact CZ-CD1 3.71Å
230	T	96.3	Very high	93.9	Very high	112 Å²	112	64.7 Å²	64.7	69%	0.687	38%	0.379	S	S	*	.			trans	-102.7	110.9	174.4	-54.9	0	0	0	0	109.3
231	P	96.8	Very high	94.1	Very high	9 Å²	9	65.8 Å²	65.8	6%	0.058	39%	0.392	C	S	.	.			trans	-63.9	138.6	178.5	-24.3	35.9	0	0	0	112.5	I190 A193 L213 T215 F229 Q233	I190-P231 HydrophobicContact CD1-CB 4.42Å; I190-P231 HydrophobicContact CD1-CG 4.27Å; I190-P231 HydrophobicContact CG2-CG 4.23Å; A193-P231 HydrophobicContact CB-CG 3.49Å; A193-P231 VanDerWaalsContact CB-CG 3.49Å; L213-P231 HydrophobicContact CB-CB 3.92Å; L213-P231 HydrophobicContact CD1-CB 4.09Å; L213-P231 HydrophobicContact CD1-CG 4.07Å; T215-P231 VanDerWaalsContact OG1-CA 3.25Å; T215-P231 WeakPolarHBondContact OG1-CA 3.37Å; F229-P231 HydrophobicContact CD2-CG 4.25Å; F229-P231 HydrophobicContact CE2-CB 4.26Å; F229-P231 HydrophobicContact CE2-CG 3.79Å; F229-P231 HydrophobicContact CZ-CG 4.25Å; F229-P231 WeakPolarHBondContact O-CD 3.16Å; P231-Q233 VanDerWaalsContact C-N 3.31Å; P231-Q233 VanDerWaalsContact CB-O 3.3Å; P231-Q233 WeakPolarHBondContact CB-O 3.36Å
232	V	96.8	Very high	94.5	Very high	103 Å²	103	65.9 Å²	65.9	62%	0.624	39%	0.392	S	S	*	.	S	Bend	trans	-60.1	-45.8	166.3	173.7	0	0	0	0	109.6	L213 G214 T215 K234	L213-V232 PolarHBondContact O-N 3.5Å; G214-V232 WeakPolarHBondContact O-CG2 3.35Å; T215-V232 PolarHBondContact OG1-N 2.74Å; V232-K234 PolarHBondContact O-N 2.72Å
233	Q	95.5	Very high	94.9	Very high	67 Å²	67	64.4 Å²	64.4	31%	0.313	39%	0.391	S	S	.	.	S	Bend	trans	-80	98.4	170.3	-177.9	179	-18.1	0	0	110.3	I190 L213 P231 T235	I190-Q233 WeakPolarHBondContact CD1-O 3.03Å; L213-Q233 HydrophobicContact CB-CB 4.24Å; L213-Q233 HydrophobicContact CD2-CB 4.21Å; L213-Q233 HydrophobicContact CD2-CG 4.32Å; L213-Q233 PolarHBondContact O-N 3.14Å; P231-Q233 VanDerWaalsContact C-N 3.31Å; P231-Q233 VanDerWaalsContact CB-O 3.3Å; P231-Q233 WeakPolarHBondContact CB-O 3.36Å; Q233-T235 WeakPolarHBondContact CG-O 2.97Å; Q233-T235 PolarHBondContact NE2-O 3.16Å; Q233-T235 VanDerWaalsContact NE2-O 3.08Å
234	K	96.3	Very high	95.4	Very high	131 Å²	131	58 Å²	58	57%	0.57	37%	0.366	S	S	*	.			trans	-81.7	-13	-176.3	-62.6	-177.7	179.5	-178.3	0	114.9	I190 V232	I190-K234 PolarHBondContact N-O 3.23Å; V232-K234 PolarHBondContact O-N 2.72Å
235	T	96.9	Very high	95.8	Very high	79 Å²	79	55.1 Å²	55.1	49%	0.485	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142	-176.3	55.6	0	0	0	0	111.4	G188 Q233	G188-T235 CarbonylContact O-C 3.57Å; G188-T235 WeakPolarHBondContact O-CA 3Å; Q233-T235 WeakPolarHBondContact CG-O 2.97Å; Q233-T235 PolarHBondContact NE2-O 3.16Å; Q233-T235 VanDerWaalsContact NE2-O 3.08Å
236	L	96.8	Very high	96	Very high	2 Å²	2	54 Å²	54	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	150.1	168.5	-58	-176.4	0	0	0	109.7	L162 S184 T187 G188 I190 L213 F242 L265 V267	L162-L236 HydrophobicContact CD1-CD1 3.77Å; S184-L236 WeakPolarHBondContact OG-CB 3.48Å; T187-L236 WeakPolarHBondContact CA-O 2.95Å; G188-L236 PolarHBondContact N-O 3.19Å; G188-L236 PolarHBondContact O-N 3.26Å; I190-L236 HydrophobicContact CD1-CD1 4.5Å; I190-L236 HydrophobicContact CD1-CD2 3.95Å; I190-L236 HydrophobicContact CD1-CG 4Å; I190-L236 HydrophobicContact CG1-CD1 4.42Å; I190-L236 HydrophobicContact CG1-CD2 4.48Å; I190-L236 HydrophobicContact CG1-CG 3.98Å; L213-L236 HydrophobicContact CD2-CD2 3.95Å; L236-F242 HydrophobicContact CD1-CE1 4.43Å; L236-F242 HydrophobicContact CD2-CD1 3.76Å; L236-F242 HydrophobicContact CD2-CE1 4.15Å; L236-F242 HydrophobicContact CD2-CG 4.38Å; L236-L265 HydrophobicContact CD1-CD1 4.09Å; L236-V267 HydrophobicContact CD1-CG2 3.84Å
237	T	96.7	Very high	96.1	Very high	68 Å²	68	50 Å²	50	42%	0.417	32%	0.317	S	S	.	.			trans	-125.5	128.7	173.1	-54.3	0	0	0	0	107.9	V186 G239 V240	V186-T237 CarbonylContact O-C 3.52Å; T237-G239 PolarHBondContact O-N 2.87Å; T237-V240 HydrophobicContact CG2-CG2 3.77Å; T237-V240 WeakPolarHBondContact O-CB 3.35Å; T237-V240 PolarHBondContact O-N 3.37Å
238	A	95.4	Very high	96	Very high	46 Å²	46	48.9 Å²	48.9	38%	0.38	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	133.2	179.8	0	0	0	0	0	110.2	S184 V186 T187 V240	S184-A238 WeakPolarHBondContact O-CA 2.96Å; V186-A238 PolarHBondContact O-N 2.86Å; T187-A238 WeakPolarHBondContact OG1-CB 3.29Å; T187-A238 PolarHBondContact OG1-N 2.93Å; A238-V240 PolarHBondContact O-N 3.5Å
239	G	95.7	Very high	95.8	Very high	60 Å²	60	53.3 Å²	53.3	62%	0.619	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-11.3	-177.2	0	0	0	0	0	115	T183 S184 T237	T183-G239 VanDerWaalsContact CG2-CA 3.49Å; S184-G239 PolarHBondContact O-N 2.89Å; T237-G239 PolarHBondContact O-N 2.87Å
240	V	96.3	Very high	95.5	Very high	78 Å²	78	53.6 Å²	53.6	47%	0.473	32%	0.316	S	S	.	.			trans	-92.8	131.9	174.6	-176.8	0	0	0	0	109.6	S184 T237 A238	S184-V240 PolarHBondContact N-O 3.39Å; T237-V240 HydrophobicContact CG2-CG2 3.77Å; T237-V240 WeakPolarHBondContact O-CB 3.35Å; T237-V240 PolarHBondContact O-N 3.37Å; A238-V240 PolarHBondContact O-N 3.5Å
241	A	94.7	Very high	95.1	Very high	48 Å²	48	51.2 Å²	51.2	40%	0.397	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	140.7	180	0	0	0	0	0	112.3	I182	I182-A241 CarbonylContact O-C 3.59Å; I182-A241 WeakPolarHBondContact O-CA 3.28Å
242	F	95.3	Very high	94.6	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.018	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	164.7	161.5	65.7	-90.1	0	0	0	109.7	Y164 S181 I182 L213 L236 L263 L265	Y164-F242 HydrophobicContact CD2-CZ 4.19Å; Y164-F242 HydrophobicContact CE2-CE1 4.41Å; Y164-F242 AromaticContact CE2-CZ 3.79Å; Y164-F242 HydrophobicContact CE2-CZ 3.79Å; S181-F242 CarbonylContact C-O 3.53Å; S181-F242 WeakPolarHBondContact CA-O 3.26Å; I182-F242 HydrophobicContact CB-CD1 4.3Å; I182-F242 HydrophobicContact CB-CD2 4.35Å; I182-F242 HydrophobicContact CB-CE1 3.84Å; I182-F242 HydrophobicContact CB-CE2 3.9Å; I182-F242 HydrophobicContact CB-CZ 3.63Å; I182-F242 HydrophobicContact CD1-CE2 3.66Å; I182-F242 HydrophobicContact CD1-CZ 3.88Å; I182-F242 HydrophobicContact CG1-CE2 4.32Å; I182-F242 HydrophobicContact CG1-CZ 4.35Å; I182-F242 HydrophobicContact CG2-CD1 4.49Å; I182-F242 HydrophobicContact CG2-CE1 3.64Å; I182-F242 HydrophobicContact CG2-CE2 4.28Å; I182-F242 HydrophobicContact CG2-CZ 3.52Å; I182-F242 PolarHBondContact N-O 2.86Å; I182-F242 VanDerWaalsContact O-CD1 3.31Å; I182-F242 WeakPolarHBondContact O-CD1 3.49Å; I182-F242 PolarHBondContact O-N 2.77Å; L213-F242 HydrophobicContact CD2-CB 3.61Å; L213-F242 HydrophobicContact CD2-CD1 4.21Å; L213-F242 HydrophobicContact CD2-CD2 3.49Å; L213-F242 VanDerWaalsContact CD2-CD2 3.49Å; L213-F242 HydrophobicContact CD2-CE2 4.16Å; L213-F242 HydrophobicContact CD2-CG 3.51Å; L213-F242 HydrophobicContact CG-CD2 3.82Å; L213-F242 HydrophobicContact CG-CE2 4.26Å; L213-F242 HydrophobicContact CG-CG 4.35Å; L236-F242 HydrophobicContact CD1-CE1 4.43Å; L236-F242 HydrophobicContact CD2-CD1 3.76Å; L236-F242 HydrophobicContact CD2-CE1 4.15Å; L236-F242 HydrophobicContact CD2-CG 4.38Å; F242-L263 HydrophobicContact CE2-CD2 3.9Å; F242-L263 HydrophobicContact CZ-CD2 4.36Å; F242-L265 HydrophobicContact CZ-CD1 4.05Å
243	T	94.9	Very high	94.1	Very high	61 Å²	61	54.7 Å²	54.7	37%	0.374	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	151.6	-174.3	58.5	0	0	0	0	113.7	V179 V180 L213	V179-T243 HydrophobicContact CG1-CG2 3.87Å; V180-T243 CarbonylContact O-C 3.59Å; V180-T243 WeakPolarHBondContact O-CA 3.49Å; L213-T243 PolarHBondContact N-O 2.64Å; L213-T243 VanDerWaalsContact N-O 3.1Å
244	S	96.6	Very high	93.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.4	161.2	-179.4	0	0	0	0	108.2	V180 T211 H258	V180-S244 PolarHBondContact N-O 2.86Å; V180-S244 PolarHBondContact O-N 2.69Å; T211-S244 CarbonylContact O-C 3.59Å; T211-S244 VanDerWaalsContact O-CA 3.29Å; T211-S244 WeakPolarHBondContact O-CA 3.33Å; S244-H258 PolarHBondContact OG-CE1 2.7Å; S244-H258 PolarHBondContact OG-NE2 2.85Å
245	S	96.5	Very high	93.4	Very high	19 Å²	19	52.2 Å²	52.2	13%	0.133	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	152.4	-177.6	61.1	0	0	0	0	114.7	Y178 I210 T211	Y178-S245 WeakPolarHBondContact O-CA 3.25Å; Y178-S245 VanDerWaalsContact O-CB 3.31Å; Y178-S245 WeakPolarHBondContact O-CB 3.42Å; I210-S245 CarbonylContact C-O 3.56Å; I210-S245 WeakPolarHBondContact CA-O 3.26Å; T211-S245 PolarHBondContact N-O 2.73Å; T211-S245 PolarHBondContact O-N 3.34Å
246	H	95.3	Very high	93	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	163.7	171.7	70	74.5	0	0	0	111.2	Q177 Y178 M208 I210 V248 F255 H258 T259	Q177-H246 CarbonylContact C-O 3.54Å; Q177-H246 WeakPolarHBondContact CA-O 3.27Å; Q177-H246 VanDerWaalsContact OE1-CA 3.23Å; Q177-H246 PolarHBondContact OE1-O 3.24Å; Y178-H246 PolarHBondContact N-O 3.02Å; Y178-H246 PolarHBondContact O-N 3.36Å; Y178-H246 VanDerWaalsContact O-N 3.14Å; M208-H246 HydrophobicContact CE-CB 3.94Å; M208-H246 HydrophobicContact SD-CB 4.05Å; I210-H246 HydrophobicContact CG1-CB 4.02Å; H246-V248 PolarHBondContact O-N 3.41Å; H246-F255 AromaticContact CE1-CD1 3.99Å; H246-F255 AromaticContact CE1-CD2 3.92Å; H246-F255 AromaticContact CE1-CG 3.64Å; H246-H258 AromaticContact CD2-CD2 3.63Å; H246-H258 AromaticContact CD2-CE1 3.68Å; H246-H258 AromaticContact CD2-CG 3.79Å; H246-H258 AromaticContact CD2-ND1 3.81Å; H246-H258 AromaticContact CD2-NE2 3.57Å; H246-H258 WeakPolarHBondContact NE2-CA 3.5Å; H246-H258 AromaticContact NE2-CD2 3.97Å; H246-H258 AromaticContact NE2-CG 3.77Å; H246-T259 PolarHBondContact NE2-N 3.19Å
247	P	96.3	Very high	92.5	Very high	35 Å²	35	65.4 Å²	65.4	23%	0.227	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	137.6	179.2	-23.7	32.6	0	0	0	112.6	Q177 R249 V250	Q177-P247 VanDerWaalsContact OE1-N 3.09Å; P247-R249 PolarHBondContact O-N 2.97Å; P247-V250 HydrophobicContact CB-CG2 4.01Å; P247-V250 HydrophobicContact CG-CG2 4.37Å
248	V	93.6	Very high	92.3	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.042	35%	0.345	C	S	.	.	S	Bend	trans	-61.9	-33.3	175	169.7	0	0	0	0	111.6	E173 G176 Y178 H246 K254 F255	E173-V248 HydrophobicContact CB-CG2 4.44Å; E173-V248 HydrophobicContact CG-CG2 3.78Å; G176-V248 WeakPolarHBondContact O-CG2 3.14Å; G176-V248 PolarHBondContact O-N 3.19Å; Y178-V248 HydrophobicContact CD1-CG2 4.46Å; Y178-V248 HydrophobicContact CD2-CB 4.03Å; Y178-V248 HydrophobicContact CD2-CG1 4.27Å; Y178-V248 HydrophobicContact CD2-CG2 3.58Å; Y178-V248 HydrophobicContact CE2-CB 3.97Å; Y178-V248 HydrophobicContact CE2-CG1 3.67Å; Y178-V248 HydrophobicContact CE2-CG2 3.74Å; Y178-V248 HydrophobicContact CG-CG2 3.94Å; H246-V248 PolarHBondContact O-N 3.41Å; V248-K254 HydrophobicContact CG1-CG 4.28Å; V248-F255 PolarHBondContact O-N 3.49Å
249	R	92.3	Very high	92	Very high	165 Å²	165	60.5 Å²	60.5	62%	0.623	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.7	179.8	-178.7	179.4	-77.9	171.8	-6	110.3	P247 G251 T253	P247-R249 PolarHBondContact O-N 2.97Å; R249-G251 WeakPolarHBondContact CD-O 3.32Å; R249-G251 WeakPolarHBondContact CG-O 3.03Å; R249-T253 CarbonylContact C-O 3.59Å; R249-T253 VanDerWaalsContact CA-O 3.29Å; R249-T253 WeakPolarHBondContact CA-O 2.98Å
250	V	90.1	Very high	91.7	Very high	32 Å²	32	59.2 Å²	59.2	19%	0.194	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	109	172.5	-179.2	0	0	0	0	107.8	V206 M208 P247 N252 T253 F255	V206-V250 HydrophobicContact CG1-CB 3.8Å; V206-V250 HydrophobicContact CG1-CG1 3.72Å; M208-V250 HydrophobicContact CB-CG1 4.47Å; M208-V250 HydrophobicContact CB-CG2 3.93Å; M208-V250 HydrophobicContact CG-CG2 4.41Å; M208-V250 HydrophobicContact SD-CG2 3.66Å; P247-V250 HydrophobicContact CB-CG2 4.01Å; P247-V250 HydrophobicContact CG-CG2 4.37Å; V250-N252 PolarHBondContact O-N 3.06Å; V250-T253 PolarHBondContact N-O 3.43Å; V250-T253 WeakPolarHBondContact O-CB 3.37Å; V250-T253 PolarHBondContact O-N 3.48Å; V250-F255 HydrophobicContact CB-CE2 4.31Å; V250-F255 HydrophobicContact CG2-CE2 4.01Å
251	G	88.4	Confident	91.4	Very high	61 Å²	61	55.5 Å²	55.5	63%	0.629	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-127.4	-168.3	0	0	0	0	0	111.5	R249 T253	R249-G251 WeakPolarHBondContact CD-O 3.32Å; R249-G251 WeakPolarHBondContact CG-O 3.03Å; G251-T253 VanDerWaalsContact C-N 3.3Å
252	N	86	Confident	91.5	Very high	155 Å²	155	59 Å²	59	83%	0.829	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-3	177.8	-63.7	-17.3	0	0	0	113.5	V250	V250-N252 PolarHBondContact O-N 3.06Å
253	T	86.7	Confident	91.6	Very high	30 Å²	30	58.8 Å²	58.8	18%	0.184	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	114.3	-178.3	-60.5	0	0	0	0	109.7	R249 V250 G251 F255	R249-T253 CarbonylContact C-O 3.59Å; R249-T253 VanDerWaalsContact CA-O 3.29Å; R249-T253 WeakPolarHBondContact CA-O 2.98Å; V250-T253 PolarHBondContact N-O 3.43Å; V250-T253 WeakPolarHBondContact O-CB 3.37Å; V250-T253 PolarHBondContact O-N 3.48Å; G251-T253 VanDerWaalsContact C-N 3.3Å; T253-F255 HydrophobicContact CG2-CE2 4.17Å; T253-F255 HydrophobicContact CG2-CZ 4.22Å
254	K	88.9	Confident	91.7	Very high	126 Å²	126	61.4 Å²	61.4	55%	0.548	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.7	168.7	-173.7	176.1	-179.1	177.1	0	109	V248	V248-K254 HydrophobicContact CG1-CG 4.28Å
255	F	88.1	Confident	91.8	Very high	20 Å²	20	61.4 Å²	61.4	9%	0.088	30%	0.298	C	S	.	.			trans	-75.1	149.2	172.6	-65.3	-91.5	0	0	0	109.2	Y178 V206 M208 W219 H246 V248 V250 T253 T259	Y178-F255 HydrophobicContact CD2-CB 4Å; Y178-F255 HydrophobicContact CE2-CB 3.91Å; Y178-F255 WeakPolarHBondContact CE2-O 3.16Å; Y178-F255 PolarHBondContact OH-O 2.78Å; V206-F255 HydrophobicContact CG1-CE2 4.43Å; V206-F255 HydrophobicContact CG1-CZ 4.12Å; M208-F255 HydrophobicContact CE-CE1 4.11Å; M208-F255 HydrophobicContact CE-CE2 4.12Å; M208-F255 HydrophobicContact CE-CZ 3.69Å; M208-F255 HydrophobicContact SD-CE2 3.84Å; M208-F255 HydrophobicContact SD-CZ 3.89Å; W219-F255 HydrophobicContact CH2-CE1 4.29Å; W219-F255 HydrophobicContact CZ3-CE1 4.39Å; W219-F255 HydrophobicContact CZ3-CZ 4.18Å; H246-F255 AromaticContact CE1-CD1 3.99Å; H246-F255 AromaticContact CE1-CD2 3.92Å; H246-F255 AromaticContact CE1-CG 3.64Å; V248-F255 PolarHBondContact O-N 3.49Å; V250-F255 HydrophobicContact CB-CE2 4.31Å; V250-F255 HydrophobicContact CG2-CE2 4.01Å; T253-F255 HydrophobicContact CG2-CE2 4.17Å; T253-F255 HydrophobicContact CG2-CZ 4.22Å; F255-T259 HydrophobicContact CD1-CG2 4.24Å; F255-T259 HydrophobicContact CE1-CG2 3.8Å; F255-T259 HydrophobicContact CZ-CG2 4.47Å
256	K	87.7	Confident	91.9	Very high	196 Å²	196	61.6 Å²	61.6	85%	0.852	30%	0.299	S	S	*	.	S	Bend	trans	-107.6	-12.8	173.6	-68.2	-173.7	178.6	-177.6	0	112.9
257	R	88.3	Confident	92	Very high	163 Å²	163	61.6 Å²	61.6	62%	0.615	30%	0.299	S	S	*	.	S	Bend	trans	-155.7	171.2	-178.3	56.5	176.6	175.1	178.9	-2.3	107.4
258	H	91.1	Very high	92	Very high	3 Å²	3	64.3 Å²	64.3	1%	0.014	30%	0.304	C	S	.	.			trans	-61.2	155	173.6	-159.1	-74.2	0	0	0	111.4	M166 S167 V180 S244 H246	M166-H258 HydrophobicContact CB-CB 4.1Å; M166-H258 WeakPolarHBondContact CB-ND1 3.42Å; S167-H258 WeakPolarHBondContact CB-O 3.39Å; V180-H258 HydrophobicContact CG2-CB 3.79Å; S244-H258 PolarHBondContact OG-CE1 2.7Å; S244-H258 PolarHBondContact OG-NE2 2.85Å; H246-H258 AromaticContact CD2-CD2 3.63Å; H246-H258 AromaticContact CD2-CE1 3.68Å; H246-H258 AromaticContact CD2-CG 3.79Å; H246-H258 AromaticContact CD2-ND1 3.81Å; H246-H258 AromaticContact CD2-NE2 3.57Å; H246-H258 WeakPolarHBondContact NE2-CA 3.5Å; H246-H258 AromaticContact NE2-CD2 3.97Å; H246-H258 AromaticContact NE2-CG 3.77Å
259	T	89.8	Confident	92.1	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.043	31%	0.306	C	S	.	.			trans	-58	154	171.7	55.3	0	0	0	0	112.2	S167 M208 I210 W219 H246 F255 M261	S167-T259 PolarHBondContact N-O 3.5Å; M208-T259 HydrophobicContact CE-CG2 3.21Å; I210-T259 HydrophobicContact CD1-CG2 4.41Å; I210-T259 VanDerWaalsContact CD1-OG1 3.26Å; I210-T259 WeakPolarHBondContact CD1-OG1 3.48Å; W219-T259 HydrophobicContact CD2-CG2 4.06Å; W219-T259 HydrophobicContact CE3-CG2 4.3Å; W219-T259 HydrophobicContact CH2-CG2 3.81Å; W219-T259 HydrophobicContact CZ2-CG2 3.59Å; W219-T259 HydrophobicContact CZ3-CG2 4.17Å; H246-T259 PolarHBondContact NE2-N 3.19Å; F255-T259 HydrophobicContact CD1-CG2 4.24Å; F255-T259 HydrophobicContact CE1-CG2 3.8Å; F255-T259 HydrophobicContact CZ-CG2 4.47Å; T259-M261 PolarHBondContact O-N 2.88Å
260	A	88.3	Confident	92	Very high	33 Å²	33	64 Å²	64	27%	0.273	31%	0.308	S	S	.	.	S	Bend	trans	-72.5	65.1	175.6	0	0	0	0	0	111.2	E165 W197 T200	E165-A260 VanDerWaalsContact OE1-CA 3.28Å; E165-A260 WeakPolarHBondContact OE1-CA 3.36Å; W197-A260 WeakPolarHBondContact CB-O 3.31Å; T200-A260 HydrophobicContact CG2-CB 4.49Å
261	M	91.6	Very high	91.7	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.317	C	S	.	.			trans	-102.7	124	175.9	-177.7	180	79.5	0	0	108.6	E165 M166 S196 W197 I210 V212 T259	E165-M261 PolarHBondContact OE1-N 3.35Å; M166-M261 WeakPolarHBondContact CB-O 3.32Å; M166-M261 HydrophobicContact CE-CE 4.12Å; M166-M261 HydrophobicContact CG-CB 4.24Å; M166-M261 HydrophobicContact CG-CE 3.72Å; M166-M261 VanDerWaalsContact CG-O 3.3Å; M166-M261 WeakPolarHBondContact CG-O 3.48Å; M166-M261 PolarHBondContact N-O 2.89Å; S196-M261 CarbonylContact O-C 3.57Å; S196-M261 WeakPolarHBondContact O-CA 3.16Å; W197-M261 HydrophobicContact CE3-CG 4.2Å; I210-M261 HydrophobicContact CD1-SD 4.24Å; I210-M261 HydrophobicContact CG2-CE 4.15Å; I210-M261 HydrophobicContact CG2-SD 4.18Å; V212-M261 HydrophobicContact CB-CE 4.25Å; V212-M261 HydrophobicContact CG1-CE 4.44Å; V212-M261 HydrophobicContact CG2-CE 4.31Å; T259-M261 PolarHBondContact O-N 2.88Å
262	K	95.6	Very high	91.4	Very high	121 Å²	121	66.6 Å²	66.6	53%	0.526	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.8	165.7	-65	-176.2	179.7	-176	0	109	Y164 E165 Y195 S196	Y164-K262 CarbonylContact O-C 3.6Å; Y164-K262 VanDerWaalsContact O-CA 3.31Å; Y164-K262 WeakPolarHBondContact O-CA 3.33Å; E165-K262 WeakPolarHBondContact OE2-CE 3.37Å; E165-K262 WeakPolarHBondContact OE2-CG 3.23Å; Y195-K262 CarbonylContact C-O 3.5Å; Y195-K262 VanDerWaalsContact CA-O 3.23Å; Y195-K262 WeakPolarHBondContact CA-O 3.2Å; S196-K262 PolarHBondContact N-O 2.93Å; S196-K262 PolarHBondContact O-N 2.87Å
263	L	97.3	Very high	91.3	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.5	171.7	179.8	71.7	0	0	0	108.1	E163 Y164 M166 V212 F229 F242 L265	E163-L263 CarbonylContact C-O 3.54Å; E163-L263 VanDerWaalsContact CA-O 3.29Å; E163-L263 WeakPolarHBondContact CA-O 3.01Å; Y164-L263 HydrophobicContact CD2-CD2 4.27Å; Y164-L263 PolarHBondContact N-O 3.43Å; Y164-L263 PolarHBondContact O-N 2.94Å; M166-L263 HydrophobicContact CE-CB 3.45Å; M166-L263 VanDerWaalsContact CE-CB 3.45Å; M166-L263 HydrophobicContact CE-CD2 3.61Å; M166-L263 HydrophobicContact CE-CG 4.17Å; V212-L263 HydrophobicContact CG2-CD1 4.28Å; V212-L263 HydrophobicContact CG2-CD2 3.83Å; F229-L263 HydrophobicContact CE1-CD1 3.71Å; F229-L263 HydrophobicContact CZ-CD1 3.71Å; F242-L263 HydrophobicContact CE2-CD2 3.9Å; F242-L263 HydrophobicContact CZ-CD2 4.36Å; L263-L265 HydrophobicContact CD1-CD2 3.94Å; L263-L265 HydrophobicContact CD2-CD1 4.11Å; L263-L265 HydrophobicContact CD2-CD2 4.2Å; L263-L265 HydrophobicContact CD2-CG 4.13Å; L263-L265 HydrophobicContact CG-CD2 4.01Å; L263-L265 HydrophobicContact CG-CG 4.08Å
264	R	98.3	Very high	91.5	Very high	115 Å²	115	60.8 Å²	60.8	43%	0.434	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.1	173.2	178.1	179.8	178.3	129.8	-9.5	108.7	T161 L162 E163 H194	T161-R264 HydrophobicContact CG2-CG 3.85Å; L162-R264 CarbonylContact O-C 3.57Å; L162-R264 WeakPolarHBondContact O-CA 3.45Å; E163-R264 HydrophobicContact CG-CB 4.11Å; E163-R264 HydrophobicContact CG-CG 3.92Å; E163-R264 WeakPolarHBondContact OE1-CD 3.41Å; E163-R264 IonicContact OE1-CZ 3.03Å; E163-R264 IonicContact OE1-NE 3.51Å; E163-R264 IonicContact OE1-NH1 3.06Å; E163-R264 PolarHBondContact OE1-NH1 3.24Å; H194-R264 HydrophobicContact CB-CB 4.29Å; H194-R264 PolarHBondContact N-O 2.96Å; H194-R264 PolarHBondContact O-N 2.78Å
265	L	98.2	Very high	91.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.9	177.6	-55.3	176.8	0	0	0	109.1	T161 L162 Y164 I190 A193 L213 L236 F242 L263 V267	T161-L265 CarbonylContact C-O 3.57Å; T161-L265 WeakPolarHBondContact CA-O 3.45Å; L162-L265 HydrophobicContact CB-CB 4.39Å; L162-L265 PolarHBondContact N-O 3.49Å; L162-L265 PolarHBondContact O-N 2.8Å; Y164-L265 HydrophobicContact CE2-CD1 4.39Å; I190-L265 HydrophobicContact CD1-CD1 4.36Å; I190-L265 HydrophobicContact CG2-CD2 4.25Å; A193-L265 HydrophobicContact CB-CD2 3.59Å; L213-L265 HydrophobicContact CD1-CD1 3.98Å; L213-L265 HydrophobicContact CD1-CD2 3.79Å; L236-L265 HydrophobicContact CD1-CD1 4.09Å; F242-L265 HydrophobicContact CZ-CD1 4.05Å; L263-L265 HydrophobicContact CD1-CD2 3.94Å; L263-L265 HydrophobicContact CD2-CD1 4.11Å; L263-L265 HydrophobicContact CD2-CD2 4.2Å; L263-L265 HydrophobicContact CD2-CG 4.13Å; L263-L265 HydrophobicContact CG-CD2 4.01Å; L263-L265 HydrophobicContact CG-CG 4.08Å; L265-V267 HydrophobicContact CB-CG2 4.24Å
266	V	98.2	Very high	91.8	Very high	24 Å²	24	59 Å²	59	15%	0.145	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.1	166.9	-173.6	0	0	0	0	107.7	T159 V191 D192	T159-V266 HydrophobicContact CG2-CG1 4.14Å; V191-V266 HydrophobicContact CG2-CB 4.16Å; V191-V266 HydrophobicContact CG2-CG1 3.87Å; V191-V266 VanDerWaalsContact CG2-O 3.3Å; V191-V266 WeakPolarHBondContact CG2-O 3.5Å; V191-V266 PolarHBondContact N-O 3.2Å; D192-V266 HydrophobicContact CB-CB 4Å; D192-V266 HydrophobicContact CB-CG2 4.07Å; D192-V266 PolarHBondContact N-O 2.62Å; D192-V266 PolarHBondContact O-N 2.77Å
267	V	98	Very high	92.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.6	-174.4	-171.1	0	0	0	0	109.3	T159 R160 L162 V186 E189 L236 L265 V269	T159-V267 CarbonylContact C-O 3.54Å; T159-V267 WeakPolarHBondContact CA-O 3.28Å; R160-V267 PolarHBondContact N-O 2.69Å; R160-V267 PolarHBondContact O-N 2.81Å; L162-V267 HydrophobicContact CD1-CG2 3.76Å; L162-V267 HydrophobicContact CG-CG2 4.21Å; V186-V267 HydrophobicContact CG2-CB 4.33Å; V186-V267 HydrophobicContact CG2-CG1 4.12Å; E189-V267 CarbonylContact O-C 3.58Å; E189-V267 VanDerWaalsContact O-CA 3.31Å; E189-V267 WeakPolarHBondContact O-CA 3.31Å; L236-V267 HydrophobicContact CD1-CG2 3.84Å; L265-V267 HydrophobicContact CB-CG2 4.24Å; V267-V269 HydrophobicContact CG1-CG1 3.97Å
268	R	96.9	Very high	92.5	Very high	91 Å²	91	47.7 Å²	47.7	34%	0.343	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.2	171.8	179.4	172.7	63	-177.4	-1	109.2	W157 G188 E189 V191	W157-R268 HydrophobicContact CB-CG 3.98Å; W157-R268 HydrophobicContact CD2-CG 4.03Å; W157-R268 HydrophobicContact CE3-CG 3.55Å; W157-R268 HydrophobicContact CG-CG 4.25Å; W157-R268 HydrophobicContact CZ3-CG 4.25Å; G188-R268 VanDerWaalsContact CA-O 3.29Å; G188-R268 WeakPolarHBondContact CA-O 3.44Å; E189-R268 PolarHBondContact N-O 2.66Å; E189-R268 PolarHBondContact O-N 3.08Å; E189-R268 IonicContact OE1-NH2 3.59Å; E189-R268 IonicContact OE2-CZ 2.73Å; E189-R268 IonicContact OE2-NE 2.66Å; E189-R268 IonicContact OE2-NH2 3.7Å; E189-R268 PolarHBondContact OE2-NH2 3.36Å; V191-R268 HydrophobicContact CG1-CB 3.61Å; V191-R268 HydrophobicContact CG2-CB 4.36Å
269	V	94.8	Very high	92.8	Very high	13 Å²	13	49.5 Å²	49.5	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	145.1	-177.5	-55.8	0	0	0	0	110.6	W157 E158 R160 V186 T187 V267	W157-V269 WeakPolarHBondContact CA-O 3.36Å; E158-V269 HydrophobicContact CG-CG2 3.4Å; E158-V269 VanDerWaalsContact CG-CG2 3.4Å; E158-V269 PolarHBondContact N-O 2.8Å; E158-V269 VanDerWaalsContact N-O 3.09Å; E158-V269 WeakPolarHBondContact O-CG2 3.33Å; E158-V269 PolarHBondContact O-N 2.04Å; R160-V269 HydrophobicContact CG-CG1 4.43Å; R160-V269 HydrophobicContact CG-CG2 4.09Å; V186-V269 HydrophobicContact CB-CG1 3.9Å; V186-V269 HydrophobicContact CG1-CG1 4.48Å; V186-V269 HydrophobicContact CG2-CG1 4.01Å; T187-V269 WeakPolarHBondContact O-CG1 3.38Å; V267-V269 HydrophobicContact CG1-CG1 3.97Å
270	K	89.9	Confident	93.1	Very high	153 Å²	153	53.7 Å²	53.7	67%	0.665	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	133	175.3	-71.3	-175.3	179	-178.4	0	109.5	T155 W157	T155-K270 HydrophobicContact CG2-CD 4.42Å; T155-K270 HydrophobicContact CG2-CG 4.28Å; W157-K270 HydrophobicContact CE3-CB 4.48Å; W157-K270 HydrophobicContact CE3-CG 3.8Å; W157-K270 HydrophobicContact CH2-CD 4.11Å; W157-K270 VanDerWaalsContact CH2-CE 3.45Å; W157-K270 HydrophobicContact CH2-CG 3.5Å; W157-K270 VanDerWaalsContact CH2-CG 3.5Å; W157-K270 HydrophobicContact CZ2-CG 4.19Å; W157-K270 HydrophobicContact CZ3-CB 4.32Å; W157-K270 HydrophobicContact CZ3-CD 4.31Å; W157-K270 HydrophobicContact CZ3-CG 3.26Å
271	K	84.4	Confident	93.4	Very high	88 Å²	88	54.6 Å²	54.6	38%	0.383	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.9	173.8	-173.3	-179.5	-166	152.5	0	109.2	T156 E158 S273	T156-K271 PolarHBondContact N-O 3.29Å; T156-K271 VanDerWaalsContact N-O 3.08Å; T156-K271 PolarHBondContact O-N 3.28Å; T156-K271 PolarHBondContact OG1-O 3.35Å; E158-K271 WeakPolarHBondContact OE2-CD 3.36Å; E158-K271 IonicContact OE2-NZ 3.71Å; E158-K271 PolarHBondContact OE2-NZ 3.48Å; K271-S273 PolarHBondContact O-N 3.24Å
272	A	82.1	Confident	93.6	Very high	59 Å²	59	58.9 Å²	58.9	49%	0.488	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126.4	168.8	0	0	0	0	0	108.5	Y274	A272-Y274 HydrophobicContact CB-CE2 4.31Å
273	S	83.9	Confident	93.4	Very high	28 Å²	28	56.7 Å²	56.7	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.8	175.9	-175.4	0	0	0	0	108.9	S154 T156 K271	S154-S273 WeakPolarHBondContact CA-O 3.42Å; S154-S273 PolarHBondContact N-O 3.15Å; S154-S273 PolarHBondContact O-N 2.87Å; T156-S273 WeakPolarHBondContact OG1-CB 3.28Å; K271-S273 PolarHBondContact O-N 3.24Å
274	Y	89.5	Confident	93	Very high	36 Å²	36	58.2 Å²	58.2	14%	0.141	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.5	-178.6	-55.3	-89.8	0	0	0	110.3	L151 Q152 A272 K309 D310 Y314	L151-Y274 HydrophobicContact CB-CD1 4.28Å; L151-Y274 HydrophobicContact CB-CG 4.46Å; Q152-Y274 VanDerWaalsContact O-CA 3.26Å; Q152-Y274 WeakPolarHBondContact O-CA 2.94Å; A272-Y274 HydrophobicContact CB-CE2 4.31Å; Y274-K309 HydrophobicContact CD1-CD 4.03Å; Y274-K309 HydrophobicContact CD2-CD 4.32Å; Y274-K309 HydrophobicContact CD2-CG 4.38Å; Y274-K309 HydrophobicContact CE1-CD 3.67Å; Y274-K309 HydrophobicContact CE1-CG 4.47Å; Y274-K309 HydrophobicContact CE2-CB 4.48Å; Y274-K309 HydrophobicContact CE2-CD 3.98Å; Y274-K309 HydrophobicContact CE2-CG 3.9Å; Y274-K309 HydrophobicContact CG-CD 4.34Å; Y274-K309 VanDerWaalsContact CZ-CE 3.48Å; Y274-K309 WeakPolarHBondContact OH-CE 3.2Å; Y274-D310 WeakPolarHBondContact CE2-OD2 3.44Å; Y274-D310 PolarHBondContact OH-OD2 3.39Å; Y274-Y314 HydrophobicContact CD2-CE2 4.06Å; Y274-Y314 AromaticContact CD2-CZ 3.81Å; Y274-Y314 WeakPolarHBondContact CD2-OH 3.32Å; Y274-Y314 WeakPolarHBondContact O-CD1 3.47Å; Y274-Y314 WeakPolarHBondContact O-CE1 3.27Å
