A0A096NSV1_PAPAN Loading...

Serine/threonine-protein phosphatase 2A 55 kDa regulatory subunit B

AlphaFold DB , UniProt , Accession A0A096NSV1, Species PAPAN (Papio anubis, Olive baboon), Gene PPP2R2D, Length 453 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	31.7	Very low	29.1	Very low	250 Å²	250	107.1 Å²	107.1	100%	1.232	85%	0.845	S	S	*	*				0	125.9	0	-68.5	-178.1	-169.3	0	0	106.8
2	A	32.1	Very low	29.3	Very low	101 Å²	101	103.9 Å²	103.9	84%	0.835	83%	0.833	S	S	*	*			cis	-150.2	140.2	-1.7	0	0	0	0	0	106.1
3	G	28.2	Very low	30.2	Very low	82 Å²	82	103.7 Å²	103.7	85%	0.845	82%	0.824	S	S	*	*			trans	-73.5	139.5	169.2	0	0	0	0	0	110
4	A	31.6	Very low	31.6	Very low	106 Å²	106	106.8 Å²	106.8	88%	0.876	82%	0.821	S	S	*	*			trans	-96.3	101.8	164.1	0	0	0	0	0	107.3
5	G	26.6	Very low	33.9	Very low	75 Å²	75	105.9 Å²	105.9	77%	0.773	80%	0.8	S	S	*	*			trans	-67.2	128.6	176.6	0	0	0	0	0	111.1	G7	G5-G7 PolarHBondContact O-N 3.23Å
6	G	26.5	Very low	36.8	Very low	80 Å²	80	103.1 Å²	103.1	83%	0.825	77%	0.766	S	S	*	*			trans	-63.5	113.7	161	0	0	0	0	0	108.8	G8	G6-G8 VanDerWaalsContact C-N 3.31Å; G6-G8 PolarHBondContact O-N 2.98Å
7	G	24.7	Very low	39.8	Very low	76 Å²	76	101.8 Å²	101.8	78%	0.784	74%	0.744	S	S	*	*			trans	-65.9	93.1	166.9	0	0	0	0	0	108.9	G5 C9	G5-G7 PolarHBondContact O-N 3.23Å; G7-C9 PolarHBondContact O-N 2.76Å
8	G	26.7	Very low	42.7	Very low	72 Å²	72	96.6 Å²	96.6	74%	0.742	70%	0.704	S	S	*	*			trans	-61.1	114.8	164.9	0	0	0	0	0	108.5	G6	G6-G8 VanDerWaalsContact C-N 3.31Å; G6-G8 PolarHBondContact O-N 2.98Å
9	C	27.6	Very low	45.3	Very low	114 Å²	114	91.8 Å²	91.8	77%	0.77	67%	0.669	S	S	*	*			trans	-56.9	140.6	162.5	-64.2	0	0	0	0	108	G7 A11	G7-C9 PolarHBondContact O-N 2.76Å; C9-A11 PolarHBondContact O-N 3.2Å
10	P	31.1	Very low	47.6	Very low	128 Å²	128	87.8 Å²	87.8	83%	0.831	64%	0.638	S	S	*	*			trans	-64.8	112.6	173.6	27	-29	0	0	0	107	G12	P10-G12 PolarHBondContact O-N 2.89Å
11	A	33.1	Very low	49.7	Very low	94 Å²	94	84.4 Å²	84.4	78%	0.777	61%	0.613	S	S	*	*			trans	-60.1	110.9	165.6	0	0	0	0	0	106.6	C9 S13	C9-A11 PolarHBondContact O-N 3.2Å; A11-S13 PolarHBondContact O-N 2.94Å
12	G	31.3	Very low	52.6	Low	69 Å²	69	72.9 Å²	72.9	71%	0.711	56%	0.557	S	S	*	*			trans	-58	108.1	167.5	0	0	0	0	0	107.8	P10 N14	P10-G12 PolarHBondContact O-N 2.89Å; G12-N14 VanDerWaalsContact C-N 3.32Å; G12-N14 PolarHBondContact O-N 3.22Å
13	S	41	Very low	55.5	Low	101 Å²	101	69.8 Å²	69.8	71%	0.706	53%	0.527	S	S	*	.			trans	-75.6	85	178.7	59.6	0	0	0	0	109.1	A11 D15	A11-S13 PolarHBondContact O-N 2.94Å; S13-D15 PolarHBondContact O-N 2.87Å
14	N	50.3	Low	58.6	Low	147 Å²	147	68.1 Å²	68.1	79%	0.786	50%	0.497	S	S	*	.			trans	-86.2	31.5	168.3	-86.7	4.9	0	0	0	111.7	G12 F16	G12-N14 VanDerWaalsContact C-N 3.32Å; G12-N14 PolarHBondContact O-N 3.22Å; N14-F16 PolarHBondContact O-N 2.75Å
15	D	66.4	Low	61.2	Low	94 Å²	94	65.2 Å²	65.2	50%	0.503	48%	0.477	S	S	.	.			trans	-79.3	120.3	172.2	-70.1	-36.5	0	0	0	108.1	S13 Q17 R381	S13-D15 PolarHBondContact O-N 2.87Å; D15-Q17 PolarHBondContact O-N 3.21Å; D15-R381 VanDerWaalsContact CG-NH1 3.29Å; D15-R381 IonicContact OD1-CZ 3.98Å; D15-R381 IonicContact OD1-NH1 3.17Å; D15-R381 PolarHBondContact OD1-NH1 2.74Å; D15-R381 IonicContact OD2-NH1 3.66Å; D15-R381 PolarHBondContact OD2-NH1 3.26Å
16	F	79.3	Confident	63.7	Low	60 Å²	60	63.7 Å²	63.7	26%	0.263	46%	0.457	S	S	.	.			trans	-54.3	124.6	176.4	-60.5	-78.2	0	0	0	110.7	N14 W18 A362	N14-F16 PolarHBondContact O-N 2.75Å; F16-W18 HydrophobicContact CB-CZ2 4.23Å; F16-W18 VanDerWaalsContact CB-NE1 3.28Å; F16-W18 HydrophobicContact CD1-CZ2 4.2Å; F16-W18 HydrophobicContact CG-CZ2 4.19Å; F16-W18 AromaticContact CG-NE1 3.96Å; F16-W18 PolarHBondContact O-N 2.86Å; F16-A362 HydrophobicContact CE2-CB 4.07Å; F16-A362 HydrophobicContact CZ-CB 4.32Å
17	Q	88.3	Confident	65.8	Low	82 Å²	82	66.5 Å²	66.5	38%	0.383	45%	0.452	S	S	.	.			trans	-102.2	81.5	175.3	-173	169.5	11.4	0	0	109.4	D15 C19 S397 D450 K451	D15-Q17 PolarHBondContact O-N 3.21Å; Q17-C19 PolarHBondContact O-N 2.74Å; Q17-S397 PolarHBondContact NE2-OG 3.14Å; Q17-D450 PolarHBondContact N-OD1 3.3Å; Q17-K451 HydrophobicContact CB-CB 4.12Å; Q17-K451 HydrophobicContact CG-CB 4.24Å; Q17-K451 HydrophobicContact CG-CD 4.32Å; Q17-K451 WeakPolarHBondContact O-CB 3.43Å; Q17-K451 PolarHBondContact O-N 2.98Å
18	W	92.1	Very high	68	Low	8 Å²	8	68.6 Å²	68.6	3%	0.03	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	127.2	179.9	-65.1	101.5	0	0	0	112	F16 M374 L385 S397 L398 W430 N435 I437 F448	F16-W18 HydrophobicContact CB-CZ2 4.23Å; F16-W18 VanDerWaalsContact CB-NE1 3.28Å; F16-W18 HydrophobicContact CD1-CZ2 4.2Å; F16-W18 HydrophobicContact CG-CZ2 4.19Å; F16-W18 AromaticContact CG-NE1 3.96Å; F16-W18 PolarHBondContact O-N 2.86Å; W18-M374 HydrophobicContact CD2-SD 4.38Å; W18-M374 HydrophobicContact CG-SD 4.44Å; W18-M374 HydrophobicContact CH2-CE 4.3Å; W18-M374 HydrophobicContact CZ2-CE 3.34Å; W18-M374 HydrophobicContact CZ2-SD 4.13Å; W18-M374 PolarHBondContact NE1-SD 3.34Å; W18-L385 HydrophobicContact CB-CD1 4.14Å; W18-L385 HydrophobicContact CG-CD1 4.02Å; W18-S397 CarbonylContact O-C 3.59Å; W18-S397 WeakPolarHBondContact O-CA 3.29Å; W18-L398 HydrophobicContact CB-CD1 3.93Å; W18-L398 HydrophobicContact CB-CG 4.38Å; W18-L398 PolarHBondContact O-N 2.96Å; W18-W430 AromaticContact CH2-CZ2 3.8Å; W18-W430 HydrophobicContact CH2-CZ2 3.8Å; W18-W430 HydrophobicContact CZ2-CH2 4.06Å; W18-W430 AromaticContact CZ2-CZ2 3.65Å; W18-W430 HydrophobicContact CZ2-CZ2 3.65Å; W18-N435 HydrophobicContact CH2-CB 3.95Å; W18-N435 HydrophobicContact CZ3-CB 4.37Å; W18-N435 WeakPolarHBondContact CZ3-O 3.49Å; W18-I437 HydrophobicContact CD2-CD1 4.19Å; W18-I437 HydrophobicContact CE3-CD1 3.96Å; W18-I437 HydrophobicContact CE3-CG1 3.97Å; W18-I437 HydrophobicContact CH2-CD1 4.45Å; W18-I437 HydrophobicContact CH2-CG1 4.32Å; W18-I437 HydrophobicContact CH2-CG2 3.69Å; W18-I437 HydrophobicContact CZ2-CG2 4.4Å; W18-I437 HydrophobicContact CZ3-CB 4.35Å; W18-I437 HydrophobicContact CZ3-CD1 4.09Å; W18-I437 HydrophobicContact CZ3-CG1 3.76Å; W18-I437 HydrophobicContact CZ3-CG2 3.92Å; W18-F448 HydrophobicContact CE3-CB 4.11Å
19	C	91.5	Very high	69.9	Low	6 Å²	6	74.4 Å²	74.4	4%	0.041	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.9	176.6	-78	0	0	0	0	110.6	Q17 S21 R395 A396 S397 F448 Q449	Q17-C19 PolarHBondContact O-N 2.74Å; C19-S21 PolarHBondContact O-N 3.11Å; C19-R395 PolarHBondContact SG-O 2.97Å; C19-R395 VanDerWaalsContact SG-O 3.38Å; C19-A396 CarbonylContact C-O 3.42Å; C19-A396 VanDerWaalsContact CA-O 3.28Å; C19-A396 WeakPolarHBondContact CA-O 3.36Å; C19-S397 PolarHBondContact SG-OG 3.39Å; C19-S397 VanDerWaalsContact SG-OG 3.37Å; C19-F448 VanDerWaalsContact O-CA 3.29Å; C19-F448 WeakPolarHBondContact O-CA 3.34Å; C19-Q449 WeakPolarHBondContact CB-O 3.31Å; C19-Q449 PolarHBondContact N-O 3.27Å; C19-Q449 PolarHBondContact O-N 3.24Å
20	F	92.5	Very high	72.3	Confident	10 Å²	10	76.5 Å²	76.5	4%	0.044	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	125.6	168	176.4	-96.7	0	0	0	110.5	Q22 V23 S392 R395 A396 Y446 F448	F20-Q22 VanDerWaalsContact CE2-C 3.46Å; F20-Q22 VanDerWaalsContact CE2-O 3.28Å; F20-Q22 WeakPolarHBondContact CE2-O 3.33Å; F20-V23 HydrophobicContact CE2-CB 3.95Å; F20-V23 HydrophobicContact CE2-CG1 4.39Å; F20-V23 HydrophobicContact CZ-CB 3.91Å; F20-V23 HydrophobicContact CZ-CG1 3.92Å; F20-S392 WeakPolarHBondContact CD1-O 3.26Å; F20-S392 WeakPolarHBondContact CD2-OG 2.98Å; F20-S392 WeakPolarHBondContact CE1-O 3.05Å; F20-S392 VanDerWaalsContact CE2-CB 3.47Å; F20-S392 WeakPolarHBondContact CE2-OG 3.4Å; F20-R395 WeakPolarHBondContact O-CA 3.4Å; F20-R395 PolarHBondContact O-N 2.99Å; F20-A396 PolarHBondContact N-O 3.37Å; F20-Y446 HydrophobicContact CD2-CD1 4.39Å; F20-Y446 AromaticContact CE2-CD1 4Å; F20-Y446 HydrophobicContact CE2-CD1 4Å; F20-F448 HydrophobicContact CB-CD1 4.36Å; F20-F448 HydrophobicContact CB-CE1 4.36Å; F20-F448 HydrophobicContact CD2-CD1 4.37Å; F20-F448 AromaticContact CD2-CE1 3.9Å; F20-F448 HydrophobicContact CD2-CE1 3.9Å
21	S	91.1	Very high	74.8	Confident	18 Å²	18	72.3 Å²	72.3	13%	0.126	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-63.4	175.1	-167.2	0	0	0	0	110.4	C19 I447 Q449	C19-S21 PolarHBondContact O-N 3.11Å; S21-I447 WeakPolarHBondContact CA-O 3.46Å; S21-I447 WeakPolarHBondContact CB-O 3.43Å; S21-I447 PolarHBondContact N-O 2.74Å; S21-Q449 PolarHBondContact OG-NE2 2.85Å; S21-Q449 PolarHBondContact OG-OE1 3.3Å
22	Q	92.8	Very high	77.6	Confident	8 Å²	8	70.3 Å²	70.3	4%	0.037	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	156.6	-172.9	-59.5	177	-72.5	0	0	111.6	F20 E76 Y77 I447	F20-Q22 VanDerWaalsContact CE2-C 3.46Å; F20-Q22 VanDerWaalsContact CE2-O 3.28Å; F20-Q22 WeakPolarHBondContact CE2-O 3.33Å; Q22-E76 HydrophobicContact CG-CG 4.14Å; Q22-E76 PolarHBondContact NE2-OE2 2.87Å; Q22-Y77 PolarHBondContact NE2-O 3.38Å; Q22-I447 HydrophobicContact CB-CB 4.24Å; Q22-I447 HydrophobicContact CB-CD1 4.41Å; Q22-I447 PolarHBondContact N-O 3.14Å; Q22-I447 PolarHBondContact O-N 3.4Å
23	V	93.8	Very high	80.5	Confident	35 Å²	35	74 Å²	74	21%	0.212	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.1	163.8	64.3	0	0	0	0	108.2	F20 R389 N444 L445 Y446	F20-V23 HydrophobicContact CE2-CB 3.95Å; F20-V23 HydrophobicContact CE2-CG1 4.39Å; F20-V23 HydrophobicContact CZ-CB 3.91Å; F20-V23 HydrophobicContact CZ-CG1 3.92Å; V23-R389 VanDerWaalsContact CG1-NH1 3.32Å; V23-R389 HydrophobicContact CG2-CG 4.47Å; V23-N444 HydrophobicContact CG2-CB 4.13Å; V23-L445 CarbonylContact C-O 3.58Å; V23-L445 VanDerWaalsContact CA-O 3.31Å; V23-L445 WeakPolarHBondContact CA-O 3.43Å; V23-Y446 HydrophobicContact CB-CD1 4.25Å; V23-Y446 HydrophobicContact CB-CE1 4.34Å; V23-Y446 HydrophobicContact CG2-CD1 4.04Å; V23-Y446 HydrophobicContact CG2-CD2 4.41Å; V23-Y446 HydrophobicContact CG2-CE1 3.89Å; V23-Y446 HydrophobicContact CG2-CE2 4.27Å; V23-Y446 HydrophobicContact CG2-CG 4.31Å
24	K	92.3	Very high	83.1	Confident	48 Å²	48	71.2 Å²	71.2	21%	0.209	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	142.5	172	-48	-63.2	-173.5	177.8	0	108	F61 Y77 N444 L445	K24-F61 HydrophobicContact CB-CE1 4.3Å; K24-F61 HydrophobicContact CB-CZ 4.34Å; K24-F61 HydrophobicContact CD-CE1 4.32Å; K24-F61 HydrophobicContact CG-CD1 4.5Å; K24-F61 HydrophobicContact CG-CE1 3.85Å; K24-F61 HydrophobicContact CG-CZ 4.24Å; K24-Y77 WeakPolarHBondContact CE-O 3.38Å; K24-Y77 PolarHBondContact NZ-O 3.09Å; K24-N444 CarbonylContact O-C 3.55Å; K24-N444 VanDerWaalsContact O-CA 3.24Å; K24-N444 WeakPolarHBondContact O-CA 3.17Å; K24-L445 HydrophobicContact CB-CB 4.27Å; K24-L445 PolarHBondContact N-O 3.49Å; K24-L445 PolarHBondContact O-N 2.81Å
25	G	87.1	Confident	85.2	Confident	44 Å²	44	66.9 Å²	66.9	45%	0.454	37%	0.371	S	S	.	.	S	Bend	trans	122.9	170.5	-176.5	0	0	0	0	0	113.1	R389	G25-R389 VanDerWaalsContact C-NH2 3.28Å; G25-R389 PolarHBondContact O-NH2 3.03Å
26	A	77.3	Confident	86.6	Confident	44 Å²	44	64.3 Å²	64.3	36%	0.364	36%	0.356	S	S	.	.			trans	-69.9	153	-176.7	0	0	0	0	0	112.3	R389 N444	A26-R389 PolarHBondContact O-NH2 3.05Å; A26-N444 PolarHBondContact O-OD1 3.48Å; A26-N444 VanDerWaalsContact O-OD1 3.12Å
27	I	72.2	Confident	87.5	Confident	139 Å²	139	62.2 Å²	62.2	71%	0.713	35%	0.348	S	S	*	.	S	Bend	trans	-85	-23.4	174.1	-62.5	169.9	0	0	0	110.4
28	D	70.4	Confident	88	Confident	119 Å²	119	58.6 Å²	58.6	64%	0.636	33%	0.331	S	S	*	.	S	Bend	trans	-72.3	146.6	-172.9	-59	-30.1	0	0	0	112.1	D30	D28-D30 VanDerWaalsContact C-N 3.28Å
29	E	66.4	Low	88.3	Confident	194 Å²	194	58.3 Å²	58.3	91%	0.907	33%	0.33	S	S	*	.	S	Bend	trans	-71.6	-25.1	178.1	-64.3	-170.8	162.7	0	0	112.1	V31	E29-V31 PolarHBondContact O-N 3.46Å; E29-V31 VanDerWaalsContact O-N 3.08Å
30	D	78.4	Confident	88.7	Confident	159 Å²	159	58 Å²	58	85%	0.85	33%	0.329	S	S	*	.			trans	-83.8	81.9	178	-66.9	-32.7	0	0	0	110.6	D28	D28-D30 VanDerWaalsContact C-N 3.28Å
31	V	84.1	Confident	89	Confident	39 Å²	39	59.7 Å²	59.7	24%	0.236	34%	0.337	C	S	.	.			trans	-83.6	120.9	176.5	-179.6	0	0	0	0	110.1	E29 E33 I36 T442 N443	E29-V31 PolarHBondContact O-N 3.46Å; E29-V31 VanDerWaalsContact O-N 3.08Å; V31-E33 PolarHBondContact O-N 3.01Å; V31-I36 HydrophobicContact CG1-CG1 4.21Å; V31-T442 HydrophobicContact CB-CG2 4.17Å; V31-T442 HydrophobicContact CG1-CG2 3.89Å; V31-T442 HydrophobicContact CG2-CG2 4.23Å; V31-N443 HydrophobicContact CG1-CB 3.46Å; V31-N443 VanDerWaalsContact CG1-CB 3.46Å; V31-N443 WeakPolarHBondContact CG1-ND2 3.24Å; V31-N443 WeakPolarHBondContact CG2-ND2 3.4Å; V31-N443 WeakPolarHBondContact CG2-OD1 3.47Å
32	A	91.3	Very high	89.3	Confident	52 Å²	52	59.6 Å²	59.6	43%	0.43	33%	0.334	S	S	.	.			trans	-63.1	135.9	171.4	0	0	0	0	0	110.3	A34 D35	A32-A34 PolarHBondContact O-N 3.04Å; A32-A34 VanDerWaalsContact O-N 3.16Å; A32-D35 PolarHBondContact O-N 2.96Å
33	E	92.3	Very high	89.5	Confident	146 Å²	146	59.6 Å²	59.6	68%	0.682	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-57.3	-36.2	-176.8	-67.8	-164.6	155.2	0	0	112.8	V31 D35 I36 K54	V31-E33 PolarHBondContact O-N 3.01Å; E33-D35 PolarHBondContact O-N 3.23Å; E33-I36 HydrophobicContact CB-CD1 4.42Å; E33-I36 WeakPolarHBondContact O-CB 3.43Å; E33-I36 WeakPolarHBondContact O-CG1 3.2Å; E33-I36 PolarHBondContact O-N 3.2Å; E33-I36 VanDerWaalsContact O-N 3.12Å; E33-K54 VanDerWaalsContact O-CB 3.31Å; E33-K54 WeakPolarHBondContact O-CB 3.29Å
34	A	94.8	Very high	89.6	Confident	44 Å²	44	64.4 Å²	64.4	36%	0.364	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-61	-25.9	176.4	0	0	0	0	0	113.6	A32 I36 D53 G55	A32-A34 PolarHBondContact O-N 3.04Å; A32-A34 VanDerWaalsContact O-N 3.16Å; A34-I36 VanDerWaalsContact C-N 3.34Å; A34-D53 WeakPolarHBondContact O-CB 3.45Å; A34-D53 VanDerWaalsContact O-CG 3.27Å; A34-G55 WeakPolarHBondContact O-CA 3.38Å; A34-G55 PolarHBondContact O-N 2.75Å
35	D	94.8	Very high	89.8	Confident	56 Å²	56	64.5 Å²	64.5	30%	0.299	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-87.3	-2.9	179.4	-61.8	-34.6	0	0	0	113	A32 E33 I37 R57 N443	A32-D35 PolarHBondContact O-N 2.96Å; E33-D35 PolarHBondContact O-N 3.23Å; D35-I37 PolarHBondContact O-N 2.73Å; D35-R57 IonicContact OD1-CZ 3.44Å; D35-R57 IonicContact OD1-NH1 2.75Å; D35-R57 PolarHBondContact OD1-NH1 3.09Å; D35-R57 IonicContact OD1-NH2 3.94Å; D35-R57 PolarHBondContact OD1-NH2 2.89Å; D35-N443 HydrophobicContact CB-CB 4.17Å; D35-N443 WeakPolarHBondContact O-CA 3.37Å; D35-N443 WeakPolarHBondContact O-CB 3.49Å
36	I	96.6	Very high	90.2	Very high	40 Å²	40	62.4 Å²	62.4	21%	0.205	33%	0.334	C	S	.	.	S	Bend	trans	-69.5	122.1	178.2	-61.8	175.1	0	0	0	109.2	V31 E33 A34 S38 D53 K54 T442	V31-I36 HydrophobicContact CG1-CG1 4.21Å; E33-I36 HydrophobicContact CB-CD1 4.42Å; E33-I36 WeakPolarHBondContact O-CB 3.43Å; E33-I36 WeakPolarHBondContact O-CG1 3.2Å; E33-I36 PolarHBondContact O-N 3.2Å; E33-I36 VanDerWaalsContact O-N 3.12Å; A34-I36 VanDerWaalsContact C-N 3.34Å; I36-S38 PolarHBondContact O-N 3.03Å; I36-D53 CarbonylContact O-C 3.57Å; I36-D53 VanDerWaalsContact O-CA 3.26Å; I36-D53 WeakPolarHBondContact O-CA 3.3Å; I36-D53 WeakPolarHBondContact O-CB 3.37Å; I36-K54 HydrophobicContact CB-CD 4.08Å; I36-K54 HydrophobicContact CB-CG 4.1Å; I36-K54 HydrophobicContact CD1-CD 4.37Å; I36-K54 HydrophobicContact CG2-CD 4.42Å; I36-K54 HydrophobicContact CG2-CG 4.45Å; I36-K54 PolarHBondContact O-N 3.08Å; I36-T442 HydrophobicContact CD1-CG2 4.41Å; I36-T442 HydrophobicContact CG1-CG2 3.98Å
37	I	98.3	Very high	91	Very high	16 Å²	16	64.1 Å²	64.1	8%	0.082	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129	177.8	-61.9	170.4	0	0	0	109	D35 V40 T51 G52 A440 T442 L445	D35-I37 PolarHBondContact O-N 2.73Å; I37-V40 HydrophobicContact CG2-CG2 3.72Å; I37-T51 HydrophobicContact CG2-CG2 4.4Å; I37-G52 WeakPolarHBondContact CA-O 3.49Å; I37-A440 HydrophobicContact CB-CB 4.01Å; I37-A440 HydrophobicContact CD1-CB 4.38Å; I37-A440 HydrophobicContact CG2-CB 3.69Å; I37-T442 PolarHBondContact N-O 3.17Å; I37-L445 HydrophobicContact CD1-CB 3.84Å
38	S	98.3	Very high	92.2	Very high	5 Å²	5	57.6 Å²	57.6	4%	0.035	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-5.6	-175.8	56.1	0	0	0	0	114	I36 G52 D53 I102 H427	I36-S38 PolarHBondContact O-N 3.03Å; S38-G52 PolarHBondContact N-O 2.93Å; S38-G52 PolarHBondContact OG-O 2.95Å; S38-D53 VanDerWaalsContact OG-C 3.28Å; S38-D53 WeakPolarHBondContact OG-CA 3.23Å; S38-D53 PolarHBondContact OG-O 2.78Å; S38-I102 WeakPolarHBondContact CB-O 3.42Å; S38-I102 PolarHBondContact OG-O 2.98Å; S38-H427 PolarHBondContact O-CE1 3.49Å; S38-H427 PolarHBondContact O-ND1 3.08Å; S38-H427 PolarHBondContact O-NE2 2.75Å; S38-H427 VanDerWaalsContact O-NE2 3.16Å
39	T	98.7	Very high	93.6	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	148.7	171.3	-171.2	0	0	0	0	110.5	T51 G52 I102 I105	T39-T51 VanDerWaalsContact O-CA 3.29Å; T39-T51 WeakPolarHBondContact O-CA 3.34Å; T39-G52 PolarHBondContact N-O 2.84Å; T39-G52 PolarHBondContact O-N 3.3Å; T39-I102 HydrophobicContact CG2-CB 4.49Å; T39-I102 HydrophobicContact CG2-CG2 3.85Å; T39-I105 HydrophobicContact CG2-CB 4.29Å; T39-I105 HydrophobicContact CG2-CD1 3.79Å; T39-I105 HydrophobicContact CG2-CG1 3.75Å
40	V	98.6	Very high	95.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	130.2	179.7	-175.2	0	0	0	0	108.8	I37 L49 A50 T51 H427 A429 A438 A440 L445	I37-V40 HydrophobicContact CG2-CG2 3.72Å; V40-L49 HydrophobicContact CG1-CD1 3.67Å; V40-A50 WeakPolarHBondContact CA-O 3.26Å; V40-T51 HydrophobicContact CG1-CG2 4.33Å; V40-T51 HydrophobicContact CG2-CG2 4.15Å; V40-H427 HydrophobicContact CG2-CB 4.14Å; V40-A429 HydrophobicContact CB-CB 4.42Å; V40-A429 HydrophobicContact CG1-CB 3.92Å; V40-A438 HydrophobicContact CG1-CB 3.84Å; V40-A440 HydrophobicContact CG2-CB 3.79Å; V40-L445 HydrophobicContact CG1-CD1 4.06Å; V40-L445 HydrophobicContact CG2-CD1 4.1Å
41	E	98.6	Very high	96.1	Very high	45 Å²	45	35.6 Å²	35.6	21%	0.21	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	126.6	-175.7	-173.4	80	157	0	0	112.2	A50 I105 R106 W107	E41-A50 PolarHBondContact N-O 3.43Å; E41-A50 PolarHBondContact O-N 3.09Å; E41-I105 HydrophobicContact CB-CB 4.43Å; E41-I105 HydrophobicContact CB-CG2 4.39Å; E41-R106 WeakPolarHBondContact OE1-CD 3.24Å; E41-R106 IonicContact OE1-CZ 3.5Å; E41-R106 IonicContact OE1-NE 2.75Å; E41-R106 IonicContact OE1-NH1 3.43Å; E41-R106 PolarHBondContact OE1-NH1 3.02Å; E41-R106 IonicContact OE2-NH1 2.67Å; E41-R106 PolarHBondContact OE2-NH1 3.37Å; E41-W107 PolarHBondContact O-NE1 3.12Å
42	F	98.5	Very high	96.8	Very high	15 Å²	15	33.7 Å²	33.7	7%	0.066	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	146.6	167.5	-76.1	-78.2	0	0	0	111.3	L48 L49 Y77 W107 A429 W430 H431 V436 A438	F42-L48 WeakPolarHBondContact CA-O 3.5Å; F42-L49 HydrophobicContact CD1-CB 3.99Å; F42-L49 HydrophobicContact CD1-CD1 3.9Å; F42-L49 HydrophobicContact CD1-CG 4.46Å; F42-L49 HydrophobicContact CD2-CD1 4.04Å; F42-L49 HydrophobicContact CE1-CB 3.85Å; F42-L49 HydrophobicContact CE1-CD1 3.83Å; F42-L49 HydrophobicContact CE1-CD2 4.13Å; F42-L49 HydrophobicContact CE1-CG 4.15Å; F42-L49 HydrophobicContact CE2-CD1 3.97Å; F42-L49 HydrophobicContact CG-CD1 4Å; F42-L49 HydrophobicContact CZ-CD1 3.86Å; F42-L49 HydrophobicContact CZ-CD2 4.11Å; F42-L49 HydrophobicContact CZ-CG 4.41Å; F42-Y77 HydrophobicContact CD1-CE1 4.49Å; F42-Y77 AromaticContact CE1-CE1 3.88Å; F42-Y77 HydrophobicContact CE1-CE1 3.88Å; F42-Y77 AromaticContact CE1-CZ 3.73Å; F42-W107 VanDerWaalsContact C-CD1 3.46Å; F42-A429 HydrophobicContact CD2-CB 3.76Å; F42-A429 HydrophobicContact CE2-CB 4Å; F42-W430 WeakPolarHBondContact CD2-O 3.49Å; F42-H431 HydrophobicContact CD2-CB 4.48Å; F42-H431 HydrophobicContact CE1-CB 4.5Å; F42-H431 HydrophobicContact CE2-CB 4.29Å; F42-H431 HydrophobicContact CZ-CB 4.3Å; F42-V436 HydrophobicContact CZ-CG1 4.37Å; F42-A438 HydrophobicContact CE2-CB 3.97Å; F42-A438 HydrophobicContact CZ-CB 4.09Å
43	N	97.7	Very high	97.1	Very high	9 Å²	9	31.6 Å²	31.6	5%	0.048	16%	0.163	C	C	.	.			trans	-71	170.8	165	78.7	-27.1	0	0	0	110.8	S45 G46 D47 L48 W107	N43-S45 VanDerWaalsContact C-N 3.26Å; N43-S45 PolarHBondContact ND2-OG 3.12Å; N43-S45 PolarHBondContact O-N 2.88Å; N43-S45 PolarHBondContact OD1-OG 2.73Å; N43-G46 PolarHBondContact O-N 3.14Å; N43-G46 VanDerWaalsContact OD1-CA 3.3Å; N43-G46 WeakPolarHBondContact OD1-CA 3.4Å; N43-G46 PolarHBondContact OD1-N 2.78Å; N43-D47 PolarHBondContact OD1-N 2.86Å; N43-D47 VanDerWaalsContact OD1-N 3.14Å; N43-L48 HydrophobicContact CB-CB 4.06Å; N43-L48 PolarHBondContact N-O 3.49Å; N43-L48 PolarHBondContact OD1-N 3.25Å; N43-L48 PolarHBondContact OD1-O 2.87Å; N43-W107 VanDerWaalsContact CA-CD1 3.42Å; N43-W107 HydrophobicContact CB-CB 4.3Å; N43-W107 HydrophobicContact CB-CD2 3.58Å; N43-W107 HydrophobicContact CB-CE3 4.05Å; N43-W107 HydrophobicContact CB-CG 3.7Å; N43-W107 HydrophobicContact CB-CZ2 4.27Å
44	Y	95.7	Very high	97.4	Very high	136 Å²	136	28.5 Å²	28.5	53%	0.533	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.1	-177.3	-70.7	-89.6	0	0	0	114.8	W107 L108 P109 P432	Y44-W107 HydrophobicContact CD2-CB 4.24Å; Y44-W107 HydrophobicContact CE2-CB 4.18Å; Y44-W107 WeakPolarHBondContact CE2-O 3.28Å; Y44-L108 VanDerWaalsContact CE2-C 3.5Å; Y44-P109 HydrophobicContact CD2-CG 4.36Å; Y44-P109 HydrophobicContact CE1-CG 4.34Å; Y44-P109 HydrophobicContact CE2-CB 4.43Å; Y44-P109 HydrophobicContact CE2-CG 3.75Å; Y44-P432 WeakPolarHBondContact O-CG 3.29Å
45	S	94.8	Very high	97.5	Very high	49 Å²	49	26.9 Å²	26.9	34%	0.343	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-23.3	175.6	68.9	0	0	0	0	113.1	N43 D47 H431	N43-S45 VanDerWaalsContact C-N 3.26Å; N43-S45 PolarHBondContact ND2-OG 3.12Å; N43-S45 PolarHBondContact O-N 2.88Å; N43-S45 PolarHBondContact OD1-OG 2.73Å; S45-D47 VanDerWaalsContact C-N 3.25Å; S45-D47 VanDerWaalsContact CB-OD2 3.24Å; S45-D47 WeakPolarHBondContact CB-OD2 3.29Å; S45-D47 WeakPolarHBondContact OG-CB 3.49Å; S45-D47 VanDerWaalsContact OG-CG 3.28Å; S45-D47 PolarHBondContact OG-N 3.03Å; S45-D47 PolarHBondContact OG-OD2 2.66Å; S45-H431 PolarHBondContact O-CE1 3.15Å
46	G	95.8	Very high	97.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	79.9	-1.6	-169.7	0	0	0	0	0	114.4	N43 L48 Y77 H431	N43-G46 PolarHBondContact O-N 3.14Å; N43-G46 VanDerWaalsContact OD1-CA 3.3Å; N43-G46 WeakPolarHBondContact OD1-CA 3.4Å; N43-G46 PolarHBondContact OD1-N 2.78Å; G46-L48 VanDerWaalsContact C-N 3.26Å; G46-L48 PolarHBondContact O-N 3.01Å; G46-Y77 WeakPolarHBondContact O-CE1 3.34Å; G46-Y77 PolarHBondContact O-OH 3.24Å; G46-H431 PolarHBondContact O-NE2 2.91Å
47	D	95.3	Very high	97.8	Very high	81 Å²	81	26.1 Å²	26.1	43%	0.433	13%	0.125	S	C	.	.	S	Bend	trans	-70.1	-25.5	176.7	-60.2	-49.8	0	0	0	112.5	N43 S45 Q62 R63	N43-D47 PolarHBondContact OD1-N 2.86Å; N43-D47 VanDerWaalsContact OD1-N 3.14Å; S45-D47 VanDerWaalsContact C-N 3.25Å; S45-D47 VanDerWaalsContact CB-OD2 3.24Å; S45-D47 WeakPolarHBondContact CB-OD2 3.29Å; S45-D47 WeakPolarHBondContact OG-CB 3.49Å; S45-D47 VanDerWaalsContact OG-CG 3.28Å; S45-D47 PolarHBondContact OG-N 3.03Å; S45-D47 PolarHBondContact OG-OD2 2.66Å; D47-Q62 CarbonylContact O-C 3.57Å; D47-Q62 WeakPolarHBondContact O-CA 3.41Å; D47-R63 PolarHBondContact O-N 2.73Å
48	L	97.7	Very high	97.8	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.4	176.6	-56.6	179.5	0	0	0	110.5	F42 N43 G46 I60 F61 Q62 Y80 W107 H115	F42-L48 WeakPolarHBondContact CA-O 3.5Å; N43-L48 HydrophobicContact CB-CB 4.06Å; N43-L48 PolarHBondContact N-O 3.49Å; N43-L48 PolarHBondContact OD1-N 3.25Å; N43-L48 PolarHBondContact OD1-O 2.87Å; G46-L48 VanDerWaalsContact C-N 3.26Å; G46-L48 PolarHBondContact O-N 3.01Å; L48-I60 HydrophobicContact CB-CG2 4.19Å; L48-I60 HydrophobicContact CD1-CG2 4.46Å; L48-I60 HydrophobicContact CD2-CG2 4.2Å; L48-F61 CarbonylContact C-O 3.57Å; L48-F61 VanDerWaalsContact CA-O 3.27Å; L48-F61 WeakPolarHBondContact CA-O 3.46Å; L48-Q62 HydrophobicContact CD2-CB 3.66Å; L48-Q62 HydrophobicContact CD2-CG 3.8Å; L48-Y80 HydrophobicContact CD2-CD1 4.09Å; L48-Y80 HydrophobicContact CD2-CE1 4.33Å; L48-Y80 HydrophobicContact CD2-CG 4.47Å; L48-W107 HydrophobicContact CB-CH2 3.95Å; L48-W107 HydrophobicContact CB-CZ2 3.9Å; L48-W107 HydrophobicContact CD1-CH2 3.67Å; L48-W107 HydrophobicContact CD1-CZ2 4.45Å; L48-W107 HydrophobicContact CD1-CZ3 3.98Å; L48-W107 HydrophobicContact CG-CH2 4.47Å; L48-H115 HydrophobicContact CD1-CB 4.25Å
49	L	98.6	Very high	97.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	121.2	173.7	175.5	59.6	0	0	0	108.2	V40 F42 I60 F61 Y77 A438 L445 I447	V40-L49 HydrophobicContact CG1-CD1 3.67Å; F42-L49 HydrophobicContact CD1-CB 3.99Å; F42-L49 HydrophobicContact CD1-CD1 3.9Å; F42-L49 HydrophobicContact CD1-CG 4.46Å; F42-L49 HydrophobicContact CD2-CD1 4.04Å; F42-L49 HydrophobicContact CE1-CB 3.85Å; F42-L49 HydrophobicContact CE1-CD1 3.83Å; F42-L49 HydrophobicContact CE1-CD2 4.13Å; F42-L49 HydrophobicContact CE1-CG 4.15Å; F42-L49 HydrophobicContact CE2-CD1 3.97Å; F42-L49 HydrophobicContact CG-CD1 4Å; F42-L49 HydrophobicContact CZ-CD1 3.86Å; F42-L49 HydrophobicContact CZ-CD2 4.11Å; F42-L49 HydrophobicContact CZ-CG 4.41Å; L49-I60 CarbonylContact O-C 3.6Å; L49-I60 WeakPolarHBondContact O-CA 3.35Å; L49-F61 HydrophobicContact CB-CB 4.4Å; L49-F61 PolarHBondContact N-O 3.02Å; L49-F61 WeakPolarHBondContact O-CD2 3.32Å; L49-F61 PolarHBondContact O-N 2.67Å; L49-Y77 HydrophobicContact CB-CD1 3.89Å; L49-Y77 HydrophobicContact CB-CE1 4.02Å; L49-A438 HydrophobicContact CD1-CB 4.02Å; L49-A438 HydrophobicContact CD2-CB 3.8Å; L49-L445 HydrophobicContact CD2-CD2 3.92Å; L49-I447 HydrophobicContact CD2-CD1 4.18Å
50	A	98.7	Very high	97.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.7	176	0	0	0	0	0	111.1	V40 E41 V59 I60 I105 W107	V40-A50 WeakPolarHBondContact CA-O 3.26Å; E41-A50 PolarHBondContact N-O 3.43Å; E41-A50 PolarHBondContact O-N 3.09Å; A50-V59 CarbonylContact C-O 3.56Å; A50-V59 WeakPolarHBondContact CA-O 3.33Å; A50-I60 HydrophobicContact CB-CG1 4.37Å; A50-I105 HydrophobicContact CB-CD1 4.13Å; A50-I105 HydrophobicContact CB-CG2 4.13Å; A50-W107 HydrophobicContact CB-CZ2 3.72Å
51	T	98.8	Very high	97.8	Very high	10 Å²	10	26.7 Å²	26.7	6%	0.061	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.3	165.9	60.3	0	0	0	0	110.1	I37 T39 V40 V58 V59 F61 L445	I37-T51 HydrophobicContact CG2-CG2 4.4Å; T39-T51 VanDerWaalsContact O-CA 3.29Å; T39-T51 WeakPolarHBondContact O-CA 3.34Å; V40-T51 HydrophobicContact CG1-CG2 4.33Å; V40-T51 HydrophobicContact CG2-CG2 4.15Å; T51-V58 WeakPolarHBondContact O-CA 3.46Å; T51-V59 PolarHBondContact N-O 2.8Å; T51-V59 PolarHBondContact O-N 2.87Å; T51-F61 HydrophobicContact CG2-CE2 4.13Å; T51-L445 HydrophobicContact CG2-CD1 3.97Å; T51-L445 HydrophobicContact CG2-CD2 3.7Å; T51-L445 HydrophobicContact CG2-CG 4.37Å
52	G	98.7	Very high	97.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.5	165.4	0	0	0	0	0	110.2	I37 S38 T39 R57	I37-G52 WeakPolarHBondContact CA-O 3.49Å; S38-G52 PolarHBondContact N-O 2.93Å; S38-G52 PolarHBondContact OG-O 2.95Å; T39-G52 PolarHBondContact N-O 2.84Å; T39-G52 PolarHBondContact O-N 3.3Å; G52-R57 WeakPolarHBondContact CA-O 3.13Å
53	D	98.3	Very high	97.5	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.043	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	172.6	177.6	63.4	29.4	0	0	0	113.4	A34 I36 S38 G55 G56 R57 I102	A34-D53 WeakPolarHBondContact O-CB 3.45Å; A34-D53 VanDerWaalsContact O-CG 3.27Å; I36-D53 CarbonylContact O-C 3.57Å; I36-D53 VanDerWaalsContact O-CA 3.26Å; I36-D53 WeakPolarHBondContact O-CA 3.3Å; I36-D53 WeakPolarHBondContact O-CB 3.37Å; S38-D53 VanDerWaalsContact OG-C 3.28Å; S38-D53 WeakPolarHBondContact OG-CA 3.23Å; S38-D53 PolarHBondContact OG-O 2.78Å; D53-G55 PolarHBondContact O-N 2.91Å; D53-G55 VanDerWaalsContact OD1-C 3.24Å; D53-G55 WeakPolarHBondContact OD1-CA 3.35Å; D53-G55 PolarHBondContact OD1-N 3.26Å; D53-G55 VanDerWaalsContact OD1-N 3.1Å; D53-G56 PolarHBondContact O-N 3.33Å; D53-G56 PolarHBondContact OD1-N 2.99Å; D53-R57 PolarHBondContact N-O 2.74Å; D53-R57 PolarHBondContact OD1-N 3.05Å; D53-R57 IonicContact OD1-NE 2.71Å; D53-R57 WeakPolarHBondContact OD2-CB 3.39Å; D53-R57 IonicContact OD2-CZ 3.16Å; D53-R57 IonicContact OD2-NE 3.78Å; D53-R57 PolarHBondContact OD2-NE 3.4Å; D53-R57 IonicContact OD2-NH2 2.74Å; D53-R57 PolarHBondContact OD2-NH2 2.99Å; D53-I102 PolarHBondContact O-N 3.35Å
54	K	98.1	Very high	97.1	Very high	81 Å²	81	32.8 Å²	32.8	35%	0.352	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-26	176.1	-71.8	-162.9	174.4	-173	0	113.3	E33 I36 G56 K101	E33-K54 VanDerWaalsContact O-CB 3.31Å; E33-K54 WeakPolarHBondContact O-CB 3.29Å; I36-K54 HydrophobicContact CB-CD 4.08Å; I36-K54 HydrophobicContact CB-CG 4.1Å; I36-K54 HydrophobicContact CD1-CD 4.37Å; I36-K54 HydrophobicContact CG2-CD 4.42Å; I36-K54 HydrophobicContact CG2-CG 4.45Å; I36-K54 PolarHBondContact O-N 3.08Å; K54-G56 PolarHBondContact O-N 2.91Å; K54-K101 HydrophobicContact CG-CD 4.11Å; K54-K101 HydrophobicContact CG-CG 4.3Å; K54-K101 VanDerWaalsContact O-CA 3.29Å; K54-K101 WeakPolarHBondContact O-CA 3.39Å; K54-K101 PolarHBondContact O-N 2.75Å
55	G	98.1	Very high	96.3	Very high	9 Å²	9	34.4 Å²	34.4	9%	0.093	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	11.8	176.3	0	0	0	0	0	114.3	A34 D53 R57 Q84 E100	A34-G55 WeakPolarHBondContact O-CA 3.38Å; A34-G55 PolarHBondContact O-N 2.75Å; D53-G55 PolarHBondContact O-N 2.91Å; D53-G55 VanDerWaalsContact OD1-C 3.24Å; D53-G55 WeakPolarHBondContact OD1-CA 3.35Å; D53-G55 PolarHBondContact OD1-N 3.26Å; D53-G55 VanDerWaalsContact OD1-N 3.1Å; G55-R57 VanDerWaalsContact C-N 3.32Å; G55-R57 PolarHBondContact O-N 3.16Å; G55-Q84 PolarHBondContact O-NE2 3.03Å; G55-E100 VanDerWaalsContact C-CG 3.4Å
56	G	98.4	Very high	94.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	75.7	11.9	173.8	0	0	0	0	0	115.8	D53 K54 Q84 S85 H86 E100	D53-G56 PolarHBondContact O-N 3.33Å; D53-G56 PolarHBondContact OD1-N 2.99Å; K54-G56 PolarHBondContact O-N 2.91Å; G56-Q84 PolarHBondContact O-NE2 3.02Å; G56-S85 WeakPolarHBondContact O-CA 3.29Å; G56-S85 WeakPolarHBondContact O-CB 3.32Å; G56-S85 PolarHBondContact O-N 2.85Å; G56-H86 PolarHBondContact O-N 2.85Å; G56-E100 WeakPolarHBondContact CA-O 3.29Å
57	R	98.6	Very high	93.1	Very high	81 Å²	81	42.5 Å²	42.5	31%	0.306	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	150.1	178.2	-53.9	170.4	-55.2	-169.1	6.2	110.5	D35 G52 D53 G55 F83 Q84	D35-R57 IonicContact OD1-CZ 3.44Å; D35-R57 IonicContact OD1-NH1 2.75Å; D35-R57 PolarHBondContact OD1-NH1 3.09Å; D35-R57 IonicContact OD1-NH2 3.94Å; D35-R57 PolarHBondContact OD1-NH2 2.89Å; G52-R57 WeakPolarHBondContact CA-O 3.13Å; D53-R57 PolarHBondContact N-O 2.74Å; D53-R57 PolarHBondContact OD1-N 3.05Å; D53-R57 IonicContact OD1-NE 2.71Å; D53-R57 WeakPolarHBondContact OD2-CB 3.39Å; D53-R57 IonicContact OD2-CZ 3.16Å; D53-R57 IonicContact OD2-NE 3.78Å; D53-R57 PolarHBondContact OD2-NE 3.4Å; D53-R57 IonicContact OD2-NH2 2.74Å; D53-R57 PolarHBondContact OD2-NH2 2.99Å; G55-R57 VanDerWaalsContact C-N 3.32Å; G55-R57 PolarHBondContact O-N 3.16Å; R57-F83 WeakPolarHBondContact CA-O 3.41Å; R57-Q84 VanDerWaalsContact CG-OE1 3.27Å
58	V	98.8	Very high	91.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	128	169.3	174.3	0	0	0	0	108.5	T51 I60 T82 F83 I102 I105	T51-V58 WeakPolarHBondContact O-CA 3.46Å; V58-I60 HydrophobicContact CG1-CG1 4.19Å; V58-T82 WeakPolarHBondContact O-CA 3.22Å; V58-F83 HydrophobicContact CB-CD2 4.32Å; V58-F83 HydrophobicContact CB-CE1 4.02Å; V58-F83 HydrophobicContact CB-CE2 3.74Å; V58-F83 HydrophobicContact CB-CZ 3.58Å; V58-F83 HydrophobicContact CG1-CE1 3.86Å; V58-F83 HydrophobicContact CG1-CE2 4.24Å; V58-F83 HydrophobicContact CG1-CZ 3.57Å; V58-F83 HydrophobicContact CG2-CE2 4.15Å; V58-F83 HydrophobicContact CG2-CZ 4.28Å; V58-F83 PolarHBondContact N-O 2.96Å; V58-F83 PolarHBondContact O-N 2.67Å; V58-I102 HydrophobicContact CG2-CG1 4.41Å; V58-I105 HydrophobicContact CG1-CD1 4.04Å; V58-I105 HydrophobicContact CG2-CD1 4.01Å
59	V	98.6	Very high	89.3	Confident	24 Å²	24	53 Å²	53	15%	0.145	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.3	174.7	-172.8	0	0	0	0	108.2	A50 T51 F61 V79 T82	A50-V59 CarbonylContact C-O 3.56Å; A50-V59 WeakPolarHBondContact CA-O 3.33Å; T51-V59 PolarHBondContact N-O 2.8Å; T51-V59 PolarHBondContact O-N 2.87Å; V59-F61 HydrophobicContact CB-CE2 4.17Å; V59-F61 HydrophobicContact CB-CZ 4.31Å; V59-F61 HydrophobicContact CG1-CD2 4.39Å; V59-F61 HydrophobicContact CG1-CE1 4.05Å; V59-F61 HydrophobicContact CG1-CE2 3.73Å; V59-F61 HydrophobicContact CG1-CZ 3.53Å; V59-V79 HydrophobicContact CG1-CG1 4.38Å; V59-T82 HydrophobicContact CG2-CG2 4.11Å
60	I	98.6	Very high	87.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.9	176.8	-56.8	171.6	0	0	0	107.6	L48 L49 A50 V58 Y80 S81 F83 W107 L117 I130	L48-I60 HydrophobicContact CB-CG2 4.19Å; L48-I60 HydrophobicContact CD1-CG2 4.46Å; L48-I60 HydrophobicContact CD2-CG2 4.2Å; L49-I60 CarbonylContact O-C 3.6Å; L49-I60 WeakPolarHBondContact O-CA 3.35Å; A50-I60 HydrophobicContact CB-CG1 4.37Å; V58-I60 HydrophobicContact CG1-CG1 4.19Å; I60-Y80 HydrophobicContact CB-CD1 4.42Å; I60-Y80 HydrophobicContact CG2-CD1 3.87Å; I60-Y80 WeakPolarHBondContact O-CA 3.15Å; I60-Y80 WeakPolarHBondContact O-CB 3.47Å; I60-Y80 PolarHBondContact O-N 2.89Å; I60-S81 PolarHBondContact N-O 2.85Å; I60-S81 PolarHBondContact O-N 2.83Å; I60-S81 VanDerWaalsContact O-N 3.13Å; I60-F83 HydrophobicContact CD1-CE1 3.89Å; I60-F83 HydrophobicContact CG1-CE1 4.44Å; I60-W107 HydrophobicContact CD1-CH2 3.93Å; I60-W107 HydrophobicContact CG1-CH2 4.31Å; I60-W107 HydrophobicContact CG2-CH2 3.98Å; I60-W107 HydrophobicContact CG2-CZ2 4.23Å; I60-L117 HydrophobicContact CD1-CD2 3.88Å; I60-L117 HydrophobicContact CG1-CD2 4.47Å; I60-I130 HydrophobicContact CD1-CD1 4.25Å; I60-I130 HydrophobicContact CD1-CG1 3.59Å; I60-I130 HydrophobicContact CD1-CG2 4.45Å
61	F	98.1	Very high	84.9	Confident	11 Å²	11	65.4 Å²	65.4	5%	0.048	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.7	172.7	-52.6	-92.9	0	0	0	109.7	K24 L48 L49 T51 V59 Y77 N78 V79 L445	K24-F61 HydrophobicContact CB-CE1 4.3Å; K24-F61 HydrophobicContact CB-CZ 4.34Å; K24-F61 HydrophobicContact CD-CE1 4.32Å; K24-F61 HydrophobicContact CG-CD1 4.5Å; K24-F61 HydrophobicContact CG-CE1 3.85Å; K24-F61 HydrophobicContact CG-CZ 4.24Å; L48-F61 CarbonylContact C-O 3.57Å; L48-F61 VanDerWaalsContact CA-O 3.27Å; L48-F61 WeakPolarHBondContact CA-O 3.46Å; L49-F61 HydrophobicContact CB-CB 4.4Å; L49-F61 PolarHBondContact N-O 3.02Å; L49-F61 WeakPolarHBondContact O-CD2 3.32Å; L49-F61 PolarHBondContact O-N 2.67Å; T51-F61 HydrophobicContact CG2-CE2 4.13Å; V59-F61 HydrophobicContact CB-CE2 4.17Å; V59-F61 HydrophobicContact CB-CZ 4.31Å; V59-F61 HydrophobicContact CG1-CD2 4.39Å; V59-F61 HydrophobicContact CG1-CE1 4.05Å; V59-F61 HydrophobicContact CG1-CE2 3.73Å; V59-F61 HydrophobicContact CG1-CZ 3.53Å; F61-Y77 HydrophobicContact CB-CD1 4.29Å; F61-N78 CarbonylContact C-O 3.56Å; F61-N78 WeakPolarHBondContact CA-O 3.33Å; F61-V79 HydrophobicContact CD1-CG2 3.97Å; F61-V79 HydrophobicContact CE1-CG2 3.66Å; F61-L445 HydrophobicContact CD2-CD2 4.08Å; F61-L445 HydrophobicContact CE2-CD2 3.67Å; F61-L445 HydrophobicContact CZ-CD2 4.16Å
