A0A077ZGQ3_TRITR Loading...

Abnormal cell migration protein 18-like fibronectin type I domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZGQ3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 354 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	27.4	Very low	42.2	Very low	224 Å²	224	129 Å²	129	100%	1.103	65%	0.654	S	S	*	*				0	100.6	0	-68.9	178.1	-163.6	0	0	108	W3	M1-W3 PolarHBondContact O-N 3.06Å
2	Q	30.9	Very low	42.5	Very low	185 Å²	185	121.1 Å²	121.1	86%	0.864	63%	0.629	S	S	*	*			trans	-73.2	112.3	178	-74.3	167.7	-30.7	0	0	108.3	L4	Q2-L4 PolarHBondContact O-N 2.74Å; Q2-L4 VanDerWaalsContact O-N 3.1Å
3	W	35.5	Very low	42.2	Very low	250 Å²	250	120.8 Å²	120.8	95%	0.947	64%	0.642	S	S	*	*			trans	-73.5	100.1	168	-82.6	41.2	0	0	0	106.9	M1 A5	M1-W3 PolarHBondContact O-N 3.06Å; W3-A5 PolarHBondContact O-N 3.1Å
4	L	37.1	Very low	42.5	Very low	125 Å²	125	119.6 Å²	119.6	65%	0.654	63%	0.629	S	S	*	*			trans	-54.4	122.2	166.7	-77.6	152.2	0	0	0	107.5	Q2 V6 A323	Q2-L4 PolarHBondContact O-N 2.74Å; Q2-L4 VanDerWaalsContact O-N 3.1Å; L4-V6 HydrophobicContact CB-CG2 4.25Å; L4-V6 PolarHBondContact O-N 2.82Å; L4-A323 HydrophobicContact CD2-CB 4.47Å
5	A	42.9	Very low	42.6	Very low	48 Å²	48	119.4 Å²	119.4	40%	0.397	62%	0.623	S	S	.	*			trans	-67.4	83.4	168.2	0	0	0	0	0	107.8	W3 L7	W3-A5 PolarHBondContact O-N 3.1Å; A5-L7 PolarHBondContact O-N 3.23Å
6	V	40.3	Very low	43.2	Very low	99 Å²	99	118.2 Å²	118.2	60%	0.6	62%	0.616	S	S	*	*			trans	-71	118.1	174.8	178.9	0	0	0	0	107.1	L4 L8	L4-V6 HydrophobicContact CB-CG2 4.25Å; L4-V6 PolarHBondContact O-N 2.82Å; V6-L8 HydrophobicContact CG1-CD2 3.91Å; V6-L8 HydrophobicContact CG1-CG 4.04Å; V6-L8 PolarHBondContact O-N 3.35Å
7	L	44.2	Very low	43.8	Very low	89 Å²	89	115.8 Å²	115.8	47%	0.466	61%	0.612	S	S	.	*			trans	-70.3	84.4	173.6	-141.3	147.8	0	0	0	107.4	A5 I9	A5-L7 PolarHBondContact O-N 3.23Å; L7-I9 HydrophobicContact CD2-CD1 3.86Å; L7-I9 HydrophobicContact CD2-CG1 3.63Å; L7-I9 PolarHBondContact O-N 3.3Å; L7-I9 VanDerWaalsContact O-N 3.1Å
8	L	50.3	Low	44.8	Very low	112 Å²	112	110.7 Å²	110.7	59%	0.586	59%	0.586	S	S	*	*			trans	-76.1	94.5	178.8	-72.6	171.3	0	0	0	109	V6 F226	V6-L8 HydrophobicContact CG1-CD2 3.91Å; V6-L8 HydrophobicContact CG1-CG 4.04Å; V6-L8 PolarHBondContact O-N 3.35Å; L8-F226 HydrophobicContact CB-CZ 4.27Å
9	I	52.4	Low	45.3	Very low	110 Å²	110	108.1 Å²	108.1	56%	0.564	58%	0.582	S	S	*	*			trans	-87	105.7	169.4	-57.1	177.2	0	0	0	107.8	L7 L11	L7-I9 HydrophobicContact CD2-CD1 3.86Å; L7-I9 HydrophobicContact CD2-CG1 3.63Å; L7-I9 PolarHBondContact O-N 3.3Å; L7-I9 VanDerWaalsContact O-N 3.1Å; I9-L11 HydrophobicContact CG2-CD1 4.09Å; I9-L11 HydrophobicContact CG2-CG 4.17Å; I9-L11 PolarHBondContact O-N 2.64Å
10	A	57.2	Low	46	Very low	29 Å²	29	107.9 Å²	107.9	24%	0.24	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-89	100	168	0	0	0	0	0	109.3	G12 F226 F241	A10-G12 PolarHBondContact O-N 3.41Å; A10-F226 HydrophobicContact CB-CE2 4Å; A10-F226 HydrophobicContact CB-CZ 4.13Å; A10-F241 HydrophobicContact CB-CE1 4.42Å; A10-F241 HydrophobicContact CB-CZ 3.8Å
11	L	46.1	Very low	47	Very low	148 Å²	148	106.7 Å²	106.7	78%	0.775	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76	104.3	171	-86.6	136.2	0	0	0	109.4	I9 C13	I9-L11 HydrophobicContact CG2-CD1 4.09Å; I9-L11 HydrophobicContact CG2-CG 4.17Å; I9-L11 PolarHBondContact O-N 2.64Å; L11-C13 PolarHBondContact O-N 3.1Å; L11-C13 VanDerWaalsContact O-N 3.13Å
12	G	45.3	Very low	49.6	Very low	34 Å²	34	99 Å²	99	35%	0.351	54%	0.538	S	S	.	.			trans	-76	93.6	-177.7	0	0	0	0	0	113.4	A10 F14	A10-G12 PolarHBondContact O-N 3.41Å; G12-F14 PolarHBondContact O-N 3.28Å; G12-F14 VanDerWaalsContact O-N 3.08Å
13	C	39.3	Very low	52.4	Low	118 Å²	118	95 Å²	95	80%	0.797	52%	0.518	S	S	*	.			trans	-79.1	48.1	164.4	-76.3	0	0	0	0	112.6	L11	L11-C13 PolarHBondContact O-N 3.1Å; L11-C13 VanDerWaalsContact O-N 3.13Å
14	F	45.4	Very low	54.9	Low	104 Å²	104	83.8 Å²	83.8	46%	0.456	48%	0.478	S	S	.	.			trans	-132.1	55.3	-172.4	-63.9	-65.5	0	0	0	114.5	G12 L16 K187	G12-F14 PolarHBondContact O-N 3.28Å; G12-F14 VanDerWaalsContact O-N 3.08Å; F14-L16 HydrophobicContact CD1-CD1 4.27Å; F14-L16 PolarHBondContact O-N 3.04Å; F14-K187 HydrophobicContact CD1-CD 4.29Å; F14-K187 VanDerWaalsContact CD1-CE 3.49Å; F14-K187 VanDerWaalsContact CD2-NZ 3.3Å; F14-K187 VanDerWaalsContact CE1-CE 3.41Å; F14-K187 VanDerWaalsContact CE2-NZ 3.32Å
15	H	44.1	Very low	57.3	Low	116 Å²	116	82.6 Å²	82.6	54%	0.537	47%	0.471	S	S	.	.			trans	-87.4	64.3	155	-72.1	-50.4	0	0	0	109.9
16	L	52	Low	59.6	Low	100 Å²	100	81.9 Å²	81.9	52%	0.524	46%	0.462	S	S	.	.			trans	-84.8	106.6	157.4	-85.6	117.7	0	0	0	106.9	F14 F188	F14-L16 HydrophobicContact CD1-CD1 4.27Å; F14-L16 PolarHBondContact O-N 3.04Å; L16-F188 HydrophobicContact CB-CE2 4.21Å; L16-F188 VanDerWaalsContact O-CZ 3.28Å; L16-F188 WeakPolarHBondContact O-CZ 3.36Å
17	S	53.7	Low	62.1	Low	77 Å²	77	80.8 Å²	80.8	54%	0.538	45%	0.449	S	S	.	.			trans	-96.6	137.1	164.8	47.7	0	0	0	0	108.5
18	T	61.5	Low	64.5	Low	24 Å²	24	80 Å²	80	15%	0.147	45%	0.449	C	S	.	.	B	Isolated β-bridge	trans	-114.6	125.7	173.9	63.6	0	0	0	0	109.8	F188 Y190 G236	T18-F188 HydrophobicContact CG2-CD2 3.54Å; T18-F188 HydrophobicContact CG2-CE2 3.71Å; T18-F188 HydrophobicContact CG2-CG 4.33Å; T18-Y190 WeakPolarHBondContact CB-OH 3.42Å; T18-Y190 WeakPolarHBondContact CG2-OH 2.99Å; T18-Y190 PolarHBondContact OG1-OH 3.46Å; T18-Y190 VanDerWaalsContact OG1-OH 3.13Å; T18-G236 VanDerWaalsContact O-CA 3.23Å; T18-G236 WeakPolarHBondContact O-CA 3.49Å
19	A	54.5	Low	66.8	Low	62 Å²	62	75.7 Å²	75.7	51%	0.512	43%	0.428	S	S	.	.			trans	-117.6	67	-176.3	0	0	0	0	0	109.6	V235	A19-V235 HydrophobicContact CB-CG1 3.38Å
20	H	59.1	Low	68.9	Low	104 Å²	104	72.5 Å²	72.5	48%	0.481	41%	0.413	S	S	.	.			trans	-130.3	78.8	179.4	-84.8	36.9	0	0	0	110.3
21	S	68.5	Low	70.8	Confident	83 Å²	83	71.6 Å²	71.6	58%	0.58	41%	0.406	S	S	*	.			trans	-101.1	84	153.4	168.1	0	0	0	0	108	I202	S21-I202 WeakPolarHBondContact CA-O 3.39Å
22	E	82.2	Confident	73.2	Confident	61 Å²	61	67.6 Å²	67.6	29%	0.285	38%	0.38	S	S	.	.			trans	-89	145.8	170.5	-67.9	-171	177.4	0	0	110	S151 F152 Q201 I202	E22-S151 WeakPolarHBondContact OE2-CB 3.14Å; E22-S151 PolarHBondContact OE2-OG 2.93Å; E22-F152 HydrophobicContact CB-CE2 4.01Å; E22-F152 HydrophobicContact CB-CZ 3.85Å; E22-F152 WeakPolarHBondContact O-CZ 3.17Å; E22-Q201 WeakPolarHBondContact O-CA 3.32Å; E22-Q201 VanDerWaalsContact O-CB 3.31Å; E22-Q201 WeakPolarHBondContact O-CB 3.09Å; E22-I202 PolarHBondContact O-N 3.37Å
23	K	88.8	Confident	75.6	Confident	102 Å²	102	68.5 Å²	68.5	44%	0.443	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.9	178.8	-51	-174	-177	-175.9	0	109.6	Y195 Q201	K23-Y195 HydrophobicContact CB-CD1 4.32Å; K23-Y195 HydrophobicContact CD-CD1 4.04Å; K23-Y195 HydrophobicContact CD-CD2 4.07Å; K23-Y195 HydrophobicContact CD-CE1 3.76Å; K23-Y195 HydrophobicContact CD-CE2 3.79Å; K23-Y195 HydrophobicContact CD-CG 4.17Å; K23-Q201 HydrophobicContact CB-CB 4.33Å; K23-Q201 HydrophobicContact CG-CB 3.84Å
24	C	87.3	Confident	78.1	Confident	14 Å²	14	64.9 Å²	64.9	10%	0.095	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	136.4	173	-163.9	0	0	0	0	111.2	F152 F154 G199 V200	C24-F152 HydrophobicContact CB-CB 4.48Å; C24-F152 HydrophobicContact CB-CD2 3.4Å; C24-F152 HydrophobicContact CB-CE2 3.65Å; C24-F152 HydrophobicContact CB-CG 3.89Å; C24-F152 HydrophobicContact CB-CZ 4.32Å; C24-F154 HydrophobicContact CB-CE2 4.45Å; C24-F154 HydrophobicContact CB-CZ 4.04Å; C24-F154 VanDerWaalsContact SG-CZ 3.53Å; C24-G199 CarbonylContact O-C 3.54Å; C24-G199 WeakPolarHBondContact O-CA 3.36Å; C24-V200 PolarHBondContact N-O 2.84Å; C24-V200 PolarHBondContact O-N 2.64Å
25	L	88.4	Confident	80.2	Confident	100 Å²	100	65.8 Å²	65.8	52%	0.524	35%	0.351	S	S	.	.			trans	-97.8	147.3	179.3	-63.7	175.3	0	0	0	111	R149 Y195	L25-R149 PolarHBondContact O-NH1 3.19Å; L25-Y195 HydrophobicContact CD2-CD1 4.22Å; L25-Y195 HydrophobicContact CD2-CE1 4.36Å
26	T	90.6	Very high	82.2	Confident	34 Å²	34	61.4 Å²	61.4	21%	0.209	33%	0.33	C	S	.	.			trans	-57	144.5	167	-72.5	0	0	0	0	111	I164 H165 G198	T26-I164 HydrophobicContact CG2-CG2 3.43Å; T26-I164 VanDerWaalsContact CG2-CG2 3.43Å; T26-H165 VanDerWaalsContact CG2-O 3.3Å; T26-H165 WeakPolarHBondContact CG2-O 2.92Å; T26-H165 PolarHBondContact OG1-O 2.87Å; T26-H165 VanDerWaalsContact OG1-O 3.11Å; T26-G198 PolarHBondContact OG1-O 2.91Å
27	K	93.5	Very high	83.4	Confident	75 Å²	75	60.3 Å²	60.3	33%	0.326	33%	0.331	S	S	.	.			trans	-113.9	140.5	169.6	-60.5	-62.8	-175.9	178.3	0	107.9	W114 F115 I164 H165	K27-W114 HydrophobicContact CB-CB 4.3Å; K27-W114 HydrophobicContact CB-CG 4.25Å; K27-W114 HydrophobicContact CD-CG 4.36Å; K27-W114 HydrophobicContact CG-CB 4.42Å; K27-W114 HydrophobicContact CG-CD2 4.19Å; K27-W114 HydrophobicContact CG-CG 3.86Å; K27-F115 HydrophobicContact CB-CE2 4.34Å; K27-F115 HydrophobicContact CB-CZ 4.18Å; K27-I164 CarbonylContact O-C 3.51Å; K27-I164 WeakPolarHBondContact O-CA 3.43Å; K27-H165 HydrophobicContact CB-CB 4.19Å; K27-H165 PolarHBondContact O-N 2.95Å
28	T	95.1	Very high	84.3	Confident	73 Å²	73	64 Å²	64	45%	0.448	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142	-179.9	-54.1	0	0	0	0	108.2	V163 I164	T28-V163 WeakPolarHBondContact CA-O 3.24Å; T28-I164 HydrophobicContact CG2-CG1 3.81Å
29	S	96.9	Very high	85.1	Confident	22 Å²	22	67.4 Å²	67.4	15%	0.154	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	173.1	166.1	-164.7	0	0	0	0	110.7	F115 Y117 Q162 V163	S29-F115 VanDerWaalsContact CB-CE2 3.43Å; S29-Y117 WeakPolarHBondContact CB-OH 3.25Å; S29-Y117 PolarHBondContact OG-OH 2.95Å; S29-Q162 CarbonylContact O-C 3.57Å; S29-Q162 VanDerWaalsContact O-CA 3.29Å; S29-Q162 WeakPolarHBondContact O-CA 3.44Å; S29-V163 PolarHBondContact N-O 2.97Å; S29-V163 PolarHBondContact O-N 3Å
30	T	97.3	Very high	86.1	Confident	42 Å²	42	65.9 Å²	65.9	26%	0.258	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.4	-174.4	-46.6	0	0	0	0	109.9	Y32 D161 Q162	T30-Y32 WeakPolarHBondContact O-CE2 3.49Å; T30-D161 CarbonylContact C-O 3.58Å; T30-D161 WeakPolarHBondContact CA-O 3.2Å; T30-D161 HydrophobicContact CG2-CB 3.92Å; T30-Q162 HydrophobicContact CG2-CG 4.16Å
31	S	97	Very high	86.9	Confident	11 Å²	11	66.1 Å²	66.1	8%	0.077	34%	0.339	C	S	.	.			trans	-79.3	151.9	169.6	-56.6	0	0	0	0	109.6	L128 I130 D161	S31-L128 WeakPolarHBondContact CA-O 3.44Å; S31-I130 PolarHBondContact OG-N 3.49Å; S31-D161 WeakPolarHBondContact CB-O 3.46Å; S31-D161 PolarHBondContact N-O 3.1Å; S31-D161 PolarHBondContact OG-O 3.29Å
32	Y	96.8	Very high	87.4	Confident	63 Å²	63	70.9 Å²	70.9	25%	0.247	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	144.8	-179	-54.5	-84	0	0	0	109.8	T30 Y77 F78 G127 L128	T30-Y32 WeakPolarHBondContact O-CE2 3.49Å; Y32-Y77 HydrophobicContact CD1-CD1 4.34Å; Y32-Y77 AromaticContact CD1-CD2 3.78Å; Y32-Y77 HydrophobicContact CD1-CD2 3.78Å; Y32-Y77 HydrophobicContact CD1-CE1 4.02Å; Y32-Y77 AromaticContact CD1-CE2 3.43Å; Y32-Y77 HydrophobicContact CD1-CE2 3.43Å; Y32-Y77 VanDerWaalsContact CD1-CE2 3.43Å; Y32-Y77 HydrophobicContact CD1-CG 4.22Å; Y32-Y77 AromaticContact CD1-CZ 3.55Å; Y32-Y77 AromaticContact CD2-CD1 3.69Å; Y32-Y77 HydrophobicContact CD2-CD1 3.69Å; Y32-Y77 HydrophobicContact CD2-CD2 4.49Å; Y32-Y77 AromaticContact CD2-CE1 3.66Å; Y32-Y77 HydrophobicContact CD2-CE1 3.66Å; Y32-Y77 HydrophobicContact CD2-CE2 4.48Å; Y32-Y77 HydrophobicContact CD2-CG 4.11Å; Y32-Y77 HydrophobicContact CE1-CD2 4.38Å; Y32-Y77 AromaticContact CE1-CE1 3.86Å; Y32-Y77 HydrophobicContact CE1-CE1 3.86Å; Y32-Y77 AromaticContact CE1-CE2 3.61Å; Y32-Y77 HydrophobicContact CE1-CE2 3.61Å; Y32-Y77 AromaticContact CE1-CZ 3.29Å; Y32-Y77 VanDerWaalsContact CE1-OH 3.23Å; Y32-Y77 WeakPolarHBondContact CE1-OH 3.27Å; Y32-Y77 AromaticContact CE2-CD1 4Å; Y32-Y77 HydrophobicContact CE2-CD1 4Å; Y32-Y77 AromaticContact CE2-CE1 3.49Å; Y32-Y77 HydrophobicContact CE2-CE1 3.49Å; Y32-Y77 VanDerWaalsContact CE2-CE1 3.49Å; Y32-Y77 AromaticContact CE2-CZ 3.85Å; Y32-Y77 AromaticContact CG-CD1 3.87Å; Y32-Y77 HydrophobicContact CG-CD1 3.87Å; Y32-Y77 AromaticContact CG-CD2 3.83Å; Y32-Y77 HydrophobicContact CG-CD2 3.83Å; Y32-Y77 AromaticContact CG-CE1 3.92Å; Y32-Y77 HydrophobicContact CG-CE1 3.92Å; Y32-Y77 AromaticContact CG-CE2 3.9Å; Y32-Y77 HydrophobicContact CG-CE2 3.9Å; Y32-Y77 AromaticContact CG-CG 3.82Å; Y32-Y77 HydrophobicContact CG-CG 3.82Å; Y32-Y77 AromaticContact CG-CZ 3.93Å; Y32-Y77 AromaticContact CZ-CE1 3.59Å; Y32-Y77 AromaticContact CZ-CZ 3.46Å; Y32-Y77 VanDerWaalsContact CZ-CZ 3.46Å; Y32-Y77 VanDerWaalsContact CZ-OH 3.32Å; Y32-Y77 PolarHBondContact OH-OH 3.18Å; Y32-F78 WeakPolarHBondContact O-CZ 3.41Å; Y32-G127 CarbonylContact O-C 3.58Å; Y32-G127 VanDerWaalsContact O-CA 3.26Å; Y32-G127 WeakPolarHBondContact O-CA 3.25Å; Y32-L128 HydrophobicContact CD2-CD2 4.28Å; Y32-L128 PolarHBondContact N-O 2.87Å; Y32-L128 PolarHBondContact O-N 2.93Å
33	H	94.7	Very high	87.5	Confident	54 Å²	54	72.7 Å²	72.7	25%	0.25	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.1	-174.9	-54.7	102.3	0	0	0	111	R125 I126 E129 D161	H33-R125 HydrophobicContact CB-CG 4.3Å; H33-I126 WeakPolarHBondContact CA-O 3.39Å; H33-E129 IonicContact CD2-OE1 3.76Å; H33-E129 IonicContact NE2-OE1 2.76Å; H33-D161 IonicContact CE1-OD1 2.68Å; H33-D161 PolarHBondContact CE1-OD1 2.8Å; H33-D161 IonicContact ND1-OD1 2.77Å; H33-D161 IonicContact ND1-OD2 2.96Å
34	Y	92.9	Very high	87.6	Confident	41 Å²	41	68.1 Å²	68.1	16%	0.161	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	117.6	171.1	-179.4	-100.7	0	0	0	109.7	Y36 F78 L80 L92 P94 R125 I126	Y34-Y36 HydrophobicContact CD1-CD1 4.1Å; Y34-Y36 HydrophobicContact CE1-CD1 4.42Å; Y34-F78 HydrophobicContact CG-CD2 4.48Å; Y34-L80 HydrophobicContact CD1-CD2 3.75Å; Y34-L80 HydrophobicContact CD2-CD1 4.42Å; Y34-L80 HydrophobicContact CE1-CD1 4.01Å; Y34-L80 HydrophobicContact CE1-CD2 3.66Å; Y34-L80 HydrophobicContact CE1-CG 4.5Å; Y34-L80 HydrophobicContact CE2-CD1 3.9Å; Y34-L80 HydrophobicContact CG-CD2 4.34Å; Y34-L92 HydrophobicContact CE1-CB 4.46Å; Y34-L92 WeakPolarHBondContact OH-CB 3.48Å; Y34-L92 WeakPolarHBondContact OH-CD1 2.98Å; Y34-P94 HydrophobicContact CD1-CB 4.47Å; Y34-R125 WeakPolarHBondContact O-CA 3.15Å; Y34-I126 HydrophobicContact CD1-CG2 4.23Å; Y34-I126 PolarHBondContact N-O 3.31Å; Y34-I126 PolarHBondContact O-N 2.85Å
35	E	90.3	Very high	87.8	Confident	123 Å²	123	69.6 Å²	69.6	58%	0.575	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.1	178.1	-67.2	-176.4	-177.8	0	0	110.4	R125	E35-R125 HydrophobicContact CG-CB 4.5Å; E35-R125 HydrophobicContact CG-CG 4.07Å
36	Y	85	Confident	88	Confident	24 Å²	24	66.5 Å²	66.5	9%	0.094	32%	0.324	C	S	.	.			trans	-130	6.9	-179.3	58.7	-81.2	0	0	0	112.9	Y34 K38 I91 P94 E121 G124 R125 I126	Y34-Y36 HydrophobicContact CD1-CD1 4.1Å; Y34-Y36 HydrophobicContact CE1-CD1 4.42Å; Y36-K38 PolarHBondContact O-N 3.46Å; Y36-I91 HydrophobicContact CD2-CD1 4.28Å; Y36-I91 WeakPolarHBondContact O-CD1 3.29Å; Y36-P94 HydrophobicContact CD1-CG 3.42Å; Y36-P94 VanDerWaalsContact CD1-CG 3.42Å; Y36-P94 HydrophobicContact CD2-CG 4.25Å; Y36-P94 HydrophobicContact CE1-CG 3.26Å; Y36-P94 HydrophobicContact CE2-CG 4.11Å; Y36-P94 HydrophobicContact CG-CG 3.94Å; Y36-E121 WeakPolarHBondContact OH-CG 3.27Å; Y36-E121 PolarHBondContact OH-OE1 2.57Å; Y36-G124 VanDerWaalsContact CD1-O 3.27Å; Y36-G124 WeakPolarHBondContact CD1-O 3.46Å; Y36-G124 VanDerWaalsContact CE1-O 3.32Å; Y36-G124 WeakPolarHBondContact CE1-O 3.28Å; Y36-G124 PolarHBondContact N-O 2.76Å; Y36-G124 WeakPolarHBondContact OH-CA 3.44Å; Y36-R125 VanDerWaalsContact CE1-C 3.5Å; Y36-R125 VanDerWaalsContact CE1-CA 3.48Å; Y36-R125 VanDerWaalsContact CE1-N 3.34Å; Y36-I126 HydrophobicContact CE1-CB 4.3Å
37	S	77.4	Confident	88.1	Confident	77 Å²	77	68.6 Å²	68.6	54%	0.538	33%	0.331	S	S	.	.			trans	-62.9	-18.9	175	57.9	0	0	0	0	113.8	I39 G124	S37-I39 PolarHBondContact O-N 2.77Å; S37-G124 PolarHBondContact N-O 2.81Å; S37-G124 VanDerWaalsContact N-O 3.14Å
38	K	73.8	Confident	87.9	Confident	154 Å²	154	71.2 Å²	71.2	67%	0.67	34%	0.34	S	S	*	.	S	Bend	trans	-85	111.3	177.1	-64.7	-178.9	-175.3	172	0	109.9	Y36 Q40	Y36-K38 PolarHBondContact O-N 3.46Å; K38-Q40 PolarHBondContact O-N 2.9Å
39	I	76.2	Confident	87.6	Confident	97 Å²	97	73 Å²	73	50%	0.497	34%	0.343	S	S	.	.			trans	-54	124.8	165.8	-61.4	179.9	0	0	0	108.2	S37 I41 I85 A89	S37-I39 PolarHBondContact O-N 2.77Å; I39-I41 HydrophobicContact CG2-CG1 4.35Å; I39-I85 HydrophobicContact CB-CD1 4.38Å; I39-I85 HydrophobicContact CD1-CD1 4.43Å; I39-I85 HydrophobicContact CG1-CD1 3.93Å; I39-I85 HydrophobicContact CG2-CD1 3.98Å; I39-A89 HydrophobicContact CG2-CB 3.58Å
40	Q	76.9	Confident	87.4	Confident	30 Å²	30	81.7 Å²	81.7	14%	0.14	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-93.9	108.3	-178.2	-63.2	-169.4	-8.6	0	0	109.6	K38 R43 V44 V90	K38-Q40 PolarHBondContact O-N 2.9Å; Q40-R43 HydrophobicContact CB-CB 4.17Å; Q40-R43 VanDerWaalsContact OE1-CB 3.29Å; Q40-V44 WeakPolarHBondContact O-CG2 3Å; Q40-V90 HydrophobicContact CB-CG2 4.46Å; Q40-V90 PolarHBondContact N-O 3.47Å; Q40-V90 PolarHBondContact O-N 2.81Å
41	I	76	Confident	86.8	Confident	108 Å²	108	89 Å²	89	55%	0.554	41%	0.407	S	S	*	.	S	Bend	trans	-94.1	-30.6	173.8	-56.7	173.7	0	0	0	110.4	I39 V44	I39-I41 HydrophobicContact CG2-CG1 4.35Å; I41-V44 WeakPolarHBondContact O-CG2 2.94Å
42	E	78.3	Confident	86.4	Confident	183 Å²	183	95.4 Å²	95.4	86%	0.855	44%	0.436	S	S	*	.	S	Bend	trans	-85	-32.7	-177.8	-65.3	-179.1	172.6	0	0	113.2	V44	E42-V44 PolarHBondContact O-N 2.8Å
43	R	84.4	Confident	85.9	Confident	99 Å²	99	99.7 Å²	99.7	37%	0.374	45%	0.451	S	S	.	.	S	Bend	trans	-93.9	44.5	-176	-60.5	178.3	178.5	-156.1	-10.4	112.4	Q40 V60 D62	Q40-R43 HydrophobicContact CB-CB 4.17Å; Q40-R43 VanDerWaalsContact OE1-CB 3.29Å; R43-V60 PolarHBondContact O-N 3.44Å; R43-D62 IonicContact CZ-OD1 3.65Å; R43-D62 VanDerWaalsContact NH1-CG 3.29Å; R43-D62 IonicContact NH1-OD1 3.18Å; R43-D62 PolarHBondContact NH1-OD1 3.32Å; R43-D62 IonicContact NH1-OD2 2.62Å; R43-D62 PolarHBondContact NH1-OD2 2Å; R43-D62 IonicContact NH2-OD1 2.87Å; R43-D62 PolarHBondContact NH2-OD1 3.31Å
44	V	90.9	Very high	85.7	Confident	6 Å²	6	99.6 Å²	99.6	4%	0.036	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.6	-176.1	178.1	0	0	0	0	108.8	Q40 I41 E42 W46 A56 V90	Q40-V44 WeakPolarHBondContact O-CG2 3Å; I41-V44 WeakPolarHBondContact O-CG2 2.94Å; E42-V44 PolarHBondContact O-N 2.8Å; V44-W46 HydrophobicContact CB-CD2 4.46Å; V44-W46 HydrophobicContact CB-CZ2 3.98Å; V44-W46 HydrophobicContact CG1-CD2 3.92Å; V44-W46 HydrophobicContact CG1-CE3 4.41Å; V44-W46 HydrophobicContact CG1-CG 4.32Å; V44-W46 HydrophobicContact CG1-CH2 4.4Å; V44-W46 HydrophobicContact CG1-CZ2 3.88Å; V44-W46 HydrophobicContact CG2-CZ2 4.31Å; V44-W46 PolarHBondContact O-N 2.85Å; V44-W46 PolarHBondContact O-NE1 2.92Å; V44-A56 HydrophobicContact CG1-CB 3.41Å; V44-A56 VanDerWaalsContact CG1-CB 3.41Å; V44-V90 HydrophobicContact CB-CG2 4.48Å; V44-V90 HydrophobicContact CG1-CG1 4Å; V44-V90 HydrophobicContact CG2-CB 4.49Å; V44-V90 HydrophobicContact CG2-CG1 4.14Å; V44-V90 HydrophobicContact CG2-CG2 3.8Å
45	Q	92.6	Very high	85.7	Confident	46 Å²	46	99.9 Å²	99.9	22%	0.215	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	117.6	167.5	-171.3	-172.7	-0.6	0	0	107.5	I57 G58 V60 N66	Q45-I57 HydrophobicContact CB-CG1 4.19Å; Q45-I57 HydrophobicContact CG-CD1 4.04Å; Q45-I57 HydrophobicContact CG-CG1 3.82Å; Q45-I57 VanDerWaalsContact O-CG1 3.24Å; Q45-I57 WeakPolarHBondContact O-CG1 3.47Å; Q45-I57 PolarHBondContact O-N 3Å; Q45-G58 PolarHBondContact N-O 3.03Å; Q45-G58 PolarHBondContact O-N 2.85Å; Q45-V60 HydrophobicContact CB-CG2 4.12Å; Q45-N66 HydrophobicContact CG-CB 4.39Å
46	W	91.8	Very high	85.8	Confident	35 Å²	35	94.1 Å²	94.1	13%	0.133	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.2	-175.2	-67.5	95.9	0	0	0	111.9	V44 Y48 R53 T88	V44-W46 HydrophobicContact CB-CD2 4.46Å; V44-W46 HydrophobicContact CB-CZ2 3.98Å; V44-W46 HydrophobicContact CG1-CD2 3.92Å; V44-W46 HydrophobicContact CG1-CE3 4.41Å; V44-W46 HydrophobicContact CG1-CG 4.32Å; V44-W46 HydrophobicContact CG1-CH2 4.4Å; V44-W46 HydrophobicContact CG1-CZ2 3.88Å; V44-W46 HydrophobicContact CG2-CZ2 4.31Å; V44-W46 PolarHBondContact O-N 2.85Å; V44-W46 PolarHBondContact O-NE1 2.92Å; W46-Y48 HydrophobicContact CB-CD2 4.26Å; W46-Y48 HydrophobicContact CB-CE2 3.68Å; W46-Y48 WeakPolarHBondContact O-CD2 2.91Å; W46-R53 HydrophobicContact CB-CB 4.45Å; W46-R53 HydrophobicContact CB-CG 4.1Å; W46-R53 HydrophobicContact CD2-CB 3.98Å; W46-R53 HydrophobicContact CD2-CG 4.05Å; W46-R53 HydrophobicContact CE3-CB 3.87Å; W46-R53 HydrophobicContact CE3-CG 4.45Å; W46-R53 HydrophobicContact CG-CB 4.24Å; W46-R53 HydrophobicContact CG-CG 3.88Å; W46-R53 HydrophobicContact CZ3-CB 4.46Å; W46-T88 HydrophobicContact CH2-CG2 4.26Å
47	Q	91.8	Very high	86.3	Confident	77 Å²	77	95.9 Å²	95.9	36%	0.36	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.4	157.4	-176.8	170.9	-12.4	0	0	109.2	E49 T54 V55 I57	Q47-E49 PolarHBondContact NE2-OE1 2.96Å; Q47-T54 PolarHBondContact O-N 2.89Å; Q47-T54 PolarHBondContact O-OG1 3.39Å; Q47-V55 HydrophobicContact CB-CG2 3.91Å; Q47-V55 PolarHBondContact N-O 2.89Å; Q47-I57 HydrophobicContact CB-CD1 4.43Å; Q47-I57 HydrophobicContact CB-CG2 3.71Å
48	Y	89.2	Confident	87.2	Confident	130 Å²	130	92.2 Å²	92.2	51%	0.51	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.1	177.9	-70.8	-94.3	0	0	0	110.2	W46 E52 R53	W46-Y48 HydrophobicContact CB-CD2 4.26Å; W46-Y48 HydrophobicContact CB-CE2 3.68Å; W46-Y48 WeakPolarHBondContact O-CD2 2.91Å; Y48-E52 VanDerWaalsContact CA-O 3.29Å; Y48-E52 WeakPolarHBondContact CA-O 3.4Å; Y48-R53 HydrophobicContact CD1-CG 4.23Å; Y48-R53 HydrophobicContact CE1-CB 4.48Å; Y48-R53 HydrophobicContact CE1-CG 3.47Å; Y48-R53 VanDerWaalsContact CE1-CG 3.47Å; Y48-R53 PolarHBondContact OH-NE 3.35Å