275	T	90.4	Very high	92.2	Very high	80 Å²	80	56.5 Å²	56.5	49%	0.491	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.4	171.7	-57	0	0	0	0	108.1	Q152	Q152-T275 PolarHBondContact N-O 3.28Å; Q152-T275 PolarHBondContact O-N 2.71Å
276	P	94.2	Very high	91.3	Very high	29 Å²	29	57 Å²	57	19%	0.188	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	145.8	176.8	31.8	-34.7	0	0	0	110.7	M149 E150 L151 M316	M149-P276 HydrophobicContact CE-CB 3.35Å; M149-P276 HydrophobicContact CE-CG 4.31Å; M149-P276 HydrophobicContact CG-CB 4.43Å; E150-P276 CarbonylContact O-C 3.5Å; E150-P276 VanDerWaalsContact O-CA 3.31Å; E150-P276 WeakPolarHBondContact O-CA 3.26Å; L151-P276 HydrophobicContact CD2-CB 3.89Å; P276-M316 HydrophobicContact CB-CB 4.37Å; P276-M316 HydrophobicContact CB-CE 3.84Å; P276-M316 HydrophobicContact CG-CE 3.9Å; P276-M316 WeakPolarHBondContact O-CE 3.42Å
277	Y	94.6	Very high	90.5	Very high	88 Å²	88	56.4 Å²	56.4	35%	0.345	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	164.3	173.2	67.6	-80.8	0	0	0	110.5	M149 E150 Q152 V279	M149-Y277 WeakPolarHBondContact CA-O 3.3Å; E150-Y277 HydrophobicContact CB-CD1 4.38Å; E150-Y277 HydrophobicContact CB-CE1 3.75Å; E150-Y277 HydrophobicContact CB-CE2 3.97Å; E150-Y277 VanDerWaalsContact CB-CZ 3.49Å; E150-Y277 PolarHBondContact N-O 3.36Å; E150-Y277 PolarHBondContact O-N 2.9Å; E150-Y277 PolarHBondContact OE2-OH 3.26Å; Q152-Y277 HydrophobicContact CB-CD1 3.87Å; Q152-Y277 HydrophobicContact CB-CE1 3.7Å; Y277-V279 HydrophobicContact CD2-CG2 3.93Å; Y277-V279 HydrophobicContact CE2-CG2 3.37Å
278	V	95.4	Very high	89.7	Confident	33 Å²	33	60.1 Å²	60.1	20%	0.2	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	134.8	178.3	177.8	0	0	0	0	111	A147 R148 W280 M316 Q318 W321	A147-V278 HydrophobicContact CB-CG1 3.44Å; A147-V278 VanDerWaalsContact CB-CG1 3.44Å; R148-V278 WeakPolarHBondContact O-CA 3.35Å; V278-W280 HydrophobicContact CG1-CG 4.44Å; V278-M316 HydrophobicContact CG2-SD 3.33Å; V278-M316 WeakPolarHBondContact CG2-SD 3.42Å; V278-Q318 HydrophobicContact CG2-CG 3.89Å; V278-W321 HydrophobicContact CG2-CH2 4.23Å; V278-W321 HydrophobicContact CG2-CZ3 4.06Å
279	V	96.8	Very high	88.7	Confident	41 Å²	41	62.3 Å²	62.3	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.3	166.8	-177.4	0	0	0	0	108.5	A147 R148 E150 Y277	A147-V279 WeakPolarHBondContact CA-O 3.45Å; R148-V279 HydrophobicContact CG-CB 4.29Å; R148-V279 WeakPolarHBondContact CG-O 2.9Å; R148-V279 PolarHBondContact N-O 2.96Å; R148-V279 PolarHBondContact O-N 3.12Å; E150-V279 HydrophobicContact CG-CG2 4.29Å; Y277-V279 HydrophobicContact CD2-CG2 3.93Å; Y277-V279 HydrophobicContact CE2-CG2 3.37Å
280	W	96.4	Very high	87.7	Confident	95 Å²	95	62.4 Å²	62.4	36%	0.36	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	132.7	173.4	-72.5	92.5	0	0	0	110.1	R145 T146 A147 V278 Y323	R145-W280 HydrophobicContact CB-CE3 3.89Å; R145-W280 HydrophobicContact CB-CZ3 4.16Å; T146-W280 VanDerWaalsContact C-CE3 3.48Å; T146-W280 WeakPolarHBondContact O-CA 3.27Å; A147-W280 HydrophobicContact CB-CD2 3.73Å; A147-W280 HydrophobicContact CB-CE3 3.71Å; A147-W280 HydrophobicContact CB-CH2 3.52Å; A147-W280 HydrophobicContact CB-CZ2 3.55Å; A147-W280 HydrophobicContact CB-CZ3 3.61Å; V278-W280 HydrophobicContact CG1-CG 4.44Å; W280-Y323 AromaticContact CH2-CD2 3.45Å; W280-Y323 HydrophobicContact CH2-CD2 3.45Å; W280-Y323 VanDerWaalsContact CH2-CD2 3.45Å; W280-Y323 AromaticContact CH2-CE2 3.45Å; W280-Y323 HydrophobicContact CH2-CE2 3.45Å; W280-Y323 VanDerWaalsContact CH2-CE2 3.45Å; W280-Y323 HydrophobicContact CZ2-CD2 4.33Å; W280-Y323 HydrophobicContact CZ2-CE2 4.01Å; W280-Y323 AromaticContact CZ3-CD2 3.71Å; W280-Y323 HydrophobicContact CZ3-CD2 3.71Å; W280-Y323 HydrophobicContact CZ3-CE2 4.19Å
281	S	96	Very high	87.1	Confident	52 Å²	52	55.8 Å²	55.8	36%	0.364	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.3	165.3	51.8	0	0	0	0	109.5	R145 T146	R145-S281 CarbonylContact C-O 3.01Å; R145-S281 VanDerWaalsContact CA-O 3.31Å; R145-S281 WeakPolarHBondContact CA-O 3.28Å; T146-S281 PolarHBondContact N-O 3.18Å; T146-S281 PolarHBondContact O-N 3.35Å; T146-S281 PolarHBondContact O-OG 2.93Å
282	E	94	Very high	87	Confident	89 Å²	89	58.4 Å²	58.4	42%	0.416	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.6	179.2	-177.1	175.4	-120.9	0	0	110.5	T144 R145 K288	T144-E282 CarbonylContact O-C 3.47Å; T144-E282 WeakPolarHBondContact O-CA 3.07Å; R145-E282 HydrophobicContact CG-CB 3.87Å; R145-E282 HydrophobicContact CG-CG 3.7Å; E282-K288 IonicContact OE1-NZ 2.6Å; E282-K288 PolarHBondContact OE1-NZ 3.49Å; E282-K288 VanDerWaalsContact OE2-CE 3.3Å; E282-K288 WeakPolarHBondContact OE2-CE 3.31Å; E282-K288 IonicContact OE2-NZ 2.95Å; E282-K288 PolarHBondContact OE2-NZ 3.07Å
283	S	92	Very high	87.3	Confident	76 Å²	76	59.4 Å²	59.4	53%	0.531	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.8	170.6	-172.5	0	0	0	0	109.7	C143 T144	C143-S283 CarbonylContact C-O 3.56Å; C143-S283 WeakPolarHBondContact CA-O 3.47Å; T144-S283 PolarHBondContact N-O 3.39Å; T144-S283 PolarHBondContact O-N 3.07Å
284	C	88.9	Confident	87.5	Confident	32 Å²	32	61.8 Å²	61.8	22%	0.216	33%	0.327	C	S	.	.			trans	-132	126.6	177.6	-62.5	0	0	0	0	108.6	C143 F286	C143-C284 HydrophobicContact CB-CB 4.15Å; C143-C284 WeakPolarHBondContact CB-SG 3.44Å; C143-C284 WeakPolarHBondContact SG-CB 3.5Å; C143-C284 CovalentContact SG-SG 2.04Å; C143-C284 PolarHBondContact SG-SG 2.83Å; C284-F286 WeakPolarHBondContact CB-O 3.29Å; C284-F286 PolarHBondContact O-N 2.99Å
285	P	82	Confident	87.6	Confident	80 Å²	80	65 Å²	65	52%	0.519	34%	0.342	S	S	.	.	S	Bend	trans	-76	-3.7	175.1	28.4	-29.5	0	0	0	113.1	Y142	Y142-P285 WeakPolarHBondContact O-CD 3.42Å
286	F	79	Confident	87.9	Confident	11 Å²	11	64.4 Å²	64.4	5%	0.048	34%	0.337	C	S	.	.	S	Bend	trans	-138.3	165.9	-177.8	66.7	-76.7	0	0	0	110.6	Q141 C284 K288 Y327 T329	Q141-F286 HydrophobicContact CB-CD1 3.56Å; Q141-F286 HydrophobicContact CB-CE1 3.45Å; Q141-F286 VanDerWaalsContact CB-CE1 3.45Å; Q141-F286 HydrophobicContact CB-CG 4.21Å; Q141-F286 HydrophobicContact CB-CZ 4Å; Q141-F286 HydrophobicContact CG-CD1 4.41Å; C284-F286 WeakPolarHBondContact CB-O 3.29Å; C284-F286 PolarHBondContact O-N 2.99Å; F286-K288 PolarHBondContact O-N 3.06Å; F286-Y327 HydrophobicContact CE2-CD1 4.4Å; F286-Y327 HydrophobicContact CE2-CD2 4.3Å; F286-Y327 AromaticContact CE2-CG 3.92Å; F286-Y327 HydrophobicContact CE2-CG 3.92Å; F286-Y327 HydrophobicContact CZ-CD1 4.5Å; F286-Y327 AromaticContact CZ-CD2 3.62Å; F286-Y327 HydrophobicContact CZ-CD2 3.62Å; F286-Y327 HydrophobicContact CZ-CE2 4.43Å; F286-Y327 AromaticContact CZ-CG 3.67Å; F286-Y327 HydrophobicContact CZ-CG 3.67Å; F286-T329 HydrophobicContact CD2-CG2 3.52Å; F286-T329 HydrophobicContact CE2-CG2 3.57Å; F286-T329 HydrophobicContact CG-CG2 4.23Å; F286-T329 HydrophobicContact CZ-CG2 4.31Å
287	S	81.1	Confident	88	Confident	11 Å²	11	66.6 Å²	66.6	8%	0.077	35%	0.345	C	S	.	.			trans	-74.7	121.7	170.5	-175.3	0	0	0	0	110	E289 L290 V494 C495	S287-E289 PolarHBondContact O-N 3.45Å; S287-E289 VanDerWaalsContact O-N 3.09Å; S287-E289 WeakPolarHBondContact OG-CB 3.31Å; S287-E289 PolarHBondContact OG-N 2.94Å; S287-L290 WeakPolarHBondContact O-CB 3.47Å; S287-L290 PolarHBondContact O-N 2.85Å; S287-V494 VanDerWaalsContact CB-CG1 3.4Å; S287-C495 WeakPolarHBondContact CB-O 3.28Å
288	K	82.8	Confident	88.1	Confident	77 Å²	77	65.5 Å²	65.5	34%	0.335	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-56.7	-24.4	171.8	-71	-173.6	-73.3	-177.1	0	113.1	E282 F286 L290 G291 Y327	E282-K288 IonicContact OE1-NZ 2.6Å; E282-K288 PolarHBondContact OE1-NZ 3.49Å; E282-K288 VanDerWaalsContact OE2-CE 3.3Å; E282-K288 WeakPolarHBondContact OE2-CE 3.31Å; E282-K288 IonicContact OE2-NZ 2.95Å; E282-K288 PolarHBondContact OE2-NZ 3.07Å; F286-K288 PolarHBondContact O-N 3.06Å; K288-L290 PolarHBondContact O-N 2.87Å; K288-G291 PolarHBondContact O-N 3.22Å; K288-G291 VanDerWaalsContact O-N 3.1Å; K288-Y327 HydrophobicContact CB-CE1 4.08Å; K288-Y327 HydrophobicContact CD-CE1 4.08Å; K288-Y327 HydrophobicContact CD-CE2 4.25Å; K288-Y327 WeakPolarHBondContact CD-OH 3.36Å; K288-Y327 HydrophobicContact CG-CE1 3.94Å; K288-Y327 HydrophobicContact CG-CE2 4.31Å
289	E	75.2	Confident	88.2	Confident	137 Å²	137	67.8 Å²	67.8	64%	0.64	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-64.3	-25.2	175	-57.9	178.6	170.3	0	0	112.4	S287 G291 A443	S287-E289 PolarHBondContact O-N 3.45Å; S287-E289 VanDerWaalsContact O-N 3.09Å; S287-E289 WeakPolarHBondContact OG-CB 3.31Å; S287-E289 PolarHBondContact OG-N 2.94Å; E289-G291 VanDerWaalsContact C-N 3.34Å; E289-A443 VanDerWaalsContact O-CA 3.28Å; E289-A443 WeakPolarHBondContact O-CA 3.27Å; E289-A443 WeakPolarHBondContact O-CB 3.39Å
290	L	73.3	Confident	88.1	Confident	16 Å²	16	69.3 Å²	69.3	8%	0.084	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-80.1	-18.5	175.9	-64.6	179.1	0	0	0	112.7	S287 K288 A444 C495 K498	S287-L290 WeakPolarHBondContact O-CB 3.47Å; S287-L290 PolarHBondContact O-N 2.85Å; K288-L290 PolarHBondContact O-N 2.87Å; L290-A444 WeakPolarHBondContact O-CB 3.34Å; L290-A444 PolarHBondContact O-N 3.11Å; L290-C495 HydrophobicContact CD1-CB 4.49Å; L290-C495 WeakPolarHBondContact CD1-O 3.39Å; L290-K498 HydrophobicContact CD1-CD 4.45Å; L290-K498 HydrophobicContact CD1-CG 4.34Å
291	G	78.3	Confident	87.9	Confident	13 Å²	13	68.6 Å²	68.6	13%	0.134	38%	0.382	C	S	.	.	S	Bend	trans	-112.1	159.6	-174.2	0	0	0	0	0	113.6	K288 E289 V328	K288-G291 PolarHBondContact O-N 3.22Å; K288-G291 VanDerWaalsContact O-N 3.1Å; E289-G291 VanDerWaalsContact C-N 3.34Å; G291-V328 VanDerWaalsContact CA-O 3.32Å; G291-V328 WeakPolarHBondContact CA-O 3.15Å
292	K	82.1	Confident	87.8	Confident	143 Å²	143	67.8 Å²	67.8	62%	0.622	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.9	165.8	-177.5	-178.6	177.3	-175	0	108.8	T294 Y327 V328 A444	K292-T294 PolarHBondContact O-N 2.9Å; K292-Y327 CarbonylContact O-C 3.55Å; K292-Y327 VanDerWaalsContact O-CA 3.25Å; K292-Y327 WeakPolarHBondContact O-CA 3.44Å; K292-V328 PolarHBondContact N-O 3.33Å; K292-V328 PolarHBondContact O-N 3.48Å; K292-A444 HydrophobicContact CB-CB 3.78Å
293	L	87.2	Confident	87.9	Confident	80 Å²	80	64.6 Å²	64.6	42%	0.419	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	122.3	173.1	-178.1	69.2	0	0	0	109.1	K295 D325 Y327	L293-K295 WeakPolarHBondContact CD1-O 3.13Å; L293-D325 HydrophobicContact CD1-CB 3.66Å; L293-Y327 HydrophobicContact CB-CD1 4.07Å; L293-Y327 HydrophobicContact CB-CE1 3.7Å; L293-Y327 HydrophobicContact CD1-CD2 4.19Å; L293-Y327 HydrophobicContact CD1-CE1 4.19Å; L293-Y327 HydrophobicContact CD1-CE2 3.71Å; L293-Y327 VanDerWaalsContact N-CD1 3.34Å
294	T	87.8	Confident	88.1	Confident	78 Å²	78	66.2 Å²	66.2	48%	0.479	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-28	178.5	50.9	0	0	0	0	112.5	K292 T326 V328	K292-T294 PolarHBondContact O-N 2.9Å; T294-T326 PolarHBondContact N-O 3.16Å; T294-T326 PolarHBondContact OG1-O 2.73Å; T294-V328 HydrophobicContact CG2-CB 4.17Å; T294-V328 HydrophobicContact CG2-CG2 3.51Å
295	K	91.9	Very high	88.3	Confident	105 Å²	105	68 Å²	68	46%	0.457	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	143.8	-174.8	-160.2	-176.5	-179.9	-159.5	0	110.9	L293 E297 D325 T326	L293-K295 WeakPolarHBondContact CD1-O 3.13Å; K295-E297 HydrophobicContact CD-CG 3.99Å; K295-E297 WeakPolarHBondContact CD-OE2 3.34Å; K295-E297 VanDerWaalsContact CE-OE1 3.27Å; K295-E297 WeakPolarHBondContact CE-OE1 3.07Å; K295-E297 VanDerWaalsContact CE-OE2 3.26Å; K295-E297 WeakPolarHBondContact CE-OE2 3.1Å; K295-E297 HydrophobicContact CG-CG 4.04Å; K295-E297 IonicContact NZ-OE1 3.84Å; K295-E297 PolarHBondContact NZ-OE1 3.12Å; K295-E297 IonicContact NZ-OE2 3.12Å; K295-E297 PolarHBondContact NZ-OE2 2.76Å; K295-D325 CarbonylContact O-C 3.53Å; K295-D325 WeakPolarHBondContact O-CA 3.4Å; K295-T326 PolarHBondContact N-O 3.18Å; K295-T326 PolarHBondContact O-N 2.79Å
296	T	96.6	Very high	88.9	Confident	66 Å²	66	67.8 Å²	67.8	41%	0.405	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.8	169.9	-70.3	0	0	0	0	108	Y323 D325	T296-Y323 HydrophobicContact CG2-CD1 3.44Å; T296-Y323 VanDerWaalsContact CG2-CD1 3.44Å; T296-Y323 HydrophobicContact CG2-CE1 3.97Å; T296-Y323 HydrophobicContact CG2-CG 4.13Å; T296-D325 VanDerWaalsContact CB-OD1 3.25Å; T296-D325 WeakPolarHBondContact CB-OD1 3.33Å; T296-D325 WeakPolarHBondContact CG2-OD1 3.49Å; T296-D325 PolarHBondContact OG1-OD1 3.32Å
297	E	96.2	Very high	89.6	Confident	75 Å²	75	70.3 Å²	70.3	35%	0.35	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138	-177	-63.6	-176.5	95.2	0	0	110.6	K295 T299 Y323 R324	K295-E297 HydrophobicContact CD-CG 3.99Å; K295-E297 WeakPolarHBondContact CD-OE2 3.34Å; K295-E297 VanDerWaalsContact CE-OE1 3.27Å; K295-E297 WeakPolarHBondContact CE-OE1 3.07Å; K295-E297 VanDerWaalsContact CE-OE2 3.26Å; K295-E297 WeakPolarHBondContact CE-OE2 3.1Å; K295-E297 HydrophobicContact CG-CG 4.04Å; K295-E297 IonicContact NZ-OE1 3.84Å; K295-E297 PolarHBondContact NZ-OE1 3.12Å; K295-E297 IonicContact NZ-OE2 3.12Å; K295-E297 PolarHBondContact NZ-OE2 2.76Å; E297-T299 PolarHBondContact O-N 2.88Å; E297-Y323 CarbonylContact O-C 3.58Å; E297-Y323 WeakPolarHBondContact O-CA 3.39Å; E297-R324 PolarHBondContact N-O 3.2Å; E297-R324 PolarHBondContact O-N 2.68Å
298	C	97.2	Very high	90.1	Very high	66 Å²	66	75 Å²	75	45%	0.446	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113.9	172.5	-176	0	0	0	0	109.6	E300 C320 A322 Y323	C298-E300 PolarHBondContact SG-O 3.29Å; C298-C320 WeakPolarHBondContact CA-SG 3.35Å; C298-C320 HydrophobicContact CB-CB 3.9Å; C298-C320 WeakPolarHBondContact CB-SG 3.27Å; C298-C320 WeakPolarHBondContact SG-CB 3.4Å; C298-C320 CovalentContact SG-SG 2.02Å; C298-C320 PolarHBondContact SG-SG 2.95Å; C298-A322 CarbonylContact C-O 3.52Å; C298-Y323 HydrophobicContact CB-CE1 4.34Å
299	T	96.4	Very high	90.3	Very high	80 Å²	80	75.4 Å²	75.4	49%	0.491	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-19.3	178.2	53.7	0	0	0	0	113.2	E297 A322 R324	E297-T299 PolarHBondContact O-N 2.88Å; T299-A322 PolarHBondContact N-O 3.47Å; T299-A322 WeakPolarHBondContact OG1-CB 3.49Å; T299-A322 PolarHBondContact OG1-O 2.04Å; T299-A322 VanDerWaalsContact OG1-O 3.06Å; T299-R324 HydrophobicContact CG2-CB 3.5Å
300	E	95.2	Very high	90.6	Very high	74 Å²	74	74.5 Å²	74.5	35%	0.346	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	114.8	169.5	-166.8	-169.6	156.1	0	0	110	C298 R305 C320 W321 A322	C298-E300 PolarHBondContact SG-O 3.29Å; E300-R305 IonicContact OE1-CZ 2.9Å; E300-R305 IonicContact OE1-NE 2.84Å; E300-R305 IonicContact OE1-NH2 3.34Å; E300-R305 PolarHBondContact OE1-NH2 2.93Å; E300-R305 IonicContact OE2-NH2 2.88Å; E300-R305 PolarHBondContact OE2-NH2 2.97Å; E300-C320 PolarHBondContact O-SG 2.65Å; E300-W321 HydrophobicContact CB-CB 4.18Å; E300-W321 HydrophobicContact CG-CB 4.12Å; E300-W321 PolarHBondContact O-N 3.3Å; E300-A322 HydrophobicContact CB-CB 3.56Å; E300-A322 PolarHBondContact N-O 3.4Å; E300-A322 VanDerWaalsContact N-O 3.16Å
301	A	92.6	Very high	91.1	Very high	79 Å²	79	77.4 Å²	77.4	65%	0.653	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.1	143.2	-170.4	0	0	0	0	0	113.1
302	G	94.2	Very high	91.4	Very high	35 Å²	35	81.1 Å²	81.1	36%	0.361	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	162.6	172.3	0	0	0	0	0	113.1	Q318 S319	G302-Q318 CarbonylContact C-O 3.6Å; G302-Q318 WeakPolarHBondContact CA-O 3.28Å; G302-S319 WeakPolarHBondContact CA-O 3.31Å; G302-S319 PolarHBondContact N-O 2.87Å
303	G	96	Very high	91.8	Very high	22 Å²	22	77.9 Å²	77.9	23%	0.227	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.3	179.6	-179.8	0	0	0	0	0	112.3	Q318 W321	G303-Q318 PolarHBondContact N-O 2.83Å; G303-Q318 PolarHBondContact O-N 2.83Å; G303-Q318 VanDerWaalsContact O-N 3.11Å; G303-W321 PolarHBondContact O-NE1 2.88Å
304	N	95.5	Very high	92	Very high	110 Å²	110	74.8 Å²	74.8	59%	0.588	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.9	174.2	-71.7	-47.8	0	0	0	110.4	M316 Y317	N304-M316 WeakPolarHBondContact CA-O 3.46Å; N304-Y317 WeakPolarHBondContact OD1-CA 3.42Å; N304-Y317 VanDerWaalsContact OD1-CB 3.28Å; N304-Y317 WeakPolarHBondContact OD1-CB 3.38Å; N304-Y317 PolarHBondContact OD1-N 2.03Å
305	R	94.6	Very high	92.3	Very high	71 Å²	71	74 Å²	74	27%	0.268	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	152.2	160.6	-75.5	-176.7	178.1	174.7	-8.1	109.4	A147 M149 E300 S315 M316 W321	A147-R305 PolarHBondContact O-NH1 3.37Å; M149-R305 HydrophobicContact SD-CB 4.28Å; E300-R305 IonicContact OE1-CZ 2.9Å; E300-R305 IonicContact OE1-NE 2.84Å; E300-R305 IonicContact OE1-NH2 3.34Å; E300-R305 PolarHBondContact OE1-NH2 2.93Å; E300-R305 IonicContact OE2-NH2 2.88Å; E300-R305 PolarHBondContact OE2-NH2 2.97Å; R305-S315 CarbonylContact O-C 3.53Å; R305-S315 VanDerWaalsContact O-CA 3.28Å; R305-S315 WeakPolarHBondContact O-CA 3.05Å; R305-S315 PolarHBondContact O-OG 2.8Å; R305-M316 PolarHBondContact N-O 3.37Å; R305-M316 PolarHBondContact O-N 3.23Å; R305-W321 HydrophobicContact CB-CH2 3.96Å; R305-W321 HydrophobicContact CB-CZ2 3.56Å; R305-W321 VanDerWaalsContact CD-CE2 3.43Å; R305-W321 HydrophobicContact CG-CD2 4.1Å; R305-W321 VanDerWaalsContact CG-CE2 3.49Å; R305-W321 HydrophobicContact CG-CH2 4.15Å; R305-W321 HydrophobicContact CG-CZ2 3.53Å
306	T	94.5	Very high	92.4	Very high	75 Å²	75	70.9 Å²	70.9	46%	0.46	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.1	-173.4	-58.3	0	0	0	0	110.1	S313 Y314 S315	T306-S313 WeakPolarHBondContact CG2-OG 3.38Å; T306-Y314 CarbonylContact C-O 3.52Å; T306-Y314 VanDerWaalsContact CA-O 3.26Å; T306-Y314 WeakPolarHBondContact CA-O 3.39Å; T306-S315 PolarHBondContact OG1-OG 2.91Å
307	L	93.1	Very high	92.4	Very high	64 Å²	64	74.6 Å²	74.6	34%	0.335	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.2	170.9	-67.1	177.5	0	0	0	109.3	M149 L151 Y314	M149-L307 HydrophobicContact CB-CD1 4.17Å; M149-L307 HydrophobicContact CE-CB 4Å; M149-L307 HydrophobicContact CE-CD1 4.01Å; M149-L307 HydrophobicContact CE-CG 3.95Å; M149-L307 HydrophobicContact CG-CD1 3.81Å; M149-L307 HydrophobicContact CG-CG 4.27Å; M149-L307 WeakPolarHBondContact O-CD1 3.26Å; M149-L307 HydrophobicContact SD-CD1 4.1Å; M149-L307 HydrophobicContact SD-CG 3.93Å; L151-L307 HydrophobicContact CD1-CB 4.15Å; L151-L307 HydrophobicContact CD2-CD1 4.42Å; L151-L307 HydrophobicContact CG-CB 4.35Å; L151-L307 HydrophobicContact CG-CD1 3.96Å; L307-Y314 PolarHBondContact N-O 2.81Å; L307-Y314 PolarHBondContact O-N 2.89Å
308	V	90.5	Very high	92.4	Very high	110 Å²	110	73.1 Å²	73.1	67%	0.667	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.4	175.8	-178.5	0	0	0	0	108.7	Q312	V308-Q312 WeakPolarHBondContact CA-O 3.23Å
309	K	86.9	Confident	92.3	Very high	84 Å²	84	73.5 Å²	73.5	37%	0.365	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	130.8	174.2	-168.8	161.5	-174.1	176.8	0	110.1	L151 Y274 G311 Q312 Y314	L151-K309 HydrophobicContact CD1-CB 3.59Å; L151-K309 HydrophobicContact CD1-CD 3.82Å; L151-K309 HydrophobicContact CD1-CG 4.35Å; Y274-K309 HydrophobicContact CD1-CD 4.03Å; Y274-K309 HydrophobicContact CD2-CD 4.32Å; Y274-K309 HydrophobicContact CD2-CG 4.38Å; Y274-K309 HydrophobicContact CE1-CD 3.67Å; Y274-K309 HydrophobicContact CE1-CG 4.47Å; Y274-K309 HydrophobicContact CE2-CB 4.48Å; Y274-K309 HydrophobicContact CE2-CD 3.98Å; Y274-K309 HydrophobicContact CE2-CG 3.9Å; Y274-K309 HydrophobicContact CG-CD 4.34Å; Y274-K309 VanDerWaalsContact CZ-CE 3.48Å; Y274-K309 WeakPolarHBondContact OH-CE 3.2Å; K309-G311 PolarHBondContact O-N 3.45Å; K309-Q312 PolarHBondContact N-O 3.42Å; K309-Q312 PolarHBondContact O-N 3.21Å; K309-Y314 HydrophobicContact CB-CE2 4.22Å
310	D	83.3	Confident	92.4	Very high	119 Å²	119	69.7 Å²	69.7	64%	0.636	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	37.4	-176.6	-54.8	-34.4	0	0	0	113.2	Y274 Q312	Y274-D310 WeakPolarHBondContact CE2-OD2 3.44Å; Y274-D310 PolarHBondContact OH-OD2 3.39Å; D310-Q312 PolarHBondContact O-N 3Å
311	G	82.7	Confident	92.5	Very high	77 Å²	77	66.4 Å²	66.4	79%	0.794	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	-5.4	-178.3	0	0	0	0	0	115.1	K309	K309-G311 PolarHBondContact O-N 3.45Å
312	Q	84.2	Confident	92.7	Very high	91 Å²	91	63 Å²	63	43%	0.425	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.6	174.9	-174.2	169.3	-12	0	0	110.7	V308 K309 D310 Y314	V308-Q312 WeakPolarHBondContact CA-O 3.23Å; K309-Q312 PolarHBondContact N-O 3.42Å; K309-Q312 PolarHBondContact O-N 3.21Å; D310-Q312 PolarHBondContact O-N 3Å; Q312-Y314 HydrophobicContact CB-CE2 3.84Å; Q312-Y314 VanDerWaalsContact CD-OH 3.22Å; Q312-Y314 HydrophobicContact CG-CE1 4.28Å; Q312-Y314 HydrophobicContact CG-CE2 3.92Å; Q312-Y314 WeakPolarHBondContact O-CD2 3.36Å; Q312-Y314 WeakPolarHBondContact O-CE2 3.21Å; Q312-Y314 PolarHBondContact OE1-OH 3.47Å
313	S	91.7	Very high	92.9	Very high	74 Å²	74	63.6 Å²	63.6	52%	0.517	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.9	176.4	-173.4	0	0	0	0	110.2	T306	T306-S313 WeakPolarHBondContact CG2-OG 3.38Å
314	Y	91.6	Very high	93	Very high	16 Å²	16	67.2 Å²	67.2	6%	0.063	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.5	176	-61.1	-87.5	0	0	0	107.8	M149 L151 Y274 T306 L307 K309 Q312	M149-Y314 WeakPolarHBondContact CE-O 3.2Å; L151-Y314 HydrophobicContact CD1-CD2 3.9Å; L151-Y314 HydrophobicContact CD1-CE2 4.42Å; L151-Y314 HydrophobicContact CD1-CG 4.43Å; L151-Y314 HydrophobicContact CD2-CD1 4.41Å; L151-Y314 HydrophobicContact CD2-CD2 4.14Å; L151-Y314 HydrophobicContact CD2-CG 3.82Å; Y274-Y314 HydrophobicContact CD2-CE2 4.06Å; Y274-Y314 AromaticContact CD2-CZ 3.81Å; Y274-Y314 WeakPolarHBondContact CD2-OH 3.32Å; Y274-Y314 WeakPolarHBondContact O-CD1 3.47Å; Y274-Y314 WeakPolarHBondContact O-CE1 3.27Å; T306-Y314 CarbonylContact C-O 3.52Å; T306-Y314 VanDerWaalsContact CA-O 3.26Å; T306-Y314 WeakPolarHBondContact CA-O 3.39Å; L307-Y314 PolarHBondContact N-O 2.81Å; L307-Y314 PolarHBondContact O-N 2.89Å; K309-Y314 HydrophobicContact CB-CE2 4.22Å; Q312-Y314 HydrophobicContact CB-CE2 3.84Å; Q312-Y314 VanDerWaalsContact CD-OH 3.22Å; Q312-Y314 HydrophobicContact CG-CE1 4.28Å; Q312-Y314 HydrophobicContact CG-CE2 3.92Å; Q312-Y314 WeakPolarHBondContact O-CD2 3.36Å; Q312-Y314 WeakPolarHBondContact O-CE2 3.21Å; Q312-Y314 PolarHBondContact OE1-OH 3.47Å
315	S	93.8	Very high	93	Very high	62 Å²	62	62.1 Å²	62.1	43%	0.434	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.8	180	-165	0	0	0	0	110.8	R305 T306	R305-S315 CarbonylContact O-C 3.53Å; R305-S315 VanDerWaalsContact O-CA 3.28Å; R305-S315 WeakPolarHBondContact O-CA 3.05Å; R305-S315 PolarHBondContact O-OG 2.8Å; T306-S315 PolarHBondContact OG1-OG 2.91Å
316	M	93.9	Very high	92.8	Very high	39 Å²	39	59.4 Å²	59.4	19%	0.192	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.1	175.7	175.5	170.7	-77.3	0	0	110.3	M149 P276 V278 N304 R305	M149-M316 HydrophobicContact CE-CB 4.26Å; M149-M316 HydrophobicContact CG-CB 4.43Å; M149-M316 HydrophobicContact SD-CB 3.93Å; P276-M316 HydrophobicContact CB-CB 4.37Å; P276-M316 HydrophobicContact CB-CE 3.84Å; P276-M316 HydrophobicContact CG-CE 3.9Å; P276-M316 WeakPolarHBondContact O-CE 3.42Å; V278-M316 HydrophobicContact CG2-SD 3.33Å; V278-M316 WeakPolarHBondContact CG2-SD 3.42Å; N304-M316 WeakPolarHBondContact CA-O 3.46Å; R305-M316 PolarHBondContact N-O 3.37Å; R305-M316 PolarHBondContact O-N 3.23Å
317	Y	96.3	Very high	92.5	Very high	143 Å²	143	56.9 Å²	56.9	56%	0.561	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	139.2	172.5	-177.1	-99.4	0	0	0	111.1	N304	N304-Y317 WeakPolarHBondContact OD1-CA 3.42Å; N304-Y317 VanDerWaalsContact OD1-CB 3.28Å; N304-Y317 WeakPolarHBondContact OD1-CB 3.38Å; N304-Y317 PolarHBondContact OD1-N 2.03Å
318	Q	96.3	Very high	92.1	Very high	45 Å²	45	54.3 Å²	54.3	21%	0.21	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.2	159.1	-71.3	-66.1	-42.7	0	0	109.4	V278 G302 G303 C320 W321	V278-Q318 HydrophobicContact CG2-CG 3.89Å; G302-Q318 CarbonylContact C-O 3.6Å; G302-Q318 WeakPolarHBondContact CA-O 3.28Å; G303-Q318 PolarHBondContact N-O 2.83Å; G303-Q318 PolarHBondContact O-N 2.83Å; G303-Q318 VanDerWaalsContact O-N 3.11Å; Q318-C320 PolarHBondContact O-N 2.92Å; Q318-W321 HydrophobicContact CB-CD2 3.92Å; Q318-W321 HydrophobicContact CB-CE3 4.29Å; Q318-W321 HydrophobicContact CB-CG 4.47Å; Q318-W321 HydrophobicContact CB-CH2 4.14Å; Q318-W321 HydrophobicContact CB-CZ2 3.74Å; Q318-W321 HydrophobicContact CB-CZ3 4.4Å; Q318-W321 HydrophobicContact CG-CD2 4.08Å; Q318-W321 HydrophobicContact CG-CE3 3.95Å; Q318-W321 HydrophobicContact CG-CH2 3.43Å; Q318-W321 VanDerWaalsContact CG-CH2 3.43Å; Q318-W321 HydrophobicContact CG-CZ2 3.55Å; Q318-W321 HydrophobicContact CG-CZ3 3.64Å
319	S	95.2	Very high	91.6	Very high	73 Å²	73	50.1 Å²	50.1	51%	0.51	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	-22.2	172.3	52.3	0	0	0	0	112.4	G302	G302-S319 WeakPolarHBondContact CA-O 3.31Å; G302-S319 PolarHBondContact N-O 2.87Å
320	C	97.7	Very high	91.2	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.007	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	143.2	175.8	-169.2	0	0	0	0	109.9	C298 E300 Q318 A322 Y323	C298-C320 WeakPolarHBondContact CA-SG 3.35Å; C298-C320 HydrophobicContact CB-CB 3.9Å; C298-C320 WeakPolarHBondContact CB-SG 3.27Å; C298-C320 WeakPolarHBondContact SG-CB 3.4Å; C298-C320 CovalentContact SG-SG 2.02Å; C298-C320 PolarHBondContact SG-SG 2.95Å; E300-C320 PolarHBondContact O-SG 2.65Å; Q318-C320 PolarHBondContact O-N 2.92Å; C320-A322 PolarHBondContact SG-O 2.88Å; C320-Y323 HydrophobicContact CB-CD1 4.45Å; C320-Y323 HydrophobicContact CB-CD2 4.41Å; C320-Y323 HydrophobicContact CB-CE1 3.74Å; C320-Y323 HydrophobicContact CB-CE2 3.68Å; C320-Y323 VanDerWaalsContact CB-OH 3.28Å; C320-Y323 WeakPolarHBondContact CB-OH 3.31Å