62	Q	96.4	Very high	82.7	Confident	64 Å²	64	71.5 Å²	71.5	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.5	173.7	-177.3	179	49.7	0	0	109.7	D47 L48 Y77 N78 Y80	D47-Q62 CarbonylContact O-C 3.57Å; D47-Q62 WeakPolarHBondContact O-CA 3.41Å; L48-Q62 HydrophobicContact CD2-CB 3.66Å; L48-Q62 HydrophobicContact CD2-CG 3.8Å; Q62-Y77 WeakPolarHBondContact O-CA 3.24Å; Q62-N78 PolarHBondContact N-O 3.22Å; Q62-N78 PolarHBondContact O-N 3.19Å; Q62-Y80 HydrophobicContact CB-CD2 3.84Å; Q62-Y80 HydrophobicContact CB-CG 3.8Å; Q62-Y80 HydrophobicContact CG-CD2 4.38Å; Q62-Y80 VanDerWaalsContact OE1-CD2 3.25Å
63	R	94.3	Very high	80.7	Confident	32 Å²	32	73 Å²	73	12%	0.121	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	127.8	172.7	-170.2	176.3	175.2	172.9	-7.8	109.6	D47 Q65 Y77 H431 D434	D47-R63 PolarHBondContact O-N 2.73Å; R63-Q65 PolarHBondContact O-N 3.12Å; R63-Y77 HydrophobicContact CB-CD1 4.08Å; R63-Y77 HydrophobicContact CB-CE1 3.7Å; R63-Y77 HydrophobicContact CB-CE2 4.19Å; R63-Y77 HydrophobicContact CB-CG 4.48Å; R63-Y77 HydrophobicContact CG-CE1 4.44Å; R63-Y77 HydrophobicContact CG-CE2 4.05Å; R63-H431 PolarHBondContact NH1-NE2 2.78Å; R63-H431 VanDerWaalsContact NH1-NE2 3.17Å; R63-D434 IonicContact CZ-OD2 2.82Å; R63-D434 IonicContact NH1-OD2 3.76Å; R63-D434 PolarHBondContact NH1-OD2 3.38Å; R63-D434 IonicContact NH2-OD2 3.59Å; R63-D434 PolarHBondContact NH2-OD2 3.03Å
64	E	89.6	Confident	79.5	Confident	102 Å²	102	74.5 Å²	74.5	48%	0.477	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-61.4	132.1	172.2	-168.3	178.8	-165.6	0	0	110	G75 E76	E64-G75 WeakPolarHBondContact O-CA 3.41Å; E64-E76 PolarHBondContact N-O 2.85Å
65	Q	79	Confident	78.8	Confident	169 Å²	169	71 Å²	71	79%	0.79	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-67.2	144.3	177.4	-66.5	-175.6	13.3	0	0	110.6	R63 N67	R63-Q65 PolarHBondContact O-N 3.12Å; Q65-N67 PolarHBondContact O-N 2.73Å
66	E	64.4	Low	78.4	Confident	119 Å²	119	75 Å²	75	56%	0.556	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-58.8	116	178.5	-79.2	-169.3	165.8	0	0	111.1
67	N	58	Low	78.3	Confident	100 Å²	100	75.1 Å²	75.1	54%	0.535	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-75.4	130.8	171.8	-110.8	-37.1	0	0	0	109.4	Q65 S69 R70	Q65-N67 PolarHBondContact O-N 2.73Å; N67-S69 PolarHBondContact O-N 2.87Å; N67-R70 PolarHBondContact O-N 2.81Å
68	K	56.7	Low	78.2	Confident	209 Å²	209	74.6 Å²	74.6	91%	0.909	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-18.1	177.4	-69.3	-176.8	179	178.2	0	114.1
69	S	57.2	Low	78.1	Confident	95 Å²	95	79.2 Å²	79.2	66%	0.664	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.2	177.4	61	0	0	0	0	114.8	N67	N67-S69 PolarHBondContact O-N 2.87Å
70	R	55.6	Low	78	Confident	174 Å²	174	79.2 Å²	79.2	66%	0.657	39%	0.39	S	S	*	.			trans	-135.2	68	-179.9	-67	-173.8	179.7	179.4	2	112.3	N67 H72 S73	N67-R70 PolarHBondContact O-N 2.81Å; R70-H72 PolarHBondContact O-N 2.88Å; R70-S73 PolarHBondContact O-N 2.86Å
71	P	49	Very low	77.9	Confident	86 Å²	86	79.8 Å²	79.8	56%	0.558	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	6.9	-174.8	25.2	-32.8	0	0	0	116.1
72	H	51.7	Low	77.9	Confident	138 Å²	138	83.2 Å²	83.2	64%	0.639	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	15.9	-179	-58.1	79.4	0	0	0	112.7	R70	R70-H72 PolarHBondContact O-N 2.88Å
73	S	57.9	Low	78	Confident	31 Å²	31	81.2 Å²	81.2	22%	0.217	41%	0.406	C	S	.	.			trans	-112.9	108.7	176.4	-164	0	0	0	0	108.5	R70 G75	R70-S73 PolarHBondContact O-N 2.86Å; S73-G75 PolarHBondContact O-N 3.02Å
74	R	73.3	Confident	78.2	Confident	39 Å²	39	83.6 Å²	83.6	15%	0.147	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-56.8	130.2	163.2	-71.2	-174.1	174.1	178	-0.2	107.8	N435 I452	R74-N435 VanDerWaalsContact NH1-C 3.27Å; R74-N435 PolarHBondContact NH1-O 2.94Å; R74-I452 HydrophobicContact CG-CD1 3.66Å
75	G	81.8	Confident	78.6	Confident	7 Å²	7	78.8 Å²	78.8	7%	0.072	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-56.4	144.9	-177.6	0	0	0	0	0	112.7	E64 S73	E64-G75 WeakPolarHBondContact O-CA 3.41Å; S73-G75 PolarHBondContact O-N 3.02Å
76	E	91.2	Very high	79.5	Confident	95 Å²	95	70.8 Å²	70.8	44%	0.444	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-76.7	143	173.9	-82.4	-165.3	-147.9	0	0	110.7	Q22 E64	Q22-E76 HydrophobicContact CG-CG 4.14Å; Q22-E76 PolarHBondContact NE2-OE2 2.87Å; E64-E76 PolarHBondContact N-O 2.85Å
77	Y	95.6	Very high	81.1	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.008	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	118.8	172.4	-74.7	-96.6	0	0	0	109.5	Q22 K24 F42 G46 L49 F61 Q62 R63 H431 V436 I447	Q22-Y77 PolarHBondContact NE2-O 3.38Å; K24-Y77 WeakPolarHBondContact CE-O 3.38Å; K24-Y77 PolarHBondContact NZ-O 3.09Å; F42-Y77 HydrophobicContact CD1-CE1 4.49Å; F42-Y77 AromaticContact CE1-CE1 3.88Å; F42-Y77 HydrophobicContact CE1-CE1 3.88Å; F42-Y77 AromaticContact CE1-CZ 3.73Å; G46-Y77 WeakPolarHBondContact O-CE1 3.34Å; G46-Y77 PolarHBondContact O-OH 3.24Å; L49-Y77 HydrophobicContact CB-CD1 3.89Å; L49-Y77 HydrophobicContact CB-CE1 4.02Å; F61-Y77 HydrophobicContact CB-CD1 4.29Å; Q62-Y77 WeakPolarHBondContact O-CA 3.24Å; R63-Y77 HydrophobicContact CB-CD1 4.08Å; R63-Y77 HydrophobicContact CB-CE1 3.7Å; R63-Y77 HydrophobicContact CB-CE2 4.19Å; R63-Y77 HydrophobicContact CB-CG 4.48Å; R63-Y77 HydrophobicContact CG-CE1 4.44Å; R63-Y77 HydrophobicContact CG-CE2 4.05Å; Y77-H431 PolarHBondContact OH-CD2 3.3Å; Y77-H431 VanDerWaalsContact OH-CD2 3.26Å; Y77-V436 HydrophobicContact CE2-CG1 4.22Å; Y77-I447 HydrophobicContact CD2-CD1 3.93Å; Y77-I447 HydrophobicContact CD2-CG2 4.48Å; Y77-I447 HydrophobicContact CG-CD1 4.01Å
78	N	95.8	Very high	82.9	Confident	69 Å²	69	70 Å²	70	37%	0.369	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	151.1	-178.4	-68.3	-47.1	0	0	0	110.8	F61 Q62 Y80	F61-N78 CarbonylContact C-O 3.56Å; F61-N78 WeakPolarHBondContact CA-O 3.33Å; Q62-N78 PolarHBondContact N-O 3.22Å; Q62-N78 PolarHBondContact O-N 3.19Å; N78-Y80 PolarHBondContact O-N 3.5Å; N78-Y80 VanDerWaalsContact O-N 3.14Å
79	V	96.4	Very high	84.7	Confident	97 Å²	97	63.9 Å²	63.9	59%	0.588	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	122.3	-178.9	179.4	0	0	0	0	109	V59 F61	V59-V79 HydrophobicContact CG1-CG1 4.38Å; F61-V79 HydrophobicContact CD1-CG2 3.97Å; F61-V79 HydrophobicContact CE1-CG2 3.66Å
80	Y	96.5	Very high	86.3	Confident	25 Å²	25	63.8 Å²	63.8	10%	0.098	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-39.8	-177.7	175.7	-109.9	0	0	0	111.3	L48 I60 Q62 N78 I130 E132 V170	L48-Y80 HydrophobicContact CD2-CD1 4.09Å; L48-Y80 HydrophobicContact CD2-CE1 4.33Å; L48-Y80 HydrophobicContact CD2-CG 4.47Å; I60-Y80 HydrophobicContact CB-CD1 4.42Å; I60-Y80 HydrophobicContact CG2-CD1 3.87Å; I60-Y80 WeakPolarHBondContact O-CA 3.15Å; I60-Y80 WeakPolarHBondContact O-CB 3.47Å; I60-Y80 PolarHBondContact O-N 2.89Å; Q62-Y80 HydrophobicContact CB-CD2 3.84Å; Q62-Y80 HydrophobicContact CB-CG 3.8Å; Q62-Y80 HydrophobicContact CG-CD2 4.38Å; Q62-Y80 VanDerWaalsContact OE1-CD2 3.25Å; N78-Y80 PolarHBondContact O-N 3.5Å; N78-Y80 VanDerWaalsContact O-N 3.14Å; Y80-I130 HydrophobicContact CD1-CG2 4.47Å; Y80-I130 HydrophobicContact CE1-CG2 3.73Å; Y80-E132 HydrophobicContact CE2-CG 4.41Å; Y80-E132 WeakPolarHBondContact CE2-OE1 3.41Å; Y80-E132 WeakPolarHBondContact OH-CG 3.24Å; Y80-E132 PolarHBondContact OH-OE1 2.81Å; Y80-V170 HydrophobicContact CD1-CG1 4.13Å; Y80-V170 HydrophobicContact CD2-CG2 3.87Å; Y80-V170 HydrophobicContact CE1-CG1 3.64Å; Y80-V170 HydrophobicContact CE1-CG2 4.38Å; Y80-V170 HydrophobicContact CE2-CB 4.45Å; Y80-V170 HydrophobicContact CE2-CG1 4.2Å; Y80-V170 HydrophobicContact CE2-CG2 3.4Å
81	S	97.3	Very high	87.7	Confident	11 Å²	11	57.5 Å²	57.5	8%	0.077	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	145.3	174.5	-166.8	0	0	0	0	111	I60	I60-S81 PolarHBondContact N-O 2.85Å; I60-S81 PolarHBondContact O-N 2.83Å; I60-S81 VanDerWaalsContact O-N 3.13Å
82	T	97.9	Very high	89.5	Confident	84 Å²	84	62.3 Å²	62.3	52%	0.515	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132	171.6	-59.1	0	0	0	0	108.5	V58 V59	V58-T82 WeakPolarHBondContact O-CA 3.22Å; V59-T82 HydrophobicContact CG2-CG2 4.11Å
83	F	98.5	Very high	91.1	Very high	22 Å²	22	63.9 Å²	63.9	10%	0.096	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152.2	177.3	57.8	-87	0	0	0	111.8	R57 V58 I60 S85 W128 A172	R57-F83 WeakPolarHBondContact CA-O 3.41Å; V58-F83 HydrophobicContact CB-CD2 4.32Å; V58-F83 HydrophobicContact CB-CE1 4.02Å; V58-F83 HydrophobicContact CB-CE2 3.74Å; V58-F83 HydrophobicContact CB-CZ 3.58Å; V58-F83 HydrophobicContact CG1-CE1 3.86Å; V58-F83 HydrophobicContact CG1-CE2 4.24Å; V58-F83 HydrophobicContact CG1-CZ 3.57Å; V58-F83 HydrophobicContact CG2-CE2 4.15Å; V58-F83 HydrophobicContact CG2-CZ 4.28Å; V58-F83 PolarHBondContact N-O 2.96Å; V58-F83 PolarHBondContact O-N 2.67Å; I60-F83 HydrophobicContact CD1-CE1 3.89Å; I60-F83 HydrophobicContact CG1-CE1 4.44Å; F83-S85 PolarHBondContact O-N 3.37Å; F83-W128 AromaticContact CD2-CD2 3.88Å; F83-W128 HydrophobicContact CD2-CD2 3.88Å; F83-W128 AromaticContact CD2-CE3 3.62Å; F83-W128 HydrophobicContact CD2-CE3 3.62Å; F83-W128 AromaticContact CD2-CH2 3.84Å; F83-W128 HydrophobicContact CD2-CH2 3.84Å; F83-W128 HydrophobicContact CD2-CZ2 4.11Å; F83-W128 AromaticContact CD2-CZ3 3.57Å; F83-W128 HydrophobicContact CD2-CZ3 3.57Å; F83-W128 HydrophobicContact CE2-CB 4.41Å; F83-W128 AromaticContact CE2-CD2 3.32Å; F83-W128 HydrophobicContact CE2-CD2 3.32Å; F83-W128 AromaticContact CE2-CE2 3.63Å; F83-W128 AromaticContact CE2-CE3 3.5Å; F83-W128 HydrophobicContact CE2-CE3 3.5Å; F83-W128 VanDerWaalsContact CE2-CE3 3.5Å; F83-W128 AromaticContact CE2-CG 3.71Å; F83-W128 HydrophobicContact CE2-CG 3.71Å; F83-W128 HydrophobicContact CE2-CH2 4.25Å; F83-W128 HydrophobicContact CE2-CZ2 4.13Å; F83-W128 AromaticContact CE2-CZ3 3.94Å; F83-W128 HydrophobicContact CE2-CZ3 3.94Å; F83-W128 HydrophobicContact CG-CE3 4.43Å; F83-W128 HydrophobicContact CG-CZ3 4.33Å; F83-W128 HydrophobicContact CZ-CB 4.29Å; F83-W128 HydrophobicContact CZ-CD2 4.05Å; F83-W128 HydrophobicContact CZ-CE3 4.21Å; F83-W128 HydrophobicContact CZ-CG 4.05Å; F83-A172 HydrophobicContact CB-CB 4.01Å; F83-A172 HydrophobicContact CD1-CB 3.25Å; F83-A172 HydrophobicContact CD2-CB 4.35Å; F83-A172 HydrophobicContact CE1-CB 3.71Å; F83-A172 HydrophobicContact CG-CB 3.62Å; F83-A172 HydrophobicContact CZ-CB 4.41Å
84	Q	98.6	Very high	92.3	Very high	81 Å²	81	69 Å²	69	38%	0.379	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	113.4	170.3	-167	67.6	44.6	0	0	108.4	G55 G56 R57 H86 E87 W128	G55-Q84 PolarHBondContact O-NE2 3.03Å; G56-Q84 PolarHBondContact O-NE2 3.02Å; R57-Q84 VanDerWaalsContact CG-OE1 3.27Å; Q84-H86 PolarHBondContact NE2-O 2.85Å; Q84-E87 HydrophobicContact CG-CG 3.94Å; Q84-W128 WeakPolarHBondContact O-CH2 3.32Å
85	S	98.6	Very high	93.1	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.014	36%	0.364	C	S	.	.			trans	-85.4	-48.9	179.7	174.8	0	0	0	0	111.3	G56 F83 S119 K126 W128	G56-S85 WeakPolarHBondContact O-CA 3.29Å; G56-S85 WeakPolarHBondContact O-CB 3.32Å; G56-S85 PolarHBondContact O-N 2.85Å; F83-S85 PolarHBondContact O-N 3.37Å; S85-S119 PolarHBondContact OG-OG 2.55Å; S85-K126 VanDerWaalsContact O-CD 3.24Å; S85-K126 WeakPolarHBondContact O-CD 3.3Å; S85-K126 WeakPolarHBondContact O-CE 3.3Å; S85-K126 PolarHBondContact O-NZ 2.76Å; S85-W128 WeakPolarHBondContact O-CZ2 2.9Å; S85-W128 PolarHBondContact OG-NE1 2.93Å
86	H	98.6	Very high	93.4	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	38%	0.377	C	S	.	.			trans	-128.8	150.2	-177.6	-70.1	70.7	0	0	0	109.9	G56 Q84 E100 I102 T124	G56-H86 PolarHBondContact O-N 2.85Å; Q84-H86 PolarHBondContact NE2-O 2.85Å; H86-E100 HydrophobicContact CB-CB 4.19Å; H86-E100 WeakPolarHBondContact CB-O 3.25Å; H86-I102 HydrophobicContact CB-CD1 4.1Å; H86-I102 WeakPolarHBondContact ND1-CD1 3.41Å; H86-T124 PolarHBondContact NE2-O 3.48Å
87	E	97.4	Very high	93.5	Very high	129 Å²	129	76.2 Å²	76.2	60%	0.603	39%	0.385	S	S	*	.			trans	-122.5	155.3	174.1	-68.6	-176.6	158.3	0	0	107.2	Q84 E89	Q84-E87 HydrophobicContact CG-CG 3.94Å; E87-E89 PolarHBondContact O-N 2.87Å
88	P	95.7	Very high	93.4	Very high	74 Å²	74	77 Å²	77	48%	0.481	39%	0.389	S	S	.	.			trans	-59.3	131.6	178.7	-2.4	2.1	0	0	0	110.1	E100	P88-E100 WeakPolarHBondContact CB-OE2 3.4Å; P88-E100 WeakPolarHBondContact CG-OE1 3.31Å; P88-E100 VanDerWaalsContact CG-OE2 3.3Å; P88-E100 WeakPolarHBondContact CG-OE2 3.42Å
89	E	93.8	Very high	93.4	Very high	81 Å²	81	78.6 Å²	78.6	38%	0.379	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	154	176.5	-71	174.8	-163.7	0	0	109.4	E87 I98	E87-E89 PolarHBondContact O-N 2.87Å; E89-I98 HydrophobicContact CB-CB 4.05Å; E89-I98 HydrophobicContact CB-CD1 4.25Å; E89-I98 PolarHBondContact N-O 2.94Å; E89-I98 PolarHBondContact O-N 2.81Å
90	F	91.1	Very high	93.5	Very high	92 Å²	92	76.2 Å²	76.2	40%	0.404	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	121	178.1	-166.2	-94	0	0	0	110.8	Y92 E97	F90-Y92 AromaticContact CD1-CD1 3.46Å; F90-Y92 HydrophobicContact CD1-CD1 3.46Å; F90-Y92 VanDerWaalsContact CD1-CD1 3.46Å; F90-Y92 HydrophobicContact CD1-CD2 4.25Å; F90-Y92 AromaticContact CD1-CE1 3.61Å; F90-Y92 HydrophobicContact CD1-CE1 3.61Å; F90-Y92 HydrophobicContact CD1-CE2 4.4Å; F90-Y92 AromaticContact CD1-CG 3.8Å; F90-Y92 HydrophobicContact CD1-CG 3.8Å; F90-Y92 AromaticContact CE1-CD1 3.71Å; F90-Y92 HydrophobicContact CE1-CD1 3.71Å; F90-Y92 HydrophobicContact CE1-CE1 4.13Å; F90-Y92 HydrophobicContact CE1-CG 4.25Å; F90-Y92 PolarHBondContact O-N 2.88Å; F90-E97 HydrophobicContact CD2-CB 4.05Å; F90-E97 HydrophobicContact CE2-CB 4.31Å
91	D	84.4	Confident	93.6	Very high	42 Å²	42	77.7 Å²	77.7	23%	0.225	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	95.5	170.5	-175	-22.7	0	0	0	108.8	L93 K94 S95 L96	D91-L93 PolarHBondContact O-N 3.24Å; D91-L93 WeakPolarHBondContact OD1-CB 3.41Å; D91-L93 PolarHBondContact OD1-N 2.86Å; D91-K94 HydrophobicContact CB-CB 4.36Å; D91-K94 PolarHBondContact O-N 2.78Å; D91-K94 PolarHBondContact OD1-N 2.82Å; D91-K94 VanDerWaalsContact OD1-N 3.09Å; D91-K94 VanDerWaalsContact OD2-CD 3.26Å; D91-K94 WeakPolarHBondContact OD2-CD 3.4Å; D91-K94 WeakPolarHBondContact OD2-CG 3.47Å; D91-K94 IonicContact OD2-NZ 3.33Å; D91-S95 WeakPolarHBondContact O-CA 3.33Å; D91-S95 PolarHBondContact O-N 2.82Å; D91-L96 HydrophobicContact CB-CB 4.4Å; D91-L96 PolarHBondContact N-O 3.4Å; D91-L96 PolarHBondContact O-N 2.72Å; D91-L96 VanDerWaalsContact O-N 3.11Å
92	Y	87.1	Confident	93.6	Very high	188 Å²	188	77.2 Å²	77.2	74%	0.737	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.7	179.7	-65	-79.8	0	0	0	114.1	F90	F90-Y92 AromaticContact CD1-CD1 3.46Å; F90-Y92 HydrophobicContact CD1-CD1 3.46Å; F90-Y92 VanDerWaalsContact CD1-CD1 3.46Å; F90-Y92 HydrophobicContact CD1-CD2 4.25Å; F90-Y92 AromaticContact CD1-CE1 3.61Å; F90-Y92 HydrophobicContact CD1-CE1 3.61Å; F90-Y92 HydrophobicContact CD1-CE2 4.4Å; F90-Y92 AromaticContact CD1-CG 3.8Å; F90-Y92 HydrophobicContact CD1-CG 3.8Å; F90-Y92 AromaticContact CE1-CD1 3.71Å; F90-Y92 HydrophobicContact CE1-CD1 3.71Å; F90-Y92 HydrophobicContact CE1-CE1 4.13Å; F90-Y92 HydrophobicContact CE1-CG 4.25Å; F90-Y92 PolarHBondContact O-N 2.88Å
93	L	85.7	Confident	93.6	Very high	170 Å²	170	74 Å²	74	89%	0.89	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-33	-178.8	-63.6	176.5	0	0	0	111.1	D91	D91-L93 PolarHBondContact O-N 3.24Å; D91-L93 WeakPolarHBondContact OD1-CB 3.41Å; D91-L93 PolarHBondContact OD1-N 2.86Å
94	K	83.3	Confident	93.7	Very high	140 Å²	140	74.2 Å²	74.2	61%	0.609	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-5.8	177.2	-62.8	-177.7	-167.7	153.1	0	113.6	D91 L96	D91-K94 HydrophobicContact CB-CB 4.36Å; D91-K94 PolarHBondContact O-N 2.78Å; D91-K94 PolarHBondContact OD1-N 2.82Å; D91-K94 VanDerWaalsContact OD1-N 3.09Å; D91-K94 VanDerWaalsContact OD2-CD 3.26Å; D91-K94 WeakPolarHBondContact OD2-CD 3.4Å; D91-K94 WeakPolarHBondContact OD2-CG 3.47Å; D91-K94 IonicContact OD2-NZ 3.33Å; K94-L96 HydrophobicContact CB-CB 4.06Å; K94-L96 PolarHBondContact O-N 2.91Å
95	S	90	Very high	93.7	Very high	95 Å²	95	70.4 Å²	70.4	66%	0.664	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	44.3	-169.9	-59.4	0	0	0	0	111.6	D91	D91-S95 WeakPolarHBondContact O-CA 3.33Å; D91-S95 PolarHBondContact O-N 2.82Å
96	L	88.9	Confident	93.7	Very high	66 Å²	66	71.7 Å²	71.7	35%	0.346	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.2	-175	-179	67.9	0	0	0	109.8	D91 K94	D91-L96 HydrophobicContact CB-CB 4.4Å; D91-L96 PolarHBondContact N-O 3.4Å; D91-L96 PolarHBondContact O-N 2.72Å; D91-L96 VanDerWaalsContact O-N 3.11Å; K94-L96 HydrophobicContact CB-CB 4.06Å; K94-L96 PolarHBondContact O-N 2.91Å
97	E	92.4	Very high	93.7	Very high	131 Å²	131	72 Å²	72	61%	0.612	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	134	167	-173.8	168.9	-166.5	0	0	109.6	F90	F90-E97 HydrophobicContact CD2-CB 4.05Å; F90-E97 HydrophobicContact CE2-CB 4.31Å
98	I	93.3	Very high	93.7	Very high	18 Å²	18	67 Å²	67	9%	0.092	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	106	175.2	-59.3	169.6	0	0	0	106	E89 N121 K123	E89-I98 HydrophobicContact CB-CB 4.05Å; E89-I98 HydrophobicContact CB-CD1 4.25Å; E89-I98 PolarHBondContact N-O 2.94Å; E89-I98 PolarHBondContact O-N 2.81Å; I98-N121 WeakPolarHBondContact CG2-ND2 3.41Å; I98-K123 HydrophobicContact CD1-CB 4.32Å; I98-K123 HydrophobicContact CD1-CG 3.9Å; I98-K123 HydrophobicContact CG1-CG 4.01Å; I98-K123 HydrophobicContact CG2-CB 4.09Å; I98-K123 HydrophobicContact CG2-CG 3.86Å
99	E	95.9	Very high	93.7	Very high	102 Å²	102	65.1 Å²	65.1	48%	0.477	31%	0.314	S	S	.	.			trans	-60.2	144.2	178.4	-63.7	-179.4	-161.4	0	0	111.4	K101 N121	E99-K101 HydrophobicContact CB-CB 4.28Å; E99-K101 PolarHBondContact O-N 3.4Å; E99-N121 PolarHBondContact O-ND2 3.34Å
100	E	97.8	Very high	93.5	Very high	47 Å²	47	66.1 Å²	66.1	22%	0.22	32%	0.319	C	S	.	.			trans	-76	-10.7	173.2	64.7	-91.2	-140.6	0	0	113.5	G55 G56 H86 P88 I102	G55-E100 VanDerWaalsContact C-CG 3.4Å; G56-E100 WeakPolarHBondContact CA-O 3.29Å; H86-E100 HydrophobicContact CB-CB 4.19Å; H86-E100 WeakPolarHBondContact CB-O 3.25Å; P88-E100 WeakPolarHBondContact CB-OE2 3.4Å; P88-E100 WeakPolarHBondContact CG-OE1 3.31Å; P88-E100 VanDerWaalsContact CG-OE2 3.3Å; P88-E100 WeakPolarHBondContact CG-OE2 3.42Å; E100-I102 PolarHBondContact O-N 3.03Å
101	K	98.4	Very high	93.4	Very high	57 Å²	57	68.7 Å²	68.7	25%	0.248	33%	0.332	C	S	.	.			trans	-45.8	126.1	-179.1	169.3	175.4	162.8	-92	0	112.3	K54 E99 N103 N121	K54-K101 HydrophobicContact CG-CD 4.11Å; K54-K101 HydrophobicContact CG-CG 4.3Å; K54-K101 VanDerWaalsContact O-CA 3.29Å; K54-K101 WeakPolarHBondContact O-CA 3.39Å; K54-K101 PolarHBondContact O-N 2.75Å; E99-K101 HydrophobicContact CB-CB 4.28Å; E99-K101 PolarHBondContact O-N 3.4Å; K101-N103 PolarHBondContact NZ-OD1 2.91Å; K101-N103 PolarHBondContact O-N 3.06Å; K101-N121 WeakPolarHBondContact O-CA 3.29Å; K101-N121 VanDerWaalsContact O-CB 3.24Å; K101-N121 WeakPolarHBondContact O-CB 3.16Å
102	I	98.8	Very high	93.8	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.342	C	S	.	.			trans	-78.7	112	176.7	-51.3	-55.7	0	0	0	109.3	S38 T39 D53 V58 H86 E100 I105	S38-I102 WeakPolarHBondContact CB-O 3.42Å; S38-I102 PolarHBondContact OG-O 2.98Å; T39-I102 HydrophobicContact CG2-CB 4.49Å; T39-I102 HydrophobicContact CG2-CG2 3.85Å; D53-I102 PolarHBondContact O-N 3.35Å; V58-I102 HydrophobicContact CG2-CG1 4.41Å; H86-I102 HydrophobicContact CB-CD1 4.1Å; H86-I102 WeakPolarHBondContact ND1-CD1 3.41Å; E100-I102 PolarHBondContact O-N 3.03Å; I102-I105 HydrophobicContact CG2-CD1 4.31Å; I102-I105 HydrophobicContact CG2-CG1 3.91Å
103	N	98.5	Very high	94.1	Very high	17 Å²	17	66 Å²	66	9%	0.091	34%	0.343	C	S	.	.			trans	-78.1	-44.5	180	-72	-15.6	0	0	0	112.4	K101 T120 D122 I186	K101-N103 PolarHBondContact NZ-OD1 2.91Å; K101-N103 PolarHBondContact O-N 3.06Å; N103-T120 HydrophobicContact CB-CG2 4.31Å; N103-T120 PolarHBondContact N-O 3.42Å; N103-D122 PolarHBondContact ND2-N 3.46Å; N103-D122 PolarHBondContact ND2-OD1 2.97Å; N103-I186 PolarHBondContact ND2-O 2.87Å
104	K	98.7	Very high	94.6	Very high	27 Å²	27	58.1 Å²	58.1	12%	0.117	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.3	-178.4	-64.3	-65.9	172.7	-179.7	0	111.3	T120 I189 E353	K104-T120 HydrophobicContact CB-CG2 4.04Å; K104-T120 PolarHBondContact O-N 3.2Å; K104-T120 VanDerWaalsContact O-N 3.13Å; K104-I189 HydrophobicContact CB-CD1 4.2Å; K104-I189 HydrophobicContact CB-CG1 3.79Å; K104-E353 IonicContact NZ-OE1 3.16Å; K104-E353 PolarHBondContact NZ-OE1 3.3Å
105	I	98.8	Very high	95.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.1	167.1	-66.7	169.3	0	0	0	108.4	T39 E41 A50 V58 I102 L117 L118	T39-I105 HydrophobicContact CG2-CB 4.29Å; T39-I105 HydrophobicContact CG2-CD1 3.79Å; T39-I105 HydrophobicContact CG2-CG1 3.75Å; E41-I105 HydrophobicContact CB-CB 4.43Å; E41-I105 HydrophobicContact CB-CG2 4.39Å; A50-I105 HydrophobicContact CB-CD1 4.13Å; A50-I105 HydrophobicContact CB-CG2 4.13Å; V58-I105 HydrophobicContact CG1-CD1 4.04Å; V58-I105 HydrophobicContact CG2-CD1 4.01Å; I102-I105 HydrophobicContact CG2-CD1 4.31Å; I102-I105 HydrophobicContact CG2-CG1 3.91Å; I105-L117 HydrophobicContact CG2-CB 4.38Å; I105-L117 HydrophobicContact CG2-CD1 4.31Å; I105-L117 HydrophobicContact CG2-CD2 4.47Å; I105-L118 CarbonylContact C-O 3.53Å; I105-L118 VanDerWaalsContact CA-O 3.3Å; I105-L118 WeakPolarHBondContact CA-O 3.03Å
106	R	98.6	Very high	95.7	Very high	30 Å²	30	49.3 Å²	49.3	11%	0.113	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.3	169.8	-69.3	-67	175.7	-122.4	-10.8	110.1	E41 L117 L118 I189 V191	E41-R106 WeakPolarHBondContact OE1-CD 3.24Å; E41-R106 IonicContact OE1-CZ 3.5Å; E41-R106 IonicContact OE1-NE 2.75Å; E41-R106 IonicContact OE1-NH1 3.43Å; E41-R106 PolarHBondContact OE1-NH1 3.02Å; E41-R106 IonicContact OE2-NH1 2.67Å; E41-R106 PolarHBondContact OE2-NH1 3.37Å; R106-L117 CarbonylContact O-C 3.51Å; R106-L117 WeakPolarHBondContact O-CA 3.42Å; R106-L118 PolarHBondContact N-O 3.07Å; R106-L118 PolarHBondContact O-N 3.15Å; R106-I189 HydrophobicContact CB-CD1 4.24Å; R106-I189 HydrophobicContact CG-CD1 4.08Å; R106-I189 HydrophobicContact CG-CG1 3.88Å; R106-I189 WeakPolarHBondContact CG-O 3.31Å; R106-I189 PolarHBondContact NE-O 3.15Å; R106-V191 HydrophobicContact CB-CG2 4.34Å
107	W	98.6	Very high	96.1	Very high	6 Å²	6	46.2 Å²	46.2	2%	0.023	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	150.1	173.4	-67.8	93.4	0	0	0	110.8	E41 F42 N43 Y44 L48 A50 I60 H115 L117	E41-W107 PolarHBondContact O-NE1 3.12Å; F42-W107 VanDerWaalsContact C-CD1 3.46Å; N43-W107 VanDerWaalsContact CA-CD1 3.42Å; N43-W107 HydrophobicContact CB-CB 4.3Å; N43-W107 HydrophobicContact CB-CD2 3.58Å; N43-W107 HydrophobicContact CB-CE3 4.05Å; N43-W107 HydrophobicContact CB-CG 3.7Å; N43-W107 HydrophobicContact CB-CZ2 4.27Å; Y44-W107 HydrophobicContact CD2-CB 4.24Å; Y44-W107 HydrophobicContact CE2-CB 4.18Å; Y44-W107 WeakPolarHBondContact CE2-O 3.28Å; L48-W107 HydrophobicContact CB-CH2 3.95Å; L48-W107 HydrophobicContact CB-CZ2 3.9Å; L48-W107 HydrophobicContact CD1-CH2 3.67Å; L48-W107 HydrophobicContact CD1-CZ2 4.45Å; L48-W107 HydrophobicContact CD1-CZ3 3.98Å; L48-W107 HydrophobicContact CG-CH2 4.47Å; A50-W107 HydrophobicContact CB-CZ2 3.72Å; I60-W107 HydrophobicContact CD1-CH2 3.93Å; I60-W107 HydrophobicContact CG1-CH2 4.31Å; I60-W107 HydrophobicContact CG2-CH2 3.98Å; I60-W107 HydrophobicContact CG2-CZ2 4.23Å; W107-H115 HydrophobicContact CE3-CB 4.46Å; W107-H115 HydrophobicContact CZ3-CB 3.82Å; W107-L117 HydrophobicContact CD2-CB 4.11Å; W107-L117 HydrophobicContact CD2-CD2 4.47Å; W107-L117 HydrophobicContact CE3-CB 3.88Å; W107-L117 HydrophobicContact CE3-CD2 4.21Å; W107-L117 HydrophobicContact CH2-CD2 3.82Å; W107-L117 HydrophobicContact CZ2-CD2 4.09Å; W107-L117 HydrophobicContact CZ3-CB 4.3Å; W107-L117 HydrophobicContact CZ3-CD2 3.86Å
108	L	98.2	Very high	96.4	Very high	25 Å²	25	40 Å²	40	13%	0.131	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-93.2	148.8	164.1	-81.8	66.7	0	0	0	109.1	Y44 Q110 F116 L118 L127 V191 L211	Y44-L108 VanDerWaalsContact CE2-C 3.5Å; L108-Q110 PolarHBondContact O-N 3.42Å; L108-F116 HydrophobicContact CB-CB 4.01Å; L108-F116 HydrophobicContact CD2-CB 4.05Å; L108-F116 HydrophobicContact CG-CB 4.45Å; L108-F116 PolarHBondContact N-O 3.31Å; L108-L118 HydrophobicContact CD1-CD1 4.22Å; L108-L118 HydrophobicContact CD1-CG 3.85Å; L108-L127 HydrophobicContact CD1-CD1 3.95Å; L108-L127 HydrophobicContact CD2-CD1 3.92Å; L108-V191 HydrophobicContact CD1-CG2 4.22Å; L108-L211 HydrophobicContact CD2-CD1 3.89Å; L108-L211 HydrophobicContact CD2-CD2 4.18Å
109	P	94.6	Very high	96.7	Very high	33 Å²	33	39.1 Å²	39.1	21%	0.214	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-54.9	135.4	169.3	-28	38.1	0	0	0	111.2	Y44 Q111	Y44-P109 HydrophobicContact CD2-CG 4.36Å; Y44-P109 HydrophobicContact CE1-CG 4.34Å; Y44-P109 HydrophobicContact CE2-CB 4.43Å; Y44-P109 HydrophobicContact CE2-CG 3.75Å; P109-Q111 PolarHBondContact O-N 3.22Å
110	Q	91.2	Very high	96.8	Very high	103 Å²	103	34.2 Å²	34.2	48%	0.481	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-70.9	118.4	-175.3	-175.6	173.7	-1.5	0	0	111	L108 N112 H115	L108-Q110 PolarHBondContact O-N 3.42Å; Q110-N112 WeakPolarHBondContact CG-O 3.31Å; Q110-N112 PolarHBondContact NE2-O 2.86Å; Q110-H115 PolarHBondContact OE1-CE1 2.97Å; Q110-H115 VanDerWaalsContact OE1-CE1 3.25Å
111	Q	88.4	Confident	96.9	Very high	145 Å²	145	32 Å²	32	68%	0.678	17%	0.17	S	C	*	.			trans	-101.1	-21.2	178.7	-67	-177.9	-19.2	0	0	113.6	P109	P109-Q111 PolarHBondContact O-N 3.22Å
112	N	92.6	Very high	96.8	Very high	81 Å²	81	30.5 Å²	30.5	43%	0.433	16%	0.164	S	C	.	.	S	Bend	trans	-152.2	-169.6	-179	57.1	61.1	0	0	0	110	Q110 A114	Q110-N112 WeakPolarHBondContact CG-O 3.31Å; Q110-N112 PolarHBondContact NE2-O 2.86Å; N112-A114 PolarHBondContact O-N 3.14Å; N112-A114 VanDerWaalsContact O-N 3.17Å; N112-A114 WeakPolarHBondContact OD1-CA 3.45Å; N112-A114 VanDerWaalsContact OD1-CB 3.3Å; N112-A114 WeakPolarHBondContact OD1-CB 3.28Å; N112-A114 PolarHBondContact OD1-N 2.71Å; N112-A114 PolarHBondContact OD1-O 2.91Å
113	A	94	Very high	96.7	Very high	93 Å²	93	31.8 Å²	31.8	77%	0.769	17%	0.17	S	C	*	.	S	Bend	trans	-62.6	-20	-179.7	0	0	0	0	0	114
114	A	95.9	Very high	96.6	Very high	4 Å²	4	31.3 Å²	31.3	3%	0.033	17%	0.167	C	C	.	.	S	Bend	trans	-87.9	148.7	175	0	0	0	0	0	111.3	N112 F116 K129 I130	N112-A114 PolarHBondContact O-N 3.14Å; N112-A114 VanDerWaalsContact O-N 3.17Å; N112-A114 WeakPolarHBondContact OD1-CA 3.45Å; N112-A114 VanDerWaalsContact OD1-CB 3.3Å; N112-A114 WeakPolarHBondContact OD1-CB 3.28Å; N112-A114 PolarHBondContact OD1-N 2.71Å; N112-A114 PolarHBondContact OD1-O 2.91Å; A114-F116 HydrophobicContact CB-CE2 3.92Å; A114-F116 HydrophobicContact CB-CZ 4.27Å; A114-K129 HydrophobicContact CB-CD 4.22Å; A114-K129 HydrophobicContact CB-CG 3.93Å; A114-I130 CarbonylContact C-O 3.59Å; A114-I130 WeakPolarHBondContact CA-O 3.29Å; A114-I130 WeakPolarHBondContact CB-O 3.43Å
115	H	97.4	Very high	96.6	Very high	24 Å²	24	30 Å²	30	11%	0.111	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	151.1	171.5	-55.1	-78.4	0	0	0	110.5	L48 W107 Q110 K129 I130	L48-H115 HydrophobicContact CD1-CB 4.25Å; W107-H115 HydrophobicContact CE3-CB 4.46Å; W107-H115 HydrophobicContact CZ3-CB 3.82Å; Q110-H115 PolarHBondContact OE1-CE1 2.97Å; Q110-H115 VanDerWaalsContact OE1-CE1 3.25Å; H115-K129 WeakPolarHBondContact O-CA 3.49Å; H115-I130 HydrophobicContact CB-CB 4.38Å; H115-I130 PolarHBondContact N-O 3.47Å; H115-I130 PolarHBondContact O-N 3.08Å
116	F	98.3	Very high	96.6	Very high	27 Å²	27	31.3 Å²	31.3	12%	0.118	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	139.4	-179.8	-63.8	-98.3	0	0	0	110	L108 A114 L127 W128 K129 R175	L108-F116 HydrophobicContact CB-CB 4.01Å; L108-F116 HydrophobicContact CD2-CB 4.05Å; L108-F116 HydrophobicContact CG-CB 4.45Å; L108-F116 PolarHBondContact N-O 3.31Å; A114-F116 HydrophobicContact CB-CE2 3.92Å; A114-F116 HydrophobicContact CB-CZ 4.27Å; F116-L127 HydrophobicContact CB-CD1 4.25Å; F116-L127 HydrophobicContact CD1-CD1 4.46Å; F116-W128 VanDerWaalsContact CA-O 3.25Å; F116-W128 WeakPolarHBondContact CA-O 2.96Å; F116-K129 HydrophobicContact CD1-CB 3.9Å; F116-K129 HydrophobicContact CD1-CG 4.23Å; F116-K129 HydrophobicContact CE1-CB 3.62Å; F116-K129 HydrophobicContact CE1-CD 3.95Å; F116-K129 HydrophobicContact CE1-CG 3.66Å; F116-K129 HydrophobicContact CZ-CB 4.32Å; F116-K129 HydrophobicContact CZ-CD 3.92Å; F116-K129 HydrophobicContact CZ-CG 3.82Å; F116-R175 HydrophobicContact CE1-CG 4.48Å
117	L	98.5	Very high	96.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	150.4	174.6	64.4	84.2	0	0	0	110.6	I60 I105 R106 W107 W128 I130	I60-L117 HydrophobicContact CD1-CD2 3.88Å; I60-L117 HydrophobicContact CG1-CD2 4.47Å; I105-L117 HydrophobicContact CG2-CB 4.38Å; I105-L117 HydrophobicContact CG2-CD1 4.31Å; I105-L117 HydrophobicContact CG2-CD2 4.47Å; R106-L117 CarbonylContact O-C 3.51Å; R106-L117 WeakPolarHBondContact O-CA 3.42Å; W107-L117 HydrophobicContact CD2-CB 4.11Å; W107-L117 HydrophobicContact CD2-CD2 4.47Å; W107-L117 HydrophobicContact CE3-CB 3.88Å; W107-L117 HydrophobicContact CE3-CD2 4.21Å; W107-L117 HydrophobicContact CH2-CD2 3.82Å; W107-L117 HydrophobicContact CZ2-CD2 4.09Å; W107-L117 HydrophobicContact CZ3-CB 4.3Å; W107-L117 HydrophobicContact CZ3-CD2 3.86Å; L117-W128 HydrophobicContact CD1-CB 3.96Å; L117-W128 HydrophobicContact CD1-CG 4.24Å; L117-W128 HydrophobicContact CG-CB 4.17Å; L117-W128 PolarHBondContact N-O 3.21Å; L117-W128 VanDerWaalsContact N-O 3.16Å; L117-W128 PolarHBondContact O-N 3.31Å; L117-I130 HydrophobicContact CD2-CD1 4.03Å; L117-I130 HydrophobicContact CG-CD1 4.07Å
118	L	98.8	Very high	96.7	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.7	165.1	-66.7	168	0	0	0	108.7	I105 R106 L108 I125 K126 L127 F178 I189 V191 Y198 L211	I105-L118 CarbonylContact C-O 3.53Å; I105-L118 VanDerWaalsContact CA-O 3.3Å; I105-L118 WeakPolarHBondContact CA-O 3.03Å; R106-L118 PolarHBondContact N-O 3.07Å; R106-L118 PolarHBondContact O-N 3.15Å; L108-L118 HydrophobicContact CD1-CD1 4.22Å; L108-L118 HydrophobicContact CD1-CG 3.85Å; L118-I125 HydrophobicContact CB-CG2 4.2Å; L118-I125 HydrophobicContact CD2-CG2 3.91Å; L118-K126 WeakPolarHBondContact CA-O 3.24Å; L118-L127 HydrophobicContact CD2-CB 3.95Å; L118-L127 HydrophobicContact CD2-CD1 3.99Å; L118-L127 HydrophobicContact CG-CD1 4.44Å; L118-F178 HydrophobicContact CD2-CE2 4.15Å; L118-I189 HydrophobicContact CB-CD1 3.83Å; L118-V191 HydrophobicContact CD1-CG2 3.95Å; L118-Y198 HydrophobicContact CD1-CD1 4.09Å; L118-Y198 HydrophobicContact CD1-CD2 3.8Å; L118-Y198 HydrophobicContact CD1-CE1 4.41Å; L118-Y198 HydrophobicContact CD1-CE2 4.2Å; L118-Y198 HydrophobicContact CD1-CG 3.76Å; L118-L211 HydrophobicContact CD1-CD2 4.34Å
119	S	98.8	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.9	166.6	60.1	0	0	0	0	109.3	S85 I125 K126 W128	S85-S119 PolarHBondContact OG-OG 2.55Å; S119-I125 CarbonylContact O-C 3.58Å; S119-I125 WeakPolarHBondContact O-CA 2.94Å; S119-K126 PolarHBondContact N-O 3.39Å; S119-K126 PolarHBondContact O-N 3.2Å; S119-W128 VanDerWaalsContact OG-CD1 3.29Å; S119-W128 PolarHBondContact OG-NE1 3.1Å; S119-W128 VanDerWaalsContact OG-NE1 3.1Å
120	T	98.8	Very high	96.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143	178.2	-168.8	0	0	0	0	111.4	N103 K104 T124 I186 I189	N103-T120 HydrophobicContact CB-CG2 4.31Å; N103-T120 PolarHBondContact N-O 3.42Å; K104-T120 HydrophobicContact CB-CG2 4.04Å; K104-T120 PolarHBondContact O-N 3.2Å; K104-T120 VanDerWaalsContact O-N 3.13Å; T120-T124 WeakPolarHBondContact CA-O 3.38Å; T120-T124 PolarHBondContact OG1-O 3.22Å; T120-I186 HydrophobicContact CG2-CG2 4.02Å; T120-I189 HydrophobicContact CG2-CD1 3.97Å; T120-I189 HydrophobicContact CG2-CG1 4.05Å; T120-I189 HydrophobicContact CG2-CG2 3.96Å
121	N	98.4	Very high	97	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.146	C	C	.	.			trans	-100.3	-156.6	157.3	72.4	-11.9	0	0	0	108.7	I98 E99 K101 K123 T124	I98-N121 WeakPolarHBondContact CG2-ND2 3.41Å; E99-N121 PolarHBondContact O-ND2 3.34Å; K101-N121 WeakPolarHBondContact O-CA 3.29Å; K101-N121 VanDerWaalsContact O-CB 3.24Å; K101-N121 WeakPolarHBondContact O-CB 3.16Å; N121-K123 VanDerWaalsContact C-N 3.28Å; N121-K123 PolarHBondContact O-N 2.73Å; N121-K123 PolarHBondContact OD1-N 3.42Å; N121-K123 VanDerWaalsContact OD1-N 3.15Å; N121-T124 PolarHBondContact N-O 3.03Å; N121-T124 PolarHBondContact OD1-N 2.94Å; N121-T124 PolarHBondContact OD1-O 3.39Å
122	D	97.1	Very high	97.3	Very high	25 Å²	25	24.3 Å²	24.3	13%	0.134	13%	0.134	C	C	.	.	S	Bend	trans	-66.5	-21.2	-177.7	-77.6	-6.8	0	0	0	115.4	N103 H185 I186	N103-D122 PolarHBondContact ND2-N 3.46Å; N103-D122 PolarHBondContact ND2-OD1 2.97Å; D122-H185 HydrophobicContact CB-CB 4.41Å; D122-H185 IonicContact OD1-ND1 2.68Å; D122-H185 IonicContact OD2-CE1 3.38Å; D122-H185 PolarHBondContact OD2-CE1 2.93Å; D122-H185 IonicContact OD2-CG 3.42Å; D122-H185 IonicContact OD2-ND1 3.03Å; D122-H185 PolarHBondContact OD2-ND1 3.46Å; D122-I186 WeakPolarHBondContact O-CG1 3.32Å; D122-I186 PolarHBondContact O-N 3.35Å
123	K	96.5	Very high	97.3	Very high	28 Å²	28	25 Å²	25	12%	0.122	13%	0.131	C	C	.	.	S	Bend	trans	-132.1	-24.6	-170.2	-61.9	-62.5	175.1	-161.3	0	115	I98 N121 T183 Y184	I98-K123 HydrophobicContact CD1-CB 4.32Å; I98-K123 HydrophobicContact CD1-CG 3.9Å; I98-K123 HydrophobicContact CG1-CG 4.01Å; I98-K123 HydrophobicContact CG2-CB 4.09Å; I98-K123 HydrophobicContact CG2-CG 3.86Å; N121-K123 VanDerWaalsContact C-N 3.28Å; N121-K123 PolarHBondContact O-N 2.73Å; N121-K123 PolarHBondContact OD1-N 3.42Å; N121-K123 VanDerWaalsContact OD1-N 3.15Å; K123-T183 PolarHBondContact NZ-O 3Å; K123-Y184 PolarHBondContact NZ-O 3.41Å
124	T	97.4	Very high	97.3	Very high	6 Å²	6	24.4 Å²	24.4	4%	0.037	12%	0.115	C	C	.	.			trans	-133	128.4	-168	-61.5	0	0	0	0	111.2	H86 T120 N121 K126 I177 A179	H86-T124 PolarHBondContact NE2-O 3.48Å; T120-T124 WeakPolarHBondContact CA-O 3.38Å; T120-T124 PolarHBondContact OG1-O 3.22Å; N121-T124 PolarHBondContact N-O 3.03Å; N121-T124 PolarHBondContact OD1-N 2.94Å; N121-T124 PolarHBondContact OD1-O 3.39Å; T124-K126 HydrophobicContact CG2-CG 4.26Å; T124-I177 HydrophobicContact CG2-CG2 3.47Å; T124-I177 VanDerWaalsContact CG2-CG2 3.47Å; T124-A179 HydrophobicContact CG2-CB 4.09Å
125	I	98.8	Very high	97.1	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.3	171	-48.3	86.7	0	0	0	108.7	L118 S119 F178 I186 I189 Y198 W209	L118-I125 HydrophobicContact CB-CG2 4.2Å; L118-I125 HydrophobicContact CD2-CG2 3.91Å; S119-I125 CarbonylContact O-C 3.58Å; S119-I125 WeakPolarHBondContact O-CA 2.94Å; I125-F178 HydrophobicContact CB-CB 4.21Å; I125-F178 HydrophobicContact CB-CD2 4.25Å; I125-F178 HydrophobicContact CD1-CB 4.4Å; I125-F178 HydrophobicContact CG2-CD2 4.39Å; I125-F178 PolarHBondContact N-O 3.22Å; I125-F178 PolarHBondContact O-N 2.87Å; I125-I186 HydrophobicContact CD1-CD1 3.68Å; I125-I186 HydrophobicContact CG1-CD1 4.28Å; I125-I189 HydrophobicContact CG1-CG2 3.98Å; I125-I189 HydrophobicContact CG2-CG2 4.42Å; I125-Y198 HydrophobicContact CG1-CE2 4.49Å; I125-Y198 HydrophobicContact CG2-CE2 4.25Å; I125-W209 HydrophobicContact CD1-CZ2 4.4Å