49	E	90.5	Very high	88.2	Confident	110 Å²	110	84.9 Å²	84.9	51%	0.514	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.9	168.8	-61.3	-176.4	-179	0	0	108.2	Q47 K51 E52 T54	Q47-E49 PolarHBondContact NE2-OE1 2.96Å; E49-K51 PolarHBondContact O-N 2.91Å; E49-E52 PolarHBondContact N-O 2.87Å; E49-E52 VanDerWaalsContact N-O 3.11Å; E49-E52 PolarHBondContact O-N 3.41Å; E49-T54 HydrophobicContact CB-CG2 3.71Å; E49-T54 HydrophobicContact CG-CG2 3.86Å
50	K	91.6	Very high	89	Confident	205 Å²	205	81.9 Å²	81.9	89%	0.891	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	33.5	-176.9	-57.2	178.3	-178.7	173.9	0	113.9	E52	K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 2.81Å
51	K	85.3	Confident	89.6	Confident	197 Å²	197	81.1 Å²	81.1	86%	0.857	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	11.4	-177.5	-53.7	177.4	176.8	178.9	0	115.6	E49	E49-K51 PolarHBondContact O-N 2.91Å
52	E	89.3	Confident	90.1	Very high	145 Å²	145	81.9 Å²	81.9	68%	0.678	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.4	173.8	-65.7	-177.7	173.4	0	0	110.8	Y48 E49 K50 T54	Y48-E52 VanDerWaalsContact CA-O 3.29Å; Y48-E52 WeakPolarHBondContact CA-O 3.4Å; E49-E52 PolarHBondContact N-O 2.87Å; E49-E52 VanDerWaalsContact N-O 3.11Å; E49-E52 PolarHBondContact O-N 3.41Å; K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 2.81Å; E52-T54 PolarHBondContact O-N 3.01Å
53	R	86.3	Confident	90.6	Very high	153 Å²	153	76.8 Å²	76.8	58%	0.577	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	118.2	174	-68.3	178.5	-178.3	176.7	2.9	108.4	W46 Y48	W46-R53 HydrophobicContact CB-CB 4.45Å; W46-R53 HydrophobicContact CB-CG 4.1Å; W46-R53 HydrophobicContact CD2-CB 3.98Å; W46-R53 HydrophobicContact CD2-CG 4.05Å; W46-R53 HydrophobicContact CE3-CB 3.87Å; W46-R53 HydrophobicContact CE3-CG 4.45Å; W46-R53 HydrophobicContact CG-CB 4.24Å; W46-R53 HydrophobicContact CG-CG 3.88Å; W46-R53 HydrophobicContact CZ3-CB 4.46Å; Y48-R53 HydrophobicContact CD1-CG 4.23Å; Y48-R53 HydrophobicContact CE1-CB 4.48Å; Y48-R53 HydrophobicContact CE1-CG 3.47Å; Y48-R53 VanDerWaalsContact CE1-CG 3.47Å; Y48-R53 PolarHBondContact OH-NE 3.35Å
54	T	89.8	Confident	90.9	Very high	51 Å²	51	74.3 Å²	74.3	31%	0.313	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-61.9	-178.2	53.5	0	0	0	0	112	Q47 E49 E52	Q47-T54 PolarHBondContact O-N 2.89Å; Q47-T54 PolarHBondContact O-OG1 3.39Å; E49-T54 HydrophobicContact CB-CG2 3.71Å; E49-T54 HydrophobicContact CG-CG2 3.86Å; E52-T54 PolarHBondContact O-N 3.01Å
55	V	92.2	Very high	91	Very high	47 Å²	47	79.2 Å²	79.2	29%	0.285	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.8	-175.6	-61.2	0	0	0	0	111.6	Q47 I57	Q47-V55 HydrophobicContact CB-CG2 3.91Å; Q47-V55 PolarHBondContact N-O 2.89Å; V55-I57 HydrophobicContact CG2-CG2 4.19Å
56	A	93	Very high	91.1	Very high	2 Å²	2	81.1 Å²	81.1	2%	0.017	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	129.9	166.5	0	0	0	0	0	109.9	V44 F69 D87 V90	V44-A56 HydrophobicContact CG1-CB 3.41Å; V44-A56 VanDerWaalsContact CG1-CB 3.41Å; A56-F69 HydrophobicContact CB-CZ 4.01Å; A56-F69 WeakPolarHBondContact O-CE2 3.46Å; A56-F69 WeakPolarHBondContact O-CZ 3.37Å; A56-D87 WeakPolarHBondContact CB-O 3.36Å; A56-D87 PolarHBondContact N-O 3.48Å; A56-V90 HydrophobicContact CB-CG1 3.83Å
57	I	95.1	Very high	91.3	Very high	61 Å²	61	79.7 Å²	79.7	31%	0.313	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-6.2	176.3	57.4	169.2	0	0	0	113.6	Q45 Q47 V55 F69	Q45-I57 HydrophobicContact CB-CG1 4.19Å; Q45-I57 HydrophobicContact CG-CD1 4.04Å; Q45-I57 HydrophobicContact CG-CG1 3.82Å; Q45-I57 VanDerWaalsContact O-CG1 3.24Å; Q45-I57 WeakPolarHBondContact O-CG1 3.47Å; Q45-I57 PolarHBondContact O-N 3Å; Q47-I57 HydrophobicContact CB-CD1 4.43Å; Q47-I57 HydrophobicContact CB-CG2 3.71Å; V55-I57 HydrophobicContact CG2-CG2 4.19Å; I57-F69 VanDerWaalsContact CA-CE2 3.45Å
58	G	95.3	Very high	91.5	Very high	0 Å²	0	79.3 Å²	79.3	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.5	-172.4	-177.5	0	0	0	0	0	113.3	Q45 L67	Q45-G58 PolarHBondContact N-O 3.03Å; Q45-G58 PolarHBondContact O-N 2.85Å; G58-L67 CarbonylContact C-O 3.58Å; G58-L67 WeakPolarHBondContact CA-O 3.49Å
59	C	94.8	Very high	91.8	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	148.1	-180	-54.5	0	0	0	0	109.9	L67 C82 V90 L92	C59-L67 HydrophobicContact CB-CB 4.43Å; C59-L67 PolarHBondContact N-O 3.42Å; C59-L67 PolarHBondContact O-N 3.45Å; C59-C82 HydrophobicContact CB-CB 3.78Å; C59-C82 WeakPolarHBondContact CB-SG 3.33Å; C59-C82 PolarHBondContact N-SG 3.09Å; C59-C82 WeakPolarHBondContact SG-CA 3.27Å; C59-C82 WeakPolarHBondContact SG-CB 3.22Å; C59-C82 CovalentContact SG-SG 2.04Å; C59-C82 PolarHBondContact SG-SG 3.19Å; C59-V90 HydrophobicContact CB-CG2 4.28Å; C59-L92 HydrophobicContact CB-CD2 3.89Å; C59-L92 HydrophobicContact CB-CG 4.37Å
60	V	93.3	Very high	92.1	Very high	35 Å²	35	73.3 Å²	73.3	21%	0.212	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.1	172.6	-172.1	0	0	0	0	108.9	R43 Q45	R43-V60 PolarHBondContact O-N 3.44Å; Q45-V60 HydrophobicContact CB-CG2 4.12Å
61	L	90.6	Very high	92.4	Very high	13 Å²	13	67.7 Å²	67.7	7%	0.068	37%	0.365	C	S	.	.			trans	-76.5	164.7	177.6	-66.4	179	0	0	0	112	S63 G64 E65 L67 Y73 L92	L61-S63 WeakPolarHBondContact CB-OG 3.43Å; L61-S63 PolarHBondContact O-N 3.02Å; L61-G64 PolarHBondContact O-N 3.48Å; L61-E65 HydrophobicContact CB-CB 4.44Å; L61-E65 HydrophobicContact CD1-CB 4.13Å; L61-E65 PolarHBondContact N-O 2.84Å; L61-L67 HydrophobicContact CD1-CD1 3.98Å; L61-L67 HydrophobicContact CD1-CD2 4.23Å; L61-L67 HydrophobicContact CD1-CG 4.08Å; L61-L67 HydrophobicContact CD2-CD1 3.71Å; L61-L67 HydrophobicContact CD2-CG 4.47Å; L61-L67 HydrophobicContact CG-CD1 3.85Å; L61-L67 HydrophobicContact CG-CG 4.07Å; L61-Y73 HydrophobicContact CD1-CD1 3.87Å; L61-Y73 HydrophobicContact CD1-CD2 3.32Å; L61-Y73 HydrophobicContact CD1-CE1 3.92Å; L61-Y73 HydrophobicContact CD1-CE2 3.38Å; L61-Y73 HydrophobicContact CD1-CG 3.56Å; L61-Y73 HydrophobicContact CD2-CD1 3.89Å; L61-Y73 HydrophobicContact CD2-CE1 4.18Å; L61-Y73 HydrophobicContact CD2-CG 4.18Å; L61-L92 HydrophobicContact CD2-CD1 3.87Å; L61-L92 HydrophobicContact CD2-CD2 4.3Å
62	D	86.5	Confident	92.9	Very high	125 Å²	125	62.7 Å²	62.7	67%	0.668	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.3	172.9	-75.9	-53.1	0	0	0	113.1	R43 G64	R43-D62 IonicContact CZ-OD1 3.65Å; R43-D62 VanDerWaalsContact NH1-CG 3.29Å; R43-D62 IonicContact NH1-OD1 3.18Å; R43-D62 PolarHBondContact NH1-OD1 3.32Å; R43-D62 IonicContact NH1-OD2 2.62Å; R43-D62 PolarHBondContact NH1-OD2 2Å; R43-D62 IonicContact NH2-OD1 2.87Å; R43-D62 PolarHBondContact NH2-OD1 3.31Å; D62-G64 PolarHBondContact O-N 2.89Å
63	S	89.1	Confident	93.2	Very high	75 Å²	75	59.1 Å²	59.1	52%	0.524	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.4	172.9	53.8	0	0	0	0	113.6	L61 E65	L61-S63 WeakPolarHBondContact CB-OG 3.43Å; L61-S63 PolarHBondContact O-N 3.02Å; S63-E65 VanDerWaalsContact C-N 3.3Å; S63-E65 WeakPolarHBondContact OG-CB 3.28Å; S63-E65 WeakPolarHBondContact OG-CG 3.34Å; S63-E65 PolarHBondContact OG-N 3Å; S63-E65 PolarHBondContact OG-OE2 3.25Å
64	G	90.5	Very high	93.6	Very high	48 Å²	48	58 Å²	58	50%	0.495	32%	0.323	S	S	.	.	S	Bend	trans	84.1	-0.4	-169.7	0	0	0	0	0	114.2	L61 D62	L61-G64 PolarHBondContact O-N 3.48Å; D62-G64 PolarHBondContact O-N 2.89Å
65	E	92.4	Very high	93.7	Very high	108 Å²	108	57 Å²	57	51%	0.505	32%	0.317	S	S	.	.			trans	-70.4	142.8	174.4	-68.3	172.7	162	0	0	111.3	L61 S63	L61-E65 HydrophobicContact CB-CB 4.44Å; L61-E65 HydrophobicContact CD1-CB 4.13Å; L61-E65 PolarHBondContact N-O 2.84Å; S63-E65 VanDerWaalsContact C-N 3.3Å; S63-E65 WeakPolarHBondContact OG-CB 3.28Å; S63-E65 WeakPolarHBondContact OG-CG 3.34Å; S63-E65 PolarHBondContact OG-N 3Å; S63-E65 PolarHBondContact OG-OE2 3.25Å
66	N	94.9	Very high	93.8	Very high	87 Å²	87	60 Å²	60	47%	0.465	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.1	179.4	-65.9	-42.3	0	0	0	110.7	Q45	Q45-N66 HydrophobicContact CG-CB 4.39Å
67	L	95.6	Very high	94	Very high	5 Å²	5	63.4 Å²	63.4	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.5	175.5	-61.1	177	0	0	0	110	G58 C59 L61 Q71 Y73 C82 L92	G58-L67 CarbonylContact C-O 3.58Å; G58-L67 WeakPolarHBondContact CA-O 3.49Å; C59-L67 HydrophobicContact CB-CB 4.43Å; C59-L67 PolarHBondContact N-O 3.42Å; C59-L67 PolarHBondContact O-N 3.45Å; L61-L67 HydrophobicContact CD1-CD1 3.98Å; L61-L67 HydrophobicContact CD1-CD2 4.23Å; L61-L67 HydrophobicContact CD1-CG 4.08Å; L61-L67 HydrophobicContact CD2-CD1 3.71Å; L61-L67 HydrophobicContact CD2-CG 4.47Å; L61-L67 HydrophobicContact CG-CD1 3.85Å; L61-L67 HydrophobicContact CG-CG 4.07Å; L67-Q71 HydrophobicContact CB-CB 4.4Å; L67-Q71 HydrophobicContact CD2-CG 4.07Å; L67-Y73 HydrophobicContact CD1-CG 4.35Å; L67-C82 HydrophobicContact CB-CB 3.97Å; L67-C82 HydrophobicContact CD1-CB 4.44Å; L67-L92 HydrophobicContact CD1-CD2 3.99Å
68	S	96.6	Very high	94.1	Very high	68 Å²	68	60.9 Å²	60.9	48%	0.476	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	154.9	168.6	-61.4	0	0	0	0	110.7	G70 Q71	S68-G70 PolarHBondContact O-N 3.16Å; S68-Q71 WeakPolarHBondContact O-CB 3.35Å; S68-Q71 PolarHBondContact O-N 2.92Å
69	F	96.2	Very high	94.1	Very high	70 Å²	70	61.7 Å²	61.7	31%	0.307	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	137.6	172.5	-62.9	-49.6	0	0	0	112.1	A56 I57 Q71 C82 K84 V90	A56-F69 HydrophobicContact CB-CZ 4.01Å; A56-F69 WeakPolarHBondContact O-CE2 3.46Å; A56-F69 WeakPolarHBondContact O-CZ 3.37Å; I57-F69 VanDerWaalsContact CA-CE2 3.45Å; F69-Q71 PolarHBondContact O-N 3.41Å; F69-C82 WeakPolarHBondContact CA-O 3.24Å; F69-K84 HydrophobicContact CD1-CB 3.88Å; F69-K84 HydrophobicContact CD2-CB 4.29Å; F69-K84 HydrophobicContact CD2-CD 4.43Å; F69-K84 HydrophobicContact CE1-CB 3.63Å; F69-K84 HydrophobicContact CE1-CG 4.16Å; F69-K84 HydrophobicContact CE2-CB 4.03Å; F69-K84 HydrophobicContact CE2-CD 3.76Å; F69-K84 HydrophobicContact CE2-CG 4.09Å; F69-K84 HydrophobicContact CG-CB 4.22Å; F69-K84 HydrophobicContact CZ-CB 3.71Å; F69-K84 HydrophobicContact CZ-CD 3.93Å; F69-K84 HydrophobicContact CZ-CG 3.76Å; F69-V90 HydrophobicContact CE1-CB 4.35Å; F69-V90 HydrophobicContact CE1-CG1 3.62Å; F69-V90 HydrophobicContact CZ-CG1 3.95Å
70	G	95.5	Very high	94.1	Very high	45 Å²	45	62 Å²	62	46%	0.464	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-13.1	-174.3	0	0	0	0	0	114.6	S68 C82	S68-G70 PolarHBondContact O-N 3.16Å; G70-C82 PolarHBondContact N-O 3.34Å
71	Q	97.4	Very high	94.2	Very high	87 Å²	87	64.5 Å²	64.5	41%	0.407	35%	0.348	S	S	.	.			trans	-67.5	136.7	176.1	-169.5	175.5	-20.4	0	0	110.4	L67 S68 F69 C82	L67-Q71 HydrophobicContact CB-CB 4.4Å; L67-Q71 HydrophobicContact CD2-CG 4.07Å; S68-Q71 WeakPolarHBondContact O-CB 3.35Å; S68-Q71 PolarHBondContact O-N 2.92Å; F69-Q71 PolarHBondContact O-N 3.41Å; Q71-C82 PolarHBondContact O-N 2.95Å; Q71-C82 VanDerWaalsContact O-N 3.12Å
72	I	96.5	Very high	94.5	Very high	92 Å²	92	63.9 Å²	63.9	47%	0.472	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.2	179.3	-61.6	176.5	0	0	0	109.1	L79 L80 R81 L95	I72-L79 HydrophobicContact CG2-CD1 3.72Å; I72-L79 HydrophobicContact CG2-CD2 3.81Å; I72-L79 HydrophobicContact CG2-CG 3.51Å; I72-L80 CarbonylContact C-O 3.58Å; I72-L80 WeakPolarHBondContact CA-O 3.48Å; I72-R81 HydrophobicContact CG1-CB 4.49Å; I72-R81 HydrophobicContact CG1-CG 4.36Å; I72-L95 HydrophobicContact CD1-CD1 4.2Å; I72-L95 HydrophobicContact CG1-CD1 4.37Å
73	Y	95	Very high	94.9	Very high	69 Å²	69	59.6 Å²	59.6	27%	0.271	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.8	173.1	174.3	-109.5	0	0	0	110.8	L61 L67 L80	L61-Y73 HydrophobicContact CD1-CD1 3.87Å; L61-Y73 HydrophobicContact CD1-CD2 3.32Å; L61-Y73 HydrophobicContact CD1-CE1 3.92Å; L61-Y73 HydrophobicContact CD1-CE2 3.38Å; L61-Y73 HydrophobicContact CD1-CG 3.56Å; L61-Y73 HydrophobicContact CD2-CD1 3.89Å; L61-Y73 HydrophobicContact CD2-CE1 4.18Å; L61-Y73 HydrophobicContact CD2-CG 4.18Å; L67-Y73 HydrophobicContact CD1-CG 4.35Å; Y73-L80 HydrophobicContact CD1-CD1 4.33Å; Y73-L80 PolarHBondContact N-O 2.98Å; Y73-L80 PolarHBondContact O-N 3.44Å
74	R	95.1	Very high	95.1	Very high	130 Å²	130	60.5 Å²	60.5	49%	0.491	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	102.9	179	-172	-176.5	178.8	131.2	4.5	109.2	L79 L98 G101	R74-L79 HydrophobicContact CB-CD1 4.28Å; R74-L79 HydrophobicContact CG-CD1 4.32Å; R74-L98 HydrophobicContact CG-CD1 3.48Å; R74-L98 VanDerWaalsContact CG-CD1 3.48Å; R74-G101 VanDerWaalsContact NH2-CA 3.35Å; R74-G101 PolarHBondContact NH2-O 3.26Å
75	S	93.1	Very high	95.1	Very high	29 Å²	29	61.7 Å²	61.7	20%	0.203	31%	0.31	C	S	.	.			trans	-81.9	-174.7	171.2	74.4	0	0	0	0	111.3	Y77 F78 L98	S75-Y77 VanDerWaalsContact C-N 3.31Å; S75-Y77 PolarHBondContact O-N 3.25Å; S75-Y77 PolarHBondContact OG-N 2.87Å; S75-F78 WeakPolarHBondContact CB-O 3.5Å; S75-F78 PolarHBondContact N-O 3.2Å; S75-F78 WeakPolarHBondContact OG-CA 3.46Å; S75-F78 PolarHBondContact OG-N 3.1Å; S75-F78 PolarHBondContact OG-O 3.32Å; S75-L98 VanDerWaalsContact O-CD1 3.29Å; S75-L98 WeakPolarHBondContact O-CD1 3.02Å
76	T	94.2	Very high	95.1	Very high	111 Å²	111	60 Å²	60	68%	0.681	30%	0.304	S	S	*	.	S	Bend	trans	-61.7	-37.5	174.7	-49.5	0	0	0	0	112.8
77	Y	96.4	Very high	94.9	Very high	73 Å²	73	60.4 Å²	60.4	29%	0.286	31%	0.306	S	S	.	.	S	Bend	trans	-125.1	-9.7	-170.2	-56.3	-67.4	0	0	0	114.7	Y32 S75 C97 L98 L128	Y32-Y77 HydrophobicContact CD1-CD1 4.34Å; Y32-Y77 AromaticContact CD1-CD2 3.78Å; Y32-Y77 HydrophobicContact CD1-CD2 3.78Å; Y32-Y77 HydrophobicContact CD1-CE1 4.02Å; Y32-Y77 AromaticContact CD1-CE2 3.43Å; Y32-Y77 HydrophobicContact CD1-CE2 3.43Å; Y32-Y77 VanDerWaalsContact CD1-CE2 3.43Å; Y32-Y77 HydrophobicContact CD1-CG 4.22Å; Y32-Y77 AromaticContact CD1-CZ 3.55Å; Y32-Y77 AromaticContact CD2-CD1 3.69Å; Y32-Y77 HydrophobicContact CD2-CD1 3.69Å; Y32-Y77 HydrophobicContact CD2-CD2 4.49Å; Y32-Y77 AromaticContact CD2-CE1 3.66Å; Y32-Y77 HydrophobicContact CD2-CE1 3.66Å; Y32-Y77 HydrophobicContact CD2-CE2 4.48Å; Y32-Y77 HydrophobicContact CD2-CG 4.11Å; Y32-Y77 HydrophobicContact CE1-CD2 4.38Å; Y32-Y77 AromaticContact CE1-CE1 3.86Å; Y32-Y77 HydrophobicContact CE1-CE1 3.86Å; Y32-Y77 AromaticContact CE1-CE2 3.61Å; Y32-Y77 HydrophobicContact CE1-CE2 3.61Å; Y32-Y77 AromaticContact CE1-CZ 3.29Å; Y32-Y77 VanDerWaalsContact CE1-OH 3.23Å; Y32-Y77 WeakPolarHBondContact CE1-OH 3.27Å; Y32-Y77 AromaticContact CE2-CD1 4Å; Y32-Y77 HydrophobicContact CE2-CD1 4Å; Y32-Y77 AromaticContact CE2-CE1 3.49Å; Y32-Y77 HydrophobicContact CE2-CE1 3.49Å; Y32-Y77 VanDerWaalsContact CE2-CE1 3.49Å; Y32-Y77 AromaticContact CE2-CZ 3.85Å; Y32-Y77 AromaticContact CG-CD1 3.87Å; Y32-Y77 HydrophobicContact CG-CD1 3.87Å; Y32-Y77 AromaticContact CG-CD2 3.83Å; Y32-Y77 HydrophobicContact CG-CD2 3.83Å; Y32-Y77 AromaticContact CG-CE1 3.92Å; Y32-Y77 HydrophobicContact CG-CE1 3.92Å; Y32-Y77 AromaticContact CG-CE2 3.9Å; Y32-Y77 HydrophobicContact CG-CE2 3.9Å; Y32-Y77 AromaticContact CG-CG 3.82Å; Y32-Y77 HydrophobicContact CG-CG 3.82Å; Y32-Y77 AromaticContact CG-CZ 3.93Å; Y32-Y77 AromaticContact CZ-CE1 3.59Å; Y32-Y77 AromaticContact CZ-CZ 3.46Å; Y32-Y77 VanDerWaalsContact CZ-CZ 3.46Å; Y32-Y77 VanDerWaalsContact CZ-OH 3.32Å; Y32-Y77 PolarHBondContact OH-OH 3.18Å; S75-Y77 VanDerWaalsContact C-N 3.31Å; S75-Y77 PolarHBondContact O-N 3.25Å; S75-Y77 PolarHBondContact OG-N 2.87Å; Y77-C97 CarbonylContact O-C 3.57Å; Y77-C97 WeakPolarHBondContact O-CA 3.38Å; Y77-L98 PolarHBondContact O-N 3.32Å; Y77-L128 HydrophobicContact CD1-CD2 4.22Å
78	F	96.7	Very high	94.6	Very high	9 Å²	9	63.6 Å²	63.6	4%	0.039	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	145.9	-173.5	-52.8	-73.3	0	0	0	112.5	Y32 Y34 S75 L80 K96 L98 I126 L128	Y32-F78 WeakPolarHBondContact O-CZ 3.41Å; Y34-F78 HydrophobicContact CG-CD2 4.48Å; S75-F78 WeakPolarHBondContact CB-O 3.5Å; S75-F78 PolarHBondContact N-O 3.2Å; S75-F78 WeakPolarHBondContact OG-CA 3.46Å; S75-F78 PolarHBondContact OG-N 3.1Å; S75-F78 PolarHBondContact OG-O 3.32Å; F78-L80 HydrophobicContact CB-CD2 3.9Å; F78-L80 HydrophobicContact CB-CG 4.34Å; F78-K96 WeakPolarHBondContact CA-O 3.43Å; F78-L98 WeakPolarHBondContact O-CD1 3.49Å; F78-I126 HydrophobicContact CD1-CG1 4.46Å; F78-I126 HydrophobicContact CD1-CG2 3.71Å; F78-I126 HydrophobicContact CE1-CG1 4.45Å; F78-I126 HydrophobicContact CE1-CG2 3.85Å; F78-I126 HydrophobicContact CG-CG2 4.35Å; F78-L128 HydrophobicContact CE1-CB 4.33Å
79	L	96.6	Very high	94.4	Very high	16 Å²	16	60.5 Å²	60.5	8%	0.084	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.7	167.1	-160.4	89	0	0	0	108.2	I72 R74 L95 K96	I72-L79 HydrophobicContact CG2-CD1 3.72Å; I72-L79 HydrophobicContact CG2-CD2 3.81Å; I72-L79 HydrophobicContact CG2-CG 3.51Å; R74-L79 HydrophobicContact CB-CD1 4.28Å; R74-L79 HydrophobicContact CG-CD1 4.32Å; L79-L95 HydrophobicContact CD2-CB 4.16Å; L79-L95 HydrophobicContact CD2-CD1 4.07Å; L79-L95 PolarHBondContact O-N 2.78Å; L79-K96 HydrophobicContact CB-CB 4.07Å; L79-K96 PolarHBondContact N-O 3.04Å
80	L	94.8	Very high	94.2	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.4	-175.2	-52.8	178.6	0	0	0	110	Y34 I72 Y73 F78 T93 P94	Y34-L80 HydrophobicContact CD1-CD2 3.75Å; Y34-L80 HydrophobicContact CD2-CD1 4.42Å; Y34-L80 HydrophobicContact CE1-CD1 4.01Å; Y34-L80 HydrophobicContact CE1-CD2 3.66Å; Y34-L80 HydrophobicContact CE1-CG 4.5Å; Y34-L80 HydrophobicContact CE2-CD1 3.9Å; Y34-L80 HydrophobicContact CG-CD2 4.34Å; I72-L80 CarbonylContact C-O 3.58Å; I72-L80 WeakPolarHBondContact CA-O 3.48Å; Y73-L80 HydrophobicContact CD1-CD1 4.33Å; Y73-L80 PolarHBondContact N-O 2.98Å; Y73-L80 PolarHBondContact O-N 3.44Å; F78-L80 HydrophobicContact CB-CD2 3.9Å; F78-L80 HydrophobicContact CB-CG 4.34Å; L80-T93 CarbonylContact C-O 3.57Å; L80-T93 WeakPolarHBondContact CA-O 3.29Å; L80-P94 HydrophobicContact CD2-CB 3.74Å
81	R	95.5	Very high	94.1	Very high	89 Å²	89	56.6 Å²	56.6	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.7	173	-171.6	177.9	67.1	-151.1	-9.2	110.5	I72 D83 L92 T93 L95	I72-R81 HydrophobicContact CG1-CB 4.49Å; I72-R81 HydrophobicContact CG1-CG 4.36Å; R81-D83 IonicContact CZ-OD1 3.54Å; R81-D83 IonicContact CZ-OD2 3.55Å; R81-D83 IonicContact NE-OD1 2.77Å; R81-D83 PolarHBondContact NE-OD1 2.03Å; R81-D83 IonicContact NE-OD2 3.29Å; R81-D83 PolarHBondContact NE-OD2 2.78Å; R81-D83 IonicContact NH2-OD1 3.51Å; R81-D83 IonicContact NH2-OD2 2.89Å; R81-D83 PolarHBondContact NH2-OD2 3.17Å; R81-D83 PolarHBondContact O-N 3.45Å; R81-L92 CarbonylContact O-C 3.53Å; R81-L92 WeakPolarHBondContact O-CA 3.41Å; R81-T93 PolarHBondContact N-O 2.84Å; R81-T93 PolarHBondContact O-N 2.89Å; R81-L95 HydrophobicContact CB-CD1 3.93Å; R81-L95 HydrophobicContact CB-CD2 4.37Å; R81-L95 HydrophobicContact CB-CG 4.16Å
82	C	95.5	Very high	93.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	114.1	173.2	179.8	0	0	0	0	110.7	C59 L67 F69 G70 Q71 L92	C59-C82 HydrophobicContact CB-CB 3.78Å; C59-C82 WeakPolarHBondContact CB-SG 3.33Å; C59-C82 PolarHBondContact N-SG 3.09Å; C59-C82 WeakPolarHBondContact SG-CA 3.27Å; C59-C82 WeakPolarHBondContact SG-CB 3.22Å; C59-C82 CovalentContact SG-SG 2.04Å; C59-C82 PolarHBondContact SG-SG 3.19Å; L67-C82 HydrophobicContact CB-CB 3.97Å; L67-C82 HydrophobicContact CD1-CB 4.44Å; F69-C82 WeakPolarHBondContact CA-O 3.24Å; G70-C82 PolarHBondContact N-O 3.34Å; Q71-C82 PolarHBondContact O-N 2.95Å; Q71-C82 VanDerWaalsContact O-N 3.12Å; C82-L92 HydrophobicContact CB-CD2 4.33Å
83	D	94.8	Very high	93.7	Very high	34 Å²	34	50.1 Å²	50.1	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.7	179.6	-68.8	-28.6	0	0	0	110.8	R81 V90 I91 T93	R81-D83 IonicContact CZ-OD1 3.54Å; R81-D83 IonicContact CZ-OD2 3.55Å; R81-D83 IonicContact NE-OD1 2.77Å; R81-D83 PolarHBondContact NE-OD1 2.03Å; R81-D83 IonicContact NE-OD2 3.29Å; R81-D83 PolarHBondContact NE-OD2 2.78Å; R81-D83 IonicContact NH2-OD1 3.51Å; R81-D83 IonicContact NH2-OD2 2.89Å; R81-D83 PolarHBondContact NH2-OD2 3.17Å; R81-D83 PolarHBondContact O-N 3.45Å; D83-V90 WeakPolarHBondContact O-CA 3.42Å; D83-I91 HydrophobicContact CB-CG2 3.93Å; D83-I91 PolarHBondContact N-O 2.76Å; D83-I91 PolarHBondContact O-N 2.83Å; D83-T93 WeakPolarHBondContact OD2-CB 3.07Å; D83-T93 PolarHBondContact OD2-OG1 3.05Å
84	K	94	Very high	93.6	Very high	94 Å²	94	47.2 Å²	47.2	41%	0.409	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.1	174.7	-172.2	176.6	178.4	177.2	0	109.3	F69 N86 D87	F69-K84 HydrophobicContact CD1-CB 3.88Å; F69-K84 HydrophobicContact CD2-CB 4.29Å; F69-K84 HydrophobicContact CD2-CD 4.43Å; F69-K84 HydrophobicContact CE1-CB 3.63Å; F69-K84 HydrophobicContact CE1-CG 4.16Å; F69-K84 HydrophobicContact CE2-CB 4.03Å; F69-K84 HydrophobicContact CE2-CD 3.76Å; F69-K84 HydrophobicContact CE2-CG 4.09Å; F69-K84 HydrophobicContact CG-CB 4.22Å; F69-K84 HydrophobicContact CZ-CB 3.71Å; F69-K84 HydrophobicContact CZ-CD 3.93Å; F69-K84 HydrophobicContact CZ-CG 3.76Å; K84-N86 VanDerWaalsContact CE-C 3.44Å; K84-N86 WeakPolarHBondContact CE-O 3.19Å; K84-N86 VanDerWaalsContact CG-O 3.29Å; K84-N86 WeakPolarHBondContact CG-O 3.49Å; K84-D87 VanDerWaalsContact CE-OD1 3.3Å; K84-D87 WeakPolarHBondContact CE-OD1 3.35Å; K84-D87 IonicContact NZ-OD1 2.7Å; K84-D87 PolarHBondContact NZ-OD1 2.82Å
85	I	91.3	Very high	93.6	Very high	74 Å²	74	43.1 Å²	43.1	38%	0.379	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-52.3	170.7	-65.5	172.2	0	0	0	109.4	I39 A89 I91	I39-I85 HydrophobicContact CB-CD1 4.38Å; I39-I85 HydrophobicContact CD1-CD1 4.43Å; I39-I85 HydrophobicContact CG1-CD1 3.93Å; I39-I85 HydrophobicContact CG2-CD1 3.98Å; I85-A89 HydrophobicContact CB-CB 4.32Å; I85-A89 WeakPolarHBondContact CB-O 2.95Å; I85-A89 PolarHBondContact N-O 2.93Å; I85-I91 HydrophobicContact CD1-CB 3.69Å; I85-I91 HydrophobicContact CD1-CD1 4.36Å; I85-I91 HydrophobicContact CD1-CG2 3.93Å; I85-I91 HydrophobicContact CG1-CB 4.05Å; I85-I91 HydrophobicContact CG1-CG2 3.73Å