321	W	97.4	Very high	91	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-16.5	179	-72.8	104.6	0	0	0	113.8	A147 M149 V278 E300 G303 R305 Q318	A147-W321 HydrophobicContact CB-CE3 3.58Å; A147-W321 HydrophobicContact CB-CZ3 4.04Å; A147-W321 WeakPolarHBondContact CB-O 3.31Å; A147-W321 PolarHBondContact N-O 2.87Å; M149-W321 HydrophobicContact CB-CH2 4.17Å; M149-W321 HydrophobicContact CB-CZ3 4.32Å; V278-W321 HydrophobicContact CG2-CH2 4.23Å; V278-W321 HydrophobicContact CG2-CZ3 4.06Å; E300-W321 HydrophobicContact CB-CB 4.18Å; E300-W321 HydrophobicContact CG-CB 4.12Å; E300-W321 PolarHBondContact O-N 3.3Å; G303-W321 PolarHBondContact O-NE1 2.88Å; R305-W321 HydrophobicContact CB-CH2 3.96Å; R305-W321 HydrophobicContact CB-CZ2 3.56Å; R305-W321 VanDerWaalsContact CD-CE2 3.43Å; R305-W321 HydrophobicContact CG-CD2 4.1Å; R305-W321 VanDerWaalsContact CG-CE2 3.49Å; R305-W321 HydrophobicContact CG-CH2 4.15Å; R305-W321 HydrophobicContact CG-CZ2 3.53Å; Q318-W321 HydrophobicContact CB-CD2 3.92Å; Q318-W321 HydrophobicContact CB-CE3 4.29Å; Q318-W321 HydrophobicContact CB-CG 4.47Å; Q318-W321 HydrophobicContact CB-CH2 4.14Å; Q318-W321 HydrophobicContact CB-CZ2 3.74Å; Q318-W321 HydrophobicContact CB-CZ3 4.4Å; Q318-W321 HydrophobicContact CG-CD2 4.08Å; Q318-W321 HydrophobicContact CG-CE3 3.95Å; Q318-W321 HydrophobicContact CG-CH2 3.43Å; Q318-W321 VanDerWaalsContact CG-CH2 3.43Å; Q318-W321 HydrophobicContact CG-CZ2 3.55Å; Q318-W321 HydrophobicContact CG-CZ3 3.64Å
322	A	98.2	Very high	91.1	Very high	8 Å²	8	41.5 Å²	41.5	7%	0.066	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	136	172.4	0	0	0	0	0	111.1	R145 T146 C298 T299 E300 C320	R145-A322 CarbonylContact O-C 3.52Å; R145-A322 WeakPolarHBondContact O-CA 3.48Å; T146-A322 HydrophobicContact CG2-CB 4.41Å; C298-A322 CarbonylContact C-O 3.52Å; T299-A322 PolarHBondContact N-O 3.47Å; T299-A322 WeakPolarHBondContact OG1-CB 3.49Å; T299-A322 PolarHBondContact OG1-O 2.04Å; T299-A322 VanDerWaalsContact OG1-O 3.06Å; E300-A322 HydrophobicContact CB-CB 3.56Å; E300-A322 PolarHBondContact N-O 3.4Å; E300-A322 VanDerWaalsContact N-O 3.16Å; C320-A322 PolarHBondContact SG-O 2.88Å
323	Y	97.7	Very high	91	Very high	48 Å²	48	37.8 Å²	37.8	19%	0.188	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.9	176.5	-69.4	-82.2	0	0	0	111.5	T144 R145 W280 T296 E297 C298 C320	T144-Y323 WeakPolarHBondContact CA-O 3.46Å; R145-Y323 PolarHBondContact N-O 3.24Å; R145-Y323 PolarHBondContact O-N 3.2Å; W280-Y323 AromaticContact CH2-CD2 3.45Å; W280-Y323 HydrophobicContact CH2-CD2 3.45Å; W280-Y323 VanDerWaalsContact CH2-CD2 3.45Å; W280-Y323 AromaticContact CH2-CE2 3.45Å; W280-Y323 HydrophobicContact CH2-CE2 3.45Å; W280-Y323 VanDerWaalsContact CH2-CE2 3.45Å; W280-Y323 HydrophobicContact CZ2-CD2 4.33Å; W280-Y323 HydrophobicContact CZ2-CE2 4.01Å; W280-Y323 AromaticContact CZ3-CD2 3.71Å; W280-Y323 HydrophobicContact CZ3-CD2 3.71Å; W280-Y323 HydrophobicContact CZ3-CE2 4.19Å; T296-Y323 HydrophobicContact CG2-CD1 3.44Å; T296-Y323 VanDerWaalsContact CG2-CD1 3.44Å; T296-Y323 HydrophobicContact CG2-CE1 3.97Å; T296-Y323 HydrophobicContact CG2-CG 4.13Å; E297-Y323 CarbonylContact O-C 3.58Å; E297-Y323 WeakPolarHBondContact O-CA 3.39Å; C298-Y323 HydrophobicContact CB-CE1 4.34Å; C320-Y323 HydrophobicContact CB-CD1 4.45Å; C320-Y323 HydrophobicContact CB-CD2 4.41Å; C320-Y323 HydrophobicContact CB-CE1 3.74Å; C320-Y323 HydrophobicContact CB-CE2 3.68Å; C320-Y323 VanDerWaalsContact CB-OH 3.28Å; C320-Y323 WeakPolarHBondContact CB-OH 3.31Å
324	R	97.1	Very high	90.8	Very high	98 Å²	98	38 Å²	38	37%	0.37	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.2	159.9	179.5	-176	-67	-165.1	-3.1	108.2	Y142 C143 E297 T299	Y142-R324 HydrophobicContact CD2-CG 4.45Å; Y142-R324 HydrophobicContact CG-CG 4.34Å; C143-R324 WeakPolarHBondContact O-CA 3Å; E297-R324 PolarHBondContact N-O 3.2Å; E297-R324 PolarHBondContact O-N 2.68Å; T299-R324 HydrophobicContact CG2-CB 3.5Å
325	D	95.4	Very high	90.6	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.011	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.8	178.7	-67.2	-41.2	0	0	0	109.3	Y142 C143 R145 L293 K295 T296 Y327	Y142-D325 CarbonylContact C-O 3.49Å; Y142-D325 WeakPolarHBondContact CA-O 3.18Å; C143-D325 HydrophobicContact CB-CB 4.41Å; C143-D325 PolarHBondContact N-O 3.39Å; C143-D325 PolarHBondContact O-N 2.84Å; R145-D325 IonicContact CZ-OD2 3.76Å; R145-D325 IonicContact NE-OD2 2.66Å; R145-D325 PolarHBondContact NE-OD2 3.11Å; R145-D325 IonicContact NH2-OD1 2.71Å; R145-D325 PolarHBondContact NH2-OD1 2.99Å; R145-D325 IonicContact NH2-OD2 3.6Å; R145-D325 PolarHBondContact NH2-OD2 3.17Å; L293-D325 HydrophobicContact CD1-CB 3.66Å; K295-D325 CarbonylContact O-C 3.53Å; K295-D325 WeakPolarHBondContact O-CA 3.4Å; T296-D325 VanDerWaalsContact CB-OD1 3.25Å; T296-D325 WeakPolarHBondContact CB-OD1 3.33Å; T296-D325 WeakPolarHBondContact CG2-OD1 3.49Å; T296-D325 PolarHBondContact OG1-OD1 3.32Å; D325-Y327 HydrophobicContact CB-CD2 4.41Å; D325-Y327 HydrophobicContact CB-CE2 3.63Å; D325-Y327 WeakPolarHBondContact O-CD2 3.07Å
326	T	91.6	Very high	90.2	Very high	15 Å²	15	36.1 Å²	36.1	9%	0.092	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.2	179.3	-53.8	0	0	0	0	110.5	E140 T294 K295	E140-T326 HydrophobicContact CB-CG2 3.99Å; E140-T326 HydrophobicContact CG-CG2 4.34Å; T294-T326 PolarHBondContact N-O 3.16Å; T294-T326 PolarHBondContact OG1-O 2.73Å; K295-T326 PolarHBondContact N-O 3.18Å; K295-T326 PolarHBondContact O-N 2.79Å
327	Y	87.2	Confident	90.1	Very high	22 Å²	22	34.2 Å²	34.2	9%	0.086	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.7	177.5	-66.3	-107.4	0	0	0	109.8	E140 Q141 C143 F286 K288 K292 L293 D325 T329	E140-Y327 CarbonylContact C-O 3.54Å; E140-Y327 WeakPolarHBondContact CA-O 3.29Å; Q141-Y327 PolarHBondContact N-O 2.91Å; Q141-Y327 PolarHBondContact O-N 2.65Å; C143-Y327 HydrophobicContact CB-CE2 4.13Å; F286-Y327 HydrophobicContact CE2-CD1 4.4Å; F286-Y327 HydrophobicContact CE2-CD2 4.3Å; F286-Y327 AromaticContact CE2-CG 3.92Å; F286-Y327 HydrophobicContact CE2-CG 3.92Å; F286-Y327 HydrophobicContact CZ-CD1 4.5Å; F286-Y327 AromaticContact CZ-CD2 3.62Å; F286-Y327 HydrophobicContact CZ-CD2 3.62Å; F286-Y327 HydrophobicContact CZ-CE2 4.43Å; F286-Y327 AromaticContact CZ-CG 3.67Å; F286-Y327 HydrophobicContact CZ-CG 3.67Å; K288-Y327 HydrophobicContact CB-CE1 4.08Å; K288-Y327 HydrophobicContact CD-CE1 4.08Å; K288-Y327 HydrophobicContact CD-CE2 4.25Å; K288-Y327 WeakPolarHBondContact CD-OH 3.36Å; K288-Y327 HydrophobicContact CG-CE1 3.94Å; K288-Y327 HydrophobicContact CG-CE2 4.31Å; K292-Y327 CarbonylContact O-C 3.55Å; K292-Y327 VanDerWaalsContact O-CA 3.25Å; K292-Y327 WeakPolarHBondContact O-CA 3.44Å; L293-Y327 HydrophobicContact CB-CD1 4.07Å; L293-Y327 HydrophobicContact CB-CE1 3.7Å; L293-Y327 HydrophobicContact CD1-CD2 4.19Å; L293-Y327 HydrophobicContact CD1-CE1 4.19Å; L293-Y327 HydrophobicContact CD1-CE2 3.71Å; L293-Y327 VanDerWaalsContact N-CD1 3.34Å; D325-Y327 HydrophobicContact CB-CD2 4.41Å; D325-Y327 HydrophobicContact CB-CE2 3.63Å; D325-Y327 WeakPolarHBondContact O-CD2 3.07Å; Y327-T329 PolarHBondContact O-N 3.34Å
328	V	85.4	Confident	89.8	Confident	9 Å²	9	30.4 Å²	30.4	6%	0.055	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	109.5	165	174	0	0	0	0	107.6	Q138 V139 E140 G291 K292 T294 Q330 A444	Q138-V328 HydrophobicContact CG-CG1 4.11Å; Q138-V328 HydrophobicContact CG-CG2 4.43Å; V139-V328 WeakPolarHBondContact O-CA 3.31Å; E140-V328 HydrophobicContact CG-CG2 4Å; G291-V328 VanDerWaalsContact CA-O 3.32Å; G291-V328 WeakPolarHBondContact CA-O 3.15Å; K292-V328 PolarHBondContact N-O 3.33Å; K292-V328 PolarHBondContact O-N 3.48Å; T294-V328 HydrophobicContact CG2-CB 4.17Å; T294-V328 HydrophobicContact CG2-CG2 3.51Å; V328-Q330 VanDerWaalsContact CG1-O 3.31Å; V328-Q330 WeakPolarHBondContact CG1-O 3.46Å; V328-A444 WeakPolarHBondContact O-CB 3.47Å
329	T	79.3	Confident	89.3	Confident	23 Å²	23	32.7 Å²	32.7	14%	0.141	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-17.4	179.2	59.9	0	0	0	0	112.6	V139 Q141 F286 Y327	V139-T329 PolarHBondContact O-N 3.07Å; V139-T329 PolarHBondContact O-OG1 3.48Å; Q141-T329 HydrophobicContact CB-CG2 4.12Å; Q141-T329 HydrophobicContact CG-CG2 4.22Å; Q141-T329 VanDerWaalsContact OE1-CG2 3.3Å; Q141-T329 PolarHBondContact OE1-OG1 2.99Å; F286-T329 HydrophobicContact CD2-CG2 3.52Å; F286-T329 HydrophobicContact CE2-CG2 3.57Å; F286-T329 HydrophobicContact CG-CG2 4.23Å; F286-T329 HydrophobicContact CZ-CG2 4.31Å; Y327-T329 PolarHBondContact O-N 3.34Å
330	Q	79.3	Confident	89.1	Confident	6 Å²	6	29.6 Å²	29.6	3%	0.028	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	123.3	165.9	179.8	177.4	-75.5	0	0	108.7	L137 Q138 V139 V328 L363	L137-Q330 PolarHBondContact O-NE2 3.07Å; Q138-Q330 CarbonylContact C-O 3.59Å; Q138-Q330 VanDerWaalsContact CA-O 3.3Å; Q138-Q330 WeakPolarHBondContact CA-O 3.19Å; V139-Q330 HydrophobicContact CB-CB 3.95Å; V139-Q330 HydrophobicContact CG2-CB 3.93Å; V139-Q330 PolarHBondContact N-O 3.42Å; V139-Q330 PolarHBondContact O-N 2.88Å; V328-Q330 VanDerWaalsContact CG1-O 3.31Å; V328-Q330 WeakPolarHBondContact CG1-O 3.46Å; Q330-L363 PolarHBondContact NE2-O 3.06Å
331	S	79.7	Confident	88.6	Confident	42 Å²	42	31.9 Å²	31.9	29%	0.294	17%	0.174	S	C	.	.			trans	-79.2	141.8	168.4	-50.3	0	0	0	0	109.5	K451	S331-K451 PolarHBondContact O-NZ 3.27Å
332	A	83.4	Confident	88.3	Confident	51 Å²	51	36 Å²	36	42%	0.421	20%	0.196	S	C	.	.			trans	-50.3	143.8	171.8	0	0	0	0	0	111.1	D136 Q138 K451	D136-A332 WeakPolarHBondContact O-CA 3.45Å; Q138-A332 HydrophobicContact CB-CB 4.15Å; A332-K451 PolarHBondContact O-NZ 2.89Å; A332-K451 VanDerWaalsContact O-NZ 3.08Å
333	D	83.8	Confident	87.8	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.064	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-135.6	122.7	172.8	-171.5	-9.1	0	0	0	106.8	R135 D136 G335 K451 D452	R135-D333 WeakPolarHBondContact CB-O 3.46Å; D136-D333 HydrophobicContact CB-CB 3.9Å; D136-D333 PolarHBondContact N-O 3.33Å; D136-D333 PolarHBondContact O-N 3.45Å; D333-G335 PolarHBondContact O-N 2.98Å; D333-G335 PolarHBondContact OD1-N 3Å; D333-K451 HydrophobicContact CB-CD 4.33Å; D333-K451 WeakPolarHBondContact OD2-CA 3.38Å; D333-K451 VanDerWaalsContact OD2-CB 3.32Å; D333-K451 WeakPolarHBondContact OD2-CB 3.28Å; D333-K451 WeakPolarHBondContact OD2-CD 3.47Å; D333-K451 VanDerWaalsContact OD2-CG 3.27Å; D333-K451 WeakPolarHBondContact OD2-CG 3.25Å; D333-D452 PolarHBondContact OD2-N 2.89Å
334	K	87.5	Confident	87.5	Confident	79 Å²	79	39.4 Å²	39.4	34%	0.343	22%	0.22	S	C	.	.			trans	-67.2	-18	178.9	-69.7	169.3	173.8	-176.7	0	111.1	R135 T336 C337 Q338 T341 D342	R135-K334 WeakPolarHBondContact CB-O 3.47Å; K334-T336 PolarHBondContact O-N 3.24Å; K334-C337 VanDerWaalsContact O-CA 3.31Å; K334-C337 WeakPolarHBondContact O-CA 3.39Å; K334-C337 WeakPolarHBondContact O-CB 3.47Å; K334-C337 PolarHBondContact O-N 2.87Å; K334-Q338 HydrophobicContact CB-CB 4.16Å; K334-Q338 PolarHBondContact O-N 3.26Å; K334-T341 HydrophobicContact CD-CG2 3.99Å; K334-T341 HydrophobicContact CG-CG2 4.37Å; K334-D342 IonicContact NZ-OD1 2.67Å; K334-D342 PolarHBondContact NZ-OD1 3.27Å
335	G	86.2	Confident	87.1	Confident	12 Å²	12	35.4 Å²	35.4	12%	0.124	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	52.5	-133.4	176.1	0	0	0	0	0	111.7	D333 C337 Q338 D452	D333-G335 PolarHBondContact O-N 2.98Å; D333-G335 PolarHBondContact OD1-N 3Å; G335-C337 PolarHBondContact O-N 3.45Å; G335-Q338 PolarHBondContact O-N 3.01Å; G335-D452 WeakPolarHBondContact CA-OD2 3.34Å
336	T	86.5	Confident	87	Confident	26 Å²	26	35.8 Å²	35.8	16%	0.16	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-74.9	-7.9	176.9	60.4	0	0	0	0	113.1	E134 K334 Q338 K475 K478	E134-T336 PolarHBondContact N-OG1 3.32Å; E134-T336 PolarHBondContact O-N 3.14Å; E134-T336 PolarHBondContact O-OG1 3.04Å; K334-T336 PolarHBondContact O-N 3.24Å; T336-Q338 VanDerWaalsContact C-N 3.3Å; T336-K475 WeakPolarHBondContact CG2-O 3.47Å; T336-K478 HydrophobicContact CG2-CG 4.31Å
337	C	91	Very high	87	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-80.6	-4.2	173.6	-56.4	0	0	0	0	113.8	C133 R135 K334 G335 T339 Y340 T341 Y369	C133-C337 VanDerWaalsContact C-SG 3.51Å; C133-C337 HydrophobicContact CB-CB 3.91Å; C133-C337 WeakPolarHBondContact CB-SG 3.15Å; C133-C337 WeakPolarHBondContact SG-CA 3.5Å; C133-C337 WeakPolarHBondContact SG-CB 3.36Å; C133-C337 CovalentContact SG-SG 2.02Å; C133-C337 PolarHBondContact SG-SG 3.14Å; R135-C337 HydrophobicContact CB-CB 4.31Å; K334-C337 VanDerWaalsContact O-CA 3.31Å; K334-C337 WeakPolarHBondContact O-CA 3.39Å; K334-C337 WeakPolarHBondContact O-CB 3.47Å; K334-C337 PolarHBondContact O-N 2.87Å; G335-C337 PolarHBondContact O-N 3.45Å; C337-T339 VanDerWaalsContact C-N 3.3Å; C337-T339 PolarHBondContact O-N 2.93Å; C337-Y340 PolarHBondContact O-N 3.17Å; C337-T341 WeakPolarHBondContact O-CB 3.48Å; C337-T341 PolarHBondContact O-N 2.81Å; C337-T341 PolarHBondContact O-OG1 2.84Å; C337-Y369 HydrophobicContact CB-CE2 4.08Å
338	Q	89.1	Confident	87.2	Confident	62 Å²	62	37 Å²	37	29%	0.29	22%	0.22	S	C	.	.	H	α-helix	trans	-53.5	-47.4	-178.9	-174.3	75.9	50.5	0	0	111.7	K334 G335 T336 Y340 T341 D342	K334-Q338 HydrophobicContact CB-CB 4.16Å; K334-Q338 PolarHBondContact O-N 3.26Å; G335-Q338 PolarHBondContact O-N 3.01Å; T336-Q338 VanDerWaalsContact C-N 3.3Å; Q338-Y340 VanDerWaalsContact C-N 3.27Å; Q338-Y340 PolarHBondContact O-N 3.07Å; Q338-T341 PolarHBondContact O-N 3.17Å; Q338-D342 PolarHBondContact NE2-OD1 3.26Å; Q338-D342 PolarHBondContact NE2-OD2 3.36Å; Q338-D342 WeakPolarHBondContact O-CB 3.44Å; Q338-D342 PolarHBondContact O-N 3.39Å
339	T	86.9	Confident	87.4	Confident	93 Å²	93	41 Å²	41	57%	0.571	24%	0.244	S	C	*	.	H	α-helix	trans	-55.4	-40.6	-179.5	-52.9	0	0	0	0	112.5	C337 N343	C337-T339 VanDerWaalsContact C-N 3.3Å; C337-T339 PolarHBondContact O-N 2.93Å; T339-N343 WeakPolarHBondContact O-CB 3.49Å; T339-N343 PolarHBondContact O-N 2.02Å
340	Y	89.9	Confident	87.9	Confident	8 Å²	8	42.8 Å²	42.8	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-86.7	-32.3	-178	-45.1	-57.2	0	0	0	112.2	Y131 C133 C337 Q338 D342 N343 C346 Y369 K478	Y131-Y340 AromaticContact CD1-CE1 3.61Å; Y131-Y340 HydrophobicContact CD1-CE1 3.61Å; Y131-Y340 AromaticContact CD1-CZ 3.63Å; Y131-Y340 VanDerWaalsContact CD1-OH 3.24Å; Y131-Y340 WeakPolarHBondContact CD1-OH 3.35Å; Y131-Y340 HydrophobicContact CD2-CD1 4.24Å; Y131-Y340 AromaticContact CD2-CE1 3.92Å; Y131-Y340 HydrophobicContact CD2-CE1 3.92Å; Y131-Y340 HydrophobicContact CE1-CE1 4.25Å; Y131-Y340 HydrophobicContact CG-CD1 4.08Å; Y131-Y340 AromaticContact CG-CE1 3.41Å; Y131-Y340 HydrophobicContact CG-CE1 3.41Å; Y131-Y340 VanDerWaalsContact CG-CE1 3.41Å; Y131-Y340 HydrophobicContact CG-CE2 4.37Å; Y131-Y340 AromaticContact CG-CZ 3.59Å; C133-Y340 HydrophobicContact CB-CD2 4.1Å; C133-Y340 HydrophobicContact CB-CE2 3.94Å; C337-Y340 PolarHBondContact O-N 3.17Å; Q338-Y340 VanDerWaalsContact C-N 3.27Å; Q338-Y340 PolarHBondContact O-N 3.07Å; Y340-D342 VanDerWaalsContact C-N 3.28Å; Y340-D342 PolarHBondContact O-N 2.65Å; Y340-N343 PolarHBondContact O-N 2.69Å; Y340-C346 VanDerWaalsContact O-CB 3.23Å; Y340-C346 WeakPolarHBondContact O-CB 3.42Å; Y340-Y369 HydrophobicContact CD2-CD2 4.45Å; Y340-Y369 HydrophobicContact CG-CG 4.44Å; Y340-K478 PolarHBondContact OH-NZ 3.36Å
341	T	88.9	Confident	88.5	Confident	49 Å²	49	46.5 Å²	46.5	30%	0.301	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-31.4	177	-53.2	0	0	0	0	111.8	K334 C337 Q338 Y369	K334-T341 HydrophobicContact CD-CG2 3.99Å; K334-T341 HydrophobicContact CG-CG2 4.37Å; C337-T341 WeakPolarHBondContact O-CB 3.48Å; C337-T341 PolarHBondContact O-N 2.81Å; C337-T341 PolarHBondContact O-OG1 2.84Å; Q338-T341 PolarHBondContact O-N 3.17Å; T341-Y369 PolarHBondContact OG1-OH 3.45Å; T341-Y369 VanDerWaalsContact OG1-OH 3.14Å
342	D	89.3	Confident	89	Confident	90 Å²	90	51.1 Å²	51.1	48%	0.481	29%	0.291	S	S	.	.	S	Bend	trans	-88.6	-11	179.2	-66	0.2	0	0	0	112.8	K334 Q338 Y340 P344	K334-D342 IonicContact NZ-OD1 2.67Å; K334-D342 PolarHBondContact NZ-OD1 3.27Å; Q338-D342 PolarHBondContact NE2-OD1 3.26Å; Q338-D342 PolarHBondContact NE2-OD2 3.36Å; Q338-D342 WeakPolarHBondContact O-CB 3.44Å; Q338-D342 PolarHBondContact O-N 3.39Å; Y340-D342 VanDerWaalsContact C-N 3.28Å; Y340-D342 PolarHBondContact O-N 2.65Å; D342-P344 WeakPolarHBondContact O-CD 3.38Å
343	N	89.5	Confident	89.4	Confident	65 Å²	65	49.7 Å²	49.7	35%	0.348	28%	0.278	S	S	.	.			trans	-89.8	111.6	178.4	-176.7	-6.2	0	0	0	109.9	T339 Y340 A345 C346	T339-N343 WeakPolarHBondContact O-CB 3.49Å; T339-N343 PolarHBondContact O-N 2.02Å; Y340-N343 PolarHBondContact O-N 2.69Å; N343-A345 PolarHBondContact O-N 3.33Å; N343-A345 VanDerWaalsContact O-N 3.12Å; N343-A345 WeakPolarHBondContact OD1-CB 3.37Å; N343-A345 PolarHBondContact OD1-N 2.87Å; N343-C346 HydrophobicContact CB-CB 4.31Å; N343-C346 PolarHBondContact ND2-SG 2.86Å; N343-C346 WeakPolarHBondContact O-CB 3.46Å; N343-C346 PolarHBondContact O-N 3.35Å
344	P	90.2	Very high	89.5	Confident	63 Å²	63	50.6 Å²	50.6	41%	0.409	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15.1	-179.2	27.8	-35.7	0	0	0	113.9	S91 D342	S91-P344 WeakPolarHBondContact OG-CB 3.39Å; D342-P344 WeakPolarHBondContact O-CD 3.38Å
345	A	89.6	Confident	89.6	Confident	14 Å²	14	47.7 Å²	47.7	12%	0.116	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.4	172.5	0	0	0	0	0	113.1	P95 N343 C371 E372	P95-A345 HydrophobicContact CG-CB 4.06Å; N343-A345 PolarHBondContact O-N 3.33Å; N343-A345 VanDerWaalsContact O-N 3.12Å; N343-A345 WeakPolarHBondContact OD1-CB 3.37Å; N343-A345 PolarHBondContact OD1-N 2.87Å; A345-C371 WeakPolarHBondContact O-CA 3.28Å; A345-E372 HydrophobicContact CB-CB 4.34Å; A345-E372 WeakPolarHBondContact CB-O 3.38Å; A345-E372 PolarHBondContact O-N 2.83Å
346	C	92.9	Very high	89.7	Confident	10 Å²	10	54 Å²	54	7%	0.068	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	137.3	-179.6	-60.8	0	0	0	0	112	Y340 N343 Y369 S370 C371	Y340-C346 VanDerWaalsContact O-CB 3.23Å; Y340-C346 WeakPolarHBondContact O-CB 3.42Å; N343-C346 HydrophobicContact CB-CB 4.31Å; N343-C346 PolarHBondContact ND2-SG 2.86Å; N343-C346 WeakPolarHBondContact O-CB 3.46Å; N343-C346 PolarHBondContact O-N 3.35Å; C346-Y369 HydrophobicContact CB-CD1 4.18Å; C346-S370 CarbonylContact C-O 3.54Å; C346-S370 WeakPolarHBondContact CA-O 3.4Å; C346-C371 HydrophobicContact CB-CB 4.07Å; C346-C371 WeakPolarHBondContact CB-SG 3.23Å; C346-C371 WeakPolarHBondContact SG-CB 3.44Å; C346-C371 CovalentContact SG-SG 2.03Å; C346-C371 PolarHBondContact SG-SG 2.81Å
347	T	91.4	Very high	89.4	Confident	37 Å²	37	53.6 Å²	53.6	23%	0.227	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.6	173.7	-54.7	0	0	0	0	110.2	L90 V349 Y369 S370	L90-T347 HydrophobicContact CD2-CG2 3.66Å; T347-V349 PolarHBondContact O-N 3.23Å; T347-Y369 CarbonylContact O-C 3.55Å; T347-Y369 VanDerWaalsContact O-CA 3.29Å; T347-Y369 WeakPolarHBondContact O-CA 3.22Å; T347-S370 PolarHBondContact N-O 2.82Å; T347-S370 PolarHBondContact O-N 3.27Å
348	L	92.5	Very high	88.6	Confident	27 Å²	27	61.1 Å²	61.1	14%	0.141	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	118.5	173.9	-177.8	67.3	0	0	0	109.6	S350 H351 A367 Y369	L348-S350 WeakPolarHBondContact CD1-O 2.95Å; L348-H351 HydrophobicContact CD1-CB 4.48Å; L348-A367 HydrophobicContact CD1-CB 3.7Å; L348-Y369 HydrophobicContact CB-CD1 4.33Å; L348-Y369 HydrophobicContact CB-CE1 3.97Å; L348-Y369 HydrophobicContact CD1-CD2 4.07Å; L348-Y369 HydrophobicContact CD1-CE1 4.45Å; L348-Y369 HydrophobicContact CD1-CE2 3.71Å
349	V	88.2	Confident	87.8	Confident	93 Å²	93	62.4 Å²	62.4	56%	0.564	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	-38.4	-177.8	176.4	0	0	0	0	111.8	T347 T368	T347-V349 PolarHBondContact O-N 3.23Å; V349-T368 PolarHBondContact N-O 3.15Å
350	S	89.9	Confident	87.4	Confident	60 Å²	60	60.4 Å²	60.4	42%	0.42	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.8	177	63.9	0	0	0	0	110.7	L348 T368	L348-S350 WeakPolarHBondContact CD1-O 2.95Å; S350-T368 PolarHBondContact N-O 3.05Å; S350-T368 PolarHBondContact O-N 3.18Å; S350-T368 WeakPolarHBondContact OG-CB 3.03Å
351	H	92.1	Very high	87.1	Confident	84 Å²	84	61.9 Å²	61.9	39%	0.389	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	151.7	172	63	109.3	0	0	0	110.1	L348 E365 Y366 A367	L348-H351 HydrophobicContact CD1-CB 4.48Å; H351-E365 IonicContact CE1-OE2 2.8Å; H351-E365 IonicContact CG-OE2 2.71Å; H351-E365 IonicContact ND1-OE1 3.42Å; H351-E365 IonicContact ND1-OE2 3.68Å; H351-E365 PolarHBondContact ND1-OE2 2.99Å; H351-Y366 CarbonylContact C-O 3.56Å; H351-Y366 WeakPolarHBondContact CA-O 3.39Å; H351-A367 HydrophobicContact CB-CB 4.34Å
352	Q	89.4	Confident	87.2	Confident	139 Å²	139	60.8 Å²	60.8	65%	0.65	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	131.9	178.8	-179.3	179.9	8.5	0	0	109.9	A354 E365 Y366	Q352-A354 PolarHBondContact O-N 2.64Å; Q352-E365 CarbonylContact O-C 3.57Å; Q352-E365 VanDerWaalsContact O-CA 3.23Å; Q352-E365 WeakPolarHBondContact O-CA 3.41Å; Q352-E365 VanDerWaalsContact O-CB 3.22Å; Q352-E365 WeakPolarHBondContact O-CB 3.26Å; Q352-Y366 PolarHBondContact N-O 3.07Å; Q352-Y366 PolarHBondContact O-N 3.49Å
353	C	91.6	Very high	87.2	Confident	20 Å²	20	56.8 Å²	56.8	14%	0.135	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	124.5	173	-163.8	0	0	0	0	111.1	F355 Y356 C362 H364	C353-F355 PolarHBondContact SG-O 2.88Å; C353-Y356 HydrophobicContact CB-CE1 3.93Å; C353-Y356 HydrophobicContact CB-CE2 3.87Å; C353-Y356 VanDerWaalsContact CB-CZ 3.46Å; C353-Y356 WeakPolarHBondContact CB-OH 3.49Å; C353-Y356 VanDerWaalsContact SG-CZ 3.6Å; C353-C362 WeakPolarHBondContact CA-SG 3.13Å; C353-C362 HydrophobicContact CB-CB 3.93Å; C353-C362 WeakPolarHBondContact CB-SG 3.48Å; C353-C362 WeakPolarHBondContact SG-CA 3.35Å; C353-C362 WeakPolarHBondContact SG-CB 3.41Å; C353-C362 CovalentContact SG-SG 2.03Å; C353-C362 PolarHBondContact SG-SG 3.24Å; C353-H364 PolarHBondContact SG-O 2.84Å
354	A	87.4	Confident	87.2	Confident	31 Å²	31	54 Å²	54	26%	0.256	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-43.5	175.2	0	0	0	0	0	110.9	Q352 H364 Y366	Q352-A354 PolarHBondContact O-N 2.64Å; A354-H364 HydrophobicContact CB-CB 4.38Å; A354-H364 WeakPolarHBondContact CB-O 3.33Å; A354-H364 PolarHBondContact N-O 2.97Å; A354-Y366 HydrophobicContact CB-CD2 3.87Å; A354-Y366 HydrophobicContact CB-CE1 4.35Å; A354-Y366 HydrophobicContact CB-CE2 3.4Å
355	F	88.8	Confident	87.3	Confident	19 Å²	19	51.2 Å²	51.2	8%	0.083	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	154.2	174.3	55.2	-91.9	0	0	0	112.6	C353 L363 H364 E485 R500	C353-F355 PolarHBondContact SG-O 2.88Å; F355-L363 HydrophobicContact CD2-CB 3.96Å; F355-L363 HydrophobicContact CD2-CD1 4.18Å; F355-L363 HydrophobicContact CE2-CB 3.71Å; F355-L363 HydrophobicContact CE2-CD1 4.1Å; F355-L363 PolarHBondContact O-N 3.41Å; F355-H364 HydrophobicContact CD1-CB 4.06Å; F355-H364 HydrophobicContact CD2-CB 4.44Å; F355-H364 HydrophobicContact CE1-CB 3.4Å; F355-H364 VanDerWaalsContact CE1-CB 3.4Å; F355-H364 AromaticContact CE1-CD2 3.87Å; F355-H364 AromaticContact CE1-CG 3.78Å; F355-H364 HydrophobicContact CE2-CB 3.86Å; F355-H364 HydrophobicContact CZ-CB 3.29Å; F355-H364 AromaticContact CZ-CG 3.92Å; F355-E485 HydrophobicContact CE2-CG 3.92Å; F355-R500 HydrophobicContact CZ-CG 4.37Å
356	Y	88.3	Confident	87.3	Confident	145 Å²	145	52.8 Å²	52.8	57%	0.569	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	161.1	-177.2	-60.2	-92.9	0	0	0	111.3	C353 G360 A361 C362	C353-Y356 HydrophobicContact CB-CE1 3.93Å; C353-Y356 HydrophobicContact CB-CE2 3.87Å; C353-Y356 VanDerWaalsContact CB-CZ 3.46Å; C353-Y356 WeakPolarHBondContact CB-OH 3.49Å; C353-Y356 VanDerWaalsContact SG-CZ 3.6Å; Y356-G360 VanDerWaalsContact CD1-O 3.27Å; Y356-G360 WeakPolarHBondContact CD1-O 3.26Å; Y356-A361 CarbonylContact C-O 3.54Å; Y356-A361 WeakPolarHBondContact CA-O 3.29Å; Y356-C362 HydrophobicContact CD1-CB 4.02Å; Y356-C362 HydrophobicContact CE1-CB 3.95Å
357	S	79.6	Confident	87.2	Confident	16 Å²	16	52.3 Å²	52.3	11%	0.112	29%	0.285	C	S	.	.			trans	-72	168.1	165.7	58.2	0	0	0	0	111.3	E359 G360 A361	S357-E359 VanDerWaalsContact CB-OE2 3.31Å; S357-E359 WeakPolarHBondContact CB-OE2 3.42Å; S357-E359 PolarHBondContact O-N 3.44Å; S357-G360 PolarHBondContact O-N 3.42Å; S357-G360 PolarHBondContact OG-N 2.96Å; S357-A361 PolarHBondContact N-O 3.02Å; S357-A361 WeakPolarHBondContact OG-CA 2.97Å; S357-A361 WeakPolarHBondContact OG-CB 3.42Å; S357-A361 PolarHBondContact OG-N 3.46Å; S357-A361 PolarHBondContact OG-O 3.41Å
358	E	74.7	Confident	87.1	Confident	158 Å²	158	51.8 Å²	51.8	74%	0.738	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.1	173.3	-67.7	-179.3	-171.6	0	0	111.1
359	E	71.7	Confident	87.1	Confident	90 Å²	90	51.1 Å²	51.1	42%	0.421	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	2.4	179	-53	88	162	0	0	113.8	Q141 S357	Q141-E359 PolarHBondContact NE2-OE1 2.96Å; S357-E359 VanDerWaalsContact CB-OE2 3.31Å; S357-E359 WeakPolarHBondContact CB-OE2 3.42Å; S357-E359 PolarHBondContact O-N 3.44Å
360	G	79	Confident	87.2	Confident	50 Å²	50	47.6 Å²	47.6	52%	0.515	26%	0.257	S	S	.	.	S	Bend	trans	85.8	0.8	175.3	0	0	0	0	0	116	Y356 S357	Y356-G360 VanDerWaalsContact CD1-O 3.27Å; Y356-G360 WeakPolarHBondContact CD1-O 3.26Å; S357-G360 PolarHBondContact O-N 3.42Å; S357-G360 PolarHBondContact OG-N 2.96Å
361	A	84.5	Confident	87.1	Confident	39 Å²	39	45.2 Å²	45.2	32%	0.322	24%	0.241	S	C	.	.			trans	-74.6	135.1	171.5	0	0	0	0	0	110.9	V139 Y356 S357 L363	V139-A361 HydrophobicContact CG1-CB 4.12Å; Y356-A361 CarbonylContact C-O 3.54Å; Y356-A361 WeakPolarHBondContact CA-O 3.29Å; S357-A361 PolarHBondContact N-O 3.02Å; S357-A361 WeakPolarHBondContact OG-CA 2.97Å; S357-A361 WeakPolarHBondContact OG-CB 3.42Å; S357-A361 PolarHBondContact OG-N 3.46Å; S357-A361 PolarHBondContact OG-O 3.41Å; A361-L363 PolarHBondContact O-N 3.45Å
362	C	89.9	Confident	86.9	Confident	27 Å²	27	41.8 Å²	41.8	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.3	175.3	-175.4	0	0	0	0	110.5	L137 C353 Y356 H364	L137-C362 HydrophobicContact CD1-CB 3.83Å; C353-C362 WeakPolarHBondContact CA-SG 3.13Å; C353-C362 HydrophobicContact CB-CB 3.93Å; C353-C362 WeakPolarHBondContact CB-SG 3.48Å; C353-C362 WeakPolarHBondContact SG-CA 3.35Å; C353-C362 WeakPolarHBondContact SG-CB 3.41Å; C353-C362 CovalentContact SG-SG 2.03Å; C353-C362 PolarHBondContact SG-SG 3.24Å; Y356-C362 HydrophobicContact CD1-CB 4.02Å; Y356-C362 HydrophobicContact CE1-CB 3.95Å; C362-H364 PolarHBondContact SG-O 3Å