126	K	98.8	Very high	96.8	Very high	28 Å²	28	34.2 Å²	34.2	12%	0.122	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.4	174.7	-62.8	-176.2	-174.5	177	0	110.5	S85 L118 S119 T124 W128 R176 I177	S85-K126 VanDerWaalsContact O-CD 3.24Å; S85-K126 WeakPolarHBondContact O-CD 3.3Å; S85-K126 WeakPolarHBondContact O-CE 3.3Å; S85-K126 PolarHBondContact O-NZ 2.76Å; L118-K126 WeakPolarHBondContact CA-O 3.24Å; S119-K126 PolarHBondContact N-O 3.39Å; S119-K126 PolarHBondContact O-N 3.2Å; T124-K126 HydrophobicContact CG2-CG 4.26Å; K126-W128 HydrophobicContact CD-CZ2 4.1Å; K126-R176 WeakPolarHBondContact CA-O 3.43Å; K126-I177 HydrophobicContact CG-CG1 4.2Å; K126-I177 HydrophobicContact CG-CG2 4.31Å
127	L	98.8	Very high	96.4	Very high	14 Å²	14	34.6 Å²	34.6	7%	0.073	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.5	169.2	177.5	64.4	0	0	0	108.9	L108 F116 L118 R175 R176 F178	L108-L127 HydrophobicContact CD1-CD1 3.95Å; L108-L127 HydrophobicContact CD2-CD1 3.92Å; F116-L127 HydrophobicContact CB-CD1 4.25Å; F116-L127 HydrophobicContact CD1-CD1 4.46Å; L118-L127 HydrophobicContact CD2-CB 3.95Å; L118-L127 HydrophobicContact CD2-CD1 3.99Å; L118-L127 HydrophobicContact CG-CD1 4.44Å; L127-R175 HydrophobicContact CD2-CB 4.33Å; L127-R175 HydrophobicContact CG-CB 4.32Å; L127-R175 PolarHBondContact O-N 2.85Å; L127-R176 HydrophobicContact CB-CB 3.99Å; L127-R176 HydrophobicContact CD2-CB 4.46Å; L127-R176 HydrophobicContact CD2-CG 4.22Å; L127-R176 PolarHBondContact N-O 2.98Å; L127-R176 PolarHBondContact O-N 3.34Å; L127-F178 HydrophobicContact CB-CE2 4.06Å
128	W	98.7	Very high	95.9	Very high	14 Å²	14	36.4 Å²	36.4	5%	0.053	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	141.3	178.1	-69.4	90.1	0	0	0	110.9	F83 Q84 S85 F116 L117 S119 K126 I130 A172 S173 P174	F83-W128 AromaticContact CD2-CD2 3.88Å; F83-W128 HydrophobicContact CD2-CD2 3.88Å; F83-W128 AromaticContact CD2-CE3 3.62Å; F83-W128 HydrophobicContact CD2-CE3 3.62Å; F83-W128 AromaticContact CD2-CH2 3.84Å; F83-W128 HydrophobicContact CD2-CH2 3.84Å; F83-W128 HydrophobicContact CD2-CZ2 4.11Å; F83-W128 AromaticContact CD2-CZ3 3.57Å; F83-W128 HydrophobicContact CD2-CZ3 3.57Å; F83-W128 HydrophobicContact CE2-CB 4.41Å; F83-W128 AromaticContact CE2-CD2 3.32Å; F83-W128 HydrophobicContact CE2-CD2 3.32Å; F83-W128 AromaticContact CE2-CE2 3.63Å; F83-W128 AromaticContact CE2-CE3 3.5Å; F83-W128 HydrophobicContact CE2-CE3 3.5Å; F83-W128 VanDerWaalsContact CE2-CE3 3.5Å; F83-W128 AromaticContact CE2-CG 3.71Å; F83-W128 HydrophobicContact CE2-CG 3.71Å; F83-W128 HydrophobicContact CE2-CH2 4.25Å; F83-W128 HydrophobicContact CE2-CZ2 4.13Å; F83-W128 AromaticContact CE2-CZ3 3.94Å; F83-W128 HydrophobicContact CE2-CZ3 3.94Å; F83-W128 HydrophobicContact CG-CE3 4.43Å; F83-W128 HydrophobicContact CG-CZ3 4.33Å; F83-W128 HydrophobicContact CZ-CB 4.29Å; F83-W128 HydrophobicContact CZ-CD2 4.05Å; F83-W128 HydrophobicContact CZ-CE3 4.21Å; F83-W128 HydrophobicContact CZ-CG 4.05Å; Q84-W128 WeakPolarHBondContact O-CH2 3.32Å; S85-W128 WeakPolarHBondContact O-CZ2 2.9Å; S85-W128 PolarHBondContact OG-NE1 2.93Å; F116-W128 VanDerWaalsContact CA-O 3.25Å; F116-W128 WeakPolarHBondContact CA-O 2.96Å; L117-W128 HydrophobicContact CD1-CB 3.96Å; L117-W128 HydrophobicContact CD1-CG 4.24Å; L117-W128 HydrophobicContact CG-CB 4.17Å; L117-W128 PolarHBondContact N-O 3.21Å; L117-W128 VanDerWaalsContact N-O 3.16Å; L117-W128 PolarHBondContact O-N 3.31Å; S119-W128 VanDerWaalsContact OG-CD1 3.29Å; S119-W128 PolarHBondContact OG-NE1 3.1Å; S119-W128 VanDerWaalsContact OG-NE1 3.1Å; K126-W128 HydrophobicContact CD-CZ2 4.1Å; W128-I130 HydrophobicContact CB-CD1 3.93Å; W128-A172 HydrophobicContact CE3-CB 4.45Å; W128-S173 VanDerWaalsContact CE3-C 3.43Å; W128-P174 HydrophobicContact CD2-CB 4.36Å; W128-P174 HydrophobicContact CE3-CB 4.16Å; W128-P174 HydrophobicContact CH2-CB 3.82Å; W128-P174 HydrophobicContact CH2-CG 3.98Å; W128-P174 HydrophobicContact CZ2-CB 3.98Å; W128-P174 HydrophobicContact CZ3-CB 3.93Å; W128-P174 VanDerWaalsContact CZ3-CD 3.42Å; W128-P174 HydrophobicContact CZ3-CG 4.02Å
129	K	98.1	Very high	95.4	Very high	50 Å²	50	38.4 Å²	38.4	22%	0.217	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.2	167.7	177.3	-175.8	174.6	-160.4	0	109.4	A114 H115 F116 A172 S173 R175	A114-K129 HydrophobicContact CB-CD 4.22Å; A114-K129 HydrophobicContact CB-CG 3.93Å; H115-K129 WeakPolarHBondContact O-CA 3.49Å; F116-K129 HydrophobicContact CD1-CB 3.9Å; F116-K129 HydrophobicContact CD1-CG 4.23Å; F116-K129 HydrophobicContact CE1-CB 3.62Å; F116-K129 HydrophobicContact CE1-CD 3.95Å; F116-K129 HydrophobicContact CE1-CG 3.66Å; F116-K129 HydrophobicContact CZ-CB 4.32Å; F116-K129 HydrophobicContact CZ-CD 3.92Å; F116-K129 HydrophobicContact CZ-CG 3.82Å; K129-A172 CarbonylContact O-C 3.54Å; K129-A172 WeakPolarHBondContact O-CA 3.4Å; K129-S173 PolarHBondContact N-O 3.24Å; K129-S173 PolarHBondContact O-N 3.38Å; K129-S173 PolarHBondContact O-OG 3.06Å; K129-R175 HydrophobicContact CB-CG 3.51Å; K129-R175 VanDerWaalsContact CD-NE 3.29Å
130	I	98.1	Very high	94.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115.9	177.8	-57.9	66	0	0	0	106.7	I60 Y80 A114 H115 L117 W128 V170 E171 A172	I60-I130 HydrophobicContact CD1-CD1 4.25Å; I60-I130 HydrophobicContact CD1-CG1 3.59Å; I60-I130 HydrophobicContact CD1-CG2 4.45Å; Y80-I130 HydrophobicContact CD1-CG2 4.47Å; Y80-I130 HydrophobicContact CE1-CG2 3.73Å; A114-I130 CarbonylContact C-O 3.59Å; A114-I130 WeakPolarHBondContact CA-O 3.29Å; A114-I130 WeakPolarHBondContact CB-O 3.43Å; H115-I130 HydrophobicContact CB-CB 4.38Å; H115-I130 PolarHBondContact N-O 3.47Å; H115-I130 PolarHBondContact O-N 3.08Å; L117-I130 HydrophobicContact CD2-CD1 4.03Å; L117-I130 HydrophobicContact CG-CD1 4.07Å; W128-I130 HydrophobicContact CB-CD1 3.93Å; I130-V170 HydrophobicContact CG2-CG1 3.68Å; I130-E171 WeakPolarHBondContact CA-O 3.44Å; I130-A172 HydrophobicContact CG1-CB 4.46Å
131	S	95.9	Very high	94.4	Very high	23 Å²	23	46.2 Å²	46.2	16%	0.161	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.3	-178.5	48.3	0	0	0	0	112.4	E171	S131-E171 PolarHBondContact N-O 3.38Å; S131-E171 PolarHBondContact O-N 2.78Å
132	E	94.4	Very high	94	Very high	93 Å²	93	51.1 Å²	51.1	44%	0.435	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	141.3	170.9	-64.4	-174.2	176.5	0	0	111	Y80 L168 M169 V170	Y80-E132 HydrophobicContact CE2-CG 4.41Å; Y80-E132 WeakPolarHBondContact CE2-OE1 3.41Å; Y80-E132 WeakPolarHBondContact OH-CG 3.24Å; Y80-E132 PolarHBondContact OH-OE1 2.81Å; E132-L168 HydrophobicContact CB-CD1 3.82Å; E132-L168 HydrophobicContact CG-CD1 4.25Å; E132-M169 CarbonylContact C-O 3.5Å; E132-M169 WeakPolarHBondContact CA-O 3.32Å; E132-V170 HydrophobicContact CG-CG2 4.45Å
133	R	92.8	Very high	93.4	Very high	96 Å²	96	55.1 Å²	55.1	36%	0.362	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	117.7	173.3	-169.7	174.5	79.2	-152.5	2.7	109.8	K135 M169 E171	R133-K135 VanDerWaalsContact CG-O 3.31Å; R133-K135 WeakPolarHBondContact CG-O 3.27Å; R133-M169 PolarHBondContact N-O 3.03Å; R133-M169 PolarHBondContact O-N 3.03Å; R133-E171 IonicContact CZ-OE1 3.27Å; R133-E171 VanDerWaalsContact CZ-OE1 3.23Å; R133-E171 IonicContact CZ-OE2 2.78Å; R133-E171 IonicContact NH1-OE1 3.99Å; R133-E171 PolarHBondContact NH1-OE1 3.16Å; R133-E171 IonicContact NH1-OE2 3.01Å; R133-E171 PolarHBondContact NH1-OE2 3.19Å; R133-E171 IonicContact NH2-OE1 2.77Å; R133-E171 PolarHBondContact NH2-OE1 3.34Å
134	D	93	Very high	92.6	Very high	80 Å²	80	56.8 Å²	56.8	43%	0.428	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	3.9	179.9	71.1	-28.8	0	0	0	112.6	P165 M166 L168	D134-P165 CarbonylContact O-C 3.57Å; D134-P165 WeakPolarHBondContact O-CA 3.44Å; D134-M166 WeakPolarHBondContact O-CG 3.19Å; D134-M166 PolarHBondContact O-N 2.77Å; D134-L168 HydrophobicContact CB-CD1 4.25Å
135	K	92.1	Very high	91.7	Very high	101 Å²	101	64.2 Å²	64.2	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	145	-177.2	-69.3	167.5	-165.7	171.9	0	111.9	R133 L163 K164	R133-K135 VanDerWaalsContact CG-O 3.31Å; R133-K135 WeakPolarHBondContact CG-O 3.27Å; K135-L163 HydrophobicContact CB-CB 4.46Å; K135-K164 CarbonylContact C-O 3.5Å; K135-K164 VanDerWaalsContact CA-O 3.29Å; K135-K164 WeakPolarHBondContact CA-O 3.26Å
136	R	90.7	Very high	90.8	Very high	133 Å²	133	70.7 Å²	70.7	50%	0.502	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.5	172.2	64.9	-174.8	-168	-168.7	3.3	111.6	E138 L163 K164 M166	R136-E138 HydrophobicContact CG-CG 4.34Å; R136-E138 IonicContact CZ-OE1 3.62Å; R136-E138 IonicContact NE-OE1 3.7Å; R136-E138 PolarHBondContact NE-OE1 2.92Å; R136-E138 IonicContact NH2-OE1 2.69Å; R136-E138 PolarHBondContact NH2-OE1 2.97Å; R136-L163 WeakPolarHBondContact O-CA 3.26Å; R136-K164 PolarHBondContact N-O 3Å; R136-K164 PolarHBondContact O-N 3.47Å; R136-M166 HydrophobicContact CB-CG 4.49Å; R136-M166 HydrophobicContact CB-SD 3.75Å; R136-M166 HydrophobicContact CG-CB 4.24Å; R136-M166 HydrophobicContact CG-SD 4.31Å
137	A	90.6	Very high	89.9	Confident	36 Å²	36	71.4 Å²	71.4	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	128.6	174.4	0	0	0	0	0	110.7	Y140 P161 L163	A137-Y140 WeakPolarHBondContact O-CE2 3.11Å; A137-P161 HydrophobicContact CB-CB 4.23Å; A137-L163 HydrophobicContact CB-CD2 4.17Å
138	E	88.2	Confident	89.3	Confident	38 Å²	38	79.1 Å²	79.1	18%	0.178	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	162.9	175.8	-70	-173.1	-171	0	0	111.4	R136 P161 I162 K164	R136-E138 HydrophobicContact CG-CG 4.34Å; R136-E138 IonicContact CZ-OE1 3.62Å; R136-E138 IonicContact NE-OE1 3.7Å; R136-E138 PolarHBondContact NE-OE1 2.92Å; R136-E138 IonicContact NH2-OE1 2.69Å; R136-E138 PolarHBondContact NH2-OE1 2.97Å; E138-P161 CarbonylContact O-C 3.59Å; E138-P161 WeakPolarHBondContact O-CA 3.35Å; E138-P161 WeakPolarHBondContact O-CB 3.23Å; E138-I162 PolarHBondContact N-O 3.44Å; E138-I162 PolarHBondContact O-N 2.91Å; E138-K164 WeakPolarHBondContact OE2-CD 3.3Å; E138-K164 WeakPolarHBondContact OE2-CE 3.35Å; E138-K164 IonicContact OE2-NZ 2.85Å; E138-K164 PolarHBondContact OE2-NZ 2.85Å
139	G	87	Confident	88.7	Confident	41 Å²	41	85.2 Å²	85.2	42%	0.423	42%	0.42	S	S	.	.			trans	89.4	36.9	178.1	0	0	0	0	0	114.6
140	Y	88.4	Confident	88	Confident	128 Å²	128	87 Å²	87	50%	0.502	43%	0.425	S	S	.	.			trans	-63.9	146.2	175	-66.4	-82.6	0	0	0	111.9	A137 P161	A137-Y140 WeakPolarHBondContact O-CE2 3.11Å; Y140-P161 HydrophobicContact CD1-CG 4.11Å; Y140-P161 HydrophobicContact CE1-CG 4.17Å
141	N	89	Confident	87.4	Confident	37 Å²	37	90.3 Å²	90.3	20%	0.198	44%	0.443	C	S	.	.	S	Bend	trans	-68.2	-38	-179.5	-69.4	-64	0	0	0	112.9	L158 R159	N141-L158 WeakPolarHBondContact OD1-CA 3.28Å; N141-R159 PolarHBondContact ND2-O 2.86Å; N141-R159 PolarHBondContact OD1-N 2.95Å; N141-R159 PolarHBondContact OD1-O 2.76Å
142	L	88.9	Confident	86.8	Confident	102 Å²	102	93.4 Å²	93.4	53%	0.534	46%	0.463	S	S	.	.	S	Bend	trans	-97.9	-5.9	-171.7	-57.8	179.9	0	0	0	113.9	L149 R150 I155	L142-L149 CarbonylContact O-C 3.58Å; L142-L149 WeakPolarHBondContact O-CA 3.4Å; L142-R150 PolarHBondContact O-N 3.18Å; L142-I155 HydrophobicContact CD2-CD1 3.55Å
143	K	85.6	Confident	86.3	Confident	110 Å²	110	98.3 Å²	98.3	48%	0.478	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-127.2	136.5	178.8	-66	-176.3	179.1	-176.5	0	109.9	R148 L149	K143-R148 CarbonylContact C-O 3.58Å; K143-R148 VanDerWaalsContact CA-O 3.24Å; K143-R148 WeakPolarHBondContact CA-O 3.49Å; K143-L149 HydrophobicContact CG-CD2 4.42Å
144	D	80.1	Confident	85.9	Confident	63 Å²	63	102.8 Å²	102.8	34%	0.337	50%	0.5	S	S	.	.			trans	-77.1	179.4	169.3	61.3	19.5	0	0	0	111.3	D146 G147 R148 R150	D144-D146 PolarHBondContact O-N 3.19Å; D144-D146 PolarHBondContact OD1-N 3.12Å; D144-G147 PolarHBondContact O-N 3.24Å; D144-G147 PolarHBondContact OD1-N 3.07Å; D144-G147 VanDerWaalsContact OD1-N 3.14Å; D144-R148 PolarHBondContact N-O 2.97Å; D144-R148 WeakPolarHBondContact OD1-CA 3.29Å; D144-R148 WeakPolarHBondContact OD1-CB 3.25Å; D144-R148 PolarHBondContact OD1-N 2.9Å; D144-R150 HydrophobicContact CB-CG 4.14Å
145	E	76.8	Confident	85.5	Confident	162 Å²	162	101 Å²	101	76%	0.757	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.4	-178.5	-64.9	-160.5	148.1	0	0	112.6	G147 K164	E145-G147 VanDerWaalsContact C-N 3.27Å; E145-G147 PolarHBondContact O-N 3.25Å; E145-K164 IonicContact OE1-NZ 3.16Å
146	D	80.3	Confident	85.3	Confident	136 Å²	136	103 Å²	103	73%	0.727	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	3.6	174.5	-61.5	-41.8	0	0	0	112.8	D144 R148	D144-D146 PolarHBondContact O-N 3.19Å; D144-D146 PolarHBondContact OD1-N 3.12Å; D146-R148 VanDerWaalsContact C-N 3.29Å; D146-R148 HydrophobicContact CB-CG 4.45Å; D146-R148 PolarHBondContact O-N 2.9Å
147	G	81.3	Confident	85.2	Confident	43 Å²	43	99.4 Å²	99.4	44%	0.443	51%	0.51	S	S	.	.	S	Bend	trans	77.8	6.2	178.8	0	0	0	0	0	115	D144 E145	D144-G147 PolarHBondContact O-N 3.24Å; D144-G147 PolarHBondContact OD1-N 3.07Å; D144-G147 VanDerWaalsContact OD1-N 3.14Å; E145-G147 VanDerWaalsContact C-N 3.27Å; E145-G147 PolarHBondContact O-N 3.25Å
148	R	85.2	Confident	85.2	Confident	176 Å²	176	104.8 Å²	104.8	66%	0.664	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-77.3	144.9	178.2	-58.7	179.2	172.1	179	-0.8	110.5	K143 D144 D146 R150	K143-R148 CarbonylContact C-O 3.58Å; K143-R148 VanDerWaalsContact CA-O 3.24Å; K143-R148 WeakPolarHBondContact CA-O 3.49Å; D144-R148 PolarHBondContact N-O 2.97Å; D144-R148 WeakPolarHBondContact OD1-CA 3.29Å; D144-R148 WeakPolarHBondContact OD1-CB 3.25Å; D144-R148 PolarHBondContact OD1-N 2.9Å; D146-R148 VanDerWaalsContact C-N 3.29Å; D146-R148 HydrophobicContact CB-CG 4.45Å; D146-R148 PolarHBondContact O-N 2.9Å; R148-R150 PolarHBondContact O-N 3.5Å
149	L	86.5	Confident	85.2	Confident	142 Å²	142	110.8 Å²	110.8	74%	0.743	55%	0.554	S	S	*	*	B	Isolated β-bridge	trans	-64.5	126.1	177.5	-70.1	170.3	0	0	0	110.1	L142 K143	L142-L149 CarbonylContact O-C 3.58Å; L142-L149 WeakPolarHBondContact O-CA 3.4Å; K143-L149 HydrophobicContact CG-CD2 4.42Å
150	R	83.6	Confident	85.4	Confident	86 Å²	86	114.9 Å²	114.9	33%	0.325	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-80	140.7	173.1	-63.7	-179	69.7	-163	0	109.1	L142 D144 R148 P152	L142-R150 PolarHBondContact O-N 3.18Å; D144-R150 HydrophobicContact CB-CG 4.14Å; R148-R150 PolarHBondContact O-N 3.5Å; R150-P152 VanDerWaalsContact O-CD 3.31Å; R150-P152 WeakPolarHBondContact O-CD 3.3Å
151	D	85.1	Confident	85.6	Confident	71 Å²	71	111.3 Å²	111.3	38%	0.38	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-59	117.7	172.3	178.1	0.8	0	0	0	109.9	F153 R154	D151-F153 PolarHBondContact O-N 2.95Å; D151-F153 VanDerWaalsContact O-N 3.15Å; D151-F153 WeakPolarHBondContact OD1-CD2 3.39Å; D151-F153 PolarHBondContact OD1-N 3.35Å; D151-R154 HydrophobicContact CB-CB 4.35Å; D151-R154 HydrophobicContact CB-CG 4.03Å; D151-R154 PolarHBondContact O-N 3.36Å; D151-R154 IonicContact OD2-NE 2.65Å
152	P	82.9	Confident	85.8	Confident	87 Å²	87	115.4 Å²	115.4	57%	0.565	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-55.1	-32.3	-179.2	-26.6	35.4	0	0	0	113.5	R150 R154 I155	R150-P152 VanDerWaalsContact O-CD 3.31Å; R150-P152 WeakPolarHBondContact O-CD 3.3Å; P152-R154 PolarHBondContact O-N 2.91Å; P152-I155 PolarHBondContact O-N 3.08Å
153	F	84.9	Confident	86	Confident	197 Å²	197	116.2 Å²	116.2	86%	0.864	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-73.7	-12.3	-179.3	-63.8	-76.2	0	0	0	113.4	D151	D151-F153 PolarHBondContact O-N 2.95Å; D151-F153 VanDerWaalsContact O-N 3.15Å; D151-F153 WeakPolarHBondContact OD1-CD2 3.39Å; D151-F153 PolarHBondContact OD1-N 3.35Å
154	R	82.9	Confident	86.3	Confident	190 Å²	190	115 Å²	115	72%	0.717	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-96	1.6	176.3	-64.4	-174.2	179.5	-158.2	-4.2	113.4	D151 P152 T156	D151-R154 HydrophobicContact CB-CB 4.35Å; D151-R154 HydrophobicContact CB-CG 4.03Å; D151-R154 PolarHBondContact O-N 3.36Å; D151-R154 IonicContact OD2-NE 2.65Å; P152-R154 PolarHBondContact O-N 2.91Å; R154-T156 PolarHBondContact O-N 3.34Å
155	I	86.1	Confident	87	Confident	42 Å²	42	117.3 Å²	117.3	22%	0.215	60%	0.601	C	S	.	*			trans	-85.9	100.3	-179.8	-56.9	177.3	0	0	0	108.7	L142 P152 L158	L142-I155 HydrophobicContact CD2-CD1 3.55Å; P152-I155 PolarHBondContact O-N 3.08Å; I155-L158 HydrophobicContact CG2-CD2 4.46Å
156	T	87.9	Confident	87.7	Confident	142 Å²	142	111.9 Å²	111.9	87%	0.871	58%	0.576	S	S	*	*			trans	-93	-15.1	-177.4	54.6	0	0	0	0	114	R154	R154-T156 PolarHBondContact O-N 3.34Å
157	A	87.6	Confident	88.3	Confident	59 Å²	59	112.4 Å²	112.4	49%	0.488	58%	0.579	S	S	.	*	S	Bend	trans	-154.1	144.3	177.4	0	0	0	0	0	110.8
158	L	90.5	Very high	88.7	Confident	149 Å²	149	115.2 Å²	115.2	78%	0.78	58%	0.583	S	S	*	*			trans	-84.5	141.6	173.9	-63.1	177.9	0	0	0	110.7	N141 I155	N141-L158 WeakPolarHBondContact OD1-CA 3.28Å; I155-L158 HydrophobicContact CG2-CD2 4.46Å
159	R	88.3	Confident	89	Confident	164 Å²	164	110 Å²	110	62%	0.619	57%	0.567	S	S	*	*			trans	-125.1	149.8	177.8	-57.2	179.6	-174.8	179.9	-1.2	109.7	N141	N141-R159 PolarHBondContact ND2-O 2.86Å; N141-R159 PolarHBondContact OD1-N 2.95Å; N141-R159 PolarHBondContact OD1-O 2.76Å
160	V	92.4	Very high	89.5	Confident	126 Å²	126	105 Å²	105	76%	0.764	54%	0.542	S	S	*	.			trans	-94.9	133.6	170.8	-179.2	0	0	0	0	107.9
161	P	91.7	Very high	90	Very high	54 Å²	54	104.2 Å²	104.2	35%	0.351	54%	0.542	S	S	.	.			trans	-57.7	143.6	175.7	-24.8	34.4	0	0	0	112.1	A137 E138 Y140	A137-P161 HydrophobicContact CB-CB 4.23Å; E138-P161 CarbonylContact O-C 3.59Å; E138-P161 WeakPolarHBondContact O-CA 3.35Å; E138-P161 WeakPolarHBondContact O-CB 3.23Å; Y140-P161 HydrophobicContact CD1-CG 4.11Å; Y140-P161 HydrophobicContact CE1-CG 4.17Å
162	I	92.8	Very high	90.6	Very high	123 Å²	123	102.3 Å²	102.3	63%	0.631	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	141.1	178.7	-56.2	172.3	0	0	0	108.3	E138 K164	E138-I162 PolarHBondContact N-O 3.44Å; E138-I162 PolarHBondContact O-N 2.91Å; I162-K164 PolarHBondContact O-N 2.99Å
163	L	93.8	Very high	91.3	Very high	118 Å²	118	100.2 Å²	100.2	62%	0.618	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	119.7	173.2	-65.9	177	0	0	0	109.8	K135 R136 A137	K135-L163 HydrophobicContact CB-CB 4.46Å; R136-L163 WeakPolarHBondContact O-CA 3.26Å; A137-L163 HydrophobicContact CB-CD2 4.17Å
164	K	92.2	Very high	91.9	Very high	85 Å²	85	94.3 Å²	94.3	37%	0.37	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.1	170.3	-65.9	-159.1	-163.9	153.8	0	110.7	K135 R136 E138 E145 I162	K135-K164 CarbonylContact C-O 3.5Å; K135-K164 VanDerWaalsContact CA-O 3.29Å; K135-K164 WeakPolarHBondContact CA-O 3.26Å; R136-K164 PolarHBondContact N-O 3Å; R136-K164 PolarHBondContact O-N 3.47Å; E138-K164 WeakPolarHBondContact OE2-CD 3.3Å; E138-K164 WeakPolarHBondContact OE2-CE 3.35Å; E138-K164 IonicContact OE2-NZ 2.85Å; E138-K164 PolarHBondContact OE2-NZ 2.85Å; E145-K164 IonicContact OE1-NZ 3.16Å; I162-K164 PolarHBondContact O-N 2.99Å
165	P	93.9	Very high	92.6	Very high	112 Å²	112	90.8 Å²	90.8	73%	0.727	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.6	145.5	171.7	-21.8	33	0	0	0	111.9	D134	D134-P165 CarbonylContact O-C 3.57Å; D134-P165 WeakPolarHBondContact O-CA 3.44Å
166	M	92.7	Very high	93.1	Very high	47 Å²	47	93.7 Å²	93.7	23%	0.232	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	168.5	171.2	63.7	174.7	-75.5	0	0	109.7	D134 R136 M169	D134-M166 WeakPolarHBondContact O-CG 3.19Å; D134-M166 PolarHBondContact O-N 2.77Å; R136-M166 HydrophobicContact CB-CG 4.49Å; R136-M166 HydrophobicContact CB-SD 3.75Å; R136-M166 HydrophobicContact CG-CB 4.24Å; R136-M166 HydrophobicContact CG-SD 4.31Å; M166-M169 HydrophobicContact CE-CB 3.99Å; M166-M169 HydrophobicContact CE-SD 4.21Å
167	D	91.3	Very high	93.6	Very high	147 Å²	147	91.1 Å²	91.1	79%	0.786	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	140.1	171.6	-61.8	-31.9	0	0	0	110.4	M169	D167-M169 PolarHBondContact O-N 2.86Å
168	L	90.5	Very high	94.1	Very high	103 Å²	103	88.3 Å²	88.3	54%	0.539	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	122.2	-178.8	-174.5	69.7	0	0	0	109.9	E132 D134	E132-L168 HydrophobicContact CB-CD1 3.82Å; E132-L168 HydrophobicContact CG-CD1 4.25Å; D134-L168 HydrophobicContact CB-CD1 4.25Å
169	M	92.4	Very high	94.4	Very high	66 Å²	66	82.7 Å²	82.7	33%	0.325	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.3	178.9	-163.4	179.3	81.4	0	0	109.8	E132 R133 M166 D167 E171	E132-M169 CarbonylContact C-O 3.5Å; E132-M169 WeakPolarHBondContact CA-O 3.32Å; R133-M169 PolarHBondContact N-O 3.03Å; R133-M169 PolarHBondContact O-N 3.03Å; M166-M169 HydrophobicContact CE-CB 3.99Å; M166-M169 HydrophobicContact CE-SD 4.21Å; D167-M169 PolarHBondContact O-N 2.86Å; M169-E171 VanDerWaalsContact CE-CD 3.43Å; M169-E171 HydrophobicContact CE-CG 3.45Å; M169-E171 VanDerWaalsContact CE-CG 3.45Å; M169-E171 WeakPolarHBondContact CE-OE1 3.36Å
170	V	95.6	Very high	94.5	Very high	36 Å²	36	82.8 Å²	82.8	22%	0.218	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.8	178.7	-174.5	0	0	0	0	108.8	Y80 I130 E132	Y80-V170 HydrophobicContact CD1-CG1 4.13Å; Y80-V170 HydrophobicContact CD2-CG2 3.87Å; Y80-V170 HydrophobicContact CE1-CG1 3.64Å; Y80-V170 HydrophobicContact CE1-CG2 4.38Å; Y80-V170 HydrophobicContact CE2-CB 4.45Å; Y80-V170 HydrophobicContact CE2-CG1 4.2Å; Y80-V170 HydrophobicContact CE2-CG2 3.4Å; I130-V170 HydrophobicContact CG2-CG1 3.68Å; E132-V170 HydrophobicContact CG-CG2 4.45Å
171	E	94.9	Very high	94.7	Very high	71 Å²	71	78 Å²	78	33%	0.332	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.3	178.5	-67.5	-176.7	148.3	0	0	110.3	I130 S131 R133 M169	I130-E171 WeakPolarHBondContact CA-O 3.44Å; S131-E171 PolarHBondContact N-O 3.38Å; S131-E171 PolarHBondContact O-N 2.78Å; R133-E171 IonicContact CZ-OE1 3.27Å; R133-E171 VanDerWaalsContact CZ-OE1 3.23Å; R133-E171 IonicContact CZ-OE2 2.78Å; R133-E171 IonicContact NH1-OE1 3.99Å; R133-E171 PolarHBondContact NH1-OE1 3.16Å; R133-E171 IonicContact NH1-OE2 3.01Å; R133-E171 PolarHBondContact NH1-OE2 3.19Å; R133-E171 IonicContact NH2-OE1 2.77Å; R133-E171 PolarHBondContact NH2-OE1 3.34Å; M169-E171 VanDerWaalsContact CE-CD 3.43Å; M169-E171 HydrophobicContact CE-CG 3.45Å; M169-E171 VanDerWaalsContact CE-CG 3.45Å; M169-E171 WeakPolarHBondContact CE-OE1 3.36Å
172	A	97.6	Very high	94.9	Very high	31 Å²	31	76 Å²	76	26%	0.256	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	128.7	167.5	0	0	0	0	0	109.5	F83 W128 K129 I130	F83-A172 HydrophobicContact CB-CB 4.01Å; F83-A172 HydrophobicContact CD1-CB 3.25Å; F83-A172 HydrophobicContact CD2-CB 4.35Å; F83-A172 HydrophobicContact CE1-CB 3.71Å; F83-A172 HydrophobicContact CG-CB 3.62Å; F83-A172 HydrophobicContact CZ-CB 4.41Å; W128-A172 HydrophobicContact CE3-CB 4.45Å; K129-A172 CarbonylContact O-C 3.54Å; K129-A172 WeakPolarHBondContact O-CA 3.4Å; I130-A172 HydrophobicContact CG1-CB 4.46Å
173	S	97.3	Very high	95	Very high	42 Å²	42	73.4 Å²	73.4	29%	0.294	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	134.9	-179.5	57	0	0	0	0	111.5	W128 K129 R175	W128-S173 VanDerWaalsContact CE3-C 3.43Å; K129-S173 PolarHBondContact N-O 3.24Å; K129-S173 PolarHBondContact O-N 3.38Å; K129-S173 PolarHBondContact O-OG 3.06Å; S173-R175 PolarHBondContact O-N 3.46Å
174	P	97.1	Very high	95	Very high	73 Å²	73	69.7 Å²	69.7	47%	0.474	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.9	174	29.8	-30.1	0	0	0	108.3	W128	W128-P174 HydrophobicContact CD2-CB 4.36Å; W128-P174 HydrophobicContact CE3-CB 4.16Å; W128-P174 HydrophobicContact CH2-CB 3.82Å; W128-P174 HydrophobicContact CH2-CG 3.98Å; W128-P174 HydrophobicContact CZ2-CB 3.98Å; W128-P174 HydrophobicContact CZ3-CB 3.93Å; W128-P174 VanDerWaalsContact CZ3-CD 3.42Å; W128-P174 HydrophobicContact CZ3-CG 4.02Å
175	R	97.3	Very high	95.3	Very high	116 Å²	116	69.6 Å²	69.6	44%	0.438	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-41.3	179.4	-69.2	-66.6	-129.9	154.5	7.5	111.9	F116 L127 K129 S173	F116-R175 HydrophobicContact CE1-CG 4.48Å; L127-R175 HydrophobicContact CD2-CB 4.33Å; L127-R175 HydrophobicContact CG-CB 4.32Å; L127-R175 PolarHBondContact O-N 2.85Å; K129-R175 HydrophobicContact CB-CG 3.51Å; K129-R175 VanDerWaalsContact CD-NE 3.29Å; S173-R175 PolarHBondContact O-N 3.46Å
176	R	98.1	Very high	95.5	Very high	104 Å²	104	64.3 Å²	64.3	39%	0.392	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	150.8	-175.6	-61.3	-65.5	-177.9	-100.2	3.6	110.3	K126 L127 F178 T214	K126-R176 WeakPolarHBondContact CA-O 3.43Å; L127-R176 HydrophobicContact CB-CB 3.99Å; L127-R176 HydrophobicContact CD2-CB 4.46Å; L127-R176 HydrophobicContact CD2-CG 4.22Å; L127-R176 PolarHBondContact N-O 2.98Å; L127-R176 PolarHBondContact O-N 3.34Å; R176-F178 HydrophobicContact CB-CE2 3.84Å; R176-F178 HydrophobicContact CB-CZ 3.9Å; R176-T214 HydrophobicContact CB-CG2 3.75Å; R176-T214 HydrophobicContact CG-CG2 4.14Å
177	I	98.3	Very high	95.7	Very high	87 Å²	87	63.1 Å²	63.1	45%	0.446	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.2	177.3	-55	-178.9	0	0	0	106.5	T124 K126 A179 T214	T124-I177 HydrophobicContact CG2-CG2 3.47Å; T124-I177 VanDerWaalsContact CG2-CG2 3.47Å; K126-I177 HydrophobicContact CG-CG1 4.2Å; K126-I177 HydrophobicContact CG-CG2 4.31Å; I177-A179 HydrophobicContact CG2-CB 4.38Å; I177-T214 WeakPolarHBondContact O-CB 3.27Å; I177-T214 WeakPolarHBondContact O-CG2 3.12Å
178	F	98.4	Very high	96.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	102.7	178.4	-49	-96	0	0	0	107.4	L118 I125 L127 R176 Y198 W209 L211 I213 T214	L118-F178 HydrophobicContact CD2-CE2 4.15Å; I125-F178 HydrophobicContact CB-CB 4.21Å; I125-F178 HydrophobicContact CB-CD2 4.25Å; I125-F178 HydrophobicContact CD1-CB 4.4Å; I125-F178 HydrophobicContact CG2-CD2 4.39Å; I125-F178 PolarHBondContact N-O 3.22Å; I125-F178 PolarHBondContact O-N 2.87Å; L127-F178 HydrophobicContact CB-CE2 4.06Å; R176-F178 HydrophobicContact CB-CE2 3.84Å; R176-F178 HydrophobicContact CB-CZ 3.9Å; F178-Y198 WeakPolarHBondContact CB-OH 3.45Å; F178-Y198 HydrophobicContact CD1-CE1 4.31Å; F178-Y198 WeakPolarHBondContact CD1-OH 3.35Å; F178-Y198 HydrophobicContact CD2-CE1 4.39Å; F178-Y198 WeakPolarHBondContact CD2-OH 3.35Å; F178-Y198 HydrophobicContact CE1-CE1 4.01Å; F178-Y198 HydrophobicContact CE2-CE1 4.09Å; F178-Y198 WeakPolarHBondContact CG-OH 3.14Å; F178-Y198 AromaticContact CZ-CE1 3.89Å; F178-Y198 HydrophobicContact CZ-CE1 3.89Å; F178-W209 HydrophobicContact CB-CD2 4.37Å; F178-W209 HydrophobicContact CB-CE3 3.99Å; F178-W209 HydrophobicContact CB-CH2 3.84Å; F178-W209 HydrophobicContact CB-CZ2 4.23Å; F178-W209 HydrophobicContact CB-CZ3 3.73Å; F178-W209 HydrophobicContact CD1-CD2 4.2Å; F178-W209 AromaticContact CD1-CE3 3.57Å; F178-W209 HydrophobicContact CD1-CE3 3.57Å; F178-W209 AromaticContact CD1-CZ3 3.96Å; F178-W209 HydrophobicContact CD1-CZ3 3.96Å; F178-W209 HydrophobicContact CE1-CE3 4.49Å; F178-W209 HydrophobicContact CG-CE3 4.2Å; F178-W209 HydrophobicContact CG-CZ3 4.35Å; F178-L211 WeakPolarHBondContact CZ-O 3.37Å; F178-I213 WeakPolarHBondContact CE1-O 3.16Å; F178-T214 HydrophobicContact CD1-CG2 3.86Å; F178-T214 HydrophobicContact CE1-CG2 3.79Å; F178-T214 HydrophobicContact CG-CG2 4.4Å; F178-T214 HydrophobicContact CZ-CG2 4.28Å
179	A	95.4	Very high	96.5	Very high	31 Å²	31	51.7 Å²	51.7	26%	0.256	27%	0.273	S	S	.	.			trans	-127.3	170.8	-171.6	0	0	0	0	0	111.1	T124 I177 A181	T124-A179 HydrophobicContact CG2-CB 4.09Å; I177-A179 HydrophobicContact CG2-CB 4.38Å; A179-A181 PolarHBondContact O-N 3.3Å; A179-A181 VanDerWaalsContact O-N 3.13Å
180	N	91.7	Very high	96.8	Very high	167 Å²	167	49 Å²	49	89%	0.893	26%	0.26	S	S	*	.	S	Bend	trans	61.1	19.3	170.2	-57.1	-44.8	0	0	0	116.5
181	A	95.6	Very high	96.9	Very high	24 Å²	24	48.1 Å²	48.1	20%	0.198	26%	0.255	C	S	.	.			trans	-102.7	-16.5	175.9	0	0	0	0	0	114.1	A179 N207 W209	A179-A181 PolarHBondContact O-N 3.3Å; A179-A181 VanDerWaalsContact O-N 3.13Å; A181-N207 PolarHBondContact O-ND2 3.2Å; A181-N207 VanDerWaalsContact O-ND2 3.14Å; A181-W209 HydrophobicContact CB-CH2 3.32Å; A181-W209 HydrophobicContact CB-CZ2 3.26Å
182	H	96.5	Very high	97.1	Very high	14 Å²	14	45 Å²	45	7%	0.065	24%	0.241	C	C	.	.			trans	-107.6	129.4	-177	-75.8	-76.4	0	0	0	111.3	I186 S200 D202 N207	H182-I186 HydrophobicContact CB-CD1 4.2Å; H182-I186 HydrophobicContact CB-CG1 3.87Å; H182-S200 PolarHBondContact CE1-O 2.77Å; H182-S200 WeakPolarHBondContact NE2-CB 3.08Å; H182-S200 PolarHBondContact NE2-OG 3.01Å; H182-D202 HydrophobicContact CB-CB 4.44Å; H182-D202 IonicContact CE1-OD2 2.62Å; H182-D202 IonicContact CG-OD2 3.85Å; H182-D202 WeakPolarHBondContact ND1-CB 3.26Å; H182-D202 VanDerWaalsContact ND1-CG 3.31Å; H182-D202 IonicContact ND1-OD2 2.92Å; H182-D202 PolarHBondContact ND1-OD2 3.03Å; H182-N207 PolarHBondContact CE1-ND2 3.21Å; H182-N207 PolarHBondContact NE2-ND2 2.93Å
183	T	93.8	Very high	97.1	Very high	67 Å²	67	45.1 Å²	45.1	41%	0.411	24%	0.24	S	C	.	.	S	Bend	trans	-86.2	-37	174.1	-56.9	0	0	0	0	110.3	K123	K123-T183 PolarHBondContact NZ-O 3Å
184	Y	95.4	Very high	97.1	Very high	41 Å²	41	45.7 Å²	45.7	16%	0.161	24%	0.24	C	C	.	.	S	Bend	trans	-104.2	-172.4	-176.7	-53.3	-79.4	0	0	0	111.1	K123 D202 D203 L204 K224 M228	K123-Y184 PolarHBondContact NZ-O 3.41Å; Y184-D202 PolarHBondContact N-OD2 3.22Å; Y184-D203 HydrophobicContact CG-CB 4.42Å; Y184-L204 HydrophobicContact CD2-CB 4.02Å; Y184-L204 HydrophobicContact CD2-CD1 4.15Å; Y184-L204 HydrophobicContact CD2-CG 4.28Å; Y184-L204 HydrophobicContact CE1-CD1 4.13Å; Y184-L204 HydrophobicContact CE2-CB 4.03Å; Y184-L204 HydrophobicContact CE2-CD1 3.61Å; Y184-L204 HydrophobicContact CE2-CG 4.2Å; Y184-K224 PolarHBondContact OH-NZ 2.67Å; Y184-M228 HydrophobicContact CE1-CE 4.39Å; Y184-M228 PolarHBondContact OH-SD 2.89Å
185	H	96.9	Very high	97	Very high	83 Å²	83	46.8 Å²	46.8	38%	0.384	24%	0.238	S	C	.	.			trans	-81.4	125.1	-175.5	-61.3	-77	0	0	0	110.6	D122 N187 D202 D203	D122-H185 HydrophobicContact CB-CB 4.41Å; D122-H185 IonicContact OD1-ND1 2.68Å; D122-H185 IonicContact OD2-CE1 3.38Å; D122-H185 PolarHBondContact OD2-CE1 2.93Å; D122-H185 IonicContact OD2-CG 3.42Å; D122-H185 IonicContact OD2-ND1 3.03Å; D122-H185 PolarHBondContact OD2-ND1 3.46Å; H185-N187 PolarHBondContact O-N 2.63Å; H185-D202 VanDerWaalsContact O-CA 3.22Å; H185-D202 WeakPolarHBondContact O-CA 3.29Å; H185-D202 WeakPolarHBondContact O-CB 3.35Å; H185-D203 IonicContact CD2-OD2 3.23Å; H185-D203 PolarHBondContact N-OD2 2.95Å
186	I	98.6	Very high	97	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.243	C	C	.	.			trans	-65.9	117.5	176.1	-63.1	165.5	0	0	0	109.1	N103 T120 D122 I125 H182 I189 A201	N103-I186 PolarHBondContact ND2-O 2.87Å; T120-I186 HydrophobicContact CG2-CG2 4.02Å; D122-I186 WeakPolarHBondContact O-CG1 3.32Å; D122-I186 PolarHBondContact O-N 3.35Å; I125-I186 HydrophobicContact CD1-CD1 3.68Å; I125-I186 HydrophobicContact CG1-CD1 4.28Å; H182-I186 HydrophobicContact CB-CD1 4.2Å; H182-I186 HydrophobicContact CB-CG1 3.87Å; I186-I189 HydrophobicContact CG2-CG2 4.44Å; I186-A201 CarbonylContact C-O 3.53Å; I186-A201 WeakPolarHBondContact CA-O 3.35Å
187	N	98	Very high	97	Very high	21 Å²	21	42.8 Å²	42.8	11%	0.112	23%	0.23	C	C	.	.			trans	-101.9	-22.5	177.5	59.5	56.7	0	0	0	112.8	H185 A201 D202 I235	H185-N187 PolarHBondContact O-N 2.63Å; N187-A201 PolarHBondContact N-O 2.9Å; N187-A201 PolarHBondContact OD1-O 3.16Å; N187-D202 PolarHBondContact ND2-O 3.41Å; N187-D202 VanDerWaalsContact ND2-O 3.16Å; N187-I235 PolarHBondContact ND2-O 3.05Å; N187-I235 VanDerWaalsContact ND2-O 3.13Å
188	S	98.7	Very high	97	Very high	9 Å²	9	38.6 Å²	38.6	6%	0.063	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	144.7	-174.9	-53	0	0	0	0	113.3	S200 A201 A237 A238	S188-S200 CarbonylContact O-C 3.56Å; S188-S200 VanDerWaalsContact O-CA 3.26Å; S188-S200 WeakPolarHBondContact O-CA 3.34Å; S188-A201 PolarHBondContact N-O 3.17Å; S188-A201 PolarHBondContact O-N 3.15Å; S188-A237 VanDerWaalsContact OG-CA 3.32Å; S188-A237 WeakPolarHBondContact OG-CA 3.33Å; S188-A238 WeakPolarHBondContact CB-O 3.3Å; S188-A238 PolarHBondContact OG-N 2.97Å
189	I	98.8	Very high	97	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.6	161.8	49.2	167.4	0	0	0	108.4	K104 R106 L118 T120 I125 I186 L199	K104-I189 HydrophobicContact CB-CD1 4.2Å; K104-I189 HydrophobicContact CB-CG1 3.79Å; R106-I189 HydrophobicContact CB-CD1 4.24Å; R106-I189 HydrophobicContact CG-CD1 4.08Å; R106-I189 HydrophobicContact CG-CG1 3.88Å; R106-I189 WeakPolarHBondContact CG-O 3.31Å; R106-I189 PolarHBondContact NE-O 3.15Å; L118-I189 HydrophobicContact CB-CD1 3.83Å; T120-I189 HydrophobicContact CG2-CD1 3.97Å; T120-I189 HydrophobicContact CG2-CG1 4.05Å; T120-I189 HydrophobicContact CG2-CG2 3.96Å; I125-I189 HydrophobicContact CG1-CG2 3.98Å; I125-I189 HydrophobicContact CG2-CG2 4.42Å; I186-I189 HydrophobicContact CG2-CG2 4.44Å; I189-L199 WeakPolarHBondContact CA-O 3.49Å
190	S	98.8	Very high	97.2	Very high	9 Å²	9	37.1 Å²	37.1	6%	0.063	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	128.6	179.4	-172.6	0	0	0	0	110.5	Y198 L199 E239 F240	S190-Y198 CarbonylContact O-C 3.57Å; S190-Y198 VanDerWaalsContact O-CA 3.29Å; S190-Y198 WeakPolarHBondContact O-CA 3.44Å; S190-Y198 VanDerWaalsContact O-CB 3.3Å; S190-Y198 WeakPolarHBondContact O-CB 3.42Å; S190-L199 PolarHBondContact N-O 2.75Å; S190-L199 PolarHBondContact O-N 3.07Å; S190-E239 WeakPolarHBondContact OG-CG 3.45Å; S190-F240 WeakPolarHBondContact O-CD2 3.42Å; S190-F240 PolarHBondContact OG-N 2.9Å
191	V	98.4	Very high	97.5	Very high	18 Å²	18	29.2 Å²	29.2	11%	0.109	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	136.9	-179.7	179.8	0	0	0	0	109.2	R106 L108 L118	R106-V191 HydrophobicContact CB-CG2 4.34Å; L108-V191 HydrophobicContact CD1-CG2 4.22Å; L118-V191 HydrophobicContact CD1-CG2 3.95Å
192	N	98.5	Very high	97.6	Very high	5 Å²	5	28 Å²	28	3%	0.027	15%	0.145	C	C	.	.			trans	-78.8	149	177.6	-165.4	-25	0	0	0	110.8	D194 H195 T197 F240 C245	N192-D194 WeakPolarHBondContact CB-OD1 3.38Å; N192-D194 PolarHBondContact ND2-OD2 3.34Å; N192-D194 PolarHBondContact O-N 3.38Å; N192-D194 PolarHBondContact OD1-N 2.92Å; N192-H195 PolarHBondContact O-N 3.31Å; N192-T197 WeakPolarHBondContact CB-O 3.35Å; N192-T197 VanDerWaalsContact CB-OG1 3.27Å; N192-T197 WeakPolarHBondContact CB-OG1 3.27Å; N192-T197 PolarHBondContact N-O 3.18Å; N192-T197 PolarHBondContact ND2-OG1 3.37Å; N192-T197 VanDerWaalsContact ND2-OG1 3.08Å; N192-F240 HydrophobicContact CB-CD2 3.87Å; N192-F240 HydrophobicContact CB-CE2 3.8Å; N192-F240 HydrophobicContact CB-CG 4.28Å; N192-F240 HydrophobicContact CB-CZ 4.18Å; N192-C245 PolarHBondContact ND2-O 2.88Å; N192-C245 WeakPolarHBondContact OD1-CA 3.42Å; N192-C245 VanDerWaalsContact OD1-CB 3.27Å; N192-C245 WeakPolarHBondContact OD1-CB 3.26Å; N192-C245 PolarHBondContact OD1-O 2.9Å