86	N	91.7	Very high	93.8	Very high	72 Å²	72	43.8 Å²	43.8	39%	0.385	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	-172.8	177.3	64.4	48.3	0	0	0	109.5	K84 T88 A89	K84-N86 VanDerWaalsContact CE-C 3.44Å; K84-N86 WeakPolarHBondContact CE-O 3.19Å; K84-N86 VanDerWaalsContact CG-O 3.29Å; K84-N86 WeakPolarHBondContact CG-O 3.49Å; N86-T88 PolarHBondContact O-N 2.7Å; N86-T88 VanDerWaalsContact O-N 3.1Å; N86-T88 WeakPolarHBondContact OD1-CA 3.01Å; N86-T88 PolarHBondContact OD1-N 2.85Å; N86-T88 PolarHBondContact OD1-OG1 2.88Å; N86-A89 PolarHBondContact N-O 3.36Å; N86-A89 PolarHBondContact O-N 2.98Å; N86-A89 WeakPolarHBondContact OD1-CB 3.5Å; N86-A89 PolarHBondContact OD1-N 3.07Å
87	D	90.8	Very high	94	Very high	95 Å²	95	38.5 Å²	38.5	51%	0.508	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.2	-176.4	-65.4	-33.8	0	0	0	114.9	A56 K84	A56-D87 WeakPolarHBondContact CB-O 3.36Å; A56-D87 PolarHBondContact N-O 3.48Å; K84-D87 VanDerWaalsContact CE-OD1 3.3Å; K84-D87 WeakPolarHBondContact CE-OD1 3.35Å; K84-D87 IonicContact NZ-OD1 2.7Å; K84-D87 PolarHBondContact NZ-OD1 2.82Å
88	T	89.5	Confident	94.1	Very high	73 Å²	73	35.1 Å²	35.1	45%	0.448	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-7.2	-175.7	60.1	0	0	0	0	114.3	W46 N86	W46-T88 HydrophobicContact CH2-CG2 4.26Å; N86-T88 PolarHBondContact O-N 2.7Å; N86-T88 VanDerWaalsContact O-N 3.1Å; N86-T88 WeakPolarHBondContact OD1-CA 3.01Å; N86-T88 PolarHBondContact OD1-N 2.85Å; N86-T88 PolarHBondContact OD1-OG1 2.88Å
89	A	91.4	Very high	94.1	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.025	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	138	-168.8	0	0	0	0	0	111.9	I39 I85 N86	I39-A89 HydrophobicContact CG2-CB 3.58Å; I85-A89 HydrophobicContact CB-CB 4.32Å; I85-A89 WeakPolarHBondContact CB-O 2.95Å; I85-A89 PolarHBondContact N-O 2.93Å; N86-A89 PolarHBondContact N-O 3.36Å; N86-A89 PolarHBondContact O-N 2.98Å; N86-A89 WeakPolarHBondContact OD1-CB 3.5Å; N86-A89 PolarHBondContact OD1-N 3.07Å
90	V	93.4	Very high	93.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	164.1	-179	-50.8	0	0	0	0	110.5	Q40 V44 A56 C59 F69 D83	Q40-V90 HydrophobicContact CB-CG2 4.46Å; Q40-V90 PolarHBondContact N-O 3.47Å; Q40-V90 PolarHBondContact O-N 2.81Å; V44-V90 HydrophobicContact CB-CG2 4.48Å; V44-V90 HydrophobicContact CG1-CG1 4Å; V44-V90 HydrophobicContact CG2-CB 4.49Å; V44-V90 HydrophobicContact CG2-CG1 4.14Å; V44-V90 HydrophobicContact CG2-CG2 3.8Å; A56-V90 HydrophobicContact CB-CG1 3.83Å; C59-V90 HydrophobicContact CB-CG2 4.28Å; F69-V90 HydrophobicContact CE1-CB 4.35Å; F69-V90 HydrophobicContact CE1-CG1 3.62Å; F69-V90 HydrophobicContact CZ-CG1 3.95Å; D83-V90 WeakPolarHBondContact O-CA 3.42Å
91	I	92.5	Very high	93.8	Very high	32 Å²	32	43.4 Å²	43.4	16%	0.164	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	143	175.4	-168.7	165.9	0	0	0	110.2	Y36 D83 I85	Y36-I91 HydrophobicContact CD2-CD1 4.28Å; Y36-I91 WeakPolarHBondContact O-CD1 3.29Å; D83-I91 HydrophobicContact CB-CG2 3.93Å; D83-I91 PolarHBondContact N-O 2.76Å; D83-I91 PolarHBondContact O-N 2.83Å; I85-I91 HydrophobicContact CD1-CB 3.69Å; I85-I91 HydrophobicContact CD1-CD1 4.36Å; I85-I91 HydrophobicContact CD1-CG2 3.93Å; I85-I91 HydrophobicContact CG1-CB 4.05Å; I85-I91 HydrophobicContact CG1-CG2 3.73Å
92	L	92.3	Very high	93.8	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	95.6	167.6	-73.4	171.5	0	0	0	107.7	Y34 C59 L61 L67 R81 C82 P94	Y34-L92 HydrophobicContact CE1-CB 4.46Å; Y34-L92 WeakPolarHBondContact OH-CB 3.48Å; Y34-L92 WeakPolarHBondContact OH-CD1 2.98Å; C59-L92 HydrophobicContact CB-CD2 3.89Å; C59-L92 HydrophobicContact CB-CG 4.37Å; L61-L92 HydrophobicContact CD2-CD1 3.87Å; L61-L92 HydrophobicContact CD2-CD2 4.3Å; L67-L92 HydrophobicContact CD1-CD2 3.99Å; R81-L92 CarbonylContact O-C 3.53Å; R81-L92 WeakPolarHBondContact O-CA 3.41Å; C82-L92 HydrophobicContact CB-CD2 4.33Å; L92-P94 WeakPolarHBondContact O-CD 3.42Å
93	T	92.5	Very high	93.9	Very high	36 Å²	36	47 Å²	47	22%	0.221	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	118.8	179.4	-54.7	0	0	0	0	109.1	L80 R81 D83 L95	L80-T93 CarbonylContact C-O 3.57Å; L80-T93 WeakPolarHBondContact CA-O 3.29Å; R81-T93 PolarHBondContact N-O 2.84Å; R81-T93 PolarHBondContact O-N 2.89Å; D83-T93 WeakPolarHBondContact OD2-CB 3.07Å; D83-T93 PolarHBondContact OD2-OG1 3.05Å; T93-L95 HydrophobicContact CG2-CD2 4.49Å
94	P	93.2	Very high	94.1	Very high	7 Å²	7	45.4 Å²	45.4	5%	0.045	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138	172.3	30.7	-33.5	0	0	0	110.7	Y34 Y36 L80 L92 I126	Y34-P94 HydrophobicContact CD1-CB 4.47Å; Y36-P94 HydrophobicContact CD1-CG 3.42Å; Y36-P94 VanDerWaalsContact CD1-CG 3.42Å; Y36-P94 HydrophobicContact CD2-CG 4.25Å; Y36-P94 HydrophobicContact CE1-CG 3.26Å; Y36-P94 HydrophobicContact CE2-CG 4.11Å; Y36-P94 HydrophobicContact CG-CG 3.94Å; L80-P94 HydrophobicContact CD2-CB 3.74Å; L92-P94 WeakPolarHBondContact O-CD 3.42Å; P94-I126 HydrophobicContact CB-CB 3.95Å; P94-I126 HydrophobicContact CB-CD1 3.81Å; P94-I126 HydrophobicContact CB-CG1 4.48Å; P94-I126 HydrophobicContact CB-CG2 3.41Å; P94-I126 VanDerWaalsContact CB-CG2 3.41Å; P94-I126 HydrophobicContact CG-CB 3.92Å; P94-I126 HydrophobicContact CG-CD1 4.38Å; P94-I126 HydrophobicContact CG-CG2 3.72Å
95	L	95.2	Very high	94.3	Very high	44 Å²	44	45.5 Å²	45.5	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	-46.5	179.6	-60.7	-176	0	0	0	111.5	I72 L79 R81 T93	I72-L95 HydrophobicContact CD1-CD1 4.2Å; I72-L95 HydrophobicContact CG1-CD1 4.37Å; L79-L95 HydrophobicContact CD2-CB 4.16Å; L79-L95 HydrophobicContact CD2-CD1 4.07Å; L79-L95 PolarHBondContact O-N 2.78Å; R81-L95 HydrophobicContact CB-CD1 3.93Å; R81-L95 HydrophobicContact CB-CD2 4.37Å; R81-L95 HydrophobicContact CB-CG 4.16Å; T93-L95 HydrophobicContact CG2-CD2 4.49Å
96	K	97.9	Very high	94.5	Very high	44 Å²	44	45.5 Å²	45.5	19%	0.191	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	160.1	-171.4	-60.7	-170.2	-167.5	-171.6	0	111.4	F78 L79 E103 L104 E105	F78-K96 WeakPolarHBondContact CA-O 3.43Å; L79-K96 HydrophobicContact CB-CB 4.07Å; L79-K96 PolarHBondContact N-O 3.04Å; K96-E103 HydrophobicContact CD-CB 3.95Å; K96-E103 WeakPolarHBondContact CD-OE2 3.49Å; K96-E103 IonicContact NZ-OE2 2.95Å; K96-E103 PolarHBondContact NZ-OE2 3Å; K96-L104 WeakPolarHBondContact CB-O 3.33Å; K96-E105 WeakPolarHBondContact CE-OE1 3.21Å; K96-E105 WeakPolarHBondContact CE-OE2 3.46Å; K96-E105 IonicContact NZ-OE1 2.69Å; K96-E105 PolarHBondContact NZ-OE1 3.39Å
97	C	98.2	Very high	94.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	157.7	166	-53.7	0	0	0	0	110.9	Y77 E103 L104 C119 L128	Y77-C97 CarbonylContact O-C 3.57Å; Y77-C97 WeakPolarHBondContact O-CA 3.38Å; C97-E103 WeakPolarHBondContact O-CA 3.45Å; C97-L104 HydrophobicContact CB-CB 4.32Å; C97-L104 PolarHBondContact N-O 3.36Å; C97-L104 VanDerWaalsContact N-O 3.08Å; C97-L104 PolarHBondContact O-N 2.78Å; C97-C119 HydrophobicContact CB-CB 3.61Å; C97-C119 WeakPolarHBondContact CB-SG 3.44Å; C97-C119 PolarHBondContact N-SG 2.85Å; C97-C119 WeakPolarHBondContact SG-CA 3.48Å; C97-C119 WeakPolarHBondContact SG-CB 3.31Å; C97-C119 CovalentContact SG-SG 2.04Å; C97-C119 PolarHBondContact SG-SG 3.18Å; C97-L128 HydrophobicContact CB-CB 4.27Å; C97-L128 HydrophobicContact CB-CD1 3.87Å
98	L	97.5	Very high	95.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.7	179.4	-60.1	171.1	0	0	0	109.5	R74 S75 Y77 F78 K102 E103 L128	R74-L98 HydrophobicContact CG-CD1 3.48Å; R74-L98 VanDerWaalsContact CG-CD1 3.48Å; S75-L98 VanDerWaalsContact O-CD1 3.29Å; S75-L98 WeakPolarHBondContact O-CD1 3.02Å; Y77-L98 PolarHBondContact O-N 3.32Å; F78-L98 WeakPolarHBondContact O-CD1 3.49Å; L98-K102 WeakPolarHBondContact CA-O 3.34Å; L98-E103 HydrophobicContact CD2-CB 4.31Å; L98-E103 HydrophobicContact CD2-CG 3.68Å; L98-L128 WeakPolarHBondContact O-CD2 3.29Å
99	L	96.7	Very high	95.4	Very high	15 Å²	15	44.8 Å²	44.8	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	117.8	174	-177.5	60	0	0	0	110.2	G101 K102 L104 L110 Y117 L128	L99-G101 PolarHBondContact O-N 3.16Å; L99-G101 VanDerWaalsContact O-N 3.13Å; L99-K102 PolarHBondContact N-O 2.76Å; L99-K102 PolarHBondContact O-N 2.83Å; L99-L104 HydrophobicContact CB-CD1 4.33Å; L99-L110 HydrophobicContact CB-CD2 4.23Å; L99-L110 HydrophobicContact CD2-CB 4.46Å; L99-L110 HydrophobicContact CD2-CD2 4.05Å; L99-L110 HydrophobicContact CD2-CG 4.42Å; L99-L110 HydrophobicContact CG-CD2 4.35Å; L99-Y117 HydrophobicContact CD1-CE2 4.49Å; L99-Y117 HydrophobicContact CD2-CD1 4.38Å; L99-Y117 HydrophobicContact CD2-CD2 3.34Å; L99-Y117 HydrophobicContact CD2-CE2 3.97Å; L99-Y117 HydrophobicContact CD2-CG 3.57Å; L99-L128 HydrophobicContact CB-CD1 4.49Å; L99-L128 HydrophobicContact CB-CD2 4.15Å; L99-L128 HydrophobicContact CD1-CD2 4.16Å
100	K	93.7	Very high	95.7	Very high	140 Å²	140	46.5 Å²	46.5	61%	0.609	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.9	40.6	-178.4	-63.8	-177.5	178.5	167.7	0	113.2	K102 S112 D113	K100-K102 VanDerWaalsContact C-N 3.34Å; K100-K102 PolarHBondContact O-N 3.14Å; K100-S112 WeakPolarHBondContact CD-OG 3.24Å; K100-S112 WeakPolarHBondContact CE-OG 3.35Å; K100-S112 PolarHBondContact NZ-OG 3.05Å; K100-D113 IonicContact NZ-OD1 3.84Å; K100-D113 PolarHBondContact NZ-OD1 3.25Å; K100-D113 IonicContact NZ-OD2 3.59Å; K100-D113 PolarHBondContact NZ-OD2 2.84Å
101	G	92.4	Very high	95.8	Very high	50 Å²	50	51.1 Å²	51.1	52%	0.515	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	-16.7	178.8	0	0	0	0	0	115.5	R74 L99	R74-G101 VanDerWaalsContact NH2-CA 3.35Å; R74-G101 PolarHBondContact NH2-O 3.26Å; L99-G101 PolarHBondContact O-N 3.16Å; L99-G101 VanDerWaalsContact O-N 3.13Å
102	K	96.6	Very high	95.9	Very high	93 Å²	93	50.3 Å²	50.3	40%	0.404	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.1	177.4	-179.2	173.4	170.7	-156.2	0	111	L98 L99 K100 L104 E108 L110	L98-K102 WeakPolarHBondContact CA-O 3.34Å; L99-K102 PolarHBondContact N-O 2.76Å; L99-K102 PolarHBondContact O-N 2.83Å; K100-K102 VanDerWaalsContact C-N 3.34Å; K100-K102 PolarHBondContact O-N 3.14Å; K102-L104 HydrophobicContact CD-CD2 4.49Å; K102-E108 IonicContact NZ-OE1 2.87Å; K102-E108 PolarHBondContact NZ-OE1 3.34Å; K102-L110 HydrophobicContact CB-CD2 4.21Å; K102-L110 HydrophobicContact CD-CD1 4.1Å; K102-L110 HydrophobicContact CD-CD2 3.84Å; K102-L110 HydrophobicContact CG-CD2 4.32Å
103	E	97.3	Very high	96	Very high	72 Å²	72	55.1 Å²	55.1	34%	0.336	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	139.8	171.3	-56.1	-173.8	-179.9	0	0	110.7	K96 C97 L98	K96-E103 HydrophobicContact CD-CB 3.95Å; K96-E103 WeakPolarHBondContact CD-OE2 3.49Å; K96-E103 IonicContact NZ-OE2 2.95Å; K96-E103 PolarHBondContact NZ-OE2 3Å; C97-E103 WeakPolarHBondContact O-CA 3.45Å; L98-E103 HydrophobicContact CD2-CB 4.31Å; L98-E103 HydrophobicContact CD2-CG 3.68Å
104	L	98.1	Very high	96.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.9	176.4	-61.4	172.8	0	0	0	109.2	K96 C97 L99 K102 E108 L110 C119 L128	K96-L104 WeakPolarHBondContact CB-O 3.33Å; C97-L104 HydrophobicContact CB-CB 4.32Å; C97-L104 PolarHBondContact N-O 3.36Å; C97-L104 VanDerWaalsContact N-O 3.08Å; C97-L104 PolarHBondContact O-N 2.78Å; L99-L104 HydrophobicContact CB-CD1 4.33Å; K102-L104 HydrophobicContact CD-CD2 4.49Å; L104-E108 WeakPolarHBondContact CA-OE2 3.42Å; L104-E108 HydrophobicContact CB-CB 4.31Å; L104-E108 HydrophobicContact CD2-CB 4.4Å; L104-E108 HydrophobicContact CD2-CG 3.96Å; L104-E108 WeakPolarHBondContact CD2-OE1 3.23Å; L104-L110 HydrophobicContact CD1-CB 3.88Å; L104-L110 HydrophobicContact CD1-CD2 4.49Å; L104-L110 HydrophobicContact CD2-CB 3.72Å; L104-L110 HydrophobicContact CD2-CD2 4.2Å; L104-L110 HydrophobicContact CD2-CG 4.48Å; L104-L110 HydrophobicContact CG-CB 4.43Å; L104-C119 HydrophobicContact CB-CB 4.06Å; L104-L128 HydrophobicContact CD1-CD1 3.9Å
105	E	98	Very high	96.4	Very high	95 Å²	95	56.8 Å²	56.8	44%	0.444	29%	0.294	S	S	.	.			trans	-64.7	155.1	169.6	-59.1	-58.3	157.4	0	0	110.2	K96 G107 E108 C119	K96-E105 WeakPolarHBondContact CE-OE1 3.21Å; K96-E105 WeakPolarHBondContact CE-OE2 3.46Å; K96-E105 IonicContact NZ-OE1 2.69Å; K96-E105 PolarHBondContact NZ-OE1 3.39Å; E105-G107 PolarHBondContact O-N 2.81Å; E105-E108 HydrophobicContact CB-CB 4.37Å; E105-E108 PolarHBondContact N-OE2 3.1Å; E105-E108 VanDerWaalsContact N-OE2 3.12Å; E105-E108 WeakPolarHBondContact O-CB 3.02Å; E105-E108 PolarHBondContact O-N 2.91Å; E105-C119 WeakPolarHBondContact O-CB 3.48Å
106	I	96	Very high	96.5	Very high	75 Å²	75	54.8 Å²	54.8	39%	0.385	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	126	174.1	-62.8	162.7	0	0	0	108.7	E121 I126	I106-E121 HydrophobicContact CD1-CB 4.34Å; I106-E121 WeakPolarHBondContact CD1-OE2 3.49Å; I106-E121 HydrophobicContact CG2-CB 3.94Å; I106-I126 HydrophobicContact CD1-CD1 4.47Å; I106-I126 HydrophobicContact CG1-CD1 4.2Å
107	G	96.4	Very high	96.5	Very high	48 Å²	48	53.4 Å²	53.4	50%	0.495	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	-15	-172.3	0	0	0	0	0	114.7	E105 C119	E105-G107 PolarHBondContact O-N 2.81Å; G107-C119 WeakPolarHBondContact CA-O 3.46Å; G107-C119 PolarHBondContact N-O 2.87Å
108	E	97.9	Very high	96.5	Very high	62 Å²	62	53.6 Å²	53.6	29%	0.29	28%	0.278	S	S	.	.			trans	-72.1	145.9	176.8	-166.1	-175.2	161.5	0	0	111	K102 L104 E105 T118 C119	K102-E108 IonicContact NZ-OE1 2.87Å; K102-E108 PolarHBondContact NZ-OE1 3.34Å; L104-E108 WeakPolarHBondContact CA-OE2 3.42Å; L104-E108 HydrophobicContact CB-CB 4.31Å; L104-E108 HydrophobicContact CD2-CB 4.4Å; L104-E108 HydrophobicContact CD2-CG 3.96Å; L104-E108 WeakPolarHBondContact CD2-OE1 3.23Å; E105-E108 HydrophobicContact CB-CB 4.37Å; E105-E108 PolarHBondContact N-OE2 3.1Å; E105-E108 VanDerWaalsContact N-OE2 3.12Å; E105-E108 WeakPolarHBondContact O-CB 3.02Å; E105-E108 PolarHBondContact O-N 2.91Å; E108-T118 WeakPolarHBondContact O-CA 3.2Å; E108-C119 PolarHBondContact O-N 3.33Å
109	Q	96.9	Very high	96.5	Very high	114 Å²	114	53.5 Å²	53.5	53%	0.533	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144.8	176.3	-52.1	-169.1	7.1	0	0	111.1	V116 Y117 T118	Q109-V116 HydrophobicContact CB-CG1 4.17Å; Q109-Y117 CarbonylContact C-O 3.52Å; Q109-Y117 VanDerWaalsContact CA-O 3.24Å; Q109-Y117 WeakPolarHBondContact CA-O 3.4Å; Q109-T118 HydrophobicContact CG-CG2 3.83Å; Q109-T118 WeakPolarHBondContact CG-OG1 3.44Å
110	L	96.9	Very high	96.6	Very high	39 Å²	39	55 Å²	55	20%	0.204	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.3	172.6	-174.1	62.1	0	0	0	110.4	L99 K102 L104 Y117	L99-L110 HydrophobicContact CB-CD2 4.23Å; L99-L110 HydrophobicContact CD2-CB 4.46Å; L99-L110 HydrophobicContact CD2-CD2 4.05Å; L99-L110 HydrophobicContact CD2-CG 4.42Å; L99-L110 HydrophobicContact CG-CD2 4.35Å; K102-L110 HydrophobicContact CB-CD2 4.21Å; K102-L110 HydrophobicContact CD-CD1 4.1Å; K102-L110 HydrophobicContact CD-CD2 3.84Å; K102-L110 HydrophobicContact CG-CD2 4.32Å; L104-L110 HydrophobicContact CD1-CB 3.88Å; L104-L110 HydrophobicContact CD1-CD2 4.49Å; L104-L110 HydrophobicContact CD2-CB 3.72Å; L104-L110 HydrophobicContact CD2-CD2 4.2Å; L104-L110 HydrophobicContact CD2-CG 4.48Å; L104-L110 HydrophobicContact CG-CB 4.43Å; L110-Y117 PolarHBondContact N-O 3.45Å; L110-Y117 PolarHBondContact O-N 3.33Å
111	Q	95.9	Very high	96.6	Very high	97 Å²	97	52.9 Å²	52.9	45%	0.453	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	126.8	166.3	178.2	178.3	-34.6	0	0	109.6	V134	Q111-V134 HydrophobicContact CG-CG1 4.34Å; Q111-V134 HydrophobicContact CG-CG2 3.78Å
112	S	95.2	Very high	96.5	Very high	15 Å²	15	55.5 Å²	55.5	11%	0.105	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	122.1	173	-157	0	0	0	0	110.8	K100 W114 F115	K100-S112 WeakPolarHBondContact CD-OG 3.24Å; K100-S112 WeakPolarHBondContact CE-OG 3.35Å; K100-S112 PolarHBondContact NZ-OG 3.05Å; S112-W114 PolarHBondContact O-N 2.88Å; S112-F115 PolarHBondContact N-O 3.16Å; S112-F115 PolarHBondContact O-N 2.05Å; S112-F115 VanDerWaalsContact O-N 3.1Å
113	D	92.9	Very high	96.1	Very high	109 Å²	109	63 Å²	63	58%	0.583	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	-104.6	-173.4	-49	-37.9	0	0	0	111.8	K100	K100-D113 IonicContact NZ-OD1 3.84Å; K100-D113 PolarHBondContact NZ-OD1 3.25Å; K100-D113 IonicContact NZ-OD2 3.59Å; K100-D113 PolarHBondContact NZ-OD2 2.84Å
114	W	96	Very high	95.6	Very high	71 Å²	71	60.4 Å²	60.4	27%	0.269	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	4.4	-173.1	-59.7	99.8	0	0	0	113.1	K27 S112 V134 D136 R149 H165	K27-W114 HydrophobicContact CB-CB 4.3Å; K27-W114 HydrophobicContact CB-CG 4.25Å; K27-W114 HydrophobicContact CD-CG 4.36Å; K27-W114 HydrophobicContact CG-CB 4.42Å; K27-W114 HydrophobicContact CG-CD2 4.19Å; K27-W114 HydrophobicContact CG-CG 3.86Å; S112-W114 PolarHBondContact O-N 2.88Å; W114-V134 PolarHBondContact O-N 3.26Å; W114-D136 WeakPolarHBondContact CH2-OD1 3.07Å; W114-D136 WeakPolarHBondContact CZ3-OD1 3.18Å; W114-R149 VanDerWaalsContact CZ3-NE 3.34Å; W114-H165 PolarHBondContact O-CE1 2.81Å; W114-H165 PolarHBondContact O-NE2 2.65Å
115	F	98.1	Very high	95.4	Very high	8 Å²	8	63.9 Å²	63.9	4%	0.035	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	153.1	-170.7	-59.7	-80.2	0	0	0	111.7	K27 S29 S112 Y117 I130 G132 V163 H165	K27-F115 HydrophobicContact CB-CE2 4.34Å; K27-F115 HydrophobicContact CB-CZ 4.18Å; S29-F115 VanDerWaalsContact CB-CE2 3.43Å; S112-F115 PolarHBondContact N-O 3.16Å; S112-F115 PolarHBondContact O-N 2.05Å; S112-F115 VanDerWaalsContact O-N 3.1Å; F115-Y117 HydrophobicContact CB-CD2 4.39Å; F115-Y117 HydrophobicContact CB-CE2 3.81Å; F115-I130 HydrophobicContact CB-CG2 3.98Å; F115-I130 HydrophobicContact CD1-CD1 4.49Å; F115-I130 HydrophobicContact CD1-CG2 3.83Å; F115-I130 HydrophobicContact CG-CG2 4.28Å; F115-G132 WeakPolarHBondContact CA-O 3.04Å; F115-V163 HydrophobicContact CD1-CB 4.29Å; F115-V163 HydrophobicContact CD1-CG1 4.1Å; F115-V163 HydrophobicContact CE1-CB 4.13Å; F115-V163 HydrophobicContact CE1-CG1 3.94Å; F115-V163 WeakPolarHBondContact CE1-O 3.49Å; F115-H165 AromaticContact CE1-CD2 3.53Å; F115-H165 AromaticContact CE1-NE2 3.58Å; F115-H165 AromaticContact CZ-CD2 3.76Å; F115-H165 AromaticContact CZ-NE2 3.88Å
116	V	98.1	Very high	95.2	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.4	169.1	-176.6	0	0	0	0	108.2	Q109 I130 T131 G132 V134 I140	Q109-V116 HydrophobicContact CB-CG1 4.17Å; V116-I130 CarbonylContact O-C 3.56Å; V116-I130 VanDerWaalsContact O-CA 3.32Å; V116-I130 WeakPolarHBondContact O-CA 3.14Å; V116-T131 PolarHBondContact O-N 2.86Å; V116-G132 PolarHBondContact N-O 3.45Å; V116-V134 HydrophobicContact CG2-CG2 3.62Å; V116-I140 HydrophobicContact CG2-CB 4.36Å; V116-I140 HydrophobicContact CG2-CD1 3.91Å; V116-I140 HydrophobicContact CG2-CG1 3.84Å; V116-I140 HydrophobicContact CG2-CG2 3.63Å
117	Y	98.3	Very high	95.3	Very high	14 Å²	14	55.8 Å²	55.8	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	141.3	173.7	-64.8	-97.7	0	0	0	109.4	S29 L99 Q109 L110 F115 L128 E129 I130	S29-Y117 WeakPolarHBondContact CB-OH 3.25Å; S29-Y117 PolarHBondContact OG-OH 2.95Å; L99-Y117 HydrophobicContact CD1-CE2 4.49Å; L99-Y117 HydrophobicContact CD2-CD1 4.38Å; L99-Y117 HydrophobicContact CD2-CD2 3.34Å; L99-Y117 HydrophobicContact CD2-CE2 3.97Å; L99-Y117 HydrophobicContact CD2-CG 3.57Å; Q109-Y117 CarbonylContact C-O 3.52Å; Q109-Y117 VanDerWaalsContact CA-O 3.24Å; Q109-Y117 WeakPolarHBondContact CA-O 3.4Å; L110-Y117 PolarHBondContact N-O 3.45Å; L110-Y117 PolarHBondContact O-N 3.33Å; F115-Y117 HydrophobicContact CB-CD2 4.39Å; F115-Y117 HydrophobicContact CB-CE2 3.81Å; Y117-L128 HydrophobicContact CD1-CD1 4.35Å; Y117-L128 HydrophobicContact CD1-CD2 4.44Å; Y117-L128 HydrophobicContact CD1-CG 3.94Å; Y117-L128 HydrophobicContact CG-CD1 4.44Å; Y117-L128 HydrophobicContact CG-CG 4.49Å; Y117-E129 CarbonylContact C-O 3.54Å; Y117-E129 WeakPolarHBondContact CA-O 3.49Å; Y117-I130 HydrophobicContact CD1-CG1 3.67Å; Y117-I130 HydrophobicContact CE1-CD1 3.91Å; Y117-I130 HydrophobicContact CE1-CG1 3.37Å; Y117-I130 HydrophobicContact CG-CG1 4.43Å
118	T	98.1	Very high	95.3	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.1	175.4	-53.7	0	0	0	0	108.7	E108 Q109 L120 E129 T131	E108-T118 WeakPolarHBondContact O-CA 3.2Å; Q109-T118 HydrophobicContact CG-CG2 3.83Å; Q109-T118 WeakPolarHBondContact CG-OG1 3.44Å; T118-L120 HydrophobicContact CG2-CD1 4.41Å; T118-L120 HydrophobicContact CG2-CD2 3.54Å; T118-L120 HydrophobicContact CG2-CG 3.75Å; T118-L120 PolarHBondContact O-N 2.81Å; T118-E129 PolarHBondContact N-O 3.42Å; T118-E129 PolarHBondContact O-N 2.62Å; T118-T131 HydrophobicContact CG2-CG2 4.5Å; T118-T131 VanDerWaalsContact OG1-CG2 3.24Å; T118-T131 WeakPolarHBondContact OG1-CG2 3.49Å; T118-T131 PolarHBondContact OG1-OG1 2.97Å
119	C	98.3	Very high	95.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	113.5	171.3	-167.2	0	0	0	0	108.9	C97 L104 E105 G107 E108 G127	C97-C119 HydrophobicContact CB-CB 3.61Å; C97-C119 WeakPolarHBondContact CB-SG 3.44Å; C97-C119 PolarHBondContact N-SG 2.85Å; C97-C119 WeakPolarHBondContact SG-CA 3.48Å; C97-C119 WeakPolarHBondContact SG-CB 3.31Å; C97-C119 CovalentContact SG-SG 2.04Å; C97-C119 PolarHBondContact SG-SG 3.18Å; L104-C119 HydrophobicContact CB-CB 4.06Å; E105-C119 WeakPolarHBondContact O-CB 3.48Å; G107-C119 WeakPolarHBondContact CA-O 3.46Å; G107-C119 PolarHBondContact N-O 2.87Å; E108-C119 PolarHBondContact O-N 3.33Å; C119-G127 CarbonylContact C-O 3.54Å; C119-G127 WeakPolarHBondContact CA-O 3.45Å