363	L	89.2	Confident	86.5	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-35.2	-178.6	-64	-178.1	0	0	0	111.9	L137 V139 Q330 F355 A361 E485	L137-L363 PolarHBondContact N-O 3.06Å; V139-L363 HydrophobicContact CG1-CD2 4.5Å; V139-L363 HydrophobicContact CG2-CD2 3.58Å; Q330-L363 PolarHBondContact NE2-O 3.06Å; F355-L363 HydrophobicContact CD2-CB 3.96Å; F355-L363 HydrophobicContact CD2-CD1 4.18Å; F355-L363 HydrophobicContact CE2-CB 3.71Å; F355-L363 HydrophobicContact CE2-CD1 4.1Å; F355-L363 PolarHBondContact O-N 3.41Å; A361-L363 PolarHBondContact O-N 3.45Å; L363-E485 HydrophobicContact CD1-CB 4.14Å; L363-E485 HydrophobicContact CD1-CG 4.26Å
364	H	91.2	Very high	85.7	Confident	5 Å²	5	41.1 Å²	41.1	2%	0.023	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	142.7	-170.8	-170.5	74	0	0	0	109.1	E134 R135 D136 C353 A354 F355 C362	E134-H364 WeakPolarHBondContact CB-NE2 3.37Å; E134-H364 WeakPolarHBondContact CG-NE2 3.37Å; E134-H364 IonicContact OE2-CE1 2.85Å; E134-H364 IonicContact OE2-NE2 2.71Å; E134-H364 PolarHBondContact OE2-NE2 3.18Å; E134-H364 VanDerWaalsContact OE2-NE2 3.12Å; R135-H364 WeakPolarHBondContact O-CA 3.43Å; R135-H364 PolarHBondContact O-CE1 3.05Å; R135-H364 PolarHBondContact O-ND1 3.08Å; D136-H364 IonicContact OD1-CE1 3.65Å; D136-H364 IonicContact OD1-CG 2.81Å; D136-H364 IonicContact OD1-ND1 3.76Å; D136-H364 PolarHBondContact OD1-ND1 3.23Å; C353-H364 PolarHBondContact SG-O 2.84Å; A354-H364 HydrophobicContact CB-CB 4.38Å; A354-H364 WeakPolarHBondContact CB-O 3.33Å; A354-H364 PolarHBondContact N-O 2.97Å; F355-H364 HydrophobicContact CD1-CB 4.06Å; F355-H364 HydrophobicContact CD2-CB 4.44Å; F355-H364 HydrophobicContact CE1-CB 3.4Å; F355-H364 VanDerWaalsContact CE1-CB 3.4Å; F355-H364 AromaticContact CE1-CD2 3.87Å; F355-H364 AromaticContact CE1-CG 3.78Å; F355-H364 HydrophobicContact CE2-CB 3.86Å; F355-H364 HydrophobicContact CZ-CB 3.29Å; F355-H364 AromaticContact CZ-CG 3.92Å; C362-H364 PolarHBondContact SG-O 3Å
365	E	91.7	Very high	84.9	Confident	5 Å²	5	41.4 Å²	41.4	2%	0.023	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.4	179.6	62.9	173.9	-157.9	0	0	113	R135 L137 H351 Q352	R135-E365 HydrophobicContact CG-CG 3.82Å; R135-E365 IonicContact CZ-OE1 2.73Å; R135-E365 PolarHBondContact N-O 3.3Å; R135-E365 VanDerWaalsContact N-O 3.07Å; R135-E365 IonicContact NE-OE1 3.72Å; R135-E365 PolarHBondContact NE-OE1 3.32Å; R135-E365 IonicContact NH2-OE1 3.19Å; R135-E365 PolarHBondContact NH2-OE1 2.75Å; R135-E365 PolarHBondContact O-N 2.94Å; L137-E365 HydrophobicContact CD1-CG 4.42Å; L137-E365 HydrophobicContact CD2-CG 4.13Å; L137-E365 HydrophobicContact CG-CG 4.2Å; H351-E365 IonicContact CE1-OE2 2.8Å; H351-E365 IonicContact CG-OE2 2.71Å; H351-E365 IonicContact ND1-OE1 3.42Å; H351-E365 IonicContact ND1-OE2 3.68Å; H351-E365 PolarHBondContact ND1-OE2 2.99Å; Q352-E365 CarbonylContact O-C 3.57Å; Q352-E365 VanDerWaalsContact O-CA 3.23Å; Q352-E365 WeakPolarHBondContact O-CA 3.41Å; Q352-E365 VanDerWaalsContact O-CB 3.22Å; Q352-E365 WeakPolarHBondContact O-CB 3.26Å
366	Y	88.9	Confident	84.1	Confident	48 Å²	48	42.1 Å²	42.1	19%	0.188	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126	164.1	-56.2	-61.8	0	0	0	107.9	C133 E134 H351 Q352 A354 Q515	C133-Y366 CarbonylContact O-C 3.57Å; C133-Y366 WeakPolarHBondContact O-CA 3.05Å; E134-Y366 HydrophobicContact CG-CD1 3.51Å; E134-Y366 HydrophobicContact CG-CE1 3.5Å; E134-Y366 VanDerWaalsContact CG-CE1 3.5Å; E134-Y366 WeakPolarHBondContact OE1-CE1 3.49Å; H351-Y366 CarbonylContact C-O 3.56Å; H351-Y366 WeakPolarHBondContact CA-O 3.39Å; Q352-Y366 PolarHBondContact N-O 3.07Å; Q352-Y366 PolarHBondContact O-N 3.49Å; A354-Y366 HydrophobicContact CB-CD2 3.87Å; A354-Y366 HydrophobicContact CB-CE1 4.35Å; A354-Y366 HydrophobicContact CB-CE2 3.4Å; Y366-Q515 PolarHBondContact OH-NE2 3.42Å
367	A	91.6	Very high	83	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138	179.4	0	0	0	0	0	109.7	T132 C133 L348 H351 Y369	T132-A367 CarbonylContact C-O 3.53Å; T132-A367 WeakPolarHBondContact CA-O 3.43Å; C133-A367 PolarHBondContact N-O 3.18Å; C133-A367 PolarHBondContact O-N 2.93Å; C133-A367 PolarHBondContact SG-O 3.3Å; C133-A367 VanDerWaalsContact SG-O 3.36Å; L348-A367 HydrophobicContact CD1-CB 3.7Å; H351-A367 HydrophobicContact CB-CB 4.34Å; A367-Y369 HydrophobicContact CB-CD2 4.38Å; A367-Y369 HydrophobicContact CB-CE2 3.92Å
368	T	89.8	Confident	82.5	Confident	25 Å²	25	40.9 Å²	40.9	15%	0.153	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.9	174.8	-57	0	0	0	0	109.2	N130 Y131 T132 V349 S350	N130-T368 HydrophobicContact CB-CG2 3.91Å; Y131-T368 WeakPolarHBondContact O-CA 3.46Å; T132-T368 PolarHBondContact OG1-OG1 2.94Å; V349-T368 PolarHBondContact N-O 3.15Å; S350-T368 PolarHBondContact N-O 3.05Å; S350-T368 PolarHBondContact O-N 3.18Å; S350-T368 WeakPolarHBondContact OG-CB 3.03Å
369	Y	91.3	Very high	82.2	Confident	13 Å²	13	33.3 Å²	33.3	5%	0.051	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.8	174.9	-75.8	-101.7	0	0	0	109.7	N130 Y131 R135 C337 Y340 T341 C346 T347 L348 A367	N130-Y369 CarbonylContact C-O 3.6Å; N130-Y369 VanDerWaalsContact CA-O 3.29Å; N130-Y369 WeakPolarHBondContact CA-O 3.34Å; Y131-Y369 PolarHBondContact N-O 2.81Å; Y131-Y369 PolarHBondContact O-N 3.13Å; R135-Y369 PolarHBondContact NH1-OH 3.49Å; R135-Y369 VanDerWaalsContact NH1-OH 3.07Å; C337-Y369 HydrophobicContact CB-CE2 4.08Å; Y340-Y369 HydrophobicContact CD2-CD2 4.45Å; Y340-Y369 HydrophobicContact CG-CG 4.44Å; T341-Y369 PolarHBondContact OG1-OH 3.45Å; T341-Y369 VanDerWaalsContact OG1-OH 3.14Å; C346-Y369 HydrophobicContact CB-CD1 4.18Å; T347-Y369 CarbonylContact O-C 3.55Å; T347-Y369 VanDerWaalsContact O-CA 3.29Å; T347-Y369 WeakPolarHBondContact O-CA 3.22Å; L348-Y369 HydrophobicContact CB-CD1 4.33Å; L348-Y369 HydrophobicContact CB-CE1 3.97Å; L348-Y369 HydrophobicContact CD1-CD2 4.07Å; L348-Y369 HydrophobicContact CD1-CE1 4.45Å; L348-Y369 HydrophobicContact CD1-CE2 3.71Å; A367-Y369 HydrophobicContact CB-CD2 4.38Å; A367-Y369 HydrophobicContact CB-CE2 3.92Å
370	S	89.6	Confident	82	Confident	20 Å²	20	31.3 Å²	31.3	14%	0.14	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.1	169.3	-165.2	0	0	0	0	108.9	N130 C346 T347	N130-S370 WeakPolarHBondContact OD1-CA 3.25Å; N130-S370 WeakPolarHBondContact OD1-CB 3.13Å; N130-S370 PolarHBondContact OD1-OG 3.11Å; C346-S370 CarbonylContact C-O 3.54Å; C346-S370 WeakPolarHBondContact CA-O 3.4Å; T347-S370 PolarHBondContact N-O 2.82Å; T347-S370 PolarHBondContact O-N 3.27Å
371	C	89.6	Confident	81.4	Confident	10 Å²	10	30.5 Å²	30.5	7%	0.068	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.8	-174.1	-57.5	0	0	0	0	110.8	Y128 T129 Y131 A345 C346	Y128-C371 WeakPolarHBondContact CA-O 3.35Å; T129-C371 PolarHBondContact N-O 3.24Å; T129-C371 PolarHBondContact O-N 2.93Å; Y131-C371 HydrophobicContact CD2-CB 4.06Å; Y131-C371 HydrophobicContact CE2-CB 3.86Å; A345-C371 WeakPolarHBondContact O-CA 3.28Å; C346-C371 HydrophobicContact CB-CB 4.07Å; C346-C371 WeakPolarHBondContact CB-SG 3.23Å; C346-C371 WeakPolarHBondContact SG-CB 3.44Å; C346-C371 CovalentContact SG-SG 2.03Å; C346-C371 PolarHBondContact SG-SG 2.81Å
372	E	86.4	Confident	80.4	Confident	12 Å²	12	30 Å²	30	6%	0.056	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.9	175.2	-170.4	-176.9	176.9	0	0	110.8	P95 F96 S126 E127 Y128 A345	P95-E372 WeakPolarHBondContact CB-OE2 3.37Å; F96-E372 WeakPolarHBondContact CB-OE2 3.06Å; F96-E372 PolarHBondContact N-OE2 2.6Å; S126-E372 WeakPolarHBondContact CB-OE1 3.32Å; S126-E372 PolarHBondContact OG-OE1 3.25Å; E127-E372 CarbonylContact O-C 3.49Å; E127-E372 WeakPolarHBondContact O-CA 3.31Å; Y128-E372 HydrophobicContact CD1-CB 4.07Å; Y128-E372 HydrophobicContact CE1-CB 3.71Å; Y128-E372 HydrophobicContact CE1-CG 3.96Å; A345-E372 HydrophobicContact CB-CB 4.34Å; A345-E372 WeakPolarHBondContact CB-O 3.38Å; A345-E372 PolarHBondContact O-N 2.83Å
373	S	80.7	Confident	79	Confident	64 Å²	64	32.1 Å²	32.1	45%	0.448	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.5	162.7	-177	0	0	0	0	108.6	S126 E127	S126-S373 WeakPolarHBondContact CA-O 3.43Å; E127-S373 PolarHBondContact N-O 3.44Å; E127-S373 PolarHBondContact O-N 2.95Å
374	K	76.3	Confident	77.6	Confident	80 Å²	80	35 Å²	35	35%	0.348	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116	178.7	-173.4	-179.7	-178.2	179.1	0	109.3	S124 R125 S376	S124-K374 WeakPolarHBondContact OG-CE 3.38Å; R125-K374 WeakPolarHBondContact O-CA 3.39Å; K374-S376 WeakPolarHBondContact CE-OG 3.42Å
375	T	70.9	Confident	76.2	Confident	38 Å²	38	39.8 Å²	39.8	23%	0.233	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	122.9	166.8	-55.2	0	0	0	0	108.3	S124 R125 K395	S124-T375 CarbonylContact C-O 3.5Å; S124-T375 WeakPolarHBondContact CA-O 2.96Å; R125-T375 PolarHBondContact N-O 2.85Å; R125-T375 PolarHBondContact O-N 3.36Å; T375-K395 HydrophobicContact CG2-CB 3.97Å
376	S	70.3	Confident	74.9	Confident	34 Å²	34	42.6 Å²	42.6	24%	0.238	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	148.2	176.4	-50	0	0	0	0	109.5	I123 K374	I123-S376 VanDerWaalsContact O-CA 3.28Å; I123-S376 WeakPolarHBondContact O-CA 3.05Å; K374-S376 WeakPolarHBondContact CE-OG 3.42Å
377	G	66.8	Low	73.8	Confident	4 Å²	4	45.6 Å²	45.6	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	151.6	176.3	0	0	0	0	0	110.7	I123	I123-G377 PolarHBondContact N-O 3.19Å; I123-G377 VanDerWaalsContact N-O 3.12Å; I123-G377 PolarHBondContact O-N 2.73Å
378	K	68.3	Low	72.4	Confident	130 Å²	130	47.5 Å²	47.5	57%	0.565	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.8	178.6	-70.6	-178.8	-177.5	173.8	0	110	L389 C393	K378-L389 HydrophobicContact CB-CD1 4.48Å; K378-L389 PolarHBondContact O-N 3.46Å; K378-C393 PolarHBondContact O-SG 2.71Å; K378-C393 VanDerWaalsContact O-SG 3.39Å
379	V	68.5	Low	71	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	150.3	171.7	-66.9	0	0	0	0	111.4	A120 Q121 I123 V381 V386 F387 C393	A120-V379 CarbonylContact C-O 3.5Å; A120-V379 WeakPolarHBondContact CA-O 3.4Å; Q121-V379 HydrophobicContact CB-CG2 4.15Å; Q121-V379 PolarHBondContact N-O 3.29Å; Q121-V379 WeakPolarHBondContact O-CG2 3.39Å; Q121-V379 PolarHBondContact O-N 2.8Å; Q121-V379 VanDerWaalsContact O-O 3.12Å; I123-V379 HydrophobicContact CB-CG2 4.22Å; I123-V379 HydrophobicContact CD1-CG1 3.49Å; I123-V379 VanDerWaalsContact CD1-CG1 3.49Å; I123-V379 HydrophobicContact CD1-CG2 4.38Å; I123-V379 HydrophobicContact CG1-CB 4.4Å; I123-V379 HydrophobicContact CG1-CG1 3.6Å; I123-V379 HydrophobicContact CG1-CG2 3.93Å; I123-V379 HydrophobicContact CG2-CG2 3.46Å; I123-V379 VanDerWaalsContact CG2-CG2 3.46Å; V379-V381 HydrophobicContact CG2-CG2 4.19Å; V379-V386 HydrophobicContact CB-CG1 3.53Å; V379-V386 HydrophobicContact CG1-CG1 3.5Å; V379-V386 HydrophobicContact CG2-CG1 3.9Å; V379-F387 CarbonylContact C-O 3.44Å; V379-F387 WeakPolarHBondContact CA-O 3.01Å; V379-C393 HydrophobicContact CG1-CB 3.53Å; V379-C393 VanDerWaalsContact CG1-SG 3.6Å
380	M	68.4	Low	69.6	Low	47 Å²	47	54.9 Å²	54.9	23%	0.232	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.8	163.4	-69.6	-64.3	-69.2	0	0	108.5	C118 A120 F387 L389	C118-M380 HydrophobicContact CB-CE 3.58Å; A120-M380 VanDerWaalsContact CA-SD 3.51Å; A120-M380 HydrophobicContact CB-SD 3.64Å; M380-F387 HydrophobicContact CB-CB 4.31Å; M380-F387 PolarHBondContact N-O 3.23Å; M380-F387 PolarHBondContact O-N 3.16Å; M380-L389 HydrophobicContact CG-CD1 3.75Å; M380-L389 HydrophobicContact CG-CD2 3.73Å; M380-L389 HydrophobicContact CG-CG 3.84Å; M380-L389 HydrophobicContact SD-CD1 4.15Å
381	V	66.3	Low	68.1	Low	34 Å²	34	55.4 Å²	55.4	21%	0.206	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.4	172	-176	0	0	0	0	108.1	C118 S119 Q121 V379 D385 V386	C118-V381 VanDerWaalsContact CA-O 3.27Å; C118-V381 WeakPolarHBondContact CA-O 3.36Å; S119-V381 PolarHBondContact N-O 3.24Å; S119-V381 VanDerWaalsContact N-O 3.1Å; S119-V381 PolarHBondContact O-N 2.9Å; Q121-V381 HydrophobicContact CB-CG2 4.22Å; Q121-V381 HydrophobicContact CG-CG2 4Å; V379-V381 HydrophobicContact CG2-CG2 4.19Å; V381-D385 CarbonylContact C-O 3.58Å; V381-D385 WeakPolarHBondContact CA-O 3.15Å; V381-V386 HydrophobicContact CG2-CG2 4.46Å
382	C	63.6	Low	66.7	Low	29 Å²	29	60 Å²	60	20%	0.196	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	105.8	-177	-68.1	0	0	0	0	109.7	C118 G384 D385 F387	C118-C382 HydrophobicContact CB-CB 4.17Å; C118-C382 WeakPolarHBondContact CB-SG 3.39Å; C118-C382 WeakPolarHBondContact SG-CB 3.33Å; C118-C382 CovalentContact SG-SG 2.04Å; C118-C382 PolarHBondContact SG-SG 3.21Å; C382-G384 PolarHBondContact O-N 3.14Å; C382-D385 PolarHBondContact N-O 3.36Å; C382-D385 PolarHBondContact O-N 2.88Å; C382-F387 HydrophobicContact CB-CD2 4.32Å; C382-F387 HydrophobicContact CB-CE2 4.03Å
383	G	60.4	Low	65.6	Low	71 Å²	71	59.5 Å²	59.5	73%	0.732	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	21.2	172.4	0	0	0	0	0	115.7
384	G	58.7	Low	64.6	Low	65 Å²	65	60.4 Å²	60.4	67%	0.67	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.5	-18.5	-176.5	0	0	0	0	0	114.4	C382	C382-G384 PolarHBondContact O-N 3.14Å
385	D	62.5	Low	63.7	Low	106 Å²	106	62.3 Å²	62.3	57%	0.567	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	146.4	177.6	-65.3	-38.4	0	0	0	111.7	V381 C382 F387	V381-D385 CarbonylContact C-O 3.58Å; V381-D385 WeakPolarHBondContact CA-O 3.15Å; C382-D385 PolarHBondContact N-O 3.36Å; C382-D385 PolarHBondContact O-N 2.88Å; D385-F387 HydrophobicContact CB-CD2 4.48Å; D385-F387 HydrophobicContact CB-CE2 3.66Å; D385-F387 HydrophobicContact CB-CZ 4Å
386	V	64.6	Low	63.1	Low	65 Å²	65	60.9 Å²	60.9	39%	0.394	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.5	-176.9	-176.2	0	0	0	0	109.5	V379 V381	V379-V386 HydrophobicContact CB-CG1 3.53Å; V379-V386 HydrophobicContact CG1-CG1 3.5Å; V379-V386 HydrophobicContact CG2-CG1 3.9Å; V381-V386 HydrophobicContact CG2-CG2 4.46Å
387	F	66.2	Low	62.5	Low	111 Å²	111	63.4 Å²	63.4	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.9	179.9	-61.4	-87.3	0	0	0	111.9	V379 M380 C382 D385	V379-F387 CarbonylContact C-O 3.44Å; V379-F387 WeakPolarHBondContact CA-O 3.01Å; M380-F387 HydrophobicContact CB-CB 4.31Å; M380-F387 PolarHBondContact N-O 3.23Å; M380-F387 PolarHBondContact O-N 3.16Å; C382-F387 HydrophobicContact CB-CD2 4.32Å; C382-F387 HydrophobicContact CB-CE2 4.03Å; D385-F387 HydrophobicContact CB-CD2 4.48Å; D385-F387 HydrophobicContact CB-CE2 3.66Å; D385-F387 HydrophobicContact CB-CZ 4Å
388	C	61.2	Low	62	Low	40 Å²	40	67.9 Å²	67.9	27%	0.27	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	126.7	175.7	-85.1	0	0	0	0	112.8	C393 D394	C388-C393 WeakPolarHBondContact CA-SG 3.35Å; C388-C393 HydrophobicContact CB-CB 4.39Å; C388-C393 WeakPolarHBondContact CB-SG 3.36Å; C388-C393 WeakPolarHBondContact SG-CB 3.49Å; C388-C393 CovalentContact SG-SG 2.01Å; C388-C393 PolarHBondContact SG-SG 2.78Å; C388-D394 PolarHBondContact SG-N 3.11Å; C388-D394 VanDerWaalsContact SG-N 3.38Å; C388-D394 PolarHBondContact SG-OD1 2.89Å; C388-D394 VanDerWaalsContact SG-OD1 3.39Å
389	L	61	Low	61.2	Low	110 Å²	110	62.5 Å²	62.5	58%	0.576	38%	0.375	S	S	*	.	S	Bend	trans	-89	-33.6	-177.2	-69.6	177.6	0	0	0	113.5	K378 M380	K378-L389 HydrophobicContact CB-CD1 4.48Å; K378-L389 PolarHBondContact O-N 3.46Å; M380-L389 HydrophobicContact CG-CD1 3.75Å; M380-L389 HydrophobicContact CG-CD2 3.73Å; M380-L389 HydrophobicContact CG-CG 3.84Å; M380-L389 HydrophobicContact SD-CD1 4.15Å
390	D	61	Low	60.4	Low	83 Å²	83	68 Å²	68	44%	0.444	40%	0.401	S	S	.	.	S	Bend	trans	-125	-0.7	-173.4	52.7	21	0	0	0	113.5	E392	D390-E392 PolarHBondContact O-N 2.03Å; D390-E392 WeakPolarHBondContact OD1-CB 3.42Å; D390-E392 PolarHBondContact OD1-N 3.45Å
391	G	58	Low	59.8	Low	30 Å²	30	69.4 Å²	69.4	31%	0.309	42%	0.416	S	S	.	.	S	Bend	trans	74.8	-5.5	-175.6	0	0	0	0	0	114.4	C393 D394	G391-C393 VanDerWaalsContact C-N 3.29Å; G391-C393 PolarHBondContact O-N 3.15Å; G391-D394 WeakPolarHBondContact O-CB 3.33Å; G391-D394 PolarHBondContact O-N 2.99Å; G391-D394 VanDerWaalsContact O-N 3.13Å
392	E	61.7	Low	59.4	Low	108 Å²	108	71 Å²	71	51%	0.505	42%	0.423	S	S	.	.	H	α-helix	trans	-68.8	-34	176.1	-65.2	-165.4	155.4	0	0	111.2	D390 D394 K395 A396	D390-E392 PolarHBondContact O-N 2.03Å; D390-E392 WeakPolarHBondContact OD1-CB 3.42Å; D390-E392 PolarHBondContact OD1-N 3.45Å; E392-D394 PolarHBondContact O-N 2.94Å; E392-K395 WeakPolarHBondContact O-CB 3.44Å; E392-K395 PolarHBondContact O-N 3.12Å; E392-K395 VanDerWaalsContact O-N 3.15Å; E392-A396 PolarHBondContact O-N 3.35Å
393	C	62.2	Low	59.3	Low	0 Å²	0	74.8 Å²	74.8	0%	0	44%	0.441	C	S	.	.	H	α-helix	trans	-69.9	-16.7	172.7	48.8	0	0	0	0	113.7	I123 K378 V379 C388 G391 K395 A396 Q397	I123-C393 HydrophobicContact CD1-CB 4.01Å; I123-C393 HydrophobicContact CG1-CB 4.23Å; K378-C393 PolarHBondContact O-SG 2.71Å; K378-C393 VanDerWaalsContact O-SG 3.39Å; V379-C393 HydrophobicContact CG1-CB 3.53Å; V379-C393 VanDerWaalsContact CG1-SG 3.6Å; C388-C393 WeakPolarHBondContact CA-SG 3.35Å; C388-C393 HydrophobicContact CB-CB 4.39Å; C388-C393 WeakPolarHBondContact CB-SG 3.36Å; C388-C393 WeakPolarHBondContact SG-CB 3.49Å; C388-C393 CovalentContact SG-SG 2.01Å; C388-C393 PolarHBondContact SG-SG 2.78Å; G391-C393 VanDerWaalsContact C-N 3.29Å; G391-C393 PolarHBondContact O-N 3.15Å; C393-K395 PolarHBondContact O-N 3.46Å; C393-A396 CarbonylContact O-C 3.6Å; C393-A396 WeakPolarHBondContact O-CA 3.48Å; C393-A396 WeakPolarHBondContact O-CB 3.3Å; C393-A396 PolarHBondContact O-N 2.7Å; C393-A396 VanDerWaalsContact O-N 3.09Å; C393-Q397 WeakPolarHBondContact O-CB 3.42Å; C393-Q397 WeakPolarHBondContact O-CG 3.34Å; C393-Q397 PolarHBondContact O-N 2.79Å
394	D	60.1	Low	59.5	Low	83 Å²	83	78 Å²	78	44%	0.444	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-35	170.6	-71.3	-25	0	0	0	109.7	C388 G391 E392 A396 Q397 S398	C388-D394 PolarHBondContact SG-N 3.11Å; C388-D394 VanDerWaalsContact SG-N 3.38Å; C388-D394 PolarHBondContact SG-OD1 2.89Å; C388-D394 VanDerWaalsContact SG-OD1 3.39Å; G391-D394 WeakPolarHBondContact O-CB 3.33Å; G391-D394 PolarHBondContact O-N 2.99Å; G391-D394 VanDerWaalsContact O-N 3.13Å; E392-D394 PolarHBondContact O-N 2.94Å; D394-A396 VanDerWaalsContact C-N 3.34Å; D394-Q397 PolarHBondContact O-N 2.85Å; D394-S398 VanDerWaalsContact O-CB 3.3Å; D394-S398 WeakPolarHBondContact O-CB 3.46Å; D394-S398 PolarHBondContact O-N 2.94Å; D394-S398 PolarHBondContact O-OG 3.08Å
395	K	58	Low	59.9	Low	121 Å²	121	75.5 Å²	75.5	53%	0.526	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-41.1	171.5	-62.2	179.3	-179.1	173.1	0	111	T375 E392 C393 Q397 G399	T375-K395 HydrophobicContact CG2-CB 3.97Å; E392-K395 WeakPolarHBondContact O-CB 3.44Å; E392-K395 PolarHBondContact O-N 3.12Å; E392-K395 VanDerWaalsContact O-N 3.15Å; C393-K395 PolarHBondContact O-N 3.46Å; K395-Q397 VanDerWaalsContact C-N 3.29Å; K395-Q397 PolarHBondContact O-N 3.38Å; K395-G399 PolarHBondContact O-N 2.88Å
396	A	56.7	Low	60.3	Low	7 Å²	7	73.6 Å²	73.6	6%	0.058	40%	0.396	C	S	.	.	H	α-helix	trans	-66.5	-28.1	174.8	0	0	0	0	0	112.8	I123 R125 E392 C393 D394	I123-A396 HydrophobicContact CD1-CB 4.23Å; R125-A396 HydrophobicContact CB-CB 4.17Å; R125-A396 WeakPolarHBondContact CD-O 3.3Å; R125-A396 PolarHBondContact NH1-O 2.84Å; E392-A396 PolarHBondContact O-N 3.35Å; C393-A396 CarbonylContact O-C 3.6Å; C393-A396 WeakPolarHBondContact O-CA 3.48Å; C393-A396 WeakPolarHBondContact O-CB 3.3Å; C393-A396 PolarHBondContact O-N 2.7Å; C393-A396 VanDerWaalsContact O-N 3.09Å; D394-A396 VanDerWaalsContact C-N 3.34Å
397	Q	58.1	Low	60.6	Low	88 Å²	88	73.1 Å²	73.1	41%	0.411	40%	0.399	S	S	.	.	H	α-helix	trans	-85.9	-50.4	178.2	-74	-171.5	-3.3	0	0	112.9	I123 R125 C393 D394 K395	I123-Q397 HydrophobicContact CD1-CG 4.41Å; R125-Q397 PolarHBondContact NH1-O 3.26Å; C393-Q397 WeakPolarHBondContact O-CB 3.42Å; C393-Q397 WeakPolarHBondContact O-CG 3.34Å; C393-Q397 PolarHBondContact O-N 2.79Å; D394-Q397 PolarHBondContact O-N 2.85Å; K395-Q397 VanDerWaalsContact C-N 3.29Å; K395-Q397 PolarHBondContact O-N 3.38Å
398	S	56	Low	60.8	Low	97 Å²	97	69.8 Å²	69.8	68%	0.678	39%	0.387	S	S	*	.	H	α-helix	trans	-75.2	-24.5	-171.2	57.9	0	0	0	0	113.8	D394	D394-S398 VanDerWaalsContact O-CB 3.3Å; D394-S398 WeakPolarHBondContact O-CB 3.46Å; D394-S398 PolarHBondContact O-N 2.94Å; D394-S398 PolarHBondContact O-OG 3.08Å
399	G	51.2	Low	61.5	Low	17 Å²	17	67.9 Å²	67.9	18%	0.175	37%	0.374	C	S	.	.			trans	70.9	142.2	-173.8	0	0	0	0	0	111.6	E127 K395 S401	E127-G399 WeakPolarHBondContact OE1-CA 3.49Å; K395-G399 PolarHBondContact O-N 2.88Å; G399-S401 PolarHBondContact O-N 3.49Å
400	Q	52.2	Low	62.2	Low	117 Å²	117	64.6 Å²	64.6	55%	0.547	36%	0.356	S	S	.	.			trans	-76	112.1	167.7	-71.3	-172.1	-10.2	0	0	108.2	E127 N402	E127-Q400 PolarHBondContact OE1-N 2.81Å; E127-Q400 VanDerWaalsContact OE1-N 3.1Å; Q400-N402 PolarHBondContact O-N 3.25Å
401	S	55.8	Low	63	Low	76 Å²	76	66.3 Å²	66.3	53%	0.531	37%	0.365	S	S	.	.			trans	-73	113.4	160.4	158.6	0	0	0	0	107.2	G399 D403	G399-S401 PolarHBondContact O-N 3.49Å; S401-D403 PolarHBondContact O-N 3.37Å; S401-D403 VanDerWaalsContact OG-CB 3.23Å; S401-D403 WeakPolarHBondContact OG-CB 3.39Å; S401-D403 PolarHBondContact OG-N 2.82Å; S401-D403 PolarHBondContact OG-OD2 2.94Å
402	N	57.1	Low	63.9	Low	68 Å²	68	66.3 Å²	66.3	36%	0.364	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	2.7	172.4	-71.5	-30.9	0	0	0	112.1	Q400 F404 A405 E406	Q400-N402 PolarHBondContact O-N 3.25Å; N402-F404 PolarHBondContact O-N 3.49Å; N402-F404 VanDerWaalsContact O-N 3.1Å; N402-A405 PolarHBondContact O-N 3.39Å; N402-E406 PolarHBondContact O-N 2.98Å
403	D	62.4	Low	64.7	Low	108 Å²	108	61.1 Å²	61.1	58%	0.578	34%	0.337	S	S	*	.	H	α-helix	trans	-57.6	-32.1	-174.8	-52.8	-20.1	0	0	0	111.5	S401 A407	S401-D403 PolarHBondContact O-N 3.37Å; S401-D403 VanDerWaalsContact OG-CB 3.23Å; S401-D403 WeakPolarHBondContact OG-CB 3.39Å; S401-D403 PolarHBondContact OG-N 2.82Å; S401-D403 PolarHBondContact OG-OD2 2.94Å; D403-A407 VanDerWaalsContact O-CB 3.24Å; D403-A407 WeakPolarHBondContact O-CB 3.36Å; D403-A407 PolarHBondContact O-N 3.32Å
404	F	65.5	Low	65.6	Low	138 Å²	138	65.2 Å²	65.2	61%	0.605	36%	0.359	S	S	*	.	H	α-helix	trans	-68.1	-46.1	175	-178.1	-99.9	0	0	0	112.4	N402 E406 A407 V408	N402-F404 PolarHBondContact O-N 3.49Å; N402-F404 VanDerWaalsContact O-N 3.1Å; F404-E406 VanDerWaalsContact C-N 3.3Å; F404-E406 PolarHBondContact O-N 3.4Å; F404-A407 PolarHBondContact O-N 3Å; F404-V408 HydrophobicContact CD1-CG2 4.13Å; F404-V408 HydrophobicContact CD2-CG2 4.15Å; F404-V408 HydrophobicContact CE1-CG2 3.71Å; F404-V408 HydrophobicContact CE2-CG2 3.74Å; F404-V408 HydrophobicContact CG-CG2 4.34Å; F404-V408 HydrophobicContact CZ-CG2 3.51Å; F404-V408 WeakPolarHBondContact O-CB 3.34Å; F404-V408 VanDerWaalsContact O-CG2 3.23Å; F404-V408 WeakPolarHBondContact O-CG2 3.47Å; F404-V408 PolarHBondContact O-N 3.23Å
405	A	67.1	Low	66.5	Low	13 Å²	13	64.3 Å²	64.3	11%	0.107	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-40.9	178.6	0	0	0	0	0	110.7	N402 S409 Y556	N402-A405 PolarHBondContact O-N 3.39Å; A405-S409 VanDerWaalsContact O-CB 3.25Å; A405-S409 WeakPolarHBondContact O-CB 3.26Å; A405-S409 PolarHBondContact O-N 3.39Å; A405-S409 PolarHBondContact O-OG 3.18Å; A405-Y556 HydrophobicContact CB-CD1 4.13Å; A405-Y556 HydrophobicContact CB-CE1 4.22Å; A405-Y556 HydrophobicContact CB-CG 4.34Å; A405-Y556 WeakPolarHBondContact O-CE1 3.44Å
406	E	69.5	Low	67.5	Low	66 Å²	66	59.8 Å²	59.8	31%	0.308	35%	0.348	S	S	.	.	H	α-helix	trans	-59.6	-56.2	173.9	-174.8	179.3	163.5	0	0	111.4	N402 F404 V408 S409 Q410 Y556	N402-E406 PolarHBondContact O-N 2.98Å; F404-E406 VanDerWaalsContact C-N 3.3Å; F404-E406 PolarHBondContact O-N 3.4Å; E406-V408 VanDerWaalsContact C-N 3.33Å; E406-V408 PolarHBondContact O-N 2.83Å; E406-S409 PolarHBondContact O-N 3.16Å; E406-S409 VanDerWaalsContact O-N 3.14Å; E406-S409 PolarHBondContact O-OG 3.42Å; E406-Q410 VanDerWaalsContact CG-NE2 3.35Å; E406-Q410 WeakPolarHBondContact O-CG 3.41Å; E406-Q410 PolarHBondContact O-N 2.84Å; E406-Q410 PolarHBondContact OE1-NE2 2.95Å; E406-Q410 VanDerWaalsContact OE1-NE2 3.16Å; E406-Y556 WeakPolarHBondContact CA-OH 3.46Å; E406-Y556 WeakPolarHBondContact CB-OH 3.49Å
407	A	71.2	Confident	68.6	Low	54 Å²	54	59.6 Å²	59.6	45%	0.446	35%	0.347	S	S	.	.	H	α-helix	trans	-59.5	-41.6	-179.5	0	0	0	0	0	112.7	D403 F404 L411	D403-A407 VanDerWaalsContact O-CB 3.24Å; D403-A407 WeakPolarHBondContact O-CB 3.36Å; D403-A407 PolarHBondContact O-N 3.32Å; F404-A407 PolarHBondContact O-N 3Å; A407-L411 WeakPolarHBondContact O-CB 3.48Å; A407-L411 PolarHBondContact O-N 2.94Å
408	V	70.8	Confident	69.6	Low	41 Å²	41	57.3 Å²	57.3	25%	0.248	35%	0.346	C	S	.	.	H	α-helix	trans	-67.4	-38.7	177.9	171.8	0	0	0	0	111.4	F404 E406 L411 A412 L559	F404-V408 HydrophobicContact CD1-CG2 4.13Å; F404-V408 HydrophobicContact CD2-CG2 4.15Å; F404-V408 HydrophobicContact CE1-CG2 3.71Å; F404-V408 HydrophobicContact CE2-CG2 3.74Å; F404-V408 HydrophobicContact CG-CG2 4.34Å; F404-V408 HydrophobicContact CZ-CG2 3.51Å; F404-V408 WeakPolarHBondContact O-CB 3.34Å; F404-V408 VanDerWaalsContact O-CG2 3.23Å; F404-V408 WeakPolarHBondContact O-CG2 3.47Å; F404-V408 PolarHBondContact O-N 3.23Å; E406-V408 VanDerWaalsContact C-N 3.33Å; E406-V408 PolarHBondContact O-N 2.83Å; V408-L411 PolarHBondContact O-N 3.11Å; V408-A412 VanDerWaalsContact O-CB 3.26Å; V408-A412 WeakPolarHBondContact O-CB 3.06Å; V408-A412 PolarHBondContact O-N 3.29Å; V408-L559 HydrophobicContact CB-CD2 4.13Å; V408-L559 HydrophobicContact CG1-CD1 3.78Å; V408-L559 HydrophobicContact CG1-CD2 3.79Å; V408-L559 HydrophobicContact CG1-CG 4.43Å
409	S	75.5	Confident	70.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-66.4	-40.6	178.2	71.3	0	0	0	0	112.7	A405 E406 A412 A413 F552 Y556	A405-S409 VanDerWaalsContact O-CB 3.25Å; A405-S409 WeakPolarHBondContact O-CB 3.26Å; A405-S409 PolarHBondContact O-N 3.39Å; A405-S409 PolarHBondContact O-OG 3.18Å; E406-S409 PolarHBondContact O-N 3.16Å; E406-S409 VanDerWaalsContact O-N 3.14Å; E406-S409 PolarHBondContact O-OG 3.42Å; S409-A412 PolarHBondContact O-N 3.29Å; S409-A413 WeakPolarHBondContact O-CB 3.38Å; S409-A413 PolarHBondContact O-N 3.34Å; S409-F552 VanDerWaalsContact OG-CB 3.25Å; S409-F552 WeakPolarHBondContact OG-CB 3.38Å; S409-F552 WeakPolarHBondContact OG-CD2 3.47Å; S409-F552 WeakPolarHBondContact OG-CG 3.21Å; S409-Y556 WeakPolarHBondContact OG-CE1 3.44Å