193	S	97.6	Very high	97.7	Very high	34 Å²	34	29.2 Å²	29.2	24%	0.238	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.2	171.5	60.5	0	0	0	0	114.3	H195 P242 C245	S193-H195 VanDerWaalsContact C-N 3.28Å; S193-P242 WeakPolarHBondContact CB-O 2.99Å; S193-C245 VanDerWaalsContact OG-CA 3.29Å; S193-C245 WeakPolarHBondContact OG-CA 3.4Å; S193-C245 PolarHBondContact OG-N 2.83Å
194	D	97.3	Very high	97.9	Very high	55 Å²	55	26.1 Å²	26.1	29%	0.294	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.7	173.2	69.3	11.1	0	0	0	114.3	N192 E196 T197 C245	N192-D194 WeakPolarHBondContact CB-OD1 3.38Å; N192-D194 PolarHBondContact ND2-OD2 3.34Å; N192-D194 PolarHBondContact O-N 3.38Å; N192-D194 PolarHBondContact OD1-N 2.92Å; D194-E196 PolarHBondContact O-N 2.94Å; D194-E196 PolarHBondContact OD1-N 2.88Å; D194-T197 PolarHBondContact OD1-N 2.96Å; D194-T197 PolarHBondContact OD1-OG1 3.32Å; D194-T197 PolarHBondContact OD2-OG1 2.91Å; D194-C245 HydrophobicContact CB-CB 4.12Å
195	H	94.4	Very high	98	Very high	95 Å²	95	27.4 Å²	27.4	44%	0.44	14%	0.137	S	C	.	.	S	Bend	trans	62.7	11	-176.8	-52.2	-68.7	0	0	0	116.1	N192 S193	N192-H195 PolarHBondContact O-N 3.31Å; S193-H195 VanDerWaalsContact C-N 3.28Å
196	E	97.3	Very high	98.1	Very high	117 Å²	117	23.4 Å²	23.4	55%	0.547	12%	0.119	S	C	.	.	S	Bend	trans	-121	-32	-178.4	-70.7	-173.7	172.1	0	0	112	D194 L211	D194-E196 PolarHBondContact O-N 2.94Å; D194-E196 PolarHBondContact OD1-N 2.88Å; E196-L211 WeakPolarHBondContact O-CG 3.36Å; E196-L211 PolarHBondContact O-N 2.79Å
197	T	98.5	Very high	98.1	Very high	19 Å²	19	23.6 Å²	23.6	12%	0.117	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	162.1	-174.8	71	0	0	0	0	113.5	N192 D194 W209	N192-T197 WeakPolarHBondContact CB-O 3.35Å; N192-T197 VanDerWaalsContact CB-OG1 3.27Å; N192-T197 WeakPolarHBondContact CB-OG1 3.27Å; N192-T197 PolarHBondContact N-O 3.18Å; N192-T197 PolarHBondContact ND2-OG1 3.37Å; N192-T197 VanDerWaalsContact ND2-OG1 3.08Å; D194-T197 PolarHBondContact OD1-N 2.96Å; D194-T197 PolarHBondContact OD1-OG1 3.32Å; D194-T197 PolarHBondContact OD2-OG1 2.91Å; T197-W209 CarbonylContact C-O 3.25Å; T197-W209 WeakPolarHBondContact CA-O 3.42Å; T197-W209 WeakPolarHBondContact CB-O 3.36Å
198	Y	98.8	Very high	98.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.9	170.3	78.3	-86	0	0	0	109.3	L118 I125 F178 S190 W209 L211	L118-Y198 HydrophobicContact CD1-CD1 4.09Å; L118-Y198 HydrophobicContact CD1-CD2 3.8Å; L118-Y198 HydrophobicContact CD1-CE1 4.41Å; L118-Y198 HydrophobicContact CD1-CE2 4.2Å; L118-Y198 HydrophobicContact CD1-CG 3.76Å; I125-Y198 HydrophobicContact CG1-CE2 4.49Å; I125-Y198 HydrophobicContact CG2-CE2 4.25Å; F178-Y198 WeakPolarHBondContact CB-OH 3.45Å; F178-Y198 HydrophobicContact CD1-CE1 4.31Å; F178-Y198 WeakPolarHBondContact CD1-OH 3.35Å; F178-Y198 HydrophobicContact CD2-CE1 4.39Å; F178-Y198 WeakPolarHBondContact CD2-OH 3.35Å; F178-Y198 HydrophobicContact CE1-CE1 4.01Å; F178-Y198 HydrophobicContact CE2-CE1 4.09Å; F178-Y198 WeakPolarHBondContact CG-OH 3.14Å; F178-Y198 AromaticContact CZ-CE1 3.89Å; F178-Y198 HydrophobicContact CZ-CE1 3.89Å; S190-Y198 CarbonylContact O-C 3.57Å; S190-Y198 VanDerWaalsContact O-CA 3.29Å; S190-Y198 WeakPolarHBondContact O-CA 3.44Å; S190-Y198 VanDerWaalsContact O-CB 3.3Å; S190-Y198 WeakPolarHBondContact O-CB 3.42Å; Y198-W209 HydrophobicContact CD1-CB 3.71Å; Y198-W209 HydrophobicContact CE1-CB 3.29Å; Y198-W209 AromaticContact CE1-CG 3.86Å; Y198-W209 HydrophobicContact CE1-CG 3.86Å; Y198-W209 HydrophobicContact CE2-CB 4.19Å; Y198-W209 AromaticContact CE2-CD1 3.66Å; Y198-W209 HydrophobicContact CE2-CG 4.01Å; Y198-W209 HydrophobicContact CG-CB 4.34Å; Y198-W209 AromaticContact CZ-CD1 3.67Å; Y198-W209 AromaticContact CZ-CG 3.54Å; Y198-W209 PolarHBondContact N-O 2.85Å; Y198-W209 PolarHBondContact O-N 2.93Å; Y198-L211 HydrophobicContact CD1-CD2 3.46Å; Y198-L211 VanDerWaalsContact CD1-CD2 3.46Å; Y198-L211 HydrophobicContact CD1-CG 4.17Å; Y198-L211 HydrophobicContact CE1-CD2 4.01Å; Y198-L211 HydrophobicContact CG-CD2 4.33Å
199	L	98.7	Very high	98.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	152.9	174.4	65.8	76	0	0	0	110.8	I189 S190 I206 N207 A238 F240 F248	I189-L199 WeakPolarHBondContact CA-O 3.49Å; S190-L199 PolarHBondContact N-O 2.75Å; S190-L199 PolarHBondContact O-N 3.07Å; L199-I206 HydrophobicContact CB-CG2 4.05Å; L199-I206 HydrophobicContact CD1-CG2 4.34Å; L199-I206 HydrophobicContact CD2-CG2 4.34Å; L199-I206 HydrophobicContact CG-CG2 4.48Å; L199-N207 CarbonylContact C-O 3.59Å; L199-N207 VanDerWaalsContact CA-O 3.24Å; L199-N207 WeakPolarHBondContact CA-O 3.31Å; L199-A238 HydrophobicContact CD1-CB 4.06Å; L199-F240 HydrophobicContact CB-CD2 4.25Å; L199-F240 HydrophobicContact CB-CE2 3.57Å; L199-F240 HydrophobicContact CB-CZ 4.08Å; L199-F240 HydrophobicContact CD2-CD1 4.21Å; L199-F240 HydrophobicContact CD2-CD2 3.61Å; L199-F240 HydrophobicContact CD2-CE1 4.11Å; L199-F240 HydrophobicContact CD2-CE2 3.52Å; L199-F240 HydrophobicContact CD2-CG 3.95Å; L199-F240 HydrophobicContact CD2-CZ 3.77Å; L199-F240 HydrophobicContact CG-CD2 3.64Å; L199-F240 HydrophobicContact CG-CE2 3.49Å; L199-F240 VanDerWaalsContact CG-CE2 3.49Å; L199-F240 HydrophobicContact CG-CG 4.45Å; L199-F240 HydrophobicContact CG-CZ 4.17Å; L199-F248 HydrophobicContact CD2-CB 3.9Å; L199-F248 HydrophobicContact CD2-CD2 4.13Å; L199-F248 HydrophobicContact CD2-CG 4.06Å
200	S	98.8	Very high	98.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.6	163.9	58.3	0	0	0	0	109.8	H182 S188 I206 N207 W209	H182-S200 PolarHBondContact CE1-O 2.77Å; H182-S200 WeakPolarHBondContact NE2-CB 3.08Å; H182-S200 PolarHBondContact NE2-OG 3.01Å; S188-S200 CarbonylContact O-C 3.56Å; S188-S200 VanDerWaalsContact O-CA 3.26Å; S188-S200 WeakPolarHBondContact O-CA 3.34Å; S200-I206 WeakPolarHBondContact O-CA 3.34Å; S200-N207 PolarHBondContact N-O 2.98Å; S200-N207 PolarHBondContact O-N 3.01Å; S200-W209 PolarHBondContact OG-NE1 3.48Å
201	A	98.8	Very high	98.1	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.3	179.8	0	0	0	0	0	110.6	I186 N187 S188 R205 I206 I235 A238	I186-A201 CarbonylContact C-O 3.53Å; I186-A201 WeakPolarHBondContact CA-O 3.35Å; N187-A201 PolarHBondContact N-O 2.9Å; N187-A201 PolarHBondContact OD1-O 3.16Å; S188-A201 PolarHBondContact N-O 3.17Å; S188-A201 PolarHBondContact O-N 3.15Å; A201-R205 CarbonylContact C-O 3.56Å; A201-R205 WeakPolarHBondContact CA-O 3.28Å; A201-I206 HydrophobicContact CB-CD1 4.42Å; A201-I206 HydrophobicContact CB-CG1 3.82Å; A201-I206 HydrophobicContact CB-CG2 4.46Å; A201-I235 HydrophobicContact CB-CG2 4.28Å; A201-A238 HydrophobicContact CB-CB 3.72Å
202	D	98.3	Very high	98	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.			trans	-107	-169.8	163.3	69.2	33.7	0	0	0	110.6	H182 Y184 H185 N187 L204 R205 I235	H182-D202 HydrophobicContact CB-CB 4.44Å; H182-D202 IonicContact CE1-OD2 2.62Å; H182-D202 IonicContact CG-OD2 3.85Å; H182-D202 WeakPolarHBondContact ND1-CB 3.26Å; H182-D202 VanDerWaalsContact ND1-CG 3.31Å; H182-D202 IonicContact ND1-OD2 2.92Å; H182-D202 PolarHBondContact ND1-OD2 3.03Å; Y184-D202 PolarHBondContact N-OD2 3.22Å; H185-D202 VanDerWaalsContact O-CA 3.22Å; H185-D202 WeakPolarHBondContact O-CA 3.29Å; H185-D202 WeakPolarHBondContact O-CB 3.35Å; N187-D202 PolarHBondContact ND2-O 3.41Å; N187-D202 VanDerWaalsContact ND2-O 3.16Å; D202-L204 PolarHBondContact O-N 3.24Å; D202-L204 VanDerWaalsContact O-N 3.13Å; D202-L204 PolarHBondContact OD1-N 3.38Å; D202-R205 PolarHBondContact N-O 3.21Å; D202-R205 WeakPolarHBondContact OD1-CB 3.32Å; D202-R205 PolarHBondContact OD1-N 3.06Å; D202-I235 WeakPolarHBondContact O-CB 3.24Å
203	D	97.8	Very high	98	Very high	38 Å²	38	35.8 Å²	35.8	20%	0.203	18%	0.175	C	C	.	.	S	Bend	trans	-60.8	-20.3	-176.4	-56.6	-38.4	0	0	0	114.1	Y184 H185 V234 I235	Y184-D203 HydrophobicContact CG-CB 4.42Å; H185-D203 IonicContact CD2-OD2 3.23Å; H185-D203 PolarHBondContact N-OD2 2.95Å; D203-V234 HydrophobicContact CB-CB 4.32Å; D203-V234 HydrophobicContact CB-CG1 4.42Å; D203-V234 CarbonylContact O-C 3.58Å; D203-V234 VanDerWaalsContact O-CA 3.29Å; D203-V234 WeakPolarHBondContact O-CA 3.21Å; D203-V234 WeakPolarHBondContact O-CB 3.4Å; D203-I235 PolarHBondContact O-N 2.84Å
204	L	98	Very high	98	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	18%	0.179	C	C	.	.	S	Bend	trans	-136.5	-11.7	-175.7	-64.7	177.6	0	0	0	114.8	Y184 D202 I223 K224 M228 L231 V234	Y184-L204 HydrophobicContact CD2-CB 4.02Å; Y184-L204 HydrophobicContact CD2-CD1 4.15Å; Y184-L204 HydrophobicContact CD2-CG 4.28Å; Y184-L204 HydrophobicContact CE1-CD1 4.13Å; Y184-L204 HydrophobicContact CE2-CB 4.03Å; Y184-L204 HydrophobicContact CE2-CD1 3.61Å; Y184-L204 HydrophobicContact CE2-CG 4.2Å; D202-L204 PolarHBondContact O-N 3.24Å; D202-L204 VanDerWaalsContact O-N 3.13Å; D202-L204 PolarHBondContact OD1-N 3.38Å; L204-I223 HydrophobicContact CB-CG1 4.35Å; L204-I223 HydrophobicContact CD2-CD1 4.1Å; L204-I223 HydrophobicContact CD2-CG1 3.9Å; L204-I223 WeakPolarHBondContact O-CG1 3.5Å; L204-I223 PolarHBondContact O-N 2.85Å; L204-K224 HydrophobicContact CB-CB 4.41Å; L204-K224 HydrophobicContact CD1-CB 4.27Å; L204-K224 HydrophobicContact CD1-CG 4.37Å; L204-M228 HydrophobicContact CD1-CE 4.29Å; L204-M228 HydrophobicContact CD1-SD 4.36Å; L204-L231 HydrophobicContact CD1-CD1 4.4Å; L204-L231 HydrophobicContact CD2-CD1 3.6Å; L204-V234 HydrophobicContact CD2-CG1 4.19Å
205	R	97.9	Very high	98	Very high	68 Å²	68	39.7 Å²	39.7	26%	0.257	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.8	-172.5	-72.2	179	174	-173.7	-9.1	112.9	A201 D202 V221 D222	A201-R205 CarbonylContact C-O 3.56Å; A201-R205 WeakPolarHBondContact CA-O 3.28Å; D202-R205 PolarHBondContact N-O 3.21Å; D202-R205 WeakPolarHBondContact OD1-CB 3.32Å; D202-R205 PolarHBondContact OD1-N 3.06Å; R205-V221 VanDerWaalsContact CA-O 3.27Å; R205-V221 WeakPolarHBondContact CA-O 3.35Å; R205-D222 HydrophobicContact CG-CB 4.25Å; R205-D222 WeakPolarHBondContact CG-OD1 3.5Å; R205-D222 IonicContact CZ-OD2 3.63Å; R205-D222 VanDerWaalsContact CZ-OD2 3.27Å; R205-D222 VanDerWaalsContact NE-CG 3.28Å; R205-D222 IonicContact NE-OD1 3.91Å; R205-D222 PolarHBondContact NE-OD1 2.83Å; R205-D222 VanDerWaalsContact NE-OD1 3.16Å; R205-D222 IonicContact NE-OD2 2.66Å; R205-D222 PolarHBondContact NE-OD2 2.84Å; R205-D222 IonicContact NH2-OD1 3.58Å; R205-D222 IonicContact NH2-OD2 2.96Å; R205-D222 PolarHBondContact NH2-OD2 2.94Å
206	I	98.6	Very high	98.1	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.4	168.8	-50.1	-179.1	0	0	0	108.7	L199 S200 A201 N219 I220 V221 I235 A238 F248 Y250	L199-I206 HydrophobicContact CB-CG2 4.05Å; L199-I206 HydrophobicContact CD1-CG2 4.34Å; L199-I206 HydrophobicContact CD2-CG2 4.34Å; L199-I206 HydrophobicContact CG-CG2 4.48Å; S200-I206 WeakPolarHBondContact O-CA 3.34Å; A201-I206 HydrophobicContact CB-CD1 4.42Å; A201-I206 HydrophobicContact CB-CG1 3.82Å; A201-I206 HydrophobicContact CB-CG2 4.46Å; I206-N219 PolarHBondContact O-ND2 2.78Å; I206-I220 HydrophobicContact CB-CG1 4.1Å; I206-I220 HydrophobicContact CG2-CD1 3.95Å; I206-I220 HydrophobicContact CG2-CG1 3.94Å; I206-I220 WeakPolarHBondContact O-CG1 3.44Å; I206-I220 PolarHBondContact O-N 2.82Å; I206-V221 HydrophobicContact CB-CB 3.93Å; I206-V221 HydrophobicContact CB-CG2 4.29Å; I206-V221 HydrophobicContact CD1-CB 4.12Å; I206-V221 HydrophobicContact CD1-CG1 4.47Å; I206-V221 HydrophobicContact CD1-CG2 4.07Å; I206-V221 HydrophobicContact CG1-CB 3.95Å; I206-V221 HydrophobicContact CG1-CG1 4.45Å; I206-V221 HydrophobicContact CG1-CG2 4.38Å; I206-V221 PolarHBondContact N-O 3.27Å; I206-V221 PolarHBondContact O-N 3.17Å; I206-I235 HydrophobicContact CD1-CD1 4.14Å; I206-I235 HydrophobicContact CG1-CD1 3.79Å; I206-A238 HydrophobicContact CD1-CB 4.03Å; I206-F248 HydrophobicContact CD1-CD2 4.47Å; I206-F248 HydrophobicContact CD1-CE2 3.88Å; I206-Y250 HydrophobicContact CD1-CD1 3.87Å; I206-Y250 HydrophobicContact CD1-CG 3.84Å
207	N	98.6	Very high	98.1	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.027	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.1	179.1	-64.5	-35.2	0	0	0	110	A181 H182 L199 S200 F218 N219	A181-N207 PolarHBondContact O-ND2 3.2Å; A181-N207 VanDerWaalsContact O-ND2 3.14Å; H182-N207 PolarHBondContact CE1-ND2 3.21Å; H182-N207 PolarHBondContact NE2-ND2 2.93Å; L199-N207 CarbonylContact C-O 3.59Å; L199-N207 VanDerWaalsContact CA-O 3.24Å; L199-N207 WeakPolarHBondContact CA-O 3.31Å; S200-N207 PolarHBondContact N-O 2.98Å; S200-N207 PolarHBondContact O-N 3.01Å; N207-F218 CarbonylContact C-O 3.54Å; N207-F218 WeakPolarHBondContact CA-O 3.39Å; N207-N219 WeakPolarHBondContact OD1-CA 3.2Å; N207-N219 WeakPolarHBondContact OD1-CB 3.33Å; N207-N219 PolarHBondContact OD1-ND2 2.9Å
208	L	98.5	Very high	98.1	Very high	30 Å²	30	43.3 Å²	43.3	16%	0.157	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.1	170.5	-173.5	73.3	0	0	0	109.9	S217 F218 I220 F240 M262	L208-S217 WeakPolarHBondContact O-CA 3.39Å; L208-F218 PolarHBondContact N-O 2.94Å; L208-F218 PolarHBondContact O-N 3.21Å; L208-I220 HydrophobicContact CB-CD1 4.42Å; L208-I220 HydrophobicContact CB-CG2 3.94Å; L208-F240 HydrophobicContact CD1-CE2 4.23Å; L208-F240 HydrophobicContact CD1-CZ 3.73Å; L208-M262 HydrophobicContact CD1-CE 4.15Å; L208-M262 HydrophobicContact CD2-CE 3.6Å; L208-M262 HydrophobicContact CG-CE 4.46Å
209	W	98.7	Very high	98	Very high	6 Å²	6	45.5 Å²	45.5	2%	0.023	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	152.1	-179.5	-60.3	86.9	0	0	0	110.6	I125 F178 A181 T197 Y198 S200	I125-W209 HydrophobicContact CD1-CZ2 4.4Å; F178-W209 HydrophobicContact CB-CD2 4.37Å; F178-W209 HydrophobicContact CB-CE3 3.99Å; F178-W209 HydrophobicContact CB-CH2 3.84Å; F178-W209 HydrophobicContact CB-CZ2 4.23Å; F178-W209 HydrophobicContact CB-CZ3 3.73Å; F178-W209 HydrophobicContact CD1-CD2 4.2Å; F178-W209 AromaticContact CD1-CE3 3.57Å; F178-W209 HydrophobicContact CD1-CE3 3.57Å; F178-W209 AromaticContact CD1-CZ3 3.96Å; F178-W209 HydrophobicContact CD1-CZ3 3.96Å; F178-W209 HydrophobicContact CE1-CE3 4.49Å; F178-W209 HydrophobicContact CG-CE3 4.2Å; F178-W209 HydrophobicContact CG-CZ3 4.35Å; A181-W209 HydrophobicContact CB-CH2 3.32Å; A181-W209 HydrophobicContact CB-CZ2 3.26Å; T197-W209 CarbonylContact C-O 3.25Å; T197-W209 WeakPolarHBondContact CA-O 3.42Å; T197-W209 WeakPolarHBondContact CB-O 3.36Å; Y198-W209 HydrophobicContact CD1-CB 3.71Å; Y198-W209 HydrophobicContact CE1-CB 3.29Å; Y198-W209 AromaticContact CE1-CG 3.86Å; Y198-W209 HydrophobicContact CE1-CG 3.86Å; Y198-W209 HydrophobicContact CE2-CB 4.19Å; Y198-W209 AromaticContact CE2-CD1 3.66Å; Y198-W209 HydrophobicContact CE2-CG 4.01Å; Y198-W209 HydrophobicContact CG-CB 4.34Å; Y198-W209 AromaticContact CZ-CD1 3.67Å; Y198-W209 AromaticContact CZ-CG 3.54Å; Y198-W209 PolarHBondContact N-O 2.85Å; Y198-W209 PolarHBondContact O-N 2.93Å; S200-W209 PolarHBondContact OG-NE1 3.48Å
210	H	98.6	Very high	97.9	Very high	57 Å²	57	45.7 Å²	45.7	26%	0.264	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	135	164	-171.8	-81.8	0	0	0	108.6	E212 I213	H210-E212 PolarHBondContact ND1-N 3.27Å; H210-E212 PolarHBondContact O-N 3.49Å; H210-I213 HydrophobicContact CB-CB 4.13Å; H210-I213 HydrophobicContact CB-CD1 4.09Å; H210-I213 HydrophobicContact CB-CG1 4.12Å; H210-I213 PolarHBondContact O-N 3.16Å; H210-I213 VanDerWaalsContact O-O 3.13Å
211	L	97.9	Very high	97.9	Very high	17 Å²	17	45.9 Å²	45.9	9%	0.089	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.6	-172.1	-69.6	166.3	0	0	0	113.8	L108 L118 F178 E196 Y198	L108-L211 HydrophobicContact CD2-CD1 3.89Å; L108-L211 HydrophobicContact CD2-CD2 4.18Å; L118-L211 HydrophobicContact CD1-CD2 4.34Å; F178-L211 WeakPolarHBondContact CZ-O 3.37Å; E196-L211 WeakPolarHBondContact O-CG 3.36Å; E196-L211 PolarHBondContact O-N 2.79Å; Y198-L211 HydrophobicContact CD1-CD2 3.46Å; Y198-L211 VanDerWaalsContact CD1-CD2 3.46Å; Y198-L211 HydrophobicContact CD1-CG 4.17Å; Y198-L211 HydrophobicContact CE1-CD2 4.01Å; Y198-L211 HydrophobicContact CG-CD2 4.33Å
212	E	97.7	Very high	97.8	Very high	148 Å²	148	49.3 Å²	49.3	69%	0.692	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-9.6	178.5	-55.8	-161.9	147.8	0	0	114.9	H210	H210-E212 PolarHBondContact ND1-N 3.27Å; H210-E212 PolarHBondContact O-N 3.49Å
213	I	98.1	Very high	97.7	Very high	61 Å²	61	51.5 Å²	51.5	31%	0.313	25%	0.251	S	S	.	.			trans	-115.9	114	-173.3	-56.2	178.3	0	0	0	109.4	F178 H210 D215 R216	F178-I213 WeakPolarHBondContact CE1-O 3.16Å; H210-I213 HydrophobicContact CB-CB 4.13Å; H210-I213 HydrophobicContact CB-CD1 4.09Å; H210-I213 HydrophobicContact CB-CG1 4.12Å; H210-I213 PolarHBondContact O-N 3.16Å; H210-I213 VanDerWaalsContact O-O 3.13Å; I213-D215 WeakPolarHBondContact CG2-OD1 3.48Å; I213-R216 HydrophobicContact CG2-CB 4.43Å
214	T	97.8	Very high	97.6	Very high	53 Å²	53	53.9 Å²	53.9	33%	0.325	26%	0.259	S	S	.	.			trans	-106.1	-16.1	-173.6	56.7	0	0	0	0	114.3	R176 I177 F178	R176-T214 HydrophobicContact CB-CG2 3.75Å; R176-T214 HydrophobicContact CG-CG2 4.14Å; I177-T214 WeakPolarHBondContact O-CB 3.27Å; I177-T214 WeakPolarHBondContact O-CG2 3.12Å; F178-T214 HydrophobicContact CD1-CG2 3.86Å; F178-T214 HydrophobicContact CE1-CG2 3.79Å; F178-T214 HydrophobicContact CG-CG2 4.4Å; F178-T214 HydrophobicContact CZ-CG2 4.28Å
215	D	96.1	Very high	97.4	Very high	117 Å²	117	55 Å²	55	63%	0.626	27%	0.267	S	S	*	.	S	Bend	trans	-87.8	-10.8	-174.1	65.8	-39.8	0	0	0	113.2	I213	I213-D215 WeakPolarHBondContact CG2-OD1 3.48Å
216	R	96.4	Very high	97.3	Very high	165 Å²	165	57.3 Å²	57.3	62%	0.623	30%	0.3	S	S	*	.			trans	-144.4	140.7	-176.4	-69.8	170.1	-74	167.9	4.1	110.7	I213	I213-R216 HydrophobicContact CG2-CB 4.43Å
217	S	97.6	Very high	97.1	Very high	46 Å²	46	60.4 Å²	60.4	32%	0.322	32%	0.317	S	S	.	.			trans	-130.1	160	165.7	65.6	0	0	0	0	109.1	L208	L208-S217 WeakPolarHBondContact O-CA 3.39Å
218	F	97.8	Very high	96.8	Very high	97 Å²	97	64 Å²	64	43%	0.425	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.3	176.8	179.3	-120.6	0	0	0	109.7	N207 L208 I220 A266 L267	N207-F218 CarbonylContact C-O 3.54Å; N207-F218 WeakPolarHBondContact CA-O 3.39Å; L208-F218 PolarHBondContact N-O 2.94Å; L208-F218 PolarHBondContact O-N 3.21Å; F218-I220 HydrophobicContact CD1-CG2 3.41Å; F218-I220 VanDerWaalsContact CD1-CG2 3.41Å; F218-I220 HydrophobicContact CE1-CG2 3.62Å; F218-I220 HydrophobicContact CG-CG2 4.44Å; F218-I220 PolarHBondContact O-N 3.03Å; F218-A266 VanDerWaalsContact CE1-O 3.28Å; F218-A266 WeakPolarHBondContact CE1-O 3.38Å; F218-L267 HydrophobicContact CE2-CD2 4.32Å; F218-L267 HydrophobicContact CZ-CD2 3.84Å
219	N	97.5	Very high	96.6	Very high	46 Å²	46	70.7 Å²	70.7	25%	0.246	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	117.7	175.8	-179.8	-101	0	0	0	109.8	I206 N207 V221	I206-N219 PolarHBondContact O-ND2 2.78Å; N207-N219 WeakPolarHBondContact OD1-CA 3.2Å; N207-N219 WeakPolarHBondContact OD1-CB 3.33Å; N207-N219 PolarHBondContact OD1-ND2 2.9Å; N219-V221 PolarHBondContact ND2-O 2.65Å; N219-V221 PolarHBondContact OD1-O 3.28Å
220	I	97.4	Very high	96.4	Very high	3 Å²	3	76.5 Å²	76.5	2%	0.015	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-21.8	-177.7	56.8	172.2	0	0	0	112.7	I206 L208 F218 F248 C268	I206-I220 HydrophobicContact CB-CG1 4.1Å; I206-I220 HydrophobicContact CG2-CD1 3.95Å; I206-I220 HydrophobicContact CG2-CG1 3.94Å; I206-I220 WeakPolarHBondContact O-CG1 3.44Å; I206-I220 PolarHBondContact O-N 2.82Å; L208-I220 HydrophobicContact CB-CD1 4.42Å; L208-I220 HydrophobicContact CB-CG2 3.94Å; F218-I220 HydrophobicContact CD1-CG2 3.41Å; F218-I220 VanDerWaalsContact CD1-CG2 3.41Å; F218-I220 HydrophobicContact CE1-CG2 3.62Å; F218-I220 HydrophobicContact CG-CG2 4.44Å; F218-I220 PolarHBondContact O-N 3.03Å; I220-F248 HydrophobicContact CD1-CD1 4.38Å; I220-F248 HydrophobicContact CD1-CE1 3.72Å; I220-F248 HydrophobicContact CD1-CE2 4.37Å; I220-F248 HydrophobicContact CD1-CZ 3.71Å; I220-F248 HydrophobicContact CG1-CZ 4.33Å; I220-C268 WeakPolarHBondContact O-CA 3.47Å; I220-C268 VanDerWaalsContact O-CB 3.31Å; I220-C268 WeakPolarHBondContact O-CB 3.34Å; I220-C268 PolarHBondContact O-N 3.03Å
221	V	97.8	Very high	96.2	Very high	5 Å²	5	76.9 Å²	76.9	3%	0.03	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	132.8	174.2	178.1	0	0	0	0	108.7	R205 I206 N219 I223 I235 F248 Y250 C268	R205-V221 VanDerWaalsContact CA-O 3.27Å; R205-V221 WeakPolarHBondContact CA-O 3.35Å; I206-V221 HydrophobicContact CB-CB 3.93Å; I206-V221 HydrophobicContact CB-CG2 4.29Å; I206-V221 HydrophobicContact CD1-CB 4.12Å; I206-V221 HydrophobicContact CD1-CG1 4.47Å; I206-V221 HydrophobicContact CD1-CG2 4.07Å; I206-V221 HydrophobicContact CG1-CB 3.95Å; I206-V221 HydrophobicContact CG1-CG1 4.45Å; I206-V221 HydrophobicContact CG1-CG2 4.38Å; I206-V221 PolarHBondContact N-O 3.27Å; I206-V221 PolarHBondContact O-N 3.17Å; N219-V221 PolarHBondContact ND2-O 2.65Å; N219-V221 PolarHBondContact OD1-O 3.28Å; V221-I223 HydrophobicContact CG1-CG2 3.97Å; V221-I235 HydrophobicContact CG1-CD1 4.31Å; V221-F248 HydrophobicContact CG2-CE2 3.99Å; V221-F248 HydrophobicContact CG2-CZ 3.75Å; V221-Y250 HydrophobicContact CG1-CE1 4.16Å; V221-Y250 HydrophobicContact CG2-CE1 4.25Å; V221-C268 HydrophobicContact CG2-CB 3.92Å
222	D	96.4	Very high	96.1	Very high	71 Å²	71	80.4 Å²	80.4	38%	0.38	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	106.2	169.9	-165.4	-0.5	0	0	0	108.7	R205 K224	R205-D222 HydrophobicContact CG-CB 4.25Å; R205-D222 WeakPolarHBondContact CG-OD1 3.5Å; R205-D222 IonicContact CZ-OD2 3.63Å; R205-D222 VanDerWaalsContact CZ-OD2 3.27Å; R205-D222 VanDerWaalsContact NE-CG 3.28Å; R205-D222 IonicContact NE-OD1 3.91Å; R205-D222 PolarHBondContact NE-OD1 2.83Å; R205-D222 VanDerWaalsContact NE-OD1 3.16Å; R205-D222 IonicContact NE-OD2 2.66Å; R205-D222 PolarHBondContact NE-OD2 2.84Å; R205-D222 IonicContact NH2-OD1 3.58Å; R205-D222 IonicContact NH2-OD2 2.96Å; R205-D222 PolarHBondContact NH2-OD2 2.94Å; D222-K224 WeakPolarHBondContact OD1-CB 3.28Å; D222-K224 PolarHBondContact OD1-N 2.94Å; D222-K224 VanDerWaalsContact OD1-N 3.15Å
223	I	95.8	Very high	96	Very high	46 Å²	46	75 Å²	75	24%	0.236	39%	0.393	C	S	.	.			trans	-98.7	10.8	175.8	65.7	159.4	0	0	0	112.1	L204 V221 P225 I235	L204-I223 HydrophobicContact CB-CG1 4.35Å; L204-I223 HydrophobicContact CD2-CD1 4.1Å; L204-I223 HydrophobicContact CD2-CG1 3.9Å; L204-I223 WeakPolarHBondContact O-CG1 3.5Å; L204-I223 PolarHBondContact O-N 2.85Å; V221-I223 HydrophobicContact CG1-CG2 3.97Å; I223-P225 WeakPolarHBondContact O-CD 3.42Å; I223-I235 HydrophobicContact CD1-CD1 4.33Å; I223-I235 HydrophobicContact CD1-CG1 3.67Å; I223-I235 HydrophobicContact CG1-CD1 4.19Å; I223-I235 HydrophobicContact CG1-CG1 4.08Å
224	K	95.9	Very high	96	Very high	88 Å²	88	73.9 Å²	73.9	38%	0.383	39%	0.389	S	S	.	.			trans	-59.7	123.3	178.6	176.2	172.7	175	143.7	0	110.5	Y184 L204 D222 M228	Y184-K224 PolarHBondContact OH-NZ 2.67Å; L204-K224 HydrophobicContact CB-CB 4.41Å; L204-K224 HydrophobicContact CD1-CB 4.27Å; L204-K224 HydrophobicContact CD1-CG 4.37Å; D222-K224 WeakPolarHBondContact OD1-CB 3.28Å; D222-K224 PolarHBondContact OD1-N 2.94Å; D222-K224 VanDerWaalsContact OD1-N 3.15Å; K224-M228 HydrophobicContact CG-SD 4.32Å
225	P	94.9	Very high	96	Very high	27 Å²	27	71.3 Å²	71.3	18%	0.175	37%	0.373	C	S	.	.			trans	-68.6	154.9	174.7	31.4	-36.8	0	0	0	110.7	I223 N227 E230 L231	I223-P225 WeakPolarHBondContact O-CD 3.42Å; P225-N227 VanDerWaalsContact C-N 3.26Å; P225-N227 WeakPolarHBondContact CB-O 3.43Å; P225-N227 VanDerWaalsContact CG-O 3.26Å; P225-N227 WeakPolarHBondContact CG-O 3.35Å; P225-N227 PolarHBondContact O-N 2.86Å; P225-E230 HydrophobicContact CB-CB 4.49Å; P225-L231 HydrophobicContact CG-CB 4.19Å; P225-L231 HydrophobicContact CG-CD1 4.31Å
226	A	94.3	Very high	96.1	Very high	115 Å²	115	66.3 Å²	66.3	95%	0.95	35%	0.347	S	S	*	.	S	Bend	trans	-61.1	-39.4	175.6	0	0	0	0	0	111.5
227	N	94.9	Very high	96.2	Very high	65 Å²	65	58.7 Å²	58.7	35%	0.348	32%	0.319	S	S	.	.	S	Bend	trans	-108.5	123.5	169.9	-174.5	1.1	0	0	0	109.9	P225 E229 E230	P225-N227 VanDerWaalsContact C-N 3.26Å; P225-N227 WeakPolarHBondContact CB-O 3.43Å; P225-N227 VanDerWaalsContact CG-O 3.26Å; P225-N227 WeakPolarHBondContact CG-O 3.35Å; P225-N227 PolarHBondContact O-N 2.86Å; N227-E229 PolarHBondContact ND2-OE2 2.97Å; N227-E229 PolarHBondContact O-N 2.71Å; N227-E229 PolarHBondContact OD1-N 2.84Å; N227-E230 HydrophobicContact CB-CG 4.15Å; N227-E230 WeakPolarHBondContact O-CB 3.21Å; N227-E230 PolarHBondContact O-N 3.14Å
228	M	93.6	Very high	96.3	Very high	80 Å²	80	56.8 Å²	56.8	39%	0.394	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-63.6	-21.8	177.7	-75	-63.2	-54.9	0	0	113.2	Y184 L204 K224 E230 L231	Y184-M228 HydrophobicContact CE1-CE 4.39Å; Y184-M228 PolarHBondContact OH-SD 2.89Å; L204-M228 HydrophobicContact CD1-CE 4.29Å; L204-M228 HydrophobicContact CD1-SD 4.36Å; K224-M228 HydrophobicContact CG-SD 4.32Å; M228-E230 PolarHBondContact O-N 2.82Å; M228-L231 HydrophobicContact CE-CD2 4.02Å; M228-L231 WeakPolarHBondContact O-CB 3.17Å; M228-L231 PolarHBondContact O-N 2.87Å
229	E	94	Very high	96.3	Very high	171 Å²	171	53.5 Å²	53.5	80%	0.799	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-68.7	-20.8	174.1	-61.4	175.9	159.3	0	0	112.7	N227 L231	N227-E229 PolarHBondContact ND2-OE2 2.97Å; N227-E229 PolarHBondContact O-N 2.71Å; N227-E229 PolarHBondContact OD1-N 2.84Å; E229-L231 VanDerWaalsContact C-N 3.27Å
230	E	94	Very high	96.4	Very high	129 Å²	129	51.6 Å²	51.6	60%	0.603	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-90.4	11.2	176.4	-62	176.9	-179.3	0	0	112.3	P225 N227 M228 T232	P225-E230 HydrophobicContact CB-CB 4.49Å; N227-E230 HydrophobicContact CB-CG 4.15Å; N227-E230 WeakPolarHBondContact O-CB 3.21Å; N227-E230 PolarHBondContact O-N 3.14Å; M228-E230 PolarHBondContact O-N 2.82Å; E230-T232 PolarHBondContact O-N 3.02Å; E230-T232 VanDerWaalsContact O-N 3.1Å
231	L	95.3	Very high	96.5	Very high	64 Å²	64	51.9 Å²	51.9	34%	0.335	28%	0.283	S	S	.	.			trans	-65.4	113.1	177.9	179.3	64	0	0	0	110.1	L204 P225 M228 E229 E233 V234	L204-L231 HydrophobicContact CD1-CD1 4.4Å; L204-L231 HydrophobicContact CD2-CD1 3.6Å; P225-L231 HydrophobicContact CG-CB 4.19Å; P225-L231 HydrophobicContact CG-CD1 4.31Å; M228-L231 HydrophobicContact CE-CD2 4.02Å; M228-L231 WeakPolarHBondContact O-CB 3.17Å; M228-L231 PolarHBondContact O-N 2.87Å; E229-L231 VanDerWaalsContact C-N 3.27Å; L231-E233 VanDerWaalsContact CD1-O 3.28Å; L231-E233 WeakPolarHBondContact CD1-O 3.39Å; L231-V234 HydrophobicContact CD1-CG1 4.19Å; L231-V234 HydrophobicContact CD2-CG1 4.2Å; L231-V234 HydrophobicContact CG-CG1 4.49Å
232	T	94.4	Very high	96.4	Very high	91 Å²	91	54.1 Å²	54.1	56%	0.558	30%	0.298	S	S	*	.			trans	-117.3	-15.3	177.1	66	0	0	0	0	113.5	E230 K254	E230-T232 PolarHBondContact O-N 3.02Å; E230-T232 VanDerWaalsContact O-N 3.1Å; T232-K254 VanDerWaalsContact CB-NZ 3.34Å; T232-K254 WeakPolarHBondContact O-CE 3.4Å; T232-K254 PolarHBondContact OG1-NZ 3.18Å
233	E	95.6	Very high	96.5	Very high	34 Å²	34	56.6 Å²	56.6	16%	0.159	31%	0.307	C	S	.	.			trans	-144	136.1	-170.7	-174.3	174.3	-163.4	0	0	110.2	L231 S252 K254 T256 R258	L231-E233 VanDerWaalsContact CD1-O 3.28Å; L231-E233 WeakPolarHBondContact CD1-O 3.39Å; E233-S252 WeakPolarHBondContact OE1-CB 3.5Å; E233-S252 PolarHBondContact OE1-OG 2.65Å; E233-K254 HydrophobicContact CB-CD 4.32Å; E233-K254 HydrophobicContact CB-CG 4.39Å; E233-K254 HydrophobicContact CG-CD 4.46Å; E233-K254 HydrophobicContact CG-CG 4.25Å; E233-T256 PolarHBondContact OE1-OG1 2.75Å; E233-R258 VanDerWaalsContact CD-NH2 3.33Å; E233-R258 IonicContact OE1-CZ 2.87Å; E233-R258 IonicContact OE1-NH1 3.82Å; E233-R258 PolarHBondContact OE1-NH1 3.13Å; E233-R258 IonicContact OE1-NH2 2.93Å; E233-R258 PolarHBondContact OE1-NH2 3.1Å; E233-R258 IonicContact OE2-CZ 2.73Å; E233-R258 IonicContact OE2-NH1 3.02Å; E233-R258 IonicContact OE2-NH2 3.79Å; E233-R258 PolarHBondContact OE2-NH2 3.18Å
234	V	97.9	Very high	96.6	Very high	38 Å²	38	59 Å²	59	23%	0.23	32%	0.317	C	S	.	.			trans	-125.5	150.9	173.7	-63.1	0	0	0	0	110.6	D203 L204 L231 T236 S252 S253	D203-V234 HydrophobicContact CB-CB 4.32Å; D203-V234 HydrophobicContact CB-CG1 4.42Å; D203-V234 CarbonylContact O-C 3.58Å; D203-V234 VanDerWaalsContact O-CA 3.29Å; D203-V234 WeakPolarHBondContact O-CA 3.21Å; D203-V234 WeakPolarHBondContact O-CB 3.4Å; L204-V234 HydrophobicContact CD2-CG1 4.19Å; L231-V234 HydrophobicContact CD1-CG1 4.19Å; L231-V234 HydrophobicContact CD2-CG1 4.2Å; L231-V234 HydrophobicContact CG-CG1 4.49Å; V234-T236 HydrophobicContact CG2-CG2 4.41Å; V234-S252 CarbonylContact O-C 3.57Å; V234-S252 WeakPolarHBondContact O-CA 3.47Å; V234-S252 VanDerWaalsContact O-CB 3.29Å; V234-S252 WeakPolarHBondContact O-CB 3.3Å; V234-S253 PolarHBondContact N-OG 3.22Å; V234-S253 VanDerWaalsContact N-OG 3.17Å; V234-S253 PolarHBondContact O-N 3.06Å
235	I	98.6	Very high	96.7	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	131.5	171.1	-59.9	174.6	0	0	0	108.3	N187 A201 D202 D203 I206 V221 I223 Y250 S251	N187-I235 PolarHBondContact ND2-O 3.05Å; N187-I235 VanDerWaalsContact ND2-O 3.13Å; A201-I235 HydrophobicContact CB-CG2 4.28Å; D202-I235 WeakPolarHBondContact O-CB 3.24Å; D203-I235 PolarHBondContact O-N 2.84Å; I206-I235 HydrophobicContact CD1-CD1 4.14Å; I206-I235 HydrophobicContact CG1-CD1 3.79Å; V221-I235 HydrophobicContact CG1-CD1 4.31Å; I223-I235 HydrophobicContact CD1-CD1 4.33Å; I223-I235 HydrophobicContact CD1-CG1 3.67Å; I223-I235 HydrophobicContact CG1-CD1 4.19Å; I223-I235 HydrophobicContact CG1-CG1 4.08Å; I235-Y250 HydrophobicContact CD1-CD2 4.24Å; I235-Y250 HydrophobicContact CD1-CE2 4.44Å; I235-Y250 HydrophobicContact CG1-CD2 3.88Å; I235-Y250 HydrophobicContact CG1-CE2 4.16Å; I235-Y250 HydrophobicContact CG2-CD2 4.31Å; I235-S251 WeakPolarHBondContact CA-O 3.5Å
236	T	98.6	Very high	96.8	Very high	11 Å²	11	56.4 Å²	56.4	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-31.5	-176.3	53.7	0	0	0	0	113.9	V234 S251 I294	V234-T236 HydrophobicContact CG2-CG2 4.41Å; T236-S251 PolarHBondContact N-O 2.99Å; T236-S251 PolarHBondContact OG1-O 2.79Å; T236-S251 PolarHBondContact OG1-OG 3.12Å; T236-I294 WeakPolarHBondContact CB-O 3.29Å; T236-I294 PolarHBondContact OG1-O 2.97Å
237	A	98.7	Very high	97	Very high	5 Å²	5	51.3 Å²	51.3	4%	0.041	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	151.3	174.6	0	0	0	0	0	110.3	S188 Y250 S251 V297	S188-A237 VanDerWaalsContact OG-CA 3.32Å; S188-A237 WeakPolarHBondContact OG-CA 3.33Å; A237-Y250 CarbonylContact O-C 3.59Å; A237-Y250 WeakPolarHBondContact O-CA 3.45Å; A237-Y250 WeakPolarHBondContact O-CB 3.48Å; A237-S251 PolarHBondContact N-OG 2.84Å; A237-S251 PolarHBondContact O-N 3.34Å; A237-V297 HydrophobicContact CB-CB 4.35Å; A237-V297 HydrophobicContact CB-CG2 4.17Å
238	A	98.8	Very high	97.2	Very high	7 Å²	7	48.2 Å²	48.2	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	141.7	173	0	0	0	0	0	111.9	S188 L199 A201 I206 V249	S188-A238 WeakPolarHBondContact CB-O 3.3Å; S188-A238 PolarHBondContact OG-N 2.97Å; L199-A238 HydrophobicContact CD1-CB 4.06Å; A201-A238 HydrophobicContact CB-CB 3.72Å; I206-A238 HydrophobicContact CD1-CB 4.03Å; A238-V249 CarbonylContact C-O 3.57Å; A238-V249 VanDerWaalsContact CA-O 3.23Å; A238-V249 WeakPolarHBondContact CA-O 3.46Å
239	E	98.7	Very high	97.4	Very high	27 Å²	27	44.4 Å²	44.4	13%	0.126	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	140.4	-179.1	-161.1	174.1	-127.9	0	0	111.9	S190 F248 V249 K298 F299	S190-E239 WeakPolarHBondContact OG-CG 3.45Å; E239-F248 CarbonylContact O-C 3.58Å; E239-F248 VanDerWaalsContact O-CA 3.31Å; E239-F248 WeakPolarHBondContact O-CA 3.38Å; E239-F248 WeakPolarHBondContact O-CB 3.26Å; E239-V249 PolarHBondContact N-O 2.88Å; E239-V249 PolarHBondContact O-N 3.29Å; E239-K298 WeakPolarHBondContact OE1-CD 3.39Å; E239-K298 IonicContact OE1-NZ 2.89Å; E239-K298 PolarHBondContact OE1-NZ 3.02Å; E239-K298 VanDerWaalsContact OE2-CA 3.25Å; E239-K298 WeakPolarHBondContact OE2-CA 3.16Å; E239-F299 HydrophobicContact CB-CD2 4.41Å; E239-F299 HydrophobicContact CG-CD2 4.43Å; E239-F299 PolarHBondContact OE2-N 3.4Å
240	F	98.8	Very high	97.6	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	148.6	168.8	-89.3	-62.5	0	0	0	111.7	S190 N192 L199 L208 F248 M262 F299	S190-F240 WeakPolarHBondContact O-CD2 3.42Å; S190-F240 PolarHBondContact OG-N 2.9Å; N192-F240 HydrophobicContact CB-CD2 3.87Å; N192-F240 HydrophobicContact CB-CE2 3.8Å; N192-F240 HydrophobicContact CB-CG 4.28Å; N192-F240 HydrophobicContact CB-CZ 4.18Å; L199-F240 HydrophobicContact CB-CD2 4.25Å; L199-F240 HydrophobicContact CB-CE2 3.57Å; L199-F240 HydrophobicContact CB-CZ 4.08Å; L199-F240 HydrophobicContact CD2-CD1 4.21Å; L199-F240 HydrophobicContact CD2-CD2 3.61Å; L199-F240 HydrophobicContact CD2-CE1 4.11Å; L199-F240 HydrophobicContact CD2-CE2 3.52Å; L199-F240 HydrophobicContact CD2-CG 3.95Å; L199-F240 HydrophobicContact CD2-CZ 3.77Å; L199-F240 HydrophobicContact CG-CD2 3.64Å; L199-F240 HydrophobicContact CG-CE2 3.49Å; L199-F240 VanDerWaalsContact CG-CE2 3.49Å; L199-F240 HydrophobicContact CG-CG 4.45Å; L199-F240 HydrophobicContact CG-CZ 4.17Å; L208-F240 HydrophobicContact CD1-CE2 4.23Å; L208-F240 HydrophobicContact CD1-CZ 3.73Å; F240-F248 HydrophobicContact CD1-CB 3.67Å; F240-F248 HydrophobicContact CE1-CB 3.99Å; F240-F248 HydrophobicContact CE1-CD1 4.27Å; F240-F248 HydrophobicContact CE1-CG 4.46Å; F240-F248 HydrophobicContact CG-CB 4.32Å; F240-M262 HydrophobicContact CE1-SD 3.79Å; F240-M262 HydrophobicContact CZ-SD 4.22Å; F240-F299 VanDerWaalsContact O-CD2 3.29Å; F240-F299 WeakPolarHBondContact O-CD2 3.4Å
241	H	98.7	Very high	97.8	Very high	9 Å²	9	30.5 Å²	30.5	4%	0.042	17%	0.165	C	C	.	.			trans	-65.7	136.1	170.5	-175	-80.5	0	0	0	110.2	H243 Q244 V247 F299 G303	H241-H243 PolarHBondContact ND1-N 2.98Å; H241-H243 PolarHBondContact O-N 3.4Å; H241-H243 VanDerWaalsContact O-N 3.12Å; H241-Q244 HydrophobicContact CB-CB 4.11Å; H241-Q244 WeakPolarHBondContact ND1-CB 3.33Å; H241-Q244 PolarHBondContact ND1-N 2.75Å; H241-V247 HydrophobicContact CB-CB 3.87Å; H241-V247 HydrophobicContact CB-CG1 4.02Å; H241-V247 VanDerWaalsContact CB-O 3.29Å; H241-V247 WeakPolarHBondContact CB-O 3.44Å; H241-V247 PolarHBondContact N-O 3.46Å; H241-F299 HydrophobicContact CB-CE2 4.1Å; H241-F299 HydrophobicContact CB-CZ 4.1Å; H241-F299 AromaticContact CD2-CE1 3.77Å; H241-G303 WeakPolarHBondContact NE2-CA 3.45Å; H241-G303 PolarHBondContact NE2-O 3.28Å
242	P	97.4	Very high	98	Very high	52 Å²	52	27.5 Å²	27.5	34%	0.338	15%	0.15	S	C	.	.	S	Bend	trans	-63.1	-25.6	-172	22.2	-34.1	0	0	0	114.4	S193 F299	S193-P242 WeakPolarHBondContact CB-O 2.99Å; P242-F299 HydrophobicContact CG-CB 4.27Å
243	H	97.6	Very high	98.1	Very high	123 Å²	123	24.5 Å²	24.5	57%	0.569	13%	0.133	S	C	*	.	S	Bend	trans	-122.3	-11.8	-175.6	-52.9	-64.1	0	0	0	115.5	H241 H301	H241-H243 PolarHBondContact ND1-N 2.98Å; H241-H243 PolarHBondContact O-N 3.4Å; H241-H243 VanDerWaalsContact O-N 3.12Å; H243-H301 PolarHBondContact NE2-O 3.31Å
244	Q	98	Very high	98.1	Very high	96 Å²	96	26.4 Å²	26.4	45%	0.449	14%	0.14	S	C	.	.			trans	-119.4	100.5	-169.9	-69.5	-175.9	-3.7	0	0	108.2	H241 N246 V247	H241-Q244 HydrophobicContact CB-CB 4.11Å; H241-Q244 WeakPolarHBondContact ND1-CB 3.33Å; H241-Q244 PolarHBondContact ND1-N 2.75Å; Q244-N246 PolarHBondContact O-N 2.85Å; Q244-V247 HydrophobicContact CB-CB 4.1Å; Q244-V247 HydrophobicContact CB-CG2 4.1Å; Q244-V247 PolarHBondContact O-N 3.39Å; Q244-V247 VanDerWaalsContact OE1-CG2 3.32Å