120	L	97.2	Very high	95.4	Very high	45 Å²	45	47.2 Å²	47.2	24%	0.236	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.5	-175.9	-65.8	178.1	0	0	0	110.5	T118 I126 G127 E129 T131	T118-L120 HydrophobicContact CG2-CD1 4.41Å; T118-L120 HydrophobicContact CG2-CD2 3.54Å; T118-L120 HydrophobicContact CG2-CG 3.75Å; T118-L120 PolarHBondContact O-N 2.81Å; L120-I126 CarbonylContact O-C 3.44Å; L120-I126 WeakPolarHBondContact O-CA 3.29Å; L120-G127 PolarHBondContact N-O 3.1Å; L120-G127 PolarHBondContact O-N 2.8Å; L120-E129 HydrophobicContact CD1-CB 4.14Å; L120-E129 HydrophobicContact CD1-CG 4.38Å; L120-E129 WeakPolarHBondContact CD1-OE2 3.42Å; L120-T131 HydrophobicContact CD1-CG2 4.34Å
121	E	94.3	Very high	95.4	Very high	97 Å²	97	47.5 Å²	47.5	45%	0.453	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.9	172.2	-169	-174.5	179.9	0	0	109.3	Y36 I106 R125	Y36-E121 WeakPolarHBondContact OH-CG 3.27Å; Y36-E121 PolarHBondContact OH-OE1 2.57Å; I106-E121 HydrophobicContact CD1-CB 4.34Å; I106-E121 WeakPolarHBondContact CD1-OE2 3.49Å; I106-E121 HydrophobicContact CG2-CB 3.94Å; E121-R125 CarbonylContact C-O 3.6Å; E121-R125 WeakPolarHBondContact CA-O 3.37Å
122	Q	90.5	Very high	95.5	Very high	104 Å²	104	42.9 Å²	42.9	49%	0.486	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	125.8	178.6	-63	-174.1	9.2	0	0	111.1	G124 R125	Q122-G124 PolarHBondContact O-N 3.09Å; Q122-R125 PolarHBondContact N-O 2.88Å; Q122-R125 WeakPolarHBondContact O-CB 3.37Å; Q122-R125 PolarHBondContact O-N 3.08Å
123	R	87.5	Confident	95.6	Very high	250 Å²	250	42.2 Å²	42.2	94%	0.943	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	44.4	168.8	-58.1	-178.5	178.7	176.2	-0.2	114.5	R125	R123-R125 VanDerWaalsContact C-N 3.33Å
124	G	88	Confident	95.8	Very high	18 Å²	18	37.1 Å²	37.1	19%	0.186	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	26.9	-180	0	0	0	0	0	113.7	Y36 S37 Q122	Y36-G124 VanDerWaalsContact CD1-O 3.27Å; Y36-G124 WeakPolarHBondContact CD1-O 3.46Å; Y36-G124 VanDerWaalsContact CE1-O 3.32Å; Y36-G124 WeakPolarHBondContact CE1-O 3.28Å; Y36-G124 PolarHBondContact N-O 2.76Å; Y36-G124 WeakPolarHBondContact OH-CA 3.44Å; S37-G124 PolarHBondContact N-O 2.81Å; S37-G124 VanDerWaalsContact N-O 3.14Å; Q122-G124 PolarHBondContact O-N 3.09Å
125	R	92.2	Very high	95.8	Very high	73 Å²	73	34 Å²	34	28%	0.275	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.4	173.8	-173.9	-175.6	77.7	171.3	8.7	109.1	H33 Y34 E35 Y36 E121 Q122 R123 E129	H33-R125 HydrophobicContact CB-CG 4.3Å; Y34-R125 WeakPolarHBondContact O-CA 3.15Å; E35-R125 HydrophobicContact CG-CB 4.5Å; E35-R125 HydrophobicContact CG-CG 4.07Å; Y36-R125 VanDerWaalsContact CE1-C 3.5Å; Y36-R125 VanDerWaalsContact CE1-CA 3.48Å; Y36-R125 VanDerWaalsContact CE1-N 3.34Å; E121-R125 CarbonylContact C-O 3.6Å; E121-R125 WeakPolarHBondContact CA-O 3.37Å; Q122-R125 PolarHBondContact N-O 2.88Å; Q122-R125 WeakPolarHBondContact O-CB 3.37Å; Q122-R125 PolarHBondContact O-N 3.08Å; R123-R125 VanDerWaalsContact C-N 3.33Å; R125-E129 IonicContact NH2-OE1 3.01Å; R125-E129 PolarHBondContact NH2-OE1 3.39Å
126	I	95.7	Very high	95.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.5	168.8	-167.9	169	0	0	0	107.6	H33 Y34 Y36 F78 P94 I106 L120	H33-I126 WeakPolarHBondContact CA-O 3.39Å; Y34-I126 HydrophobicContact CD1-CG2 4.23Å; Y34-I126 PolarHBondContact N-O 3.31Å; Y34-I126 PolarHBondContact O-N 2.85Å; Y36-I126 HydrophobicContact CE1-CB 4.3Å; F78-I126 HydrophobicContact CD1-CG1 4.46Å; F78-I126 HydrophobicContact CD1-CG2 3.71Å; F78-I126 HydrophobicContact CE1-CG1 4.45Å; F78-I126 HydrophobicContact CE1-CG2 3.85Å; F78-I126 HydrophobicContact CG-CG2 4.35Å; P94-I126 HydrophobicContact CB-CB 3.95Å; P94-I126 HydrophobicContact CB-CD1 3.81Å; P94-I126 HydrophobicContact CB-CG1 4.48Å; P94-I126 HydrophobicContact CB-CG2 3.41Å; P94-I126 VanDerWaalsContact CB-CG2 3.41Å; P94-I126 HydrophobicContact CG-CB 3.92Å; P94-I126 HydrophobicContact CG-CD1 4.38Å; P94-I126 HydrophobicContact CG-CG2 3.72Å; I106-I126 HydrophobicContact CD1-CD1 4.47Å; I106-I126 HydrophobicContact CG1-CD1 4.2Å; L120-I126 CarbonylContact O-C 3.44Å; L120-I126 WeakPolarHBondContact O-CA 3.29Å
127	G	96.9	Very high	95.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131.1	-176.6	0	0	0	0	0	111.1	Y32 C119 L120 E129	Y32-G127 CarbonylContact O-C 3.58Å; Y32-G127 VanDerWaalsContact O-CA 3.26Å; Y32-G127 WeakPolarHBondContact O-CA 3.25Å; C119-G127 CarbonylContact C-O 3.54Å; C119-G127 WeakPolarHBondContact CA-O 3.45Å; L120-G127 PolarHBondContact N-O 3.1Å; L120-G127 PolarHBondContact O-N 2.8Å; G127-E129 VanDerWaalsContact C-N 3.33Å; G127-E129 PolarHBondContact O-N 2.99Å
128	L	97.6	Very high	95	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	82.7	159.8	-177.6	64.1	0	0	0	106.5	S31 Y32 Y77 F78 C97 L98 L99 L104 Y117	S31-L128 WeakPolarHBondContact CA-O 3.44Å; Y32-L128 HydrophobicContact CD2-CD2 4.28Å; Y32-L128 PolarHBondContact N-O 2.87Å; Y32-L128 PolarHBondContact O-N 2.93Å; Y77-L128 HydrophobicContact CD1-CD2 4.22Å; F78-L128 HydrophobicContact CE1-CB 4.33Å; C97-L128 HydrophobicContact CB-CB 4.27Å; C97-L128 HydrophobicContact CB-CD1 3.87Å; L98-L128 WeakPolarHBondContact O-CD2 3.29Å; L99-L128 HydrophobicContact CB-CD1 4.49Å; L99-L128 HydrophobicContact CB-CD2 4.15Å; L99-L128 HydrophobicContact CD1-CD2 4.16Å; L104-L128 HydrophobicContact CD1-CD1 3.9Å; Y117-L128 HydrophobicContact CD1-CD1 4.35Å; Y117-L128 HydrophobicContact CD1-CD2 4.44Å; Y117-L128 HydrophobicContact CD1-CG 3.94Å; Y117-L128 HydrophobicContact CG-CD1 4.44Å; Y117-L128 HydrophobicContact CG-CG 4.49Å
129	E	97.3	Very high	94.9	Very high	38 Å²	38	48.7 Å²	48.7	18%	0.178	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	136.7	-169	-61.9	-167.8	-175.5	0	0	111.1	H33 Y117 T118 L120 R125 G127 T131	H33-E129 IonicContact CD2-OE1 3.76Å; H33-E129 IonicContact NE2-OE1 2.76Å; Y117-E129 CarbonylContact C-O 3.54Å; Y117-E129 WeakPolarHBondContact CA-O 3.49Å; T118-E129 PolarHBondContact N-O 3.42Å; T118-E129 PolarHBondContact O-N 2.62Å; L120-E129 HydrophobicContact CD1-CB 4.14Å; L120-E129 HydrophobicContact CD1-CG 4.38Å; L120-E129 WeakPolarHBondContact CD1-OE2 3.42Å; R125-E129 IonicContact NH2-OE1 3.01Å; R125-E129 PolarHBondContact NH2-OE1 3.39Å; G127-E129 VanDerWaalsContact C-N 3.33Å; G127-E129 PolarHBondContact O-N 2.99Å; E129-T131 PolarHBondContact O-N 3.24Å
130	I	98.1	Very high	94.8	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.031	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	116.7	171.4	-59.8	166	0	0	0	108.3	S31 F115 V116 Y117 G132 V163	S31-I130 PolarHBondContact OG-N 3.49Å; F115-I130 HydrophobicContact CB-CG2 3.98Å; F115-I130 HydrophobicContact CD1-CD1 4.49Å; F115-I130 HydrophobicContact CD1-CG2 3.83Å; F115-I130 HydrophobicContact CG-CG2 4.28Å; V116-I130 CarbonylContact O-C 3.56Å; V116-I130 VanDerWaalsContact O-CA 3.32Å; V116-I130 WeakPolarHBondContact O-CA 3.14Å; Y117-I130 HydrophobicContact CD1-CG1 3.67Å; Y117-I130 HydrophobicContact CE1-CD1 3.91Å; Y117-I130 HydrophobicContact CE1-CG1 3.37Å; Y117-I130 HydrophobicContact CG-CG1 4.43Å; I130-G132 WeakPolarHBondContact CG2-O 3Å; I130-V163 HydrophobicContact CB-CB 4.12Å; I130-V163 HydrophobicContact CB-CG2 3.62Å; I130-V163 HydrophobicContact CD1-CB 4.08Å; I130-V163 HydrophobicContact CD1-CG2 4.23Å; I130-V163 HydrophobicContact CG2-CB 3.68Å; I130-V163 HydrophobicContact CG2-CG1 3.95Å; I130-V163 HydrophobicContact CG2-CG2 3.58Å
131	T	97.1	Very high	94.9	Very high	46 Å²	46	50.4 Å²	50.4	28%	0.282	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-10.4	-177.2	53.4	0	0	0	0	113.4	V116 T118 L120 E129	V116-T131 PolarHBondContact O-N 2.86Å; T118-T131 HydrophobicContact CG2-CG2 4.5Å; T118-T131 VanDerWaalsContact OG1-CG2 3.24Å; T118-T131 WeakPolarHBondContact OG1-CG2 3.49Å; T118-T131 PolarHBondContact OG1-OG1 2.97Å; L120-T131 HydrophobicContact CD1-CG2 4.34Å; E129-T131 PolarHBondContact O-N 3.24Å
132	G	98	Very high	95	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	170.7	178.4	0	0	0	0	0	114.4	F115 V116 I130 A141	F115-G132 WeakPolarHBondContact CA-O 3.04Å; V116-G132 PolarHBondContact N-O 3.45Å; I130-G132 WeakPolarHBondContact CG2-O 3Å; G132-A141 CarbonylContact C-O 3.59Å; G132-A141 WeakPolarHBondContact CA-O 3.25Å
133	C	98.3	Very high	95.4	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	150.6	175.8	-62.8	0	0	0	0	110	I140 A141 F147 C156 H165	C133-I140 CarbonylContact O-C 3.56Å; C133-I140 WeakPolarHBondContact O-CA 3.35Å; C133-A141 HydrophobicContact CB-CB 4.47Å; C133-A141 PolarHBondContact N-O 2.95Å; C133-A141 PolarHBondContact O-N 2.79Å; C133-F147 HydrophobicContact CB-CE1 3.66Å; C133-F147 HydrophobicContact CB-CE2 4.41Å; C133-F147 HydrophobicContact CB-CZ 3.57Å; C133-C156 HydrophobicContact CB-CB 3.6Å; C133-C156 WeakPolarHBondContact CB-SG 3.15Å; C133-C156 PolarHBondContact N-SG 2.83Å; C133-C156 WeakPolarHBondContact SG-CA 3.26Å; C133-C156 WeakPolarHBondContact SG-CB 3.45Å; C133-C156 CovalentContact SG-SG 2.03Å; C133-C156 PolarHBondContact SG-SG 2.88Å; C133-H165 VanDerWaalsContact CB-NE2 3.33Å; C133-H165 WeakPolarHBondContact CB-NE2 3.4Å; C133-H165 PolarHBondContact SG-CD2 3.09Å
134	V	97.2	Very high	95.9	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.5	-176.7	-177.6	0	0	0	0	110.4	Q111 W114 V116 F139 I140	Q111-V134 HydrophobicContact CG-CG1 4.34Å; Q111-V134 HydrophobicContact CG-CG2 3.78Å; W114-V134 PolarHBondContact O-N 3.26Å; V116-V134 HydrophobicContact CG2-CG2 3.62Å; V134-F139 WeakPolarHBondContact CA-O 3.23Å; V134-I140 HydrophobicContact CG2-CG1 4.41Å
135	S	95.1	Very high	96.3	Very high	7 Å²	7	44.6 Å²	44.6	5%	0.049	24%	0.243	C	C	.	.			trans	-78.1	173.6	174.4	78.3	0	0	0	0	112.5	T137 G138 F139 S148	S135-T137 PolarHBondContact O-N 2.9Å; S135-T137 PolarHBondContact OG-N 3.11Å; S135-T137 PolarHBondContact OG-OG1 3.2Å; S135-G138 PolarHBondContact O-N 2.92Å; S135-G138 VanDerWaalsContact O-N 3.17Å; S135-G138 PolarHBondContact OG-N 3.47Å; S135-F139 PolarHBondContact N-O 3.06Å; S135-F139 WeakPolarHBondContact OG-CB 3.28Å; S135-F139 PolarHBondContact OG-N 2.86Å; S135-S148 WeakPolarHBondContact CB-O 3.36Å
136	D	91.1	Very high	96.6	Very high	67 Å²	67	45.7 Å²	45.7	36%	0.358	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.8	172.3	-56.1	-44.8	0	0	0	112.9	W114 R149 K150	W114-D136 WeakPolarHBondContact CH2-OD1 3.07Å; W114-D136 WeakPolarHBondContact CZ3-OD1 3.18Å; D136-R149 IonicContact OD1-NE 3.91Å; D136-R149 WeakPolarHBondContact OD2-CA 3.24Å; D136-R149 WeakPolarHBondContact OD2-CB 3.34Å; D136-K150 VanDerWaalsContact OD2-CG 3.29Å; D136-K150 WeakPolarHBondContact OD2-CG 3.21Å; D136-K150 PolarHBondContact OD2-N 3.49Å
137	T	92.8	Very high	96.6	Very high	124 Å²	124	46.1 Å²	46.1	76%	0.761	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.8	178.3	58.7	0	0	0	0	113.2	S135 F139	S135-T137 PolarHBondContact O-N 2.9Å; S135-T137 PolarHBondContact OG-N 3.11Å; S135-T137 PolarHBondContact OG-OG1 3.2Å; T137-F139 VanDerWaalsContact C-N 3.3Å
138	G	94	Very high	96.5	Very high	33 Å²	33	49 Å²	49	34%	0.34	28%	0.275	S	S	.	.			trans	80.1	6.9	-174.7	0	0	0	0	0	114.4	S135 I140	S135-G138 PolarHBondContact O-N 2.92Å; S135-G138 VanDerWaalsContact O-N 3.17Å; S135-G138 PolarHBondContact OG-N 3.47Å; G138-I140 PolarHBondContact O-N 2.91Å
139	F	95.3	Very high	96.3	Very high	113 Å²	113	49.5 Å²	49.5	50%	0.496	28%	0.277	S	S	.	.			trans	-65.3	132.1	171.9	172.1	-96.7	0	0	0	110	V134 S135 T137 A141 F147	V134-F139 WeakPolarHBondContact CA-O 3.23Å; S135-F139 PolarHBondContact N-O 3.06Å; S135-F139 WeakPolarHBondContact OG-CB 3.28Å; S135-F139 PolarHBondContact OG-N 2.86Å; T137-F139 VanDerWaalsContact C-N 3.3Å; F139-A141 HydrophobicContact CD1-CB 4.43Å; F139-A141 HydrophobicContact CE1-CB 4Å; F139-F147 HydrophobicContact CD1-CB 4.17Å; F139-F147 HydrophobicContact CE1-CB 4.17Å
140	I	97.2	Very high	96	Very high	81 Å²	81	55.4 Å²	55.4	42%	0.415	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111.1	-179.8	-61	168.8	0	0	0	109	V116 C133 V134 G138	V116-I140 HydrophobicContact CG2-CB 4.36Å; V116-I140 HydrophobicContact CG2-CD1 3.91Å; V116-I140 HydrophobicContact CG2-CG1 3.84Å; V116-I140 HydrophobicContact CG2-CG2 3.63Å; C133-I140 CarbonylContact O-C 3.56Å; C133-I140 WeakPolarHBondContact O-CA 3.35Å; V134-I140 HydrophobicContact CG2-CG1 4.41Å; G138-I140 PolarHBondContact O-N 2.91Å
141	A	98	Very high	95.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131	172.8	0	0	0	0	0	109.8	G132 C133 F139 D145 F147	G132-A141 CarbonylContact C-O 3.59Å; G132-A141 WeakPolarHBondContact CA-O 3.25Å; C133-A141 HydrophobicContact CB-CB 4.47Å; C133-A141 PolarHBondContact N-O 2.95Å; C133-A141 PolarHBondContact O-N 2.79Å; F139-A141 HydrophobicContact CD1-CB 4.43Å; F139-A141 HydrophobicContact CE1-CB 4Å; A141-D145 HydrophobicContact CB-CB 4Å; A141-F147 HydrophobicContact CB-CB 3.88Å; A141-F147 HydrophobicContact CB-CD1 3.48Å; A141-F147 VanDerWaalsContact CB-CD1 3.48Å; A141-F147 HydrophobicContact CB-CE1 4.16Å; A141-F147 HydrophobicContact CB-CG 3.77Å
142	K	98	Very high	95.7	Very high	151 Å²	151	54.4 Å²	54.4	66%	0.657	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	162.3	173.2	-59.9	178.8	-179	176.8	0	109.8	G144 D145 C156	K142-G144 PolarHBondContact O-N 2.99Å; K142-D145 VanDerWaalsContact CB-OD2 3.3Å; K142-D145 WeakPolarHBondContact CB-OD2 3.47Å; K142-D145 PolarHBondContact N-OD2 3.15Å; K142-D145 VanDerWaalsContact O-CB 3.31Å; K142-D145 WeakPolarHBondContact O-CB 3.36Å; K142-D145 PolarHBondContact O-N 2.85Å; K142-C156 WeakPolarHBondContact O-CB 3.44Å
143	I	97.8	Very high	95.6	Very high	84 Å²	84	55 Å²	55	43%	0.431	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	125.2	170.4	-61.4	176	0	0	0	109.1	C156 V163	I143-C156 CarbonylContact C-O 3.33Å; I143-C156 WeakPolarHBondContact CA-O 3.34Å; I143-V163 HydrophobicContact CD1-CG2 4.2Å
144	G	97.6	Very high	95.5	Very high	45 Å²	45	55 Å²	55	46%	0.464	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.3	-23.7	-173.9	0	0	0	0	0	113.9	K142 C156	K142-G144 PolarHBondContact O-N 2.99Å; G144-C156 PolarHBondContact N-O 2.82Å
145	D	98.1	Very high	95.5	Very high	67 Å²	67	57.7 Å²	57.7	36%	0.358	31%	0.314	S	S	.	.			trans	-74.9	149.2	-176.5	-67.7	-15.6	0	0	0	111.9	A141 K142 M155 C156	A141-D145 HydrophobicContact CB-CB 4Å; K142-D145 VanDerWaalsContact CB-OD2 3.3Å; K142-D145 WeakPolarHBondContact CB-OD2 3.47Å; K142-D145 PolarHBondContact N-OD2 3.15Å; K142-D145 VanDerWaalsContact O-CB 3.31Å; K142-D145 WeakPolarHBondContact O-CB 3.36Å; K142-D145 PolarHBondContact O-N 2.85Å; D145-M155 WeakPolarHBondContact O-CA 3.03Å; D145-C156 PolarHBondContact O-N 3.11Å
146	I	97.1	Very high	95.7	Very high	95 Å²	95	57.4 Å²	57.4	49%	0.487	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	136.9	169.6	-60.6	174.6	0	0	0	108.7	L153 F154 M155 V168	I146-L153 HydrophobicContact CG2-CB 4.39Å; I146-F154 CarbonylContact C-O 3.46Å; I146-F154 VanDerWaalsContact CA-O 3.26Å; I146-F154 WeakPolarHBondContact CA-O 3.49Å; I146-M155 HydrophobicContact CD1-CE 3.95Å; I146-M155 HydrophobicContact CG1-CB 4.32Å; I146-M155 HydrophobicContact CG1-CE 3.85Å; I146-M155 HydrophobicContact CG1-CG 4.44Å; I146-V168 HydrophobicContact CG2-CG2 4.29Å
147	F	96.8	Very high	96	Very high	9 Å²	9	56.1 Å²	56.1	4%	0.039	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	160.3	178.5	65.4	-76.5	0	0	0	110.7	C133 F139 A141 R149 F154 C156 H165	C133-F147 HydrophobicContact CB-CE1 3.66Å; C133-F147 HydrophobicContact CB-CE2 4.41Å; C133-F147 HydrophobicContact CB-CZ 3.57Å; F139-F147 HydrophobicContact CD1-CB 4.17Å; F139-F147 HydrophobicContact CE1-CB 4.17Å; A141-F147 HydrophobicContact CB-CB 3.88Å; A141-F147 HydrophobicContact CB-CD1 3.48Å; A141-F147 VanDerWaalsContact CB-CD1 3.48Å; A141-F147 HydrophobicContact CB-CE1 4.16Å; A141-F147 HydrophobicContact CB-CG 3.77Å; F147-R149 HydrophobicContact CD2-CG 4.16Å; F147-R149 HydrophobicContact CE2-CG 3.82Å; F147-F154 HydrophobicContact CD1-CB 4.31Å; F147-F154 VanDerWaalsContact CD1-O 3.29Å; F147-F154 WeakPolarHBondContact CD1-O 3.17Å; F147-F154 HydrophobicContact CE1-CB 3.82Å; F147-F154 HydrophobicContact CE2-CB 4.23Å; F147-F154 HydrophobicContact CZ-CB 3.78Å; F147-F154 PolarHBondContact N-O 2.68Å; F147-F154 PolarHBondContact O-N 2.7Å; F147-C156 HydrophobicContact CE1-CB 4.01Å; F147-H165 AromaticContact CE2-CE1 3.93Å; F147-H165 AromaticContact CE2-ND1 3.98Å; F147-H165 AromaticContact CZ-CE1 3.6Å; F147-H165 AromaticContact CZ-CG 3.88Å; F147-H165 AromaticContact CZ-ND1 3.56Å; F147-H165 AromaticContact CZ-NE2 3.97Å
148	S	95.1	Very high	96.2	Very high	60 Å²	60	52 Å²	52	42%	0.42	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	145.4	179.4	59.4	0	0	0	0	112.3	S135 F152	S135-S148 WeakPolarHBondContact CB-O 3.36Å; S148-F152 CarbonylContact C-O 3.57Å; S148-F152 VanDerWaalsContact CA-O 3.3Å; S148-F152 WeakPolarHBondContact CA-O 3.46Å
149	R	92.2	Very high	96.2	Very high	11 Å²	11	59.3 Å²	59.3	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	114.9	165.8	-70	173.7	63	-139.3	2.8	107.8	L25 W114 D136 F147 S151 F152 F154	L25-R149 PolarHBondContact O-NH1 3.19Å; W114-R149 VanDerWaalsContact CZ3-NE 3.34Å; D136-R149 IonicContact OD1-NE 3.91Å; D136-R149 WeakPolarHBondContact OD2-CA 3.24Å; D136-R149 WeakPolarHBondContact OD2-CB 3.34Å; F147-R149 HydrophobicContact CD2-CG 4.16Å; F147-R149 HydrophobicContact CE2-CG 3.82Å; R149-S151 PolarHBondContact O-N 2.85Å; R149-F152 PolarHBondContact N-O 3.27Å; R149-F152 PolarHBondContact O-N 2.95Å; R149-F154 HydrophobicContact CB-CD2 3.85Å; R149-F154 HydrophobicContact CB-CE2 3.82Å; R149-F154 HydrophobicContact CG-CD2 4.06Å; R149-F154 HydrophobicContact CG-CE2 4.38Å
150	K	90.8	Very high	96.2	Very high	163 Å²	163	57.7 Å²	57.7	71%	0.709	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	-124	-169	-52	-176.1	179.6	-178.9	0	110.2	D136 F152	D136-K150 VanDerWaalsContact OD2-CG 3.29Å; D136-K150 WeakPolarHBondContact OD2-CG 3.21Å; D136-K150 PolarHBondContact OD2-N 3.49Å; K150-F152 VanDerWaalsContact C-N 3.3Å; K150-F152 PolarHBondContact O-N 3.08Å
151	S	93.7	Very high	96.1	Very high	29 Å²	29	57.9 Å²	57.9	20%	0.203	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	25.6	-179.9	-48.4	0	0	0	0	113.7	E22 R149 C170 I171	E22-S151 WeakPolarHBondContact OE2-CB 3.14Å; E22-S151 PolarHBondContact OE2-OG 2.93Å; R149-S151 PolarHBondContact O-N 2.85Å; S151-C170 CarbonylContact O-C 3.5Å; S151-I171 PolarHBondContact O-N 2.96Å
152	F	95.9	Very high	96.1	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.009	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.1	-173.3	-57.7	-78.8	0	0	0	112.9	E22 C24 S148 R149 K150 F154 C170 V200 I202	E22-F152 HydrophobicContact CB-CE2 4.01Å; E22-F152 HydrophobicContact CB-CZ 3.85Å; E22-F152 WeakPolarHBondContact O-CZ 3.17Å; C24-F152 HydrophobicContact CB-CB 4.48Å; C24-F152 HydrophobicContact CB-CD2 3.4Å; C24-F152 HydrophobicContact CB-CE2 3.65Å; C24-F152 HydrophobicContact CB-CG 3.89Å; C24-F152 HydrophobicContact CB-CZ 4.32Å; S148-F152 CarbonylContact C-O 3.57Å; S148-F152 VanDerWaalsContact CA-O 3.3Å; S148-F152 WeakPolarHBondContact CA-O 3.46Å; R149-F152 PolarHBondContact N-O 3.27Å; R149-F152 PolarHBondContact O-N 2.95Å; K150-F152 VanDerWaalsContact C-N 3.3Å; K150-F152 PolarHBondContact O-N 3.08Å; F152-F154 HydrophobicContact CB-CD2 4.31Å; F152-F154 HydrophobicContact CB-CE2 3.63Å; F152-F154 HydrophobicContact CB-CZ 4.31Å; F152-C170 HydrophobicContact CD1-CB 4.43Å; F152-V200 HydrophobicContact CB-CG1 4.14Å; F152-V200 HydrophobicContact CD1-CB 4.18Å; F152-V200 HydrophobicContact CD1-CG1 3.3Å; F152-V200 HydrophobicContact CD1-CG2 3.95Å; F152-V200 HydrophobicContact CE1-CB 4.43Å; F152-V200 HydrophobicContact CE1-CG1 3.87Å; F152-V200 HydrophobicContact CE1-CG2 4.12Å; F152-V200 HydrophobicContact CG-CG1 3.87Å; F152-I202 HydrophobicContact CE1-CD1 4.19Å; F152-I202 HydrophobicContact CE1-CG1 3.92Å; F152-I202 HydrophobicContact CZ-CD1 4.28Å; F152-I202 HydrophobicContact CZ-CG1 4.28Å
153	L	96.1	Very high	96.1	Very high	11 Å²	11	54.8 Å²	54.8	6%	0.058	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.9	177.1	-60.1	169.9	0	0	0	109.9	I146 V168 G169 I171 E176	I146-L153 HydrophobicContact CG2-CB 4.39Å; L153-V168 HydrophobicContact CB-CG2 3.84Å; L153-V168 WeakPolarHBondContact O-CG2 3.49Å; L153-V168 PolarHBondContact O-N 3.48Å; L153-G169 PolarHBondContact N-O 3.28Å; L153-G169 PolarHBondContact O-N 3.13Å; L153-I171 HydrophobicContact CD2-CD1 3.79Å; L153-I171 HydrophobicContact CD2-CG1 3.83Å; L153-I171 HydrophobicContact CG-CD1 4.37Å; L153-I171 HydrophobicContact CG-CG1 3.91Å; L153-E176 HydrophobicContact CD1-CB 3.83Å; L153-E176 HydrophobicContact CD1-CG 3.78Å
154	F	96.1	Very high	96	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.2	178.3	-71.1	-88.4	0	0	0	110.3	C24 I146 F147 R149 F152 H165 K166 A167	C24-F154 HydrophobicContact CB-CE2 4.45Å; C24-F154 HydrophobicContact CB-CZ 4.04Å; C24-F154 VanDerWaalsContact SG-CZ 3.53Å; I146-F154 CarbonylContact C-O 3.46Å; I146-F154 VanDerWaalsContact CA-O 3.26Å; I146-F154 WeakPolarHBondContact CA-O 3.49Å; F147-F154 HydrophobicContact CD1-CB 4.31Å; F147-F154 VanDerWaalsContact CD1-O 3.29Å; F147-F154 WeakPolarHBondContact CD1-O 3.17Å; F147-F154 HydrophobicContact CE1-CB 3.82Å; F147-F154 HydrophobicContact CE2-CB 4.23Å; F147-F154 HydrophobicContact CZ-CB 3.78Å; F147-F154 PolarHBondContact N-O 2.68Å; F147-F154 PolarHBondContact O-N 2.7Å; R149-F154 HydrophobicContact CB-CD2 3.85Å; R149-F154 HydrophobicContact CB-CE2 3.82Å; R149-F154 HydrophobicContact CG-CD2 4.06Å; R149-F154 HydrophobicContact CG-CE2 4.38Å; F152-F154 HydrophobicContact CB-CD2 4.31Å; F152-F154 HydrophobicContact CB-CE2 3.63Å; F152-F154 HydrophobicContact CB-CZ 4.31Å; F154-H165 HydrophobicContact CD1-CB 3.77Å; F154-H165 WeakPolarHBondContact CD1-O 3.29Å; F154-H165 HydrophobicContact CE1-CB 4.34Å; F154-H165 HydrophobicContact CG-CB 4.36Å; F154-K166 CarbonylContact C-O 3.54Å; F154-K166 VanDerWaalsContact CA-O 3.31Å; F154-K166 WeakPolarHBondContact CA-O 3.47Å; F154-A167 HydrophobicContact CD1-CB 4.17Å; F154-A167 HydrophobicContact CE1-CB 3.81Å; F154-A167 HydrophobicContact CZ-CB 4.42Å