410	Q	76.9	Confident	71.7	Confident	41 Å²	41	62.1 Å²	62.1	19%	0.192	35%	0.353	C	S	.	.	H	α-helix	trans	-62.1	-46.1	174.3	-68.8	170.9	10.4	0	0	110.6	E406 A412 A413 L414 F547 F552	E406-Q410 VanDerWaalsContact CG-NE2 3.35Å; E406-Q410 WeakPolarHBondContact O-CG 3.41Å; E406-Q410 PolarHBondContact O-N 2.84Å; E406-Q410 PolarHBondContact OE1-NE2 2.95Å; E406-Q410 VanDerWaalsContact OE1-NE2 3.16Å; Q410-A412 VanDerWaalsContact C-N 3.35Å; Q410-A412 PolarHBondContact O-N 2.98Å; Q410-A413 WeakPolarHBondContact O-CB 3.35Å; Q410-A413 PolarHBondContact O-N 2.95Å; Q410-L414 WeakPolarHBondContact O-CG 3.36Å; Q410-L414 PolarHBondContact O-N 2.77Å; Q410-F547 HydrophobicContact CB-CB 4.48Å; Q410-F547 HydrophobicContact CG-CB 4.22Å; Q410-F552 HydrophobicContact CB-CE2 4.44Å; Q410-F552 HydrophobicContact CG-CD2 4.16Å; Q410-F552 HydrophobicContact CG-CE2 3.57Å; Q410-F552 HydrophobicContact CG-CZ 4.35Å
411	L	76.7	Confident	72.5	Confident	120 Å²	120	59.1 Å²	59.1	63%	0.628	34%	0.342	S	S	*	.	H	α-helix	trans	-64.1	-40.2	176.9	-174.9	63	0	0	0	111.8	A407 V408 A413 L414 A415	A407-L411 WeakPolarHBondContact O-CB 3.48Å; A407-L411 PolarHBondContact O-N 2.94Å; V408-L411 PolarHBondContact O-N 3.11Å; L411-A413 VanDerWaalsContact C-N 3.33Å; L411-A413 PolarHBondContact O-N 3.47Å; L411-L414 PolarHBondContact O-N 2.95Å; L411-A415 WeakPolarHBondContact O-CB 3.02Å; L411-A415 PolarHBondContact O-N 3.09Å
412	A	76.3	Confident	73.1	Confident	29 Å²	29	59.2 Å²	59.2	24%	0.24	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-39.6	176.2	0	0	0	0	0	111.5	V408 S409 Q410 A415 A416 L509 F555	V408-A412 VanDerWaalsContact O-CB 3.26Å; V408-A412 WeakPolarHBondContact O-CB 3.06Å; V408-A412 PolarHBondContact O-N 3.29Å; S409-A412 PolarHBondContact O-N 3.29Å; Q410-A412 VanDerWaalsContact C-N 3.35Å; Q410-A412 PolarHBondContact O-N 2.98Å; A412-A415 PolarHBondContact O-N 3.39Å; A412-A416 WeakPolarHBondContact O-CB 3.39Å; A412-A416 PolarHBondContact O-N 3.32Å; A412-L509 HydrophobicContact CB-CD1 3.79Å; A412-F555 HydrophobicContact CB-CE1 4.28Å; A412-F555 HydrophobicContact CB-CZ 4.33Å
413	A	80.1	Confident	73.6	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-49.7	174.6	0	0	0	0	0	110.9	S409 Q410 L411 A415 A416 A417 F432 L509 V513 F547 F552	S409-A413 WeakPolarHBondContact O-CB 3.38Å; S409-A413 PolarHBondContact O-N 3.34Å; Q410-A413 WeakPolarHBondContact O-CB 3.35Å; Q410-A413 PolarHBondContact O-N 2.95Å; L411-A413 VanDerWaalsContact C-N 3.33Å; L411-A413 PolarHBondContact O-N 3.47Å; A413-A415 VanDerWaalsContact C-N 3.33Å; A413-A415 PolarHBondContact O-N 2.98Å; A413-A416 PolarHBondContact O-N 2.95Å; A413-A417 PolarHBondContact O-N 2.97Å; A413-F432 VanDerWaalsContact O-CZ 3.31Å; A413-F432 WeakPolarHBondContact O-CZ 3.4Å; A413-L509 HydrophobicContact CB-CB 4.48Å; A413-L509 HydrophobicContact CB-CD2 4.15Å; A413-V513 HydrophobicContact CB-CG2 4.2Å; A413-F547 HydrophobicContact CB-CD1 4.1Å; A413-F547 HydrophobicContact CB-CE1 3.7Å; A413-F552 HydrophobicContact CB-CE1 3.94Å; A413-F552 HydrophobicContact CB-CZ 4.08Å
414	L	80.7	Confident	73.7	Confident	86 Å²	86	58.1 Å²	58.1	45%	0.45	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-41.1	177.1	-69.9	171.2	0	0	0	112.4	Q410 L411 A417 G418 F547	Q410-L414 WeakPolarHBondContact O-CG 3.36Å; Q410-L414 PolarHBondContact O-N 2.77Å; L411-L414 PolarHBondContact O-N 2.95Å; L414-A417 WeakPolarHBondContact O-CB 3.23Å; L414-A417 PolarHBondContact O-N 3.26Å; L414-G418 PolarHBondContact O-N 3.17Å; L414-F547 HydrophobicContact CD2-CD2 4.32Å; L414-F547 HydrophobicContact CD2-CE1 4.04Å; L414-F547 HydrophobicContact CD2-CE2 3.85Å; L414-F547 HydrophobicContact CD2-CZ 3.69Å; L414-F547 HydrophobicContact CG-CD1 4.41Å; L414-F547 HydrophobicContact CG-CE1 4.21Å; L414-F547 HydrophobicContact CG-CZ 4.36Å
415	A	78.2	Confident	73.6	Confident	64 Å²	64	59.8 Å²	59.8	53%	0.529	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-40.4	176.4	0	0	0	0	0	112.2	L411 A412 A413 G418 K419	L411-A415 WeakPolarHBondContact O-CB 3.02Å; L411-A415 PolarHBondContact O-N 3.09Å; A412-A415 PolarHBondContact O-N 3.39Å; A413-A415 VanDerWaalsContact C-N 3.33Å; A413-A415 PolarHBondContact O-N 2.98Å; A415-G418 PolarHBondContact O-N 3.36Å; A415-K419 PolarHBondContact O-N 2.95Å
416	A	80.3	Confident	73.4	Confident	26 Å²	26	61.4 Å²	61.4	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-63.3	-42.6	174.7	0	0	0	0	0	111.4	A412 A413 G418 K419 D420 F432	A412-A416 WeakPolarHBondContact O-CB 3.39Å; A412-A416 PolarHBondContact O-N 3.32Å; A413-A416 PolarHBondContact O-N 2.95Å; A416-G418 VanDerWaalsContact C-N 3.32Å; A416-G418 PolarHBondContact O-N 3.14Å; A416-K419 WeakPolarHBondContact O-CB 3.07Å; A416-K419 PolarHBondContact O-N 3.25Å; A416-D420 PolarHBondContact O-N 2.99Å; A416-D420 VanDerWaalsContact O-N 3.11Å; A416-F432 HydrophobicContact CB-CE1 3.83Å; A416-F432 HydrophobicContact CB-CZ 4.37Å
417	A	78.8	Confident	73.1	Confident	3 Å²	3	65.7 Å²	65.7	3%	0.025	42%	0.416	C	S	.	.	H	α-helix	trans	-59.8	-43.2	174	0	0	0	0	0	111.7	A413 L414 K419 D420 V421 A431 F432 L542	A413-A417 PolarHBondContact O-N 2.97Å; L414-A417 WeakPolarHBondContact O-CB 3.23Å; L414-A417 PolarHBondContact O-N 3.26Å; A417-K419 VanDerWaalsContact C-N 3.3Å; A417-K419 PolarHBondContact O-N 2.99Å; A417-D420 PolarHBondContact O-N 3.16Å; A417-V421 WeakPolarHBondContact O-CG2 3.24Å; A417-V421 PolarHBondContact O-N 2.96Å; A417-A431 HydrophobicContact CB-CB 3.87Å; A417-F432 HydrophobicContact CB-CE1 4.38Å; A417-F432 HydrophobicContact CB-CE2 3.7Å; A417-F432 HydrophobicContact CB-CZ 3.61Å; A417-L542 HydrophobicContact CB-CD2 3.77Å
418	G	79.3	Confident	73	Confident	39 Å²	39	67.6 Å²	67.6	40%	0.402	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-35.8	176.4	0	0	0	0	0	113.2	L414 A415 A416 V421 A422	L414-G418 PolarHBondContact O-N 3.17Å; A415-G418 PolarHBondContact O-N 3.36Å; A416-G418 VanDerWaalsContact C-N 3.32Å; A416-G418 PolarHBondContact O-N 3.14Å; G418-V421 PolarHBondContact O-N 3.14Å; G418-A422 WeakPolarHBondContact O-CB 3.06Å; G418-A422 PolarHBondContact O-N 2.99Å
419	K	75.9	Confident	73.3	Confident	162 Å²	162	67.1 Å²	67.1	70%	0.704	42%	0.415	S	S	*	.	H	α-helix	trans	-67	-42.7	175.3	-173.4	-177.6	176.2	-173.7	0	112	A415 A416 A417 V421 A422 A423	A415-K419 PolarHBondContact O-N 2.95Å; A416-K419 WeakPolarHBondContact O-CB 3.07Å; A416-K419 PolarHBondContact O-N 3.25Å; A417-K419 VanDerWaalsContact C-N 3.3Å; A417-K419 PolarHBondContact O-N 2.99Å; K419-V421 VanDerWaalsContact C-N 3.33Å; K419-A422 PolarHBondContact O-N 3.02Å; K419-A423 PolarHBondContact O-N 2.83Å; K419-A423 VanDerWaalsContact O-N 3.16Å
420	D	74.8	Confident	73.8	Confident	54 Å²	54	70.6 Å²	70.6	29%	0.289	43%	0.429	S	S	.	.	H	α-helix	trans	-63.5	-41.8	176	-70.7	-9.5	0	0	0	111.1	A416 A417 A423 L424 A431 F432	A416-D420 PolarHBondContact O-N 2.99Å; A416-D420 VanDerWaalsContact O-N 3.11Å; A417-D420 PolarHBondContact O-N 3.16Å; D420-A423 PolarHBondContact O-N 2.88Å; D420-L424 WeakPolarHBondContact O-CG 3.18Å; D420-L424 PolarHBondContact O-N 3.42Å; D420-A431 HydrophobicContact CB-CB 4.34Å; D420-F432 WeakPolarHBondContact OD2-CA 3.34Å; D420-F432 PolarHBondContact OD2-N 2.77Å
421	V	70.1	Confident	74.4	Confident	53 Å²	53	68.8 Å²	68.8	32%	0.321	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-47	175.8	164.4	0	0	0	0	111.4	A417 G418 K419 A423 L424 V429	A417-V421 WeakPolarHBondContact O-CG2 3.24Å; A417-V421 PolarHBondContact O-N 2.96Å; G418-V421 PolarHBondContact O-N 3.14Å; K419-V421 VanDerWaalsContact C-N 3.33Å; V421-A423 VanDerWaalsContact C-N 3.25Å; V421-A423 PolarHBondContact O-N 3.28Å; V421-L424 PolarHBondContact O-N 3.12Å; V421-L424 VanDerWaalsContact O-N 3.13Å; V421-V429 HydrophobicContact CB-CG1 3.7Å; V421-V429 HydrophobicContact CG1-CG1 3.67Å; V421-V429 HydrophobicContact CG2-CG1 3.49Å; V421-V429 VanDerWaalsContact CG2-CG1 3.49Å
422	A	68.9	Low	75.1	Confident	78 Å²	78	63.2 Å²	63.2	65%	0.645	39%	0.391	S	S	*	.	H	α-helix	trans	-66.1	-25.8	-179.1	0	0	0	0	0	113.4	G418 K419 L424	G418-A422 WeakPolarHBondContact O-CB 3.06Å; G418-A422 PolarHBondContact O-N 2.99Å; K419-A422 PolarHBondContact O-N 3.02Å; A422-L424 VanDerWaalsContact C-N 3.31Å
423	A	67.3	Low	75.9	Confident	80 Å²	80	65.3 Å²	65.3	66%	0.661	40%	0.401	S	S	*	.	H	α-helix	trans	-76.8	-17.1	175.9	0	0	0	0	0	113.2	K419 D420 V421	K419-A423 PolarHBondContact O-N 2.83Å; K419-A423 VanDerWaalsContact O-N 3.16Å; D420-A423 PolarHBondContact O-N 2.88Å; V421-A423 VanDerWaalsContact C-N 3.25Å; V421-A423 PolarHBondContact O-N 3.28Å
424	L	63.9	Low	76.6	Confident	74 Å²	74	65.9 Å²	65.9	39%	0.387	41%	0.407	S	S	.	.			trans	-98.3	101	-177	-67.1	170.6	0	0	0	110.8	D420 V421 A422 G426 V429 R430	D420-L424 WeakPolarHBondContact O-CG 3.18Å; D420-L424 PolarHBondContact O-N 3.42Å; V421-L424 PolarHBondContact O-N 3.12Å; V421-L424 VanDerWaalsContact O-N 3.13Å; A422-L424 VanDerWaalsContact C-N 3.31Å; L424-G426 PolarHBondContact O-N 3.09Å; L424-V429 HydrophobicContact CB-CG1 4.39Å; L424-V429 HydrophobicContact CD1-CG1 4.1Å; L424-R430 WeakPolarHBondContact CD1-O 3.16Å
425	N	62.7	Low	77.3	Confident	173 Å²	173	66.8 Å²	66.8	93%	0.925	41%	0.409	S	S	*	.			trans	-75	30.6	174.2	-73.8	-25.1	0	0	0	113.8
426	G	62.8	Low	78.3	Confident	46 Å²	46	65.9 Å²	65.9	47%	0.474	40%	0.401	S	S	.	.	S	Bend	trans	-123.5	169.8	-167.2	0	0	0	0	0	114.6	L424 V429	L424-G426 PolarHBondContact O-N 3.09Å; G426-V429 VanDerWaalsContact O-CG2 3.28Å; G426-V429 WeakPolarHBondContact O-CG2 3.36Å
427	V	63.9	Low	79	Confident	156 Å²	156	67.3 Å²	67.3	95%	0.945	40%	0.402	S	S	*	.	S	Bend	trans	-76.7	-29.3	175.9	-175.4	0	0	0	0	111.8	V429	V427-V429 PolarHBondContact O-N 2.86Å
428	D	69.2	Low	79.8	Confident	94 Å²	94	71 Å²	71	50%	0.503	42%	0.418	S	S	.	.	S	Bend	trans	-100.1	74	178.8	-168.6	10	0	0	0	110.4	R430	D428-R430 IonicContact OD1-CZ 3.24Å; D428-R430 IonicContact OD1-NE 3.67Å; D428-R430 PolarHBondContact OD1-NE 2.92Å; D428-R430 IonicContact OD1-NH2 3.95Å; D428-R430 PolarHBondContact OD1-NH2 3.49Å; D428-R430 IonicContact OD2-CZ 2.64Å; D428-R430 IonicContact OD2-NE 3.14Å; D428-R430 PolarHBondContact OD2-NE 2.88Å; D428-R430 IonicContact OD2-NH2 2.7Å; D428-R430 PolarHBondContact OD2-NH2 2.84Å
429	V	76.4	Confident	80.3	Confident	31 Å²	31	69.1 Å²	69.1	19%	0.188	40%	0.399	C	S	.	.			trans	-77.8	122	178.8	-176.2	0	0	0	0	109.7	V421 L424 G426 V427	V421-V429 HydrophobicContact CB-CG1 3.7Å; V421-V429 HydrophobicContact CG1-CG1 3.67Å; V421-V429 HydrophobicContact CG2-CG1 3.49Å; V421-V429 VanDerWaalsContact CG2-CG1 3.49Å; L424-V429 HydrophobicContact CB-CG1 4.39Å; L424-V429 HydrophobicContact CD1-CG1 4.1Å; G426-V429 VanDerWaalsContact O-CG2 3.28Å; G426-V429 WeakPolarHBondContact O-CG2 3.36Å; V427-V429 PolarHBondContact O-N 2.86Å
430	R	87.2	Confident	80.8	Confident	74 Å²	74	64.5 Å²	64.5	28%	0.279	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	117.1	-179.8	-61.8	-171.5	-176.2	179	2	111.8	L424 D428 T433 I537 T538	L424-R430 WeakPolarHBondContact CD1-O 3.16Å; D428-R430 IonicContact OD1-CZ 3.24Å; D428-R430 IonicContact OD1-NE 3.67Å; D428-R430 PolarHBondContact OD1-NE 2.92Å; D428-R430 IonicContact OD1-NH2 3.95Å; D428-R430 PolarHBondContact OD1-NH2 3.49Å; D428-R430 IonicContact OD2-CZ 2.64Å; D428-R430 IonicContact OD2-NE 3.14Å; D428-R430 PolarHBondContact OD2-NE 2.88Å; D428-R430 IonicContact OD2-NH2 2.7Å; D428-R430 PolarHBondContact OD2-NH2 2.84Å; R430-T433 PolarHBondContact O-OG1 3.23Å; R430-I537 CarbonylContact C-O 3.49Å; R430-I537 WeakPolarHBondContact CA-O 3.42Å; R430-T538 HydrophobicContact CG-CG2 4.42Å
431	A	88.4	Confident	81.1	Confident	2 Å²	2	62.8 Å²	62.8	2%	0.017	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	152.3	175.5	0	0	0	0	0	111.2	A417 D420 T433 G536 I537	A417-A431 HydrophobicContact CB-CB 3.87Å; D420-A431 HydrophobicContact CB-CB 4.34Å; A431-T433 VanDerWaalsContact C-N 3.33Å; A431-T433 PolarHBondContact O-N 2.88Å; A431-G536 CarbonylContact O-C 3.52Å; A431-G536 WeakPolarHBondContact O-CA 3.46Å; A431-I537 PolarHBondContact N-O 3.31Å; A431-I537 PolarHBondContact O-N 2.89Å
432	F	92.1	Very high	80.8	Confident	4 Å²	4	62 Å²	62	2%	0.018	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	34.8	172.1	-50.7	-53.7	0	0	0	115	A413 A416 A417 D420 G434 F505 A510 V513 Q514 I537 L542	A413-F432 VanDerWaalsContact O-CZ 3.31Å; A413-F432 WeakPolarHBondContact O-CZ 3.4Å; A416-F432 HydrophobicContact CB-CE1 3.83Å; A416-F432 HydrophobicContact CB-CZ 4.37Å; A417-F432 HydrophobicContact CB-CE1 4.38Å; A417-F432 HydrophobicContact CB-CE2 3.7Å; A417-F432 HydrophobicContact CB-CZ 3.61Å; D420-F432 WeakPolarHBondContact OD2-CA 3.34Å; D420-F432 PolarHBondContact OD2-N 2.77Å; F432-G434 PolarHBondContact O-N 3.4Å; F432-F505 WeakPolarHBondContact O-CD1 3.25Å; F432-F505 WeakPolarHBondContact O-CE1 3.38Å; F432-A510 HydrophobicContact CB-CB 3.82Å; F432-A510 HydrophobicContact CD1-CB 3.44Å; F432-A510 VanDerWaalsContact CD1-CB 3.44Å; F432-A510 HydrophobicContact CE1-CB 4.24Å; F432-A510 HydrophobicContact CG-CB 3.92Å; F432-V513 HydrophobicContact CD2-CB 4.16Å; F432-V513 HydrophobicContact CD2-CG1 3.98Å; F432-V513 HydrophobicContact CE2-CB 4.03Å; F432-V513 HydrophobicContact CE2-CG1 3.85Å; F432-V513 HydrophobicContact CE2-CG2 4.1Å; F432-V513 HydrophobicContact CZ-CG2 4.38Å; F432-Q514 HydrophobicContact CB-CG 4Å; F432-Q514 PolarHBondContact O-NE2 2.88Å; F432-I537 HydrophobicContact CD2-CD1 4.35Å; F432-L542 HydrophobicContact CE2-CD1 4.26Å
433	T	92.5	Very high	80.2	Confident	73 Å²	73	59 Å²	59	45%	0.448	34%	0.343	S	S	.	.			trans	-63.1	127.3	178.7	-62	0	0	0	0	110.6	R430 A431 G536	R430-T433 PolarHBondContact O-OG1 3.23Å; A431-T433 VanDerWaalsContact C-N 3.33Å; A431-T433 PolarHBondContact O-N 2.88Å; T433-G536 WeakPolarHBondContact OG1-CA 3.38Å; T433-G536 PolarHBondContact OG1-N 2.95Å
434	G	94.6	Very high	79.5	Confident	11 Å²	11	56.1 Å²	56.1	11%	0.113	32%	0.319	C	S	.	.			trans	-101.7	175.9	176.8	0	0	0	0	0	112.9	F432 Q504 C534	F432-G434 PolarHBondContact O-N 3.4Å; G434-Q504 CarbonylContact C-O 3.47Å; G434-Q504 WeakPolarHBondContact CA-O 3.46Å; G434-C534 WeakPolarHBondContact CA-O 3.2Å; G434-C534 PolarHBondContact N-O 3.02Å
435	Q	96.8	Very high	78.9	Confident	106 Å²	106	54.1 Å²	54.1	50%	0.495	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	135.2	176.4	-62.7	-177	6	0	0	110.9	K437 Q504	Q435-K437 PolarHBondContact O-N 3.28Å; Q435-Q504 PolarHBondContact N-O 3.24Å; Q435-Q504 PolarHBondContact O-N 3.3Å
436	A	97.7	Very high	78.4	Confident	44 Å²	44	52 Å²	52	36%	0.364	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	123.3	171	0	0	0	0	0	109.9	F438 Y502 P532	A436-F438 HydrophobicContact CB-CE2 4.2Å; A436-F438 HydrophobicContact CB-CZ 4.43Å; A436-Y502 WeakPolarHBondContact CA-O 3.4Å; A436-P532 HydrophobicContact CB-CB 4.07Å; A436-P532 HydrophobicContact CB-CG 4.19Å
437	K	96	Very high	78.3	Confident	57 Å²	57	50.8 Å²	50.8	25%	0.248	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.7	175.4	-59.3	-65.3	-178.9	-173	0	110.1	Q435 L471 S501 Y502 Q504	Q435-K437 PolarHBondContact O-N 3.28Å; K437-L471 HydrophobicContact CB-CD1 3.87Å; K437-L471 HydrophobicContact CB-CD2 4.09Å; K437-L471 HydrophobicContact CB-CG 4.49Å; K437-L471 HydrophobicContact CG-CD1 4.36Å; K437-S501 CarbonylContact O-C 3.58Å; K437-S501 VanDerWaalsContact O-CA 3.31Å; K437-S501 WeakPolarHBondContact O-CA 3.29Å; K437-Y502 PolarHBondContact N-O 3.11Å; K437-Y502 PolarHBondContact O-N 3.46Å; K437-Q504 HydrophobicContact CG-CB 3.82Å
438	F	94.5	Very high	78.8	Confident	79 Å²	79	44.1 Å²	44.1	35%	0.346	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.2	-176.6	-57	-92.3	0	0	0	110.8	A436 F486 R500 S501 P532	A436-F438 HydrophobicContact CB-CE2 4.2Å; A436-F438 HydrophobicContact CB-CZ 4.43Å; F438-F486 AromaticContact CD1-CE1 3.86Å; F438-F486 HydrophobicContact CD1-CE1 3.86Å; F438-F486 HydrophobicContact CD1-CZ 4.13Å; F438-F486 AromaticContact CE1-CE1 3.86Å; F438-F486 HydrophobicContact CE1-CE1 3.86Å; F438-F486 HydrophobicContact CE1-CZ 4.13Å; F438-R500 VanDerWaalsContact CA-O 3.28Å; F438-R500 WeakPolarHBondContact CA-O 3.32Å; F438-S501 VanDerWaalsContact CE1-CB 3.42Å; F438-P532 HydrophobicContact CE1-CG 4.14Å; F438-P532 HydrophobicContact CZ-CG 4.01Å
439	C	90.4	Very high	79.4	Confident	1 Å²	1	40 Å²	40	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.4	168.4	56.2	0	0	0	0	110.8	C449 C450 E468 L471 K499 R500 Y502	C439-C449 HydrophobicContact CB-CB 4.44Å; C439-C449 WeakPolarHBondContact CB-O 3.48Å; C439-C450 HydrophobicContact CB-CB 4.06Å; C439-C450 WeakPolarHBondContact CB-SG 3.05Å; C439-C450 PolarHBondContact O-SG 3.2Å; C439-C450 VanDerWaalsContact O-SG 3.34Å; C439-C450 WeakPolarHBondContact SG-CA 3.46Å; C439-C450 WeakPolarHBondContact SG-CB 3.35Å; C439-C450 CovalentContact SG-SG 2.01Å; C439-C450 PolarHBondContact SG-SG 3.24Å; C439-E468 WeakPolarHBondContact CA-OE1 3.33Å; C439-E468 HydrophobicContact CB-CG 4.1Å; C439-L471 HydrophobicContact CB-CD2 4.08Å; C439-K499 VanDerWaalsContact O-CA 3.27Å; C439-K499 WeakPolarHBondContact O-CA 3.22Å; C439-R500 PolarHBondContact N-O 3.46Å; C439-R500 PolarHBondContact O-N 2.82Å; C439-Y502 WeakPolarHBondContact SG-CE2 3.38Å
440	K	87.5	Confident	79.7	Confident	64 Å²	64	38.7 Å²	38.7	28%	0.278	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.7	177.6	-68.1	167.2	-73.8	168.4	0	110.7	C449 E468 K499	K440-C449 WeakPolarHBondContact O-CB 3.38Å; K440-C449 PolarHBondContact O-N 3.16Å; K440-E468 WeakPolarHBondContact CB-OE1 3.08Å; K440-E468 VanDerWaalsContact CE-CD 3.49Å; K440-E468 WeakPolarHBondContact CE-OE1 3.29Å; K440-E468 VanDerWaalsContact CE-OE2 3.23Å; K440-E468 WeakPolarHBondContact CE-OE2 3.41Å; K440-E468 PolarHBondContact N-OE1 3.32Å; K440-E468 IonicContact NZ-OE2 3.89Å; K440-K499 HydrophobicContact CG-CG 4.18Å
441	K	80.1	Confident	79.1	Confident	18 Å²	18	36.6 Å²	36.6	8%	0.078	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	97.9	166.7	-59.9	-178.6	70.1	-170.8	0	107.3	C450 E485 K498	K441-C450 HydrophobicContact CG-CB 4.13Å; K441-C450 WeakPolarHBondContact CG-SG 3.11Å; K441-E485 HydrophobicContact CD-CG 4.46Å; K441-E485 WeakPolarHBondContact CD-OE1 3.05Å; K441-E485 WeakPolarHBondContact CD-OE2 3.17Å; K441-E485 IonicContact NZ-OE1 2.84Å; K441-E485 PolarHBondContact NZ-OE1 2.87Å; K441-E485 IonicContact NZ-OE2 2.65Å; K441-E485 PolarHBondContact NZ-OE2 3.02Å; K441-K498 HydrophobicContact CB-CB 4.26Å; K441-K498 PolarHBondContact N-O 3.14Å
442	A	64.3	Low	78	Confident	38 Å²	38	38.2 Å²	38.2	31%	0.314	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	151.4	166.2	0	0	0	0	0	109.6	S447	A442-S447 VanDerWaalsContact C-OG 3.22Å; A442-S447 WeakPolarHBondContact CB-OG 3.09Å; A442-S447 PolarHBondContact N-O 2.91Å; A442-S447 VanDerWaalsContact N-O 3.11Å; A442-S447 CarbonylContact O-C 3.46Å; A442-S447 PolarHBondContact O-OG 2.95Å
443	A	56.8	Low	76.3	Confident	15 Å²	15	41 Å²	41	12%	0.124	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	9.4	120.8	170.9	0	0	0	0	0	117.8	E289 G445 Y446	E289-A443 VanDerWaalsContact O-CA 3.28Å; E289-A443 WeakPolarHBondContact O-CA 3.27Å; E289-A443 WeakPolarHBondContact O-CB 3.39Å; A443-G445 PolarHBondContact O-N 2.57Å; A443-Y446 HydrophobicContact CB-CE1 4.08Å; A443-Y446 HydrophobicContact CB-CE2 4.17Å; A443-Y446 VanDerWaalsContact CB-OH 3.27Å; A443-Y446 WeakPolarHBondContact CB-OH 3.31Å
444	A	52.3	Low	74.3	Confident	19 Å²	19	38.8 Å²	38.8	16%	0.157	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-12.7	90.9	174.4	0	0	0	0	0	115.8	L290 K292 V328 Y446	L290-A444 WeakPolarHBondContact O-CB 3.34Å; L290-A444 PolarHBondContact O-N 3.11Å; K292-A444 HydrophobicContact CB-CB 3.78Å; V328-A444 WeakPolarHBondContact O-CB 3.47Å; A444-Y446 PolarHBondContact O-N 2.78Å
445	G	49.7	Very low	71.5	Confident	31 Å²	31	45.8 Å²	45.8	32%	0.32	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.2	-34.2	156.3	0	0	0	0	0	117.5	A443	A443-G445 PolarHBondContact O-N 2.57Å
446	Y	53.1	Low	69.1	Low	128 Å²	128	40.9 Å²	40.9	50%	0.502	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-18.7	-175.4	54.9	-93.5	0	0	0	114.3	A443 A444	A443-Y446 HydrophobicContact CB-CE1 4.08Å; A443-Y446 HydrophobicContact CB-CE2 4.17Å; A443-Y446 VanDerWaalsContact CB-OH 3.27Å; A443-Y446 WeakPolarHBondContact CB-OH 3.31Å; A444-Y446 PolarHBondContact O-N 2.78Å
447	S	60	Low	66.6	Low	21 Å²	21	41.4 Å²	41.4	15%	0.147	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	32.8	-176.4	52.4	0	0	0	0	113.5	A442 C449	A442-S447 VanDerWaalsContact C-OG 3.22Å; A442-S447 WeakPolarHBondContact CB-OG 3.09Å; A442-S447 PolarHBondContact N-O 2.91Å; A442-S447 VanDerWaalsContact N-O 3.11Å; A442-S447 CarbonylContact O-C 3.46Å; A442-S447 PolarHBondContact O-OG 2.95Å; S447-C449 PolarHBondContact O-N 3.34Å
448	N	75.1	Confident	64.2	Low	17 Å²	17	44.8 Å²	44.8	9%	0.091	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	98.5	173.8	-173.2	-9.4	0	0	0	110	C450 K451	N448-C450 PolarHBondContact O-N 2.71Å; N448-C450 WeakPolarHBondContact OD1-CA 3.4Å; N448-C450 WeakPolarHBondContact OD1-CB 3.2Å; N448-C450 PolarHBondContact OD1-N 3.5Å; N448-K451 HydrophobicContact CB-CG 4.08Å; N448-K451 WeakPolarHBondContact ND2-CG 3.34Å
449	C	80.9	Confident	61.7	Low	7 Å²	7	46.4 Å²	46.4	5%	0.047	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	3.8	177.6	-63.1	0	0	0	0	113.5	C439 K440 S447 C464 E468	C439-C449 HydrophobicContact CB-CB 4.44Å; C439-C449 WeakPolarHBondContact CB-O 3.48Å; K440-C449 WeakPolarHBondContact O-CB 3.38Å; K440-C449 PolarHBondContact O-N 3.16Å; S447-C449 PolarHBondContact O-N 3.34Å; C449-C464 WeakPolarHBondContact CA-SG 3.5Å; C449-C464 HydrophobicContact CB-CB 3.78Å; C449-C464 WeakPolarHBondContact CB-SG 3.39Å; C449-C464 WeakPolarHBondContact SG-CA 3.36Å; C449-C464 WeakPolarHBondContact SG-CB 3.24Å; C449-C464 CovalentContact SG-SG 2.04Å; C449-C464 PolarHBondContact SG-SG 3.23Å; C449-E468 HydrophobicContact CB-CB 4.17Å; C449-E468 HydrophobicContact CB-CG 4.25Å; C449-E468 WeakPolarHBondContact CB-OE1 3.19Å
450	C	83.8	Confident	59.7	Low	3 Å²	3	49 Å²	49	2%	0.02	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-10.1	176	-56.8	0	0	0	0	113.9	C439 K441 N448 K475	C439-C450 HydrophobicContact CB-CB 4.06Å; C439-C450 WeakPolarHBondContact CB-SG 3.05Å; C439-C450 PolarHBondContact O-SG 3.2Å; C439-C450 VanDerWaalsContact O-SG 3.34Å; C439-C450 WeakPolarHBondContact SG-CA 3.46Å; C439-C450 WeakPolarHBondContact SG-CB 3.35Å; C439-C450 CovalentContact SG-SG 2.01Å; C439-C450 PolarHBondContact SG-SG 3.24Å; K441-C450 HydrophobicContact CG-CB 4.13Å; K441-C450 WeakPolarHBondContact CG-SG 3.11Å; N448-C450 PolarHBondContact O-N 2.71Å; N448-C450 WeakPolarHBondContact OD1-CA 3.4Å; N448-C450 WeakPolarHBondContact OD1-CB 3.2Å; N448-C450 PolarHBondContact OD1-N 3.5Å; C450-K475 PolarHBondContact O-NZ 2.98Å
451	K	74.7	Confident	57.8	Low	30 Å²	30	50.8 Å²	50.8	13%	0.13	29%	0.29	C	S	.	.			trans	-73.9	145.6	176.6	-71.4	-154.5	167.1	-152.9	0	111.4	S331 A332 D333 N448 Q457	S331-K451 PolarHBondContact O-NZ 3.27Å; A332-K451 PolarHBondContact O-NZ 2.89Å; A332-K451 VanDerWaalsContact O-NZ 3.08Å; D333-K451 HydrophobicContact CB-CD 4.33Å; D333-K451 WeakPolarHBondContact OD2-CA 3.38Å; D333-K451 VanDerWaalsContact OD2-CB 3.32Å; D333-K451 WeakPolarHBondContact OD2-CB 3.28Å; D333-K451 WeakPolarHBondContact OD2-CD 3.47Å; D333-K451 VanDerWaalsContact OD2-CG 3.27Å; D333-K451 WeakPolarHBondContact OD2-CG 3.25Å; N448-K451 HydrophobicContact CB-CG 4.08Å; N448-K451 WeakPolarHBondContact ND2-CG 3.34Å; K451-Q457 PolarHBondContact O-NE2 3.41Å
452	D	64.6	Low	56.7	Low	36 Å²	36	50.3 Å²	50.3	19%	0.193	29%	0.29	C	S	.	.	S	Bend	trans	-80.7	-24.5	177.1	-64	-40.4	0	0	0	112.2	D333 G335 K475	D333-D452 PolarHBondContact OD2-N 2.89Å; G335-D452 WeakPolarHBondContact CA-OD2 3.34Å; D452-K475 WeakPolarHBondContact OD1-CB 3.44Å; D452-K475 VanDerWaalsContact OD1-CD 3.26Å; D452-K475 WeakPolarHBondContact OD1-CD 3.17Å; D452-K475 WeakPolarHBondContact OD1-CE 3.32Å; D452-K475 IonicContact OD1-NZ 3.19Å; D452-K475 PolarHBondContact OD1-NZ 2.89Å; D452-K475 IonicContact OD2-NZ 3.18Å; D452-K475 PolarHBondContact OD2-NZ 2.82Å
453	S	56.8	Low	56.8	Low	64 Å²	64	57.8 Å²	57.8	45%	0.448	32%	0.315	S	S	.	.	S	Bend	trans	-150.5	150.4	178.8	63.3	0	0	0	0	110.8
454	G	50.1	Low	57.8	Low	26 Å²	26	57.9 Å²	57.9	27%	0.268	32%	0.315	S	S	.	.			trans	161.9	139.5	172.5	0	0	0	0	0	112.6	G456 Q457 D458	G454-G456 PolarHBondContact O-N 3.02Å; G454-Q457 PolarHBondContact O-N 3.42Å; G454-D458 PolarHBondContact O-N 3.29Å
455	W	36.3	Very low	59.3	Low	157 Å²	157	59.3 Å²	59.3	60%	0.595	32%	0.323	S	S	*	.	H	α-helix	trans	-42.9	-40.2	-178.3	67.7	-84.9	0	0	0	113.7	Q457 D458 I459 L461	W455-Q457 VanDerWaalsContact C-N 3.35Å; W455-Q457 PolarHBondContact O-N 3.08Å; W455-D458 PolarHBondContact O-N 3.25Å; W455-I459 HydrophobicContact CE3-CD1 3.97Å; W455-I459 HydrophobicContact CE3-CG1 4.31Å; W455-I459 HydrophobicContact CZ3-CD1 4.08Å; W455-I459 VanDerWaalsContact O-CG1 3.26Å; W455-I459 WeakPolarHBondContact O-CG1 3.32Å; W455-I459 PolarHBondContact O-N 2.96Å; W455-I459 VanDerWaalsContact O-N 3.08Å; W455-L461 HydrophobicContact CE3-CD1 4.49Å; W455-L461 HydrophobicContact CH2-CD1 4.32Å; W455-L461 HydrophobicContact CZ3-CD1 3.66Å
456	G	46.4	Very low	60.8	Low	3 Å²	3	62.1 Å²	62.1	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-25.3	-178.4	0	0	0	0	0	115.5	G454 L461 A462	G454-G456 PolarHBondContact O-N 3.02Å; G456-L461 PolarHBondContact O-N 3.39Å; G456-A462 PolarHBondContact O-N 3.19Å
457	Q	46.1	Very low	62.3	Low	55 Å²	55	61.3 Å²	61.3	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-78.9	-43.3	169.7	-77.2	-173.1	13.7	0	0	110.9	K451 G454 W455 I459 G460 A462	K451-Q457 PolarHBondContact O-NE2 3.41Å; G454-Q457 PolarHBondContact O-N 3.42Å; W455-Q457 VanDerWaalsContact C-N 3.35Å; W455-Q457 PolarHBondContact O-N 3.08Å; Q457-I459 VanDerWaalsContact C-N 3.27Å; Q457-I459 PolarHBondContact O-N 3.32Å; Q457-G460 PolarHBondContact O-N 3.22Å; Q457-A462 HydrophobicContact CG-CB 4.32Å
458	D	44.9	Very low	63.5	Low	128 Å²	128	60.6 Å²	60.6	68%	0.684	34%	0.337	S	S	*	.	H	α-helix	trans	-63.2	-32.9	-176.2	-59	-35.9	0	0	0	112.5	G454 W455	G454-D458 PolarHBondContact O-N 3.29Å; W455-D458 PolarHBondContact O-N 3.25Å
459	I	42.8	Very low	63.8	Low	114 Å²	114	66.3 Å²	66.3	59%	0.585	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	14.4	175.2	65.5	160.8	0	0	0	114.3	W455 Q457 L461	W455-I459 HydrophobicContact CE3-CD1 3.97Å; W455-I459 HydrophobicContact CE3-CG1 4.31Å; W455-I459 HydrophobicContact CZ3-CD1 4.08Å; W455-I459 VanDerWaalsContact O-CG1 3.26Å; W455-I459 WeakPolarHBondContact O-CG1 3.32Å; W455-I459 PolarHBondContact O-N 2.96Å; W455-I459 VanDerWaalsContact O-N 3.08Å; Q457-I459 VanDerWaalsContact C-N 3.27Å; Q457-I459 PolarHBondContact O-N 3.32Å; I459-L461 HydrophobicContact CD1-CD1 3.37Å; I459-L461 HydrophobicContact CD1-CG 3.82Å; I459-L461 HydrophobicContact CG1-CD1 3.88Å; I459-L461 HydrophobicContact CG1-CG 3.9Å; I459-L461 PolarHBondContact O-N 2.95Å