245	C	97.6	Very high	98	Very high	47 Å²	47	25.5 Å²	25.5	32%	0.318	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.7	-170.1	62.2	0	0	0	0	115.4	N192 S193 D194	N192-C245 PolarHBondContact ND2-O 2.88Å; N192-C245 WeakPolarHBondContact OD1-CA 3.42Å; N192-C245 VanDerWaalsContact OD1-CB 3.27Å; N192-C245 WeakPolarHBondContact OD1-CB 3.26Å; N192-C245 PolarHBondContact OD1-O 2.9Å; S193-C245 VanDerWaalsContact OG-CA 3.29Å; S193-C245 WeakPolarHBondContact OG-CA 3.4Å; S193-C245 PolarHBondContact OG-N 2.83Å; D194-C245 HydrophobicContact CB-CB 4.12Å
246	N	97.5	Very high	97.9	Very high	14 Å²	14	25.8 Å²	25.8	8%	0.075	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-7.2	179.7	59.2	-69.1	0	0	0	113.9	Q244 D261 M262 R263	Q244-N246 PolarHBondContact O-N 2.85Å; N246-D261 VanDerWaalsContact ND2-CG 3.32Å; N246-D261 PolarHBondContact ND2-OD1 2.93Å; N246-D261 WeakPolarHBondContact O-CA 3.39Å; N246-M262 HydrophobicContact CB-CB 4.36Å; N246-M262 WeakPolarHBondContact O-CB 3.29Å; N246-M262 WeakPolarHBondContact O-CG 3.44Å; N246-M262 PolarHBondContact O-N 3.37Å; N246-R263 HydrophobicContact CB-CG 3.7Å; N246-R263 VanDerWaalsContact OD1-CZ 3.24Å; N246-R263 PolarHBondContact OD1-NH2 3.28Å
247	V	98.1	Very high	97.9	Very high	8 Å²	8	25.2 Å²	25.2	5%	0.048	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.5	-173.1	178.1	0	0	0	0	110.5	H241 Q244 L259 C260	H241-V247 HydrophobicContact CB-CB 3.87Å; H241-V247 HydrophobicContact CB-CG1 4.02Å; H241-V247 VanDerWaalsContact CB-O 3.29Å; H241-V247 WeakPolarHBondContact CB-O 3.44Å; H241-V247 PolarHBondContact N-O 3.46Å; Q244-V247 HydrophobicContact CB-CB 4.1Å; Q244-V247 HydrophobicContact CB-CG2 4.1Å; Q244-V247 PolarHBondContact O-N 3.39Å; Q244-V247 VanDerWaalsContact OE1-CG2 3.32Å; V247-L259 HydrophobicContact CG1-CD1 4.06Å; V247-L259 HydrophobicContact CG1-CD2 3.79Å; V247-L259 HydrophobicContact CG1-CG 3.83Å; V247-C260 WeakPolarHBondContact CA-O 3.36Å
248	F	98.6	Very high	97.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	162.5	169.5	70.1	-85.4	0	0	0	110.1	L199 I206 I220 V221 E239 F240 Y250 L259 C260 M262 C268	L199-F248 HydrophobicContact CD2-CB 3.9Å; L199-F248 HydrophobicContact CD2-CD2 4.13Å; L199-F248 HydrophobicContact CD2-CG 4.06Å; I206-F248 HydrophobicContact CD1-CD2 4.47Å; I206-F248 HydrophobicContact CD1-CE2 3.88Å; I220-F248 HydrophobicContact CD1-CD1 4.38Å; I220-F248 HydrophobicContact CD1-CE1 3.72Å; I220-F248 HydrophobicContact CD1-CE2 4.37Å; I220-F248 HydrophobicContact CD1-CZ 3.71Å; I220-F248 HydrophobicContact CG1-CZ 4.33Å; V221-F248 HydrophobicContact CG2-CE2 3.99Å; V221-F248 HydrophobicContact CG2-CZ 3.75Å; E239-F248 CarbonylContact O-C 3.58Å; E239-F248 VanDerWaalsContact O-CA 3.31Å; E239-F248 WeakPolarHBondContact O-CA 3.38Å; E239-F248 WeakPolarHBondContact O-CB 3.26Å; F240-F248 HydrophobicContact CD1-CB 3.67Å; F240-F248 HydrophobicContact CE1-CB 3.99Å; F240-F248 HydrophobicContact CE1-CD1 4.27Å; F240-F248 HydrophobicContact CE1-CG 4.46Å; F240-F248 HydrophobicContact CG-CB 4.32Å; F248-Y250 HydrophobicContact CE2-CD1 4.13Å; F248-L259 WeakPolarHBondContact O-CA 3.28Å; F248-C260 HydrophobicContact CD1-CB 3.96Å; F248-C260 HydrophobicContact CD2-CB 4.34Å; F248-C260 HydrophobicContact CE1-CB 3.42Å; F248-C260 VanDerWaalsContact CE1-CB 3.42Å; F248-C260 HydrophobicContact CE2-CB 3.84Å; F248-C260 HydrophobicContact CG-CB 4.39Å; F248-C260 HydrophobicContact CZ-CB 3.35Å; F248-C260 PolarHBondContact N-O 3.31Å; F248-C260 PolarHBondContact O-N 3Å; F248-M262 HydrophobicContact CD1-CG 3.98Å; F248-M262 HydrophobicContact CD1-SD 4.06Å; F248-M262 HydrophobicContact CE1-CG 3.75Å; F248-M262 HydrophobicContact CE1-SD 4.22Å; F248-C268 HydrophobicContact CE1-CB 4.28Å; F248-C268 HydrophobicContact CZ-CB 3.94Å
249	V	98.6	Very high	97.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	154.2	173.2	-69	0	0	0	0	110.5	A238 E239 I257 R258 L259 V297 F299 M306	A238-V249 CarbonylContact C-O 3.57Å; A238-V249 VanDerWaalsContact CA-O 3.23Å; A238-V249 WeakPolarHBondContact CA-O 3.46Å; E239-V249 PolarHBondContact N-O 2.88Å; E239-V249 PolarHBondContact O-N 3.29Å; V249-I257 HydrophobicContact CB-CG2 4.01Å; V249-I257 HydrophobicContact CG1-CG2 4.26Å; V249-R258 CarbonylContact C-O 3.56Å; V249-R258 VanDerWaalsContact CA-O 3.25Å; V249-R258 WeakPolarHBondContact CA-O 3.24Å; V249-L259 HydrophobicContact CG1-CB 3.76Å; V249-L259 HydrophobicContact CG1-CD1 4.14Å; V249-L259 HydrophobicContact CG1-CG 3.94Å; V249-V297 HydrophobicContact CG2-CG1 3.61Å; V249-F299 HydrophobicContact CB-CE2 4.36Å; V249-F299 HydrophobicContact CB-CZ 4.19Å; V249-F299 HydrophobicContact CG1-CE1 4.22Å; V249-F299 HydrophobicContact CG1-CE2 4.16Å; V249-F299 HydrophobicContact CG1-CZ 3.51Å; V249-F299 HydrophobicContact CG2-CD2 4.28Å; V249-F299 HydrophobicContact CG2-CE2 3.55Å; V249-F299 HydrophobicContact CG2-CZ 3.78Å; V249-M306 HydrophobicContact CG1-SD 4.08Å
250	Y	98.7	Very high	97.8	Very high	9 Å²	9	25.4 Å²	25.4	4%	0.035	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.5	160.4	69.1	-85.3	0	0	0	110.8	I206 V221 I235 A237 F248 R258	I206-Y250 HydrophobicContact CD1-CD1 3.87Å; I206-Y250 HydrophobicContact CD1-CG 3.84Å; V221-Y250 HydrophobicContact CG1-CE1 4.16Å; V221-Y250 HydrophobicContact CG2-CE1 4.25Å; I235-Y250 HydrophobicContact CD1-CD2 4.24Å; I235-Y250 HydrophobicContact CD1-CE2 4.44Å; I235-Y250 HydrophobicContact CG1-CD2 3.88Å; I235-Y250 HydrophobicContact CG1-CE2 4.16Å; I235-Y250 HydrophobicContact CG2-CD2 4.31Å; A237-Y250 CarbonylContact O-C 3.59Å; A237-Y250 WeakPolarHBondContact O-CA 3.45Å; A237-Y250 WeakPolarHBondContact O-CB 3.48Å; F248-Y250 HydrophobicContact CE2-CD1 4.13Å; Y250-R258 HydrophobicContact CD1-CB 4.06Å; Y250-R258 HydrophobicContact CE1-CB 3.6Å; Y250-R258 HydrophobicContact CE2-CB 4.21Å; Y250-R258 PolarHBondContact N-O 3.16Å; Y250-R258 PolarHBondContact O-N 3.13Å; Y250-R258 WeakPolarHBondContact OH-CD 3.22Å
251	S	98.6	Very high	97.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	167.4	172.3	58.2	0	0	0	0	112	I235 T236 A237 T256 I294 V297	I235-S251 WeakPolarHBondContact CA-O 3.5Å; T236-S251 PolarHBondContact N-O 2.99Å; T236-S251 PolarHBondContact OG1-O 2.79Å; T236-S251 PolarHBondContact OG1-OG 3.12Å; A237-S251 PolarHBondContact N-OG 2.84Å; A237-S251 PolarHBondContact O-N 3.34Å; S251-T256 VanDerWaalsContact CA-O 3.28Å; S251-T256 WeakPolarHBondContact CA-O 3.47Å; S251-I294 WeakPolarHBondContact OG-CG2 3.35Å; S251-V297 VanDerWaalsContact OG-CG2 3.26Å; S251-V297 WeakPolarHBondContact OG-CG2 3.38Å
252	S	97.8	Very high	97.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	169.7	176.4	76.4	0	0	0	0	115.1	E233 V234 K254 G255 T256 I294	E233-S252 WeakPolarHBondContact OE1-CB 3.5Å; E233-S252 PolarHBondContact OE1-OG 2.65Å; V234-S252 CarbonylContact O-C 3.57Å; V234-S252 WeakPolarHBondContact O-CA 3.47Å; V234-S252 VanDerWaalsContact O-CB 3.29Å; V234-S252 WeakPolarHBondContact O-CB 3.3Å; S252-K254 PolarHBondContact O-N 3.14Å; S252-K254 VanDerWaalsContact O-N 3.15Å; S252-K254 PolarHBondContact OG-N 3.24Å; S252-G255 PolarHBondContact O-N 3.05Å; S252-T256 PolarHBondContact N-O 2.86Å; S252-T256 PolarHBondContact OG-OG1 2.89Å; S252-I294 PolarHBondContact O-N 3.09Å
253	S	97.1	Very high	97.6	Very high	29 Å²	29	35.1 Å²	35.1	20%	0.203	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.4	173.4	62	0	0	0	0	114.6	V234 S293	V234-S253 PolarHBondContact N-OG 3.22Å; V234-S253 VanDerWaalsContact N-OG 3.17Å; V234-S253 PolarHBondContact O-N 3.06Å; S253-S293 WeakPolarHBondContact CA-OG 3.24Å; S253-S293 WeakPolarHBondContact O-CA 3.41Å; S253-S293 WeakPolarHBondContact O-CB 3.44Å
254	K	95.6	Very high	97.3	Very high	73 Å²	73	33.8 Å²	33.8	32%	0.317	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	8.8	176.1	-67.2	-164.4	-177.2	175.5	0	113.9	T232 E233 S252 T256	T232-K254 VanDerWaalsContact CB-NZ 3.34Å; T232-K254 WeakPolarHBondContact O-CE 3.4Å; T232-K254 PolarHBondContact OG1-NZ 3.18Å; E233-K254 HydrophobicContact CB-CD 4.32Å; E233-K254 HydrophobicContact CB-CG 4.39Å; E233-K254 HydrophobicContact CG-CD 4.46Å; E233-K254 HydrophobicContact CG-CG 4.25Å; S252-K254 PolarHBondContact O-N 3.14Å; S252-K254 VanDerWaalsContact O-N 3.15Å; S252-K254 PolarHBondContact OG-N 3.24Å; K254-T256 HydrophobicContact CB-CG2 4.5Å
255	G	96.1	Very high	96.9	Very high	19 Å²	19	31.6 Å²	31.6	20%	0.196	17%	0.169	C	C	.	.	S	Bend	trans	77	21.5	178.5	0	0	0	0	0	115.3	S252 S292	S252-G255 PolarHBondContact O-N 3.05Å; G255-S292 WeakPolarHBondContact CA-O 3.17Å; G255-S292 PolarHBondContact N-O 2.99Å
256	T	96.8	Very high	96.3	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.037	18%	0.183	C	C	.	.			trans	-105.7	149.3	179.2	71.2	0	0	0	0	110.9	E233 S251 S252 K254 R258 F274	E233-T256 PolarHBondContact OE1-OG1 2.75Å; S251-T256 VanDerWaalsContact CA-O 3.28Å; S251-T256 WeakPolarHBondContact CA-O 3.47Å; S252-T256 PolarHBondContact N-O 2.86Å; S252-T256 PolarHBondContact OG-OG1 2.89Å; K254-T256 HydrophobicContact CB-CG2 4.5Å; T256-R258 PolarHBondContact OG1-NH1 3.05Å; T256-R258 VanDerWaalsContact OG1-NH1 3.14Å; T256-F274 HydrophobicContact CG2-CE2 4.12Å; T256-F274 HydrophobicContact CG2-CZ 3.61Å
257	I	98.4	Very high	95.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.5	170.8	-45.9	100	0	0	0	109.8	V249 F275 I294 M306 T308 W317	V249-I257 HydrophobicContact CB-CG2 4.01Å; V249-I257 HydrophobicContact CG1-CG2 4.26Å; I257-F275 HydrophobicContact CB-CB 4.1Å; I257-F275 HydrophobicContact CD1-CB 3.97Å; I257-F275 PolarHBondContact N-O 3.37Å; I257-F275 PolarHBondContact O-N 3.38Å; I257-I294 HydrophobicContact CD1-CD1 3.87Å; I257-I294 HydrophobicContact CG1-CD1 3.73Å; I257-M306 HydrophobicContact CB-CE 3.95Å; I257-M306 HydrophobicContact CD1-CE 4.1Å; I257-M306 HydrophobicContact CG1-CE 4.21Å; I257-M306 HydrophobicContact CG2-CE 3.84Å; I257-M306 HydrophobicContact CG2-SD 3.89Å; I257-T308 HydrophobicContact CD1-CG2 3.71Å; I257-T308 HydrophobicContact CG1-CG2 3.75Å; I257-W317 HydrophobicContact CD1-CD2 4.48Å; I257-W317 HydrophobicContact CD1-CZ2 4.02Å
258	R	98.1	Very high	95.5	Very high	32 Å²	32	36.2 Å²	36.2	12%	0.121	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.1	175.8	-74.9	171.7	-169.3	100	-11.9	108.9	E233 V249 Y250 T256 H271 F274	E233-R258 VanDerWaalsContact CD-NH2 3.33Å; E233-R258 IonicContact OE1-CZ 2.87Å; E233-R258 IonicContact OE1-NH1 3.82Å; E233-R258 PolarHBondContact OE1-NH1 3.13Å; E233-R258 IonicContact OE1-NH2 2.93Å; E233-R258 PolarHBondContact OE1-NH2 3.1Å; E233-R258 IonicContact OE2-CZ 2.73Å; E233-R258 IonicContact OE2-NH1 3.02Å; E233-R258 IonicContact OE2-NH2 3.79Å; E233-R258 PolarHBondContact OE2-NH2 3.18Å; V249-R258 CarbonylContact C-O 3.56Å; V249-R258 VanDerWaalsContact CA-O 3.25Å; V249-R258 WeakPolarHBondContact CA-O 3.24Å; Y250-R258 HydrophobicContact CD1-CB 4.06Å; Y250-R258 HydrophobicContact CE1-CB 3.6Å; Y250-R258 HydrophobicContact CE2-CB 4.21Å; Y250-R258 PolarHBondContact N-O 3.16Å; Y250-R258 PolarHBondContact O-N 3.13Å; Y250-R258 WeakPolarHBondContact OH-CD 3.22Å; T256-R258 PolarHBondContact OG1-NH1 3.05Å; T256-R258 VanDerWaalsContact OG1-NH1 3.14Å; R258-H271 HydrophobicContact CB-CB 3.84Å; R258-H271 HydrophobicContact CG-CB 3.98Å; R258-F274 HydrophobicContact CG-CD2 3.71Å; R258-F274 HydrophobicContact CG-CE2 4.02Å
259	L	98.3	Very high	94.6	Very high	11 Å²	11	41.9 Å²	41.9	6%	0.058	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126	171.8	-177.9	159.1	0	0	0	108.5	V247 F248 V249 S272 K273 F275 L319	V247-L259 HydrophobicContact CG1-CD1 4.06Å; V247-L259 HydrophobicContact CG1-CD2 3.79Å; V247-L259 HydrophobicContact CG1-CG 3.83Å; F248-L259 WeakPolarHBondContact O-CA 3.28Å; V249-L259 HydrophobicContact CG1-CB 3.76Å; V249-L259 HydrophobicContact CG1-CD1 4.14Å; V249-L259 HydrophobicContact CG1-CG 3.94Å; L259-S272 WeakPolarHBondContact O-CA 3.23Å; L259-S272 WeakPolarHBondContact O-CB 3.35Å; L259-S272 PolarHBondContact O-N 2.88Å; L259-K273 HydrophobicContact CB-CB 4.12Å; L259-K273 PolarHBondContact N-O 3.25Å; L259-K273 PolarHBondContact O-N 3.21Å; L259-K273 VanDerWaalsContact O-N 3.14Å; L259-F275 HydrophobicContact CB-CE2 3.92Å; L259-F275 HydrophobicContact CD1-CE2 4.3Å; L259-L319 HydrophobicContact CD1-CD2 4.04Å
260	C	98	Very high	94	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.2	-177.4	-66	0	0	0	0	110.5	V247 F248 C268	V247-C260 WeakPolarHBondContact CA-O 3.36Å; F248-C260 HydrophobicContact CD1-CB 3.96Å; F248-C260 HydrophobicContact CD2-CB 4.34Å; F248-C260 HydrophobicContact CE1-CB 3.42Å; F248-C260 VanDerWaalsContact CE1-CB 3.42Å; F248-C260 HydrophobicContact CE2-CB 3.84Å; F248-C260 HydrophobicContact CG-CB 4.39Å; F248-C260 HydrophobicContact CZ-CB 3.35Å; F248-C260 PolarHBondContact N-O 3.31Å; F248-C260 PolarHBondContact O-N 3Å; C260-C268 HydrophobicContact CB-CB 3.94Å
261	D	97	Very high	93.5	Very high	39 Å²	39	55.1 Å²	55.1	21%	0.209	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	108.4	171.7	-176.8	-9.9	0	0	0	109.6	N246 R263 S264	N246-D261 VanDerWaalsContact ND2-CG 3.32Å; N246-D261 PolarHBondContact ND2-OD1 2.93Å; N246-D261 WeakPolarHBondContact O-CA 3.39Å; D261-R263 PolarHBondContact O-N 3.41Å; D261-R263 VanDerWaalsContact O-N 3.15Å; D261-R263 WeakPolarHBondContact OD1-CB 3.39Å; D261-R263 PolarHBondContact OD1-N 3.17Å; D261-S264 WeakPolarHBondContact O-CB 3.34Å; D261-S264 PolarHBondContact O-N 3.27Å
262	M	96.6	Very high	93.2	Very high	48 Å²	48	58.2 Å²	58.2	24%	0.236	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.2	-178.6	-62	173.2	66.4	0	0	113.8	L208 F240 N246 F248	L208-M262 HydrophobicContact CD1-CE 4.15Å; L208-M262 HydrophobicContact CD2-CE 3.6Å; L208-M262 HydrophobicContact CG-CE 4.46Å; F240-M262 HydrophobicContact CE1-SD 3.79Å; F240-M262 HydrophobicContact CZ-SD 4.22Å; N246-M262 HydrophobicContact CB-CB 4.36Å; N246-M262 WeakPolarHBondContact O-CB 3.29Å; N246-M262 WeakPolarHBondContact O-CG 3.44Å; N246-M262 PolarHBondContact O-N 3.37Å; F248-M262 HydrophobicContact CD1-CG 3.98Å; F248-M262 HydrophobicContact CD1-SD 4.06Å; F248-M262 HydrophobicContact CE1-CG 3.75Å; F248-M262 HydrophobicContact CE1-SD 4.22Å
263	R	95.7	Very high	93.2	Very high	183 Å²	183	60.9 Å²	60.9	69%	0.691	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-26.1	172.7	-67.6	172.9	-178.5	165	4	112.3	N246 D261	N246-R263 HydrophobicContact CB-CG 3.7Å; N246-R263 VanDerWaalsContact OD1-CZ 3.24Å; N246-R263 PolarHBondContact OD1-NH2 3.28Å; D261-R263 PolarHBondContact O-N 3.41Å; D261-R263 VanDerWaalsContact O-N 3.15Å; D261-R263 WeakPolarHBondContact OD1-CB 3.39Å; D261-R263 PolarHBondContact OD1-N 3.17Å
264	S	93.2	Very high	93.2	Very high	95 Å²	95	62.3 Å²	62.3	66%	0.664	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-34.9	-177.6	-67.5	0	0	0	0	111.9	D261	D261-S264 WeakPolarHBondContact O-CB 3.34Å; D261-S264 PolarHBondContact O-N 3.27Å
265	S	89.2	Confident	93.3	Very high	50 Å²	50	58.9 Å²	58.9	35%	0.35	31%	0.305	S	S	.	.			trans	-156.3	145.6	176.4	176.4	0	0	0	0	110.4	L267	S265-L267 VanDerWaalsContact C-N 3.26Å; S265-L267 WeakPolarHBondContact CB-O 3.4Å; S265-L267 PolarHBondContact O-N 3.05Å; S265-L267 PolarHBondContact OG-N 3.22Å; S265-L267 PolarHBondContact OG-O 3.49Å
266	A	84.3	Confident	93.2	Very high	74 Å²	74	62.8 Å²	62.8	61%	0.612	32%	0.318	S	S	*	.	S	Bend	trans	-63.2	-36.2	173.1	0	0	0	0	0	111.6	F218	F218-A266 VanDerWaalsContact CE1-O 3.28Å; F218-A266 WeakPolarHBondContact CE1-O 3.38Å
267	L	88.6	Confident	92.9	Very high	88 Å²	88	66 Å²	66	46%	0.461	33%	0.333	S	S	.	.	S	Bend	trans	-98.8	120.4	171.4	-58.9	176.2	0	0	0	107.3	F218 S265 D269	F218-L267 HydrophobicContact CE2-CD2 4.32Å; F218-L267 HydrophobicContact CZ-CD2 3.84Å; S265-L267 VanDerWaalsContact C-N 3.26Å; S265-L267 WeakPolarHBondContact CB-O 3.4Å; S265-L267 PolarHBondContact O-N 3.05Å; S265-L267 PolarHBondContact OG-N 3.22Å; S265-L267 PolarHBondContact OG-O 3.49Å; L267-D269 PolarHBondContact O-N 3.25Å
268	C	89.9	Confident	92.2	Very high	4 Å²	4	71.1 Å²	71.1	3%	0.027	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	42.9	178.5	-60.7	0	0	0	0	110.8	I220 V221 F248 C260 R270	I220-C268 WeakPolarHBondContact O-CA 3.47Å; I220-C268 VanDerWaalsContact O-CB 3.31Å; I220-C268 WeakPolarHBondContact O-CB 3.34Å; I220-C268 PolarHBondContact O-N 3.03Å; V221-C268 HydrophobicContact CG2-CB 3.92Å; F248-C268 HydrophobicContact CE1-CB 4.28Å; F248-C268 HydrophobicContact CZ-CB 3.94Å; C260-C268 HydrophobicContact CB-CB 3.94Å; C268-R270 VanDerWaalsContact C-N 3.27Å; C268-R270 PolarHBondContact O-N 2.71Å
269	D	81.1	Confident	91.4	Very high	119 Å²	119	74.2 Å²	74.2	64%	0.636	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.5	179.5	63.3	-20.6	0	0	0	112.2	L267	L267-D269 PolarHBondContact O-N 3.25Å
270	R	84.5	Confident	90.4	Very high	209 Å²	209	78 Å²	78	79%	0.789	40%	0.403	S	S	*	.	S	Bend	trans	-106.1	123.7	165.4	-63.8	-176.6	-179.6	-176.6	-0.3	109.7	C268	C268-R270 VanDerWaalsContact C-N 3.27Å; C268-R270 PolarHBondContact O-N 2.71Å
271	H	89	Confident	89.6	Confident	79 Å²	79	83.5 Å²	83.5	37%	0.366	44%	0.438	S	S	.	.			trans	-69.9	144.3	169.1	53.7	-92.9	0	0	0	109.7	R258 F274	R258-H271 HydrophobicContact CB-CB 3.84Å; R258-H271 HydrophobicContact CG-CB 3.98Å; H271-F274 AromaticContact NE2-CD2 3.94Å; H271-F274 AromaticContact NE2-CG 3.96Å
272	S	92.7	Very high	88.6	Confident	65 Å²	65	86.5 Å²	86.5	46%	0.455	46%	0.462	S	S	.	.	S	Bend	trans	-74.2	-35.4	174.8	177.5	0	0	0	0	111.6	L259	L259-S272 WeakPolarHBondContact O-CA 3.23Å; L259-S272 WeakPolarHBondContact O-CB 3.35Å; L259-S272 PolarHBondContact O-N 2.88Å
273	K	96.6	Very high	87.6	Confident	55 Å²	55	87.8 Å²	87.8	24%	0.239	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	147.3	-178.8	-70.8	-177.6	177	176.1	0	110.5	L259 F275 L319 E322	L259-K273 HydrophobicContact CB-CB 4.12Å; L259-K273 PolarHBondContact N-O 3.25Å; L259-K273 PolarHBondContact O-N 3.21Å; L259-K273 VanDerWaalsContact O-N 3.14Å; K273-F275 HydrophobicContact CB-CD2 4.45Å; K273-F275 HydrophobicContact CB-CE2 3.7Å; K273-F275 HydrophobicContact CB-CZ 4.26Å; K273-F275 HydrophobicContact CD-CE2 4.39Å; K273-F275 HydrophobicContact CD-CZ 4.17Å; K273-L319 PolarHBondContact NZ-O 3.03Å; K273-E322 WeakPolarHBondContact CA-OE1 3.28Å; K273-E322 HydrophobicContact CB-CG 4.18Å; K273-E322 WeakPolarHBondContact CB-OE1 3.34Å; K273-E322 HydrophobicContact CD-CG 4.36Å; K273-E322 HydrophobicContact CG-CG 4.43Å; K273-E322 VanDerWaalsContact CG-OE1 3.26Å; K273-E322 WeakPolarHBondContact CG-OE1 3.36Å
274	F	97.4	Very high	87	Confident	60 Å²	60	86.7 Å²	86.7	26%	0.263	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	112.4	-177.1	-171.2	-110.2	0	0	0	110.3	T256 R258 H271 E276 E322	T256-F274 HydrophobicContact CG2-CE2 4.12Å; T256-F274 HydrophobicContact CG2-CZ 3.61Å; R258-F274 HydrophobicContact CG-CD2 3.71Å; R258-F274 HydrophobicContact CG-CE2 4.02Å; H271-F274 AromaticContact NE2-CD2 3.94Å; H271-F274 AromaticContact NE2-CG 3.96Å; F274-E276 HydrophobicContact CD1-CB 4.09Å; F274-E276 HydrophobicContact CE1-CB 3.64Å; F274-E276 HydrophobicContact CE1-CG 4.3Å; F274-E276 WeakPolarHBondContact CE1-OE2 3.38Å; F274-E276 HydrophobicContact CZ-CB 4.35Å; F274-E322 PolarHBondContact N-OE1 2.82Å; F274-E322 WeakPolarHBondContact O-CB 3.36Å
275	F	98.1	Very high	86.6	Confident	0 Å²	0	85 Å²	85	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.2	-179	-57.9	-106	0	0	0	109	I257 L259 K273 M306 W317 L319 E322	I257-F275 HydrophobicContact CB-CB 4.1Å; I257-F275 HydrophobicContact CD1-CB 3.97Å; I257-F275 PolarHBondContact N-O 3.37Å; I257-F275 PolarHBondContact O-N 3.38Å; L259-F275 HydrophobicContact CB-CE2 3.92Å; L259-F275 HydrophobicContact CD1-CE2 4.3Å; K273-F275 HydrophobicContact CB-CD2 4.45Å; K273-F275 HydrophobicContact CB-CE2 3.7Å; K273-F275 HydrophobicContact CB-CZ 4.26Å; K273-F275 HydrophobicContact CD-CE2 4.39Å; K273-F275 HydrophobicContact CD-CZ 4.17Å; F275-M306 HydrophobicContact CB-CE 3.88Å; F275-M306 HydrophobicContact CD1-CE 3.48Å; F275-M306 VanDerWaalsContact CD1-CE 3.48Å; F275-M306 HydrophobicContact CD2-CE 3.59Å; F275-M306 HydrophobicContact CE1-CE 3.86Å; F275-M306 HydrophobicContact CE2-CE 3.95Å; F275-M306 HydrophobicContact CG-CE 3.36Å; F275-M306 HydrophobicContact CZ-CE 4.09Å; F275-W317 HydrophobicContact CB-CD2 4.43Å; F275-W317 HydrophobicContact CB-CE3 3.98Å; F275-W317 HydrophobicContact CB-CH2 4.44Å; F275-W317 HydrophobicContact CB-CZ3 3.97Å; F275-W317 HydrophobicContact CD1-CB 4.39Å; F275-W317 HydrophobicContact CD1-CD2 4.39Å; F275-W317 AromaticContact CD1-CE3 3.81Å; F275-W317 HydrophobicContact CD1-CE3 3.81Å; F275-W317 HydrophobicContact CD1-CZ3 4.44Å; F275-W317 HydrophobicContact CG-CE3 4.39Å; F275-L319 HydrophobicContact CZ-CD2 4.24Å; F275-E322 WeakPolarHBondContact CA-O 3.35Å; F275-E322 HydrophobicContact CD1-CB 4.3Å; F275-E322 HydrophobicContact CD1-CG 4.18Å; F275-E322 HydrophobicContact CE1-CB 4.45Å; F275-E322 HydrophobicContact CE1-CG 3.92Å; F275-E322 HydrophobicContact CE2-CG 4.3Å; F275-E322 HydrophobicContact CG-CG 4.47Å; F275-E322 HydrophobicContact CZ-CG 3.98Å
276	E	94.7	Very high	86.6	Confident	101 Å²	101	89 Å²	89	47%	0.472	47%	0.471	S	S	.	.			trans	-146.5	138.1	179.7	-176.7	179.1	-140	0	0	108.3	F274 E322 S323	F274-E276 HydrophobicContact CD1-CB 4.09Å; F274-E276 HydrophobicContact CE1-CB 3.64Å; F274-E276 HydrophobicContact CE1-CG 4.3Å; F274-E276 WeakPolarHBondContact CE1-OE2 3.38Å; F274-E276 HydrophobicContact CZ-CB 4.35Å; E276-E322 PolarHBondContact N-O 2.67Å; E276-S323 CarbonylContact O-C 3.55Å
277	E	89.5	Confident	87	Confident	75 Å²	75	87.7 Å²	87.7	35%	0.35	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-96.1	122.3	172.6	-175.2	172.8	-158.8	0	0	108.2	E279 K315 W317	E277-E279 PolarHBondContact O-N 2.89Å; E277-E279 VanDerWaalsContact O-N 3.11Å; E277-K315 IonicContact OE2-NZ 2.74Å; E277-K315 PolarHBondContact OE2-NZ 2.85Å; E277-W317 HydrophobicContact CB-CH2 4.1Å
278	P	84.8	Confident	87.1	Confident	107 Å²	107	84.1 Å²	84.1	70%	0.695	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-60.3	117.2	177.2	-22.4	32	0	0	0	110.9	S323	P278-S323 WeakPolarHBondContact CD-O 3.3Å
279	E	79.6	Confident	87.2	Confident	96 Å²	96	88.3 Å²	88.3	45%	0.449	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-82.3	134.9	170.5	-71.6	-164.8	156.2	0	0	110.7	E277 P281	E277-E279 PolarHBondContact O-N 2.89Å; E277-E279 VanDerWaalsContact O-N 3.11Å; E279-P281 VanDerWaalsContact O-CD 3.29Å; E279-P281 WeakPolarHBondContact O-CD 3.21Å
280	D	77.6	Confident	87.8	Confident	92 Å²	92	84.2 Å²	84.2	49%	0.492	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-67.2	119	170.4	-178.2	-15.8	0	0	0	108.9	S282 S283 R284	D280-S282 PolarHBondContact O-N 2.98Å; D280-S282 WeakPolarHBondContact OD1-CB 3.5Å; D280-S282 PolarHBondContact OD1-N 3.17Å; D280-S282 PolarHBondContact OD1-OG 3.49Å; D280-S282 PolarHBondContact OD2-OG 3.26Å; D280-S283 PolarHBondContact O-N 3Å; D280-S283 PolarHBondContact O-OG 2.98Å; D280-R284 PolarHBondContact O-N 3.37Å
281	P	80.9	Confident	88.4	Confident	114 Å²	114	75.2 Å²	75.2	74%	0.74	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-26.9	179.8	-25.6	34.6	0	0	0	113.7	E279 S283 R284	E279-P281 VanDerWaalsContact O-CD 3.29Å; E279-P281 WeakPolarHBondContact O-CD 3.21Å; P281-S283 VanDerWaalsContact C-N 3.31Å; P281-R284 PolarHBondContact O-N 2.89Å
282	S	77.8	Confident	88.6	Confident	103 Å²	103	72.4 Å²	72.4	72%	0.72	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.9	177.4	73.1	0	0	0	0	113.6	D280	D280-S282 PolarHBondContact O-N 2.98Å; D280-S282 WeakPolarHBondContact OD1-CB 3.5Å; D280-S282 PolarHBondContact OD1-N 3.17Å; D280-S282 PolarHBondContact OD1-OG 3.49Å; D280-S282 PolarHBondContact OD2-OG 3.26Å
283	S	75.6	Confident	88.9	Confident	74 Å²	74	71.1 Å²	71.1	52%	0.517	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-7.6	176.9	73.2	0	0	0	0	113.4	D280 P281 S285	D280-S283 PolarHBondContact O-N 3Å; D280-S283 PolarHBondContact O-OG 2.98Å; P281-S283 VanDerWaalsContact C-N 3.31Å; S283-S285 PolarHBondContact O-N 2.82Å
284	R	81.4	Confident	89	Confident	160 Å²	160	68.8 Å²	68.8	60%	0.604	37%	0.369	S	S	*	.			trans	-72.3	119.9	-176.3	-165.3	172.8	177.3	169.7	0.6	110.3	D280 P281 E289	D280-R284 PolarHBondContact O-N 3.37Å; P281-R284 PolarHBondContact O-N 2.89Å; R284-E289 IonicContact NH2-OE2 2.73Å
285	S	85.9	Confident	89	Confident	59 Å²	59	66.8 Å²	66.8	41%	0.413	36%	0.362	S	S	.	.			trans	-116.5	168.3	174.8	72.6	0	0	0	0	110.1	S283 F287 S288	S283-S285 PolarHBondContact O-N 2.82Å; S285-F287 PolarHBondContact O-N 3.35Å; S285-F287 PolarHBondContact OG-N 2.79Å; S285-S288 PolarHBondContact N-OG 3.42Å; S285-S288 VanDerWaalsContact O-CB 3.3Å; S285-S288 WeakPolarHBondContact O-CB 3.36Å; S285-S288 PolarHBondContact O-N 3.18Å; S285-S288 PolarHBondContact O-OG 2.89Å; S285-S288 PolarHBondContact OG-N 2.86Å; S285-S288 PolarHBondContact OG-OG 2.74Å; S285-S288 VanDerWaalsContact OG-OG 3.09Å
286	F	88.4	Confident	89	Confident	136 Å²	136	67.2 Å²	67.2	60%	0.596	36%	0.364	S	S	*	.	H	α-helix	trans	-51.7	-41.4	169.8	169.6	-103.7	0	0	0	112	S288 I290 Y343	F286-S288 VanDerWaalsContact C-N 3.29Å; F286-S288 PolarHBondContact O-N 2.84Å; F286-I290 HydrophobicContact CD1-CD1 4.2Å; F286-I290 HydrophobicContact CE1-CD1 3.54Å; F286-I290 HydrophobicContact CZ-CD1 3.75Å; F286-Y343 HydrophobicContact CE1-CE2 4.26Å; F286-Y343 HydrophobicContact CZ-CE2 4.36Å
287	F	93.3	Very high	89.2	Confident	46 Å²	46	62.5 Å²	62.5	20%	0.202	34%	0.342	C	S	.	.	H	α-helix	trans	-73.2	-18.8	-179.8	-64.8	-68.2	0	0	0	113.7	S285 E289 I290 I291 L339 C340 Y343 I348	S285-F287 PolarHBondContact O-N 3.35Å; S285-F287 PolarHBondContact OG-N 2.79Å; F287-E289 VanDerWaalsContact C-N 3.31Å; F287-E289 PolarHBondContact O-N 3.42Å; F287-I290 HydrophobicContact CD1-CD1 4.19Å; F287-I290 PolarHBondContact O-N 3.26Å; F287-I291 VanDerWaalsContact O-CG1 3.3Å; F287-I291 WeakPolarHBondContact O-CG1 3.48Å; F287-I291 PolarHBondContact O-N 2.87Å; F287-L339 HydrophobicContact CB-CD1 4.07Å; F287-L339 HydrophobicContact CD1-CB 4.24Å; F287-L339 HydrophobicContact CD2-CB 4.32Å; F287-L339 HydrophobicContact CG-CB 4.14Å; F287-L339 HydrophobicContact CG-CD1 4.42Å; F287-C340 HydrophobicContact CZ-CB 4.24Å; F287-Y343 HydrophobicContact CE1-CD2 4.35Å; F287-Y343 HydrophobicContact CE1-CG 4.03Å; F287-I348 HydrophobicContact CD1-CD1 3.99Å
288	S	91.3	Very high	89.7	Confident	13 Å²	13	60.2 Å²	60.2	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-58.5	-44.8	-178.3	-62.2	0	0	0	0	111	S285 F286 I290 S292	S285-S288 PolarHBondContact N-OG 3.42Å; S285-S288 VanDerWaalsContact O-CB 3.3Å; S285-S288 WeakPolarHBondContact O-CB 3.36Å; S285-S288 PolarHBondContact O-N 3.18Å; S285-S288 PolarHBondContact O-OG 2.89Å; S285-S288 PolarHBondContact OG-N 2.86Å; S285-S288 PolarHBondContact OG-OG 2.74Å; S285-S288 VanDerWaalsContact OG-OG 3.09Å; F286-S288 VanDerWaalsContact C-N 3.29Å; F286-S288 PolarHBondContact O-N 2.84Å; S288-I290 PolarHBondContact O-N 2.97Å; S288-S292 WeakPolarHBondContact O-CB 3.28Å; S288-S292 PolarHBondContact O-N 2.72Å; S288-S292 PolarHBondContact O-OG 2.84Å
289	E	90.3	Very high	90.3	Very high	91 Å²	91	55.8 Å²	55.8	43%	0.425	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-41.2	178.6	-170.5	163.1	178	0	0	111.8	R284 F287 S292	R284-E289 IonicContact NH2-OE2 2.73Å; F287-E289 VanDerWaalsContact C-N 3.31Å; F287-E289 PolarHBondContact O-N 3.42Å; E289-S292 PolarHBondContact O-N 2.81Å; E289-S292 PolarHBondContact O-OG 3.36Å
290	I	94.9	Very high	91.2	Very high	33 Å²	33	51.2 Å²	51.2	17%	0.169	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-50.1	179.5	-57.5	175.1	0	0	0	111	F286 F287 S288 S292 S293 Y343 I348 F349	F286-I290 HydrophobicContact CD1-CD1 4.2Å; F286-I290 HydrophobicContact CE1-CD1 3.54Å; F286-I290 HydrophobicContact CZ-CD1 3.75Å; F287-I290 HydrophobicContact CD1-CD1 4.19Å; F287-I290 PolarHBondContact O-N 3.26Å; S288-I290 PolarHBondContact O-N 2.97Å; I290-S292 VanDerWaalsContact C-N 3.3Å; I290-S292 PolarHBondContact O-N 3.49Å; I290-S293 WeakPolarHBondContact O-CB 3.01Å; I290-S293 PolarHBondContact O-N 2.93Å; I290-Y343 HydrophobicContact CD1-CD2 3.8Å; I290-Y343 HydrophobicContact CD1-CE2 3.71Å; I290-I348 HydrophobicContact CB-CD1 4.44Å; I290-I348 HydrophobicContact CG2-CD1 3.8Å; I290-I348 HydrophobicContact CG2-CG1 3.9Å; I290-I348 HydrophobicContact CG2-CG2 4.08Å; I290-F349 HydrophobicContact CG2-CD1 4.35Å; I290-F349 HydrophobicContact CG2-CE1 3.85Å
291	I	95.7	Very high	92.2	Very high	20 Å²	20	50.8 Å²	50.8	10%	0.103	28%	0.275	C	S	.	.	H	α-helix	trans	-77.7	-16	-177	70.8	-173.7	0	0	0	113.1	F287 S293 D310 Y311 L312 L339 I348	F287-I291 VanDerWaalsContact O-CG1 3.3Å; F287-I291 WeakPolarHBondContact O-CG1 3.48Å; F287-I291 PolarHBondContact O-N 2.87Å; I291-S293 VanDerWaalsContact C-N 3.27Å; I291-D310 WeakPolarHBondContact O-CB 3.45Å; I291-Y311 HydrophobicContact CG2-CD1 3.98Å; I291-Y311 HydrophobicContact CG2-CG 4.4Å; I291-Y311 PolarHBondContact O-N 2.92Å; I291-L312 HydrophobicContact CD1-CD1 3.88Å; I291-L339 HydrophobicContact CD1-CD1 4.27Å; I291-L339 HydrophobicContact CG2-CD1 4.45Å; I291-L339 HydrophobicContact CG2-CD2 3.84Å; I291-I348 HydrophobicContact CG2-CD1 3.85Å; I291-I348 HydrophobicContact CG2-CG1 4.09Å
292	S	95.1	Very high	92.9	Very high	20 Å²	20	48.4 Å²	48.4	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-73.1	-20	174.5	73.3	0	0	0	0	113	G255 S288 E289 I290 I294	G255-S292 WeakPolarHBondContact CA-O 3.17Å; G255-S292 PolarHBondContact N-O 2.99Å; S288-S292 WeakPolarHBondContact O-CB 3.28Å; S288-S292 PolarHBondContact O-N 2.72Å; S288-S292 PolarHBondContact O-OG 2.84Å; E289-S292 PolarHBondContact O-N 2.81Å; E289-S292 PolarHBondContact O-OG 3.36Å; I290-S292 VanDerWaalsContact C-N 3.3Å; I290-S292 PolarHBondContact O-N 3.49Å; S292-I294 PolarHBondContact O-N 2.86Å; S292-I294 VanDerWaalsContact O-N 3.15Å
293	S	97.5	Very high	93.9	Very high	39 Å²	39	43.8 Å²	43.8	27%	0.273	23%	0.229	S	C	.	.			trans	-53.7	119.8	177.5	-177.7	0	0	0	0	110.9	S253 I290 I291	S253-S293 WeakPolarHBondContact CA-OG 3.24Å; S253-S293 WeakPolarHBondContact O-CA 3.41Å; S253-S293 WeakPolarHBondContact O-CB 3.44Å; I290-S293 WeakPolarHBondContact O-CB 3.01Å; I290-S293 PolarHBondContact O-N 2.93Å; I291-S293 VanDerWaalsContact C-N 3.27Å
294	I	98.6	Very high	94.9	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.031	23%	0.228	C	C	.	.			trans	-79	126.2	177.9	-68.3	160.2	0	0	0	108	T236 S251 S252 I257 S292 D296 V297 T308	T236-I294 WeakPolarHBondContact CB-O 3.29Å; T236-I294 PolarHBondContact OG1-O 2.97Å; S251-I294 WeakPolarHBondContact OG-CG2 3.35Å; S252-I294 PolarHBondContact O-N 3.09Å; I257-I294 HydrophobicContact CD1-CD1 3.87Å; I257-I294 HydrophobicContact CG1-CD1 3.73Å; S292-I294 PolarHBondContact O-N 2.86Å; S292-I294 VanDerWaalsContact O-N 3.15Å; I294-D296 VanDerWaalsContact CG2-O 3.26Å; I294-D296 WeakPolarHBondContact CG2-O 3.4Å; I294-V297 HydrophobicContact CG2-CG2 3.76Å; I294-T308 HydrophobicContact CD1-CG2 4.36Å
295	S	98.3	Very high	95.8	Very high	18 Å²	18	41 Å²	41	13%	0.126	21%	0.208	C	C	.	.			trans	-93.4	-25.6	179.7	55.5	0	0	0	0	113.8	R309 F352	S295-R309 PolarHBondContact N-O 2.66Å; S295-R309 PolarHBondContact OG-O 3.2Å; S295-F352 PolarHBondContact OG-O 2.85Å
296	D	98.7	Very high	96.3	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.043	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	148.2	180	-164.9	25.3	0	0	0	111.4	I294 T308 R309 E353 C354	I294-D296 VanDerWaalsContact CG2-O 3.26Å; I294-D296 WeakPolarHBondContact CG2-O 3.4Å; D296-T308 WeakPolarHBondContact O-CA 3.37Å; D296-R309 HydrophobicContact CB-CB 4.34Å; D296-R309 PolarHBondContact O-N 3.45Å; D296-E353 WeakPolarHBondContact OD2-CA 3.42Å; D296-C354 PolarHBondContact OD2-N 3.11Å
297	V	98.7	Very high	96.8	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.5	176.2	-179	0	0	0	0	108.9	A237 V249 S251 I294 M307 T308	A237-V297 HydrophobicContact CB-CB 4.35Å; A237-V297 HydrophobicContact CB-CG2 4.17Å; V249-V297 HydrophobicContact CG2-CG1 3.61Å; S251-V297 VanDerWaalsContact OG-CG2 3.26Å; S251-V297 WeakPolarHBondContact OG-CG2 3.38Å; I294-V297 HydrophobicContact CG2-CG2 3.76Å; V297-M307 CarbonylContact C-O 3.55Å; V297-M307 VanDerWaalsContact CA-O 3.32Å; V297-M307 WeakPolarHBondContact CA-O 3.08Å; V297-T308 HydrophobicContact CG1-CG2 4.48Å; V297-T308 HydrophobicContact CG2-CG2 4.14Å
298	K	98.6	Very high	97.1	Very high	28 Å²	28	29.6 Å²	29.6	12%	0.122	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	116.6	-178.3	-68.7	-64.1	177.9	176	0	113.7	E239 M306 M307 C354 W356	E239-K298 WeakPolarHBondContact OE1-CD 3.39Å; E239-K298 IonicContact OE1-NZ 2.89Å; E239-K298 PolarHBondContact OE1-NZ 3.02Å; E239-K298 VanDerWaalsContact OE2-CA 3.25Å; E239-K298 WeakPolarHBondContact OE2-CA 3.16Å; K298-M306 CarbonylContact O-C 3.58Å; K298-M306 WeakPolarHBondContact O-CA 3.42Å; K298-M307 HydrophobicContact CB-CE 4.19Å; K298-M307 PolarHBondContact N-O 2.79Å; K298-M307 PolarHBondContact O-N 3.19Å; K298-C354 WeakPolarHBondContact CG-O 3.43Å; K298-W356 PolarHBondContact O-NE1 2.83Å; K298-W356 VanDerWaalsContact O-NE1 3.07Å
299	F	98.7	Very high	97.4	Very high	13 Å²	13	29 Å²	29	6%	0.057	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	144.1	165.7	-76.9	-71.7	0	0	0	110.9	E239 F240 H241 P242 V249 M306 L319 W356	E239-F299 HydrophobicContact CB-CD2 4.41Å; E239-F299 HydrophobicContact CG-CD2 4.43Å; E239-F299 PolarHBondContact OE2-N 3.4Å; F240-F299 VanDerWaalsContact O-CD2 3.29Å; F240-F299 WeakPolarHBondContact O-CD2 3.4Å; H241-F299 HydrophobicContact CB-CE2 4.1Å; H241-F299 HydrophobicContact CB-CZ 4.1Å; H241-F299 AromaticContact CD2-CE1 3.77Å; P242-F299 HydrophobicContact CG-CB 4.27Å; V249-F299 HydrophobicContact CB-CE2 4.36Å; V249-F299 HydrophobicContact CB-CZ 4.19Å; V249-F299 HydrophobicContact CG1-CE1 4.22Å; V249-F299 HydrophobicContact CG1-CE2 4.16Å; V249-F299 HydrophobicContact CG1-CZ 3.51Å; V249-F299 HydrophobicContact CG2-CD2 4.28Å; V249-F299 HydrophobicContact CG2-CE2 3.55Å; V249-F299 HydrophobicContact CG2-CZ 3.78Å; F299-M306 HydrophobicContact CD1-CB 4.07Å; F299-M306 HydrophobicContact CE1-CB 4.36Å; F299-L319 HydrophobicContact CD1-CD1 4.29Å; F299-L319 HydrophobicContact CE1-CD1 3.8Å; F299-L319 HydrophobicContact CE1-CD2 3.93Å; F299-L319 HydrophobicContact CE1-CG 4.47Å; F299-W356 VanDerWaalsContact O-CD1 3.24Å; F299-W356 PolarHBondContact O-NE1 2.84Å
300	S	98.4	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.			trans	-68.7	152.7	167.7	72.6	0	0	0	0	109.6	S302 G303 Y305 D360	S300-S302 PolarHBondContact O-N 3.02Å; S300-S302 PolarHBondContact OG-OG 2.96Å; S300-G303 WeakPolarHBondContact O-CA 3.42Å; S300-G303 PolarHBondContact O-N 3.3Å; S300-G303 PolarHBondContact OG-N 3.02Å; S300-Y305 PolarHBondContact N-O 3.11Å; S300-Y305 PolarHBondContact OG-N 3.43Å; S300-Y305 VanDerWaalsContact OG-N 3.09Å; S300-Y305 PolarHBondContact OG-O 3.26Å; S300-D360 VanDerWaalsContact CB-OD2 3.29Å; S300-D360 WeakPolarHBondContact CB-OD2 3.12Å