155	M	97.1	Very high	95.9	Very high	60 Å²	60	50.4 Å²	50.4	30%	0.296	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.5	166.5	-175.8	179.4	-77.1	0	0	108.9	D145 I146 V157 K166 V168	D145-M155 WeakPolarHBondContact O-CA 3.03Å; I146-M155 HydrophobicContact CD1-CE 3.95Å; I146-M155 HydrophobicContact CG1-CB 4.32Å; I146-M155 HydrophobicContact CG1-CE 3.85Å; I146-M155 HydrophobicContact CG1-CG 4.44Å; M155-V157 HydrophobicContact CB-CG2 4.07Å; M155-V157 HydrophobicContact CG-CG2 3.75Å; M155-V157 PolarHBondContact O-N 3.06Å; M155-V157 HydrophobicContact SD-CG2 3.98Å; M155-K166 PolarHBondContact N-O 2.95Å; M155-K166 PolarHBondContact O-N 2.61Å; M155-V168 HydrophobicContact CB-CG1 3.79Å
156	C	98	Very high	95.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	100	174.1	-169.2	0	0	0	0	109.6	C133 K142 I143 G144 D145 F147	C133-C156 HydrophobicContact CB-CB 3.6Å; C133-C156 WeakPolarHBondContact CB-SG 3.15Å; C133-C156 PolarHBondContact N-SG 2.83Å; C133-C156 WeakPolarHBondContact SG-CA 3.26Å; C133-C156 WeakPolarHBondContact SG-CB 3.45Å; C133-C156 CovalentContact SG-SG 2.03Å; C133-C156 PolarHBondContact SG-SG 2.88Å; K142-C156 WeakPolarHBondContact O-CB 3.44Å; I143-C156 CarbonylContact C-O 3.33Å; I143-C156 WeakPolarHBondContact CA-O 3.34Å; G144-C156 PolarHBondContact N-O 2.82Å; D145-C156 PolarHBondContact O-N 3.11Å; F147-C156 HydrophobicContact CE1-CB 4.01Å
157	V	97.7	Very high	95.7	Very high	41 Å²	41	48.7 Å²	48.7	25%	0.248	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.8	-171.8	-179.8	0	0	0	0	110.6	M155 V163 I164 K166	M155-V157 HydrophobicContact CB-CG2 4.07Å; M155-V157 HydrophobicContact CG-CG2 3.75Å; M155-V157 PolarHBondContact O-N 3.06Å; M155-V157 HydrophobicContact SD-CG2 3.98Å; V157-V163 CarbonylContact O-C 3.51Å; V157-V163 WeakPolarHBondContact O-CA 3.07Å; V157-I164 PolarHBondContact N-O 2.54Å; V157-I164 PolarHBondContact O-N 2.04Å; V157-K166 HydrophobicContact CB-CB 4.46Å; V157-K166 HydrophobicContact CG2-CB 3.75Å; V157-K166 HydrophobicContact CG2-CD 4.04Å
158	G	97.4	Very high	95.6	Very high	37 Å²	37	50.1 Å²	50.1	38%	0.381	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	134.7	166.6	0	0	0	0	0	111.4	Q162	G158-Q162 CarbonylContact C-O 3.58Å; G158-Q162 WeakPolarHBondContact CA-O 3.31Å
159	R	95.3	Very high	95.7	Very high	187 Å²	187	47.2 Å²	47.2	71%	0.706	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	97.9	174.2	-174.4	-177.2	-178.1	-179.3	0.3	109.7	D161 Q162	R159-D161 PolarHBondContact O-N 3.15Å; R159-Q162 PolarHBondContact N-O 3.14Å; R159-Q162 PolarHBondContact O-N 3.27Å; R159-Q162 VanDerWaalsContact O-N 3.07Å
160	G	94.4	Very high	95.9	Very high	78 Å²	78	46.7 Å²	46.7	80%	0.804	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	-130.8	-170.4	0	0	0	0	0	109.5	Q162	G160-Q162 PolarHBondContact O-N 3.13Å
161	D	95.5	Very high	96.2	Very high	85 Å²	85	41 Å²	41	46%	0.455	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-7.9	178	-59.7	-23.7	0	0	0	113.1	T30 S31 H33 R159	T30-D161 CarbonylContact C-O 3.58Å; T30-D161 WeakPolarHBondContact CA-O 3.2Å; T30-D161 HydrophobicContact CG2-CB 3.92Å; S31-D161 WeakPolarHBondContact CB-O 3.46Å; S31-D161 PolarHBondContact N-O 3.1Å; S31-D161 PolarHBondContact OG-O 3.29Å; H33-D161 IonicContact CE1-OD1 2.68Å; H33-D161 PolarHBondContact CE1-OD1 2.8Å; H33-D161 IonicContact ND1-OD1 2.77Å; H33-D161 IonicContact ND1-OD2 2.96Å; R159-D161 PolarHBondContact O-N 3.15Å
162	Q	97.5	Very high	96.2	Very high	84 Å²	84	40.1 Å²	40.1	39%	0.393	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	143	-177.1	-63.5	-173.9	-33.6	0	0	112.3	S29 T30 G158 R159 G160	S29-Q162 CarbonylContact O-C 3.57Å; S29-Q162 VanDerWaalsContact O-CA 3.29Å; S29-Q162 WeakPolarHBondContact O-CA 3.44Å; T30-Q162 HydrophobicContact CG2-CG 4.16Å; G158-Q162 CarbonylContact C-O 3.58Å; G158-Q162 WeakPolarHBondContact CA-O 3.31Å; R159-Q162 PolarHBondContact N-O 3.14Å; R159-Q162 PolarHBondContact O-N 3.27Å; R159-Q162 VanDerWaalsContact O-N 3.07Å; G160-Q162 PolarHBondContact O-N 3.13Å
163	V	98.2	Very high	96.1	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.7	168.2	-178.8	0	0	0	0	109.3	T28 S29 F115 I130 I143 V157	T28-V163 WeakPolarHBondContact CA-O 3.24Å; S29-V163 PolarHBondContact N-O 2.97Å; S29-V163 PolarHBondContact O-N 3Å; F115-V163 HydrophobicContact CD1-CB 4.29Å; F115-V163 HydrophobicContact CD1-CG1 4.1Å; F115-V163 HydrophobicContact CE1-CB 4.13Å; F115-V163 HydrophobicContact CE1-CG1 3.94Å; F115-V163 WeakPolarHBondContact CE1-O 3.49Å; I130-V163 HydrophobicContact CB-CB 4.12Å; I130-V163 HydrophobicContact CB-CG2 3.62Å; I130-V163 HydrophobicContact CD1-CB 4.08Å; I130-V163 HydrophobicContact CD1-CG2 4.23Å; I130-V163 HydrophobicContact CG2-CB 3.68Å; I130-V163 HydrophobicContact CG2-CG1 3.95Å; I130-V163 HydrophobicContact CG2-CG2 3.58Å; I143-V163 HydrophobicContact CD1-CG2 4.2Å; V157-V163 CarbonylContact O-C 3.51Å; V157-V163 WeakPolarHBondContact O-CA 3.07Å
164	I	96.1	Very high	95.9	Very high	36 Å²	36	54.6 Å²	54.6	19%	0.185	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133	-168.3	-56.5	167.5	0	0	0	109.5	T26 K27 T28 V157 K166	T26-I164 HydrophobicContact CG2-CG2 3.43Å; T26-I164 VanDerWaalsContact CG2-CG2 3.43Å; K27-I164 CarbonylContact O-C 3.51Å; K27-I164 WeakPolarHBondContact O-CA 3.43Å; T28-I164 HydrophobicContact CG2-CG1 3.81Å; V157-I164 PolarHBondContact N-O 2.54Å; V157-I164 PolarHBondContact O-N 2.04Å; I164-K166 PolarHBondContact O-N 3.03Å; I164-K166 VanDerWaalsContact O-N 3.12Å
165	H	95.3	Very high	95.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	87.5	164.2	-68.8	-152.7	0	0	0	108.1	T26 K27 W114 F115 C133 F147 F154 A167	T26-H165 VanDerWaalsContact CG2-O 3.3Å; T26-H165 WeakPolarHBondContact CG2-O 2.92Å; T26-H165 PolarHBondContact OG1-O 2.87Å; T26-H165 VanDerWaalsContact OG1-O 3.11Å; K27-H165 HydrophobicContact CB-CB 4.19Å; K27-H165 PolarHBondContact O-N 2.95Å; W114-H165 PolarHBondContact O-CE1 2.81Å; W114-H165 PolarHBondContact O-NE2 2.65Å; F115-H165 AromaticContact CE1-CD2 3.53Å; F115-H165 AromaticContact CE1-NE2 3.58Å; F115-H165 AromaticContact CZ-CD2 3.76Å; F115-H165 AromaticContact CZ-NE2 3.88Å; C133-H165 VanDerWaalsContact CB-NE2 3.33Å; C133-H165 WeakPolarHBondContact CB-NE2 3.4Å; C133-H165 PolarHBondContact SG-CD2 3.09Å; F147-H165 AromaticContact CE2-CE1 3.93Å; F147-H165 AromaticContact CE2-ND1 3.98Å; F147-H165 AromaticContact CZ-CE1 3.6Å; F147-H165 AromaticContact CZ-CG 3.88Å; F147-H165 AromaticContact CZ-ND1 3.56Å; F147-H165 AromaticContact CZ-NE2 3.97Å; F154-H165 HydrophobicContact CD1-CB 3.77Å; F154-H165 WeakPolarHBondContact CD1-O 3.29Å; F154-H165 HydrophobicContact CE1-CB 4.34Å; F154-H165 HydrophobicContact CG-CB 4.36Å; H165-A167 PolarHBondContact O-N 3.27Å
166	K	95	Very high	95.8	Very high	116 Å²	116	63.1 Å²	63.1	50%	0.504	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116.6	179.6	-174.8	-179.3	178.8	-174.9	0	109	F154 M155 V157 I164 V168	F154-K166 CarbonylContact C-O 3.54Å; F154-K166 VanDerWaalsContact CA-O 3.31Å; F154-K166 WeakPolarHBondContact CA-O 3.47Å; M155-K166 PolarHBondContact N-O 2.95Å; M155-K166 PolarHBondContact O-N 2.61Å; V157-K166 HydrophobicContact CB-CB 4.46Å; V157-K166 HydrophobicContact CG2-CB 3.75Å; V157-K166 HydrophobicContact CG2-CD 4.04Å; I164-K166 PolarHBondContact O-N 3.03Å; I164-K166 VanDerWaalsContact O-N 3.12Å; K166-V168 PolarHBondContact O-N 3.34Å
167	A	95.1	Very high	95.8	Very high	11 Å²	11	63.5 Å²	63.5	9%	0.091	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	132.3	173.5	0	0	0	0	0	110	F154 H165 I179 V200	F154-A167 HydrophobicContact CD1-CB 4.17Å; F154-A167 HydrophobicContact CE1-CB 3.81Å; F154-A167 HydrophobicContact CZ-CB 4.42Å; H165-A167 PolarHBondContact O-N 3.27Å; A167-I179 HydrophobicContact CB-CD1 4.49Å; A167-I179 WeakPolarHBondContact O-CD1 3.13Å; A167-V200 HydrophobicContact CB-CB 3.89Å; A167-V200 HydrophobicContact CB-CG1 3.58Å
168	V	95.6	Very high	95.8	Very high	38 Å²	38	66.7 Å²	66.7	23%	0.23	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	-17.7	-180	-65.6	0	0	0	0	113.4	I146 L153 M155 K166 I179	I146-V168 HydrophobicContact CG2-CG2 4.29Å; L153-V168 HydrophobicContact CB-CG2 3.84Å; L153-V168 WeakPolarHBondContact O-CG2 3.49Å; L153-V168 PolarHBondContact O-N 3.48Å; M155-V168 HydrophobicContact CB-CG1 3.79Å; K166-V168 PolarHBondContact O-N 3.34Å; V168-I179 WeakPolarHBondContact O-CG1 3.38Å
169	G	96.7	Very high	95.7	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	-176.7	178.7	0	0	0	0	0	113.8	L153 V177	L153-G169 PolarHBondContact N-O 3.28Å; L153-G169 PolarHBondContact O-N 3.13Å; G169-V177 CarbonylContact C-O 3.52Å; G169-V177 VanDerWaalsContact CA-O 3.31Å; G169-V177 WeakPolarHBondContact CA-O 3.48Å
170	C	97.2	Very high	95.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	157.5	176.1	-59.3	0	0	0	0	109.9	S151 F152 I172 E176 V177 C192 V200 I202	S151-C170 CarbonylContact O-C 3.5Å; F152-C170 HydrophobicContact CD1-CB 4.43Å; C170-I172 HydrophobicContact CB-CD1 4.27Å; C170-I172 HydrophobicContact CB-CG1 4.01Å; C170-E176 CarbonylContact O-C 3.58Å; C170-E176 WeakPolarHBondContact O-CA 3.42Å; C170-V177 PolarHBondContact N-O 2.99Å; C170-V177 PolarHBondContact O-N 2.86Å; C170-C192 HydrophobicContact CB-CB 3.66Å; C170-C192 WeakPolarHBondContact CB-SG 3.4Å; C170-C192 PolarHBondContact N-SG 2.95Å; C170-C192 WeakPolarHBondContact SG-CA 3.3Å; C170-C192 WeakPolarHBondContact SG-CB 3.29Å; C170-C192 CovalentContact SG-SG 2.04Å; C170-C192 PolarHBondContact SG-SG 3.24Å; C170-V200 WeakPolarHBondContact SG-CG2 3.47Å; C170-I202 HydrophobicContact CB-CD1 4.16Å; C170-I202 HydrophobicContact CB-CG1 3.78Å
171	I	95.9	Very high	95.9	Very high	42 Å²	42	64.4 Å²	64.4	22%	0.215	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	106.8	169	-54.4	172.6	0	0	0	106.6	S151 L153 Q175	S151-I171 PolarHBondContact O-N 2.96Å; L153-I171 HydrophobicContact CD2-CD1 3.79Å; L153-I171 HydrophobicContact CD2-CG1 3.83Å; L153-I171 HydrophobicContact CG-CD1 4.37Å; L153-I171 HydrophobicContact CG-CG1 3.91Å; I171-Q175 CarbonylContact C-O 3.49Å; I171-Q175 WeakPolarHBondContact CA-O 3.01Å
172	I	94.3	Very high	95.9	Very high	11 Å²	11	61.9 Å²	61.9	6%	0.056	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116	-177.4	-52	179.2	0	0	0	107.8	C170 K174 Q175 V177 V183 I185 Y190 I202	C170-I172 HydrophobicContact CB-CD1 4.27Å; C170-I172 HydrophobicContact CB-CG1 4.01Å; I172-K174 VanDerWaalsContact C-N 3.29Å; I172-K174 PolarHBondContact O-N 3.02Å; I172-Q175 PolarHBondContact N-O 2.97Å; I172-Q175 WeakPolarHBondContact O-CB 3.05Å; I172-Q175 PolarHBondContact O-N 2.78Å; I172-V177 HydrophobicContact CB-CG2 4.3Å; I172-V177 HydrophobicContact CD1-CB 4.31Å; I172-V177 HydrophobicContact CD1-CG2 4.1Å; I172-V177 HydrophobicContact CG1-CG2 4.22Å; I172-V183 HydrophobicContact CB-CG1 4.08Å; I172-V183 HydrophobicContact CD1-CG1 3.96Å; I172-V183 HydrophobicContact CG2-CG1 3.99Å; I172-I185 HydrophobicContact CG2-CG1 3.98Å; I172-Y190 HydrophobicContact CG2-CD2 4.41Å; I172-Y190 HydrophobicContact CG2-CG 4.19Å; I172-I202 HydrophobicContact CD1-CG1 4.21Å; I172-I202 HydrophobicContact CD1-CG2 3.9Å; I172-I202 HydrophobicContact CG1-CD1 3.96Å; I172-I202 HydrophobicContact CG1-CG1 4.03Å; I172-I202 HydrophobicContact CG1-CG2 4.15Å
173	N	93	Very high	95.9	Very high	118 Å²	118	58.5 Å²	58.5	63%	0.631	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	46.8	-174.8	-168.4	41.2	0	0	0	113.2	Q175 I185	N173-Q175 PolarHBondContact O-N 3.41Å; N173-Q175 VanDerWaalsContact O-N 3.15Å; N173-I185 HydrophobicContact CB-CD1 3.66Å; N173-I185 HydrophobicContact CB-CG1 4.15Å; N173-I185 HydrophobicContact CB-CG2 4Å
174	K	93	Very high	95.8	Very high	199 Å²	199	61.2 Å²	61.2	87%	0.865	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	7.3	-176.4	-50.1	176.3	179.3	178	0	115.3	I172	I172-K174 VanDerWaalsContact C-N 3.29Å; I172-K174 PolarHBondContact O-N 3.02Å
175	Q	94.7	Very high	95.7	Very high	104 Å²	104	61.3 Å²	61.3	49%	0.486	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.2	173.1	-177.1	173.9	1.1	0	0	110.6	I171 I172 N173 V177 V183	I171-Q175 CarbonylContact C-O 3.49Å; I171-Q175 WeakPolarHBondContact CA-O 3.01Å; I172-Q175 PolarHBondContact N-O 2.97Å; I172-Q175 WeakPolarHBondContact O-CB 3.05Å; I172-Q175 PolarHBondContact O-N 2.78Å; N173-Q175 PolarHBondContact O-N 3.41Å; N173-Q175 VanDerWaalsContact O-N 3.15Å; Q175-V177 HydrophobicContact CG-CG2 4.45Å; Q175-V183 VanDerWaalsContact OE1-CG2 3.26Å
176	E	96.6	Very high	95.6	Very high	136 Å²	136	64.7 Å²	64.7	64%	0.636	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.2	170.9	-59.3	-168.5	174.5	0	0	110.6	L153 C170	L153-E176 HydrophobicContact CD1-CB 3.83Å; L153-E176 HydrophobicContact CD1-CG 3.78Å; C170-E176 CarbonylContact O-C 3.58Å; C170-E176 WeakPolarHBondContact O-CA 3.42Å
177	V	97.4	Very high	95.7	Very high	8 Å²	8	62.5 Å²	62.5	5%	0.048	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	117.4	-177.2	-176.8	0	0	0	0	108.7	G169 C170 I172 Q175 K181 V183 C192	G169-V177 CarbonylContact C-O 3.52Å; G169-V177 VanDerWaalsContact CA-O 3.31Å; G169-V177 WeakPolarHBondContact CA-O 3.48Å; C170-V177 PolarHBondContact N-O 2.99Å; C170-V177 PolarHBondContact O-N 2.86Å; I172-V177 HydrophobicContact CB-CG2 4.3Å; I172-V177 HydrophobicContact CD1-CB 4.31Å; I172-V177 HydrophobicContact CD1-CG2 4.1Å; I172-V177 HydrophobicContact CG1-CG2 4.22Å; Q175-V177 HydrophobicContact CG-CG2 4.45Å; V177-K181 HydrophobicContact CG1-CB 3.91Å; V177-V183 HydrophobicContact CG2-CB 4.14Å; V177-V183 HydrophobicContact CG2-CG1 3.89Å; V177-C192 HydrophobicContact CB-CB 4.42Å; V177-C192 HydrophobicContact CG1-CB 3.99Å
178	D	97.5	Very high	95.7	Very high	108 Å²	108	62.2 Å²	62.2	58%	0.578	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	152.8	176.5	-62.4	-29	0	0	0	111.8	H180 K181	D178-H180 PolarHBondContact O-N 2.82Å; D178-K181 HydrophobicContact CB-CB 4.41Å; D178-K181 HydrophobicContact CB-CG 3.73Å; D178-K181 VanDerWaalsContact O-CB 3.29Å; D178-K181 WeakPolarHBondContact O-CB 3.11Å; D178-K181 PolarHBondContact O-N 2.84Å
179	I	95.6	Very high	95.8	Very high	32 Å²	32	61.4 Å²	61.4	16%	0.164	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	137.4	173.8	-62.2	169.6	0	0	0	110.2	A167 V168 K181 R194 V200	A167-I179 HydrophobicContact CB-CD1 4.49Å; A167-I179 WeakPolarHBondContact O-CD1 3.13Å; V168-I179 WeakPolarHBondContact O-CG1 3.38Å; I179-K181 PolarHBondContact O-N 2.86Å; I179-R194 HydrophobicContact CG2-CG 3.66Å; I179-V200 HydrophobicContact CG1-CG2 4.39Å
180	H	95.7	Very high	95.7	Very high	91 Å²	91	62.3 Å²	62.3	42%	0.421	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	-2	-173.3	-53.7	-58.9	0	0	0	116.2	D178 R191 C192	D178-H180 PolarHBondContact O-N 2.82Å; H180-R191 PolarHBondContact O-NE 2.81Å; H180-C192 VanDerWaalsContact CA-O 3.24Å; H180-C192 WeakPolarHBondContact CA-O 3.31Å; H180-C192 PolarHBondContact N-O 2.99Å
181	K	97.8	Very high	95.7	Very high	130 Å²	130	66.5 Å²	66.5	57%	0.565	34%	0.335	S	S	*	.			trans	-87.5	162.2	173.5	-57.7	-60.9	-175.6	175	0	111.8	V177 D178 I179 R191 C192	V177-K181 HydrophobicContact CG1-CB 3.91Å; D178-K181 HydrophobicContact CB-CB 4.41Å; D178-K181 HydrophobicContact CB-CG 3.73Å; D178-K181 VanDerWaalsContact O-CB 3.29Å; D178-K181 WeakPolarHBondContact O-CB 3.11Å; D178-K181 PolarHBondContact O-N 2.84Å; I179-K181 PolarHBondContact O-N 2.86Å; K181-R191 WeakPolarHBondContact O-CA 3.35Å; K181-R191 WeakPolarHBondContact O-CG 3.3Å; K181-C192 PolarHBondContact O-N 2.94Å
182	S	96.4	Very high	95.7	Very high	32 Å²	32	64.5 Å²	64.5	22%	0.224	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145.4	-174.9	-65.7	0	0	0	0	112	Y190 R191 R214	S182-Y190 CarbonylContact C-O 3.53Å; S182-Y190 WeakPolarHBondContact CA-O 3.49Å; S182-Y190 WeakPolarHBondContact CB-O 3.45Å; S182-Y190 PolarHBondContact OG-O 2.83Å; S182-R191 WeakPolarHBondContact OG-CB 3.35Å; S182-R191 WeakPolarHBondContact OG-CG 3.39Å; S182-R214 PolarHBondContact O-NH2 3.12Å
183	V	96.7	Very high	95.8	Very high	14 Å²	14	64.4 Å²	64.4	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	147.1	-177.7	63.8	0	0	0	0	110.3	I172 Q175 V177 I185 W189 Y190	I172-V183 HydrophobicContact CB-CG1 4.08Å; I172-V183 HydrophobicContact CD1-CG1 3.96Å; I172-V183 HydrophobicContact CG2-CG1 3.99Å; Q175-V183 VanDerWaalsContact OE1-CG2 3.26Å; V177-V183 HydrophobicContact CG2-CB 4.14Å; V177-V183 HydrophobicContact CG2-CG1 3.89Å; V183-I185 HydrophobicContact CG1-CD1 4.31Å; V183-I185 HydrophobicContact CG1-CG1 4.13Å; V183-I185 HydrophobicContact CG2-CD1 3.87Å; V183-I185 HydrophobicContact CG2-CG1 4.42Å; V183-W189 CarbonylContact O-C 3.5Å; V183-W189 VanDerWaalsContact O-CA 3.26Å; V183-W189 WeakPolarHBondContact O-CA 3.31Å; V183-Y190 PolarHBondContact N-O 3.01Å; V183-Y190 PolarHBondContact O-N 3.06Å
184	N	96.5	Very high	95.8	Very high	60 Å²	60	67 Å²	67	32%	0.321	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.3	174.4	-62.7	7.4	0	0	0	108.5	V208 G212 R214	N184-V208 HydrophobicContact CB-CG2 4.16Å; N184-G212 PolarHBondContact ND2-O 3.01Å; N184-R214 PolarHBondContact OD1-NE 2.99Å; N184-R214 PolarHBondContact OD1-NH2 3.25Å
185	I	94.2	Very high	95.7	Very high	38 Å²	38	62 Å²	62	20%	0.195	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	107.7	175.5	-54	-63	0	0	0	108.3	I172 N173 V183 K187 F188 Y190	I172-I185 HydrophobicContact CG2-CG1 3.98Å; N173-I185 HydrophobicContact CB-CD1 3.66Å; N173-I185 HydrophobicContact CB-CG1 4.15Å; N173-I185 HydrophobicContact CB-CG2 4Å; V183-I185 HydrophobicContact CG1-CD1 4.31Å; V183-I185 HydrophobicContact CG1-CG1 4.13Å; V183-I185 HydrophobicContact CG2-CD1 3.87Å; V183-I185 HydrophobicContact CG2-CG1 4.42Å; I185-K187 PolarHBondContact O-N 3.05Å; I185-F188 CarbonylContact C-O 3.53Å; I185-F188 PolarHBondContact N-O 3.33Å; I185-F188 PolarHBondContact O-N 2.69Å; I185-F188 VanDerWaalsContact O-O 3.07Å; I185-Y190 HydrophobicContact CB-CD2 4.02Å; I185-Y190 HydrophobicContact CB-CE2 3.79Å; I185-Y190 HydrophobicContact CG1-CD2 4Å; I185-Y190 HydrophobicContact CG1-CE2 4.25Å
186	G	93.8	Very high	95.4	Very high	70 Å²	70	59.9 Å²	59.9	72%	0.722	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-127	-174.2	0	0	0	0	0	111.2	F188	G186-F188 VanDerWaalsContact C-N 3.3Å; G186-F188 PolarHBondContact O-N 3.4Å
187	K	95.7	Very high	94.7	Very high	70 Å²	70	61.5 Å²	61.5	30%	0.304	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	9.9	-177.9	-59.4	-165.3	173.8	-162.4	0	114.5	F14 I185 C207 V208 I239	F14-K187 HydrophobicContact CD1-CD 4.29Å; F14-K187 VanDerWaalsContact CD1-CE 3.49Å; F14-K187 VanDerWaalsContact CD2-NZ 3.3Å; F14-K187 VanDerWaalsContact CE1-CE 3.41Å; F14-K187 VanDerWaalsContact CE2-NZ 3.32Å; I185-K187 PolarHBondContact O-N 3.05Å; K187-C207 CarbonylContact O-C 3.5Å; K187-C207 WeakPolarHBondContact O-CA 3.36Å; K187-V208 PolarHBondContact O-N 2.84Å; K187-I239 HydrophobicContact CB-CD1 3.7Å; K187-I239 HydrophobicContact CD-CD1 4.02Å; K187-I239 HydrophobicContact CG-CD1 4.48Å
188	F	96.3	Very high	94	Very high	5 Å²	5	63.1 Å²	63.1	2%	0.022	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.6	-176.3	-57.5	-77.6	0	0	0	110	L16 T18 I185 G186 Y190 V204 G206 L237 I239	L16-F188 HydrophobicContact CB-CE2 4.21Å; L16-F188 VanDerWaalsContact O-CZ 3.28Å; L16-F188 WeakPolarHBondContact O-CZ 3.36Å; T18-F188 HydrophobicContact CG2-CD2 3.54Å; T18-F188 HydrophobicContact CG2-CE2 3.71Å; T18-F188 HydrophobicContact CG2-CG 4.33Å; I185-F188 CarbonylContact C-O 3.53Å; I185-F188 PolarHBondContact N-O 3.33Å; I185-F188 PolarHBondContact O-N 2.69Å; I185-F188 VanDerWaalsContact O-O 3.07Å; G186-F188 VanDerWaalsContact C-N 3.3Å; G186-F188 PolarHBondContact O-N 3.4Å; F188-Y190 HydrophobicContact CB-CE2 3.83Å; F188-V204 HydrophobicContact CB-CG2 4.12Å; F188-V204 HydrophobicContact CD1-CG2 4.43Å; F188-G206 WeakPolarHBondContact CA-O 3.49Å; F188-L237 HydrophobicContact CD1-CB 4.04Å; F188-L237 HydrophobicContact CD1-CD1 4.5Å; F188-L237 HydrophobicContact CE1-CB 3.76Å; F188-I239 HydrophobicContact CE1-CG1 4.33Å
189	W	96.4	Very high	93.6	Very high	21 Å²	21	58 Å²	58	8%	0.08	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.1	171.5	68	-81	0	0	0	110.3	V183 M205 G206 C207 V208 R214 V215 D216	V183-W189 CarbonylContact O-C 3.5Å; V183-W189 VanDerWaalsContact O-CA 3.26Å; V183-W189 WeakPolarHBondContact O-CA 3.31Å; W189-M205 HydrophobicContact CD2-CB 3.69Å; W189-M205 HydrophobicContact CD2-CG 4.5Å; W189-M205 HydrophobicContact CE3-CB 3.54Å; W189-M205 HydrophobicContact CE3-CG 3.88Å; W189-M205 HydrophobicContact CH2-CB 3.16Å; W189-M205 HydrophobicContact CH2-CE 4.35Å; W189-M205 HydrophobicContact CH2-CG 3.69Å; W189-M205 HydrophobicContact CZ2-CB 3.27Å; W189-M205 HydrophobicContact CZ2-CG 4.3Å; W189-M205 HydrophobicContact CZ3-CB 3.29Å; W189-M205 HydrophobicContact CZ3-CG 3.44Å; W189-M205 VanDerWaalsContact CZ3-CG 3.44Å; W189-M205 PolarHBondContact O-N 2.82Å; W189-G206 PolarHBondContact N-O 2.76Å; W189-G206 VanDerWaalsContact NE1-CA 3.29Å; W189-C207 VanDerWaalsContact CD1-O 3.22Å; W189-V208 HydrophobicContact CB-CG2 3.75Å; W189-V208 HydrophobicContact CG-CG2 4.27Å; W189-R214 HydrophobicContact CB-CG 4.11Å; W189-R214 HydrophobicContact CD2-CB 4.21Å; W189-R214 HydrophobicContact CD2-CG 3.97Å; W189-R214 HydrophobicContact CG-CB 4.15Å; W189-R214 HydrophobicContact CG-CG 3.71Å; W189-V215 PolarHBondContact NE1-O 2.99Å; W189-V215 VanDerWaalsContact NE1-O 3.11Å; W189-D216 WeakPolarHBondContact CZ2-OD1 2.99Å