460	G	46.6	Very low	64	Low	56 Å²	56	68.7 Å²	68.7	58%	0.577	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	15.3	170.6	0	0	0	0	0	116	Q457	Q457-G460 PolarHBondContact O-N 3.22Å
461	L	47.7	Very low	64.2	Low	101 Å²	101	68.7 Å²	68.7	53%	0.529	38%	0.381	S	S	.	.			trans	-74.6	-33	178.4	-69.4	177.4	0	0	0	112	W455 G456 I459 K463	W455-L461 HydrophobicContact CE3-CD1 4.49Å; W455-L461 HydrophobicContact CH2-CD1 4.32Å; W455-L461 HydrophobicContact CZ3-CD1 3.66Å; G456-L461 PolarHBondContact O-N 3.39Å; I459-L461 HydrophobicContact CD1-CD1 3.37Å; I459-L461 HydrophobicContact CD1-CG 3.82Å; I459-L461 HydrophobicContact CG1-CD1 3.88Å; I459-L461 HydrophobicContact CG1-CG 3.9Å; I459-L461 PolarHBondContact O-N 2.95Å; L461-K463 PolarHBondContact O-N 2.96Å
462	A	56.9	Low	64.6	Low	8 Å²	8	67.9 Å²	67.9	7%	0.066	38%	0.38	C	S	.	.	S	Bend	trans	-74.3	106.4	172	0	0	0	0	0	108.9	G456 Q457 C464	G456-A462 PolarHBondContact O-N 3.19Å; Q457-A462 HydrophobicContact CG-CB 4.32Å; A462-C464 VanDerWaalsContact CB-SG 3.53Å; A462-C464 PolarHBondContact O-N 3.08Å
463	K	67.8	Low	65.5	Low	195 Å²	195	71.9 Å²	71.9	85%	0.848	40%	0.396	S	S	*	.			trans	-69.5	57.5	172.5	-66.4	-175	178.9	-178.7	0	111.5	L461	L461-K463 PolarHBondContact O-N 2.96Å
464	C	77.1	Confident	66.9	Low	17 Å²	17	69.1 Å²	69.1	12%	0.115	38%	0.377	C	S	.	.			trans	-76.4	140.9	176.3	-53.3	0	0	0	0	110	C449 A462 E468	C449-C464 WeakPolarHBondContact CA-SG 3.5Å; C449-C464 HydrophobicContact CB-CB 3.78Å; C449-C464 WeakPolarHBondContact CB-SG 3.39Å; C449-C464 WeakPolarHBondContact SG-CA 3.36Å; C449-C464 WeakPolarHBondContact SG-CB 3.24Å; C449-C464 CovalentContact SG-SG 2.04Å; C449-C464 PolarHBondContact SG-SG 3.23Å; A462-C464 VanDerWaalsContact CB-SG 3.53Å; A462-C464 PolarHBondContact O-N 3.08Å; C464-E468 VanDerWaalsContact CA-OE2 3.32Å; C464-E468 WeakPolarHBondContact CA-OE2 3.41Å; C464-E468 HydrophobicContact CB-CB 4Å
465	S	82.9	Confident	68.7	Low	48 Å²	48	68.3 Å²	68.3	34%	0.336	37%	0.366	S	S	.	.			trans	-66.9	166.3	175.4	70.5	0	0	0	0	111.3	D467 E468 K469	S465-D467 PolarHBondContact O-N 3.22Å; S465-D467 PolarHBondContact OG-N 3.04Å; S465-E468 PolarHBondContact N-OE2 3.13Å; S465-E468 PolarHBondContact O-N 2.88Å; S465-E468 WeakPolarHBondContact OG-CG 3.46Å; S465-E468 PolarHBondContact OG-N 3.36Å; S465-E468 PolarHBondContact OG-OE2 2.72Å; S465-K469 WeakPolarHBondContact O-CG 3.13Å; S465-K469 PolarHBondContact O-N 3.49Å; S465-K469 VanDerWaalsContact O-N 3.15Å
466	S	81.8	Confident	70.9	Confident	91 Å²	91	64.2 Å²	64.2	64%	0.636	36%	0.361	S	S	*	.	H	α-helix	trans	-54.8	-40.7	170.6	48.8	0	0	0	0	112.1	K469 A470	S466-K469 PolarHBondContact O-N 3Å; S466-A470 PolarHBondContact O-N 3.41Å
467	D	84.2	Confident	72.7	Confident	110 Å²	110	66.7 Å²	66.7	59%	0.588	37%	0.374	S	S	*	.	H	α-helix	trans	-68	-36.8	-178.3	-62.5	-3.8	0	0	0	111.7	S465 A470 L471	S465-D467 PolarHBondContact O-N 3.22Å; S465-D467 PolarHBondContact OG-N 3.04Å; D467-A470 PolarHBondContact O-N 2.82Å; D467-L471 WeakPolarHBondContact O-CB 3.29Å; D467-L471 PolarHBondContact O-N 3.48Å
468	E	86.7	Confident	74.7	Confident	7 Å²	7	65.4 Å²	65.4	3%	0.033	37%	0.367	C	S	.	.	H	α-helix	trans	-66.9	-37.3	175.2	-71.3	173.6	131.1	0	0	111.4	C439 K440 C449 C464 S465 L471 A472	C439-E468 WeakPolarHBondContact CA-OE1 3.33Å; C439-E468 HydrophobicContact CB-CG 4.1Å; K440-E468 WeakPolarHBondContact CB-OE1 3.08Å; K440-E468 VanDerWaalsContact CE-CD 3.49Å; K440-E468 WeakPolarHBondContact CE-OE1 3.29Å; K440-E468 VanDerWaalsContact CE-OE2 3.23Å; K440-E468 WeakPolarHBondContact CE-OE2 3.41Å; K440-E468 PolarHBondContact N-OE1 3.32Å; K440-E468 IonicContact NZ-OE2 3.89Å; C449-E468 HydrophobicContact CB-CB 4.17Å; C449-E468 HydrophobicContact CB-CG 4.25Å; C449-E468 WeakPolarHBondContact CB-OE1 3.19Å; C464-E468 VanDerWaalsContact CA-OE2 3.32Å; C464-E468 WeakPolarHBondContact CA-OE2 3.41Å; C464-E468 HydrophobicContact CB-CB 4Å; S465-E468 PolarHBondContact N-OE2 3.13Å; S465-E468 PolarHBondContact O-N 2.88Å; S465-E468 WeakPolarHBondContact OG-CG 3.46Å; S465-E468 PolarHBondContact OG-N 3.36Å; S465-E468 PolarHBondContact OG-OE2 2.72Å; E468-L471 PolarHBondContact O-N 3.38Å; E468-A472 PolarHBondContact O-N 3.39Å
469	K	81.3	Confident	76.9	Confident	136 Å²	136	60.9 Å²	60.9	59%	0.591	34%	0.343	S	S	*	.	H	α-helix	trans	-68.4	-41.3	174.1	-66.4	179.2	-177.8	-173	0	112.2	S465 S466 L471 A472 K473	S465-K469 WeakPolarHBondContact O-CG 3.13Å; S465-K469 PolarHBondContact O-N 3.49Å; S465-K469 VanDerWaalsContact O-N 3.15Å; S466-K469 PolarHBondContact O-N 3Å; K469-L471 VanDerWaalsContact C-N 3.29Å; K469-L471 PolarHBondContact O-N 3.21Å; K469-A472 PolarHBondContact O-N 3.28Å; K469-K473 PolarHBondContact O-N 2.76Å; K469-K473 VanDerWaalsContact O-N 3.12Å
470	A	84.9	Confident	79.2	Confident	58 Å²	58	55.8 Å²	55.8	48%	0.479	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-39.4	174.6	0	0	0	0	0	111.2	S466 D467 K473 A474	S466-A470 PolarHBondContact O-N 3.41Å; D467-A470 PolarHBondContact O-N 2.82Å; A470-K473 PolarHBondContact O-N 3.44Å; A470-A474 PolarHBondContact O-N 3.01Å
471	L	88.4	Confident	81.4	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-44.3	173.6	177.9	61.2	0	0	0	111.8	K437 C439 D467 E468 K469 K473 A474 K475 T480 Y502	K437-L471 HydrophobicContact CB-CD1 3.87Å; K437-L471 HydrophobicContact CB-CD2 4.09Å; K437-L471 HydrophobicContact CB-CG 4.49Å; K437-L471 HydrophobicContact CG-CD1 4.36Å; C439-L471 HydrophobicContact CB-CD2 4.08Å; D467-L471 WeakPolarHBondContact O-CB 3.29Å; D467-L471 PolarHBondContact O-N 3.48Å; E468-L471 PolarHBondContact O-N 3.38Å; K469-L471 VanDerWaalsContact C-N 3.29Å; K469-L471 PolarHBondContact O-N 3.21Å; L471-K473 VanDerWaalsContact C-N 3.27Å; L471-K473 PolarHBondContact O-N 3.04Å; L471-A474 PolarHBondContact O-N 3.09Å; L471-A474 VanDerWaalsContact O-N 3.12Å; L471-K475 HydrophobicContact CD1-CG 4.36Å; L471-K475 HydrophobicContact CG-CD 4.46Å; L471-K475 HydrophobicContact CG-CG 4.49Å; L471-K475 WeakPolarHBondContact O-CG 3.42Å; L471-K475 PolarHBondContact O-N 2.98Å; L471-T480 HydrophobicContact CD1-CG2 3.83Å; L471-Y502 HydrophobicContact CD1-CD2 4.37Å; L471-Y502 HydrophobicContact CD1-CG 4.19Å; L471-Y502 HydrophobicContact CD2-CD2 3.71Å; L471-Y502 HydrophobicContact CD2-CE2 3.98Å; L471-Y502 HydrophobicContact CD2-CG 4.35Å
472	A	83.4	Confident	83.6	Confident	13 Å²	13	48.5 Å²	48.5	11%	0.107	27%	0.266	C	S	.	.	H	α-helix	trans	-57.9	-40.5	176	0	0	0	0	0	112	E468 K469 K475 S476	E468-A472 PolarHBondContact O-N 3.39Å; K469-A472 PolarHBondContact O-N 3.28Å; A472-K475 PolarHBondContact O-N 3.4Å; A472-S476 PolarHBondContact O-N 3.3Å
473	K	82	Confident	85.3	Confident	119 Å²	119	49.1 Å²	49.1	52%	0.517	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-45.9	173.4	-178.4	53.5	175.2	147	0	111.9	K469 A470 L471 K475 S476 D477	K469-K473 PolarHBondContact O-N 2.76Å; K469-K473 VanDerWaalsContact O-N 3.12Å; A470-K473 PolarHBondContact O-N 3.44Å; L471-K473 VanDerWaalsContact C-N 3.27Å; L471-K473 PolarHBondContact O-N 3.04Å; K473-K475 VanDerWaalsContact C-N 3.28Å; K473-K475 PolarHBondContact O-N 3.24Å; K473-S476 WeakPolarHBondContact O-CB 3.14Å; K473-S476 PolarHBondContact O-N 3.5Å; K473-D477 WeakPolarHBondContact CD-OD2 3.46Å; K473-D477 WeakPolarHBondContact CE-OD2 3.25Å; K473-D477 VanDerWaalsContact NZ-CG 3.27Å; K473-D477 IonicContact NZ-OD1 2.81Å; K473-D477 PolarHBondContact NZ-OD1 2.78Å; K473-D477 IonicContact NZ-OD2 3.52Å; K473-D477 PolarHBondContact NZ-OD2 2.53Å; K473-D477 VanDerWaalsContact NZ-OD2 3.08Å; K473-D477 WeakPolarHBondContact O-CB 3.18Å; K473-D477 VanDerWaalsContact O-CG 3.3Å; K473-D477 PolarHBondContact O-N 3.4Å
474	A	87.3	Confident	86.5	Confident	6 Å²	6	40 Å²	40	5%	0.05	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-36.9	177.1	0	0	0	0	0	112.7	A470 L471 D477 K478 L479 T480 Q504	A470-A474 PolarHBondContact O-N 3.01Å; L471-A474 PolarHBondContact O-N 3.09Å; L471-A474 VanDerWaalsContact O-N 3.12Å; A474-D477 CarbonylContact O-C 3.44Å; A474-D477 PolarHBondContact O-N 2.67Å; A474-K478 PolarHBondContact O-N 2.91Å; A474-L479 HydrophobicContact CB-CB 4.34Å; A474-L479 WeakPolarHBondContact O-CB 3.34Å; A474-L479 PolarHBondContact O-N 3.22Å; A474-T480 HydrophobicContact CB-CG2 3.91Å; A474-Q504 HydrophobicContact CB-CG 4Å
475	K	87.5	Confident	87.2	Confident	9 Å²	9	40.7 Å²	40.7	4%	0.039	23%	0.232	C	C	.	.	H	α-helix	trans	-64.1	-48.6	172.9	-70.9	179.4	71.4	-142	0	111.7	T336 C450 D452 L471 A472 K473 D477 K478 T480 Y502	T336-K475 WeakPolarHBondContact CG2-O 3.47Å; C450-K475 PolarHBondContact O-NZ 2.98Å; D452-K475 WeakPolarHBondContact OD1-CB 3.44Å; D452-K475 VanDerWaalsContact OD1-CD 3.26Å; D452-K475 WeakPolarHBondContact OD1-CD 3.17Å; D452-K475 WeakPolarHBondContact OD1-CE 3.32Å; D452-K475 IonicContact OD1-NZ 3.19Å; D452-K475 PolarHBondContact OD1-NZ 2.89Å; D452-K475 IonicContact OD2-NZ 3.18Å; D452-K475 PolarHBondContact OD2-NZ 2.82Å; L471-K475 HydrophobicContact CD1-CG 4.36Å; L471-K475 HydrophobicContact CG-CD 4.46Å; L471-K475 HydrophobicContact CG-CG 4.49Å; L471-K475 WeakPolarHBondContact O-CG 3.42Å; L471-K475 PolarHBondContact O-N 2.98Å; A472-K475 PolarHBondContact O-N 3.4Å; K473-K475 VanDerWaalsContact C-N 3.28Å; K473-K475 PolarHBondContact O-N 3.24Å; K475-D477 PolarHBondContact O-N 3.24Å; K475-K478 WeakPolarHBondContact O-CA 3.49Å; K475-K478 PolarHBondContact O-N 3.15Å; K475-T480 HydrophobicContact CG-CG2 3.96Å; K475-T480 WeakPolarHBondContact CG-OG1 3.41Å; K475-Y502 HydrophobicContact CD-CD1 4.49Å; K475-Y502 HydrophobicContact CD-CE1 3.78Å; K475-Y502 HydrophobicContact CG-CE1 4.26Å
476	S	81.9	Confident	87.5	Confident	72 Å²	72	40.1 Å²	40.1	50%	0.503	22%	0.223	S	C	.	.	H	α-helix	trans	-58	-34.1	174.8	-178.9	0	0	0	0	112.3	A472 K473 K478	A472-S476 PolarHBondContact O-N 3.3Å; K473-S476 WeakPolarHBondContact O-CB 3.14Å; K473-S476 PolarHBondContact O-N 3.5Å; S476-K478 PolarHBondContact O-N 3.32Å
477	D	84.5	Confident	87.8	Confident	54 Å²	54	37.2 Å²	37.2	29%	0.289	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	5.8	177.6	-65.9	-20.6	0	0	0	113	K473 A474 K475 L479 K508	K473-D477 WeakPolarHBondContact CD-OD2 3.46Å; K473-D477 WeakPolarHBondContact CE-OD2 3.25Å; K473-D477 VanDerWaalsContact NZ-CG 3.27Å; K473-D477 IonicContact NZ-OD1 2.81Å; K473-D477 PolarHBondContact NZ-OD1 2.78Å; K473-D477 IonicContact NZ-OD2 3.52Å; K473-D477 PolarHBondContact NZ-OD2 2.53Å; K473-D477 VanDerWaalsContact NZ-OD2 3.08Å; K473-D477 WeakPolarHBondContact O-CB 3.18Å; K473-D477 VanDerWaalsContact O-CG 3.3Å; K473-D477 PolarHBondContact O-N 3.4Å; A474-D477 CarbonylContact O-C 3.44Å; A474-D477 PolarHBondContact O-N 2.67Å; K475-D477 PolarHBondContact O-N 3.24Å; D477-L479 VanDerWaalsContact C-N 3.26Å; D477-L479 HydrophobicContact CB-CD1 3.99Å; D477-L479 HydrophobicContact CB-CG 3.9Å; D477-L479 PolarHBondContact O-N 3.14Å; D477-K508 WeakPolarHBondContact O-CE 3.48Å
478	K	87.3	Confident	88	Confident	29 Å²	29	34 Å²	34	13%	0.126	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	36.1	179.5	-51.3	173.2	-176.8	167	0	112.5	T336 Y340 A474 K475 S476 K508 N554 E557	T336-K478 HydrophobicContact CG2-CG 4.31Å; Y340-K478 PolarHBondContact OH-NZ 3.36Å; A474-K478 PolarHBondContact O-N 2.91Å; K475-K478 WeakPolarHBondContact O-CA 3.49Å; K475-K478 PolarHBondContact O-N 3.15Å; S476-K478 PolarHBondContact O-N 3.32Å; K478-K508 HydrophobicContact CB-CD 4.46Å; K478-N554 HydrophobicContact CD-CB 4Å; K478-N554 WeakPolarHBondContact CD-OD1 3.49Å; K478-N554 PolarHBondContact NZ-OD1 2.97Å; K478-E557 IonicContact NZ-OE2 2.79Å
479	L	91.2	Very high	87.8	Confident	33 Å²	33	39.8 Å²	39.8	17%	0.173	21%	0.214	C	C	.	.			trans	-100.3	7.3	-178	-60	-179.5	0	0	0	113.6	A474 D477 F505 K508	A474-L479 HydrophobicContact CB-CB 4.34Å; A474-L479 WeakPolarHBondContact O-CB 3.34Å; A474-L479 PolarHBondContact O-N 3.22Å; D477-L479 VanDerWaalsContact C-N 3.26Å; D477-L479 HydrophobicContact CB-CD1 3.99Å; D477-L479 HydrophobicContact CB-CG 3.9Å; D477-L479 PolarHBondContact O-N 3.14Å; L479-F505 PolarHBondContact O-N 3.48Å; L479-K508 HydrophobicContact CD2-CG 3.84Å; L479-K508 VanDerWaalsContact CD2-N 3.32Å
480	T	92.3	Very high	87.7	Confident	6 Å²	6	39.4 Å²	39.4	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.3	-173.1	59.6	0	0	0	0	111.8	L471 A474 K475 C503 Q504 Q511	L471-T480 HydrophobicContact CD1-CG2 3.83Å; A474-T480 HydrophobicContact CB-CG2 3.91Å; K475-T480 HydrophobicContact CG-CG2 3.96Å; K475-T480 WeakPolarHBondContact CG-OG1 3.41Å; T480-C503 CarbonylContact C-O 3.43Å; T480-C503 VanDerWaalsContact CA-O 3.28Å; T480-C503 WeakPolarHBondContact CA-O 3.36Å; T480-Q504 HydrophobicContact CG2-CB 4.21Å; T480-Q504 HydrophobicContact CG2-CG 4.22Å; T480-Q511 PolarHBondContact O-NE2 3.03Å
481	V	92.6	Very high	87.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.1	162.5	177.9	0	0	0	0	108.6	Y502 C503 F505 Q511 Q515 F526	V481-Y502 VanDerWaalsContact O-CA 3.28Å; V481-Y502 WeakPolarHBondContact O-CA 3.44Å; V481-C503 PolarHBondContact N-O 2.97Å; V481-C503 PolarHBondContact O-N 3.42Å; V481-F505 HydrophobicContact CB-CE2 4.41Å; V481-F505 HydrophobicContact CG2-CE2 3.91Å; V481-Q511 HydrophobicContact CG2-CG 4.07Å; V481-Q515 HydrophobicContact CG2-CB 3.81Å; V481-Q515 HydrophobicContact CG2-CG 4.16Å; V481-F526 HydrophobicContact CB-CE2 4.33Å; V481-F526 HydrophobicContact CB-CZ 4.39Å; V481-F526 HydrophobicContact CG1-CD2 3.88Å; V481-F526 HydrophobicContact CG1-CE2 3.62Å; V481-F526 HydrophobicContact CG1-CZ 4.16Å; V481-F526 HydrophobicContact CG2-CE2 4.46Å; V481-F526 HydrophobicContact CG2-CZ 4.25Å
482	S	92.8	Very high	86.9	Confident	4 Å²	4	46 Å²	46	3%	0.028	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	126.1	175.9	-58.2	0	0	0	0	111.2	E134 Y502	E134-S482 WeakPolarHBondContact OE2-CB 3.4Å; E134-S482 PolarHBondContact OE2-OG 3.48Å; S482-Y502 WeakPolarHBondContact OG-CE1 3.32Å
483	V	94.1	Very high	86.2	Confident	22 Å²	22	48.5 Å²	48.5	13%	0.133	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-44.3	-175	178.9	0	0	0	0	112.1	S501 F526 P532	V483-S501 PolarHBondContact N-O 3.08Å; V483-F526 HydrophobicContact CG1-CB 4.18Å; V483-F526 WeakPolarHBondContact CG1-O 3.42Å; V483-F526 HydrophobicContact CG2-CB 3.77Å; V483-F526 HydrophobicContact CG2-CG 4.48Å; V483-P532 HydrophobicContact CG1-CB 4.43Å; V483-P532 HydrophobicContact CG2-CB 4.31Å
484	G	92.9	Very high	85.8	Confident	4 Å²	4	44.8 Å²	44.8	4%	0.041	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159	-175.1	175.6	0	0	0	0	0	114	R500 S501	G484-R500 WeakPolarHBondContact O-CA 3.39Å; G484-R500 WeakPolarHBondContact O-CG 3.45Å; G484-S501 PolarHBondContact O-N 2.75Å; G484-S501 PolarHBondContact O-OG 3.31Å
485	E	91.3	Very high	85.4	Confident	31 Å²	31	45.4 Å²	45.4	15%	0.145	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	149.7	-179.8	-72.4	-177.3	-156.6	0	0	112.9	F355 L363 K441 K499 R500 A529	F355-E485 HydrophobicContact CE2-CG 3.92Å; L363-E485 HydrophobicContact CD1-CB 4.14Å; L363-E485 HydrophobicContact CD1-CG 4.26Å; K441-E485 HydrophobicContact CD-CG 4.46Å; K441-E485 WeakPolarHBondContact CD-OE1 3.05Å; K441-E485 WeakPolarHBondContact CD-OE2 3.17Å; K441-E485 IonicContact NZ-OE1 2.84Å; K441-E485 PolarHBondContact NZ-OE1 2.87Å; K441-E485 IonicContact NZ-OE2 2.65Å; K441-E485 PolarHBondContact NZ-OE2 3.02Å; E485-K499 CarbonylContact C-O 3.59Å; E485-K499 VanDerWaalsContact CA-O 3.31Å; E485-K499 WeakPolarHBondContact CA-O 3.15Å; E485-R500 HydrophobicContact CG-CB 3.78Å; E485-R500 HydrophobicContact CG-CG 3.82Å; E485-R500 IonicContact OE1-CZ 2.87Å; E485-R500 IonicContact OE1-NE 3.72Å; E485-R500 PolarHBondContact OE1-NE 3.36Å; E485-R500 IonicContact OE1-NH2 3.39Å; E485-R500 PolarHBondContact OE1-NH2 3.05Å; E485-A529 WeakPolarHBondContact O-CB 2.89Å
486	F	90.1	Very high	84.9	Confident	36 Å²	36	47.3 Å²	47.3	16%	0.158	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	156.1	173.8	67.1	-81.1	0	0	0	111.7	F438 S488 K498 K499 A529 K530	F438-F486 AromaticContact CD1-CE1 3.86Å; F438-F486 HydrophobicContact CD1-CE1 3.86Å; F438-F486 HydrophobicContact CD1-CZ 4.13Å; F438-F486 AromaticContact CE1-CE1 3.86Å; F438-F486 HydrophobicContact CE1-CE1 3.86Å; F438-F486 HydrophobicContact CE1-CZ 4.13Å; F486-S488 PolarHBondContact O-N 3.19Å; F486-K498 WeakPolarHBondContact O-CA 3.44Å; F486-K499 HydrophobicContact CD1-CB 4.38Å; F486-K499 HydrophobicContact CE1-CB 3.8Å; F486-K499 HydrophobicContact CE2-CB 4.32Å; F486-K499 HydrophobicContact CZ-CB 3.77Å; F486-K499 HydrophobicContact CZ-CD 4.21Å; F486-K499 PolarHBondContact N-O 3.27Å; F486-K499 PolarHBondContact O-N 3.27Å; F486-A529 HydrophobicContact CB-CB 4.26Å; F486-A529 HydrophobicContact CD1-CB 3.99Å; F486-A529 WeakPolarHBondContact CD1-O 3.48Å; F486-A529 WeakPolarHBondContact CE1-O 3.36Å; F486-K530 HydrophobicContact CD1-CB 4.35Å; F486-K530 HydrophobicContact CD2-CB 4.26Å; F486-K530 HydrophobicContact CD2-CD 4.48Å; F486-K530 HydrophobicContact CD2-CG 4.1Å; F486-K530 HydrophobicContact CE2-CG 4.11Å; F486-K530 HydrophobicContact CG-CB 4.14Å; F486-K530 HydrophobicContact CG-CG 4.48Å
487	C	87.6	Confident	84.9	Confident	30 Å²	30	46.6 Å²	46.6	20%	0.203	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	112.8	172.7	-166.1	0	0	0	0	111	K489 C495	C487-K489 PolarHBondContact SG-O 3.17Å; C487-C495 WeakPolarHBondContact CA-SG 3.42Å; C487-C495 HydrophobicContact CB-CB 3.91Å; C487-C495 WeakPolarHBondContact CB-SG 3.48Å; C487-C495 WeakPolarHBondContact SG-CA 3.49Å; C487-C495 WeakPolarHBondContact SG-CB 3.3Å; C487-C495 CovalentContact SG-SG 2.03Å; C487-C495 PolarHBondContact SG-SG 3.32Å
488	S	87.2	Confident	85	Confident	43 Å²	43	46 Å²	46	30%	0.301	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-26.4	-179.9	68.4	0	0	0	0	113.3	F486 E497	F486-S488 PolarHBondContact O-N 3.19Å; S488-E497 PolarHBondContact N-O 2.84Å; S488-E497 WeakPolarHBondContact OG-CG 3.34Å; S488-E497 PolarHBondContact OG-O 3.44Å; S488-E497 PolarHBondContact OG-OE1 3.08Å; S488-E497 VanDerWaalsContact OG-OE1 3.13Å
489	K	83.8	Confident	85.1	Confident	127 Å²	127	47.7 Å²	47.7	55%	0.552	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	117	173.7	-169.3	178.7	-179	-178.6	0	109.7	C487 L496 E497	C487-K489 PolarHBondContact SG-O 3.17Å; K489-L496 HydrophobicContact CB-CB 4.48Å; K489-L496 HydrophobicContact CD-CB 4.5Å; K489-L496 HydrophobicContact CG-CB 4.37Å; K489-L496 PolarHBondContact O-N 3.43Å; K489-E497 HydrophobicContact CB-CB 3.78Å; K489-E497 PolarHBondContact N-O 3.08Å; K489-E497 PolarHBondContact O-N 3.03Å
490	K	78.8	Confident	85.2	Confident	129 Å²	129	46.1 Å²	46.1	56%	0.561	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.5	-175.2	-171.2	164.6	-175.2	167.8	0	110.4
491	V	77.5	Confident	85.3	Confident	65 Å²	65	45.8 Å²	45.8	39%	0.394	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	161.5	159.8	-66.1	0	0	0	0	108	G493 V494 L496	V491-G493 PolarHBondContact O-N 3.16Å; V491-V494 HydrophobicContact CG2-CB 3.86Å; V491-V494 PolarHBondContact N-O 3.08Å; V491-V494 PolarHBondContact O-N 3.41Å; V491-V494 VanDerWaalsContact O-O 3.05Å; V491-L496 HydrophobicContact CG1-CD1 3.58Å; V491-L496 HydrophobicContact CG1-CG 4.25Å; V491-L496 HydrophobicContact CG2-CD1 4.28Å; V491-L496 HydrophobicContact CG2-CD2 4.05Å; V491-L496 HydrophobicContact CG2-CG 4.12Å
492	P	78.3	Confident	85.5	Confident	135 Å²	135	45.8 Å²	45.8	88%	0.877	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	115.9	-176.1	-29.2	36.6	0	0	0	112.2	V494	P492-V494 VanDerWaalsContact C-N 3.33Å; P492-V494 PolarHBondContact O-N 3.38Å
493	G	70.2	Confident	85.7	Confident	64 Å²	64	45.6 Å²	45.6	66%	0.66	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-15.2	-178.6	0	0	0	0	0	117	V491	V491-G493 PolarHBondContact O-N 3.16Å
494	V	72.7	Confident	85.8	Confident	41 Å²	41	46.6 Å²	46.6	25%	0.248	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.4	-169.4	-179.4	0	0	0	0	112.4	S287 V491 P492 L496	S287-V494 VanDerWaalsContact CB-CG1 3.4Å; V491-V494 HydrophobicContact CG2-CB 3.86Å; V491-V494 PolarHBondContact N-O 3.08Å; V491-V494 PolarHBondContact O-N 3.41Å; V491-V494 VanDerWaalsContact O-O 3.05Å; P492-V494 VanDerWaalsContact C-N 3.33Å; P492-V494 PolarHBondContact O-N 3.38Å; V494-L496 HydrophobicContact CG1-CD2 4.29Å
495	C	79.5	Confident	85.9	Confident	19 Å²	19	46.4 Å²	46.4	13%	0.128	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	125.6	172.6	-169.4	0	0	0	0	111.6	S287 L290 C487	S287-C495 WeakPolarHBondContact CB-O 3.28Å; L290-C495 HydrophobicContact CD1-CB 4.49Å; L290-C495 WeakPolarHBondContact CD1-O 3.39Å; C487-C495 WeakPolarHBondContact CA-SG 3.42Å; C487-C495 HydrophobicContact CB-CB 3.91Å; C487-C495 WeakPolarHBondContact CB-SG 3.48Å; C487-C495 WeakPolarHBondContact SG-CA 3.49Å; C487-C495 WeakPolarHBondContact SG-CB 3.3Å; C487-C495 CovalentContact SG-SG 2.03Å; C487-C495 PolarHBondContact SG-SG 3.32Å
496	L	76.7	Confident	85.8	Confident	50 Å²	50	51.4 Å²	51.4	26%	0.262	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-29.9	179	-58.6	-175.5	0	0	0	113.1	K489 V491 V494	K489-L496 HydrophobicContact CB-CB 4.48Å; K489-L496 HydrophobicContact CD-CB 4.5Å; K489-L496 HydrophobicContact CG-CB 4.37Å; K489-L496 PolarHBondContact O-N 3.43Å; V491-L496 HydrophobicContact CG1-CD1 3.58Å; V491-L496 HydrophobicContact CG1-CG 4.25Å; V491-L496 HydrophobicContact CG2-CD1 4.28Å; V491-L496 HydrophobicContact CG2-CD2 4.05Å; V491-L496 HydrophobicContact CG2-CG 4.12Å; V494-L496 HydrophobicContact CG1-CD2 4.29Å
497	E	81.4	Confident	85.8	Confident	57 Å²	57	51.6 Å²	51.6	27%	0.266	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	119.4	179.4	-173.5	179.9	102.6	0	0	110.4	S488 K489	S488-E497 PolarHBondContact N-O 2.84Å; S488-E497 WeakPolarHBondContact OG-CG 3.34Å; S488-E497 PolarHBondContact OG-O 3.44Å; S488-E497 PolarHBondContact OG-OE1 3.08Å; S488-E497 VanDerWaalsContact OG-OE1 3.13Å; K489-E497 HydrophobicContact CB-CB 3.78Å; K489-E497 PolarHBondContact N-O 3.08Å; K489-E497 PolarHBondContact O-N 3.03Å
498	K	86.1	Confident	85.8	Confident	40 Å²	40	51.2 Å²	51.2	17%	0.174	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	142.4	172.7	-70.9	-173.6	176	-175.9	0	110	L290 K441 F486	L290-K498 HydrophobicContact CD1-CD 4.45Å; L290-K498 HydrophobicContact CD1-CG 4.34Å; K441-K498 HydrophobicContact CB-CB 4.26Å; K441-K498 PolarHBondContact N-O 3.14Å; F486-K498 WeakPolarHBondContact O-CA 3.44Å
499	K	90.5	Very high	85.9	Confident	65 Å²	65	49.7 Å²	49.7	28%	0.283	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.5	167.3	-76.3	-177.2	-178	-177.4	0	109.5	C439 K440 E485 F486	C439-K499 VanDerWaalsContact O-CA 3.27Å; C439-K499 WeakPolarHBondContact O-CA 3.22Å; K440-K499 HydrophobicContact CG-CG 4.18Å; E485-K499 CarbonylContact C-O 3.59Å; E485-K499 VanDerWaalsContact CA-O 3.31Å; E485-K499 WeakPolarHBondContact CA-O 3.15Å; F486-K499 HydrophobicContact CD1-CB 4.38Å; F486-K499 HydrophobicContact CE1-CB 3.8Å; F486-K499 HydrophobicContact CE2-CB 4.32Å; F486-K499 HydrophobicContact CZ-CB 3.77Å; F486-K499 HydrophobicContact CZ-CD 4.21Å; F486-K499 PolarHBondContact N-O 3.27Å; F486-K499 PolarHBondContact O-N 3.27Å
500	R	92.2	Very high	86.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.5	167.2	-169.9	-179.2	-79.9	-173.3	3.7	109.3	D136 F355 F438 C439 G484 E485 Y502	D136-R500 VanDerWaalsContact CG-NH1 3.33Å; D136-R500 VanDerWaalsContact CG-NH2 3.27Å; D136-R500 IonicContact OD1-CZ 2.95Å; D136-R500 IonicContact OD1-NH1 2.63Å; D136-R500 PolarHBondContact OD1-NH1 2.88Å; D136-R500 IonicContact OD1-NH2 2.71Å; D136-R500 PolarHBondContact OD1-NH2 3.36Å; D136-R500 IonicContact OD2-CZ 2.65Å; D136-R500 IonicContact OD2-NH1 2.69Å; D136-R500 PolarHBondContact OD2-NH1 3.38Å; D136-R500 VanDerWaalsContact OD2-NH1 3.16Å; D136-R500 IonicContact OD2-NH2 3.08Å; D136-R500 PolarHBondContact OD2-NH2 2.75Å; D136-R500 VanDerWaalsContact OD2-NH2 3.14Å; F355-R500 HydrophobicContact CZ-CG 4.37Å; F438-R500 VanDerWaalsContact CA-O 3.28Å; F438-R500 WeakPolarHBondContact CA-O 3.32Å; C439-R500 PolarHBondContact N-O 3.46Å; C439-R500 PolarHBondContact O-N 2.82Å; G484-R500 WeakPolarHBondContact O-CA 3.39Å; G484-R500 WeakPolarHBondContact O-CG 3.45Å; E485-R500 HydrophobicContact CG-CB 3.78Å; E485-R500 HydrophobicContact CG-CG 3.82Å; E485-R500 IonicContact OE1-CZ 2.87Å; E485-R500 IonicContact OE1-NE 3.72Å; E485-R500 PolarHBondContact OE1-NE 3.36Å; E485-R500 IonicContact OE1-NH2 3.39Å; E485-R500 PolarHBondContact OE1-NH2 3.05Å; R500-Y502 HydrophobicContact CB-CE2 3.96Å; R500-Y502 VanDerWaalsContact CD-CZ 3.42Å; R500-Y502 WeakPolarHBondContact CD-OH 3.26Å; R500-Y502 HydrophobicContact CG-CD2 4.5Å; R500-Y502 HydrophobicContact CG-CE2 3.7Å
501	S	95.5	Very high	87	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	153.8	177.7	61.8	0	0	0	0	112.9	K437 F438 V483 G484 A529	K437-S501 CarbonylContact O-C 3.58Å; K437-S501 VanDerWaalsContact O-CA 3.31Å; K437-S501 WeakPolarHBondContact O-CA 3.29Å; F438-S501 VanDerWaalsContact CE1-CB 3.42Å; V483-S501 PolarHBondContact N-O 3.08Å; G484-S501 PolarHBondContact O-N 2.75Å; G484-S501 PolarHBondContact O-OG 3.31Å; S501-A529 WeakPolarHBondContact CB-O 3.48Å; S501-A529 WeakPolarHBondContact OG-CA 3.24Å; S501-A529 PolarHBondContact OG-O 3.41Å
502	Y	95.9	Very high	87.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	150.7	-174.1	-60.8	-99	0	0	0	110.1	A436 K437 C439 L471 K475 V481 S482 R500	A436-Y502 WeakPolarHBondContact CA-O 3.4Å; K437-Y502 PolarHBondContact N-O 3.11Å; K437-Y502 PolarHBondContact O-N 3.46Å; C439-Y502 WeakPolarHBondContact SG-CE2 3.38Å; L471-Y502 HydrophobicContact CD1-CD2 4.37Å; L471-Y502 HydrophobicContact CD1-CG 4.19Å; L471-Y502 HydrophobicContact CD2-CD2 3.71Å; L471-Y502 HydrophobicContact CD2-CE2 3.98Å; L471-Y502 HydrophobicContact CD2-CG 4.35Å; K475-Y502 HydrophobicContact CD-CD1 4.49Å; K475-Y502 HydrophobicContact CD-CE1 3.78Å; K475-Y502 HydrophobicContact CG-CE1 4.26Å; V481-Y502 VanDerWaalsContact O-CA 3.28Å; V481-Y502 WeakPolarHBondContact O-CA 3.44Å; S482-Y502 WeakPolarHBondContact OG-CE1 3.32Å; R500-Y502 HydrophobicContact CB-CE2 3.96Å; R500-Y502 VanDerWaalsContact CD-CZ 3.42Å; R500-Y502 WeakPolarHBondContact CD-OH 3.26Å; R500-Y502 HydrophobicContact CG-CD2 4.5Å; R500-Y502 HydrophobicContact CG-CE2 3.7Å
503	C	97.7	Very high	88.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	115.9	157.3	-67.3	0	0	0	0	108.7	T480 V481 F505 F526 C534	T480-C503 CarbonylContact C-O 3.43Å; T480-C503 VanDerWaalsContact CA-O 3.28Å; T480-C503 WeakPolarHBondContact CA-O 3.36Å; V481-C503 PolarHBondContact N-O 2.97Å; V481-C503 PolarHBondContact O-N 3.42Å; C503-F505 HydrophobicContact CB-CE2 3.82Å; C503-F505 HydrophobicContact CB-CZ 3.68Å; C503-F505 WeakPolarHBondContact O-CE2 3.22Å; C503-F526 HydrophobicContact CB-CD1 4.29Å; C503-C534 WeakPolarHBondContact CA-SG 3.34Å; C503-C534 HydrophobicContact CB-CB 3.69Å; C503-C534 WeakPolarHBondContact CB-SG 3.44Å; C503-C534 WeakPolarHBondContact SG-CA 3.32Å; C503-C534 WeakPolarHBondContact SG-CB 3.36Å; C503-C534 CovalentContact SG-SG 2.04Å; C503-C534 PolarHBondContact SG-SG 2.97Å