301	H	97.7	Very high	98	Very high	83 Å²	83	24.1 Å²	24.1	38%	0.384	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.4	179.6	-59.2	90.8	0	0	0	112	H243 G303 N357 D360	H243-H301 PolarHBondContact NE2-O 3.31Å; H301-G303 PolarHBondContact O-N 3.26Å; H301-N357 PolarHBondContact CE1-O 2.98Å; H301-N357 PolarHBondContact ND1-O 3.28Å; H301-D360 WeakPolarHBondContact CB-OD1 3.12Å; H301-D360 IonicContact CE1-OD1 3.45Å; H301-D360 IonicContact CG-OD1 3.96Å; H301-D360 VanDerWaalsContact N-CG 3.33Å; H301-D360 PolarHBondContact N-OD1 3.05Å; H301-D360 PolarHBondContact N-OD2 3.24Å; H301-D360 VanDerWaalsContact N-OD2 3.12Å; H301-D360 IonicContact ND1-OD1 2.63Å; H301-D360 PolarHBondContact ND1-OD1 3.42Å
302	S	97	Very high	98.1	Very high	64 Å²	64	23.5 Å²	23.5	45%	0.448	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.9	171.9	51.4	0	0	0	0	114.7	S300 R304 D360	S300-S302 PolarHBondContact O-N 3.02Å; S300-S302 PolarHBondContact OG-OG 2.96Å; S302-R304 PolarHBondContact O-N 2.63Å; S302-D360 VanDerWaalsContact CB-OD2 3.29Å; S302-D360 WeakPolarHBondContact CB-OD2 3.49Å; S302-D360 PolarHBondContact N-OD2 3Å; S302-D360 PolarHBondContact OG-OD2 2.97Å
303	G	97.6	Very high	98.2	Very high	6 Å²	6	22.8 Å²	22.8	6%	0.062	12%	0.115	C	C	.	.	S	Bend	trans	70.9	0.3	-173.8	0	0	0	0	0	114.7	H241 S300 H301 L319	H241-G303 WeakPolarHBondContact NE2-CA 3.45Å; H241-G303 PolarHBondContact NE2-O 3.28Å; S300-G303 WeakPolarHBondContact O-CA 3.42Å; S300-G303 PolarHBondContact O-N 3.3Å; S300-G303 PolarHBondContact OG-N 3.02Å; H301-G303 PolarHBondContact O-N 3.26Å; G303-L319 WeakPolarHBondContact O-CD1 3.38Å
304	R	97.6	Very high	98.2	Very high	132 Å²	132	21 Å²	21	50%	0.498	10%	0.102	S	C	.	.	S	Bend	trans	-79.7	-32	-179.6	178.9	172.1	175.7	-151.3	-4.2	112.8	S302 D318 L319	S302-R304 PolarHBondContact O-N 2.63Å; R304-D318 IonicContact CZ-OD2 3.33Å; R304-D318 IonicContact NE-OD2 3.21Å; R304-D318 PolarHBondContact NE-OD2 3Å; R304-D318 IonicContact NH2-OD2 3.35Å; R304-D318 PolarHBondContact NH2-OD2 3.41Å; R304-L319 WeakPolarHBondContact O-CG 3.23Å; R304-L319 PolarHBondContact O-N 2.71Å
305	Y	98.5	Very high	98.2	Very high	43 Å²	43	22.4 Å²	22.4	17%	0.169	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	161.3	-175	-54.4	-81.7	0	0	0	110.5	S300 V316 W317 D318 V326	S300-Y305 PolarHBondContact N-O 3.11Å; S300-Y305 PolarHBondContact OG-N 3.43Å; S300-Y305 VanDerWaalsContact OG-N 3.09Å; S300-Y305 PolarHBondContact OG-O 3.26Å; Y305-V316 HydrophobicContact CD1-CG1 4.12Å; Y305-V316 HydrophobicContact CG-CG1 4.29Å; Y305-W317 CarbonylContact C-O 3.54Å; Y305-W317 WeakPolarHBondContact CA-O 3.39Å; Y305-W317 WeakPolarHBondContact CB-O 3.36Å; Y305-D318 HydrophobicContact CD1-CB 4.06Å; Y305-D318 HydrophobicContact CE1-CB 4.04Å; Y305-V326 HydrophobicContact CD1-CG2 4.37Å; Y305-V326 HydrophobicContact CE1-CG2 4.41Å
306	M	98.3	Very high	98.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.1	162.3	65.1	-179	-175.1	0	0	109.4	V249 I257 F275 K298 F299 W317 L319	V249-M306 HydrophobicContact CG1-SD 4.08Å; I257-M306 HydrophobicContact CB-CE 3.95Å; I257-M306 HydrophobicContact CD1-CE 4.1Å; I257-M306 HydrophobicContact CG1-CE 4.21Å; I257-M306 HydrophobicContact CG2-CE 3.84Å; I257-M306 HydrophobicContact CG2-SD 3.89Å; F275-M306 HydrophobicContact CB-CE 3.88Å; F275-M306 HydrophobicContact CD1-CE 3.48Å; F275-M306 VanDerWaalsContact CD1-CE 3.48Å; F275-M306 HydrophobicContact CD2-CE 3.59Å; F275-M306 HydrophobicContact CE1-CE 3.86Å; F275-M306 HydrophobicContact CE2-CE 3.95Å; F275-M306 HydrophobicContact CG-CE 3.36Å; F275-M306 HydrophobicContact CZ-CE 4.09Å; K298-M306 CarbonylContact O-C 3.58Å; K298-M306 WeakPolarHBondContact O-CA 3.42Å; F299-M306 HydrophobicContact CD1-CB 4.07Å; F299-M306 HydrophobicContact CE1-CB 4.36Å; M306-W317 HydrophobicContact CE-CB 3.71Å; M306-W317 HydrophobicContact CE-CD2 4.4Å; M306-W317 HydrophobicContact CE-CG 3.86Å; M306-W317 HydrophobicContact CG-CB 3.78Å; M306-W317 HydrophobicContact CG-CG 4.4Å; M306-W317 PolarHBondContact N-O 3.25Å; M306-W317 PolarHBondContact O-N 3.28Å; M306-L319 HydrophobicContact CB-CD2 4.22Å; M306-L319 HydrophobicContact CG-CD2 3.88Å; M306-L319 HydrophobicContact SD-CD2 3.85Å
307	M	98.6	Very high	98.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	142.6	176.1	172.8	170.4	58.1	0	0	109.4	V297 K298 V314 K315 C354 W356 I363	V297-M307 CarbonylContact C-O 3.55Å; V297-M307 VanDerWaalsContact CA-O 3.32Å; V297-M307 WeakPolarHBondContact CA-O 3.08Å; K298-M307 HydrophobicContact CB-CE 4.19Å; K298-M307 PolarHBondContact N-O 2.79Å; K298-M307 PolarHBondContact O-N 3.19Å; M307-V314 HydrophobicContact CG-CG1 3.49Å; M307-V314 VanDerWaalsContact CG-CG1 3.49Å; M307-V314 HydrophobicContact SD-CG1 3.42Å; M307-V314 WeakPolarHBondContact SD-CG1 3.27Å; M307-K315 CarbonylContact C-O 3.55Å; M307-K315 VanDerWaalsContact CA-O 3.3Å; M307-K315 WeakPolarHBondContact CA-O 3.34Å; M307-C354 HydrophobicContact CE-CB 3.67Å; M307-C354 VanDerWaalsContact CE-SG 3.57Å; M307-C354 HydrophobicContact CG-CB 4.5Å; M307-C354 HydrophobicContact SD-CB 3.94Å; M307-W356 HydrophobicContact CB-CH2 4.26Å; M307-W356 HydrophobicContact CB-CZ2 3.4Å; M307-W356 VanDerWaalsContact CB-CZ2 3.4Å; M307-W356 HydrophobicContact CE-CD2 4.17Å; M307-W356 HydrophobicContact CE-CG 4.17Å; M307-I363 HydrophobicContact CE-CG2 4.25Å; M307-I363 HydrophobicContact SD-CB 4.17Å; M307-I363 HydrophobicContact SD-CD1 3.86Å; M307-I363 HydrophobicContact SD-CG1 3.81Å; M307-I363 HydrophobicContact SD-CG2 3.32Å; M307-I363 WeakPolarHBondContact SD-CG2 2.97Å
308	T	98.7	Very high	98.2	Very high	2 Å²	2	22 Å²	22	1%	0.012	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139	174.1	59.8	0	0	0	0	110.3	I257 I294 D296 V297 V314 K315 W317	I257-T308 HydrophobicContact CD1-CG2 3.71Å; I257-T308 HydrophobicContact CG1-CG2 3.75Å; I294-T308 HydrophobicContact CD1-CG2 4.36Å; D296-T308 WeakPolarHBondContact O-CA 3.37Å; V297-T308 HydrophobicContact CG1-CG2 4.48Å; V297-T308 HydrophobicContact CG2-CG2 4.14Å; T308-V314 WeakPolarHBondContact O-CA 3.43Å; T308-K315 PolarHBondContact N-O 2.79Å; T308-K315 PolarHBondContact O-N 2.83Å; T308-W317 PolarHBondContact OG1-NE1 2.87Å; T308-W317 VanDerWaalsContact OG1-NE1 3.12Å
309	R	98.7	Very high	98.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	113.3	173	177.2	65	-159.7	-107.3	-2.3	109.9	S295 D296 Y311 S313 V314 F352 C354 T365 G366	S295-R309 PolarHBondContact N-O 2.66Å; S295-R309 PolarHBondContact OG-O 3.2Å; D296-R309 HydrophobicContact CB-CB 4.34Å; D296-R309 PolarHBondContact O-N 3.45Å; R309-Y311 PolarHBondContact NH2-O 2.82Å; R309-S313 WeakPolarHBondContact CD-O 3.14Å; R309-V314 HydrophobicContact CB-CG2 4.47Å; R309-V314 HydrophobicContact CG-CG2 4.48Å; R309-F352 HydrophobicContact CG-CB 4.08Å; R309-F352 VanDerWaalsContact CG-O 3.3Å; R309-F352 WeakPolarHBondContact CG-O 3.41Å; R309-C354 HydrophobicContact CB-CB 4.13Å; R309-T365 PolarHBondContact NH1-OG1 2.81Å; R309-G366 PolarHBondContact NH1-O 2.76Å
310	D	98.1	Very high	98.1	Very high	15 Å²	15	26.9 Å²	26.9	8%	0.08	13%	0.132	C	C	.	.			trans	-95.9	-174.8	163.9	69.4	38.7	0	0	0	109.7	I291 L312 S313 K315	I291-D310 WeakPolarHBondContact O-CB 3.45Å; D310-L312 PolarHBondContact O-N 2.94Å; D310-L312 PolarHBondContact OD1-N 2.66Å; D310-L312 VanDerWaalsContact OD1-N 3.12Å; D310-S313 PolarHBondContact N-O 3.45Å; D310-S313 WeakPolarHBondContact OD1-CA 3.29Å; D310-S313 PolarHBondContact OD1-N 2.94Å; D310-S313 PolarHBondContact OD1-OG 2.83Å; D310-S313 PolarHBondContact OD2-OG 3.46Å; D310-K315 VanDerWaalsContact OD2-CE 3.26Å; D310-K315 WeakPolarHBondContact OD2-CE 3.34Å; D310-K315 IonicContact OD2-NZ 2.73Å
311	Y	98.1	Very high	98.1	Very high	8 Å²	8	29.8 Å²	29.8	3%	0.031	15%	0.147	C	C	.	.	S	Bend	trans	-60.2	-51.1	-174.3	-172.9	-111.5	0	0	0	111.8	I291 R309 H332 L339 L342 C347 I348 F352 Y368	I291-Y311 HydrophobicContact CG2-CD1 3.98Å; I291-Y311 HydrophobicContact CG2-CG 4.4Å; I291-Y311 PolarHBondContact O-N 2.92Å; R309-Y311 PolarHBondContact NH2-O 2.82Å; Y311-H332 PolarHBondContact O-NE2 3.49Å; Y311-L339 HydrophobicContact CD1-CD2 4.21Å; Y311-L339 HydrophobicContact CE1-CD2 4Å; Y311-L342 HydrophobicContact CE1-CD1 4.03Å; Y311-L342 VanDerWaalsContact OH-CD1 3.24Å; Y311-L342 WeakPolarHBondContact OH-CD1 3.44Å; Y311-C347 WeakPolarHBondContact CE2-O 3.47Å; Y311-I348 HydrophobicContact CD1-CG1 4.25Å; Y311-I348 WeakPolarHBondContact CD2-O 3.22Å; Y311-I348 HydrophobicContact CE1-CG1 4.13Å; Y311-F352 HydrophobicContact CE2-CE2 4.27Å; Y311-Y368 HydrophobicContact CE2-CE2 4.4Å; Y311-Y368 WeakPolarHBondContact CE2-OH 3.49Å; Y311-Y368 PolarHBondContact OH-OH 3.02Å; Y311-Y368 VanDerWaalsContact OH-OH 3.12Å
312	L	97.8	Very high	98.1	Very high	7 Å²	7	29.3 Å²	29.3	4%	0.037	15%	0.145	C	C	.	.	S	Bend	trans	-93.5	-19.6	-171.6	-64.7	-178.1	0	0	0	114.5	I291 D310 V331 L335 R336	I291-L312 HydrophobicContact CD1-CD1 3.88Å; D310-L312 PolarHBondContact O-N 2.94Å; D310-L312 PolarHBondContact OD1-N 2.66Å; D310-L312 VanDerWaalsContact OD1-N 3.12Å; L312-V331 WeakPolarHBondContact O-CB 3.42Å; L312-V331 PolarHBondContact O-N 2.9Å; L312-L335 HydrophobicContact CD2-CB 4.48Å; L312-R336 HydrophobicContact CD1-CB 4.37Å
313	S	98	Very high	98	Very high	5 Å²	5	29.7 Å²	29.7	4%	0.035	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.7	-166	82.1	0	0	0	0	114	R309 D310 K315 H329	R309-S313 WeakPolarHBondContact CD-O 3.14Å; D310-S313 PolarHBondContact N-O 3.45Å; D310-S313 WeakPolarHBondContact OD1-CA 3.29Å; D310-S313 PolarHBondContact OD1-N 2.94Å; D310-S313 PolarHBondContact OD1-OG 2.83Å; D310-S313 PolarHBondContact OD2-OG 3.46Å; S313-K315 WeakPolarHBondContact OG-CE 3.25Å; S313-H329 WeakPolarHBondContact CA-O 3.45Å
314	V	98.6	Very high	98	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.5	164.3	174.4	0	0	0	0	108.3	M307 T308 R309 H329 V331 I363 T365	M307-V314 HydrophobicContact CG-CG1 3.49Å; M307-V314 VanDerWaalsContact CG-CG1 3.49Å; M307-V314 HydrophobicContact SD-CG1 3.42Å; M307-V314 WeakPolarHBondContact SD-CG1 3.27Å; T308-V314 WeakPolarHBondContact O-CA 3.43Å; R309-V314 HydrophobicContact CB-CG2 4.47Å; R309-V314 HydrophobicContact CG-CG2 4.48Å; V314-H329 HydrophobicContact CB-CB 4.39Å; V314-H329 PolarHBondContact N-O 3.23Å; V314-H329 PolarHBondContact O-N 2.83Å; V314-V331 HydrophobicContact CB-CG2 4.48Å; V314-V331 HydrophobicContact CG2-CG2 3.8Å; V314-I363 HydrophobicContact CG1-CD1 4.48Å; V314-I363 HydrophobicContact CG1-CG2 4.04Å; V314-T365 HydrophobicContact CG2-CG2 3.7Å
315	K	98.5	Very high	98	Very high	37 Å²	37	30.7 Å²	30.7	16%	0.161	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.2	-179.1	-59.2	176.1	-176	-174.1	0	110.1	E277 M307 T308 D310 S313 P325 E327 T328	E277-K315 IonicContact OE2-NZ 2.74Å; E277-K315 PolarHBondContact OE2-NZ 2.85Å; M307-K315 CarbonylContact C-O 3.55Å; M307-K315 VanDerWaalsContact CA-O 3.3Å; M307-K315 WeakPolarHBondContact CA-O 3.34Å; T308-K315 PolarHBondContact N-O 2.79Å; T308-K315 PolarHBondContact O-N 2.83Å; D310-K315 VanDerWaalsContact OD2-CE 3.26Å; D310-K315 WeakPolarHBondContact OD2-CE 3.34Å; D310-K315 IonicContact OD2-NZ 2.73Å; S313-K315 WeakPolarHBondContact OG-CE 3.25Å; K315-P325 HydrophobicContact CB-CB 3.93Å; K315-P325 HydrophobicContact CB-CG 4.35Å; K315-P325 HydrophobicContact CD-CG 4.21Å; K315-P325 HydrophobicContact CG-CG 4.43Å; K315-E327 CarbonylContact C-O 3.43Å; K315-E327 WeakPolarHBondContact CA-O 3.47Å; K315-T328 HydrophobicContact CG-CG2 4.09Å
316	V	98.6	Very high	97.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.6	172.8	-178.5	0	0	0	0	108.6	Y305 P325 V326 E327 W356 I363	Y305-V316 HydrophobicContact CD1-CG1 4.12Å; Y305-V316 HydrophobicContact CG-CG1 4.29Å; V316-P325 CarbonylContact O-C 3.57Å; V316-P325 VanDerWaalsContact O-CA 3.29Å; V316-P325 WeakPolarHBondContact O-CA 3.35Å; V316-P325 VanDerWaalsContact O-CB 3.24Å; V316-P325 WeakPolarHBondContact O-CB 3.34Å; V316-V326 HydrophobicContact CB-CG2 4.12Å; V316-V326 HydrophobicContact CG1-CG2 3.82Å; V316-V326 VanDerWaalsContact O-CG2 3.23Å; V316-V326 WeakPolarHBondContact O-CG2 3.29Å; V316-V326 PolarHBondContact O-N 3.14Å; V316-E327 HydrophobicContact CB-CB 4.02Å; V316-E327 HydrophobicContact CB-CG 4.49Å; V316-E327 HydrophobicContact CG2-CB 4.2Å; V316-E327 PolarHBondContact N-O 3.06Å; V316-E327 PolarHBondContact O-N 3.35Å; V316-W356 HydrophobicContact CB-CH2 4.44Å; V316-W356 HydrophobicContact CG1-CH2 3.75Å; V316-W356 HydrophobicContact CG1-CZ2 4.44Å; V316-W356 HydrophobicContact CG2-CH2 3.84Å; V316-I363 HydrophobicContact CG2-CD1 3.52Å
317	W	98.6	Very high	97.9	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.015	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.6	178.7	-58.5	82.5	0	0	0	109.5	I257 F275 E277 Y305 M306 T308 R324 P325	I257-W317 HydrophobicContact CD1-CD2 4.48Å; I257-W317 HydrophobicContact CD1-CZ2 4.02Å; F275-W317 HydrophobicContact CB-CD2 4.43Å; F275-W317 HydrophobicContact CB-CE3 3.98Å; F275-W317 HydrophobicContact CB-CH2 4.44Å; F275-W317 HydrophobicContact CB-CZ3 3.97Å; F275-W317 HydrophobicContact CD1-CB 4.39Å; F275-W317 HydrophobicContact CD1-CD2 4.39Å; F275-W317 AromaticContact CD1-CE3 3.81Å; F275-W317 HydrophobicContact CD1-CE3 3.81Å; F275-W317 HydrophobicContact CD1-CZ3 4.44Å; F275-W317 HydrophobicContact CG-CE3 4.39Å; E277-W317 HydrophobicContact CB-CH2 4.1Å; Y305-W317 CarbonylContact C-O 3.54Å; Y305-W317 WeakPolarHBondContact CA-O 3.39Å; Y305-W317 WeakPolarHBondContact CB-O 3.36Å; M306-W317 HydrophobicContact CE-CB 3.71Å; M306-W317 HydrophobicContact CE-CD2 4.4Å; M306-W317 HydrophobicContact CE-CG 3.86Å; M306-W317 HydrophobicContact CG-CB 3.78Å; M306-W317 HydrophobicContact CG-CG 4.4Å; M306-W317 PolarHBondContact N-O 3.25Å; M306-W317 PolarHBondContact O-N 3.28Å; T308-W317 PolarHBondContact OG1-NE1 2.87Å; T308-W317 VanDerWaalsContact OG1-NE1 3.12Å; W317-R324 VanDerWaalsContact CE3-C 3.44Å; W317-P325 HydrophobicContact CD2-CB 4.02Å; W317-P325 HydrophobicContact CE3-CB 4.36Å; W317-P325 HydrophobicContact CG-CB 4.43Å; W317-P325 HydrophobicContact CZ2-CB 4.32Å; W317-P325 HydrophobicContact CZ2-CG 4.44Å
318	D	98.3	Very high	97.8	Very high	14 Å²	14	36.6 Å²	36.6	8%	0.075	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.7	164.7	-173.5	-48.3	0	0	0	107.4	R304 Y305 N320 M321 V326	R304-D318 IonicContact CZ-OD2 3.33Å; R304-D318 IonicContact NE-OD2 3.21Å; R304-D318 PolarHBondContact NE-OD2 3Å; R304-D318 IonicContact NH2-OD2 3.35Å; R304-D318 PolarHBondContact NH2-OD2 3.41Å; Y305-D318 HydrophobicContact CD1-CB 4.06Å; Y305-D318 HydrophobicContact CE1-CB 4.04Å; D318-N320 PolarHBondContact O-N 2.89Å; D318-N320 WeakPolarHBondContact OD1-CB 3.4Å; D318-N320 PolarHBondContact OD1-N 3.46Å; D318-N320 PolarHBondContact OD1-ND2 3.17Å; D318-M321 HydrophobicContact CB-CB 4.31Å; D318-M321 PolarHBondContact O-N 3.25Å; D318-V326 HydrophobicContact CB-CG1 3.76Å
319	L	97.8	Very high	97.8	Very high	17 Å²	17	37.7 Å²	37.7	9%	0.089	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.7	-178.2	-61.9	-177	0	0	0	113.6	L259 K273 F275 F299 G303 R304 M306	L259-L319 HydrophobicContact CD1-CD2 4.04Å; K273-L319 PolarHBondContact NZ-O 3.03Å; F275-L319 HydrophobicContact CZ-CD2 4.24Å; F299-L319 HydrophobicContact CD1-CD1 4.29Å; F299-L319 HydrophobicContact CE1-CD1 3.8Å; F299-L319 HydrophobicContact CE1-CD2 3.93Å; F299-L319 HydrophobicContact CE1-CG 4.47Å; G303-L319 WeakPolarHBondContact O-CD1 3.38Å; R304-L319 WeakPolarHBondContact O-CG 3.23Å; R304-L319 PolarHBondContact O-N 2.71Å; M306-L319 HydrophobicContact CB-CD2 4.22Å; M306-L319 HydrophobicContact CG-CD2 3.88Å; M306-L319 HydrophobicContact SD-CD2 3.85Å
320	N	97.8	Very high	97.7	Very high	127 Å²	127	41.8 Å²	41.8	68%	0.679	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-1.9	174.1	-57	-54.5	0	0	0	113.9	D318	D318-N320 PolarHBondContact O-N 2.89Å; D318-N320 WeakPolarHBondContact OD1-CB 3.4Å; D318-N320 PolarHBondContact OD1-N 3.46Å; D318-N320 PolarHBondContact OD1-ND2 3.17Å
321	M	97.2	Very high	97.7	Very high	62 Å²	62	41.2 Å²	41.2	31%	0.305	21%	0.209	S	C	.	.			trans	-127.7	93.6	180	-170	172.1	-160.4	0	0	111	D318 R324 V326	D318-M321 HydrophobicContact CB-CB 4.31Å; D318-M321 PolarHBondContact O-N 3.25Å; M321-R324 HydrophobicContact CE-CG 3.79Å; M321-R324 VanDerWaalsContact CE-NE 3.32Å; M321-R324 HydrophobicContact SD-CG 4.3Å; M321-V326 HydrophobicContact SD-CG1 4.39Å
322	E	97.2	Very high	97.6	Very high	73 Å²	73	40.8 Å²	40.8	34%	0.341	21%	0.208	S	C	.	.			trans	-78.7	-26.6	-175.3	-69.1	168.5	105.4	0	0	114.2	K273 F274 F275 E276 R324	K273-E322 WeakPolarHBondContact CA-OE1 3.28Å; K273-E322 HydrophobicContact CB-CG 4.18Å; K273-E322 WeakPolarHBondContact CB-OE1 3.34Å; K273-E322 HydrophobicContact CD-CG 4.36Å; K273-E322 HydrophobicContact CG-CG 4.43Å; K273-E322 VanDerWaalsContact CG-OE1 3.26Å; K273-E322 WeakPolarHBondContact CG-OE1 3.36Å; F274-E322 PolarHBondContact N-OE1 2.82Å; F274-E322 WeakPolarHBondContact O-CB 3.36Å; F275-E322 WeakPolarHBondContact CA-O 3.35Å; F275-E322 HydrophobicContact CD1-CB 4.3Å; F275-E322 HydrophobicContact CD1-CG 4.18Å; F275-E322 HydrophobicContact CE1-CB 4.45Å; F275-E322 HydrophobicContact CE1-CG 3.92Å; F275-E322 HydrophobicContact CE2-CG 4.3Å; F275-E322 HydrophobicContact CG-CG 4.47Å; F275-E322 HydrophobicContact CZ-CG 3.98Å; E276-E322 PolarHBondContact N-O 2.67Å; E322-R324 PolarHBondContact O-N 3.23Å
323	S	95.9	Very high	97.5	Very high	72 Å²	72	43.6 Å²	43.6	50%	0.503	22%	0.22	S	C	.	.	S	Bend	trans	-80	-13.1	-165.9	66.2	0	0	0	0	115.4	E276 P278	E276-S323 CarbonylContact O-C 3.55Å; P278-S323 WeakPolarHBondContact CD-O 3.3Å
324	R	96.6	Very high	97.3	Very high	147 Å²	147	45 Å²	45	56%	0.555	23%	0.225	S	C	*	.	S	Bend	trans	-171.3	155.9	179	61.4	178.9	-174.8	-171.1	-0.8	111	W317 M321 E322	W317-R324 VanDerWaalsContact CE3-C 3.44Å; M321-R324 HydrophobicContact CE-CG 3.79Å; M321-R324 VanDerWaalsContact CE-NE 3.32Å; M321-R324 HydrophobicContact SD-CG 4.3Å; E322-R324 PolarHBondContact O-N 3.23Å
325	P	97.6	Very high	97.2	Very high	12 Å²	12	45 Å²	45	8%	0.078	23%	0.225	C	C	.	.			trans	-65.3	152.2	169.5	30.3	-37.4	0	0	0	111.7	K315 V316 W317 T328	K315-P325 HydrophobicContact CB-CB 3.93Å; K315-P325 HydrophobicContact CB-CG 4.35Å; K315-P325 HydrophobicContact CD-CG 4.21Å; K315-P325 HydrophobicContact CG-CG 4.43Å; V316-P325 CarbonylContact O-C 3.57Å; V316-P325 VanDerWaalsContact O-CA 3.29Å; V316-P325 WeakPolarHBondContact O-CA 3.35Å; V316-P325 VanDerWaalsContact O-CB 3.24Å; V316-P325 WeakPolarHBondContact O-CB 3.34Å; W317-P325 HydrophobicContact CD2-CB 4.02Å; W317-P325 HydrophobicContact CE3-CB 4.36Å; W317-P325 HydrophobicContact CG-CB 4.43Å; W317-P325 HydrophobicContact CZ2-CB 4.32Å; W317-P325 HydrophobicContact CZ2-CG 4.44Å; P325-T328 WeakPolarHBondContact CG-OG1 3.38Å
326	V	97.4	Very high	97	Very high	62 Å²	62	50 Å²	50	38%	0.376	24%	0.243	S	C	.	.	S	Bend	trans	-80.8	-26.2	172.4	-66.8	0	0	0	0	112.3	Y305 V316 D318 M321	Y305-V326 HydrophobicContact CD1-CG2 4.37Å; Y305-V326 HydrophobicContact CE1-CG2 4.41Å; V316-V326 HydrophobicContact CB-CG2 4.12Å; V316-V326 HydrophobicContact CG1-CG2 3.82Å; V316-V326 VanDerWaalsContact O-CG2 3.23Å; V316-V326 WeakPolarHBondContact O-CG2 3.29Å; V316-V326 PolarHBondContact O-N 3.14Å; D318-V326 HydrophobicContact CB-CG1 3.76Å; M321-V326 HydrophobicContact SD-CG1 4.39Å
327	E	97.4	Very high	96.7	Very high	42 Å²	42	54.9 Å²	54.9	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	140.8	176	-57.1	164.8	-141.4	0	0	110.2	K315 V316 H329 R377	K315-E327 CarbonylContact C-O 3.43Å; K315-E327 WeakPolarHBondContact CA-O 3.47Å; V316-E327 HydrophobicContact CB-CB 4.02Å; V316-E327 HydrophobicContact CB-CG 4.49Å; V316-E327 HydrophobicContact CG2-CB 4.2Å; V316-E327 PolarHBondContact N-O 3.06Å; V316-E327 PolarHBondContact O-N 3.35Å; E327-H329 IonicContact OE2-CE1 3.98Å; E327-H329 IonicContact OE2-NE2 2.71Å; E327-H329 PolarHBondContact OE2-NE2 3.42Å; E327-R377 IonicContact OE1-CZ 2.74Å; E327-R377 VanDerWaalsContact OE1-CZ 3.25Å; E327-R377 IonicContact OE1-NE 3.73Å; E327-R377 PolarHBondContact OE1-NE 2.63Å; E327-R377 IonicContact OE1-NH2 3.25Å; E327-R377 PolarHBondContact OE1-NH2 2.89Å; E327-R377 WeakPolarHBondContact OE2-CG 3.33Å; E327-R377 IonicContact OE2-NE 3.03Å; E327-R377 PolarHBondContact OE2-NE 3.39Å
328	T	97.4	Very high	96.5	Very high	62 Å²	62	57.6 Å²	57.6	38%	0.38	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	119.2	174.2	-60.3	0	0	0	0	109	K315 P325	K315-T328 HydrophobicContact CG-CG2 4.09Å; P325-T328 WeakPolarHBondContact CG-OG1 3.38Å
329	H	97.9	Very high	96.4	Very high	25 Å²	25	57.6 Å²	57.6	12%	0.116	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	116.5	-175	-65.4	-69.4	0	0	0	109.6	S313 V314 E327 V331 F375	S313-H329 WeakPolarHBondContact CA-O 3.45Å; V314-H329 HydrophobicContact CB-CB 4.39Å; V314-H329 PolarHBondContact N-O 3.23Å; V314-H329 PolarHBondContact O-N 2.83Å; E327-H329 IonicContact OE2-CE1 3.98Å; E327-H329 IonicContact OE2-NE2 2.71Å; E327-H329 PolarHBondContact OE2-NE2 3.42Å; H329-V331 PolarHBondContact O-N 3.35Å; H329-F375 HydrophobicContact CB-CD1 3.64Å; H329-F375 HydrophobicContact CB-CD2 4.25Å; H329-F375 HydrophobicContact CB-CE1 3.62Å; H329-F375 HydrophobicContact CB-CE2 4.24Å; H329-F375 HydrophobicContact CB-CG 3.95Å; H329-F375 HydrophobicContact CB-CZ 3.93Å; H329-F375 AromaticContact CG-CD1 3.77Å; H329-F375 AromaticContact CG-CG 3.91Å; H329-F375 AromaticContact ND1-CD1 3.59Å; H329-F375 AromaticContact ND1-CG 3.96Å
330	Q	97.6	Very high	96.3	Very high	87 Å²	87	60.1 Å²	60.1	41%	0.407	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118.2	-179.8	-62.3	-58.5	-21.4	0	0	110.3	E333 R373	Q330-E333 HydrophobicContact CB-CB 4.29Å; Q330-E333 PolarHBondContact OE1-OE2 2.92Å; Q330-R373 PolarHBondContact O-NH2 2.93Å
331	V	97.9	Very high	96.2	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.012	29%	0.289	C	S	.	.	S	Bend	trans	-80.2	-54.2	-175.2	-178.7	0	0	0	0	110.6	L312 V314 H329 T365 R373 F375	L312-V331 WeakPolarHBondContact O-CB 3.42Å; L312-V331 PolarHBondContact O-N 2.9Å; V314-V331 HydrophobicContact CB-CG2 4.48Å; V314-V331 HydrophobicContact CG2-CG2 3.8Å; H329-V331 PolarHBondContact O-N 3.35Å; V331-T365 HydrophobicContact CG1-CG2 4.09Å; V331-T365 HydrophobicContact CG2-CG2 3.88Å; V331-R373 HydrophobicContact CG1-CB 4.4Å; V331-R373 HydrophobicContact CG1-CG 3.8Å; V331-R373 VanDerWaalsContact O-CD 3.3Å; V331-R373 WeakPolarHBondContact O-CD 3.37Å; V331-R373 PolarHBondContact O-NE 2.76Å; V331-F375 HydrophobicContact CG2-CE2 4.43Å; V331-F375 HydrophobicContact CG2-CZ 4.32Å
332	H	96.4	Very high	96.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.275	C	S	.	.			trans	-149.5	54.6	-175.2	50	-160.6	0	0	0	111.3	Y311 Y334 L335 S367 Y368	Y311-H332 PolarHBondContact O-NE2 3.49Å; H332-Y334 HydrophobicContact CB-CD1 4.37Å; H332-Y334 HydrophobicContact CB-CD2 4.44Å; H332-Y334 HydrophobicContact CB-CE1 3.71Å; H332-Y334 HydrophobicContact CB-CE2 3.78Å; H332-Y334 WeakPolarHBondContact CB-OH 3.45Å; H332-Y334 PolarHBondContact O-N 2.87Å; H332-L335 HydrophobicContact CB-CD1 4Å; H332-L335 HydrophobicContact CB-CG 4.21Å; H332-L335 WeakPolarHBondContact O-CB 3.36Å; H332-L335 PolarHBondContact O-N 3.2Å; H332-S367 PolarHBondContact ND1-OG 2.66Å; H332-Y368 AromaticContact CE1-CE2 3.9Å
333	E	94.8	Very high	96.1	Very high	65 Å²	65	54.3 Å²	54.3	30%	0.304	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-54.3	-23.8	-179.4	-173.1	62	-171.7	0	0	113.3	Q330 L335 R336	Q330-E333 HydrophobicContact CB-CB 4.29Å; Q330-E333 PolarHBondContact OE1-OE2 2.92Å; E333-L335 PolarHBondContact O-N 2.89Å; E333-R336 VanDerWaalsContact O-CB 3.31Å; E333-R336 WeakPolarHBondContact O-CB 3.32Å; E333-R336 PolarHBondContact O-N 3Å; E333-R336 VanDerWaalsContact OE1-CD 3.24Å; E333-R336 WeakPolarHBondContact OE1-CD 3.4Å; E333-R336 IonicContact OE1-CZ 3.17Å; E333-R336 VanDerWaalsContact OE1-CZ 3.32Å; E333-R336 IonicContact OE1-NE 3.32Å; E333-R336 PolarHBondContact OE1-NE 3.16Å; E333-R336 IonicContact OE1-NH1 3.03Å; E333-R336 PolarHBondContact OE1-NH1 3.23Å
334	Y	94.3	Very high	96.1	Very high	36 Å²	36	57.5 Å²	57.5	14%	0.141	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-60.1	-13.5	172.4	55.8	-105.4	0	0	0	114.1	H332 V403 V416 L419	H332-Y334 HydrophobicContact CB-CD1 4.37Å; H332-Y334 HydrophobicContact CB-CD2 4.44Å; H332-Y334 HydrophobicContact CB-CE1 3.71Å; H332-Y334 HydrophobicContact CB-CE2 3.78Å; H332-Y334 WeakPolarHBondContact CB-OH 3.45Å; H332-Y334 PolarHBondContact O-N 2.87Å; Y334-V403 HydrophobicContact CD1-CB 3.91Å; Y334-V403 HydrophobicContact CD1-CG1 4.06Å; Y334-V403 HydrophobicContact CD1-CG2 4.5Å; Y334-V403 HydrophobicContact CD2-CB 4.44Å; Y334-V403 HydrophobicContact CD2-CG1 3.77Å; Y334-V403 HydrophobicContact CE1-CB 3.83Å; Y334-V403 HydrophobicContact CE1-CG1 4.2Å; Y334-V403 HydrophobicContact CE1-CG2 3.91Å; Y334-V403 HydrophobicContact CE2-CB 4.38Å; Y334-V403 HydrophobicContact CE2-CG1 3.93Å; Y334-V403 HydrophobicContact CE2-CG2 4.34Å; Y334-V403 HydrophobicContact CG-CB 4.23Å; Y334-V403 HydrophobicContact CG-CG1 3.84Å; Y334-V416 HydrophobicContact CD2-CG2 3.91Å; Y334-V416 HydrophobicContact CG-CG2 4.16Å; Y334-L419 HydrophobicContact CD2-CD1 4.11Å; Y334-L419 HydrophobicContact CE2-CD1 3.53Å
335	L	95.9	Very high	96	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-88.5	-8.6	174	-61.3	-178.1	0	0	0	113.9	L312 H332 E333 S337 K338 L339 L342 Y368 V416 L419 F421	L312-L335 HydrophobicContact CD2-CB 4.48Å; H332-L335 HydrophobicContact CB-CD1 4Å; H332-L335 HydrophobicContact CB-CG 4.21Å; H332-L335 WeakPolarHBondContact O-CB 3.36Å; H332-L335 PolarHBondContact O-N 3.2Å; E333-L335 PolarHBondContact O-N 2.89Å; L335-S337 PolarHBondContact O-N 2.91Å; L335-K338 CarbonylContact O-C 3.57Å; L335-K338 WeakPolarHBondContact O-CA 3.46Å; L335-K338 WeakPolarHBondContact O-CB 3.11Å; L335-K338 PolarHBondContact O-N 3.18Å; L335-L339 PolarHBondContact O-N 2.84Å; L335-L342 HydrophobicContact CB-CD1 3.98Å; L335-L342 HydrophobicContact CD1-CD1 4.4Å; L335-Y368 HydrophobicContact CD1-CD2 3.61Å; L335-Y368 HydrophobicContact CD1-CE2 3.84Å; L335-V416 HydrophobicContact CD2-CG1 4.21Å; L335-L419 HydrophobicContact CD2-CD1 4.11Å; L335-F421 HydrophobicContact CD1-CE1 4.34Å; L335-F421 HydrophobicContact CD2-CE1 3.75Å; L335-F421 HydrophobicContact CD2-CZ 3.93Å
336	R	94.3	Very high	96	Very high	142 Å²	142	60.4 Å²	60.4	54%	0.536	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59.1	-35.1	-177.6	-176.5	174.7	-109.8	176.8	-15.2	112.8	L312 E333 K338 L339	L312-R336 HydrophobicContact CD1-CB 4.37Å; E333-R336 VanDerWaalsContact O-CB 3.31Å; E333-R336 WeakPolarHBondContact O-CB 3.32Å; E333-R336 PolarHBondContact O-N 3Å; E333-R336 VanDerWaalsContact OE1-CD 3.24Å; E333-R336 WeakPolarHBondContact OE1-CD 3.4Å; E333-R336 IonicContact OE1-CZ 3.17Å; E333-R336 VanDerWaalsContact OE1-CZ 3.32Å; E333-R336 IonicContact OE1-NE 3.32Å; E333-R336 PolarHBondContact OE1-NE 3.16Å; E333-R336 IonicContact OE1-NH1 3.03Å; E333-R336 PolarHBondContact OE1-NH1 3.23Å; R336-K338 PolarHBondContact O-N 3.03Å; R336-L339 HydrophobicContact CG-CD1 4.27Å; R336-L339 VanDerWaalsContact O-CG 3.32Å; R336-L339 WeakPolarHBondContact O-CG 3.21Å
337	S	92.8	Very high	96	Very high	101 Å²	101	58.1 Å²	58.1	71%	0.706	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-75.2	-7.3	175	60	0	0	0	0	114	L335	L335-S337 PolarHBondContact O-N 2.91Å
338	K	94.7	Very high	95.9	Very high	61 Å²	61	56.4 Å²	56.4	27%	0.265	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-109.7	5.6	-177.3	-59.1	-67.1	-178.5	167.1	0	113	L335 R336 C340 S341 L342 V416 D417	L335-K338 CarbonylContact O-C 3.57Å; L335-K338 WeakPolarHBondContact O-CA 3.46Å; L335-K338 WeakPolarHBondContact O-CB 3.11Å; L335-K338 PolarHBondContact O-N 3.18Å; R336-K338 PolarHBondContact O-N 3.03Å; K338-C340 PolarHBondContact O-N 2.78Å; K338-S341 PolarHBondContact O-N 2.84Å; K338-S341 VanDerWaalsContact O-N 3.07Å; K338-S341 PolarHBondContact O-OG 2.85Å; K338-L342 HydrophobicContact CB-CD1 4.22Å; K338-L342 HydrophobicContact CB-CG 4.41Å; K338-L342 VanDerWaalsContact O-CG 3.31Å; K338-L342 WeakPolarHBondContact O-CG 3.35Å; K338-L342 PolarHBondContact O-N 2.85Å; K338-V416 HydrophobicContact CG-CG1 4.06Å; K338-D417 WeakPolarHBondContact CE-OD1 3.43Å; K338-D417 IonicContact NZ-OD1 2.87Å; K338-D417 PolarHBondContact NZ-OD1 3.27Å
339	L	95.6	Very high	95.9	Very high	14 Å²	14	58.6 Å²	58.6	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-55.2	-37.6	-177.2	-68.6	174.9	0	0	0	113.2	F287 I291 Y311 L335 R336 L342 Y343 I348	F287-L339 HydrophobicContact CB-CD1 4.07Å; F287-L339 HydrophobicContact CD1-CB 4.24Å; F287-L339 HydrophobicContact CD2-CB 4.32Å; F287-L339 HydrophobicContact CG-CB 4.14Å; F287-L339 HydrophobicContact CG-CD1 4.42Å; I291-L339 HydrophobicContact CD1-CD1 4.27Å; I291-L339 HydrophobicContact CG2-CD1 4.45Å; I291-L339 HydrophobicContact CG2-CD2 3.84Å; Y311-L339 HydrophobicContact CD1-CD2 4.21Å; Y311-L339 HydrophobicContact CE1-CD2 4Å; L335-L339 PolarHBondContact O-N 2.84Å; R336-L339 HydrophobicContact CG-CD1 4.27Å; R336-L339 VanDerWaalsContact O-CG 3.32Å; R336-L339 WeakPolarHBondContact O-CG 3.21Å; L339-L342 HydrophobicContact CD2-CD1 4.5Å; L339-L342 PolarHBondContact O-N 3.3Å; L339-Y343 WeakPolarHBondContact O-CB 3.38Å; L339-Y343 PolarHBondContact O-N 3.28Å; L339-I348 HydrophobicContact CD2-CD1 4.04Å
340	C	95.8	Very high	96	Very high	70 Å²	70	58.4 Å²	58.4	47%	0.473	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-50.2	175.8	-165.1	0	0	0	0	111.9	F287 K338 L342 Y343 E344	F287-C340 HydrophobicContact CZ-CB 4.24Å; K338-C340 PolarHBondContact O-N 2.78Å; C340-L342 VanDerWaalsContact C-N 3.31Å; C340-L342 PolarHBondContact O-N 2.84Å; C340-Y343 WeakPolarHBondContact O-CB 3.39Å; C340-Y343 PolarHBondContact O-N 3.13Å; C340-E344 WeakPolarHBondContact O-CG 3.26Å; C340-E344 PolarHBondContact O-N 3.41Å
341	S	95	Very high	96	Very high	43 Å²	43	59.7 Å²	59.7	30%	0.301	30%	0.297	S	S	.	.	H	α-helix	trans	-67.9	-29	177.6	51.4	0	0	0	0	113.6	K338 N345	K338-S341 PolarHBondContact O-N 2.84Å; K338-S341 VanDerWaalsContact O-N 3.07Å; K338-S341 PolarHBondContact O-OG 2.85Å; S341-N345 PolarHBondContact O-N 2.83Å; S341-N345 PolarHBondContact O-ND2 3Å
342	L	96.3	Very high	96	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-74.3	-30.7	176.3	-67.2	167.6	0	0	0	111.6	Y311 L335 K338 L339 C340 D346 C347 I348 F421	Y311-L342 HydrophobicContact CE1-CD1 4.03Å; Y311-L342 VanDerWaalsContact OH-CD1 3.24Å; Y311-L342 WeakPolarHBondContact OH-CD1 3.44Å; L335-L342 HydrophobicContact CB-CD1 3.98Å; L335-L342 HydrophobicContact CD1-CD1 4.4Å; K338-L342 HydrophobicContact CB-CD1 4.22Å; K338-L342 HydrophobicContact CB-CG 4.41Å; K338-L342 VanDerWaalsContact O-CG 3.31Å; K338-L342 WeakPolarHBondContact O-CG 3.35Å; K338-L342 PolarHBondContact O-N 2.85Å; L339-L342 HydrophobicContact CD2-CD1 4.5Å; L339-L342 PolarHBondContact O-N 3.3Å; C340-L342 VanDerWaalsContact C-N 3.31Å; C340-L342 PolarHBondContact O-N 2.84Å; L342-D346 CarbonylContact O-C 3.59Å; L342-D346 PolarHBondContact O-N 2.97Å; L342-C347 HydrophobicContact CB-CB 4.43Å; L342-C347 HydrophobicContact CD2-CB 3.83Å; L342-C347 PolarHBondContact O-N 2.81Å; L342-I348 HydrophobicContact CB-CB 4.25Å; L342-I348 PolarHBondContact O-N 2.82Å; L342-I348 VanDerWaalsContact O-N 3.1Å; L342-F421 HydrophobicContact CD2-CD1 3.69Å; L342-F421 HydrophobicContact CD2-CE1 3.58Å; L342-F421 HydrophobicContact CD2-CG 4.26Å; L342-F421 HydrophobicContact CD2-CZ 4.04Å
343	Y	96.6	Very high	96.1	Very high	95 Å²	95	60.6 Å²	60.6	37%	0.373	30%	0.301	S	S	.	.	H	α-helix	trans	-71.4	-41.7	172.5	178.7	-93.9	0	0	0	111.7	F286 F287 I290 L339 C340 N345 D346 I348 F349	F286-Y343 HydrophobicContact CE1-CE2 4.26Å; F286-Y343 HydrophobicContact CZ-CE2 4.36Å; F287-Y343 HydrophobicContact CE1-CD2 4.35Å; F287-Y343 HydrophobicContact CE1-CG 4.03Å; I290-Y343 HydrophobicContact CD1-CD2 3.8Å; I290-Y343 HydrophobicContact CD1-CE2 3.71Å; L339-Y343 WeakPolarHBondContact O-CB 3.38Å; L339-Y343 PolarHBondContact O-N 3.28Å; C340-Y343 WeakPolarHBondContact O-CB 3.39Å; C340-Y343 PolarHBondContact O-N 3.13Å; Y343-N345 PolarHBondContact O-N 2.62Å; Y343-D346 PolarHBondContact O-N 3.35Å; Y343-I348 HydrophobicContact CD2-CG2 3.99Å; Y343-F349 HydrophobicContact CD2-CE2 4.39Å; Y343-F349 HydrophobicContact CD2-CZ 4.03Å; Y343-F349 HydrophobicContact CE2-CE2 4.4Å; Y343-F349 AromaticContact CE2-CZ 3.82Å; Y343-F349 HydrophobicContact CE2-CZ 3.82Å
344	E	95.8	Very high	96.3	Very high	139 Å²	139	57.6 Å²	57.6	65%	0.65	29%	0.287	S	S	*	.	H	α-helix	trans	-63.2	-26.4	177.3	-72.5	172.1	-172.7	0	0	113.9	C340	C340-E344 WeakPolarHBondContact O-CG 3.26Å; C340-E344 PolarHBondContact O-N 3.41Å
345	N	94.4	Very high	96.5	Very high	113 Å²	113	56.8 Å²	56.8	60%	0.604	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	18.1	179.8	-63.1	-43.1	0	0	0	113.2	S341 Y343 C347	S341-N345 PolarHBondContact O-N 2.83Å; S341-N345 PolarHBondContact O-ND2 3Å; Y343-N345 PolarHBondContact O-N 2.62Å; N345-C347 PolarHBondContact O-N 3.29Å; N345-C347 PolarHBondContact O-SG 3.46Å
346	D	97	Very high	96.6	Very high	108 Å²	108	57.2 Å²	57.2	58%	0.578	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	0.2	179.7	-62.9	-44.5	0	0	0	117.1	L342 Y343 I348 F349	L342-D346 CarbonylContact O-C 3.59Å; L342-D346 PolarHBondContact O-N 2.97Å; Y343-D346 PolarHBondContact O-N 3.35Å; D346-I348 PolarHBondContact O-N 3.18Å; D346-F349 HydrophobicContact CB-CD2 4.17Å; D346-F349 PolarHBondContact O-N 2.93Å
347	C	97.2	Very high	96.7	Very high	13 Å²	13	50.7 Å²	50.7	9%	0.088	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-60.3	-30.2	179.4	-66.2	0	0	0	0	111.9	Y311 L342 N345 F349 D350 Y368	Y311-C347 WeakPolarHBondContact CE2-O 3.47Å; L342-C347 HydrophobicContact CB-CB 4.43Å; L342-C347 HydrophobicContact CD2-CB 3.83Å; L342-C347 PolarHBondContact O-N 2.81Å; N345-C347 PolarHBondContact O-N 3.29Å; N345-C347 PolarHBondContact O-SG 3.46Å; C347-F349 PolarHBondContact O-N 3.16Å; C347-D350 VanDerWaalsContact O-CB 3.26Å; C347-D350 WeakPolarHBondContact O-CB 3.37Å; C347-D350 VanDerWaalsContact O-CG 3.31Å; C347-D350 PolarHBondContact O-N 2.79Å; C347-Y368 HydrophobicContact CB-CE1 4.36Å; C347-Y368 PolarHBondContact O-OH 3.4Å
348	I	97	Very high	96.7	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.1	-18.4	177.4	-158.3	169.4	0	0	0	113.6	F287 I290 I291 Y311 L339 L342 Y343 D346	F287-I348 HydrophobicContact CD1-CD1 3.99Å; I290-I348 HydrophobicContact CB-CD1 4.44Å; I290-I348 HydrophobicContact CG2-CD1 3.8Å; I290-I348 HydrophobicContact CG2-CG1 3.9Å; I290-I348 HydrophobicContact CG2-CG2 4.08Å; I291-I348 HydrophobicContact CG2-CD1 3.85Å; I291-I348 HydrophobicContact CG2-CG1 4.09Å; Y311-I348 HydrophobicContact CD1-CG1 4.25Å; Y311-I348 WeakPolarHBondContact CD2-O 3.22Å; Y311-I348 HydrophobicContact CE1-CG1 4.13Å; L339-I348 HydrophobicContact CD2-CD1 4.04Å; L342-I348 HydrophobicContact CB-CB 4.25Å; L342-I348 PolarHBondContact O-N 2.82Å; L342-I348 VanDerWaalsContact O-N 3.1Å; Y343-I348 HydrophobicContact CD2-CG2 3.99Å; D346-I348 PolarHBondContact O-N 3.18Å