190	Y	96.1	Very high	93.6	Very high	19 Å²	19	56.5 Å²	56.5	8%	0.075	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	155.6	-171.8	-62.2	-98.2	0	0	0	109.6	T18 I172 S182 V183 I185 F188 I202 E203 V204	T18-Y190 WeakPolarHBondContact CB-OH 3.42Å; T18-Y190 WeakPolarHBondContact CG2-OH 2.99Å; T18-Y190 PolarHBondContact OG1-OH 3.46Å; T18-Y190 VanDerWaalsContact OG1-OH 3.13Å; I172-Y190 HydrophobicContact CG2-CD2 4.41Å; I172-Y190 HydrophobicContact CG2-CG 4.19Å; S182-Y190 CarbonylContact C-O 3.53Å; S182-Y190 WeakPolarHBondContact CA-O 3.49Å; S182-Y190 WeakPolarHBondContact CB-O 3.45Å; S182-Y190 PolarHBondContact OG-O 2.83Å; V183-Y190 PolarHBondContact N-O 3.01Å; V183-Y190 PolarHBondContact O-N 3.06Å; I185-Y190 HydrophobicContact CB-CD2 4.02Å; I185-Y190 HydrophobicContact CB-CE2 3.79Å; I185-Y190 HydrophobicContact CG1-CD2 4Å; I185-Y190 HydrophobicContact CG1-CE2 4.25Å; F188-Y190 HydrophobicContact CB-CE2 3.83Å; Y190-I202 HydrophobicContact CD1-CG2 4.02Å; Y190-E203 CarbonylContact C-O 3.56Å; Y190-E203 WeakPolarHBondContact CA-O 3.06Å; Y190-V204 HydrophobicContact CD1-CB 4Å; Y190-V204 HydrophobicContact CD1-CG2 4.38Å; Y190-V204 HydrophobicContact CE1-CB 3.79Å; Y190-V204 HydrophobicContact CE1-CG2 4.01Å
191	R	95.7	Very high	93.5	Very high	89 Å²	89	53 Å²	53	34%	0.336	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137.1	172.9	-170.2	175.7	-164.1	-175.6	1.4	110.1	H180 K181 S182 E203 M205	H180-R191 PolarHBondContact O-NE 2.81Å; K181-R191 WeakPolarHBondContact O-CA 3.35Å; K181-R191 WeakPolarHBondContact O-CG 3.3Å; S182-R191 WeakPolarHBondContact OG-CB 3.35Å; S182-R191 WeakPolarHBondContact OG-CG 3.39Å; R191-E203 PolarHBondContact N-O 3.39Å; R191-E203 PolarHBondContact O-N 2.89Å; R191-M205 HydrophobicContact CB-CG 3.49Å; R191-M205 VanDerWaalsContact CB-CG 3.49Å; R191-M205 HydrophobicContact CB-SD 3.88Å
192	C	96.6	Very high	93.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	111.4	164.9	-171.2	0	0	0	0	108	C170 V177 H180 K181 V200	C170-C192 HydrophobicContact CB-CB 3.66Å; C170-C192 WeakPolarHBondContact CB-SG 3.4Å; C170-C192 PolarHBondContact N-SG 2.95Å; C170-C192 WeakPolarHBondContact SG-CA 3.3Å; C170-C192 WeakPolarHBondContact SG-CB 3.29Å; C170-C192 CovalentContact SG-SG 2.04Å; C170-C192 PolarHBondContact SG-SG 3.24Å; V177-C192 HydrophobicContact CB-CB 4.42Å; V177-C192 HydrophobicContact CG1-CB 3.99Å; H180-C192 VanDerWaalsContact CA-O 3.24Å; H180-C192 WeakPolarHBondContact CA-O 3.31Å; H180-C192 PolarHBondContact N-O 2.99Å; K181-C192 PolarHBondContact O-N 2.94Å; C192-V200 WeakPolarHBondContact SG-CG2 3.4Å
193	S	95.4	Very high	93.2	Very high	9 Å²	9	48.2 Å²	48.2	6%	0.063	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.6	-172.6	-70.6	0	0	0	0	111.2	V200 Q201 E203	S193-V200 CarbonylContact O-C 3.51Å; S193-V200 WeakPolarHBondContact O-CA 3.26Å; S193-V200 WeakPolarHBondContact O-CG2 3.29Å; S193-Q201 PolarHBondContact N-O 3.41Å; S193-Q201 PolarHBondContact O-N 2.04Å; S193-E203 VanDerWaalsContact CB-OE2 3.24Å; S193-E203 WeakPolarHBondContact CB-OE2 3.09Å; S193-E203 PolarHBondContact OG-OE2 3.41Å
194	R	94.5	Very high	93.1	Very high	173 Å²	173	49.1 Å²	49.1	65%	0.653	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	144.3	169.9	-71.4	-172.4	178.8	-164.1	0.3	110	I179	I179-R194 HydrophobicContact CG2-CG 3.66Å
195	Y	90.8	Very high	93.1	Very high	92 Å²	92	48.6 Å²	48.6	36%	0.361	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	116.7	176.8	179.8	-105.5	0	0	0	110.9	K23 L25 G199	K23-Y195 HydrophobicContact CB-CD1 4.32Å; K23-Y195 HydrophobicContact CD-CD1 4.04Å; K23-Y195 HydrophobicContact CD-CD2 4.07Å; K23-Y195 HydrophobicContact CD-CE1 3.76Å; K23-Y195 HydrophobicContact CD-CE2 3.79Å; K23-Y195 HydrophobicContact CD-CG 4.17Å; L25-Y195 HydrophobicContact CD2-CD1 4.22Å; L25-Y195 HydrophobicContact CD2-CE1 4.36Å; Y195-G199 PolarHBondContact N-O 2.97Å; Y195-G199 CarbonylContact O-C 3.39Å; Y195-G199 WeakPolarHBondContact O-CA 3.37Å; Y195-G199 PolarHBondContact O-N 3.32Å
196	G	87.1	Confident	93.2	Very high	61 Å²	61	46.8 Å²	46.8	63%	0.629	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	-151	179.9	0	0	0	0	0	113.8	G198	G196-G198 PolarHBondContact O-N 3.47Å
197	N	81.9	Confident	93.4	Very high	169 Å²	169	43.5 Å²	43.5	90%	0.904	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	84.1	-178.4	-74.2	-13.3	0	0	0	111.6	G199	N197-G199 VanDerWaalsContact C-N 3.34Å; N197-G199 PolarHBondContact O-N 3Å
198	G	83.3	Confident	93.4	Very high	42 Å²	42	40.8 Å²	40.8	43%	0.433	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	-2.1	173	0	0	0	0	0	115.4	T26 G196	T26-G198 PolarHBondContact OG1-O 2.91Å; G196-G198 PolarHBondContact O-N 3.47Å
199	G	89.7	Confident	93.4	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	167.8	172.4	0	0	0	0	0	112.8	C24 Y195 N197	C24-G199 CarbonylContact O-C 3.54Å; C24-G199 WeakPolarHBondContact O-CA 3.36Å; Y195-G199 PolarHBondContact N-O 2.97Å; Y195-G199 CarbonylContact O-C 3.39Å; Y195-G199 WeakPolarHBondContact O-CA 3.37Å; Y195-G199 PolarHBondContact O-N 3.32Å; N197-G199 VanDerWaalsContact C-N 3.34Å; N197-G199 PolarHBondContact O-N 3Å
200	V	94.7	Very high	93.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.8	178.1	56.7	0	0	0	0	108.9	C24 F152 A167 C170 I179 C192 S193	C24-V200 PolarHBondContact N-O 2.84Å; C24-V200 PolarHBondContact O-N 2.64Å; F152-V200 HydrophobicContact CB-CG1 4.14Å; F152-V200 HydrophobicContact CD1-CB 4.18Å; F152-V200 HydrophobicContact CD1-CG1 3.3Å; F152-V200 HydrophobicContact CD1-CG2 3.95Å; F152-V200 HydrophobicContact CE1-CB 4.43Å; F152-V200 HydrophobicContact CE1-CG1 3.87Å; F152-V200 HydrophobicContact CE1-CG2 4.12Å; F152-V200 HydrophobicContact CG-CG1 3.87Å; A167-V200 HydrophobicContact CB-CB 3.89Å; A167-V200 HydrophobicContact CB-CG1 3.58Å; C170-V200 WeakPolarHBondContact SG-CG2 3.47Å; I179-V200 HydrophobicContact CG1-CG2 4.39Å; C192-V200 WeakPolarHBondContact SG-CG2 3.4Å; S193-V200 CarbonylContact O-C 3.51Å; S193-V200 WeakPolarHBondContact O-CA 3.26Å; S193-V200 WeakPolarHBondContact O-CG2 3.29Å
201	Q	95	Very high	93.3	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.084	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.3	176.4	66.8	-174.6	3.7	0	0	111.7	E22 K23 S193 E203	E22-Q201 WeakPolarHBondContact O-CA 3.32Å; E22-Q201 VanDerWaalsContact O-CB 3.31Å; E22-Q201 WeakPolarHBondContact O-CB 3.09Å; K23-Q201 HydrophobicContact CB-CB 4.33Å; K23-Q201 HydrophobicContact CG-CB 3.84Å; S193-Q201 PolarHBondContact N-O 3.41Å; S193-Q201 PolarHBondContact O-N 2.04Å; Q201-E203 HydrophobicContact CG-CG 4.07Å; Q201-E203 PolarHBondContact NE2-OE1 2.89Å
202	I	95.1	Very high	93.3	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	170	-64.4	162.9	0	0	0	106.9	S21 E22 F152 C170 I172 Y190	S21-I202 WeakPolarHBondContact CA-O 3.39Å; E22-I202 PolarHBondContact O-N 3.37Å; F152-I202 HydrophobicContact CE1-CD1 4.19Å; F152-I202 HydrophobicContact CE1-CG1 3.92Å; F152-I202 HydrophobicContact CZ-CD1 4.28Å; F152-I202 HydrophobicContact CZ-CG1 4.28Å; C170-I202 HydrophobicContact CB-CD1 4.16Å; C170-I202 HydrophobicContact CB-CG1 3.78Å; I172-I202 HydrophobicContact CD1-CG1 4.21Å; I172-I202 HydrophobicContact CD1-CG2 3.9Å; I172-I202 HydrophobicContact CG1-CD1 3.96Å; I172-I202 HydrophobicContact CG1-CG1 4.03Å; I172-I202 HydrophobicContact CG1-CG2 4.15Å; Y190-I202 HydrophobicContact CD1-CG2 4.02Å
203	E	92.6	Very high	93.4	Very high	55 Å²	55	52.8 Å²	52.8	26%	0.257	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.8	176.8	-69.4	168.5	163.9	0	0	109.5	Y190 R191 S193 Q201 M205	Y190-E203 CarbonylContact C-O 3.56Å; Y190-E203 WeakPolarHBondContact CA-O 3.06Å; R191-E203 PolarHBondContact N-O 3.39Å; R191-E203 PolarHBondContact O-N 2.89Å; S193-E203 VanDerWaalsContact CB-OE2 3.24Å; S193-E203 WeakPolarHBondContact CB-OE2 3.09Å; S193-E203 PolarHBondContact OG-OE2 3.41Å; Q201-E203 HydrophobicContact CG-CG 4.07Å; Q201-E203 PolarHBondContact NE2-OE1 2.89Å; E203-M205 HydrophobicContact CB-SD 3.73Å
204	V	94.6	Very high	93.5	Very high	32 Å²	32	58.1 Å²	58.1	19%	0.194	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	120	160.6	64.5	0	0	0	0	107.4	F188 Y190 L237	F188-V204 HydrophobicContact CB-CG2 4.12Å; F188-V204 HydrophobicContact CD1-CG2 4.43Å; Y190-V204 HydrophobicContact CD1-CB 4Å; Y190-V204 HydrophobicContact CD1-CG2 4.38Å; Y190-V204 HydrophobicContact CE1-CB 3.79Å; Y190-V204 HydrophobicContact CE1-CG2 4.01Å; V204-L237 HydrophobicContact CG1-CD1 4.33Å; V204-L237 HydrophobicContact CG1-CG 4.04Å; V204-L237 HydrophobicContact CG2-CD1 3.69Å; V204-L237 HydrophobicContact CG2-CG 4.09Å
205	M	95.2	Very high	93.6	Very high	50 Å²	50	50.7 Å²	50.7	25%	0.246	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-23.1	-172.8	-62.5	-60.5	-54.3	0	0	112.6	W189 R191 E203 A217	W189-M205 HydrophobicContact CD2-CB 3.69Å; W189-M205 HydrophobicContact CD2-CG 4.5Å; W189-M205 HydrophobicContact CE3-CB 3.54Å; W189-M205 HydrophobicContact CE3-CG 3.88Å; W189-M205 HydrophobicContact CH2-CB 3.16Å; W189-M205 HydrophobicContact CH2-CE 4.35Å; W189-M205 HydrophobicContact CH2-CG 3.69Å; W189-M205 HydrophobicContact CZ2-CB 3.27Å; W189-M205 HydrophobicContact CZ2-CG 4.3Å; W189-M205 HydrophobicContact CZ3-CB 3.29Å; W189-M205 HydrophobicContact CZ3-CG 3.44Å; W189-M205 VanDerWaalsContact CZ3-CG 3.44Å; W189-M205 PolarHBondContact O-N 2.82Å; R191-M205 HydrophobicContact CB-CG 3.49Å; R191-M205 VanDerWaalsContact CB-CG 3.49Å; R191-M205 HydrophobicContact CB-SD 3.88Å; E203-M205 HydrophobicContact CB-SD 3.73Å; M205-A217 PolarHBondContact O-N 3.48Å
206	G	97	Very high	93.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	-166.1	-175.5	0	0	0	0	0	113.9	F188 W189 V215	F188-G206 WeakPolarHBondContact CA-O 3.49Å; W189-G206 PolarHBondContact N-O 2.76Å; W189-G206 VanDerWaalsContact NE1-CA 3.29Å; G206-V215 CarbonylContact C-O 3.58Å; G206-V215 WeakPolarHBondContact CA-O 3.02Å
207	C	97.2	Very high	94.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	160.1	-175.3	-59.7	0	0	0	0	111.1	K187 W189 V215 F221 C230 I239	K187-C207 CarbonylContact O-C 3.5Å; K187-C207 WeakPolarHBondContact O-CA 3.36Å; W189-C207 VanDerWaalsContact CD1-O 3.22Å; C207-V215 PolarHBondContact N-O 2.79Å; C207-V215 PolarHBondContact O-N 2.83Å; C207-F221 HydrophobicContact CB-CE1 4.29Å; C207-F221 HydrophobicContact CB-CZ 4.43Å; C207-C230 HydrophobicContact CB-CB 3.71Å; C207-C230 WeakPolarHBondContact CB-SG 3.3Å; C207-C230 PolarHBondContact N-SG 3.24Å; C207-C230 WeakPolarHBondContact SG-CA 3.46Å; C207-C230 WeakPolarHBondContact SG-CB 3.37Å; C207-C230 CovalentContact SG-SG 2.04Å; C207-C230 PolarHBondContact SG-SG 2.89Å; C207-I239 HydrophobicContact CB-CD1 3.93Å; C207-I239 HydrophobicContact CB-CG1 3.9Å; C207-I239 WeakPolarHBondContact SG-CG1 3.5Å
208	V	97	Very high	95.1	Very high	13 Å²	13	43.5 Å²	43.5	8%	0.079	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.7	176.3	-178.9	0	0	0	0	107.7	N184 K187 W189 R213	N184-V208 HydrophobicContact CB-CG2 4.16Å; K187-V208 PolarHBondContact O-N 2.84Å; W189-V208 HydrophobicContact CB-CG2 3.75Å; W189-V208 HydrophobicContact CG-CG2 4.27Å; V208-R213 WeakPolarHBondContact CA-O 3.29Å
209	D	95.7	Very high	95.8	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.043	24%	0.238	C	C	.	.			trans	-78.2	175.3	177.9	76.6	1.7	0	0	0	112.4	H211 G212 R213 F221 D223	D209-H211 PolarHBondContact O-N 3.15Å; D209-H211 VanDerWaalsContact O-N 3.09Å; D209-H211 WeakPolarHBondContact OD1-CA 3.43Å; D209-H211 WeakPolarHBondContact OD1-CB 3.41Å; D209-H211 PolarHBondContact OD1-N 3.11Å; D209-G212 PolarHBondContact O-N 2.87Å; D209-G212 PolarHBondContact OD1-N 3.39Å; D209-R213 PolarHBondContact N-O 3.26Å; D209-R213 VanDerWaalsContact N-O 3.1Å; D209-R213 WeakPolarHBondContact OD1-CB 3.4Å; D209-R213 PolarHBondContact OD1-N 3.41Å; D209-R213 IonicContact OD1-NE 2.7Å; D209-R213 IonicContact OD2-CZ 3.93Å; D209-R213 IonicContact OD2-NE 3.61Å; D209-R213 PolarHBondContact OD2-NE 2.78Å; D209-R213 IonicContact OD2-NH2 3Å; D209-R213 PolarHBondContact OD2-NH2 2.83Å; D209-F221 HydrophobicContact CB-CD2 3.91Å; D209-F221 HydrophobicContact CB-CE2 3.89Å; D209-D223 HydrophobicContact CB-CB 4.4Å
210	S	95.4	Very high	96.1	Very high	65 Å²	65	50.2 Å²	50.2	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.4	179.9	72.8	0	0	0	0	114.5	D223	S210-D223 VanDerWaalsContact CB-OD1 3.25Å; S210-D223 WeakPolarHBondContact CB-OD1 3.49Å; S210-D223 WeakPolarHBondContact CB-OD2 3.46Å; S210-D223 PolarHBondContact N-OD2 3.36Å; S210-D223 PolarHBondContact OG-OD1 3.38Å
211	H	95.5	Very high	96.2	Very high	139 Å²	139	51 Å²	51	64%	0.644	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	1.4	176.4	-60	-57.5	0	0	0	113.2	D209 R213	D209-H211 PolarHBondContact O-N 3.15Å; D209-H211 VanDerWaalsContact O-N 3.09Å; D209-H211 WeakPolarHBondContact OD1-CA 3.43Å; D209-H211 WeakPolarHBondContact OD1-CB 3.41Å; D209-H211 PolarHBondContact OD1-N 3.11Å; H211-R213 VanDerWaalsContact C-N 3.33Å; H211-R213 HydrophobicContact CB-CG 4.36Å
212	G	95.9	Very high	96.2	Very high	38 Å²	38	53.6 Å²	53.6	39%	0.392	28%	0.28	S	S	.	.			trans	81.5	8	-179	0	0	0	0	0	114.6	N184 D209	N184-G212 PolarHBondContact ND2-O 3.01Å; D209-G212 PolarHBondContact O-N 2.87Å; D209-G212 PolarHBondContact OD1-N 3.39Å
213	R	97.3	Very high	96.1	Very high	137 Å²	137	54.2 Å²	54.2	52%	0.517	28%	0.283	S	S	.	.			trans	-75.7	138.9	177.9	-57.9	-178.9	-64.4	178.6	2.9	109.8	V208 D209 H211	V208-R213 WeakPolarHBondContact CA-O 3.29Å; D209-R213 PolarHBondContact N-O 3.26Å; D209-R213 VanDerWaalsContact N-O 3.1Å; D209-R213 WeakPolarHBondContact OD1-CB 3.4Å; D209-R213 PolarHBondContact OD1-N 3.41Å; D209-R213 IonicContact OD1-NE 2.7Å; D209-R213 IonicContact OD2-CZ 3.93Å; D209-R213 IonicContact OD2-NE 3.61Å; D209-R213 PolarHBondContact OD2-NE 2.78Å; D209-R213 IonicContact OD2-NH2 3Å; D209-R213 PolarHBondContact OD2-NH2 2.83Å; H211-R213 VanDerWaalsContact C-N 3.33Å; H211-R213 HydrophobicContact CB-CG 4.36Å
214	R	97.7	Very high	95.9	Very high	120 Å²	120	57.9 Å²	57.9	45%	0.453	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.9	178.1	-67.3	176.9	178	163.8	0	109.8	S182 N184 W189	S182-R214 PolarHBondContact O-NH2 3.12Å; N184-R214 PolarHBondContact OD1-NE 2.99Å; N184-R214 PolarHBondContact OD1-NH2 3.25Å; W189-R214 HydrophobicContact CB-CG 4.11Å; W189-R214 HydrophobicContact CD2-CB 4.21Å; W189-R214 HydrophobicContact CD2-CG 3.97Å; W189-R214 HydrophobicContact CG-CB 4.15Å; W189-R214 HydrophobicContact CG-CG 3.71Å
215	V	97.8	Very high	95.5	Very high	18 Å²	18	59 Å²	59	11%	0.109	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.5	177	179.6	0	0	0	0	107	W189 G206 C207 A219 F221 C230	W189-V215 PolarHBondContact NE1-O 2.99Å; W189-V215 VanDerWaalsContact NE1-O 3.11Å; G206-V215 CarbonylContact C-O 3.58Å; G206-V215 WeakPolarHBondContact CA-O 3.02Å; C207-V215 PolarHBondContact N-O 2.79Å; C207-V215 PolarHBondContact O-N 2.83Å; V215-A219 HydrophobicContact CG1-CB 3.74Å; V215-F221 HydrophobicContact CB-CB 4.45Å; V215-F221 HydrophobicContact CB-CD1 4.23Å; V215-F221 HydrophobicContact CB-CG 4.35Å; V215-F221 HydrophobicContact CG1-CB 3.95Å; V215-F221 HydrophobicContact CG1-CD1 3.7Å; V215-F221 HydrophobicContact CG1-CE1 4.47Å; V215-F221 HydrophobicContact CG1-CG 4.04Å; V215-F221 HydrophobicContact CG2-CB 3.68Å; V215-F221 HydrophobicContact CG2-CD1 4.1Å; V215-F221 HydrophobicContact CG2-CD2 4.12Å; V215-F221 HydrophobicContact CG2-CG 3.72Å; V215-C230 HydrophobicContact CG1-CB 4.32Å
216	D	97.6	Very high	95.4	Very high	102 Å²	102	57.8 Å²	57.8	55%	0.545	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	153.8	-179.8	-66.5	-29.8	0	0	0	111.6	W189 A219	W189-D216 WeakPolarHBondContact CZ2-OD1 2.99Å; D216-A219 VanDerWaalsContact O-CB 3.28Å; D216-A219 WeakPolarHBondContact O-CB 3.33Å; D216-A219 PolarHBondContact O-N 3.36Å; D216-A219 VanDerWaalsContact O-N 3.11Å
217	A	96	Very high	95.4	Very high	30 Å²	30	57.9 Å²	57.9	25%	0.248	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	139.2	170.2	0	0	0	0	0	111.2	M205 A219 E232 L237	M205-A217 PolarHBondContact O-N 3.48Å; A217-A219 PolarHBondContact O-N 3Å; A217-E232 HydrophobicContact CB-CG 3.84Å; A217-E232 VanDerWaalsContact CB-OE1 3.29Å; A217-E232 WeakPolarHBondContact CB-OE1 3.17Å; A217-L237 HydrophobicContact CB-CD1 4.07Å; A217-L237 HydrophobicContact CB-CD2 3.75Å
218	G	96.4	Very high	95.4	Very high	39 Å²	39	59.3 Å²	59.3	40%	0.402	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-9.9	-174.5	0	0	0	0	0	115.1	H229 C230	G218-H229 PolarHBondContact O-CD2 2.84Å; G218-H229 PolarHBondContact O-NE2 3.01Å; G218-C230 WeakPolarHBondContact CA-O 3.31Å; G218-C230 PolarHBondContact N-O 2.73Å
219	A	97.8	Very high	95.4	Very high	35 Å²	35	60.9 Å²	60.9	29%	0.289	33%	0.328	S	S	.	.			trans	-83.3	147.8	-179.8	0	0	0	0	0	112.5	V215 D216 A217 C230	V215-A219 HydrophobicContact CG1-CB 3.74Å; D216-A219 VanDerWaalsContact O-CB 3.28Å; D216-A219 WeakPolarHBondContact O-CB 3.33Å; D216-A219 PolarHBondContact O-N 3.36Å; D216-A219 VanDerWaalsContact O-N 3.11Å; A217-A219 PolarHBondContact O-N 3Å; A219-C230 PolarHBondContact O-N 2.69Å
220	R	97	Very high	95.5	Very high	149 Å²	149	60.5 Å²	60.5	56%	0.562	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	149.4	167.6	-65.1	-179.5	179.5	171.8	-1.6	110.2	L227 F228 H229	R220-L227 HydrophobicContact CB-CD1 4.08Å; R220-F228 CarbonylContact C-O 3.44Å; R220-F228 WeakPolarHBondContact CA-O 3.35Å; R220-F228 WeakPolarHBondContact CB-O 3.02Å; R220-H229 HydrophobicContact CG-CB 4.22Å
221	F	96.9	Very high	95.5	Very high	16 Å²	16	60.6 Å²	60.6	7%	0.07	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	152.9	-179.6	65.1	-79.1	0	0	0	112.1	C207 D209 V215 D223 F228 C230 I239	C207-F221 HydrophobicContact CB-CE1 4.29Å; C207-F221 HydrophobicContact CB-CZ 4.43Å; D209-F221 HydrophobicContact CB-CD2 3.91Å; D209-F221 HydrophobicContact CB-CE2 3.89Å; V215-F221 HydrophobicContact CB-CB 4.45Å; V215-F221 HydrophobicContact CB-CD1 4.23Å; V215-F221 HydrophobicContact CB-CG 4.35Å; V215-F221 HydrophobicContact CG1-CB 3.95Å; V215-F221 HydrophobicContact CG1-CD1 3.7Å; V215-F221 HydrophobicContact CG1-CE1 4.47Å; V215-F221 HydrophobicContact CG1-CG 4.04Å; V215-F221 HydrophobicContact CG2-CB 3.68Å; V215-F221 HydrophobicContact CG2-CD1 4.1Å; V215-F221 HydrophobicContact CG2-CD2 4.12Å; V215-F221 HydrophobicContact CG2-CG 3.72Å; F221-D223 HydrophobicContact CD2-CB 4.04Å; F221-D223 HydrophobicContact CE2-CB 3.91Å; F221-F228 HydrophobicContact CD1-CB 3.92Å; F221-F228 HydrophobicContact CD2-CB 4.26Å; F221-F228 HydrophobicContact CE1-CB 3.5Å; F221-F228 HydrophobicContact CE2-CB 3.86Å; F221-F228 HydrophobicContact CE2-CD2 4.3Å; F221-F228 HydrophobicContact CE2-CG 4.29Å; F221-F228 HydrophobicContact CG-CB 4.3Å; F221-F228 HydrophobicContact CZ-CB 3.47Å; F221-F228 VanDerWaalsContact CZ-CB 3.47Å; F221-F228 HydrophobicContact CZ-CG 4.13Å; F221-F228 PolarHBondContact N-O 2.91Å; F221-F228 PolarHBondContact O-N 2.83Å; F221-C230 HydrophobicContact CE1-CB 4.28Å; F221-I239 HydrophobicContact CE1-CG2 4.4Å; F221-I239 HydrophobicContact CZ-CD1 4.43Å; F221-I239 HydrophobicContact CZ-CG1 4.42Å; F221-I239 HydrophobicContact CZ-CG2 3.91Å
222	H	94.6	Very high	95.5	Very high	73 Å²	73	59.9 Å²	59.9	34%	0.338	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127	177.3	-58.7	179.1	0	0	0	108.7	F226 E254	H222-F226 WeakPolarHBondContact CA-O 3.23Å; H222-E254 IonicContact CD2-OE1 3.82Å; H222-E254 IonicContact CE1-OE1 2.88Å; H222-E254 WeakPolarHBondContact NE2-CG 3.32Å; H222-E254 IonicContact NE2-OE1 2.69Å; H222-E254 PolarHBondContact NE2-OE1 2.95Å
223	D	93.2	Very high	95.2	Very high	20 Å²	20	62.8 Å²	62.8	11%	0.107	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136.8	173.8	-161.7	10.9	0	0	0	109.8	D209 S210 F221 G225 F226 F228	D209-D223 HydrophobicContact CB-CB 4.4Å; S210-D223 VanDerWaalsContact CB-OD1 3.25Å; S210-D223 WeakPolarHBondContact CB-OD1 3.49Å; S210-D223 WeakPolarHBondContact CB-OD2 3.46Å; S210-D223 PolarHBondContact N-OD2 3.36Å; S210-D223 PolarHBondContact OG-OD1 3.38Å; F221-D223 HydrophobicContact CD2-CB 4.04Å; F221-D223 HydrophobicContact CE2-CB 3.91Å; D223-G225 PolarHBondContact O-N 3.07Å; D223-F226 PolarHBondContact N-O 2.88Å; D223-F226 PolarHBondContact O-N 2.76Å; D223-F228 HydrophobicContact CB-CD2 3.71Å; D223-F228 HydrophobicContact CB-CE2 3.81Å; D223-F228 WeakPolarHBondContact O-CE2 3.34Å
224	L	88	Confident	94.6	Very high	132 Å²	132	66 Å²	66	69%	0.691	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	34	178.4	-56.2	176.7	0	0	0	115.1	F226	L224-F226 WeakPolarHBondContact O-CD2 3.41Å
225	G	86.5	Confident	93.8	Very high	55 Å²	55	64.8 Å²	64.8	57%	0.567	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	2.8	179.1	0	0	0	0	0	116	D223	D223-G225 PolarHBondContact O-N 3.07Å
226	F	93.4	Very high	93.4	Very high	25 Å²	25	64.8 Å²	64.8	11%	0.11	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	161.5	177.8	-60.1	-76.7	0	0	0	111.6	L8 A10 H222 D223 L224 F228 F241 V282	L8-F226 HydrophobicContact CB-CZ 4.27Å; A10-F226 HydrophobicContact CB-CE2 4Å; A10-F226 HydrophobicContact CB-CZ 4.13Å; H222-F226 WeakPolarHBondContact CA-O 3.23Å; D223-F226 PolarHBondContact N-O 2.88Å; D223-F226 PolarHBondContact O-N 2.76Å; L224-F226 WeakPolarHBondContact O-CD2 3.41Å; F226-F228 HydrophobicContact CB-CD2 4.44Å; F226-F228 HydrophobicContact CB-CE2 3.88Å; F226-F228 HydrophobicContact CB-CZ 4.27Å; F226-F241 HydrophobicContact CB-CD1 4.23Å; F226-F241 HydrophobicContact CB-CE1 4.1Å; F226-F241 HydrophobicContact CD2-CE1 4.41Å; F226-F241 HydrophobicContact CG-CE1 4.14Å; F226-V282 HydrophobicContact CD1-CB 4.38Å; F226-V282 HydrophobicContact CD1-CG1 3.29Å; F226-V282 HydrophobicContact CD1-CG2 4.17Å; F226-V282 HydrophobicContact CE1-CG1 3.53Å; F226-V282 HydrophobicContact CE1-CG2 4.48Å; F226-V282 HydrophobicContact CG-CG1 3.95Å; F226-V282 HydrophobicContact CZ-CG1 4.35Å
227	L	97	Very high	93.3	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	121.6	172.4	-173.5	64.4	0	0	0	108.7	R220 A242 G243 V245 E254	R220-L227 HydrophobicContact CB-CD1 4.08Å; L227-A242 HydrophobicContact CD2-CB 4.29Å; L227-A242 HydrophobicContact CG-CB 4.09Å; L227-A242 PolarHBondContact O-N 3.1Å; L227-G243 WeakPolarHBondContact CB-O 3.44Å; L227-G243 PolarHBondContact N-O 2.91Å; L227-G243 VanDerWaalsContact N-O 3.08Å; L227-G243 PolarHBondContact O-N 2.81Å; L227-V245 HydrophobicContact CB-CG2 3.94Å; L227-V245 HydrophobicContact CD1-CG2 4.48Å; L227-E254 HydrophobicContact CD1-CG 3.88Å; L227-E254 HydrophobicContact CD2-CB 3.91Å; L227-E254 HydrophobicContact CD2-CG 4Å