504	Q	96.3	Very high	89.7	Confident	42 Å²	42	25.6 Å²	25.6	20%	0.196	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.5	174.5	-177.7	-174.2	-39.9	0	0	109.7	G434 Q435 K437 A474 T480	G434-Q504 CarbonylContact C-O 3.47Å; G434-Q504 WeakPolarHBondContact CA-O 3.46Å; Q435-Q504 PolarHBondContact N-O 3.24Å; Q435-Q504 PolarHBondContact O-N 3.3Å; K437-Q504 HydrophobicContact CG-CB 3.82Å; A474-Q504 HydrophobicContact CB-CG 4Å; T480-Q504 HydrophobicContact CG2-CB 4.21Å; T480-Q504 HydrophobicContact CG2-CG 4.22Å
505	F	95	Very high	90.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.128	C	C	.	.			trans	-118.9	161.6	-180	-57.5	-77.8	0	0	0	111.5	F432 L479 V481 C503 S507 A510 Q511 Q514 F526	F432-F505 WeakPolarHBondContact O-CD1 3.25Å; F432-F505 WeakPolarHBondContact O-CE1 3.38Å; L479-F505 PolarHBondContact O-N 3.48Å; V481-F505 HydrophobicContact CB-CE2 4.41Å; V481-F505 HydrophobicContact CG2-CE2 3.91Å; C503-F505 HydrophobicContact CB-CE2 3.82Å; C503-F505 HydrophobicContact CB-CZ 3.68Å; C503-F505 WeakPolarHBondContact O-CE2 3.22Å; F505-S507 VanDerWaalsContact C-N 3.33Å; F505-A510 HydrophobicContact CB-CB 3.85Å; F505-A510 HydrophobicContact CD1-CB 4.46Å; F505-A510 HydrophobicContact CG-CB 4.36Å; F505-Q511 HydrophobicContact CB-CB 4.45Å; F505-Q511 HydrophobicContact CD2-CB 3.95Å; F505-Q511 HydrophobicContact CD2-CG 4.14Å; F505-Q514 HydrophobicContact CD1-CG 4.02Å; F505-Q514 HydrophobicContact CE1-CB 3.92Å; F505-Q514 HydrophobicContact CE1-CG 3.43Å; F505-Q514 VanDerWaalsContact CE1-CG 3.43Å; F505-Q514 HydrophobicContact CE2-CB 4.02Å; F505-Q514 HydrophobicContact CE2-CG 4.42Å; F505-Q514 HydrophobicContact CZ-CB 3.57Å; F505-Q514 HydrophobicContact CZ-CG 3.66Å; F505-F526 HydrophobicContact CZ-CE1 4.05Å
506	D	89.7	Confident	91.2	Very high	137 Å²	137	26.2 Å²	26.2	73%	0.733	13%	0.132	S	C	*	.	S	Bend	trans	-81.8	-11.8	-176.6	-65.9	-23.3	0	0	0	113.4
507	S	88.7	Confident	92.1	Very high	39 Å²	39	23.9 Å²	23.9	27%	0.273	12%	0.119	S	C	.	.	S	Bend	trans	-151.4	158.2	177.4	69.3	0	0	0	0	112.6	F505 L509 A510 Q511	F505-S507 VanDerWaalsContact C-N 3.33Å; S507-L509 VanDerWaalsContact C-N 3.25Å; S507-L509 PolarHBondContact O-N 3.06Å; S507-A510 WeakPolarHBondContact O-CB 3.34Å; S507-A510 PolarHBondContact O-N 3.09Å; S507-A510 WeakPolarHBondContact OG-CB 3.48Å; S507-A510 PolarHBondContact OG-N 2.93Å; S507-A510 VanDerWaalsContact OG-N 3.08Å; S507-Q511 PolarHBondContact O-N 2.88Å
508	K	88.1	Confident	92.8	Very high	22 Å²	22	21.1 Å²	21.1	10%	0.096	11%	0.107	C	C	.	.	H	α-helix	trans	-61.7	-35.4	172.5	-67.2	-171.7	-173.5	163.6	0	111.9	D477 K478 L479 A510 Q511 I512 N554 F555 D558	D477-K508 WeakPolarHBondContact O-CE 3.48Å; K478-K508 HydrophobicContact CB-CD 4.46Å; L479-K508 HydrophobicContact CD2-CG 3.84Å; L479-K508 VanDerWaalsContact CD2-N 3.32Å; K508-A510 PolarHBondContact O-N 3.32Å; K508-Q511 WeakPolarHBondContact O-CB 3.31Å; K508-Q511 PolarHBondContact O-N 2.96Å; K508-I512 WeakPolarHBondContact O-CB 3.49Å; K508-I512 WeakPolarHBondContact O-CD1 3.35Å; K508-I512 WeakPolarHBondContact O-CG1 3.4Å; K508-I512 PolarHBondContact O-N 3.33Å; K508-N554 WeakPolarHBondContact CD-O 2.83Å; K508-N554 PolarHBondContact NZ-O 3.41Å; K508-N554 VanDerWaalsContact NZ-O 3.11Å; K508-F555 HydrophobicContact CB-CD2 4.41Å; K508-D558 WeakPolarHBondContact CD-OD2 3.44Å; K508-D558 WeakPolarHBondContact CE-OD2 3.5Å; K508-D558 IonicContact NZ-OD1 2.71Å; K508-D558 PolarHBondContact NZ-OD1 2.63Å; K508-D558 IonicContact NZ-OD2 3.16Å; K508-D558 PolarHBondContact NZ-OD2 2.78Å
509	L	88.7	Confident	93.1	Very high	11 Å²	11	22.1 Å²	22.1	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-45.1	175.5	-65.1	172.2	0	0	0	111.2	A412 A413 S507 Q511 I512 V513 F552 F555	A412-L509 HydrophobicContact CB-CD1 3.79Å; A413-L509 HydrophobicContact CB-CB 4.48Å; A413-L509 HydrophobicContact CB-CD2 4.15Å; S507-L509 VanDerWaalsContact C-N 3.25Å; S507-L509 PolarHBondContact O-N 3.06Å; L509-Q511 PolarHBondContact O-N 3.39Å; L509-I512 PolarHBondContact O-N 3.32Å; L509-V513 VanDerWaalsContact O-CG2 3.27Å; L509-V513 WeakPolarHBondContact O-CG2 3.33Å; L509-V513 PolarHBondContact O-N 2.88Å; L509-F552 HydrophobicContact CD2-CD1 3.82Å; L509-F552 HydrophobicContact CD2-CE1 3.87Å; L509-F555 HydrophobicContact CD1-CD2 4.39Å; L509-F555 HydrophobicContact CD1-CE1 4.38Å; L509-F555 HydrophobicContact CD1-CE2 3.88Å; L509-F555 HydrophobicContact CD1-CZ 3.87Å; L509-F555 HydrophobicContact CD2-CB 4.23Å; L509-F555 HydrophobicContact CD2-CD1 3.71Å; L509-F555 HydrophobicContact CD2-CD2 3.88Å; L509-F555 HydrophobicContact CD2-CE1 3.97Å; L509-F555 HydrophobicContact CD2-CE2 4.13Å; L509-F555 HydrophobicContact CD2-CG 3.65Å; L509-F555 HydrophobicContact CD2-CZ 4.17Å; L509-F555 HydrophobicContact CG-CD1 4.45Å; L509-F555 HydrophobicContact CG-CD2 3.81Å; L509-F555 HydrophobicContact CG-CE1 4.45Å; L509-F555 HydrophobicContact CG-CE2 3.81Å; L509-F555 HydrophobicContact CG-CG 4.13Å; L509-F555 HydrophobicContact CG-CZ 4.14Å
510	A	92.2	Very high	93.1	Very high	4 Å²	4	21.1 Å²	21.1	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-46.3	174.6	0	0	0	0	0	111.3	F432 F505 S507 K508 Q514	F432-A510 HydrophobicContact CB-CB 3.82Å; F432-A510 HydrophobicContact CD1-CB 3.44Å; F432-A510 VanDerWaalsContact CD1-CB 3.44Å; F432-A510 HydrophobicContact CE1-CB 4.24Å; F432-A510 HydrophobicContact CG-CB 3.92Å; F505-A510 HydrophobicContact CB-CB 3.85Å; F505-A510 HydrophobicContact CD1-CB 4.46Å; F505-A510 HydrophobicContact CG-CB 4.36Å; S507-A510 WeakPolarHBondContact O-CB 3.34Å; S507-A510 PolarHBondContact O-N 3.09Å; S507-A510 WeakPolarHBondContact OG-CB 3.48Å; S507-A510 PolarHBondContact OG-N 2.93Å; S507-A510 VanDerWaalsContact OG-N 3.08Å; K508-A510 PolarHBondContact O-N 3.32Å; A510-Q514 WeakPolarHBondContact O-CB 3.45Å; A510-Q514 WeakPolarHBondContact O-CG 3.49Å; A510-Q514 PolarHBondContact O-N 3.1Å
511	Q	93.9	Very high	93.3	Very high	10 Å²	10	23.9 Å²	23.9	5%	0.047	14%	0.135	C	C	.	.	H	α-helix	trans	-58.6	-48.6	176.8	-171.8	-77.3	-15.5	0	0	111.7	T480 V481 F505 S507 K508 L509 Q514 Q515	T480-Q511 PolarHBondContact O-NE2 3.03Å; V481-Q511 HydrophobicContact CG2-CG 4.07Å; F505-Q511 HydrophobicContact CB-CB 4.45Å; F505-Q511 HydrophobicContact CD2-CB 3.95Å; F505-Q511 HydrophobicContact CD2-CG 4.14Å; S507-Q511 PolarHBondContact O-N 2.88Å; K508-Q511 WeakPolarHBondContact O-CB 3.31Å; K508-Q511 PolarHBondContact O-N 2.96Å; L509-Q511 PolarHBondContact O-N 3.39Å; Q511-Q514 PolarHBondContact O-N 3.3Å; Q511-Q515 WeakPolarHBondContact O-CB 3.5Å; Q511-Q515 PolarHBondContact O-N 2.97Å
512	I	91.4	Very high	93.4	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-61.6	-50.8	-178.4	-72.8	159.6	0	0	0	110.3	K508 L509 Q514 Q515 Q516 L550 F552 F555	K508-I512 WeakPolarHBondContact O-CB 3.49Å; K508-I512 WeakPolarHBondContact O-CD1 3.35Å; K508-I512 WeakPolarHBondContact O-CG1 3.4Å; K508-I512 PolarHBondContact O-N 3.33Å; L509-I512 PolarHBondContact O-N 3.32Å; I512-Q514 VanDerWaalsContact C-N 3.3Å; I512-Q514 PolarHBondContact O-N 3.1Å; I512-Q515 PolarHBondContact O-N 2.92Å; I512-Q516 WeakPolarHBondContact O-CB 3.39Å; I512-Q516 PolarHBondContact O-N 3.43Å; I512-L550 HydrophobicContact CG2-CB 4.31Å; I512-F552 HydrophobicContact CD1-CD1 4.03Å; I512-F552 HydrophobicContact CG2-CD1 3.91Å; I512-F552 HydrophobicContact CG2-CE1 3.85Å; I512-F555 HydrophobicContact CD1-CB 4Å
513	V	94.7	Very high	93.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-65.1	-37.1	-179.2	179.6	0	0	0	0	110.8	A413 F432 L509 G517 R518 I537 L542 I545 F547 L550	A413-V513 HydrophobicContact CB-CG2 4.2Å; F432-V513 HydrophobicContact CD2-CB 4.16Å; F432-V513 HydrophobicContact CD2-CG1 3.98Å; F432-V513 HydrophobicContact CE2-CB 4.03Å; F432-V513 HydrophobicContact CE2-CG1 3.85Å; F432-V513 HydrophobicContact CE2-CG2 4.1Å; F432-V513 HydrophobicContact CZ-CG2 4.38Å; L509-V513 VanDerWaalsContact O-CG2 3.27Å; L509-V513 WeakPolarHBondContact O-CG2 3.33Å; L509-V513 PolarHBondContact O-N 2.88Å; V513-G517 CarbonylContact O-C 3.5Å; V513-G517 WeakPolarHBondContact O-CA 3.44Å; V513-G517 PolarHBondContact O-N 3.06Å; V513-R518 PolarHBondContact O-N 2.99Å; V513-I537 HydrophobicContact CG1-CD1 3.66Å; V513-L542 HydrophobicContact CG1-CD1 4.2Å; V513-I545 HydrophobicContact CG1-CD1 3.96Å; V513-F547 HydrophobicContact CG1-CZ 4.43Å; V513-F547 HydrophobicContact CG2-CE1 3.95Å; V513-F547 HydrophobicContact CG2-CZ 4.46Å; V513-L550 HydrophobicContact CG2-CD1 4.02Å
514	Q	96	Very high	93.2	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-69	-45.2	177.4	-73.8	-82.8	29.3	0	0	112.4	F432 F505 A510 Q511 I512 R518 N519 F526 R535 I537	F432-Q514 HydrophobicContact CB-CG 4Å; F432-Q514 PolarHBondContact O-NE2 2.88Å; F505-Q514 HydrophobicContact CD1-CG 4.02Å; F505-Q514 HydrophobicContact CE1-CB 3.92Å; F505-Q514 HydrophobicContact CE1-CG 3.43Å; F505-Q514 VanDerWaalsContact CE1-CG 3.43Å; F505-Q514 HydrophobicContact CE2-CB 4.02Å; F505-Q514 HydrophobicContact CE2-CG 4.42Å; F505-Q514 HydrophobicContact CZ-CB 3.57Å; F505-Q514 HydrophobicContact CZ-CG 3.66Å; A510-Q514 WeakPolarHBondContact O-CB 3.45Å; A510-Q514 WeakPolarHBondContact O-CG 3.49Å; A510-Q514 PolarHBondContact O-N 3.1Å; Q511-Q514 PolarHBondContact O-N 3.3Å; I512-Q514 VanDerWaalsContact C-N 3.3Å; I512-Q514 PolarHBondContact O-N 3.1Å; Q514-R518 WeakPolarHBondContact O-CB 3.45Å; Q514-R518 PolarHBondContact O-N 2.9Å; Q514-N519 PolarHBondContact O-N 3.48Å; Q514-N519 VanDerWaalsContact O-N 3.07Å; Q514-F526 HydrophobicContact CB-CE1 4.31Å; Q514-F526 HydrophobicContact CB-CZ 4.18Å; Q514-F526 WeakPolarHBondContact O-CZ 3.23Å; Q514-R535 PolarHBondContact NE2-O 3.01Å; Q514-I537 HydrophobicContact CG-CD1 4.25Å
515	Q	92.7	Very high	93.1	Very high	30 Å²	30	39.4 Å²	39.4	14%	0.14	21%	0.208	C	C	.	.	I	π-helix	trans	-73.4	-53.3	-178.8	-171.7	174.5	38.8	0	0	111.7	E134 Y366 V481 Q511 I512 N519 G520	E134-Q515 PolarHBondContact OE1-NE2 3.18Å; Y366-Q515 PolarHBondContact OH-NE2 3.42Å; V481-Q515 HydrophobicContact CG2-CB 3.81Å; V481-Q515 HydrophobicContact CG2-CG 4.16Å; Q511-Q515 WeakPolarHBondContact O-CB 3.5Å; Q511-Q515 PolarHBondContact O-N 2.97Å; I512-Q515 PolarHBondContact O-N 2.92Å; Q515-N519 VanDerWaalsContact O-CB 3.3Å; Q515-N519 WeakPolarHBondContact O-CB 3.28Å; Q515-G520 PolarHBondContact O-N 3.17Å
516	Q	92.3	Very high	93.1	Very high	43 Å²	43	39.7 Å²	39.7	20%	0.201	21%	0.209	C	C	.	.	I	π-helix	trans	-86.4	-39.4	-172.1	-59.7	-178.3	38.6	0	0	111.7	I512 G520 Q521 L550 D551	I512-Q516 WeakPolarHBondContact O-CB 3.39Å; I512-Q516 PolarHBondContact O-N 3.43Å; Q516-G520 CarbonylContact O-C 3.55Å; Q516-G520 WeakPolarHBondContact O-CA 3.45Å; Q516-G520 PolarHBondContact O-N 3.14Å; Q516-Q521 PolarHBondContact O-N 3.31Å; Q516-L550 HydrophobicContact CB-CD2 3.61Å; Q516-D551 PolarHBondContact NE2-O 3.13Å
517	G	94.6	Very high	93.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	I	π-helix	trans	-76.7	-68.8	178	0	0	0	0	0	112.4	V513 Q521 L522	V513-G517 CarbonylContact O-C 3.5Å; V513-G517 WeakPolarHBondContact O-CA 3.44Å; V513-G517 PolarHBondContact O-N 3.06Å; G517-Q521 WeakPolarHBondContact O-CB 3.49Å; G517-Q521 PolarHBondContact O-N 3.12Å; G517-Q521 VanDerWaalsContact O-N 3.09Å; G517-L522 PolarHBondContact O-N 3.04Å
518	R	95.6	Very high	93.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.198	C	C	.	.	I	π-helix	trans	-63.9	-50.4	-175.9	172.5	-170.8	175	-88.3	5.5	112.2	V513 Q514 L522 R523 I524 S525 F526 D533 I537	V513-R518 PolarHBondContact O-N 2.99Å; Q514-R518 WeakPolarHBondContact O-CB 3.45Å; Q514-R518 PolarHBondContact O-N 2.9Å; R518-L522 CarbonylContact O-C 3.54Å; R518-L522 WeakPolarHBondContact O-CB 3.35Å; R518-R523 PolarHBondContact O-N 3.47Å; R518-I524 HydrophobicContact CG-CB 3.67Å; R518-I524 HydrophobicContact CG-CD1 4.3Å; R518-I524 HydrophobicContact CG-CG1 4.48Å; R518-I524 HydrophobicContact CG-CG2 4.02Å; R518-I524 PolarHBondContact NH1-O 3.25Å; R518-I524 VanDerWaalsContact NH1-O 3.11Å; R518-I524 PolarHBondContact O-N 3.15Å; R518-S525 PolarHBondContact NH1-O 3.49Å; R518-S525 PolarHBondContact NH2-O 2.83Å; R518-F526 VanDerWaalsContact NH1-CE1 3.33Å; R518-D533 PolarHBondContact NH2-O 2.65Å; R518-D533 IonicContact NH2-OD2 3.53Å; R518-D533 PolarHBondContact NH2-OD2 2.92Å; R518-I537 HydrophobicContact CB-CD1 3.89Å; R518-I537 HydrophobicContact CB-CG1 4.08Å
519	N	93.7	Very high	93.8	Very high	61 Å²	61	35.5 Å²	35.5	33%	0.326	20%	0.2	S	C	.	.	I	π-helix	trans	-81	-49.4	-179	-178.6	-44.3	0	0	0	112	Q514 Q515 R523 I524 F526	Q514-N519 PolarHBondContact O-N 3.48Å; Q514-N519 VanDerWaalsContact O-N 3.07Å; Q515-N519 VanDerWaalsContact O-CB 3.3Å; Q515-N519 WeakPolarHBondContact O-CB 3.28Å; N519-R523 WeakPolarHBondContact O-CA 3.34Å; N519-R523 PolarHBondContact O-N 3.36Å; N519-R523 VanDerWaalsContact O-N 3.14Å; N519-I524 WeakPolarHBondContact CA-O 3.36Å; N519-F526 HydrophobicContact CB-CD2 4.19Å; N519-F526 HydrophobicContact CB-CE2 3.55Å; N519-F526 HydrophobicContact CB-CZ 4.2Å; N519-F526 VanDerWaalsContact ND2-CD2 3.3Å; N519-F526 WeakPolarHBondContact ND2-CD2 3.45Å; N519-F526 WeakPolarHBondContact ND2-CE2 3.48Å
520	G	91.2	Very high	94.1	Very high	44 Å²	44	41.1 Å²	41.1	45%	0.454	22%	0.223	S	C	.	.	I	π-helix	trans	-67.2	-61.8	-178.1	0	0	0	0	0	114.1	Q515 Q516	Q515-G520 PolarHBondContact O-N 3.17Å; Q516-G520 CarbonylContact O-C 3.55Å; Q516-G520 WeakPolarHBondContact O-CA 3.45Å; Q516-G520 PolarHBondContact O-N 3.14Å
521	Q	95.4	Very high	94.3	Very high	58 Å²	58	47.1 Å²	47.1	27%	0.271	25%	0.251	S	S	.	.	I	π-helix	trans	-77.3	-48.7	-173.9	-61.3	179.8	13.6	0	0	112.3	Q516 G517 Q546	Q516-Q521 PolarHBondContact O-N 3.31Å; G517-Q521 WeakPolarHBondContact O-CB 3.49Å; G517-Q521 PolarHBondContact O-N 3.12Å; G517-Q521 VanDerWaalsContact O-N 3.09Å; Q521-Q546 PolarHBondContact NE2-O 2.99Å
522	L	96.8	Very high	94.5	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.209	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.2	-176.7	-50.8	-177.3	0	0	0	113.6	G517 R518 I524 E541 K544 I545	G517-L522 PolarHBondContact O-N 3.04Å; R518-L522 CarbonylContact O-C 3.54Å; R518-L522 WeakPolarHBondContact O-CB 3.35Å; L522-I524 HydrophobicContact CB-CD1 3.93Å; L522-I524 HydrophobicContact CB-CG1 3.93Å; L522-I524 HydrophobicContact CD1-CD1 4.12Å; L522-I524 PolarHBondContact O-N 3.44Å; L522-E541 HydrophobicContact CD1-CB 3.77Å; L522-E541 HydrophobicContact CD1-CG 4.27Å; L522-E541 WeakPolarHBondContact CD1-O 3.34Å; L522-K544 HydrophobicContact CD2-CB 3.61Å; L522-I545 HydrophobicContact CD1-CD1 4.16Å; L522-I545 HydrophobicContact CD1-CG1 3.91Å; L522-I545 HydrophobicContact CD2-CG1 4.36Å; L522-I545 HydrophobicContact CG-CG1 4.05Å
523	R	94.4	Very high	94.8	Very high	218 Å²	218	50.4 Å²	50.4	82%	0.823	27%	0.27	S	S	*	.			trans	59.7	27.8	-179.8	-55.2	-175.8	177.7	-152.9	-1.5	113.9	R518 N519	R518-R523 PolarHBondContact O-N 3.47Å; N519-R523 WeakPolarHBondContact O-CA 3.34Å; N519-R523 PolarHBondContact O-N 3.36Å; N519-R523 VanDerWaalsContact O-N 3.14Å
524	I	95.7	Very high	94.9	Very high	38 Å²	38	50.9 Å²	50.9	20%	0.195	27%	0.273	C	S	.	.			trans	-88.7	111.5	176.7	-55.8	173.9	0	0	0	108.1	R518 N519 L522 E541	R518-I524 HydrophobicContact CG-CB 3.67Å; R518-I524 HydrophobicContact CG-CD1 4.3Å; R518-I524 HydrophobicContact CG-CG1 4.48Å; R518-I524 HydrophobicContact CG-CG2 4.02Å; R518-I524 PolarHBondContact NH1-O 3.25Å; R518-I524 VanDerWaalsContact NH1-O 3.11Å; R518-I524 PolarHBondContact O-N 3.15Å; N519-I524 WeakPolarHBondContact CA-O 3.36Å; L522-I524 HydrophobicContact CB-CD1 3.93Å; L522-I524 HydrophobicContact CB-CG1 3.93Å; L522-I524 HydrophobicContact CD1-CD1 4.12Å; L522-I524 PolarHBondContact O-N 3.44Å; I524-E541 HydrophobicContact CD1-CG 4.12Å; I524-E541 WeakPolarHBondContact CD1-OE1 3.27Å
525	S	93.3	Very high	94.9	Very high	71 Å²	71	53.4 Å²	53.4	50%	0.497	28%	0.283	S	S	.	.			trans	-68.3	152.7	-176.8	171.2	0	0	0	0	113.1	R518 G527	R518-S525 PolarHBondContact NH1-O 3.49Å; R518-S525 PolarHBondContact NH2-O 2.83Å; S525-G527 PolarHBondContact O-N 3.05Å; S525-G527 VanDerWaalsContact O-N 3.16Å; S525-G527 PolarHBondContact OG-N 3.42Å; S525-G527 VanDerWaalsContact OG-N 3.11Å
526	F	95.8	Very high	94.9	Very high	6 Å²	6	52 Å²	52	3%	0.026	28%	0.276	C	S	.	.			trans	-77.9	22	168.6	-66	-73.4	0	0	0	113.7	V481 V483 C503 F505 Q514 R518 N519 P532 D533	V481-F526 HydrophobicContact CB-CE2 4.33Å; V481-F526 HydrophobicContact CB-CZ 4.39Å; V481-F526 HydrophobicContact CG1-CD2 3.88Å; V481-F526 HydrophobicContact CG1-CE2 3.62Å; V481-F526 HydrophobicContact CG1-CZ 4.16Å; V481-F526 HydrophobicContact CG2-CE2 4.46Å; V481-F526 HydrophobicContact CG2-CZ 4.25Å; V483-F526 HydrophobicContact CG1-CB 4.18Å; V483-F526 WeakPolarHBondContact CG1-O 3.42Å; V483-F526 HydrophobicContact CG2-CB 3.77Å; V483-F526 HydrophobicContact CG2-CG 4.48Å; C503-F526 HydrophobicContact CB-CD1 4.29Å; F505-F526 HydrophobicContact CZ-CE1 4.05Å; Q514-F526 HydrophobicContact CB-CE1 4.31Å; Q514-F526 HydrophobicContact CB-CZ 4.18Å; Q514-F526 WeakPolarHBondContact O-CZ 3.23Å; R518-F526 VanDerWaalsContact NH1-CE1 3.33Å; N519-F526 HydrophobicContact CB-CD2 4.19Å; N519-F526 HydrophobicContact CB-CE2 3.55Å; N519-F526 HydrophobicContact CB-CZ 4.2Å; N519-F526 VanDerWaalsContact ND2-CD2 3.3Å; N519-F526 WeakPolarHBondContact ND2-CD2 3.45Å; N519-F526 WeakPolarHBondContact ND2-CE2 3.48Å; F526-P532 CarbonylContact O-C 3.55Å; F526-P532 VanDerWaalsContact O-CA 3.29Å; F526-P532 WeakPolarHBondContact O-CA 3.28Å; F526-D533 PolarHBondContact O-N 3.26Å
527	G	94.7	Very high	94.9	Very high	35 Å²	35	50 Å²	50	36%	0.361	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.2	-158	-179.8	0	0	0	0	0	112.7	S525	S525-G527 PolarHBondContact O-N 3.05Å; S525-G527 VanDerWaalsContact O-N 3.16Å; S525-G527 PolarHBondContact OG-N 3.42Å; S525-G527 VanDerWaalsContact OG-N 3.11Å
528	S	94.2	Very high	94.8	Very high	59 Å²	59	51.5 Å²	51.5	41%	0.413	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	158.7	178.7	69.4	0	0	0	0	110.6	K530 H531 P532	S528-K530 PolarHBondContact O-N 2.96Å; S528-K530 VanDerWaalsContact O-N 3.08Å; S528-H531 PolarHBondContact N-O 3.3Å; S528-H531 CarbonylContact O-C 3.6Å; S528-H531 PolarHBondContact O-N 2.92Å; S528-H531 PolarHBondContact OG-N 3.43Å; S528-H531 VanDerWaalsContact OG-N 3.15Å; S528-P532 VanDerWaalsContact O-N 3.15Å
529	A	93.3	Very high	94.3	Very high	16 Å²	16	54.8 Å²	54.8	13%	0.132	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-37.6	175.7	0	0	0	0	0	113.2	E485 F486 S501	E485-A529 WeakPolarHBondContact O-CB 2.89Å; F486-A529 HydrophobicContact CB-CB 4.26Å; F486-A529 HydrophobicContact CD1-CB 3.99Å; F486-A529 WeakPolarHBondContact CD1-O 3.48Å; F486-A529 WeakPolarHBondContact CE1-O 3.36Å; S501-A529 WeakPolarHBondContact CB-O 3.48Å; S501-A529 WeakPolarHBondContact OG-CA 3.24Å; S501-A529 PolarHBondContact OG-O 3.41Å
530	K	94.3	Very high	94.2	Very high	129 Å²	129	57.1 Å²	57.1	56%	0.561	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-26.2	-179.9	-167.5	176	-180	-179	0	113.4	F486 S528	F486-K530 HydrophobicContact CD1-CB 4.35Å; F486-K530 HydrophobicContact CD2-CB 4.26Å; F486-K530 HydrophobicContact CD2-CD 4.48Å; F486-K530 HydrophobicContact CD2-CG 4.1Å; F486-K530 HydrophobicContact CE2-CG 4.11Å; F486-K530 HydrophobicContact CG-CB 4.14Å; F486-K530 HydrophobicContact CG-CG 4.48Å; S528-K530 PolarHBondContact O-N 2.96Å; S528-K530 VanDerWaalsContact O-N 3.08Å
531	H	96.2	Very high	94.3	Very high	130 Å²	130	56.5 Å²	56.5	60%	0.602	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	76	-179.3	-57.5	-71.6	0	0	0	110	S528 D533	S528-H531 PolarHBondContact N-O 3.3Å; S528-H531 CarbonylContact O-C 3.6Å; S528-H531 PolarHBondContact O-N 2.92Å; S528-H531 PolarHBondContact OG-N 3.43Å; S528-H531 VanDerWaalsContact OG-N 3.15Å; H531-D533 PolarHBondContact O-N 3.26Å
532	P	97.6	Very high	94.1	Very high	24 Å²	24	55 Å²	55	16%	0.156	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	132.8	177.3	-22.3	34.6	0	0	0	111.5	A436 F438 V483 F526 S528	A436-P532 HydrophobicContact CB-CB 4.07Å; A436-P532 HydrophobicContact CB-CG 4.19Å; F438-P532 HydrophobicContact CE1-CG 4.14Å; F438-P532 HydrophobicContact CZ-CG 4.01Å; V483-P532 HydrophobicContact CG1-CB 4.43Å; V483-P532 HydrophobicContact CG2-CB 4.31Å; F526-P532 CarbonylContact O-C 3.55Å; F526-P532 VanDerWaalsContact O-CA 3.29Å; F526-P532 WeakPolarHBondContact O-CA 3.28Å; S528-P532 VanDerWaalsContact O-N 3.15Å
533	D	97.6	Very high	93.8	Very high	56 Å²	56	60.2 Å²	60.2	30%	0.299	31%	0.31	S	S	.	.			trans	-97.4	92.4	167.9	-179.9	22.2	0	0	0	109.4	R518 F526 H531 R535	R518-D533 PolarHBondContact NH2-O 2.65Å; R518-D533 IonicContact NH2-OD2 3.53Å; R518-D533 PolarHBondContact NH2-OD2 2.92Å; F526-D533 PolarHBondContact O-N 3.26Å; H531-D533 PolarHBondContact O-N 3.26Å; D533-R535 VanDerWaalsContact C-N 3.34Å; D533-R535 VanDerWaalsContact OD1-CB 3.25Å; D533-R535 WeakPolarHBondContact OD1-CB 3.47Å; D533-R535 WeakPolarHBondContact OD1-CG 3.3Å; D533-R535 PolarHBondContact OD1-N 3.26Å; D533-R535 IonicContact OD2-NE 3.36Å; D533-R535 PolarHBondContact OD2-NE 3.28Å
534	C	97.5	Very high	93.8	Very high	10 Å²	10	56.7 Å²	56.7	7%	0.068	30%	0.301	C	S	.	.			trans	-98	20.6	177.5	-50.2	0	0	0	0	112.4	G434 C503	G434-C534 WeakPolarHBondContact CA-O 3.2Å; G434-C534 PolarHBondContact N-O 3.02Å; C503-C534 WeakPolarHBondContact CA-SG 3.34Å; C503-C534 HydrophobicContact CB-CB 3.69Å; C503-C534 WeakPolarHBondContact CB-SG 3.44Å; C503-C534 WeakPolarHBondContact SG-CA 3.32Å; C503-C534 WeakPolarHBondContact SG-CB 3.36Å; C503-C534 CovalentContact SG-SG 2.04Å; C503-C534 PolarHBondContact SG-SG 2.97Å
535	R	95	Very high	93.7	Very high	54 Å²	54	55.4 Å²	55.4	20%	0.204	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-56.9	153.2	179.9	71.8	176.5	-179.3	82.2	-13.3	111.8	Q514 D533 E541	Q514-R535 PolarHBondContact NE2-O 3.01Å; D533-R535 VanDerWaalsContact C-N 3.34Å; D533-R535 VanDerWaalsContact OD1-CB 3.25Å; D533-R535 WeakPolarHBondContact OD1-CB 3.47Å; D533-R535 WeakPolarHBondContact OD1-CG 3.3Å; D533-R535 PolarHBondContact OD1-N 3.26Å; D533-R535 IonicContact OD2-NE 3.36Å; D533-R535 PolarHBondContact OD2-NE 3.28Å; R535-E541 IonicContact CZ-OE1 2.65Å; R535-E541 IonicContact CZ-OE2 2.78Å; R535-E541 IonicContact NH1-OE1 3.16Å; R535-E541 PolarHBondContact NH1-OE1 3.02Å; R535-E541 IonicContact NH1-OE2 3.53Å; R535-E541 PolarHBondContact NH1-OE2 2.95Å; R535-E541 IonicContact NH2-OE1 3.14Å; R535-E541 PolarHBondContact NH2-OE1 3.34Å; R535-E541 IonicContact NH2-OE2 2.86Å
536	G	92.7	Very high	93.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-68.3	171.4	169.1	0	0	0	0	0	113.4	A431 T433	A431-G536 CarbonylContact O-C 3.52Å; A431-G536 WeakPolarHBondContact O-CA 3.46Å; T433-G536 WeakPolarHBondContact OG1-CA 3.38Å; T433-G536 PolarHBondContact OG1-N 2.95Å
537	I	93.5	Very high	93.2	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.5	-178.1	-59	175	0	0	0	108.1	R430 A431 F432 V513 Q514 R518 E541 L542 I545	R430-I537 CarbonylContact C-O 3.49Å; R430-I537 WeakPolarHBondContact CA-O 3.42Å; A431-I537 PolarHBondContact N-O 3.31Å; A431-I537 PolarHBondContact O-N 2.89Å; F432-I537 HydrophobicContact CD2-CD1 4.35Å; V513-I537 HydrophobicContact CG1-CD1 3.66Å; Q514-I537 HydrophobicContact CG-CD1 4.25Å; R518-I537 HydrophobicContact CB-CD1 3.89Å; R518-I537 HydrophobicContact CB-CG1 4.08Å; I537-E541 WeakPolarHBondContact CA-OE2 2.87Å; I537-E541 HydrophobicContact CG2-CB 3.49Å; I537-E541 VanDerWaalsContact CG2-CB 3.49Å; I537-L542 HydrophobicContact CG2-CB 4.02Å; I537-L542 HydrophobicContact CG2-CD1 4.3Å; I537-I545 HydrophobicContact CD1-CD1 4.02Å; I537-I545 HydrophobicContact CG2-CD1 4.26Å
538	T	91.6	Very high	92.7	Very high	32 Å²	32	59.8 Å²	59.8	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	163.1	175.7	70.1	0	0	0	0	110.6	R430 D540 E541 L542	R430-T538 HydrophobicContact CG-CG2 4.42Å; T538-D540 VanDerWaalsContact C-N 3.3Å; T538-D540 PolarHBondContact O-N 2.78Å; T538-E541 PolarHBondContact N-OE2 3.34Å; T538-E541 PolarHBondContact O-N 3.17Å; T538-E541 VanDerWaalsContact O-N 3.17Å; T538-E541 VanDerWaalsContact OG1-CG 3.25Å; T538-E541 WeakPolarHBondContact OG1-CG 3.23Å; T538-E541 PolarHBondContact OG1-N 2.71Å; T538-L542 WeakPolarHBondContact O-CB 3.41Å; T538-L542 PolarHBondContact O-N 3.07Å
539	V	86.6	Confident	92.3	Very high	69 Å²	69	65.2 Å²	65.2	42%	0.418	31%	0.312	S	S	.	.	H	α-helix	trans	-58.2	-43.2	177.8	-180	0	0	0	0	111.6	E541 L542 Q543	V539-E541 VanDerWaalsContact C-N 3.31Å; V539-E541 PolarHBondContact O-N 2.94Å; V539-L542 PolarHBondContact O-N 3.17Å; V539-Q543 WeakPolarHBondContact O-CG 3.35Å; V539-Q543 PolarHBondContact O-N 3.46Å
540	D	90.3	Very high	92.1	Very high	109 Å²	109	64.8 Å²	64.8	58%	0.583	31%	0.308	S	S	*	.	H	α-helix	trans	-65.2	-33	178.3	-67	-9.2	0	0	0	113	T538 K544	T538-D540 VanDerWaalsContact C-N 3.3Å; T538-D540 PolarHBondContact O-N 2.78Å; D540-K544 WeakPolarHBondContact O-CG 3.32Å
541	E	94.2	Very high	91.6	Very high	31 Å²	31	60.6 Å²	60.6	15%	0.145	29%	0.292	C	S	.	.	H	α-helix	trans	-71.1	-45.1	173.5	-72.1	169.2	164.7	0	0	110.2	L522 I524 R535 I537 T538 V539 Q543 K544 I545	L522-E541 HydrophobicContact CD1-CB 3.77Å; L522-E541 HydrophobicContact CD1-CG 4.27Å; L522-E541 WeakPolarHBondContact CD1-O 3.34Å; I524-E541 HydrophobicContact CD1-CG 4.12Å; I524-E541 WeakPolarHBondContact CD1-OE1 3.27Å; R535-E541 IonicContact CZ-OE1 2.65Å; R535-E541 IonicContact CZ-OE2 2.78Å; R535-E541 IonicContact NH1-OE1 3.16Å; R535-E541 PolarHBondContact NH1-OE1 3.02Å; R535-E541 IonicContact NH1-OE2 3.53Å; R535-E541 PolarHBondContact NH1-OE2 2.95Å; R535-E541 IonicContact NH2-OE1 3.14Å; R535-E541 PolarHBondContact NH2-OE1 3.34Å; R535-E541 IonicContact NH2-OE2 2.86Å; I537-E541 WeakPolarHBondContact CA-OE2 2.87Å; I537-E541 HydrophobicContact CG2-CB 3.49Å; I537-E541 VanDerWaalsContact CG2-CB 3.49Å; T538-E541 PolarHBondContact N-OE2 3.34Å; T538-E541 PolarHBondContact O-N 3.17Å; T538-E541 VanDerWaalsContact O-N 3.17Å; T538-E541 VanDerWaalsContact OG1-CG 3.25Å; T538-E541 WeakPolarHBondContact OG1-CG 3.23Å; T538-E541 PolarHBondContact OG1-N 2.71Å; V539-E541 VanDerWaalsContact C-N 3.31Å; V539-E541 PolarHBondContact O-N 2.94Å; E541-Q543 VanDerWaalsContact C-N 3.31Å; E541-Q543 PolarHBondContact O-N 3.33Å; E541-K544 WeakPolarHBondContact O-CB 3.34Å; E541-K544 PolarHBondContact O-N 2.85Å; E541-I545 PolarHBondContact O-N 3.39Å