349	F	97.6	Very high	96.8	Very high	108 Å²	108	48.2 Å²	48.2	47%	0.474	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-94.7	3.1	178.4	-55.1	-65.1	0	0	0	113.6	I290 Y343 D346 C347 K351	I290-F349 HydrophobicContact CG2-CD1 4.35Å; I290-F349 HydrophobicContact CG2-CE1 3.85Å; Y343-F349 HydrophobicContact CD2-CE2 4.39Å; Y343-F349 HydrophobicContact CD2-CZ 4.03Å; Y343-F349 HydrophobicContact CE2-CE2 4.4Å; Y343-F349 AromaticContact CE2-CZ 3.82Å; Y343-F349 HydrophobicContact CE2-CZ 3.82Å; D346-F349 HydrophobicContact CB-CD2 4.17Å; D346-F349 PolarHBondContact O-N 2.93Å; C347-F349 PolarHBondContact O-N 3.16Å; F349-K351 PolarHBondContact O-N 3.37Å
350	D	98.1	Very high	96.8	Very high	21 Å²	21	48.1 Å²	48.1	11%	0.112	26%	0.258	C	S	.	.			trans	-60.8	127.4	174.8	-76.9	-36.9	0	0	0	111.2	C347 F352 Y368 K424 L426	C347-D350 VanDerWaalsContact O-CB 3.26Å; C347-D350 WeakPolarHBondContact O-CB 3.37Å; C347-D350 VanDerWaalsContact O-CG 3.31Å; C347-D350 PolarHBondContact O-N 2.79Å; D350-F352 HydrophobicContact CB-CD2 4.25Å; D350-F352 HydrophobicContact CB-CE2 3.66Å; D350-F352 HydrophobicContact CB-CZ 4.2Å; D350-Y368 VanDerWaalsContact OD2-CE1 3.23Å; D350-Y368 WeakPolarHBondContact OD2-CE1 3.26Å; D350-Y368 PolarHBondContact OD2-OH 3.2Å; D350-K424 IonicContact OD1-NZ 3.29Å; D350-K424 PolarHBondContact OD1-NZ 2.92Å; D350-K424 WeakPolarHBondContact OD2-CD 3.05Å; D350-K424 IonicContact OD2-NZ 2.96Å; D350-L426 HydrophobicContact CB-CD2 4.07Å
351	K	98.1	Very high	96.9	Very high	115 Å²	115	46 Å²	46	50%	0.5	24%	0.244	S	C	.	.			trans	-96.7	96	-178.6	-62.1	-176.6	-177.3	-178.6	0	109.8	F349	F349-K351 PolarHBondContact O-N 3.37Å
352	F	98.6	Very high	97	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.			trans	-81	133.1	178.3	-69.4	-88.2	0	0	0	111	S295 R309 Y311 D350 G366 Y368 I425 L426	S295-F352 PolarHBondContact OG-O 2.85Å; R309-F352 HydrophobicContact CG-CB 4.08Å; R309-F352 VanDerWaalsContact CG-O 3.3Å; R309-F352 WeakPolarHBondContact CG-O 3.41Å; Y311-F352 HydrophobicContact CE2-CE2 4.27Å; D350-F352 HydrophobicContact CB-CD2 4.25Å; D350-F352 HydrophobicContact CB-CE2 3.66Å; D350-F352 HydrophobicContact CB-CZ 4.2Å; F352-G366 WeakPolarHBondContact CD1-O 3.35Å; F352-Y368 HydrophobicContact CE2-CE2 4.1Å; F352-Y368 AromaticContact CE2-CZ 3.95Å; F352-Y368 HydrophobicContact CZ-CD1 4.45Å; F352-Y368 HydrophobicContact CZ-CD2 4.27Å; F352-Y368 HydrophobicContact CZ-CE1 4.02Å; F352-Y368 AromaticContact CZ-CE2 3.81Å; F352-Y368 HydrophobicContact CZ-CE2 3.81Å; F352-Y368 AromaticContact CZ-CZ 3.67Å; F352-I425 WeakPolarHBondContact CD1-O 3.43Å; F352-I425 WeakPolarHBondContact CE1-O 3.48Å; F352-L426 HydrophobicContact CD1-CD2 3.84Å; F352-L426 HydrophobicContact CD2-CD2 4.44Å; F352-L426 HydrophobicContact CE1-CD2 3.75Å; F352-L426 HydrophobicContact CE2-CD2 4.37Å; F352-L426 HydrophobicContact CG-CD2 4.18Å; F352-L426 HydrophobicContact CZ-CD2 4.03Å
353	E	98.6	Very high	97	Very high	20 Å²	20	43.9 Å²	43.9	9%	0.093	23%	0.229	C	C	.	.			trans	-85.9	162.4	172.5	-64.9	173	179.7	0	0	111.7	K104 D296 T365 L426 H427	K104-E353 IonicContact NZ-OE1 3.16Å; K104-E353 PolarHBondContact NZ-OE1 3.3Å; D296-E353 WeakPolarHBondContact OD2-CA 3.42Å; E353-T365 PolarHBondContact O-OG1 3.29Å; E353-L426 WeakPolarHBondContact CB-O 3.3Å; E353-L426 PolarHBondContact N-O 3.23Å; E353-H427 VanDerWaalsContact CD-ND1 3.28Å; E353-H427 IonicContact OE1-CE1 2.67Å; E353-H427 IonicContact OE1-ND1 3.17Å; E353-H427 PolarHBondContact OE1-ND1 2.79Å; E353-H427 IonicContact OE2-ND1 3.85Å; E353-H427 PolarHBondContact OE2-ND1 3.45Å
354	C	98.4	Very high	97.1	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151.9	175.1	58.8	0	0	0	0	110.7	D296 K298 M307 R309 M364	D296-C354 PolarHBondContact OD2-N 3.11Å; K298-C354 WeakPolarHBondContact CG-O 3.43Å; M307-C354 HydrophobicContact CE-CB 3.67Å; M307-C354 VanDerWaalsContact CE-SG 3.57Å; M307-C354 HydrophobicContact CG-CB 4.5Å; M307-C354 HydrophobicContact SD-CB 3.94Å; R309-C354 HydrophobicContact CB-CB 4.13Å; C354-M364 WeakPolarHBondContact CA-O 3.31Å
355	C	98.3	Very high	97.3	Very high	19 Å²	19	32.7 Å²	32.7	13%	0.128	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	151.1	177.5	63.5	0	0	0	0	112.7	M364	C355-M364 PolarHBondContact N-O 2.86Å; C355-M364 PolarHBondContact O-N 2.69Å; C355-M364 WeakPolarHBondContact SG-CE 3.28Å
356	W	98.4	Very high	97.5	Very high	10 Å²	10	27.3 Å²	27.3	4%	0.038	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	151.8	173.2	-60.8	100.9	0	0	0	110.8	K298 F299 M307 V316 D360 I363 W430	K298-W356 PolarHBondContact O-NE1 2.83Å; K298-W356 VanDerWaalsContact O-NE1 3.07Å; F299-W356 VanDerWaalsContact O-CD1 3.24Å; F299-W356 PolarHBondContact O-NE1 2.84Å; M307-W356 HydrophobicContact CB-CH2 4.26Å; M307-W356 HydrophobicContact CB-CZ2 3.4Å; M307-W356 VanDerWaalsContact CB-CZ2 3.4Å; M307-W356 HydrophobicContact CE-CD2 4.17Å; M307-W356 HydrophobicContact CE-CG 4.17Å; V316-W356 HydrophobicContact CB-CH2 4.44Å; V316-W356 HydrophobicContact CG1-CH2 3.75Å; V316-W356 HydrophobicContact CG1-CZ2 4.44Å; V316-W356 HydrophobicContact CG2-CH2 3.84Å; W356-D360 HydrophobicContact CE3-CB 4.15Å; W356-D360 HydrophobicContact CZ3-CB 4.46Å; W356-I363 HydrophobicContact CE3-CD1 4.45Å; W356-I363 HydrophobicContact CE3-CG1 3.82Å; W356-I363 HydrophobicContact CH2-CD1 4.29Å; W356-I363 HydrophobicContact CZ3-CD1 3.95Å; W356-I363 HydrophobicContact CZ3-CG1 3.81Å; W356-W430 VanDerWaalsContact O-CB 3.32Å; W356-W430 WeakPolarHBondContact O-CB 3.49Å
357	N	97	Very high	97.5	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.027	12%	0.124	C	C	.	.			trans	-72.9	166.8	157.4	78	-24.8	0	0	0	110.8	H301 S359 D360 S361 A362 W430	H301-N357 PolarHBondContact CE1-O 2.98Å; H301-N357 PolarHBondContact ND1-O 3.28Å; N357-S359 PolarHBondContact ND2-OG 2.75Å; N357-S359 VanDerWaalsContact ND2-OG 3.08Å; N357-S359 PolarHBondContact O-N 3.13Å; N357-D360 PolarHBondContact O-N 2.89Å; N357-D360 WeakPolarHBondContact OD1-CA 3.46Å; N357-D360 PolarHBondContact OD1-N 2.86Å; N357-S361 PolarHBondContact ND2-OG 3.25Å; N357-S361 PolarHBondContact OD1-N 2.84Å; N357-A362 HydrophobicContact CB-CB 4.26Å; N357-A362 PolarHBondContact N-O 3.46Å; N357-A362 PolarHBondContact OD1-N 3.23Å; N357-A362 PolarHBondContact OD1-O 2.9Å; N357-W430 HydrophobicContact CB-CD2 3.59Å; N357-W430 HydrophobicContact CB-CE3 3.87Å; N357-W430 HydrophobicContact CB-CG 4.22Å; N357-W430 HydrophobicContact CB-CH2 3.67Å; N357-W430 HydrophobicContact CB-CZ2 3.38Å; N357-W430 HydrophobicContact CB-CZ3 3.9Å
358	G	93.1	Very high	97.5	Very high	28 Å²	28	21.6 Å²	21.6	29%	0.289	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.4	-176.1	0	0	0	0	0	115.5	P432	G358-P432 WeakPolarHBondContact CA-O 3.4Å
359	S	95.2	Very high	97.5	Very high	82 Å²	82	22.3 Å²	22.3	57%	0.573	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	5.5	178.3	59.6	0	0	0	0	114.5	N357 S361	N357-S359 PolarHBondContact ND2-OG 2.75Å; N357-S359 VanDerWaalsContact ND2-OG 3.08Å; N357-S359 PolarHBondContact O-N 3.13Å; S359-S361 PolarHBondContact O-N 3.43Å; S359-S361 VanDerWaalsContact O-N 3.08Å; S359-S361 PolarHBondContact OG-OG 2.83Å
360	D	97.3	Very high	97.5	Very high	12 Å²	12	18.1 Å²	18.1	6%	0.064	11%	0.107	C	C	.	.	S	Bend	trans	58.2	10.9	-172.8	-55.5	-29.5	0	0	0	115.2	S300 H301 S302 W356 N357 R377	S300-D360 VanDerWaalsContact CB-OD2 3.29Å; S300-D360 WeakPolarHBondContact CB-OD2 3.12Å; H301-D360 WeakPolarHBondContact CB-OD1 3.12Å; H301-D360 IonicContact CE1-OD1 3.45Å; H301-D360 IonicContact CG-OD1 3.96Å; H301-D360 VanDerWaalsContact N-CG 3.33Å; H301-D360 PolarHBondContact N-OD1 3.05Å; H301-D360 PolarHBondContact N-OD2 3.24Å; H301-D360 VanDerWaalsContact N-OD2 3.12Å; H301-D360 IonicContact ND1-OD1 2.63Å; H301-D360 PolarHBondContact ND1-OD1 3.42Å; S302-D360 VanDerWaalsContact CB-OD2 3.29Å; S302-D360 WeakPolarHBondContact CB-OD2 3.49Å; S302-D360 PolarHBondContact N-OD2 3Å; S302-D360 PolarHBondContact OG-OD2 2.97Å; W356-D360 HydrophobicContact CE3-CB 4.15Å; W356-D360 HydrophobicContact CZ3-CB 4.46Å; N357-D360 PolarHBondContact O-N 2.89Å; N357-D360 WeakPolarHBondContact OD1-CA 3.46Å; N357-D360 PolarHBondContact OD1-N 2.86Å; D360-R377 WeakPolarHBondContact O-CD 3.37Å; D360-R377 PolarHBondContact O-NH1 3.12Å
361	S	96.3	Very high	97.4	Very high	24 Å²	24	17.1 Å²	17.1	17%	0.168	10%	0.101	C	C	.	.	S	Bend	trans	-87.4	-16.6	-176.8	64.8	0	0	0	0	113.8	N357 S359 R377	N357-S361 PolarHBondContact ND2-OG 3.25Å; N357-S361 PolarHBondContact OD1-N 2.84Å; S359-S361 PolarHBondContact O-N 3.43Å; S359-S361 VanDerWaalsContact O-N 3.08Å; S359-S361 PolarHBondContact OG-OG 2.83Å; S361-R377 WeakPolarHBondContact O-CB 3.34Å; S361-R377 WeakPolarHBondContact O-CG 3.24Å; S361-R377 PolarHBondContact O-N 2.9Å
362	A	96.9	Very high	97.4	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.008	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	151.6	177.7	0	0	0	0	0	111.6	F16 N357 F375 W430	F16-A362 HydrophobicContact CE2-CB 4.07Å; F16-A362 HydrophobicContact CZ-CB 4.32Å; N357-A362 HydrophobicContact CB-CB 4.26Å; N357-A362 PolarHBondContact N-O 3.46Å; N357-A362 PolarHBondContact OD1-N 3.23Å; N357-A362 PolarHBondContact OD1-O 2.9Å; A362-F375 CarbonylContact C-O 3.46Å; A362-F375 VanDerWaalsContact CA-O 3.24Å; A362-F375 WeakPolarHBondContact CA-O 3.48Å; A362-W430 HydrophobicContact CB-CH2 3.69Å; A362-W430 HydrophobicContact CB-CZ3 4.13Å
363	I	98.1	Very high	97.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.8	-178.3	-67.7	167.1	0	0	0	108.7	M307 V314 V316 W356 M374 F375 R377	M307-I363 HydrophobicContact CE-CG2 4.25Å; M307-I363 HydrophobicContact SD-CB 4.17Å; M307-I363 HydrophobicContact SD-CD1 3.86Å; M307-I363 HydrophobicContact SD-CG1 3.81Å; M307-I363 HydrophobicContact SD-CG2 3.32Å; M307-I363 WeakPolarHBondContact SD-CG2 2.97Å; V314-I363 HydrophobicContact CG1-CD1 4.48Å; V314-I363 HydrophobicContact CG1-CG2 4.04Å; V316-I363 HydrophobicContact CG2-CD1 3.52Å; W356-I363 HydrophobicContact CE3-CD1 4.45Å; W356-I363 HydrophobicContact CE3-CG1 3.82Å; W356-I363 HydrophobicContact CH2-CD1 4.29Å; W356-I363 HydrophobicContact CZ3-CD1 3.95Å; W356-I363 HydrophobicContact CZ3-CG1 3.81Å; I363-M374 CarbonylContact O-C 3.54Å; I363-M374 VanDerWaalsContact O-CA 3.24Å; I363-M374 WeakPolarHBondContact O-CA 3.26Å; I363-F375 HydrophobicContact CB-CB 4.34Å; I363-F375 HydrophobicContact CG2-CD2 4.29Å; I363-F375 PolarHBondContact N-O 3.39Å; I363-F375 PolarHBondContact O-N 2.87Å; I363-R377 HydrophobicContact CD1-CG 4.13Å; I363-R377 HydrophobicContact CG1-CG 4.44Å
364	M	98.3	Very high	97.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.2	170.5	179.4	177.1	63.7	0	0	110.8	C354 C355 F372 R373 M374 T428 W430 I437 V439	C354-M364 WeakPolarHBondContact CA-O 3.31Å; C355-M364 PolarHBondContact N-O 2.86Å; C355-M364 PolarHBondContact O-N 2.69Å; C355-M364 WeakPolarHBondContact SG-CE 3.28Å; M364-F372 HydrophobicContact CG-CD2 4.42Å; M364-F372 HydrophobicContact SD-CD2 4.15Å; M364-R373 WeakPolarHBondContact CA-O 3.42Å; M364-M374 HydrophobicContact CG-CG 4.38Å; M364-T428 HydrophobicContact CE-CG2 4.47Å; M364-W430 HydrophobicContact CB-CE3 3.75Å; M364-W430 HydrophobicContact CB-CZ3 3.81Å; M364-I437 HydrophobicContact CE-CB 3.98Å; M364-I437 HydrophobicContact CE-CG2 3.93Å; M364-I437 HydrophobicContact SD-CB 3.99Å; M364-I437 HydrophobicContact SD-CD1 3.78Å; M364-I437 HydrophobicContact SD-CG1 4.45Å; M364-I437 HydrophobicContact SD-CG2 3.95Å; M364-V439 HydrophobicContact SD-CG2 4.38Å
365	T	98.8	Very high	97.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	161.3	171.7	-168.3	0	0	0	0	111	R309 V314 V331 E353 F372 R373 F375	R309-T365 PolarHBondContact NH1-OG1 2.81Å; V314-T365 HydrophobicContact CG2-CG2 3.7Å; V331-T365 HydrophobicContact CG1-CG2 4.09Å; V331-T365 HydrophobicContact CG2-CG2 3.88Å; E353-T365 PolarHBondContact O-OG1 3.29Å; T365-F372 CarbonylContact O-C 3.57Å; T365-F372 WeakPolarHBondContact O-CA 3.35Å; T365-R373 HydrophobicContact CG2-CB 4.2Å; T365-R373 PolarHBondContact N-O 3.3Å; T365-R373 PolarHBondContact O-N 2.84Å; T365-F375 HydrophobicContact CG2-CE2 4.16Å
366	G	98.4	Very high	97.2	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	170.8	-178.5	0	0	0	0	0	115.7	R309 F352 I425	R309-G366 PolarHBondContact NH1-O 2.76Å; F352-G366 WeakPolarHBondContact CD1-O 3.35Å; G366-I425 VanDerWaalsContact CA-O 3.28Å; G366-I425 WeakPolarHBondContact CA-O 3.4Å
367	S	98.4	Very high	97	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.083	C	C	.	.			trans	-153.4	-170.3	174.4	-169.4	0	0	0	0	109.4	H332 F371 I425	H332-S367 PolarHBondContact ND1-OG 2.66Å; S367-F371 CarbonylContact C-O 3.58Å; S367-F371 WeakPolarHBondContact CA-O 3.24Å; S367-F371 PolarHBondContact N-O 2.81Å; S367-I425 PolarHBondContact O-N 2.9Å
368	Y	97.7	Very high	96.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-83.1	173.7	177.2	-61.8	-76.9	0	0	0	112.7	Y311 H332 L335 C347 D350 F352 N370 F371 F421 K423 K424	Y311-Y368 HydrophobicContact CE2-CE2 4.4Å; Y311-Y368 WeakPolarHBondContact CE2-OH 3.49Å; Y311-Y368 PolarHBondContact OH-OH 3.02Å; Y311-Y368 VanDerWaalsContact OH-OH 3.12Å; H332-Y368 AromaticContact CE1-CE2 3.9Å; L335-Y368 HydrophobicContact CD1-CD2 3.61Å; L335-Y368 HydrophobicContact CD1-CE2 3.84Å; C347-Y368 HydrophobicContact CB-CE1 4.36Å; C347-Y368 PolarHBondContact O-OH 3.4Å; D350-Y368 VanDerWaalsContact OD2-CE1 3.23Å; D350-Y368 WeakPolarHBondContact OD2-CE1 3.26Å; D350-Y368 PolarHBondContact OD2-OH 3.2Å; F352-Y368 HydrophobicContact CE2-CE2 4.1Å; F352-Y368 AromaticContact CE2-CZ 3.95Å; F352-Y368 HydrophobicContact CZ-CD1 4.45Å; F352-Y368 HydrophobicContact CZ-CD2 4.27Å; F352-Y368 HydrophobicContact CZ-CE1 4.02Å; F352-Y368 AromaticContact CZ-CE2 3.81Å; F352-Y368 HydrophobicContact CZ-CE2 3.81Å; F352-Y368 AromaticContact CZ-CZ 3.67Å; Y368-N370 VanDerWaalsContact C-N 3.27Å; Y368-N370 PolarHBondContact O-N 3.17Å; Y368-F371 WeakPolarHBondContact O-CB 3.46Å; Y368-F371 WeakPolarHBondContact O-CD2 3.4Å; Y368-F371 WeakPolarHBondContact O-CG 3.35Å; Y368-F371 PolarHBondContact O-N 2.79Å; Y368-F421 HydrophobicContact CD1-CB 4.1Å; Y368-F421 AromaticContact CD1-CD1 3.69Å; Y368-F421 HydrophobicContact CD1-CD1 3.69Å; Y368-F421 HydrophobicContact CD1-CG 4.39Å; Y368-F421 WeakPolarHBondContact CD1-O 3.43Å; Y368-F421 AromaticContact CD2-CD1 3.85Å; Y368-F421 HydrophobicContact CD2-CD1 3.85Å; Y368-F421 HydrophobicContact CD2-CE1 4.09Å; Y368-F421 HydrophobicContact CE1-CB 4.4Å; Y368-F421 HydrophobicContact CE1-CD1 4.09Å; Y368-F421 HydrophobicContact CE2-CD1 4.24Å; Y368-F421 AromaticContact CG-CD1 3.55Å; Y368-F421 HydrophobicContact CG-CD1 3.55Å; Y368-F421 HydrophobicContact CG-CE1 4.13Å; Y368-K423 CarbonylContact C-O 3.56Å; Y368-K423 VanDerWaalsContact C-O 3.25Å; Y368-K423 WeakPolarHBondContact CA-O 3.49Å; Y368-K424 HydrophobicContact CD1-CB 4Å; Y368-K424 HydrophobicContact CE1-CB 4.18Å
369	N	96.3	Very high	96.7	Very high	21 Å²	21	21.6 Å²	21.6	11%	0.112	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	37.1	-175.7	-159.7	78.2	0	0	0	113.9	F371 L419 D420 K423	N369-F371 HydrophobicContact CB-CD2 4.21Å; N369-F371 HydrophobicContact CB-CE1 4.37Å; N369-F371 HydrophobicContact CB-CE2 4.02Å; N369-F371 HydrophobicContact CB-CG 4.47Å; N369-F371 HydrophobicContact CB-CZ 4.09Å; N369-F371 WeakPolarHBondContact ND2-CE1 3.38Å; N369-F371 WeakPolarHBondContact ND2-CZ 3.24Å; N369-F371 VanDerWaalsContact O-CD1 3.28Å; N369-F371 WeakPolarHBondContact O-CD1 3.4Å; N369-F371 WeakPolarHBondContact O-CE1 3.37Å; N369-F371 PolarHBondContact O-N 2.84Å; N369-F371 VanDerWaalsContact O-N 3.11Å; N369-L419 HydrophobicContact CB-CB 4.4Å; N369-L419 HydrophobicContact CB-CD2 3.79Å; N369-D420 WeakPolarHBondContact CA-O 3.46Å; N369-D420 PolarHBondContact N-O 3.02Å; N369-D420 PolarHBondContact OD1-N 2.67Å; N369-D420 VanDerWaalsContact OD1-N 3.11Å; N369-K423 CarbonylContact C-O 3.59Å; N369-K423 WeakPolarHBondContact CA-O 3.39Å; N369-K423 PolarHBondContact N-O 2.92Å
370	N	96.4	Very high	96.4	Very high	21 Å²	21	27.8 Å²	27.8	11%	0.112	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	24.4	-171.4	-70.1	-17.1	0	0	0	113.8	Y368 A387 K423 I425	Y368-N370 VanDerWaalsContact C-N 3.27Å; Y368-N370 PolarHBondContact O-N 3.17Å; N370-A387 HydrophobicContact CB-CB 4.4Å; N370-A387 VanDerWaalsContact CB-O 3.28Å; N370-A387 WeakPolarHBondContact CB-O 3.03Å; N370-A387 PolarHBondContact ND2-O 3.44Å; N370-A387 PolarHBondContact O-N 3.32Å; N370-K423 PolarHBondContact N-O 2.82Å; N370-K423 WeakPolarHBondContact OD1-CB 3.43Å; N370-I425 HydrophobicContact CB-CD1 4.17Å
371	F	97.8	Very high	96.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	146.3	176.5	-62.7	-22.1	0	0	0	111.7	S367 Y368 N369 T384 L385 E386 R401 V403 I414 L419 I425	S367-F371 CarbonylContact C-O 3.58Å; S367-F371 WeakPolarHBondContact CA-O 3.24Å; S367-F371 PolarHBondContact N-O 2.81Å; Y368-F371 WeakPolarHBondContact O-CB 3.46Å; Y368-F371 WeakPolarHBondContact O-CD2 3.4Å; Y368-F371 WeakPolarHBondContact O-CG 3.35Å; Y368-F371 PolarHBondContact O-N 2.79Å; N369-F371 HydrophobicContact CB-CD2 4.21Å; N369-F371 HydrophobicContact CB-CE1 4.37Å; N369-F371 HydrophobicContact CB-CE2 4.02Å; N369-F371 HydrophobicContact CB-CG 4.47Å; N369-F371 HydrophobicContact CB-CZ 4.09Å; N369-F371 WeakPolarHBondContact ND2-CE1 3.38Å; N369-F371 WeakPolarHBondContact ND2-CZ 3.24Å; N369-F371 VanDerWaalsContact O-CD1 3.28Å; N369-F371 WeakPolarHBondContact O-CD1 3.4Å; N369-F371 WeakPolarHBondContact O-CE1 3.37Å; N369-F371 PolarHBondContact O-N 2.84Å; N369-F371 VanDerWaalsContact O-N 3.11Å; F371-T384 HydrophobicContact CB-CG2 3.87Å; F371-T384 HydrophobicContact CD2-CG2 3.99Å; F371-T384 HydrophobicContact CG-CG2 3.89Å; F371-L385 VanDerWaalsContact CA-O 3.23Å; F371-L385 WeakPolarHBondContact CA-O 3.47Å; F371-E386 HydrophobicContact CD1-CB 3.81Å; F371-E386 HydrophobicContact CD1-CG 4.02Å; F371-E386 HydrophobicContact CE1-CB 3.9Å; F371-E386 HydrophobicContact CE1-CG 3.91Å; F371-R401 HydrophobicContact CE1-CB 4.19Å; F371-R401 HydrophobicContact CE1-CG 3.97Å; F371-R401 HydrophobicContact CZ-CB 4.25Å; F371-R401 HydrophobicContact CZ-CG 4.43Å; F371-V403 HydrophobicContact CD2-CG2 4.31Å; F371-V403 HydrophobicContact CE2-CG2 3.74Å; F371-I414 HydrophobicContact CE1-CD1 4.31Å; F371-I414 HydrophobicContact CZ-CD1 3.63Å; F371-L419 HydrophobicContact CE2-CD2 3.75Å; F371-L419 HydrophobicContact CZ-CD2 4.42Å; F371-I425 WeakPolarHBondContact O-CG1 3.42Å
372	F	98	Very high	96.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151	164.9	62.1	-81.9	0	0	0	108.9	M364 T365 M374 L385 A387 L398 I437 V439 F448	M364-F372 HydrophobicContact CG-CD2 4.42Å; M364-F372 HydrophobicContact SD-CD2 4.15Å; T365-F372 CarbonylContact O-C 3.57Å; T365-F372 WeakPolarHBondContact O-CA 3.35Å; F372-M374 HydrophobicContact CD2-CG 4.25Å; F372-M374 HydrophobicContact CD2-SD 4.49Å; F372-M374 HydrophobicContact CE2-CG 4.43Å; F372-M374 HydrophobicContact CE2-SD 4.12Å; F372-L385 HydrophobicContact CD1-CB 4.26Å; F372-L385 HydrophobicContact CD2-CB 4.21Å; F372-L385 HydrophobicContact CE1-CB 3.7Å; F372-L385 HydrophobicContact CE2-CB 3.65Å; F372-L385 HydrophobicContact CE2-CD1 3.69Å; F372-L385 HydrophobicContact CE2-CG 4.24Å; F372-L385 HydrophobicContact CG-CB 4.5Å; F372-L385 HydrophobicContact CZ-CB 3.37Å; F372-L385 HydrophobicContact CZ-CD1 3.89Å; F372-L385 HydrophobicContact CZ-CG 4.27Å; F372-L385 PolarHBondContact N-O 3.12Å; F372-L385 PolarHBondContact O-N 2.9Å; F372-A387 HydrophobicContact CE1-CB 4.48Å; F372-L398 HydrophobicContact CZ-CD1 3.97Å; F372-I437 HydrophobicContact CD2-CD1 4.47Å; F372-I437 HydrophobicContact CE2-CD1 3.66Å; F372-I437 HydrophobicContact CZ-CD1 4.17Å; F372-V439 HydrophobicContact CD1-CG1 4.24Å; F372-V439 HydrophobicContact CD1-CG2 4.41Å; F372-V439 HydrophobicContact CE1-CG2 4.47Å; F372-V439 HydrophobicContact CG-CG2 4.45Å; F372-F448 HydrophobicContact CE1-CD2 4.34Å; F372-F448 AromaticContact CE1-CE2 3.76Å; F372-F448 HydrophobicContact CE1-CE2 3.76Å; F372-F448 HydrophobicContact CE1-CZ 4.29Å; F372-F448 AromaticContact CZ-CD2 3.9Å; F372-F448 HydrophobicContact CZ-CD2 3.9Å; F372-F448 AromaticContact CZ-CE2 3.78Å; F372-F448 HydrophobicContact CZ-CE2 3.78Å; F372-F448 HydrophobicContact CZ-CZ 4.47Å
373	R	97.7	Very high	96	Very high	14 Å²	14	39.4 Å²	39.4	5%	0.053	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.9	-171.6	-65.4	-90.9	-67.6	132.5	-9.5	108.1	Q330 V331 M364 T365 F375 D382 V383 T384	Q330-R373 PolarHBondContact O-NH2 2.93Å; V331-R373 HydrophobicContact CG1-CB 4.4Å; V331-R373 HydrophobicContact CG1-CG 3.8Å; V331-R373 VanDerWaalsContact O-CD 3.3Å; V331-R373 WeakPolarHBondContact O-CD 3.37Å; V331-R373 PolarHBondContact O-NE 2.76Å; M364-R373 WeakPolarHBondContact CA-O 3.42Å; T365-R373 HydrophobicContact CG2-CB 4.2Å; T365-R373 PolarHBondContact N-O 3.3Å; T365-R373 PolarHBondContact O-N 2.84Å; R373-F375 HydrophobicContact CB-CE2 3.74Å; R373-F375 HydrophobicContact CB-CZ 4.02Å; R373-F375 VanDerWaalsContact CZ-CZ 3.42Å; R373-F375 VanDerWaalsContact NH2-CZ 3.32Å; R373-D382 IonicContact CZ-OD2 2.81Å; R373-D382 VanDerWaalsContact CZ-OD2 3.29Å; R373-D382 IonicContact NH1-OD2 2.72Å; R373-D382 PolarHBondContact NH1-OD2 3.38Å; R373-D382 IonicContact NH2-OD2 2.84Å; R373-D382 PolarHBondContact NH2-OD2 3.02Å; R373-V383 WeakPolarHBondContact CA-O 3.49Å; R373-V383 PolarHBondContact NH1-O 3.32Å; R373-T384 WeakPolarHBondContact CD-OG1 3.36Å
374	M	97.3	Very high	95.9	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.039	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.3	173.5	-50.8	-174	70.4	0	0	109.5	W18 I363 M364 F372 D382 V383 L385 W430 I437	W18-M374 HydrophobicContact CD2-SD 4.38Å; W18-M374 HydrophobicContact CG-SD 4.44Å; W18-M374 HydrophobicContact CH2-CE 4.3Å; W18-M374 HydrophobicContact CZ2-CE 3.34Å; W18-M374 HydrophobicContact CZ2-SD 4.13Å; W18-M374 PolarHBondContact NE1-SD 3.34Å; I363-M374 CarbonylContact O-C 3.54Å; I363-M374 VanDerWaalsContact O-CA 3.24Å; I363-M374 WeakPolarHBondContact O-CA 3.26Å; M364-M374 HydrophobicContact CG-CG 4.38Å; F372-M374 HydrophobicContact CD2-CG 4.25Å; F372-M374 HydrophobicContact CD2-SD 4.49Å; F372-M374 HydrophobicContact CE2-CG 4.43Å; F372-M374 HydrophobicContact CE2-SD 4.12Å; M374-D382 CarbonylContact O-C 3.57Å; M374-D382 VanDerWaalsContact O-CA 3.22Å; M374-D382 WeakPolarHBondContact O-CA 3.31Å; M374-V383 HydrophobicContact CB-CG1 3.85Å; M374-V383 HydrophobicContact CG-CG1 4.37Å; M374-V383 PolarHBondContact N-O 2.91Å; M374-V383 PolarHBondContact O-N 2.95Å; M374-L385 HydrophobicContact SD-CD1 3.98Å; M374-W430 HydrophobicContact CE-CE3 4.29Å; M374-W430 HydrophobicContact CE-CH2 3.12Å; M374-W430 HydrophobicContact CE-CZ2 3.91Å; M374-W430 HydrophobicContact CE-CZ3 3.36Å; M374-I437 HydrophobicContact SD-CD1 4.39Å
375	F	97.4	Very high	95.8	Very high	5 Å²	5	40.5 Å²	40.5	2%	0.022	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.6	-178.2	-55.9	-89.2	0	0	0	108.6	H329 V331 A362 I363 T365 R373 D382	H329-F375 HydrophobicContact CB-CD1 3.64Å; H329-F375 HydrophobicContact CB-CD2 4.25Å; H329-F375 HydrophobicContact CB-CE1 3.62Å; H329-F375 HydrophobicContact CB-CE2 4.24Å; H329-F375 HydrophobicContact CB-CG 3.95Å; H329-F375 HydrophobicContact CB-CZ 3.93Å; H329-F375 AromaticContact CG-CD1 3.77Å; H329-F375 AromaticContact CG-CG 3.91Å; H329-F375 AromaticContact ND1-CD1 3.59Å; H329-F375 AromaticContact ND1-CG 3.96Å; V331-F375 HydrophobicContact CG2-CE2 4.43Å; V331-F375 HydrophobicContact CG2-CZ 4.32Å; A362-F375 CarbonylContact C-O 3.46Å; A362-F375 VanDerWaalsContact CA-O 3.24Å; A362-F375 WeakPolarHBondContact CA-O 3.48Å; I363-F375 HydrophobicContact CB-CB 4.34Å; I363-F375 HydrophobicContact CG2-CD2 4.29Å; I363-F375 PolarHBondContact N-O 3.39Å; I363-F375 PolarHBondContact O-N 2.87Å; T365-F375 HydrophobicContact CG2-CE2 4.16Å; R373-F375 HydrophobicContact CB-CE2 3.74Å; R373-F375 HydrophobicContact CB-CZ 4.02Å; R373-F375 VanDerWaalsContact CZ-CZ 3.42Å; R373-F375 VanDerWaalsContact NH2-CZ 3.32Å; F375-D382 HydrophobicContact CD1-CB 3.5Å; F375-D382 HydrophobicContact CE1-CB 3.8Å; F375-D382 HydrophobicContact CG-CB 4.4Å
376	D	95.7	Very high	95.6	Very high	28 Å²	28	41.9 Å²	41.9	15%	0.15	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	120.1	171.1	-177.2	-69.4	0	0	0	108.3	D378 T379 R380 R381	D376-D378 PolarHBondContact OD1-N 2.92Å; D376-D378 VanDerWaalsContact OD1-N 3.16Å; D376-T379 WeakPolarHBondContact CB-OG1 3.45Å; D376-T379 WeakPolarHBondContact OD1-CB 3.34Å; D376-T379 WeakPolarHBondContact OD1-CG2 3.43Å; D376-T379 PolarHBondContact OD1-N 3.1Å; D376-T379 PolarHBondContact OD1-OG1 3.21Å; D376-R380 WeakPolarHBondContact O-CA 3.29Å; D376-R380 PolarHBondContact O-N 3.19Å; D376-R381 PolarHBondContact N-O 2.93Å
377	R	94.6	Very high	95.4	Very high	32 Å²	32	41.9 Å²	41.9	12%	0.121	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-31.7	-172.1	-63.1	177.8	59.2	-149.9	-1	112.5	E327 D360 S361 I363	E327-R377 IonicContact OE1-CZ 2.74Å; E327-R377 VanDerWaalsContact OE1-CZ 3.25Å; E327-R377 IonicContact OE1-NE 3.73Å; E327-R377 PolarHBondContact OE1-NE 2.63Å; E327-R377 IonicContact OE1-NH2 3.25Å; E327-R377 PolarHBondContact OE1-NH2 2.89Å; E327-R377 WeakPolarHBondContact OE2-CG 3.33Å; E327-R377 IonicContact OE2-NE 3.03Å; E327-R377 PolarHBondContact OE2-NE 3.39Å; D360-R377 WeakPolarHBondContact O-CD 3.37Å; D360-R377 PolarHBondContact O-NH1 3.12Å; S361-R377 WeakPolarHBondContact O-CB 3.34Å; S361-R377 WeakPolarHBondContact O-CG 3.24Å; S361-R377 PolarHBondContact O-N 2.9Å; I363-R377 HydrophobicContact CD1-CG 4.13Å; I363-R377 HydrophobicContact CG1-CG 4.44Å
378	D	91.9	Very high	94.9	Very high	132 Å²	132	42.8 Å²	42.8	71%	0.706	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-47	-176.7	-65.2	-35.5	0	0	0	111.1	D376	D376-D378 PolarHBondContact OD1-N 2.92Å; D376-D378 VanDerWaalsContact OD1-N 3.16Å
379	T	91.4	Very high	94.2	Very high	73 Å²	73	46.3 Å²	46.3	45%	0.448	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-14.3	-178.7	67	0	0	0	0	113.3	D376 R381	D376-T379 WeakPolarHBondContact CB-OG1 3.45Å; D376-T379 WeakPolarHBondContact OD1-CB 3.34Å; D376-T379 WeakPolarHBondContact OD1-CG2 3.43Å; D376-T379 PolarHBondContact OD1-N 3.1Å; D376-T379 PolarHBondContact OD1-OG1 3.21Å; T379-R381 PolarHBondContact O-N 3.22Å; T379-R381 PolarHBondContact OG1-N 2.67Å
380	R	89.7	Confident	93.1	Very high	213 Å²	213	54.5 Å²	54.5	80%	0.804	25%	0.254	S	S	*	.			trans	56.1	27.1	-173.3	-56.3	-176	175	-170.4	-2.9	113.4	D376	D376-R380 WeakPolarHBondContact O-CA 3.29Å; D376-R380 PolarHBondContact O-N 3.19Å
381	R	92.3	Very high	91.6	Very high	145 Å²	145	55.7 Å²	55.7	55%	0.547	26%	0.264	S	S	.	.			trans	-91.5	146.6	174	-67.9	-179.8	176.6	-173.2	-1.1	109.5	D15 D376 T379	D15-R381 VanDerWaalsContact CG-NH1 3.29Å; D15-R381 IonicContact OD1-CZ 3.98Å; D15-R381 IonicContact OD1-NH1 3.17Å; D15-R381 PolarHBondContact OD1-NH1 2.74Å; D15-R381 IonicContact OD2-NH1 3.66Å; D15-R381 PolarHBondContact OD2-NH1 3.26Å; D376-R381 PolarHBondContact N-O 2.93Å; T379-R381 PolarHBondContact O-N 3.22Å; T379-R381 PolarHBondContact OG1-N 2.67Å
382	D	94.3	Very high	90.3	Very high	94 Å²	94	56.7 Å²	56.7	50%	0.503	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.3	176	68.5	-73.6	0	0	0	111.4	R373 M374 F375	R373-D382 IonicContact CZ-OD2 2.81Å; R373-D382 VanDerWaalsContact CZ-OD2 3.29Å; R373-D382 IonicContact NH1-OD2 2.72Å; R373-D382 PolarHBondContact NH1-OD2 3.38Å; R373-D382 IonicContact NH2-OD2 2.84Å; R373-D382 PolarHBondContact NH2-OD2 3.02Å; M374-D382 CarbonylContact O-C 3.57Å; M374-D382 VanDerWaalsContact O-CA 3.22Å; M374-D382 WeakPolarHBondContact O-CA 3.31Å; F375-D382 HydrophobicContact CD1-CB 3.5Å; F375-D382 HydrophobicContact CE1-CB 3.8Å; F375-D382 HydrophobicContact CG-CB 4.4Å
383	V	95.3	Very high	89.3	Confident	41 Å²	41	64.4 Å²	64.4	25%	0.248	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.1	178.1	65.4	0	0	0	0	110	R373 M374 L385 P400	R373-V383 WeakPolarHBondContact CA-O 3.49Å; R373-V383 PolarHBondContact NH1-O 3.32Å; M374-V383 HydrophobicContact CB-CG1 3.85Å; M374-V383 HydrophobicContact CG-CG1 4.37Å; M374-V383 PolarHBondContact N-O 2.91Å; M374-V383 PolarHBondContact O-N 2.95Å; V383-L385 HydrophobicContact CG1-CD1 4.37Å; V383-L385 HydrophobicContact CG1-CG 4.31Å; V383-L385 HydrophobicContact CG2-CD2 3.8Å; V383-L385 HydrophobicContact CG2-CG 4.08Å; V383-P400 HydrophobicContact CG2-CB 3.87Å; V383-P400 HydrophobicContact CG2-CG 3.84Å
384	T	96.2	Very high	88.3	Confident	18 Å²	18	68.8 Å²	68.8	11%	0.11	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.6	170	-54.5	0	0	0	0	108	F371 R373 P400 R401	F371-T384 HydrophobicContact CB-CG2 3.87Å; F371-T384 HydrophobicContact CD2-CG2 3.99Å; F371-T384 HydrophobicContact CG-CG2 3.89Å; R373-T384 WeakPolarHBondContact CD-OG1 3.36Å; T384-P400 CarbonylContact O-C 3.52Å; T384-P400 WeakPolarHBondContact O-CA 3.43Å; T384-R401 WeakPolarHBondContact CB-O 3.47Å; T384-R401 HydrophobicContact CG2-CB 4.43Å; T384-R401 PolarHBondContact O-N 3.45Å
385	L	95.5	Very high	87.3	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.026	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	165	180	-61.1	175.4	0	0	0	109.3	W18 F371 F372 M374 V383 L398	W18-L385 HydrophobicContact CB-CD1 4.14Å; W18-L385 HydrophobicContact CG-CD1 4.02Å; F371-L385 VanDerWaalsContact CA-O 3.23Å; F371-L385 WeakPolarHBondContact CA-O 3.47Å; F372-L385 HydrophobicContact CD1-CB 4.26Å; F372-L385 HydrophobicContact CD2-CB 4.21Å; F372-L385 HydrophobicContact CE1-CB 3.7Å; F372-L385 HydrophobicContact CE2-CB 3.65Å; F372-L385 HydrophobicContact CE2-CD1 3.69Å; F372-L385 HydrophobicContact CE2-CG 4.24Å; F372-L385 HydrophobicContact CG-CB 4.5Å; F372-L385 HydrophobicContact CZ-CB 3.37Å; F372-L385 HydrophobicContact CZ-CD1 3.89Å; F372-L385 HydrophobicContact CZ-CG 4.27Å; F372-L385 PolarHBondContact N-O 3.12Å; F372-L385 PolarHBondContact O-N 2.9Å; M374-L385 HydrophobicContact SD-CD1 3.98Å; V383-L385 HydrophobicContact CG1-CD1 4.37Å; V383-L385 HydrophobicContact CG1-CG 4.31Å; V383-L385 HydrophobicContact CG2-CD2 3.8Å; V383-L385 HydrophobicContact CG2-CG 4.08Å; L385-L398 HydrophobicContact CB-CD1 4.26Å; L385-L398 HydrophobicContact CD1-CD1 4.06Å; L385-L398 HydrophobicContact CD2-CB 3.92Å
386	E	95.3	Very high	86.8	Confident	29 Å²	29	77.6 Å²	77.6	14%	0.136	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.5	-173.8	179.3	-178.1	-147.8	0	0	110.6	F371 S388 R401	F371-E386 HydrophobicContact CD1-CB 3.81Å; F371-E386 HydrophobicContact CD1-CG 4.02Å; F371-E386 HydrophobicContact CE1-CB 3.9Å; F371-E386 HydrophobicContact CE1-CG 3.91Å; E386-S388 PolarHBondContact O-N 2.89Å; E386-R401 HydrophobicContact CB-CG 4.02Å; E386-R401 IonicContact OE2-CZ 3.89Å; E386-R401 IonicContact OE2-NE 2.78Å; E386-R401 PolarHBondContact OE2-NE 3.15Å; E386-R401 IonicContact OE2-NH2 3.56Å; E386-R401 PolarHBondContact OE2-NH2 3.29Å
387	A	94.2	Very high	86.4	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	38%	0.383	C	S	.	.			trans	-90.1	97	170.4	0	0	0	0	0	110.1	N370 F372 I425 V439 Y446 F448	N370-A387 HydrophobicContact CB-CB 4.4Å; N370-A387 VanDerWaalsContact CB-O 3.28Å; N370-A387 WeakPolarHBondContact CB-O 3.03Å; N370-A387 PolarHBondContact ND2-O 3.44Å; N370-A387 PolarHBondContact O-N 3.32Å; F372-A387 HydrophobicContact CE1-CB 4.48Å; A387-I425 HydrophobicContact CB-CD1 4.38Å; A387-V439 HydrophobicContact CB-CG1 4.17Å; A387-Y446 HydrophobicContact CB-CD1 4.34Å; A387-Y446 HydrophobicContact CB-CD2 3.84Å; A387-Y446 HydrophobicContact CB-CE1 4.49Å; A387-Y446 HydrophobicContact CB-CE2 4.01Å; A387-Y446 HydrophobicContact CB-CG 4.01Å; A387-F448 HydrophobicContact CB-CE2 4.41Å; A387-F448 HydrophobicContact CB-CZ 4.19Å
388	S	89	Confident	86.2	Confident	19 Å²	19	78 Å²	78	13%	0.133	38%	0.383	C	S	.	.			trans	-141.3	128.2	-178.7	168.2	0	0	0	0	112.6	E386 E390 S391 S392	E386-S388 PolarHBondContact O-N 2.89Å; S388-E390 PolarHBondContact O-N 3.4Å; S388-E390 PolarHBondContact OG-N 2.89Å; S388-S391 PolarHBondContact O-N 2.77Å; S388-S391 VanDerWaalsContact O-N 3.17Å; S388-S391 PolarHBondContact O-OG 3.25Å; S388-S392 PolarHBondContact O-N 3.09Å; S388-S392 PolarHBondContact O-OG 2.83Å
389	R	81.1	Confident	86.1	Confident	74 Å²	74	79.7 Å²	79.7	28%	0.279	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-57.1	-34	174.5	-74.3	-178	179.8	-98.3	4.8	112.9	V23 G25 A26 S391 S392 N444 Y446	V23-R389 VanDerWaalsContact CG1-NH1 3.32Å; V23-R389 HydrophobicContact CG2-CG 4.47Å; G25-R389 VanDerWaalsContact C-NH2 3.28Å; G25-R389 PolarHBondContact O-NH2 3.03Å; A26-R389 PolarHBondContact O-NH2 3.05Å; R389-S391 PolarHBondContact O-N 3.01Å; R389-S392 WeakPolarHBondContact CA-OG 3.46Å; R389-S392 VanDerWaalsContact O-CB 3.26Å; R389-S392 WeakPolarHBondContact O-CB 3.49Å; R389-S392 PolarHBondContact O-N 3.26Å; R389-N444 PolarHBondContact NH2-OD1 2.85Å; R389-Y446 HydrophobicContact CG-CE1 4.33Å; R389-Y446 PolarHBondContact N-OH 2.78Å
390	E	74.3	Confident	86.1	Confident	194 Å²	194	80.4 Å²	80.4	91%	0.907	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-63.7	-26.1	-179	-62.2	177	178.8	0	0	112.9	S388	S388-E390 PolarHBondContact O-N 3.4Å; S388-E390 PolarHBondContact OG-N 2.89Å
391	S	65.6	Low	86.2	Confident	45 Å²	45	73.6 Å²	73.6	32%	0.315	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-101.9	5.2	177.3	57	0	0	0	0	113.5	S388 R389 K393	S388-S391 PolarHBondContact O-N 2.77Å; S388-S391 VanDerWaalsContact O-N 3.17Å; S388-S391 PolarHBondContact O-OG 3.25Å; R389-S391 PolarHBondContact O-N 3.01Å; S391-K393 PolarHBondContact O-N 3.11Å
392	S	68.9	Low	86.1	Confident	21 Å²	21	73.3 Å²	73.3	15%	0.147	37%	0.367	C	S	.	.			trans	-93.5	54.6	-170.6	-64.8	0	0	0	0	113.8	F20 S388 R389	F20-S392 WeakPolarHBondContact CD1-O 3.26Å; F20-S392 WeakPolarHBondContact CD2-OG 2.98Å; F20-S392 WeakPolarHBondContact CE1-O 3.05Å; F20-S392 VanDerWaalsContact CE2-CB 3.47Å; F20-S392 WeakPolarHBondContact CE2-OG 3.4Å; S388-S392 PolarHBondContact O-N 3.09Å; S388-S392 PolarHBondContact O-OG 2.83Å; R389-S392 WeakPolarHBondContact CA-OG 3.46Å; R389-S392 VanDerWaalsContact O-CB 3.26Å; R389-S392 WeakPolarHBondContact O-CB 3.49Å; R389-S392 PolarHBondContact O-N 3.26Å
393	K	78.2	Confident	85.9	Confident	162 Å²	162	70.3 Å²	70.3	70%	0.704	35%	0.352	S	S	*	.			trans	-73.4	136.6	164.8	-70.4	-176.8	-176.8	-178.3	0	108.7	S391 R395 A396	S391-K393 PolarHBondContact O-N 3.11Å; K393-R395 PolarHBondContact O-N 2.89Å; K393-A396 HydrophobicContact CB-CB 3.94Å; K393-A396 WeakPolarHBondContact O-CB 3.39Å; K393-A396 PolarHBondContact O-N 3.13Å
394	P	75.5	Confident	85.5	Confident	106 Å²	106	69.1 Å²	69.1	69%	0.688	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	128.3	178.6	-28.2	34.8	0	0	0	111.7	A396	P394-A396 PolarHBondContact O-N 3.36Å
395	R	78.1	Confident	84.8	Confident	165 Å²	165	73.5 Å²	73.5	62%	0.623	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	9.8	-177.3	-52.5	176.9	177.5	176.3	-4.8	115.6	C19 F20 K393 S397	C19-R395 PolarHBondContact SG-O 2.97Å; C19-R395 VanDerWaalsContact SG-O 3.38Å; F20-R395 WeakPolarHBondContact O-CA 3.4Å; F20-R395 PolarHBondContact O-N 2.99Å; K393-R395 PolarHBondContact O-N 2.89Å; R395-S397 PolarHBondContact O-N 2.94Å
396	A	84.9	Confident	83.7	Confident	33 Å²	33	75.3 Å²	75.3	27%	0.273	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-67.7	130.1	173.1	0	0	0	0	0	110.3	C19 F20 K393 P394	C19-A396 CarbonylContact C-O 3.42Å; C19-A396 VanDerWaalsContact CA-O 3.28Å; C19-A396 WeakPolarHBondContact CA-O 3.36Å; F20-A396 PolarHBondContact N-O 3.37Å; K393-A396 HydrophobicContact CB-CB 3.94Å; K393-A396 WeakPolarHBondContact O-CB 3.39Å; K393-A396 PolarHBondContact O-N 3.13Å; P394-A396 PolarHBondContact O-N 3.36Å