228	F	97.3	Very high	93.2	Very high	31 Å²	31	58.9 Å²	58.9	14%	0.136	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	158.6	174.9	-69	-84.2	0	0	0	110.9	R220 F221 D223 F226 I239 V240 F241	R220-F228 CarbonylContact C-O 3.44Å; R220-F228 WeakPolarHBondContact CA-O 3.35Å; R220-F228 WeakPolarHBondContact CB-O 3.02Å; F221-F228 HydrophobicContact CD1-CB 3.92Å; F221-F228 HydrophobicContact CD2-CB 4.26Å; F221-F228 HydrophobicContact CE1-CB 3.5Å; F221-F228 HydrophobicContact CE2-CB 3.86Å; F221-F228 HydrophobicContact CE2-CD2 4.3Å; F221-F228 HydrophobicContact CE2-CG 4.29Å; F221-F228 HydrophobicContact CG-CB 4.3Å; F221-F228 HydrophobicContact CZ-CB 3.47Å; F221-F228 VanDerWaalsContact CZ-CB 3.47Å; F221-F228 HydrophobicContact CZ-CG 4.13Å; F221-F228 PolarHBondContact N-O 2.91Å; F221-F228 PolarHBondContact O-N 2.83Å; D223-F228 HydrophobicContact CB-CD2 3.71Å; D223-F228 HydrophobicContact CB-CE2 3.81Å; D223-F228 WeakPolarHBondContact O-CE2 3.34Å; F226-F228 HydrophobicContact CB-CD2 4.44Å; F226-F228 HydrophobicContact CB-CE2 3.88Å; F226-F228 HydrophobicContact CB-CZ 4.27Å; F228-I239 HydrophobicContact CB-CG2 4.12Å; F228-I239 HydrophobicContact CD1-CG2 3.57Å; F228-I239 HydrophobicContact CE1-CG2 4.3Å; F228-I239 HydrophobicContact CG-CG2 4.09Å; F228-V240 CarbonylContact C-O 3.48Å; F228-V240 VanDerWaalsContact CA-O 3.29Å; F228-V240 WeakPolarHBondContact CA-O 3.44Å; F228-F241 AromaticContact CD1-CD1 4Å; F228-F241 HydrophobicContact CD1-CD1 4Å; F228-F241 HydrophobicContact CD1-CE1 4.28Å; F228-F241 AromaticContact CE1-CD1 3.47Å; F228-F241 HydrophobicContact CE1-CD1 3.47Å; F228-F241 VanDerWaalsContact CE1-CD1 3.47Å; F228-F241 AromaticContact CE1-CE1 3.31Å; F228-F241 HydrophobicContact CE1-CE1 3.31Å; F228-F241 HydrophobicContact CE1-CG 4.23Å; F228-F241 AromaticContact CE1-CZ 3.96Å; F228-F241 HydrophobicContact CE1-CZ 3.96Å; F228-F241 HydrophobicContact CE2-CE1 4.34Å; F228-F241 AromaticContact CZ-CD1 3.85Å; F228-F241 HydrophobicContact CZ-CD1 3.85Å; F228-F241 AromaticContact CZ-CE1 3.36Å; F228-F241 HydrophobicContact CZ-CE1 3.36Å; F228-F241 HydrophobicContact CZ-CZ 4.14Å
229	H	97.3	Very high	93.2	Very high	46 Å²	46	58.1 Å²	58.1	21%	0.213	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125	171	177.3	-160.4	0	0	0	109.2	G218 R220 K231 V240 A242	G218-H229 PolarHBondContact O-CD2 2.84Å; G218-H229 PolarHBondContact O-NE2 3.01Å; R220-H229 HydrophobicContact CG-CB 4.22Å; H229-K231 PolarHBondContact O-N 2.03Å; H229-V240 HydrophobicContact CB-CG2 4.08Å; H229-V240 PolarHBondContact N-O 2.75Å; H229-V240 PolarHBondContact O-N 2.93Å; H229-V240 VanDerWaalsContact O-N 3.15Å; H229-A242 HydrophobicContact CB-CB 3.77Å
230	C	97.1	Very high	93.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	76.1	170.9	-169.1	0	0	0	0	109.6	C207 V215 G218 A219 F221 T238	C207-C230 HydrophobicContact CB-CB 3.71Å; C207-C230 WeakPolarHBondContact CB-SG 3.3Å; C207-C230 PolarHBondContact N-SG 3.24Å; C207-C230 WeakPolarHBondContact SG-CA 3.46Å; C207-C230 WeakPolarHBondContact SG-CB 3.37Å; C207-C230 CovalentContact SG-SG 2.04Å; C207-C230 PolarHBondContact SG-SG 2.89Å; V215-C230 HydrophobicContact CG1-CB 4.32Å; G218-C230 WeakPolarHBondContact CA-O 3.31Å; G218-C230 PolarHBondContact N-O 2.73Å; A219-C230 PolarHBondContact O-N 2.69Å; F221-C230 HydrophobicContact CE1-CB 4.28Å; C230-T238 CarbonylContact C-O 3.5Å
231	K	96.1	Very high	93.1	Very high	66 Å²	66	50.2 Å²	50.2	29%	0.287	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.4	-166.6	-177.4	174.5	178.2	178.1	0	111.6	H229 T238 V240 E279	H229-K231 PolarHBondContact O-N 2.03Å; K231-T238 HydrophobicContact CB-CG2 3.98Å; K231-T238 PolarHBondContact N-O 3.3Å; K231-T238 PolarHBondContact O-N 2.84Å; K231-V240 HydrophobicContact CB-CG2 3.94Å; K231-V240 HydrophobicContact CD-CG2 4Å; K231-E279 IonicContact NZ-OE1 3.61Å; K231-E279 PolarHBondContact NZ-OE1 2.95Å; K231-E279 IonicContact NZ-OE2 3.12Å; K231-E279 PolarHBondContact NZ-OE2 2.97Å
232	E	93.8	Very high	93.2	Very high	124 Å²	124	50 Å²	50	58%	0.579	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	141.3	170.9	-68.2	179.2	-162.7	0	0	111.5	A217 L237	A217-E232 HydrophobicContact CB-CG 3.84Å; A217-E232 VanDerWaalsContact CB-OE1 3.29Å; A217-E232 WeakPolarHBondContact CB-OE1 3.17Å; E232-L237 HydrophobicContact CB-CD2 4.25Å; E232-L237 HydrophobicContact CG-CD2 3.64Å
233	K	90.8	Very high	93.3	Very high	99 Å²	99	46.6 Å²	46.6	43%	0.43	25%	0.248	S	C	.	.			trans	-122.2	169	171.6	-69.8	-172.4	172.5	177.4	0	109.5	V235 G236 T238	K233-V235 PolarHBondContact O-N 2.62Å; K233-V235 VanDerWaalsContact O-N 3.15Å; K233-G236 PolarHBondContact N-O 3.41Å; K233-T238 HydrophobicContact CD-CG2 4.28Å; K233-T238 VanDerWaalsContact CE-CG2 3.44Å; K233-T238 HydrophobicContact CG-CG2 4.39Å
234	E	83.7	Confident	93.4	Very high	205 Å²	205	45.7 Å²	45.7	96%	0.958	24%	0.243	S	C	*	.	S	Bend	trans	-50.6	-38.2	170.1	-67.4	-177	173.7	0	0	112
235	V	82.4	Confident	93.7	Very high	94 Å²	94	41 Å²	41	57%	0.57	22%	0.22	S	C	*	.	S	Bend	trans	-126.9	98.1	174.9	-170.7	0	0	0	0	109.3	A19 K233	A19-V235 HydrophobicContact CB-CG1 3.38Å; K233-V235 PolarHBondContact O-N 2.62Å; K233-V235 VanDerWaalsContact O-N 3.15Å
236	G	89.3	Confident	94.1	Very high	19 Å²	19	39.2 Å²	39.2	20%	0.196	20%	0.199	C	C	.	.	S	Bend	trans	85.7	-155.3	169.9	0	0	0	0	0	115.5	T18 K233	T18-G236 VanDerWaalsContact O-CA 3.23Å; T18-G236 WeakPolarHBondContact O-CA 3.49Å; K233-G236 PolarHBondContact N-O 3.41Å
237	L	94.3	Very high	94.1	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	158.3	-176.3	-59	-177.7	0	0	0	112.1	F188 V204 A217 E232	F188-L237 HydrophobicContact CD1-CB 4.04Å; F188-L237 HydrophobicContact CD1-CD1 4.5Å; F188-L237 HydrophobicContact CE1-CB 3.76Å; V204-L237 HydrophobicContact CG1-CD1 4.33Å; V204-L237 HydrophobicContact CG1-CG 4.04Å; V204-L237 HydrophobicContact CG2-CD1 3.69Å; V204-L237 HydrophobicContact CG2-CG 4.09Å; A217-L237 HydrophobicContact CB-CD1 4.07Å; A217-L237 HydrophobicContact CB-CD2 3.75Å; E232-L237 HydrophobicContact CB-CD2 4.25Å; E232-L237 HydrophobicContact CG-CD2 3.64Å
238	T	95.1	Very high	93.8	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.7	168.5	-159.5	0	0	0	0	110.3	C230 K231 K233 V240	C230-T238 CarbonylContact C-O 3.5Å; K231-T238 HydrophobicContact CB-CG2 3.98Å; K231-T238 PolarHBondContact N-O 3.3Å; K231-T238 PolarHBondContact O-N 2.84Å; K233-T238 HydrophobicContact CD-CG2 4.28Å; K233-T238 VanDerWaalsContact CE-CG2 3.44Å; K233-T238 HydrophobicContact CG-CG2 4.39Å; T238-V240 HydrophobicContact CG2-CG1 3.85Å
239	I	95.9	Very high	93.3	Very high	23 Å²	23	52.1 Å²	52.1	12%	0.118	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.7	172	-63.7	168	0	0	0	107.4	K187 F188 C207 F221 F228	K187-I239 HydrophobicContact CB-CD1 3.7Å; K187-I239 HydrophobicContact CD-CD1 4.02Å; K187-I239 HydrophobicContact CG-CD1 4.48Å; F188-I239 HydrophobicContact CE1-CG1 4.33Å; C207-I239 HydrophobicContact CB-CD1 3.93Å; C207-I239 HydrophobicContact CB-CG1 3.9Å; C207-I239 WeakPolarHBondContact SG-CG1 3.5Å; F221-I239 HydrophobicContact CE1-CG2 4.4Å; F221-I239 HydrophobicContact CZ-CD1 4.43Å; F221-I239 HydrophobicContact CZ-CG1 4.42Å; F221-I239 HydrophobicContact CZ-CG2 3.91Å; F228-I239 HydrophobicContact CB-CG2 4.12Å; F228-I239 HydrophobicContact CD1-CG2 3.57Å; F228-I239 HydrophobicContact CE1-CG2 4.3Å; F228-I239 HydrophobicContact CG-CG2 4.09Å
240	V	96.1	Very high	92.9	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	155.2	178	-67.9	0	0	0	0	110.7	F228 H229 K231 T238 E279	F228-V240 CarbonylContact C-O 3.48Å; F228-V240 VanDerWaalsContact CA-O 3.29Å; F228-V240 WeakPolarHBondContact CA-O 3.44Å; H229-V240 HydrophobicContact CB-CG2 4.08Å; H229-V240 PolarHBondContact N-O 2.75Å; H229-V240 PolarHBondContact O-N 2.93Å; H229-V240 VanDerWaalsContact O-N 3.15Å; K231-V240 HydrophobicContact CB-CG2 3.94Å; K231-V240 HydrophobicContact CD-CG2 4Å; T238-V240 HydrophobicContact CG2-CG1 3.85Å; V240-E279 HydrophobicContact CB-CB 3.79Å; V240-E279 HydrophobicContact CB-CG 4.08Å; V240-E279 HydrophobicContact CG1-CB 3.92Å; V240-E279 HydrophobicContact CG1-CG 4.42Å; V240-E279 HydrophobicContact CG2-CB 4.42Å; V240-E279 HydrophobicContact CG2-CG 4.16Å
241	F	97.5	Very high	92.7	Very high	14 Å²	14	57.4 Å²	57.4	6%	0.061	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	139.7	167.7	-68	-69	0	0	0	110.1	A10 F226 F228 F257 N278 E279 K280 V282	A10-F241 HydrophobicContact CB-CE1 4.42Å; A10-F241 HydrophobicContact CB-CZ 3.8Å; F226-F241 HydrophobicContact CB-CD1 4.23Å; F226-F241 HydrophobicContact CB-CE1 4.1Å; F226-F241 HydrophobicContact CD2-CE1 4.41Å; F226-F241 HydrophobicContact CG-CE1 4.14Å; F228-F241 AromaticContact CD1-CD1 4Å; F228-F241 HydrophobicContact CD1-CD1 4Å; F228-F241 HydrophobicContact CD1-CE1 4.28Å; F228-F241 AromaticContact CE1-CD1 3.47Å; F228-F241 HydrophobicContact CE1-CD1 3.47Å; F228-F241 VanDerWaalsContact CE1-CD1 3.47Å; F228-F241 AromaticContact CE1-CE1 3.31Å; F228-F241 HydrophobicContact CE1-CE1 3.31Å; F228-F241 HydrophobicContact CE1-CG 4.23Å; F228-F241 AromaticContact CE1-CZ 3.96Å; F228-F241 HydrophobicContact CE1-CZ 3.96Å; F228-F241 HydrophobicContact CE2-CE1 4.34Å; F228-F241 AromaticContact CZ-CD1 3.85Å; F228-F241 HydrophobicContact CZ-CD1 3.85Å; F228-F241 AromaticContact CZ-CE1 3.36Å; F228-F241 HydrophobicContact CZ-CE1 3.36Å; F228-F241 HydrophobicContact CZ-CZ 4.14Å; F241-F257 HydrophobicContact CB-CZ 3.99Å; F241-N278 WeakPolarHBondContact CB-O 3.36Å; F241-E279 PolarHBondContact N-O 2.92Å; F241-K280 WeakPolarHBondContact CE2-O 3.03Å; F241-V282 HydrophobicContact CB-CB 4.3Å; F241-V282 HydrophobicContact CB-CG1 4.44Å; F241-V282 HydrophobicContact CD1-CB 4.08Å; F241-V282 HydrophobicContact CD1-CG1 3.31Å; F241-V282 HydrophobicContact CD2-CG1 4.18Å; F241-V282 HydrophobicContact CE1-CG1 3.37Å; F241-V282 HydrophobicContact CE2-CG1 4.23Å; F241-V282 HydrophobicContact CG-CB 4.07Å; F241-V282 HydrophobicContact CG-CG1 3.74Å; F241-V282 HydrophobicContact CZ-CG1 3.85Å
242	A	97.2	Very high	92.5	Very high	13 Å²	13	57.8 Å²	57.8	11%	0.107	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	-10	177.5	0	0	0	0	0	113	L227 H229	L227-A242 HydrophobicContact CD2-CB 4.29Å; L227-A242 HydrophobicContact CG-CB 4.09Å; L227-A242 PolarHBondContact O-N 3.1Å; H229-A242 HydrophobicContact CB-CB 3.77Å
243	G	96.8	Very high	92.6	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.1	-157	176.6	0	0	0	0	0	113.1	L227 F255 C275	L227-G243 WeakPolarHBondContact CB-O 3.44Å; L227-G243 PolarHBondContact N-O 2.91Å; L227-G243 VanDerWaalsContact N-O 3.08Å; L227-G243 PolarHBondContact O-N 2.81Å; G243-F255 CarbonylContact C-O 3.56Å; G243-F255 VanDerWaalsContact CA-O 3.23Å; G243-F255 WeakPolarHBondContact CA-O 3.43Å; G243-C275 VanDerWaalsContact C-SG 3.59Å
244	C	95.6	Very high	92.9	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.014	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	151.9	-176	-55.9	0	0	0	0	110.3	F255 W261 C275 V282 V284	C244-F255 PolarHBondContact N-O 2.89Å; C244-F255 PolarHBondContact O-N 3.2Å; C244-W261 HydrophobicContact CB-CH2 4.11Å; C244-W261 HydrophobicContact CB-CZ3 4.32Å; C244-C275 HydrophobicContact CB-CB 3.71Å; C244-C275 WeakPolarHBondContact CB-SG 3.26Å; C244-C275 PolarHBondContact N-SG 2.99Å; C244-C275 VanDerWaalsContact SG-CA 3.5Å; C244-C275 WeakPolarHBondContact SG-CB 3.43Å; C244-C275 CovalentContact SG-SG 2.05Å; C244-C275 PolarHBondContact SG-SG 3.33Å; C244-V282 VanDerWaalsContact SG-CG2 3.51Å; C244-V284 HydrophobicContact CB-CG2 4.12Å; C244-V284 VanDerWaalsContact SG-CG2 3.6Å
245	V	95.5	Very high	93.5	Very high	34 Å²	34	48 Å²	48	21%	0.206	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.8	172.3	-179.1	0	0	0	0	107.7	L227 T252	L227-V245 HydrophobicContact CB-CG2 3.94Å; L227-V245 HydrophobicContact CD1-CG2 4.48Å; V245-T252 HydrophobicContact CG1-CG2 3.42Å; V245-T252 VanDerWaalsContact CG1-CG2 3.42Å
246	A	94.1	Very high	94.1	Very high	16 Å²	16	44.5 Å²	44.5	13%	0.132	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	160	-179.5	0	0	0	0	0	111.8	R253 F255 W261	A246-R253 PolarHBondContact N-O 3Å; A246-R253 PolarHBondContact O-N 3.17Å; A246-F255 HydrophobicContact CB-CD2 4.12Å; A246-F255 HydrophobicContact CB-CE2 3.9Å; A246-W261 HydrophobicContact CB-CD2 4Å; A246-W261 HydrophobicContact CB-CG 4.4Å; A246-W261 HydrophobicContact CB-CH2 4.3Å; A246-W261 HydrophobicContact CB-CZ2 3.49Å; A246-W261 VanDerWaalsContact CB-CZ2 3.49Å
247	K	92.8	Very high	94.5	Very high	143 Å²	143	47 Å²	47	62%	0.622	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.6	172.6	-72.5	-177	-180	-177.9	0	109.9	V251	K247-V251 CarbonylContact C-O 3.59Å; K247-V251 WeakPolarHBondContact CA-O 3.32Å
248	E	91.1	Very high	94.6	Very high	18 Å²	18	49.2 Å²	49.2	8%	0.084	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.9	171.6	-165.4	-175.9	-136.6	0	0	108.5	G250 V251 R253 F255 W261 Y262	E248-G250 PolarHBondContact O-N 2.8Å; E248-G250 VanDerWaalsContact O-N 3.07Å; E248-V251 PolarHBondContact N-O 2.87Å; E248-V251 PolarHBondContact O-N 3.4Å; E248-R253 IonicContact OE2-CZ 2.64Å; E248-R253 IonicContact OE2-NE 3.25Å; E248-R253 IonicContact OE2-NH1 3.72Å; E248-R253 PolarHBondContact OE2-NH1 3.46Å; E248-F255 HydrophobicContact CB-CZ 4.11Å; E248-W261 HydrophobicContact CB-CB 4.45Å; E248-W261 HydrophobicContact CG-CB 4.22Å; E248-W261 WeakPolarHBondContact OE1-CA 3.29Å; E248-W261 WeakPolarHBondContact OE1-CB 3.43Å; E248-Y262 PolarHBondContact OE1-N 3.07Å
249	F	87.5	Confident	94.7	Very high	167 Å²	167	54.2 Å²	54.2	73%	0.732	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	31.9	-173.9	-53	-68.5	0	0	0	114.5	V251	F249-V251 VanDerWaalsContact C-N 3.32Å
250	G	88	Confident	94.7	Very high	63 Å²	63	54.9 Å²	54.9	65%	0.649	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-8.8	179.2	0	0	0	0	0	115.1	E248	E248-G250 PolarHBondContact O-N 2.8Å; E248-G250 VanDerWaalsContact O-N 3.07Å
251	V	92.7	Very high	94.7	Very high	94 Å²	94	55.3 Å²	55.3	57%	0.57	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	131.2	177.9	-177.5	0	0	0	0	109.4	K247 E248 F249 R253	K247-V251 CarbonylContact C-O 3.59Å; K247-V251 WeakPolarHBondContact CA-O 3.32Å; E248-V251 PolarHBondContact N-O 2.87Å; E248-V251 PolarHBondContact O-N 3.4Å; F249-V251 VanDerWaalsContact C-N 3.32Å; V251-R253 HydrophobicContact CG1-CG 4.36Å; V251-R253 PolarHBondContact O-N 3.22Å
252	T	93.4	Very high	94.6	Very high	74 Å²	74	58.1 Å²	58.1	45%	0.454	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	123.6	171.9	-58.1	0	0	0	0	109.2	V245	V245-T252 HydrophobicContact CG1-CG2 3.42Å; V245-T252 VanDerWaalsContact CG1-CG2 3.42Å
253	R	95.2	Very high	94.4	Very high	130 Å²	130	59.1 Å²	59.1	49%	0.491	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	153.9	179.4	-64	-174.9	71.6	177.4	3.6	110.6	A246 E248 V251 F255	A246-R253 PolarHBondContact N-O 3Å; A246-R253 PolarHBondContact O-N 3.17Å; E248-R253 IonicContact OE2-CZ 2.64Å; E248-R253 IonicContact OE2-NE 3.25Å; E248-R253 IonicContact OE2-NH1 3.72Å; E248-R253 PolarHBondContact OE2-NH1 3.46Å; V251-R253 HydrophobicContact CG1-CG 4.36Å; V251-R253 PolarHBondContact O-N 3.22Å; R253-F255 HydrophobicContact CB-CE1 4.49Å; R253-F255 HydrophobicContact CB-CE2 3.65Å; R253-F255 HydrophobicContact CB-CZ 3.63Å
254	E	96.2	Very high	94.1	Very high	84 Å²	84	67.2 Å²	67.2	39%	0.393	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.1	172.6	-68.2	177.9	-165.6	0	0	109.5	H222 L227	H222-E254 IonicContact CD2-OE1 3.82Å; H222-E254 IonicContact CE1-OE1 2.88Å; H222-E254 WeakPolarHBondContact NE2-CG 3.32Å; H222-E254 IonicContact NE2-OE1 2.69Å; H222-E254 PolarHBondContact NE2-OE1 2.95Å; L227-E254 HydrophobicContact CD1-CG 3.88Å; L227-E254 HydrophobicContact CD2-CB 3.91Å; L227-E254 HydrophobicContact CD2-CG 4Å
255	F	96.1	Very high	93.9	Very high	10 Å²	10	70.8 Å²	70.8	4%	0.044	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	118.1	178.4	-62.1	-80.4	0	0	0	109.4	G243 C244 A246 E248 R253 E259 W261 C275	G243-F255 CarbonylContact C-O 3.56Å; G243-F255 VanDerWaalsContact CA-O 3.23Å; G243-F255 WeakPolarHBondContact CA-O 3.43Å; C244-F255 PolarHBondContact N-O 2.89Å; C244-F255 PolarHBondContact O-N 3.2Å; A246-F255 HydrophobicContact CB-CD2 4.12Å; A246-F255 HydrophobicContact CB-CE2 3.9Å; E248-F255 HydrophobicContact CB-CZ 4.11Å; R253-F255 HydrophobicContact CB-CE1 4.49Å; R253-F255 HydrophobicContact CB-CE2 3.65Å; R253-F255 HydrophobicContact CB-CZ 3.63Å; F255-E259 VanDerWaalsContact CA-OE2 3.31Å; F255-E259 WeakPolarHBondContact CA-OE2 3.43Å; F255-E259 HydrophobicContact CB-CB 4.19Å; F255-E259 HydrophobicContact CD1-CB 4.3Å; F255-W261 HydrophobicContact CB-CE3 4.09Å; F255-W261 HydrophobicContact CB-CZ3 4.13Å; F255-W261 HydrophobicContact CD1-CB 4.18Å; F255-W261 AromaticContact CD1-CE3 3.97Å; F255-W261 HydrophobicContact CD1-CE3 3.97Å; F255-W261 HydrophobicContact CD2-CD2 4.01Å; F255-W261 AromaticContact CD2-CE3 3.73Å; F255-W261 HydrophobicContact CD2-CE3 3.73Å; F255-W261 HydrophobicContact CD2-CG 4.43Å; F255-W261 HydrophobicContact CD2-CZ3 4.21Å; F255-W261 HydrophobicContact CE1-CB 3.49Å; F255-W261 VanDerWaalsContact CE1-CB 3.49Å; F255-W261 HydrophobicContact CE1-CE3 4.38Å; F255-W261 HydrophobicContact CE1-CG 4.24Å; F255-W261 HydrophobicContact CE2-CB 4.01Å; F255-W261 AromaticContact CE2-CD2 3.99Å; F255-W261 HydrophobicContact CE2-CD2 3.99Å; F255-W261 HydrophobicContact CE2-CE3 4.16Å; F255-W261 AromaticContact CE2-CG 3.95Å; F255-W261 HydrophobicContact CE2-CG 3.95Å; F255-W261 HydrophobicContact CG-CD2 4.29Å; F255-W261 AromaticContact CG-CE3 3.63Å; F255-W261 HydrophobicContact CG-CE3 3.63Å; F255-W261 HydrophobicContact CG-CZ3 4.12Å; F255-W261 HydrophobicContact CZ-CB 3.39Å; F255-W261 HydrophobicContact CZ-CD2 4.26Å; F255-W261 HydrophobicContact CZ-CE3 4.46Å; F255-W261 AromaticContact CZ-CG 3.84Å; F255-W261 HydrophobicContact CZ-CG 3.84Å; F255-C275 HydrophobicContact CB-CB 4.3Å
256	G	95.9	Very high	93.5	Very high	20 Å²	20	74.7 Å²	74.7	21%	0.206	40%	0.404	C	S	.	.			trans	-66	167.7	171.5	0	0	0	0	0	112.2	G258 E259 C275	G256-G258 PolarHBondContact O-N 3.12Å; G256-E259 PolarHBondContact N-OE2 2.8Å; G256-E259 WeakPolarHBondContact O-CB 3.45Å; G256-E259 PolarHBondContact O-N 2.97Å; G256-C275 WeakPolarHBondContact O-CB 3.42Å
257	F	96.5	Very high	93.3	Very high	71 Å²	71	77.6 Å²	77.6	31%	0.311	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	130.7	175.9	-55.6	-58.1	0	0	0	111.1	F241 E259 N278 V282	F241-F257 HydrophobicContact CB-CZ 3.99Å; F257-E259 VanDerWaalsContact C-N 3.29Å; F257-N278 WeakPolarHBondContact CZ-O 3.37Å; F257-V282 HydrophobicContact CE1-CB 4.25Å; F257-V282 HydrophobicContact CE1-CG2 4.03Å
258	G	96.4	Very high	93.2	Very high	53 Å²	53	72.3 Å²	72.3	55%	0.546	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-12.7	-174.5	0	0	0	0	0	114.4	G256 C275	G256-G258 PolarHBondContact O-N 3.12Å; G258-C275 PolarHBondContact N-O 3.42Å
259	E	97.5	Very high	93.4	Very high	105 Å²	105	72.9 Å²	72.9	49%	0.491	42%	0.419	S	S	.	.			trans	-77	147.1	175.7	-61.6	-171.5	152.4	0	0	111.2	F255 G256 F257 I274 C275	F255-E259 VanDerWaalsContact CA-OE2 3.31Å; F255-E259 WeakPolarHBondContact CA-OE2 3.43Å; F255-E259 HydrophobicContact CB-CB 4.19Å; F255-E259 HydrophobicContact CD1-CB 4.3Å; G256-E259 PolarHBondContact N-OE2 2.8Å; G256-E259 WeakPolarHBondContact O-CB 3.45Å; G256-E259 PolarHBondContact O-N 2.97Å; F257-E259 VanDerWaalsContact C-N 3.29Å; E259-I274 WeakPolarHBondContact O-CA 3.47Å; E259-C275 PolarHBondContact O-N 2.89Å
260	S	96.7	Very high	93.7	Very high	37 Å²	37	65.7 Å²	65.7	26%	0.259	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	149.6	-176.5	69.7	0	0	0	0	111.7	R272 M273	S260-R272 PolarHBondContact OG-NE 2.68Å; S260-R272 PolarHBondContact OG-NH2 2.89Å; S260-R272 VanDerWaalsContact OG-NH2 3.1Å; S260-M273 CarbonylContact C-O 3.54Å; S260-M273 WeakPolarHBondContact CA-O 3.49Å; S260-M273 WeakPolarHBondContact CB-O 3.49Å
261	W	96.1	Very high	94	Very high	13 Å²	13	65 Å²	65	5%	0.049	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	163.9	176.1	68.9	97.3	0	0	0	111.7	C244 A246 E248 F255 R272 M273 C275 V284	C244-W261 HydrophobicContact CB-CH2 4.11Å; C244-W261 HydrophobicContact CB-CZ3 4.32Å; A246-W261 HydrophobicContact CB-CD2 4Å; A246-W261 HydrophobicContact CB-CG 4.4Å; A246-W261 HydrophobicContact CB-CH2 4.3Å; A246-W261 HydrophobicContact CB-CZ2 3.49Å; A246-W261 VanDerWaalsContact CB-CZ2 3.49Å; E248-W261 HydrophobicContact CB-CB 4.45Å; E248-W261 HydrophobicContact CG-CB 4.22Å; E248-W261 WeakPolarHBondContact OE1-CA 3.29Å; E248-W261 WeakPolarHBondContact OE1-CB 3.43Å; F255-W261 HydrophobicContact CB-CE3 4.09Å; F255-W261 HydrophobicContact CB-CZ3 4.13Å; F255-W261 HydrophobicContact CD1-CB 4.18Å; F255-W261 AromaticContact CD1-CE3 3.97Å; F255-W261 HydrophobicContact CD1-CE3 3.97Å; F255-W261 HydrophobicContact CD2-CD2 4.01Å; F255-W261 AromaticContact CD2-CE3 3.73Å; F255-W261 HydrophobicContact CD2-CE3 3.73Å; F255-W261 HydrophobicContact CD2-CG 4.43Å; F255-W261 HydrophobicContact CD2-CZ3 4.21Å; F255-W261 HydrophobicContact CE1-CB 3.49Å; F255-W261 VanDerWaalsContact CE1-CB 3.49Å; F255-W261 HydrophobicContact CE1-CE3 4.38Å; F255-W261 HydrophobicContact CE1-CG 4.24Å; F255-W261 HydrophobicContact CE2-CB 4.01Å; F255-W261 AromaticContact CE2-CD2 3.99Å; F255-W261 HydrophobicContact CE2-CD2 3.99Å; F255-W261 HydrophobicContact CE2-CE3 4.16Å; F255-W261 AromaticContact CE2-CG 3.95Å; F255-W261 HydrophobicContact CE2-CG 3.95Å; F255-W261 HydrophobicContact CG-CD2 4.29Å; F255-W261 AromaticContact CG-CE3 3.63Å; F255-W261 HydrophobicContact CG-CE3 3.63Å; F255-W261 HydrophobicContact CG-CZ3 4.12Å; F255-W261 HydrophobicContact CZ-CB 3.39Å; F255-W261 HydrophobicContact CZ-CD2 4.26Å; F255-W261 HydrophobicContact CZ-CE3 4.46Å; F255-W261 AromaticContact CZ-CG 3.84Å; F255-W261 HydrophobicContact CZ-CG 3.84Å; W261-R272 WeakPolarHBondContact O-CA 3.36Å; W261-M273 HydrophobicContact CD2-CB 3.79Å; W261-M273 HydrophobicContact CD2-CG 4.46Å; W261-M273 VanDerWaalsContact CE2-CB 3.41Å; W261-M273 HydrophobicContact CE3-CB 4.15Å; W261-M273 HydrophobicContact CG-CB 4.41Å; W261-M273 HydrophobicContact CH2-CB 3.86Å; W261-M273 HydrophobicContact CZ2-CB 3.46Å; W261-M273 VanDerWaalsContact CZ2-CB 3.46Å; W261-M273 HydrophobicContact CZ2-CG 3.95Å; W261-M273 HydrophobicContact CZ3-CB 4.17Å; W261-M273 PolarHBondContact N-O 2.77Å; W261-M273 PolarHBondContact O-N 3.18Å; W261-C275 HydrophobicContact CZ3-CB 3.99Å; W261-V284 HydrophobicContact CH2-CB 4.28Å; W261-V284 HydrophobicContact CH2-CG1 3.49Å; W261-V284 VanDerWaalsContact CH2-CG1 3.49Å; W261-V284 HydrophobicContact CH2-CG2 3.87Å; W261-V284 HydrophobicContact CZ2-CG1 3.6Å; W261-V284 HydrophobicContact CZ2-CG2 4.43Å