542	L	90.7	Very high	90.9	Very high	27 Å²	27	54.4 Å²	54.4	14%	0.141	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-40.5	-179.3	-167.1	66.2	0	0	0	112	A417 F432 V513 I537 T538 V539 K544 I545 F547	A417-L542 HydrophobicContact CB-CD2 3.77Å; F432-L542 HydrophobicContact CE2-CD1 4.26Å; V513-L542 HydrophobicContact CG1-CD1 4.2Å; I537-L542 HydrophobicContact CG2-CB 4.02Å; I537-L542 HydrophobicContact CG2-CD1 4.3Å; T538-L542 WeakPolarHBondContact O-CB 3.41Å; T538-L542 PolarHBondContact O-N 3.07Å; V539-L542 PolarHBondContact O-N 3.17Å; L542-K544 PolarHBondContact O-N 3.29Å; L542-I545 HydrophobicContact CD1-CD1 4.33Å; L542-I545 PolarHBondContact O-N 2.97Å; L542-I545 VanDerWaalsContact O-N 3.13Å; L542-F547 HydrophobicContact CD1-CE2 4.08Å; L542-F547 HydrophobicContact CD1-CZ 3.7Å; L542-F547 HydrophobicContact CG-CE2 4.42Å; L542-F547 HydrophobicContact CG-CZ 4.35Å
543	Q	89.7	Confident	90	Very high	149 Å²	149	54 Å²	54	70%	0.696	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.3	176.7	-74.6	177.3	-11.5	0	0	114	V539 E541	V539-Q543 WeakPolarHBondContact O-CG 3.35Å; V539-Q543 PolarHBondContact O-N 3.46Å; E541-Q543 VanDerWaalsContact C-N 3.31Å; E541-Q543 PolarHBondContact O-N 3.33Å
544	K	94.5	Very high	89.1	Confident	145 Å²	145	52.1 Å²	52.1	63%	0.63	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-11	178.1	-67.7	171.4	-174.2	171.9	0	112.8	L522 D540 E541 L542	L522-K544 HydrophobicContact CD2-CB 3.61Å; D540-K544 WeakPolarHBondContact O-CG 3.32Å; E541-K544 WeakPolarHBondContact O-CB 3.34Å; E541-K544 PolarHBondContact O-N 2.85Å; L542-K544 PolarHBondContact O-N 3.29Å
545	I	93.9	Very high	88.3	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.051	25%	0.253	C	S	.	.			trans	-80.8	125.6	178.7	-64.2	170.8	0	0	0	108.8	V513 L522 I537 E541 L542 F547 L550	V513-I545 HydrophobicContact CG1-CD1 3.96Å; L522-I545 HydrophobicContact CD1-CD1 4.16Å; L522-I545 HydrophobicContact CD1-CG1 3.91Å; L522-I545 HydrophobicContact CD2-CG1 4.36Å; L522-I545 HydrophobicContact CG-CG1 4.05Å; I537-I545 HydrophobicContact CD1-CD1 4.02Å; I537-I545 HydrophobicContact CG2-CD1 4.26Å; E541-I545 PolarHBondContact O-N 3.39Å; L542-I545 HydrophobicContact CD1-CD1 4.33Å; L542-I545 PolarHBondContact O-N 2.97Å; L542-I545 VanDerWaalsContact O-N 3.13Å; I545-F547 HydrophobicContact CB-CD2 4.43Å; I545-F547 HydrophobicContact CB-CE2 4.12Å; I545-F547 HydrophobicContact CG2-CD2 4.09Å; I545-F547 HydrophobicContact CG2-CE2 4.03Å; I545-F547 WeakPolarHBondContact O-CD2 3.46Å; I545-F547 PolarHBondContact O-N 3.18Å; I545-L550 HydrophobicContact CG2-CD1 3.97Å; I545-L550 HydrophobicContact CG2-CD2 4.2Å; I545-L550 HydrophobicContact CG2-CG 4.38Å
546	Q	92.1	Very high	87.3	Confident	84 Å²	84	52.4 Å²	52.4	39%	0.393	25%	0.251	S	S	.	.			trans	-86.4	97.7	173.7	-70.5	175.2	-4.7	0	0	108.3	Q521 D548 R549	Q521-Q546 PolarHBondContact NE2-O 2.99Å; Q546-D548 VanDerWaalsContact C-N 3.25Å; Q546-D548 WeakPolarHBondContact CB-OD1 3.44Å; Q546-D548 PolarHBondContact O-N 3.39Å; Q546-R549 HydrophobicContact CB-CB 4.34Å; Q546-R549 HydrophobicContact CB-CG 4.13Å; Q546-R549 PolarHBondContact O-N 2.86Å; Q546-R549 VanDerWaalsContact O-N 3.08Å
547	F	86.7	Confident	86.2	Confident	23 Å²	23	56.1 Å²	56.1	10%	0.101	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65.7	-28.5	-176.6	-81.3	-104.2	0	0	0	112.8	Q410 A413 L414 V513 L542 I545 R549 L550 F552	Q410-F547 HydrophobicContact CB-CB 4.48Å; Q410-F547 HydrophobicContact CG-CB 4.22Å; A413-F547 HydrophobicContact CB-CD1 4.1Å; A413-F547 HydrophobicContact CB-CE1 3.7Å; L414-F547 HydrophobicContact CD2-CD2 4.32Å; L414-F547 HydrophobicContact CD2-CE1 4.04Å; L414-F547 HydrophobicContact CD2-CE2 3.85Å; L414-F547 HydrophobicContact CD2-CZ 3.69Å; L414-F547 HydrophobicContact CG-CD1 4.41Å; L414-F547 HydrophobicContact CG-CE1 4.21Å; L414-F547 HydrophobicContact CG-CZ 4.36Å; V513-F547 HydrophobicContact CG1-CZ 4.43Å; V513-F547 HydrophobicContact CG2-CE1 3.95Å; V513-F547 HydrophobicContact CG2-CZ 4.46Å; L542-F547 HydrophobicContact CD1-CE2 4.08Å; L542-F547 HydrophobicContact CD1-CZ 3.7Å; L542-F547 HydrophobicContact CG-CE2 4.42Å; L542-F547 HydrophobicContact CG-CZ 4.35Å; I545-F547 HydrophobicContact CB-CD2 4.43Å; I545-F547 HydrophobicContact CB-CE2 4.12Å; I545-F547 HydrophobicContact CG2-CD2 4.09Å; I545-F547 HydrophobicContact CG2-CE2 4.03Å; I545-F547 WeakPolarHBondContact O-CD2 3.46Å; I545-F547 PolarHBondContact O-N 3.18Å; F547-R549 PolarHBondContact O-N 3.11Å; F547-L550 HydrophobicContact CB-CD1 4.48Å; F547-L550 HydrophobicContact CD1-CD1 3.86Å; F547-L550 HydrophobicContact CE1-CD1 4.25Å; F547-L550 HydrophobicContact CG-CD1 4.14Å; F547-L550 PolarHBondContact O-N 2.69Å; F547-F552 HydrophobicContact CD1-CZ 4.13Å
548	D	83.7	Confident	85.1	Confident	98 Å²	98	58.6 Å²	58.6	52%	0.524	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-64	-11.3	171.5	61.5	-56.5	0	0	0	113.8	Q546	Q546-D548 VanDerWaalsContact C-N 3.25Å; Q546-D548 WeakPolarHBondContact CB-OD1 3.44Å; Q546-D548 PolarHBondContact O-N 3.39Å
549	R	87.3	Confident	83.9	Confident	172 Å²	172	58.6 Å²	58.6	65%	0.649	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-111.4	7.8	177.2	-58.2	-169.9	-179	177.8	-1.7	113.5	Q546 F547	Q546-R549 HydrophobicContact CB-CB 4.34Å; Q546-R549 HydrophobicContact CB-CG 4.13Å; Q546-R549 PolarHBondContact O-N 2.86Å; Q546-R549 VanDerWaalsContact O-N 3.08Å; F547-R549 PolarHBondContact O-N 3.11Å
550	L	87.6	Confident	82.8	Confident	8 Å²	8	60 Å²	60	4%	0.042	28%	0.283	C	S	.	.	S	Bend	trans	-91.9	132.1	175.5	-57.2	177.4	0	0	0	109.5	I512 V513 Q516 I545 F547 F552	I512-L550 HydrophobicContact CG2-CB 4.31Å; V513-L550 HydrophobicContact CG2-CD1 4.02Å; Q516-L550 HydrophobicContact CB-CD2 3.61Å; I545-L550 HydrophobicContact CG2-CD1 3.97Å; I545-L550 HydrophobicContact CG2-CD2 4.2Å; I545-L550 HydrophobicContact CG2-CG 4.38Å; F547-L550 HydrophobicContact CB-CD1 4.48Å; F547-L550 HydrophobicContact CD1-CD1 3.86Å; F547-L550 HydrophobicContact CE1-CD1 4.25Å; F547-L550 HydrophobicContact CG-CD1 4.14Å; F547-L550 PolarHBondContact O-N 2.69Å; L550-F552 HydrophobicContact CB-CD2 4.14Å; L550-F552 HydrophobicContact CB-CE2 3.54Å; L550-F552 HydrophobicContact CB-CZ 3.8Å; L550-F552 HydrophobicContact CD1-CE2 4.23Å; L550-F552 HydrophobicContact CD1-CZ 3.74Å; L550-F552 HydrophobicContact CG-CE2 4.45Å; L550-F552 HydrophobicContact CG-CZ 4.41Å; L550-F552 VanDerWaalsContact O-CD2 3.31Å; L550-F552 WeakPolarHBondContact O-CD2 3.37Å; L550-F552 PolarHBondContact O-N 3.38Å
551	D	85	Confident	81.5	Confident	41 Å²	41	61.1 Å²	61.1	22%	0.219	29%	0.289	C	S	.	.			trans	-81.2	103.7	172.6	176.3	9.7	0	0	0	109.8	Q516 T553	Q516-D551 PolarHBondContact NE2-O 3.13Å; D551-T553 WeakPolarHBondContact OD1-CB 3.37Å; D551-T553 PolarHBondContact OD1-N 2.01Å; D551-T553 PolarHBondContact OD1-OG1 2.77Å
552	F	82.3	Confident	79.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.315	C	S	.	.			trans	-91.6	10.5	177.2	-68.3	-78.4	0	0	0	114.1	S409 Q410 A413 L509 I512 F547 L550 N554 F555 Y556	S409-F552 VanDerWaalsContact OG-CB 3.25Å; S409-F552 WeakPolarHBondContact OG-CB 3.38Å; S409-F552 WeakPolarHBondContact OG-CD2 3.47Å; S409-F552 WeakPolarHBondContact OG-CG 3.21Å; Q410-F552 HydrophobicContact CB-CE2 4.44Å; Q410-F552 HydrophobicContact CG-CD2 4.16Å; Q410-F552 HydrophobicContact CG-CE2 3.57Å; Q410-F552 HydrophobicContact CG-CZ 4.35Å; A413-F552 HydrophobicContact CB-CE1 3.94Å; A413-F552 HydrophobicContact CB-CZ 4.08Å; L509-F552 HydrophobicContact CD2-CD1 3.82Å; L509-F552 HydrophobicContact CD2-CE1 3.87Å; I512-F552 HydrophobicContact CD1-CD1 4.03Å; I512-F552 HydrophobicContact CG2-CD1 3.91Å; I512-F552 HydrophobicContact CG2-CE1 3.85Å; F547-F552 HydrophobicContact CD1-CZ 4.13Å; L550-F552 HydrophobicContact CB-CD2 4.14Å; L550-F552 HydrophobicContact CB-CE2 3.54Å; L550-F552 HydrophobicContact CB-CZ 3.8Å; L550-F552 HydrophobicContact CD1-CE2 4.23Å; L550-F552 HydrophobicContact CD1-CZ 3.74Å; L550-F552 HydrophobicContact CG-CE2 4.45Å; L550-F552 HydrophobicContact CG-CZ 4.41Å; L550-F552 VanDerWaalsContact O-CD2 3.31Å; L550-F552 WeakPolarHBondContact O-CD2 3.37Å; L550-F552 PolarHBondContact O-N 3.38Å; F552-N554 PolarHBondContact O-N 3.09Å; F552-N554 VanDerWaalsContact O-N 3.11Å; F552-F555 WeakPolarHBondContact O-CA 3.36Å; F552-F555 WeakPolarHBondContact O-CB 3.02Å; F552-F555 PolarHBondContact O-N 3.27Å; F552-Y556 HydrophobicContact CB-CD1 4.11Å; F552-Y556 HydrophobicContact CB-CE1 3.4Å; F552-Y556 VanDerWaalsContact O-CD1 3.32Å; F552-Y556 WeakPolarHBondContact O-CD1 3.4Å; F552-Y556 PolarHBondContact O-N 3.42Å; F552-Y556 VanDerWaalsContact O-N 3.11Å
553	T	78.6	Confident	78	Confident	14 Å²	14	68.5 Å²	68.5	9%	0.086	33%	0.327	C	S	.	.	H	α-helix	trans	-55.5	-37.6	-174.2	-55.9	0	0	0	0	112.7	T129 Y131 D551 F555 Y556	T129-T553 HydrophobicContact CG2-CG2 3.93Å; Y131-T553 HydrophobicContact CD1-CG2 3.32Å; Y131-T553 HydrophobicContact CE1-CG2 3.23Å; Y131-T553 HydrophobicContact CG-CG2 4.17Å; D551-T553 WeakPolarHBondContact OD1-CB 3.37Å; D551-T553 PolarHBondContact OD1-N 2.01Å; D551-T553 PolarHBondContact OD1-OG1 2.77Å; T553-F555 PolarHBondContact O-N 3.48Å; T553-Y556 HydrophobicContact CG2-CD2 4.42Å; T553-Y556 PolarHBondContact O-N 3Å
554	N	77.5	Confident	76	Confident	18 Å²	18	71 Å²	71	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-67.3	-18.3	176.9	-80.1	-38.7	0	0	0	114.6	T132 K478 K508 F552	T132-N554 PolarHBondContact O-ND2 2.03Å; K478-N554 HydrophobicContact CD-CB 4Å; K478-N554 WeakPolarHBondContact CD-OD1 3.49Å; K478-N554 PolarHBondContact NZ-OD1 2.97Å; K508-N554 WeakPolarHBondContact CD-O 2.83Å; K508-N554 PolarHBondContact NZ-O 3.41Å; K508-N554 VanDerWaalsContact NZ-O 3.11Å; F552-N554 PolarHBondContact O-N 3.09Å; F552-N554 VanDerWaalsContact O-N 3.11Å
555	F	80.8	Confident	73.7	Confident	30 Å²	30	70.5 Å²	70.5	13%	0.132	34%	0.338	C	S	.	.	H	α-helix	trans	-93.8	-25.2	173.7	177.2	-103	0	0	0	112.6	A412 K508 L509 I512 F552 T553 E557 D558 L559	A412-F555 HydrophobicContact CB-CE1 4.28Å; A412-F555 HydrophobicContact CB-CZ 4.33Å; K508-F555 HydrophobicContact CB-CD2 4.41Å; L509-F555 HydrophobicContact CD1-CD2 4.39Å; L509-F555 HydrophobicContact CD1-CE1 4.38Å; L509-F555 HydrophobicContact CD1-CE2 3.88Å; L509-F555 HydrophobicContact CD1-CZ 3.87Å; L509-F555 HydrophobicContact CD2-CB 4.23Å; L509-F555 HydrophobicContact CD2-CD1 3.71Å; L509-F555 HydrophobicContact CD2-CD2 3.88Å; L509-F555 HydrophobicContact CD2-CE1 3.97Å; L509-F555 HydrophobicContact CD2-CE2 4.13Å; L509-F555 HydrophobicContact CD2-CG 3.65Å; L509-F555 HydrophobicContact CD2-CZ 4.17Å; L509-F555 HydrophobicContact CG-CD1 4.45Å; L509-F555 HydrophobicContact CG-CD2 3.81Å; L509-F555 HydrophobicContact CG-CE1 4.45Å; L509-F555 HydrophobicContact CG-CE2 3.81Å; L509-F555 HydrophobicContact CG-CG 4.13Å; L509-F555 HydrophobicContact CG-CZ 4.14Å; I512-F555 HydrophobicContact CD1-CB 4Å; F552-F555 WeakPolarHBondContact O-CA 3.36Å; F552-F555 WeakPolarHBondContact O-CB 3.02Å; F552-F555 PolarHBondContact O-N 3.27Å; T553-F555 PolarHBondContact O-N 3.48Å; F555-E557 VanDerWaalsContact C-N 3.28Å; F555-E557 PolarHBondContact O-N 3.36Å; F555-D558 HydrophobicContact CD2-CB 4.43Å; F555-D558 PolarHBondContact O-N 3.03Å; F555-L559 HydrophobicContact CD1-CB 4.31Å; F555-L559 HydrophobicContact CE1-CB 3.96Å; F555-L559 HydrophobicContact CE1-CD1 4.27Å; F555-L559 HydrophobicContact CE1-CG 4.47Å; F555-L559 HydrophobicContact CZ-CB 4.45Å; F555-L559 PolarHBondContact O-N 3.24Å
556	Y	74.3	Confident	71.2	Confident	39 Å²	39	73.8 Å²	73.8	15%	0.153	36%	0.36	C	S	.	.	H	α-helix	trans	-57.7	-39.2	-178.7	-63.9	-17.1	0	0	0	112.9	A405 E406 S409 F552 T553 D558 L559 M560	A405-Y556 HydrophobicContact CB-CD1 4.13Å; A405-Y556 HydrophobicContact CB-CE1 4.22Å; A405-Y556 HydrophobicContact CB-CG 4.34Å; A405-Y556 WeakPolarHBondContact O-CE1 3.44Å; E406-Y556 WeakPolarHBondContact CA-OH 3.46Å; E406-Y556 WeakPolarHBondContact CB-OH 3.49Å; S409-Y556 WeakPolarHBondContact OG-CE1 3.44Å; F552-Y556 HydrophobicContact CB-CD1 4.11Å; F552-Y556 HydrophobicContact CB-CE1 3.4Å; F552-Y556 VanDerWaalsContact O-CD1 3.32Å; F552-Y556 WeakPolarHBondContact O-CD1 3.4Å; F552-Y556 PolarHBondContact O-N 3.42Å; F552-Y556 VanDerWaalsContact O-N 3.11Å; T553-Y556 HydrophobicContact CG2-CD2 4.42Å; T553-Y556 PolarHBondContact O-N 3Å; Y556-D558 VanDerWaalsContact C-N 3.32Å; Y556-D558 PolarHBondContact O-N 3.22Å; Y556-L559 PolarHBondContact O-N 2.87Å; Y556-M560 WeakPolarHBondContact O-CB 3.44Å; Y556-M560 VanDerWaalsContact O-CG 3.29Å; Y556-M560 WeakPolarHBondContact O-CG 3.43Å; Y556-M560 PolarHBondContact O-N 3.05Å
557	E	68.6	Low	68.9	Low	79 Å²	79	75.5 Å²	75.5	37%	0.369	37%	0.372	S	S	.	.	H	α-helix	trans	-57.5	-44.6	174.5	-69.3	179.3	157.5	0	0	111.7	K478 F555 M560 N561	K478-E557 IonicContact NZ-OE2 2.79Å; F555-E557 VanDerWaalsContact C-N 3.28Å; F555-E557 PolarHBondContact O-N 3.36Å; E557-M560 PolarHBondContact O-N 3.34Å; E557-N561 VanDerWaalsContact O-CB 3.24Å; E557-N561 WeakPolarHBondContact O-CB 3.3Å; E557-N561 PolarHBondContact O-N 2.91Å; E557-N561 PolarHBondContact O-ND2 3.25Å; E557-N561 VanDerWaalsContact O-ND2 3.09Å
558	D	71	Confident	67.1	Low	52 Å²	52	78.4 Å²	78.4	28%	0.278	40%	0.395	S	S	.	.	H	α-helix	trans	-68.9	-38.5	178.8	-64.7	-6.4	0	0	0	111.2	K508 F555 Y556 N562	K508-D558 WeakPolarHBondContact CD-OD2 3.44Å; K508-D558 WeakPolarHBondContact CE-OD2 3.5Å; K508-D558 IonicContact NZ-OD1 2.71Å; K508-D558 PolarHBondContact NZ-OD1 2.63Å; K508-D558 IonicContact NZ-OD2 3.16Å; K508-D558 PolarHBondContact NZ-OD2 2.78Å; F555-D558 HydrophobicContact CD2-CB 4.43Å; F555-D558 PolarHBondContact O-N 3.03Å; Y556-D558 VanDerWaalsContact C-N 3.32Å; Y556-D558 PolarHBondContact O-N 3.22Å; D558-N562 WeakPolarHBondContact O-CB 3.45Å; D558-N562 PolarHBondContact O-N 3.33Å; D558-N562 VanDerWaalsContact O-N 3.12Å; D558-N562 PolarHBondContact O-ND2 2.89Å
559	L	66.7	Low	65.8	Low	33 Å²	33	75.8 Å²	75.8	17%	0.173	39%	0.392	C	S	.	.	H	α-helix	trans	-61.5	-48.2	176.8	-179.3	66.1	0	0	0	110.9	V408 F555 Y556 N562 Q563	V408-L559 HydrophobicContact CB-CD2 4.13Å; V408-L559 HydrophobicContact CG1-CD1 3.78Å; V408-L559 HydrophobicContact CG1-CD2 3.79Å; V408-L559 HydrophobicContact CG1-CG 4.43Å; F555-L559 HydrophobicContact CD1-CB 4.31Å; F555-L559 HydrophobicContact CE1-CB 3.96Å; F555-L559 HydrophobicContact CE1-CD1 4.27Å; F555-L559 HydrophobicContact CE1-CG 4.47Å; F555-L559 HydrophobicContact CZ-CB 4.45Å; F555-L559 PolarHBondContact O-N 3.24Å; Y556-L559 PolarHBondContact O-N 2.87Å; L559-N562 PolarHBondContact O-N 3.37Å; L559-Q563 PolarHBondContact O-N 3.49Å
560	M	62.4	Low	64.3	Low	99 Å²	99	71.8 Å²	71.8	49%	0.488	39%	0.386	S	S	.	.	H	α-helix	trans	-69.5	-41.8	-178.6	-67.7	-58.2	-67	0	0	111.9	Y556 E557 N562 Q563	Y556-M560 WeakPolarHBondContact O-CB 3.44Å; Y556-M560 VanDerWaalsContact O-CG 3.29Å; Y556-M560 WeakPolarHBondContact O-CG 3.43Å; Y556-M560 PolarHBondContact O-N 3.05Å; E557-M560 PolarHBondContact O-N 3.34Å; M560-N562 PolarHBondContact O-N 2.98Å; M560-Q563 WeakPolarHBondContact O-CB 3.42Å; M560-Q563 PolarHBondContact O-N 3.4Å; M560-Q563 VanDerWaalsContact O-N 3.15Å
561	N	63.6	Low	62.6	Low	132 Å²	132	76.3 Å²	76.3	71%	0.706	41%	0.41	S	S	*	.	H	α-helix	trans	-65.7	-25.7	177.7	-72.4	-25.7	0	0	0	113	E557	E557-N561 VanDerWaalsContact O-CB 3.24Å; E557-N561 WeakPolarHBondContact O-CB 3.3Å; E557-N561 PolarHBondContact O-N 2.91Å; E557-N561 PolarHBondContact O-ND2 3.25Å; E557-N561 VanDerWaalsContact O-ND2 3.09Å
562	N	60	Low	61.3	Low	130 Å²	130	77.9 Å²	77.9	70%	0.695	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	5.8	177.1	-67.8	-57.1	0	0	0	113.6	D558 L559 M560 K564	D558-N562 WeakPolarHBondContact O-CB 3.45Å; D558-N562 PolarHBondContact O-N 3.33Å; D558-N562 VanDerWaalsContact O-N 3.12Å; D558-N562 PolarHBondContact O-ND2 2.89Å; L559-N562 PolarHBondContact O-N 3.37Å; M560-N562 PolarHBondContact O-N 2.98Å; N562-K564 PolarHBondContact O-N 3.04Å; N562-K564 VanDerWaalsContact O-N 3.09Å
563	Q	52.5	Low	60.4	Low	82 Å²	82	82.6 Å²	82.6	38%	0.383	44%	0.443	S	S	.	.			trans	-64.4	113	171.1	-85.4	-173.9	-9.6	0	0	109.8	L559 M560 I565	L559-Q563 PolarHBondContact O-N 3.49Å; M560-Q563 WeakPolarHBondContact O-CB 3.42Å; M560-Q563 PolarHBondContact O-N 3.4Å; M560-Q563 VanDerWaalsContact O-N 3.15Å; Q563-I565 HydrophobicContact CB-CG1 4.34Å; Q563-I565 PolarHBondContact O-N 3.1Å
564	K	47.4	Very low	59.5	Low	203 Å²	203	88.6 Å²	88.6	88%	0.883	47%	0.468	S	S	*	.			trans	-74.4	85.8	156.4	-69.9	-175.1	-179.9	-179.1	0	107.4	N562	N562-K564 PolarHBondContact O-N 3.04Å; N562-K564 VanDerWaalsContact O-N 3.09Å
565	I	45.9	Very low	58.7	Low	134 Å²	134	91.1 Å²	91.1	69%	0.687	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-55.3	126.4	168.7	-57.8	177.5	0	0	0	106.6	Q563 D567	Q563-I565 HydrophobicContact CB-CG1 4.34Å; Q563-I565 PolarHBondContact O-N 3.1Å; I565-D567 PolarHBondContact O-N 3Å
566	P	41.8	Very low	58.2	Low	79 Å²	79	95.8 Å²	95.8	51%	0.513	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-52.6	133.8	177.8	-24.2	32.2	0	0	0	110.1	S568	P566-S568 PolarHBondContact O-N 3.33Å
567	D	43.7	Very low	57.8	Low	119 Å²	119	99.3 Å²	99.3	64%	0.636	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-49.3	133.1	175.9	-164.5	-23.4	0	0	0	109.7	I565 G569 V570 L571	I565-D567 PolarHBondContact O-N 3Å; D567-G569 PolarHBondContact O-N 2.9Å; D567-V570 HydrophobicContact CB-CG2 4.49Å; D567-V570 WeakPolarHBondContact O-CB 3.27Å; D567-V570 PolarHBondContact O-N 3.26Å; D567-L571 PolarHBondContact O-N 3.5Å
568	S	48.5	Very low	57.4	Low	84 Å²	84	102.2 Å²	102.2	59%	0.587	54%	0.536	S	S	*	.	H	α-helix	trans	-52	-27.7	-175.8	60.1	0	0	0	0	113.1	P566 V570 L571 T572	P566-S568 PolarHBondContact O-N 3.33Å; S568-V570 PolarHBondContact O-N 2.96Å; S568-L571 PolarHBondContact O-N 2.92Å; S568-T572 WeakPolarHBondContact O-CB 3.34Å; S568-T572 PolarHBondContact O-N 2.84Å; S568-T572 PolarHBondContact O-OG1 3.32Å
569	G	56	Low	57.2	Low	44 Å²	44	104 Å²	104	45%	0.454	54%	0.544	S	S	.	.	H	α-helix	trans	-60.7	-41.9	173.7	0	0	0	0	0	113.1	D567 Q573	D567-G569 PolarHBondContact O-N 2.9Å; G569-Q573 WeakPolarHBondContact O-CB 3.14Å; G569-Q573 PolarHBondContact O-N 3.45Å
570	V	56.1	Low	57.4	Low	88 Å²	88	104.6 Å²	104.6	53%	0.533	55%	0.554	S	S	.	*	H	α-helix	trans	-68.8	-41.9	178.9	-177.7	0	0	0	0	110.8	D567 S568 Q573 K574	D567-V570 HydrophobicContact CB-CG2 4.49Å; D567-V570 WeakPolarHBondContact O-CB 3.27Å; D567-V570 PolarHBondContact O-N 3.26Å; S568-V570 PolarHBondContact O-N 2.96Å; V570-Q573 PolarHBondContact O-N 2.94Å; V570-K574 PolarHBondContact O-N 2.04Å
571	L	51.5	Low	57.5	Low	102 Å²	102	104.4 Å²	104.4	53%	0.534	56%	0.555	S	S	.	*	H	α-helix	trans	-65.3	-44.5	178.4	-145.4	81.6	0	0	0	111.1	D567 S568 Q573 K574 V575	D567-L571 PolarHBondContact O-N 3.5Å; S568-L571 PolarHBondContact O-N 2.92Å; L571-Q573 VanDerWaalsContact C-N 3.27Å; L571-Q573 PolarHBondContact O-N 2.9Å; L571-K574 PolarHBondContact O-N 3.33Å; L571-V575 WeakPolarHBondContact O-CG2 3.35Å; L571-V575 PolarHBondContact O-N 3.36Å
572	T	59.1	Low	57.2	Low	74 Å²	74	104.8 Å²	104.8	45%	0.454	55%	0.553	S	S	.	*	H	α-helix	trans	-59.8	-40.1	176.5	-53.3	0	0	0	0	111.3	S568 V575 K576	S568-T572 WeakPolarHBondContact O-CB 3.34Å; S568-T572 PolarHBondContact O-N 2.84Å; S568-T572 PolarHBondContact O-OG1 3.32Å; T572-V575 PolarHBondContact O-N 2.89Å; T572-K576 WeakPolarHBondContact O-CG 3.29Å; T572-K576 PolarHBondContact O-N 2.92Å
573	Q	62.4	Low	57.4	Low	100 Å²	100	104.4 Å²	104.4	47%	0.467	55%	0.55	S	S	.	.	H	α-helix	trans	-66.3	-42.1	178.2	-167.2	61.7	18.5	0	0	112	G569 V570 L571 V575 K576 E577	G569-Q573 WeakPolarHBondContact O-CB 3.14Å; G569-Q573 PolarHBondContact O-N 3.45Å; V570-Q573 PolarHBondContact O-N 2.94Å; L571-Q573 VanDerWaalsContact C-N 3.27Å; L571-Q573 PolarHBondContact O-N 2.9Å; Q573-V575 PolarHBondContact O-N 2.73Å; Q573-K576 WeakPolarHBondContact O-CB 3Å; Q573-K576 PolarHBondContact O-N 3.4Å; Q573-E577 PolarHBondContact O-N 3.38Å
574	K	59.3	Low	58	Low	139 Å²	139	107.6 Å²	107.6	60%	0.604	56%	0.562	S	S	*	*	H	α-helix	trans	-60.3	-43.3	173.8	-100.5	-171.8	174.4	-176.9	0	112.9	V570 L571 K576 E577 Q578	V570-K574 PolarHBondContact O-N 2.04Å; L571-K574 PolarHBondContact O-N 3.33Å; K574-K576 VanDerWaalsContact C-N 3.33Å; K574-K576 PolarHBondContact O-N 3Å; K574-E577 PolarHBondContact O-N 3.2Å; K574-Q578 PolarHBondContact O-N 3.4Å
575	V	61.6	Low	58.3	Low	72 Å²	72	104.9 Å²	104.9	44%	0.436	55%	0.553	S	S	.	*	H	α-helix	trans	-62.8	-42.7	177.3	172.6	0	0	0	0	110.4	L571 T572 Q573 E577 Q578 I579	L571-V575 WeakPolarHBondContact O-CG2 3.35Å; L571-V575 PolarHBondContact O-N 3.36Å; T572-V575 PolarHBondContact O-N 2.89Å; Q573-V575 PolarHBondContact O-N 2.73Å; V575-E577 VanDerWaalsContact C-N 3.34Å; V575-E577 PolarHBondContact O-N 2.9Å; V575-Q578 PolarHBondContact O-N 2.87Å; V575-I579 HydrophobicContact CG1-CD1 3.75Å; V575-I579 HydrophobicContact CG1-CG1 4.35Å; V575-I579 VanDerWaalsContact O-CG1 3.29Å; V575-I579 WeakPolarHBondContact O-CG1 3.02Å; V575-I579 PolarHBondContact O-N 3.04Å
576	K	70.8	Confident	58.7	Low	128 Å²	128	102.4 Å²	102.4	56%	0.557	55%	0.553	S	S	*	*	H	α-helix	trans	-60.3	-42.2	174.7	-75.7	178.9	179	178.1	0	112.3	T572 Q573 K574 A580	T572-K576 WeakPolarHBondContact O-CG 3.29Å; T572-K576 PolarHBondContact O-N 2.92Å; Q573-K576 WeakPolarHBondContact O-CB 3Å; Q573-K576 PolarHBondContact O-N 3.4Å; K574-K576 VanDerWaalsContact C-N 3.33Å; K574-K576 PolarHBondContact O-N 3Å; K576-A580 WeakPolarHBondContact O-CB 3.48Å; K576-A580 PolarHBondContact O-N 3.49Å
577	E	65.2	Low	59.2	Low	112 Å²	112	102 Å²	102	52%	0.523	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-46.1	175.8	-78.2	174.1	175.8	0	0	111.9	Q573 K574 V575 I579 A580 D581	Q573-E577 PolarHBondContact O-N 3.38Å; K574-E577 PolarHBondContact O-N 3.2Å; V575-E577 VanDerWaalsContact C-N 3.34Å; V575-E577 PolarHBondContact O-N 2.9Å; E577-I579 PolarHBondContact O-N 3.48Å; E577-A580 WeakPolarHBondContact O-CB 3.3Å; E577-A580 PolarHBondContact O-N 2.9Å; E577-D581 PolarHBondContact O-N 3.04Å
578	Q	60.7	Low	59.2	Low	140 Å²	140	107 Å²	107	65%	0.654	58%	0.582	S	S	*	*	H	α-helix	trans	-62.7	-42.3	176.8	-90.3	-173.3	-42.5	0	0	113	K574 V575 A580 D581 Q582	K574-Q578 PolarHBondContact O-N 3.4Å; V575-Q578 PolarHBondContact O-N 2.87Å; Q578-A580 VanDerWaalsContact C-N 3.3Å; Q578-A580 PolarHBondContact O-N 2.97Å; Q578-D581 PolarHBondContact O-N 3.01Å; Q578-Q582 PolarHBondContact O-N 3.49Å
579	I	67.1	Low	59.8	Low	89 Å²	89	108.2 Å²	108.2	46%	0.456	58%	0.582	S	S	.	*	H	α-helix	trans	-62	-42.7	175.1	-68.9	169.1	0	0	0	109.9	V575 E577 D581 Q582 L583	V575-I579 HydrophobicContact CG1-CD1 3.75Å; V575-I579 HydrophobicContact CG1-CG1 4.35Å; V575-I579 VanDerWaalsContact O-CG1 3.29Å; V575-I579 WeakPolarHBondContact O-CG1 3.02Å; V575-I579 PolarHBondContact O-N 3.04Å; E577-I579 PolarHBondContact O-N 3.48Å; I579-D581 PolarHBondContact O-N 3.48Å; I579-Q582 PolarHBondContact O-N 2.92Å; I579-L583 HydrophobicContact CG2-CD1 3.84Å; I579-L583 HydrophobicContact CG2-CG 4.36Å; I579-L583 WeakPolarHBondContact O-CB 3.29Å; I579-L583 VanDerWaalsContact O-CG 3.29Å; I579-L583 WeakPolarHBondContact O-CG 3.39Å; I579-L583 PolarHBondContact O-N 3.33Å
580	A	69.6	Low	60	Low	46 Å²	46	111.6 Å²	111.6	38%	0.38	59%	0.589	S	S	.	*	H	α-helix	trans	-63.4	-39.7	177.7	0	0	0	0	0	112.4	K576 E577 Q578 L583 K584	K576-A580 WeakPolarHBondContact O-CB 3.48Å; K576-A580 PolarHBondContact O-N 3.49Å; E577-A580 WeakPolarHBondContact O-CB 3.3Å; E577-A580 PolarHBondContact O-N 2.9Å; Q578-A580 VanDerWaalsContact C-N 3.3Å; Q578-A580 PolarHBondContact O-N 2.97Å; A580-L583 PolarHBondContact O-N 3.31Å; A580-K584 PolarHBondContact O-N 3.13Å
581	D	64.8	Low	60.2	Low	95 Å²	95	112.9 Å²	112.9	51%	0.508	59%	0.592	S	S	.	*	H	α-helix	trans	-69.4	-40	176.4	-85.2	-8.1	0	0	0	112.3	E577 Q578 I579 K584 Q585	E577-D581 PolarHBondContact O-N 3.04Å; Q578-D581 PolarHBondContact O-N 3.01Å; I579-D581 PolarHBondContact O-N 3.48Å; D581-K584 PolarHBondContact O-N 3.43Å; D581-Q585 PolarHBondContact O-N 3.08Å
582	Q	56.4	Low	60.7	Low	141 Å²	141	113.5 Å²	113.5	66%	0.659	60%	0.595	S	S	*	*	H	α-helix	trans	-65	-40.6	173.3	-80.2	-164.1	-19.9	0	0	112.2	Q578 I579 K584 Q585 A586	Q578-Q582 PolarHBondContact O-N 3.49Å; I579-Q582 PolarHBondContact O-N 2.92Å; Q582-K584 VanDerWaalsContact C-N 3.29Å; Q582-K584 PolarHBondContact O-N 3.3Å; Q582-Q585 PolarHBondContact O-N 2.87Å; Q582-A586 WeakPolarHBondContact O-CB 3.48Å; Q582-A586 PolarHBondContact O-N 3.17Å
583	L	66.1	Low	60.8	Low	121 Å²	121	116 Å²	116	63%	0.634	60%	0.604	S	S	*	*	H	α-helix	trans	-63.7	-35.5	175.3	-75.7	169.8	0	0	0	111.9	I579 A580 G587	I579-L583 HydrophobicContact CG2-CD1 3.84Å; I579-L583 HydrophobicContact CG2-CG 4.36Å; I579-L583 WeakPolarHBondContact O-CB 3.29Å; I579-L583 VanDerWaalsContact O-CG 3.29Å; I579-L583 WeakPolarHBondContact O-CG 3.39Å; I579-L583 PolarHBondContact O-N 3.33Å; A580-L583 PolarHBondContact O-N 3.31Å; L583-G587 PolarHBondContact O-N 3.01Å; L583-G587 VanDerWaalsContact O-N 3.08Å
584	K	63.2	Low	60.7	Low	149 Å²	149	117.1 Å²	117.1	65%	0.648	61%	0.613	S	S	*	*	H	α-helix	trans	-65.7	-39.5	172	-81.4	178.9	-179.5	171	0	112.6	A580 D581 Q582	A580-K584 PolarHBondContact O-N 3.13Å; D581-K584 PolarHBondContact O-N 3.43Å; Q582-K584 VanDerWaalsContact C-N 3.29Å; Q582-K584 PolarHBondContact O-N 3.3Å
585	Q	53.9	Low	60.8	Low	146 Å²	146	115.5 Å²	115.5	68%	0.682	61%	0.614	S	S	*	*	H	α-helix	trans	-70.9	-35.8	177.3	-75.6	-176.1	3.6	0	0	112.7	D581 Q582 G587 Q588	D581-Q585 PolarHBondContact O-N 3.08Å; Q582-Q585 PolarHBondContact O-N 2.87Å; Q585-G587 VanDerWaalsContact C-N 3.31Å; Q585-Q588 PolarHBondContact O-N 3.46Å
586	A	54.3	Low	60.7	Low	83 Å²	83	118.8 Å²	118.8	69%	0.686	63%	0.628	S	S	*	*	H	α-helix	trans	-76.8	-18.8	177.2	0	0	0	0	0	113.3	Q582 Q588	Q582-A586 WeakPolarHBondContact O-CB 3.48Å; Q582-A586 PolarHBondContact O-N 3.17Å; A586-Q588 VanDerWaalsContact C-N 3.34Å
587	G	53.3	Low	59.9	Low	70 Å²	70	118.1 Å²	118.1	72%	0.722	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-0.9	173.4	0	0	0	0	0	114.6	L583 Q585	L583-G587 PolarHBondContact O-N 3.01Å; L583-G587 VanDerWaalsContact O-N 3.08Å; Q585-G587 VanDerWaalsContact C-N 3.31Å
588	Q	44.2	Very low	59.4	Low	225 Å²	225	118.6 Å²	118.6	100%	1.051	64%	0.644	S	S	*	*			trans	-107.1	0	169.7	-72.9	-172.8	-24.8	0	0	109.4	Q585 A586	Q585-Q588 PolarHBondContact O-N 3.46Å; A586-Q588 VanDerWaalsContact C-N 3.34Å

Retrieved 588 of 588 residues in 109.7 ms (Link to these results)

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