397	S	87.9	Confident	82.2	Confident	46 Å²	46	78.1 Å²	78.1	32%	0.322	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-68.6	133.7	173.7	-54.6	0	0	0	0	110.5	Q17 W18 C19 R395	Q17-S397 PolarHBondContact NE2-OG 3.14Å; W18-S397 CarbonylContact O-C 3.59Å; W18-S397 WeakPolarHBondContact O-CA 3.29Å; C19-S397 PolarHBondContact SG-OG 3.39Å; C19-S397 VanDerWaalsContact SG-OG 3.37Å; R395-S397 PolarHBondContact O-N 2.94Å
398	L	90.4	Very high	80.8	Confident	23 Å²	23	87.6 Å²	87.6	12%	0.12	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-66.8	142.5	172.8	-61.6	-179.5	0	0	0	109.8	W18 F372 L385 F448	W18-L398 HydrophobicContact CB-CD1 3.93Å; W18-L398 HydrophobicContact CB-CG 4.38Å; W18-L398 PolarHBondContact O-N 2.96Å; F372-L398 HydrophobicContact CZ-CD1 3.97Å; L385-L398 HydrophobicContact CB-CD1 4.26Å; L385-L398 HydrophobicContact CD1-CD1 4.06Å; L385-L398 HydrophobicContact CD2-CB 3.92Å; L398-F448 HydrophobicContact CD1-CD1 3.62Å; L398-F448 HydrophobicContact CD1-CE1 3.79Å; L398-F448 HydrophobicContact CD1-CG 4.02Å; L398-F448 HydrophobicContact CD1-CZ 4.3Å; L398-F448 HydrophobicContact CD2-CD1 4.22Å; L398-F448 HydrophobicContact CD2-CE1 3.85Å; L398-F448 HydrophobicContact CG-CD1 4.18Å; L398-F448 HydrophobicContact CG-CE1 4.28Å
399	K	89.7	Confident	79.8	Confident	167 Å²	167	94.7 Å²	94.7	73%	0.726	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-102	132.9	175.8	-67.1	-175.4	-179.6	-179.6	0	109.1	R401	K399-R401 PolarHBondContact O-N 2.77Å
400	P	91.4	Very high	79.5	Confident	89 Å²	89	97.9 Å²	97.9	58%	0.578	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-54	135.1	172.4	-28.4	36.2	0	0	0	112.2	V383 T384	V383-P400 HydrophobicContact CG2-CB 3.87Å; V383-P400 HydrophobicContact CG2-CG 3.84Å; T384-P400 CarbonylContact O-C 3.52Å; T384-P400 WeakPolarHBondContact O-CA 3.43Å
401	R	92.2	Very high	79.2	Confident	69 Å²	69	97.7 Å²	97.7	26%	0.26	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-99.6	147.1	171.5	-62.3	-55.9	-167.1	-179.1	2.9	110.1	F371 T384 E386 K399	F371-R401 HydrophobicContact CE1-CB 4.19Å; F371-R401 HydrophobicContact CE1-CG 3.97Å; F371-R401 HydrophobicContact CZ-CB 4.25Å; F371-R401 HydrophobicContact CZ-CG 4.43Å; T384-R401 WeakPolarHBondContact CB-O 3.47Å; T384-R401 HydrophobicContact CG2-CB 4.43Å; T384-R401 PolarHBondContact O-N 3.45Å; E386-R401 HydrophobicContact CB-CG 4.02Å; E386-R401 IonicContact OE2-CZ 3.89Å; E386-R401 IonicContact OE2-NE 2.78Å; E386-R401 PolarHBondContact OE2-NE 3.15Å; E386-R401 IonicContact OE2-NH2 3.56Å; E386-R401 PolarHBondContact OE2-NH2 3.29Å; K399-R401 PolarHBondContact O-N 2.77Å
402	K	90.5	Very high	79.7	Confident	140 Å²	140	101.2 Å²	101.2	61%	0.609	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.5	175.3	-73.6	-174.8	-179.9	-176.5	0	109.6	E413 I414	K402-E413 HydrophobicContact CB-CG 3.99Å; K402-I414 PolarHBondContact O-N 2.86Å
403	V	90.7	Very high	80.5	Confident	30 Å²	30	101.8 Å²	101.8	18%	0.182	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.1	176.4	-175.6	0	0	0	0	108.7	Y334 F371 I414 V416 L419	Y334-V403 HydrophobicContact CD1-CB 3.91Å; Y334-V403 HydrophobicContact CD1-CG1 4.06Å; Y334-V403 HydrophobicContact CD1-CG2 4.5Å; Y334-V403 HydrophobicContact CD2-CB 4.44Å; Y334-V403 HydrophobicContact CD2-CG1 3.77Å; Y334-V403 HydrophobicContact CE1-CB 3.83Å; Y334-V403 HydrophobicContact CE1-CG1 4.2Å; Y334-V403 HydrophobicContact CE1-CG2 3.91Å; Y334-V403 HydrophobicContact CE2-CB 4.38Å; Y334-V403 HydrophobicContact CE2-CG1 3.93Å; Y334-V403 HydrophobicContact CE2-CG2 4.34Å; Y334-V403 HydrophobicContact CG-CB 4.23Å; Y334-V403 HydrophobicContact CG-CG1 3.84Å; F371-V403 HydrophobicContact CD2-CG2 4.31Å; F371-V403 HydrophobicContact CE2-CG2 3.74Å; V403-I414 CarbonylContact C-O 3.57Å; V403-I414 VanDerWaalsContact CA-O 3.28Å; V403-I414 WeakPolarHBondContact CA-O 3.45Å; V403-V416 HydrophobicContact CG1-CB 4.44Å; V403-V416 HydrophobicContact CG1-CG2 3.53Å; V403-L419 HydrophobicContact CG1-CD1 4.23Å; V403-L419 HydrophobicContact CG2-CD2 4.34Å
404	C	86.7	Confident	81.1	Confident	17 Å²	17	95.4 Å²	95.4	12%	0.115	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.7	179.4	61.7	0	0	0	0	111.2	E413 I414 V416	C404-E413 HydrophobicContact CB-CB 4.48Å; C404-I414 PolarHBondContact N-O 2.79Å; C404-I414 PolarHBondContact SG-O 2.69Å; C404-V416 PolarHBondContact O-N 3Å
405	T	80.7	Confident	81.8	Confident	109 Å²	109	91.6 Å²	91.6	67%	0.669	47%	0.471	S	S	*	.			trans	-93.5	-0.4	179.3	49.4	0	0	0	0	113.7	V416	T405-V416 HydrophobicContact CG2-CG2 3.81Å
406	G	71.9	Confident	82.5	Confident	44 Å²	44	84 Å²	84	45%	0.454	44%	0.443	S	S	.	.	S	Bend	trans	-126.1	164.2	-172.4	0	0	0	0	0	114.8	K408	G406-K408 PolarHBondContact O-N 2.91Å
407	G	65.3	Low	82.7	Confident	88 Å²	88	88.1 Å²	88.1	91%	0.907	46%	0.46	S	S	*	.	S	Bend	trans	-73.2	-11.3	-169.3	0	0	0	0	0	117.5	R409	G407-R409 PolarHBondContact O-N 3.38Å
408	K	63.7	Low	82.9	Confident	199 Å²	199	89.6 Å²	89.6	87%	0.865	47%	0.47	S	S	*	.			trans	-96.8	89.3	174.5	-75.5	-169.4	-179.2	-179.7	0	110.4	G406	G406-K408 PolarHBondContact O-N 2.91Å
409	R	68.4	Low	83.1	Confident	168 Å²	168	89 Å²	89	63%	0.634	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-68.7	124.8	175.2	-175.4	177	-177.7	-176.2	1.6	110.9	G407 E413	G407-R409 PolarHBondContact O-N 3.38Å; R409-E413 PolarHBondContact NE-O 2.79Å; R409-E413 PolarHBondContact NH2-O 3.23Å; R409-E413 VanDerWaalsContact NH2-O 3.14Å
410	K	75.4	Confident	83.3	Confident	140 Å²	140	83.4 Å²	83.4	61%	0.609	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-80	158.4	165	-63.6	-178.3	-173.1	162.6	0	110.5	D412 E413	K410-D412 PolarHBondContact O-N 2.75Å; K410-E413 HydrophobicContact CB-CG 4.11Å; K410-E413 PolarHBondContact N-OE2 3.06Å; K410-E413 PolarHBondContact O-N 3.06Å; K410-E413 VanDerWaalsContact O-N 3.17Å
411	K	68.3	Low	83.5	Confident	190 Å²	190	81.6 Å²	81.6	83%	0.826	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	126.9	169.2	-167.8	176.4	178.3	-179.1	0	108
412	D	75.4	Confident	83.5	Confident	119 Å²	119	85 Å²	85	64%	0.636	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	4.9	-178.4	-46.5	-43.1	0	0	0	117.8	K410	K410-D412 PolarHBondContact O-N 2.75Å
413	E	86.1	Confident	83.7	Confident	34 Å²	34	82.8 Å²	82.8	16%	0.159	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	151	169.3	-71.3	176.6	178.4	0	0	112.1	K402 C404 R409 K410	K402-E413 HydrophobicContact CB-CG 3.99Å; C404-E413 HydrophobicContact CB-CB 4.48Å; R409-E413 PolarHBondContact NE-O 2.79Å; R409-E413 PolarHBondContact NH2-O 3.23Å; R409-E413 VanDerWaalsContact NH2-O 3.14Å; K410-E413 HydrophobicContact CB-CG 4.11Å; K410-E413 PolarHBondContact N-OE2 3.06Å; K410-E413 PolarHBondContact O-N 3.06Å; K410-E413 VanDerWaalsContact O-N 3.17Å
414	I	89.2	Confident	84	Confident	27 Å²	27	84.7 Å²	84.7	14%	0.138	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.3	179	-62.5	166.8	0	0	0	108.6	F371 K402 V403 C404 L419	F371-I414 HydrophobicContact CE1-CD1 4.31Å; F371-I414 HydrophobicContact CZ-CD1 3.63Å; K402-I414 PolarHBondContact O-N 2.86Å; V403-I414 CarbonylContact C-O 3.57Å; V403-I414 VanDerWaalsContact CA-O 3.28Å; V403-I414 WeakPolarHBondContact CA-O 3.45Å; C404-I414 PolarHBondContact N-O 2.79Å; C404-I414 PolarHBondContact SG-O 2.69Å; I414-L419 HydrophobicContact CG2-CD2 3.94Å
415	S	91.2	Very high	84.6	Confident	26 Å²	26	83.9 Å²	83.9	18%	0.182	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	144.9	176.9	-174.3	0	0	0	0	110.5	D417 S418	S415-D417 PolarHBondContact O-N 2.71Å; S415-D417 PolarHBondContact OG-N 2.78Å; S415-S418 PolarHBondContact O-N 2.76Å
416	V	91.7	Very high	85.4	Confident	7 Å²	7	80.1 Å²	80.1	4%	0.042	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-54.3	-38.9	170.9	177	0	0	0	0	111.4	Y334 L335 K338 V403 C404 T405 S418 L419	Y334-V416 HydrophobicContact CD2-CG2 3.91Å; Y334-V416 HydrophobicContact CG-CG2 4.16Å; L335-V416 HydrophobicContact CD2-CG1 4.21Å; K338-V416 HydrophobicContact CG-CG1 4.06Å; V403-V416 HydrophobicContact CG1-CB 4.44Å; V403-V416 HydrophobicContact CG1-CG2 3.53Å; C404-V416 PolarHBondContact O-N 3Å; T405-V416 HydrophobicContact CG2-CG2 3.81Å; V416-S418 PolarHBondContact O-N 2.82Å; V416-L419 HydrophobicContact CG1-CD1 4.41Å; V416-L419 WeakPolarHBondContact O-CG 3.36Å; V416-L419 PolarHBondContact O-N 3.35Å
417	D	89.8	Confident	86.7	Confident	119 Å²	119	79.4 Å²	79.4	64%	0.636	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-71.3	-8.7	-180	-56.8	-48.1	0	0	0	113.5	K338 S415	K338-D417 WeakPolarHBondContact CE-OD1 3.43Å; K338-D417 IonicContact NZ-OD1 2.87Å; K338-D417 PolarHBondContact NZ-OD1 3.27Å; S415-D417 PolarHBondContact O-N 2.71Å; S415-D417 PolarHBondContact OG-N 2.78Å
418	S	92.3	Very high	88.3	Confident	76 Å²	76	75.5 Å²	75.5	53%	0.531	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-105.6	5.7	178.4	-53.8	0	0	0	0	112.9	S415 V416	S415-S418 PolarHBondContact O-N 2.76Å; V416-S418 PolarHBondContact O-N 2.82Å
419	L	94.2	Very high	89.9	Confident	12 Å²	12	66.3 Å²	66.3	6%	0.063	32%	0.323	C	S	.	.			trans	-74	134.3	177.3	-62.8	176.5	0	0	0	110.4	Y334 L335 N369 F371 V403 I414 V416 F421	Y334-L419 HydrophobicContact CD2-CD1 4.11Å; Y334-L419 HydrophobicContact CE2-CD1 3.53Å; L335-L419 HydrophobicContact CD2-CD1 4.11Å; N369-L419 HydrophobicContact CB-CB 4.4Å; N369-L419 HydrophobicContact CB-CD2 3.79Å; F371-L419 HydrophobicContact CE2-CD2 3.75Å; F371-L419 HydrophobicContact CZ-CD2 4.42Å; V403-L419 HydrophobicContact CG1-CD1 4.23Å; V403-L419 HydrophobicContact CG2-CD2 4.34Å; I414-L419 HydrophobicContact CG2-CD2 3.94Å; V416-L419 HydrophobicContact CG1-CD1 4.41Å; V416-L419 WeakPolarHBondContact O-CG 3.36Å; V416-L419 PolarHBondContact O-N 3.35Å; L419-F421 HydrophobicContact CB-CZ 4.27Å
420	D	94.2	Very high	91.3	Very high	49 Å²	49	59 Å²	59	26%	0.262	30%	0.295	S	S	.	.			trans	-88.9	109.9	171.7	-173.8	-12.6	0	0	0	110.1	N369 N422 K423	N369-D420 WeakPolarHBondContact CA-O 3.46Å; N369-D420 PolarHBondContact N-O 3.02Å; N369-D420 PolarHBondContact OD1-N 2.67Å; N369-D420 VanDerWaalsContact OD1-N 3.11Å; D420-N422 VanDerWaalsContact C-N 3.33Å; D420-N422 WeakPolarHBondContact OD1-CB 3.21Å; D420-N422 PolarHBondContact OD1-N 2.62Å; D420-K423 HydrophobicContact CB-CB 4.23Å; D420-K423 HydrophobicContact CB-CD 4.08Å; D420-K423 HydrophobicContact CB-CG 4.3Å; D420-K423 PolarHBondContact O-N 3.1Å; D420-K423 WeakPolarHBondContact OD2-CD 3.4Å; D420-K423 WeakPolarHBondContact OD2-CE 3.45Å; D420-K423 WeakPolarHBondContact OD2-CG 3.43Å; D420-K423 IonicContact OD2-NZ 3.75Å
421	F	95.2	Very high	92.4	Very high	51 Å²	51	52.6 Å²	52.6	22%	0.224	27%	0.268	C	S	.	.	S	Bend	trans	-78.2	-15.6	-179.3	-64.1	-74.5	0	0	0	113.5	L335 L342 Y368 L419 K423	L335-F421 HydrophobicContact CD1-CE1 4.34Å; L335-F421 HydrophobicContact CD2-CE1 3.75Å; L335-F421 HydrophobicContact CD2-CZ 3.93Å; L342-F421 HydrophobicContact CD2-CD1 3.69Å; L342-F421 HydrophobicContact CD2-CE1 3.58Å; L342-F421 HydrophobicContact CD2-CG 4.26Å; L342-F421 HydrophobicContact CD2-CZ 4.04Å; Y368-F421 HydrophobicContact CD1-CB 4.1Å; Y368-F421 AromaticContact CD1-CD1 3.69Å; Y368-F421 HydrophobicContact CD1-CD1 3.69Å; Y368-F421 HydrophobicContact CD1-CG 4.39Å; Y368-F421 WeakPolarHBondContact CD1-O 3.43Å; Y368-F421 AromaticContact CD2-CD1 3.85Å; Y368-F421 HydrophobicContact CD2-CD1 3.85Å; Y368-F421 HydrophobicContact CD2-CE1 4.09Å; Y368-F421 HydrophobicContact CE1-CB 4.4Å; Y368-F421 HydrophobicContact CE1-CD1 4.09Å; Y368-F421 HydrophobicContact CE2-CD1 4.24Å; Y368-F421 AromaticContact CG-CD1 3.55Å; Y368-F421 HydrophobicContact CG-CD1 3.55Å; Y368-F421 HydrophobicContact CG-CE1 4.13Å; L419-F421 HydrophobicContact CB-CZ 4.27Å; F421-K423 VanDerWaalsContact C-N 3.29Å
422	N	93.6	Very high	93.7	Very high	139 Å²	139	45.3 Å²	45.3	74%	0.743	24%	0.24	S	C	*	.	S	Bend	trans	-75.1	-25.7	172.8	-65	-42	0	0	0	111.4	D420 K424	D420-N422 VanDerWaalsContact C-N 3.33Å; D420-N422 WeakPolarHBondContact OD1-CB 3.21Å; D420-N422 PolarHBondContact OD1-N 2.62Å; N422-K424 PolarHBondContact O-N 3.25Å
423	K	94.9	Very high	94.5	Very high	95 Å²	95	43.2 Å²	43.2	41%	0.413	24%	0.239	S	C	.	.	S	Bend	trans	-84.6	80.4	174.9	-73.6	179.2	-172.1	165.8	0	110.5	Y368 N369 N370 D420 F421	Y368-K423 CarbonylContact C-O 3.56Å; Y368-K423 VanDerWaalsContact C-O 3.25Å; Y368-K423 WeakPolarHBondContact CA-O 3.49Å; N369-K423 CarbonylContact C-O 3.59Å; N369-K423 WeakPolarHBondContact CA-O 3.39Å; N369-K423 PolarHBondContact N-O 2.92Å; N370-K423 PolarHBondContact N-O 2.82Å; N370-K423 WeakPolarHBondContact OD1-CB 3.43Å; D420-K423 HydrophobicContact CB-CB 4.23Å; D420-K423 HydrophobicContact CB-CD 4.08Å; D420-K423 HydrophobicContact CB-CG 4.3Å; D420-K423 PolarHBondContact O-N 3.1Å; D420-K423 WeakPolarHBondContact OD2-CD 3.4Å; D420-K423 WeakPolarHBondContact OD2-CE 3.45Å; D420-K423 WeakPolarHBondContact OD2-CG 3.43Å; D420-K423 IonicContact OD2-NZ 3.75Å; F421-K423 VanDerWaalsContact C-N 3.29Å
424	K	96.4	Very high	94.8	Very high	69 Å²	69	43.9 Å²	43.9	30%	0.3	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-110.6	136.2	-179.1	55.3	-169.2	175.7	-172.4	0	112	D350 Y368 N422 L426	D350-K424 IonicContact OD1-NZ 3.29Å; D350-K424 PolarHBondContact OD1-NZ 2.92Å; D350-K424 WeakPolarHBondContact OD2-CD 3.05Å; D350-K424 IonicContact OD2-NZ 2.96Å; Y368-K424 HydrophobicContact CD1-CB 4Å; Y368-K424 HydrophobicContact CE1-CB 4.18Å; N422-K424 PolarHBondContact O-N 3.25Å; K424-L426 HydrophobicContact CB-CD2 4.27Å; K424-L426 HydrophobicContact CB-CG 4.4Å; K424-L426 HydrophobicContact CD-CD1 4.04Å; K424-L426 HydrophobicContact CD-CD2 4.09Å; K424-L426 HydrophobicContact CD-CG 4.13Å; K424-L426 HydrophobicContact CG-CD1 4.28Å; K424-L426 HydrophobicContact CG-CD2 4.23Å; K424-L426 HydrophobicContact CG-CG 3.99Å
425	I	98.4	Very high	95	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.			trans	-95.3	97.5	170.6	-56.2	-54.1	0	0	0	107.4	F352 G366 S367 N370 F371 A387 T428 V439 A440 A441	F352-I425 WeakPolarHBondContact CD1-O 3.43Å; F352-I425 WeakPolarHBondContact CE1-O 3.48Å; G366-I425 VanDerWaalsContact CA-O 3.28Å; G366-I425 WeakPolarHBondContact CA-O 3.4Å; S367-I425 PolarHBondContact O-N 2.9Å; N370-I425 HydrophobicContact CB-CD1 4.17Å; F371-I425 WeakPolarHBondContact O-CG1 3.42Å; A387-I425 HydrophobicContact CB-CD1 4.38Å; I425-T428 HydrophobicContact CG2-CG2 3.38Å; I425-V439 HydrophobicContact CD1-CG1 3.91Å; I425-V439 HydrophobicContact CG1-CG1 4.24Å; I425-V439 HydrophobicContact CG2-CG1 3.6Å; I425-A440 WeakPolarHBondContact CD1-O 3.49Å; I425-A441 HydrophobicContact CD1-CB 3.48Å; I425-A441 VanDerWaalsContact CD1-CB 3.48Å
426	L	98.4	Very high	95.2	Very high	31 Å²	31	43.4 Å²	43.4	16%	0.162	24%	0.239	C	C	.	.			trans	-92.4	-34.6	179.1	-60.6	-178.9	0	0	0	112.3	D350 F352 E353 K424	D350-L426 HydrophobicContact CB-CD2 4.07Å; F352-L426 HydrophobicContact CD1-CD2 3.84Å; F352-L426 HydrophobicContact CD2-CD2 4.44Å; F352-L426 HydrophobicContact CE1-CD2 3.75Å; F352-L426 HydrophobicContact CE2-CD2 4.37Å; F352-L426 HydrophobicContact CG-CD2 4.18Å; F352-L426 HydrophobicContact CZ-CD2 4.03Å; E353-L426 WeakPolarHBondContact CB-O 3.3Å; E353-L426 PolarHBondContact N-O 3.23Å; K424-L426 HydrophobicContact CB-CD2 4.27Å; K424-L426 HydrophobicContact CB-CG 4.4Å; K424-L426 HydrophobicContact CD-CD1 4.04Å; K424-L426 HydrophobicContact CD-CD2 4.09Å; K424-L426 HydrophobicContact CD-CG 4.13Å; K424-L426 HydrophobicContact CG-CD1 4.28Å; K424-L426 HydrophobicContact CG-CD2 4.23Å; K424-L426 HydrophobicContact CG-CG 3.99Å
427	H	98.5	Very high	95.5	Very high	28 Å²	28	43 Å²	43	13%	0.13	24%	0.237	C	C	.	.			trans	-117.9	124.9	-171.7	-48.4	-66.5	0	0	0	110.7	S38 V40 E353 A440	S38-H427 PolarHBondContact O-CE1 3.49Å; S38-H427 PolarHBondContact O-ND1 3.08Å; S38-H427 PolarHBondContact O-NE2 2.75Å; S38-H427 VanDerWaalsContact O-NE2 3.16Å; V40-H427 HydrophobicContact CG2-CB 4.14Å; E353-H427 VanDerWaalsContact CD-ND1 3.28Å; E353-H427 IonicContact OE1-CE1 2.67Å; E353-H427 IonicContact OE1-ND1 3.17Å; E353-H427 PolarHBondContact OE1-ND1 2.79Å; E353-H427 IonicContact OE2-ND1 3.85Å; E353-H427 PolarHBondContact OE2-ND1 3.45Å; H427-A440 HydrophobicContact CB-CB 4.22Å; H427-A440 PolarHBondContact O-N 3.16Å; H427-A440 VanDerWaalsContact O-N 3.09Å
428	T	98.4	Very high	95.9	Very high	6 Å²	6	37.4 Å²	37.4	4%	0.037	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	145.3	179.4	68.6	0	0	0	0	110.1	M364 I425 A438 V439	M364-T428 HydrophobicContact CE-CG2 4.47Å; I425-T428 HydrophobicContact CG2-CG2 3.38Å; T428-A438 CarbonylContact C-O 3.51Å; T428-A438 WeakPolarHBondContact CA-O 3.47Å; T428-V439 HydrophobicContact CG2-CG1 4.4Å; T428-V439 HydrophobicContact CG2-CG2 4.44Å
429	A	98.4	Very high	96.1	Very high	6 Å²	6	33.8 Å²	33.8	5%	0.05	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.9	175.5	0	0	0	0	0	110.9	V40 F42 I437 A438	V40-A429 HydrophobicContact CB-CB 4.42Å; V40-A429 HydrophobicContact CG1-CB 3.92Å; F42-A429 HydrophobicContact CD2-CB 3.76Å; F42-A429 HydrophobicContact CE2-CB 4Å; A429-I437 WeakPolarHBondContact O-CA 2.9Å; A429-A438 HydrophobicContact CB-CB 4.45Å; A429-A438 PolarHBondContact N-O 2.74Å; A429-A438 PolarHBondContact O-N 2.89Å
430	W	98.1	Very high	96.3	Very high	16 Å²	16	33.4 Å²	33.4	6%	0.061	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.7	171.3	-152.6	-50.3	0	0	0	108.8	W18 F42 W356 N357 A362 M364 M374 D434 I437	W18-W430 AromaticContact CH2-CZ2 3.8Å; W18-W430 HydrophobicContact CH2-CZ2 3.8Å; W18-W430 HydrophobicContact CZ2-CH2 4.06Å; W18-W430 AromaticContact CZ2-CZ2 3.65Å; W18-W430 HydrophobicContact CZ2-CZ2 3.65Å; F42-W430 WeakPolarHBondContact CD2-O 3.49Å; W356-W430 VanDerWaalsContact O-CB 3.32Å; W356-W430 WeakPolarHBondContact O-CB 3.49Å; N357-W430 HydrophobicContact CB-CD2 3.59Å; N357-W430 HydrophobicContact CB-CE3 3.87Å; N357-W430 HydrophobicContact CB-CG 4.22Å; N357-W430 HydrophobicContact CB-CH2 3.67Å; N357-W430 HydrophobicContact CB-CZ2 3.38Å; N357-W430 HydrophobicContact CB-CZ3 3.9Å; A362-W430 HydrophobicContact CB-CH2 3.69Å; A362-W430 HydrophobicContact CB-CZ3 4.13Å; M364-W430 HydrophobicContact CB-CE3 3.75Å; M364-W430 HydrophobicContact CB-CZ3 3.81Å; M374-W430 HydrophobicContact CE-CE3 4.29Å; M374-W430 HydrophobicContact CE-CH2 3.12Å; M374-W430 HydrophobicContact CE-CZ2 3.91Å; M374-W430 HydrophobicContact CE-CZ3 3.36Å; W430-D434 PolarHBondContact NE1-O 3.46Å; W430-I437 HydrophobicContact CB-CG2 4.37Å; W430-I437 HydrophobicContact CD2-CG2 3.64Å; W430-I437 HydrophobicContact CE3-CG2 4.15Å; W430-I437 HydrophobicContact CG-CG2 3.75Å; W430-I437 HydrophobicContact CZ2-CG2 4.48Å
431	H	97.6	Very high	96.3	Very high	5 Å²	5	31.1 Å²	31.1	2%	0.023	17%	0.168	C	C	.	.			trans	-58.8	138.2	172.6	-173.9	-55.2	0	0	0	110.4	F42 S45 G46 R63 Y77 A433 D434 V436	F42-H431 HydrophobicContact CD2-CB 4.48Å; F42-H431 HydrophobicContact CE1-CB 4.5Å; F42-H431 HydrophobicContact CE2-CB 4.29Å; F42-H431 HydrophobicContact CZ-CB 4.3Å; S45-H431 PolarHBondContact O-CE1 3.15Å; G46-H431 PolarHBondContact O-NE2 2.91Å; R63-H431 PolarHBondContact NH1-NE2 2.78Å; R63-H431 VanDerWaalsContact NH1-NE2 3.17Å; Y77-H431 PolarHBondContact OH-CD2 3.3Å; Y77-H431 VanDerWaalsContact OH-CD2 3.26Å; H431-A433 PolarHBondContact ND1-N 2.93Å; H431-A433 PolarHBondContact O-N 3.2Å; H431-D434 HydrophobicContact CB-CB 4.47Å; H431-D434 WeakPolarHBondContact CB-O 3.47Å; H431-D434 PolarHBondContact ND1-N 2.86Å; H431-D434 VanDerWaalsContact ND1-N 3.2Å; H431-D434 IonicContact NE2-OD2 3.94Å; H431-V436 HydrophobicContact CB-CB 3.92Å; H431-V436 VanDerWaalsContact CB-O 3.29Å; H431-V436 WeakPolarHBondContact CB-O 3.3Å; H431-V436 PolarHBondContact N-O 3.33Å
432	P	95.1	Very high	96.2	Very high	37 Å²	37	31.3 Å²	31.3	24%	0.24	17%	0.174	C	C	.	.	S	Bend	trans	-65.3	-5.3	-173.3	24.1	-36.9	0	0	0	115.9	Y44 G358	Y44-P432 WeakPolarHBondContact O-CG 3.29Å; G358-P432 WeakPolarHBondContact CA-O 3.4Å
433	A	92	Very high	96	Very high	75 Å²	75	25.3 Å²	25.3	62%	0.62	14%	0.142	S	C	*	.	S	Bend	trans	-149.4	-39.8	-170.5	0	0	0	0	0	112.3	H431	H431-A433 PolarHBondContact ND1-N 2.93Å; H431-A433 PolarHBondContact O-N 3.2Å
434	D	92.7	Very high	96	Very high	47 Å²	47	21.9 Å²	21.9	25%	0.251	13%	0.128	S	C	.	.	S	Bend	trans	-95.6	157.4	-179.8	-75.9	-16.1	0	0	0	112.6	R63 W430 H431 V436	R63-D434 IonicContact CZ-OD2 2.82Å; R63-D434 IonicContact NH1-OD2 3.76Å; R63-D434 PolarHBondContact NH1-OD2 3.38Å; R63-D434 IonicContact NH2-OD2 3.59Å; R63-D434 PolarHBondContact NH2-OD2 3.03Å; W430-D434 PolarHBondContact NE1-O 3.46Å; H431-D434 HydrophobicContact CB-CB 4.47Å; H431-D434 WeakPolarHBondContact CB-O 3.47Å; H431-D434 PolarHBondContact ND1-N 2.86Å; H431-D434 VanDerWaalsContact ND1-N 3.2Å; H431-D434 IonicContact NE2-OD2 3.94Å; D434-V436 HydrophobicContact CB-CG2 4.07Å; D434-V436 PolarHBondContact O-N 2.79Å
435	N	93.6	Very high	96	Very high	41 Å²	41	18.7 Å²	18.7	22%	0.219	11%	0.114	C	C	.	.	S	Bend	trans	-75.4	66.6	166.7	-61.8	-23.7	0	0	0	110.9	W18 R74 Q449 D450	W18-N435 HydrophobicContact CH2-CB 3.95Å; W18-N435 HydrophobicContact CZ3-CB 4.37Å; W18-N435 WeakPolarHBondContact CZ3-O 3.49Å; R74-N435 VanDerWaalsContact NH1-C 3.27Å; R74-N435 PolarHBondContact NH1-O 2.94Å; N435-Q449 WeakPolarHBondContact O-CA 3.42Å; N435-D450 HydrophobicContact CB-CB 3.44Å; N435-D450 VanDerWaalsContact CB-CB 3.44Å; N435-D450 PolarHBondContact ND2-OD2 3.31Å; N435-D450 PolarHBondContact O-N 2.68Å
436	V	95.5	Very high	96	Very high	2 Å²	2	19 Å²	19	1%	0.012	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131	172.7	179.4	0	0	0	0	107.3	F42 Y77 H431 D434 I447 F448 Q449	F42-V436 HydrophobicContact CZ-CG1 4.37Å; Y77-V436 HydrophobicContact CE2-CG1 4.22Å; H431-V436 HydrophobicContact CB-CB 3.92Å; H431-V436 VanDerWaalsContact CB-O 3.29Å; H431-V436 WeakPolarHBondContact CB-O 3.3Å; H431-V436 PolarHBondContact N-O 3.33Å; D434-V436 HydrophobicContact CB-CG2 4.07Å; D434-V436 PolarHBondContact O-N 2.79Å; V436-I447 HydrophobicContact CG1-CG2 3.86Å; V436-F448 WeakPolarHBondContact CA-O 3.31Å; V436-Q449 HydrophobicContact CG2-CB 4.15Å
437	I	97.4	Very high	95.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.7	179	59.4	173.7	0	0	0	110.1	W18 M364 F372 M374 A429 W430 V439 I447 F448	W18-I437 HydrophobicContact CD2-CD1 4.19Å; W18-I437 HydrophobicContact CE3-CD1 3.96Å; W18-I437 HydrophobicContact CE3-CG1 3.97Å; W18-I437 HydrophobicContact CH2-CD1 4.45Å; W18-I437 HydrophobicContact CH2-CG1 4.32Å; W18-I437 HydrophobicContact CH2-CG2 3.69Å; W18-I437 HydrophobicContact CZ2-CG2 4.4Å; W18-I437 HydrophobicContact CZ3-CB 4.35Å; W18-I437 HydrophobicContact CZ3-CD1 4.09Å; W18-I437 HydrophobicContact CZ3-CG1 3.76Å; W18-I437 HydrophobicContact CZ3-CG2 3.92Å; M364-I437 HydrophobicContact CE-CB 3.98Å; M364-I437 HydrophobicContact CE-CG2 3.93Å; M364-I437 HydrophobicContact SD-CB 3.99Å; M364-I437 HydrophobicContact SD-CD1 3.78Å; M364-I437 HydrophobicContact SD-CG1 4.45Å; M364-I437 HydrophobicContact SD-CG2 3.95Å; F372-I437 HydrophobicContact CD2-CD1 4.47Å; F372-I437 HydrophobicContact CE2-CD1 3.66Å; F372-I437 HydrophobicContact CZ-CD1 4.17Å; M374-I437 HydrophobicContact SD-CD1 4.39Å; A429-I437 WeakPolarHBondContact O-CA 2.9Å; W430-I437 HydrophobicContact CB-CG2 4.37Å; W430-I437 HydrophobicContact CD2-CG2 3.64Å; W430-I437 HydrophobicContact CE3-CG2 4.15Å; W430-I437 HydrophobicContact CG-CG2 3.75Å; W430-I437 HydrophobicContact CZ2-CG2 4.48Å; I437-V439 HydrophobicContact CD1-CG2 4.38Å; I437-I447 WeakPolarHBondContact O-CA 3.14Å; I437-F448 HydrophobicContact CD1-CB 3.98Å; I437-F448 HydrophobicContact CD1-CD2 3.92Å; I437-F448 HydrophobicContact CD1-CG 4.37Å; I437-F448 HydrophobicContact CG1-CB 3.65Å; I437-F448 HydrophobicContact CG1-CD2 4.01Å; I437-F448 HydrophobicContact CG1-CG 4.33Å; I437-F448 PolarHBondContact N-O 2.99Å; I437-F448 PolarHBondContact O-N 2.92Å
438	A	98.2	Very high	95.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.8	174.1	0	0	0	0	0	108.9	V40 F42 L49 T428 A429 L445 Y446	V40-A438 HydrophobicContact CG1-CB 3.84Å; F42-A438 HydrophobicContact CE2-CB 3.97Å; F42-A438 HydrophobicContact CZ-CB 4.09Å; L49-A438 HydrophobicContact CD1-CB 4.02Å; L49-A438 HydrophobicContact CD2-CB 3.8Å; T428-A438 CarbonylContact C-O 3.51Å; T428-A438 WeakPolarHBondContact CA-O 3.47Å; A429-A438 HydrophobicContact CB-CB 4.45Å; A429-A438 PolarHBondContact N-O 2.74Å; A429-A438 PolarHBondContact O-N 2.89Å; A438-L445 HydrophobicContact CB-CD1 4.2Å; A438-Y446 CarbonylContact C-O 3.54Å; A438-Y446 WeakPolarHBondContact CA-O 3.16Å
439	V	98.3	Very high	95.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.9	-174.8	177.9	0	0	0	0	108.7	M364 F372 A387 I425 T428 I437 Y446 F448	M364-V439 HydrophobicContact SD-CG2 4.38Å; F372-V439 HydrophobicContact CD1-CG1 4.24Å; F372-V439 HydrophobicContact CD1-CG2 4.41Å; F372-V439 HydrophobicContact CE1-CG2 4.47Å; F372-V439 HydrophobicContact CG-CG2 4.45Å; A387-V439 HydrophobicContact CB-CG1 4.17Å; I425-V439 HydrophobicContact CD1-CG1 3.91Å; I425-V439 HydrophobicContact CG1-CG1 4.24Å; I425-V439 HydrophobicContact CG2-CG1 3.6Å; T428-V439 HydrophobicContact CG2-CG1 4.4Å; T428-V439 HydrophobicContact CG2-CG2 4.44Å; I437-V439 HydrophobicContact CD1-CG2 4.38Å; V439-Y446 PolarHBondContact N-O 3.31Å; V439-Y446 PolarHBondContact O-N 2.96Å; V439-F448 HydrophobicContact CB-CE2 4.09Å; V439-F448 HydrophobicContact CG2-CD2 4.05Å; V439-F448 HydrophobicContact CG2-CE2 3.97Å
440	A	97.6	Very high	94.9	Very high	4 Å²	4	18.5 Å²	18.5	3%	0.033	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.6	175.4	0	0	0	0	0	110.7	I37 V40 I425 H427 N444	I37-A440 HydrophobicContact CB-CB 4.01Å; I37-A440 HydrophobicContact CD1-CB 4.38Å; I37-A440 HydrophobicContact CG2-CB 3.69Å; V40-A440 HydrophobicContact CG2-CB 3.79Å; I425-A440 WeakPolarHBondContact CD1-O 3.49Å; H427-A440 HydrophobicContact CB-CB 4.22Å; H427-A440 PolarHBondContact O-N 3.16Å; H427-A440 VanDerWaalsContact O-N 3.09Å; A440-N444 WeakPolarHBondContact CA-O 3.18Å
441	A	95.1	Very high	93.9	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.017	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	102.1	170.6	0	0	0	0	0	108.6	I425 N443 N444 Y446	I425-A441 HydrophobicContact CD1-CB 3.48Å; I425-A441 VanDerWaalsContact CD1-CB 3.48Å; A441-N443 PolarHBondContact O-N 2.69Å; A441-N444 PolarHBondContact N-O 2.75Å; A441-N444 WeakPolarHBondContact O-CB 3.36Å; A441-N444 PolarHBondContact O-N 2.79Å; A441-Y446 HydrophobicContact CB-CD2 4.24Å; A441-Y446 HydrophobicContact CB-CE2 3.85Å
442	T	91.8	Very high	92.5	Very high	55 Å²	55	25.8 Å²	25.8	34%	0.337	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	-115.2	-174.1	-43.7	0	0	0	0	111	V31 I36 I37	V31-T442 HydrophobicContact CB-CG2 4.17Å; V31-T442 HydrophobicContact CG1-CG2 3.89Å; V31-T442 HydrophobicContact CG2-CG2 4.23Å; I36-T442 HydrophobicContact CD1-CG2 4.41Å; I36-T442 HydrophobicContact CG1-CG2 3.98Å; I37-T442 PolarHBondContact N-O 3.17Å
443	N	90.4	Very high	90.4	Very high	13 Å²	13	33.2 Å²	33.2	7%	0.07	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-1.3	174.2	63.4	-20.4	0	0	0	113.5	V31 D35 A441	V31-N443 HydrophobicContact CG1-CB 3.46Å; V31-N443 VanDerWaalsContact CG1-CB 3.46Å; V31-N443 WeakPolarHBondContact CG1-ND2 3.24Å; V31-N443 WeakPolarHBondContact CG2-ND2 3.4Å; V31-N443 WeakPolarHBondContact CG2-OD1 3.47Å; D35-N443 HydrophobicContact CB-CB 4.17Å; D35-N443 WeakPolarHBondContact O-CA 3.37Å; D35-N443 WeakPolarHBondContact O-CB 3.49Å; A441-N443 PolarHBondContact O-N 2.69Å
444	N	94.5	Very high	90.3	Very high	22 Å²	22	31.1 Å²	31.1	12%	0.118	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.7	-175.3	-66.9	-49.6	0	0	0	110.9	V23 K24 A26 R389 A440 A441 Y446	V23-N444 HydrophobicContact CG2-CB 4.13Å; K24-N444 CarbonylContact O-C 3.55Å; K24-N444 VanDerWaalsContact O-CA 3.24Å; K24-N444 WeakPolarHBondContact O-CA 3.17Å; A26-N444 PolarHBondContact O-OD1 3.48Å; A26-N444 VanDerWaalsContact O-OD1 3.12Å; R389-N444 PolarHBondContact NH2-OD1 2.85Å; A440-N444 WeakPolarHBondContact CA-O 3.18Å; A441-N444 PolarHBondContact N-O 2.75Å; A441-N444 WeakPolarHBondContact O-CB 3.36Å; A441-N444 PolarHBondContact O-N 2.79Å; N444-Y446 HydrophobicContact CB-CD2 4.19Å; N444-Y446 HydrophobicContact CB-CE2 3.59Å
445	L	96.9	Very high	90.2	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	109	170.3	-175.7	68.6	0	0	0	109.3	V23 K24 I37 V40 L49 T51 F61 A438	V23-L445 CarbonylContact C-O 3.58Å; V23-L445 VanDerWaalsContact CA-O 3.31Å; V23-L445 WeakPolarHBondContact CA-O 3.43Å; K24-L445 HydrophobicContact CB-CB 4.27Å; K24-L445 PolarHBondContact N-O 3.49Å; K24-L445 PolarHBondContact O-N 2.81Å; I37-L445 HydrophobicContact CD1-CB 3.84Å; V40-L445 HydrophobicContact CG1-CD1 4.06Å; V40-L445 HydrophobicContact CG2-CD1 4.1Å; L49-L445 HydrophobicContact CD2-CD2 3.92Å; T51-L445 HydrophobicContact CG2-CD1 3.97Å; T51-L445 HydrophobicContact CG2-CD2 3.7Å; T51-L445 HydrophobicContact CG2-CG 4.37Å; F61-L445 HydrophobicContact CD2-CD2 4.08Å; F61-L445 HydrophobicContact CE2-CD2 3.67Å; F61-L445 HydrophobicContact CZ-CD2 4.16Å; A438-L445 HydrophobicContact CB-CD1 4.2Å
446	Y	96.8	Very high	90	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.027	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	136.2	173.8	-66.3	-100.1	0	0	0	110.1	F20 V23 A387 R389 A438 V439 A441 N444 F448	F20-Y446 HydrophobicContact CD2-CD1 4.39Å; F20-Y446 AromaticContact CE2-CD1 4Å; F20-Y446 HydrophobicContact CE2-CD1 4Å; V23-Y446 HydrophobicContact CB-CD1 4.25Å; V23-Y446 HydrophobicContact CB-CE1 4.34Å; V23-Y446 HydrophobicContact CG2-CD1 4.04Å; V23-Y446 HydrophobicContact CG2-CD2 4.41Å; V23-Y446 HydrophobicContact CG2-CE1 3.89Å; V23-Y446 HydrophobicContact CG2-CE2 4.27Å; V23-Y446 HydrophobicContact CG2-CG 4.31Å; A387-Y446 HydrophobicContact CB-CD1 4.34Å; A387-Y446 HydrophobicContact CB-CD2 3.84Å; A387-Y446 HydrophobicContact CB-CE1 4.49Å; A387-Y446 HydrophobicContact CB-CE2 4.01Å; A387-Y446 HydrophobicContact CB-CG 4.01Å; R389-Y446 HydrophobicContact CG-CE1 4.33Å; R389-Y446 PolarHBondContact N-OH 2.78Å; A438-Y446 CarbonylContact C-O 3.54Å; A438-Y446 WeakPolarHBondContact CA-O 3.16Å; V439-Y446 PolarHBondContact N-O 3.31Å; V439-Y446 PolarHBondContact O-N 2.96Å; A441-Y446 HydrophobicContact CB-CD2 4.24Å; A441-Y446 HydrophobicContact CB-CE2 3.85Å; N444-Y446 HydrophobicContact CB-CD2 4.19Å; N444-Y446 HydrophobicContact CB-CE2 3.59Å; Y446-F448 HydrophobicContact CD1-CE1 4.49Å; Y446-F448 AromaticContact CD1-CZ 3.96Å; Y446-F448 HydrophobicContact CD1-CZ 3.96Å; Y446-F448 HydrophobicContact CG-CE2 4.42Å; Y446-F448 HydrophobicContact CG-CZ 4.05Å
447	I	96.1	Very high	89.7	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.2	172.4	-56.7	178.8	0	0	0	107.5	S21 Q22 L49 Y77 V436 I437	S21-I447 WeakPolarHBondContact CA-O 3.46Å; S21-I447 WeakPolarHBondContact CB-O 3.43Å; S21-I447 PolarHBondContact N-O 2.74Å; Q22-I447 HydrophobicContact CB-CB 4.24Å; Q22-I447 HydrophobicContact CB-CD1 4.41Å; Q22-I447 PolarHBondContact N-O 3.14Å; Q22-I447 PolarHBondContact O-N 3.4Å; L49-I447 HydrophobicContact CD2-CD1 4.18Å; Y77-I447 HydrophobicContact CD2-CD1 3.93Å; Y77-I447 HydrophobicContact CD2-CG2 4.48Å; Y77-I447 HydrophobicContact CG-CD1 4.01Å; V436-I447 HydrophobicContact CG1-CG2 3.86Å; I437-I447 WeakPolarHBondContact O-CA 3.14Å
448	F	94.9	Very high	89.2	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.6	173.2	-50.4	-75.9	0	0	0	109.5	W18 C19 F20 F372 A387 L398 V436 I437 V439 Y446	W18-F448 HydrophobicContact CE3-CB 4.11Å; C19-F448 VanDerWaalsContact O-CA 3.29Å; C19-F448 WeakPolarHBondContact O-CA 3.34Å; F20-F448 HydrophobicContact CB-CD1 4.36Å; F20-F448 HydrophobicContact CB-CE1 4.36Å; F20-F448 HydrophobicContact CD2-CD1 4.37Å; F20-F448 AromaticContact CD2-CE1 3.9Å; F20-F448 HydrophobicContact CD2-CE1 3.9Å; F372-F448 HydrophobicContact CE1-CD2 4.34Å; F372-F448 AromaticContact CE1-CE2 3.76Å; F372-F448 HydrophobicContact CE1-CE2 3.76Å; F372-F448 HydrophobicContact CE1-CZ 4.29Å; F372-F448 AromaticContact CZ-CD2 3.9Å; F372-F448 HydrophobicContact CZ-CD2 3.9Å; F372-F448 AromaticContact CZ-CE2 3.78Å; F372-F448 HydrophobicContact CZ-CE2 3.78Å; F372-F448 HydrophobicContact CZ-CZ 4.47Å; A387-F448 HydrophobicContact CB-CE2 4.41Å; A387-F448 HydrophobicContact CB-CZ 4.19Å; L398-F448 HydrophobicContact CD1-CD1 3.62Å; L398-F448 HydrophobicContact CD1-CE1 3.79Å; L398-F448 HydrophobicContact CD1-CG 4.02Å; L398-F448 HydrophobicContact CD1-CZ 4.3Å; L398-F448 HydrophobicContact CD2-CD1 4.22Å; L398-F448 HydrophobicContact CD2-CE1 3.85Å; L398-F448 HydrophobicContact CG-CD1 4.18Å; L398-F448 HydrophobicContact CG-CE1 4.28Å; V436-F448 WeakPolarHBondContact CA-O 3.31Å; I437-F448 HydrophobicContact CD1-CB 3.98Å; I437-F448 HydrophobicContact CD1-CD2 3.92Å; I437-F448 HydrophobicContact CD1-CG 4.37Å; I437-F448 HydrophobicContact CG1-CB 3.65Å; I437-F448 HydrophobicContact CG1-CD2 4.01Å; I437-F448 HydrophobicContact CG1-CG 4.33Å; I437-F448 PolarHBondContact N-O 2.99Å; I437-F448 PolarHBondContact O-N 2.92Å; V439-F448 HydrophobicContact CB-CE2 4.09Å; V439-F448 HydrophobicContact CG2-CD2 4.05Å; V439-F448 HydrophobicContact CG2-CE2 3.97Å; Y446-F448 HydrophobicContact CD1-CE1 4.49Å; Y446-F448 AromaticContact CD1-CZ 3.96Å; Y446-F448 HydrophobicContact CD1-CZ 3.96Å; Y446-F448 HydrophobicContact CG-CE2 4.42Å; Y446-F448 HydrophobicContact CG-CZ 4.05Å
449	Q	91.8	Very high	88.6	Confident	25 Å²	25	35.5 Å²	35.5	12%	0.117	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146	177.9	65.7	-167	7.9	0	0	109.6	C19 S21 N435 V436	C19-Q449 WeakPolarHBondContact CB-O 3.31Å; C19-Q449 PolarHBondContact N-O 3.27Å; C19-Q449 PolarHBondContact O-N 3.24Å; S21-Q449 PolarHBondContact OG-NE2 2.85Å; S21-Q449 PolarHBondContact OG-OE1 3.3Å; N435-Q449 WeakPolarHBondContact O-CA 3.42Å; V436-Q449 HydrophobicContact CG2-CB 4.15Å
450	D	88.4	Confident	87.9	Confident	33 Å²	33	38 Å²	38	18%	0.176	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	146.7	173.4	-166.9	16	0	0	0	110.8	Q17 N435 I452	Q17-D450 PolarHBondContact N-OD1 3.3Å; N435-D450 HydrophobicContact CB-CB 3.44Å; N435-D450 VanDerWaalsContact CB-CB 3.44Å; N435-D450 PolarHBondContact ND2-OD2 3.31Å; N435-D450 PolarHBondContact O-N 2.68Å; D450-I452 PolarHBondContact O-N 3.15Å
451	K	77.9	Confident	87.2	Confident	98 Å²	98	40.6 Å²	40.6	43%	0.426	21%	0.21	S	C	.	.			trans	-73.4	112.3	-179.7	-169.4	-177.6	177.2	-168.5	0	108.8	Q17 N453	Q17-K451 HydrophobicContact CB-CB 4.12Å; Q17-K451 HydrophobicContact CG-CB 4.24Å; Q17-K451 HydrophobicContact CG-CD 4.32Å; Q17-K451 WeakPolarHBondContact O-CB 3.43Å; Q17-K451 PolarHBondContact O-N 2.98Å; K451-N453 PolarHBondContact O-N 3.05Å
452	I	67.5	Low	86.5	Confident	76 Å²	76	43.8 Å²	43.8	39%	0.39	23%	0.226	S	C	.	.			trans	-67.8	119.7	168.3	-58.9	172.8	0	0	0	107.1	R74 D450	R74-I452 HydrophobicContact CG-CD1 3.66Å; D450-I452 PolarHBondContact O-N 3.15Å
453	N	51.3	Low	86.1	Confident	193 Å²	193	42.8 Å²	42.8	100%	1.032	22%	0.216	S	C	*	.			trans	-75.7	0	173.7	-80.5	-30	0	0	0	112	K451	K451-N453 PolarHBondContact O-N 3.05Å

Retrieved 453 of 453 residues in 510.5 ms (Link to these results)

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