262	Y	94.6	Very high	94.2	Very high	73 Å²	73	64 Å²	64	29%	0.286	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.9	175.2	-62	-77.3	0	0	0	111.3	E248 Y271 R272 I290 R297	E248-Y262 PolarHBondContact OE1-N 3.07Å; Y262-Y271 WeakPolarHBondContact CA-O 3.24Å; Y262-R272 HydrophobicContact CD1-CB 4Å; Y262-R272 HydrophobicContact CD1-CG 4.2Å; Y262-R272 HydrophobicContact CE1-CB 3.87Å; Y262-R272 HydrophobicContact CE1-CG 3.9Å; Y262-I290 HydrophobicContact CD1-CD1 3.28Å; Y262-I290 HydrophobicContact CE1-CD1 3.34Å; Y262-R297 PolarHBondContact OH-NH2 3.18Å
263	T	93.4	Very high	94.3	Very high	34 Å²	34	61.4 Å²	61.4	21%	0.209	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-69.2	157.3	172.3	68	0	0	0	0	110.5	Y271 M273	T263-Y271 PolarHBondContact N-O 3.03Å; T263-Y271 PolarHBondContact OG1-N 2.82Å; T263-M273 HydrophobicContact CG2-CG 3.52Å; T263-M273 HydrophobicContact CG2-SD 3.71Å
264	K	91.3	Very high	94.4	Very high	171 Å²	171	56.8 Å²	56.8	74%	0.743	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-56.1	134.2	165.9	-173.5	178.1	178.5	179.6	0	109.2	V266	K264-V266 PolarHBondContact O-N 2.78Å
265	P	90.5	Very high	94.4	Very high	76 Å²	76	52.8 Å²	52.8	49%	0.494	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-59.6	136.2	174.3	-24.2	33.9	0	0	0	112.1	L269	P265-L269 CarbonylContact C-O 3.58Å; P265-L269 WeakPolarHBondContact CA-O 3.36Å
266	V	88	Confident	94.4	Very high	117 Å²	117	55.6 Å²	55.6	71%	0.709	32%	0.316	S	S	*	.	B	Isolated β-bridge	trans	-109.2	101.3	167.7	-178.5	0	0	0	0	106.9	K264 S268 L269	K264-V266 PolarHBondContact O-N 2.78Å; V266-S268 PolarHBondContact O-N 3.36Å; V266-L269 PolarHBondContact N-O 3.41Å; V266-L269 PolarHBondContact O-N 2.93Å
267	G	89.7	Confident	94.4	Very high	76 Å²	76	55.9 Å²	55.9	78%	0.784	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	-124.5	-165.2	0	0	0	0	0	109.8
268	S	90.9	Very high	94.4	Very high	32 Å²	32	55.8 Å²	55.8	22%	0.224	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	1.9	178.5	55.5	0	0	0	0	115.1	V266 A291 N292 L293	V266-S268 PolarHBondContact O-N 3.36Å; S268-A291 WeakPolarHBondContact O-CA 3.47Å; S268-N292 VanDerWaalsContact CB-O 3.28Å; S268-N292 WeakPolarHBondContact CB-O 3.44Å; S268-N292 PolarHBondContact O-N 2.83Å; S268-L293 WeakPolarHBondContact OG-CD2 3.4Å
269	L	93.9	Very high	94.4	Very high	31 Å²	31	57.3 Å²	57.3	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.7	-175.4	-61.6	177	0	0	0	110.5	P265 V266 I290 A291 F314 A326 L328	P265-L269 CarbonylContact C-O 3.58Å; P265-L269 WeakPolarHBondContact CA-O 3.36Å; V266-L269 PolarHBondContact N-O 3.41Å; V266-L269 PolarHBondContact O-N 2.93Å; L269-I290 WeakPolarHBondContact CA-O 3.47Å; L269-A291 HydrophobicContact CD2-CB 3.91Å; L269-F314 HydrophobicContact CD2-CD2 4.49Å; L269-F314 HydrophobicContact CD2-CE2 3.87Å; L269-A326 HydrophobicContact CD1-CB 4.02Å; L269-A326 WeakPolarHBondContact CD1-O 3.34Å; L269-A326 HydrophobicContact CD2-CB 4.35Å; L269-L328 HydrophobicContact CD2-CD1 3.92Å; L269-L328 HydrophobicContact CD2-CG 4.29Å
270	S	94.6	Very high	94.2	Very high	15 Å²	15	58.4 Å²	58.4	11%	0.105	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	169.1	167.7	62.3	0	0	0	0	110.3	I290	S270-I290 PolarHBondContact N-O 3.03Å; S270-I290 PolarHBondContact O-N 2.9Å
271	Y	95.5	Very high	94.2	Very high	49 Å²	49	60.8 Å²	60.8	19%	0.192	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.3	179.7	-57.3	-85.4	0	0	0	109.3	Y262 T263 V286 E288 C289 A326	Y262-Y271 WeakPolarHBondContact CA-O 3.24Å; T263-Y271 PolarHBondContact N-O 3.03Å; T263-Y271 PolarHBondContact OG1-N 2.82Å; Y271-V286 HydrophobicContact CD1-CG1 3.75Å; Y271-V286 HydrophobicContact CG-CG1 4.39Å; Y271-E288 WeakPolarHBondContact CA-O 3.48Å; Y271-C289 HydrophobicContact CD1-CB 4.41Å; Y271-C289 HydrophobicContact CE1-CB 4.49Å; Y271-A326 HydrophobicContact CE1-CB 3.63Å; Y271-A326 PolarHBondContact OH-N 3.1Å
272	R	96.6	Very high	94.1	Very high	72 Å²	72	60.2 Å²	60.2	27%	0.272	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119	161.3	-170.3	-178.7	172.4	-164	-5.4	107.8	S260 W261 Y262 V287 E288 I290	S260-R272 PolarHBondContact OG-NE 2.68Å; S260-R272 PolarHBondContact OG-NH2 2.89Å; S260-R272 VanDerWaalsContact OG-NH2 3.1Å; W261-R272 WeakPolarHBondContact O-CA 3.36Å; Y262-R272 HydrophobicContact CD1-CB 4Å; Y262-R272 HydrophobicContact CD1-CG 4.2Å; Y262-R272 HydrophobicContact CE1-CB 3.87Å; Y262-R272 HydrophobicContact CE1-CG 3.9Å; R272-V287 HydrophobicContact CB-CG2 4.09Å; R272-V287 HydrophobicContact CG-CG2 3.94Å; R272-V287 VanDerWaalsContact O-CG2 3.29Å; R272-V287 WeakPolarHBondContact O-CG2 3.42Å; R272-V287 PolarHBondContact O-N 2.9Å; R272-E288 HydrophobicContact CB-CB 3.93Å; R272-E288 WeakPolarHBondContact CD-OE2 3.4Å; R272-E288 PolarHBondContact N-O 2.87Å; R272-E288 IonicContact NE-OE2 3.92Å; R272-E288 IonicContact NH1-OE1 3.79Å; R272-E288 PolarHBondContact NH1-OE1 3.21Å; R272-E288 IonicContact NH1-OE2 2.68Å; R272-E288 PolarHBondContact NH1-OE2 2.04Å; R272-E288 PolarHBondContact O-N 3.46Å; R272-I290 HydrophobicContact CB-CD1 4.31Å
273	M	95.8	Very high	94.1	Very high	21 Å²	21	57.4 Å²	57.4	10%	0.103	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	150.6	176.2	-48.1	-57.3	-64.3	0	0	109.3	S260 W261 T263 V284 E285 V286	S260-M273 CarbonylContact C-O 3.54Å; S260-M273 WeakPolarHBondContact CA-O 3.49Å; S260-M273 WeakPolarHBondContact CB-O 3.49Å; W261-M273 HydrophobicContact CD2-CB 3.79Å; W261-M273 HydrophobicContact CD2-CG 4.46Å; W261-M273 VanDerWaalsContact CE2-CB 3.41Å; W261-M273 HydrophobicContact CE3-CB 4.15Å; W261-M273 HydrophobicContact CG-CB 4.41Å; W261-M273 HydrophobicContact CH2-CB 3.86Å; W261-M273 HydrophobicContact CZ2-CB 3.46Å; W261-M273 VanDerWaalsContact CZ2-CB 3.46Å; W261-M273 HydrophobicContact CZ2-CG 3.95Å; W261-M273 HydrophobicContact CZ3-CB 4.17Å; W261-M273 PolarHBondContact N-O 2.77Å; W261-M273 PolarHBondContact O-N 3.18Å; T263-M273 HydrophobicContact CG2-CG 3.52Å; T263-M273 HydrophobicContact CG2-SD 3.71Å; M273-V284 HydrophobicContact CB-CG1 4.16Å; M273-V284 HydrophobicContact CE-CG1 3.51Å; M273-E285 CarbonylContact C-O 3.5Å; M273-E285 VanDerWaalsContact CA-O 3.24Å; M273-E285 WeakPolarHBondContact CA-O 3.02Å; M273-V286 HydrophobicContact CE-CG2 3.61Å; M273-V286 HydrophobicContact SD-CB 4.42Å; M273-V286 HydrophobicContact SD-CG2 3.67Å
274	I	96.7	Very high	94.1	Very high	33 Å²	33	58 Å²	58	17%	0.169	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	139.8	170.2	-169.2	169.2	0	0	0	109.7	E259 Q276 E285 V287	E259-I274 WeakPolarHBondContact O-CA 3.47Å; I274-Q276 HydrophobicContact CG2-CG 4Å; I274-E285 HydrophobicContact CG2-CB 4.02Å; I274-E285 PolarHBondContact N-O 3.45Å; I274-E285 PolarHBondContact O-N 3.19Å; I274-V287 HydrophobicContact CB-CG1 4.02Å; I274-V287 HydrophobicContact CB-CG2 4.37Å; I274-V287 HydrophobicContact CG2-CG1 3.36Å
275	C	96.4	Very high	94.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115	169.5	-170.1	0	0	0	0	109	G243 C244 F255 G256 G258 E259 W261	G243-C275 VanDerWaalsContact C-SG 3.59Å; C244-C275 HydrophobicContact CB-CB 3.71Å; C244-C275 WeakPolarHBondContact CB-SG 3.26Å; C244-C275 PolarHBondContact N-SG 2.99Å; C244-C275 VanDerWaalsContact SG-CA 3.5Å; C244-C275 WeakPolarHBondContact SG-CB 3.43Å; C244-C275 CovalentContact SG-SG 2.05Å; C244-C275 PolarHBondContact SG-SG 3.33Å; F255-C275 HydrophobicContact CB-CB 4.3Å; G256-C275 WeakPolarHBondContact O-CB 3.42Å; G258-C275 PolarHBondContact N-O 3.42Å; E259-C275 PolarHBondContact O-N 2.89Å; W261-C275 HydrophobicContact CZ3-CB 3.99Å
276	Q	96.1	Very high	94.5	Very high	68 Å²	68	50.4 Å²	50.4	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	154.6	175.8	-73.8	-177.2	17.4	0	0	111.1	I274 V282 S283 E285	I274-Q276 HydrophobicContact CG2-CG 4Å; Q276-V282 WeakPolarHBondContact O-CA 3.34Å; Q276-S283 PolarHBondContact N-O 3.45Å; Q276-S283 PolarHBondContact O-N 2.73Å; Q276-S283 VanDerWaalsContact O-O 3.13Å; Q276-E285 VanDerWaalsContact CD-CD 3.43Å; Q276-E285 VanDerWaalsContact CD-OE2 3.24Å; Q276-E285 PolarHBondContact NE2-OE2 2.75Å; Q276-E285 PolarHBondContact OE1-OE1 3.45Å; Q276-E285 PolarHBondContact OE1-OE2 2.82Å
277	G	95.5	Very high	94.9	Very high	27 Å²	27	46.9 Å²	46.9	28%	0.278	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	132.9	-157.3	171.6	0	0	0	0	0	113.8	H281	G277-H281 CarbonylContact C-O 3.5Å; G277-H281 WeakPolarHBondContact CA-O 3.34Å
278	N	95.9	Very high	95.3	Very high	69 Å²	69	45.5 Å²	45.5	37%	0.369	23%	0.231	S	C	.	.			trans	-157	-167.4	179.9	64	30.9	0	0	0	110.2	F241 F257 K280 H281	F241-N278 WeakPolarHBondContact CB-O 3.36Å; F257-N278 WeakPolarHBondContact CZ-O 3.37Å; N278-K280 PolarHBondContact O-N 3.13Å; N278-K280 WeakPolarHBondContact OD1-CA 3.44Å; N278-K280 WeakPolarHBondContact OD1-CB 3.2Å; N278-K280 PolarHBondContact OD1-N 2.83Å; N278-H281 PolarHBondContact N-O 3.29Å; N278-H281 PolarHBondContact ND2-CE1 2.75Å; N278-H281 PolarHBondContact ND2-ND1 3Å; N278-H281 PolarHBondContact O-N 3.01Å; N278-H281 PolarHBondContact OD1-CE1 2.92Å; N278-H281 PolarHBondContact OD1-N 2.85Å; N278-H281 PolarHBondContact OD1-ND1 2.82Å
279	E	96	Very high	95.6	Very high	84 Å²	84	44 Å²	44	39%	0.393	22%	0.22	S	C	.	.	S	Bend	trans	-59.1	-15.7	-178.8	-68.1	-165.8	166.7	0	0	115.3	K231 V240 F241	K231-E279 IonicContact NZ-OE1 3.61Å; K231-E279 PolarHBondContact NZ-OE1 2.95Å; K231-E279 IonicContact NZ-OE2 3.12Å; K231-E279 PolarHBondContact NZ-OE2 2.97Å; V240-E279 HydrophobicContact CB-CB 3.79Å; V240-E279 HydrophobicContact CB-CG 4.08Å; V240-E279 HydrophobicContact CG1-CB 3.92Å; V240-E279 HydrophobicContact CG1-CG 4.42Å; V240-E279 HydrophobicContact CG2-CB 4.42Å; V240-E279 HydrophobicContact CG2-CG 4.16Å; F241-E279 PolarHBondContact N-O 2.92Å
280	K	94.9	Very high	95.7	Very high	128 Å²	128	42.7 Å²	42.7	56%	0.557	21%	0.213	S	C	*	.	S	Bend	trans	-108.1	-27.8	-176.2	-61	-175.5	178	-178.2	0	114.4	F241 N278	F241-K280 WeakPolarHBondContact CE2-O 3.03Å; N278-K280 PolarHBondContact O-N 3.13Å; N278-K280 WeakPolarHBondContact OD1-CA 3.44Å; N278-K280 WeakPolarHBondContact OD1-CB 3.2Å; N278-K280 PolarHBondContact OD1-N 2.83Å
281	H	95	Very high	95.7	Very high	87 Å²	87	42 Å²	42	40%	0.403	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.2	-179.4	67	-84.6	0	0	0	109.9	G277 N278	G277-H281 CarbonylContact C-O 3.5Å; G277-H281 WeakPolarHBondContact CA-O 3.34Å; N278-H281 PolarHBondContact N-O 3.29Å; N278-H281 PolarHBondContact ND2-CE1 2.75Å; N278-H281 PolarHBondContact ND2-ND1 3Å; N278-H281 PolarHBondContact O-N 3.01Å; N278-H281 PolarHBondContact OD1-CE1 2.92Å; N278-H281 PolarHBondContact OD1-N 2.85Å; N278-H281 PolarHBondContact OD1-ND1 2.82Å
282	V	95.6	Very high	95.5	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	139.8	174.7	61.2	0	0	0	0	108.8	F226 F241 C244 F257 Q276	F226-V282 HydrophobicContact CD1-CB 4.38Å; F226-V282 HydrophobicContact CD1-CG1 3.29Å; F226-V282 HydrophobicContact CD1-CG2 4.17Å; F226-V282 HydrophobicContact CE1-CG1 3.53Å; F226-V282 HydrophobicContact CE1-CG2 4.48Å; F226-V282 HydrophobicContact CG-CG1 3.95Å; F226-V282 HydrophobicContact CZ-CG1 4.35Å; F241-V282 HydrophobicContact CB-CB 4.3Å; F241-V282 HydrophobicContact CB-CG1 4.44Å; F241-V282 HydrophobicContact CD1-CB 4.08Å; F241-V282 HydrophobicContact CD1-CG1 3.31Å; F241-V282 HydrophobicContact CD2-CG1 4.18Å; F241-V282 HydrophobicContact CE1-CG1 3.37Å; F241-V282 HydrophobicContact CE2-CG1 4.23Å; F241-V282 HydrophobicContact CG-CB 4.07Å; F241-V282 HydrophobicContact CG-CG1 3.74Å; F241-V282 HydrophobicContact CZ-CG1 3.85Å; C244-V282 VanDerWaalsContact SG-CG2 3.51Å; F257-V282 HydrophobicContact CE1-CB 4.25Å; F257-V282 HydrophobicContact CE1-CG2 4.03Å; Q276-V282 WeakPolarHBondContact O-CA 3.34Å
283	S	94.3	Very high	95.1	Very high	14 Å²	14	43.5 Å²	43.5	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155.4	174.1	59.9	0	0	0	0	110.1	Q276	Q276-S283 PolarHBondContact N-O 3.45Å; Q276-S283 PolarHBondContact O-N 2.73Å; Q276-S283 VanDerWaalsContact O-O 3.13Å
284	V	93.7	Very high	94.6	Very high	47 Å²	47	48.2 Å²	48.2	29%	0.285	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.9	172.5	175.6	0	0	0	0	107.5	C244 W261 M273	C244-V284 HydrophobicContact CB-CG2 4.12Å; C244-V284 VanDerWaalsContact SG-CG2 3.6Å; W261-V284 HydrophobicContact CH2-CB 4.28Å; W261-V284 HydrophobicContact CH2-CG1 3.49Å; W261-V284 VanDerWaalsContact CH2-CG1 3.49Å; W261-V284 HydrophobicContact CH2-CG2 3.87Å; W261-V284 HydrophobicContact CZ2-CG1 3.6Å; W261-V284 HydrophobicContact CZ2-CG2 4.43Å; M273-V284 HydrophobicContact CB-CG1 4.16Å; M273-V284 HydrophobicContact CE-CG1 3.51Å
285	E	93.8	Very high	94	Very high	68 Å²	68	51 Å²	51	32%	0.318	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.6	-177.3	-60.5	-164.5	166.7	0	0	111.7	M273 I274 Q276	M273-E285 CarbonylContact C-O 3.5Å; M273-E285 VanDerWaalsContact CA-O 3.24Å; M273-E285 WeakPolarHBondContact CA-O 3.02Å; I274-E285 HydrophobicContact CG2-CB 4.02Å; I274-E285 PolarHBondContact N-O 3.45Å; I274-E285 PolarHBondContact O-N 3.19Å; Q276-E285 VanDerWaalsContact CD-CD 3.43Å; Q276-E285 VanDerWaalsContact CD-OE2 3.24Å; Q276-E285 PolarHBondContact NE2-OE2 2.75Å; Q276-E285 PolarHBondContact OE1-OE1 3.45Å; Q276-E285 PolarHBondContact OE1-OE2 2.82Å
286	V	95.8	Very high	93.7	Very high	19 Å²	19	52.5 Å²	52.5	12%	0.115	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.8	168.6	179.8	0	0	0	0	107.6	Y271 M273 V302 I324	Y271-V286 HydrophobicContact CD1-CG1 3.75Å; Y271-V286 HydrophobicContact CG-CG1 4.39Å; M273-V286 HydrophobicContact CE-CG2 3.61Å; M273-V286 HydrophobicContact SD-CB 4.42Å; M273-V286 HydrophobicContact SD-CG2 3.67Å; V286-V302 HydrophobicContact CB-CG2 4.4Å; V286-V302 HydrophobicContact CG1-CG2 4.01Å; V286-V302 WeakPolarHBondContact O-CG2 3.47Å; V286-I324 HydrophobicContact CB-CB 4Å; V286-I324 HydrophobicContact CB-CG1 3.86Å; V286-I324 HydrophobicContact CB-CG2 4.24Å; V286-I324 HydrophobicContact CG1-CB 4.13Å; V286-I324 HydrophobicContact CG1-CG1 4.38Å; V286-I324 HydrophobicContact CG1-CG2 3.84Å; V286-I324 HydrophobicContact CG2-CB 4.09Å; V286-I324 HydrophobicContact CG2-CG1 4.24Å
287	V	96.3	Very high	93.5	Very high	43 Å²	43	56 Å²	56	26%	0.261	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-32.1	175.8	-74.4	0	0	0	0	112.7	R272 I274 A301 V302	R272-V287 HydrophobicContact CB-CG2 4.09Å; R272-V287 HydrophobicContact CG-CG2 3.94Å; R272-V287 VanDerWaalsContact O-CG2 3.29Å; R272-V287 WeakPolarHBondContact O-CG2 3.42Å; R272-V287 PolarHBondContact O-N 2.9Å; I274-V287 HydrophobicContact CB-CG1 4.02Å; I274-V287 HydrophobicContact CB-CG2 4.37Å; I274-V287 HydrophobicContact CG2-CG1 3.36Å; V287-A301 WeakPolarHBondContact O-CA 3.5Å; V287-V302 PolarHBondContact O-N 3.33Å
288	E	97.4	Very high	93.5	Very high	46 Å²	46	57.9 Å²	57.9	22%	0.215	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.6	179.7	-57.8	167.8	168.1	0	0	110.8	Y271 R272 V299 L300	Y271-E288 WeakPolarHBondContact CA-O 3.48Å; R272-E288 HydrophobicContact CB-CB 3.93Å; R272-E288 WeakPolarHBondContact CD-OE2 3.4Å; R272-E288 PolarHBondContact N-O 2.87Å; R272-E288 IonicContact NE-OE2 3.92Å; R272-E288 IonicContact NH1-OE1 3.79Å; R272-E288 PolarHBondContact NH1-OE1 3.21Å; R272-E288 IonicContact NH1-OE2 2.68Å; R272-E288 PolarHBondContact NH1-OE2 2.04Å; R272-E288 PolarHBondContact O-N 3.46Å; E288-V299 HydrophobicContact CB-CG1 3.76Å; E288-V299 HydrophobicContact CG-CG1 3.98Å; E288-V299 WeakPolarHBondContact OE2-CG1 3.37Å; E288-L300 CarbonylContact C-O 3.59Å; E288-L300 WeakPolarHBondContact CA-O 3.13Å
289	C	97.1	Very high	93.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	142.6	163	-54	0	0	0	0	109.2	Y271 V299 L300 F314 C316 A326	Y271-C289 HydrophobicContact CD1-CB 4.41Å; Y271-C289 HydrophobicContact CE1-CB 4.49Å; C289-V299 WeakPolarHBondContact O-CA 3.17Å; C289-L300 PolarHBondContact N-O 2.83Å; C289-L300 PolarHBondContact O-N 3.08Å; C289-F314 HydrophobicContact CB-CE1 4.47Å; C289-F314 HydrophobicContact CB-CE2 4.18Å; C289-F314 HydrophobicContact CB-CZ 3.58Å; C289-C316 HydrophobicContact CB-CB 3.47Å; C289-C316 VanDerWaalsContact CB-CB 3.47Å; C289-C316 WeakPolarHBondContact CB-SG 3.24Å; C289-C316 PolarHBondContact N-SG 3.27Å; C289-C316 WeakPolarHBondContact SG-CA 3.35Å; C289-C316 WeakPolarHBondContact SG-CB 2.93Å; C289-C316 CovalentContact SG-SG 2.03Å; C289-C316 PolarHBondContact SG-SG 2.88Å; C289-A326 HydrophobicContact CB-CB 3.82Å
290	I	96.3	Very high	93.4	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.5	-175.2	-55.7	155.9	0	0	0	108.5	Y262 L269 S270 R272 R297 K298 V299	Y262-I290 HydrophobicContact CD1-CD1 3.28Å; Y262-I290 HydrophobicContact CE1-CD1 3.34Å; L269-I290 WeakPolarHBondContact CA-O 3.47Å; S270-I290 PolarHBondContact N-O 3.03Å; S270-I290 PolarHBondContact O-N 2.9Å; R272-I290 HydrophobicContact CB-CD1 4.31Å; I290-R297 HydrophobicContact CG2-CG 3.99Å; I290-K298 WeakPolarHBondContact CA-O 3.5Å; I290-V299 HydrophobicContact CG1-CG1 4.23Å; I290-V299 HydrophobicContact CG1-CG2 4.23Å; I290-V299 HydrophobicContact CG2-CG2 4.38Å
291	A	94.9	Very high	93.4	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.4	169.6	0	0	0	0	0	109.2	S268 L269 R297 K298 Y308 F314 L328	S268-A291 WeakPolarHBondContact O-CA 3.47Å; L269-A291 HydrophobicContact CD2-CB 3.91Å; A291-R297 CarbonylContact O-C 3.57Å; A291-R297 WeakPolarHBondContact O-CA 3.36Å; A291-K298 PolarHBondContact N-O 2.82Å; A291-K298 PolarHBondContact O-N 3.14Å; A291-Y308 HydrophobicContact CB-CD2 4.05Å; A291-Y308 HydrophobicContact CB-CE2 3.66Å; A291-F314 HydrophobicContact CB-CD1 3.96Å; A291-F314 HydrophobicContact CB-CD2 4.08Å; A291-F314 HydrophobicContact CB-CE1 3.84Å; A291-F314 HydrophobicContact CB-CE2 3.97Å; A291-F314 HydrophobicContact CB-CG 4.1Å; A291-F314 HydrophobicContact CB-CZ 3.85Å; A291-L328 HydrophobicContact CB-CD1 4.3Å; A291-L328 HydrophobicContact CB-CD2 4.48Å
292	N	91.5	Very high	93.3	Very high	101 Å²	101	47.9 Å²	47.9	54%	0.54	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	99	176.8	-167.1	14.2	0	0	0	109.7	S268	S268-N292 VanDerWaalsContact CB-O 3.28Å; S268-N292 WeakPolarHBondContact CB-O 3.44Å; S268-N292 PolarHBondContact O-N 2.83Å
293	L	87.9	Confident	93.1	Very high	53 Å²	53	50.3 Å²	50.3	28%	0.277	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	-167	179.5	-69.7	166.6	0	0	0	110.8	S268 Q295 G296 Y308 L328	S268-L293 WeakPolarHBondContact OG-CD2 3.4Å; L293-Q295 PolarHBondContact O-N 2.86Å; L293-G296 PolarHBondContact O-N 2.87Å; L293-Y308 WeakPolarHBondContact CA-OH 3.27Å; L293-Y308 HydrophobicContact CB-CE1 3.92Å; L293-Y308 VanDerWaalsContact CB-OH 3.27Å; L293-Y308 WeakPolarHBondContact CB-OH 3.32Å; L293-Y308 HydrophobicContact CD1-CE1 3.88Å; L293-Y308 HydrophobicContact CG-CE1 4.44Å; L293-Y308 PolarHBondContact N-OH 2.87Å; L293-L328 HydrophobicContact CD1-CD1 3.36Å; L293-L328 HydrophobicContact CG-CD1 4.4Å
294	D	86.1	Confident	93	Very high	120 Å²	120	53.9 Å²	53.9	64%	0.642	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.1	-37.6	174.8	55.4	-22	0	0	0	114.8	G296	D294-G296 VanDerWaalsContact C-N 3.32Å
295	Q	83	Confident	92.9	Very high	91 Å²	91	52.6 Å²	52.6	43%	0.425	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	8.4	-179.7	-64	164.8	-6.6	0	0	114	L293 Y308 G309	L293-Q295 PolarHBondContact O-N 2.86Å; Q295-Y308 HydrophobicContact CB-CE1 4.07Å; Q295-Y308 VanDerWaalsContact OE1-C 3.26Å; Q295-Y308 PolarHBondContact OE1-O 2.85Å; Q295-G309 VanDerWaalsContact CD-CA 3.45Å
296	G	89.8	Confident	92.7	Very high	31 Å²	31	52.2 Å²	52.2	32%	0.32	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.8	-168	175.6	0	0	0	0	0	114.7	L293 D294 Y308	L293-G296 PolarHBondContact O-N 2.87Å; D294-G296 VanDerWaalsContact C-N 3.32Å; G296-Y308 PolarHBondContact O-OH 3.46Å
297	R	93.1	Very high	92.3	Very high	142 Å²	142	54.2 Å²	54.2	54%	0.536	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.3	-175.3	-174.6	-177.6	176.8	-146.2	0.1	111.2	Y262 I290 A291 V299	Y262-R297 PolarHBondContact OH-NH2 3.18Å; I290-R297 HydrophobicContact CG2-CG 3.99Å; A291-R297 CarbonylContact O-C 3.57Å; A291-R297 WeakPolarHBondContact O-CA 3.36Å; R297-V299 HydrophobicContact CG-CG2 4.27Å
298	K	94.2	Very high	91.9	Very high	67 Å²	67	52.6 Å²	52.6	29%	0.291	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.8	168.9	-167	76.2	174.8	-166.2	0	109.8	I290 A291 D306 Y308 F314	I290-K298 WeakPolarHBondContact CA-O 3.5Å; A291-K298 PolarHBondContact N-O 2.82Å; A291-K298 PolarHBondContact O-N 3.14Å; K298-D306 WeakPolarHBondContact CE-OD2 3.35Å; K298-D306 IonicContact NZ-OD2 2.74Å; K298-D306 PolarHBondContact NZ-OD2 3Å; K298-Y308 HydrophobicContact CB-CD2 3.6Å; K298-Y308 HydrophobicContact CB-CE2 3.53Å; K298-Y308 HydrophobicContact CG-CD2 4.15Å; K298-F314 HydrophobicContact CB-CD1 4.18Å; K298-F314 HydrophobicContact CG-CD1 3.92Å
299	V	95.6	Very high	91.3	Very high	52 Å²	52	51.8 Å²	51.8	32%	0.315	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.4	179.3	-174.3	0	0	0	0	108.1	E288 C289 I290 R297	E288-V299 HydrophobicContact CB-CG1 3.76Å; E288-V299 HydrophobicContact CG-CG1 3.98Å; E288-V299 WeakPolarHBondContact OE2-CG1 3.37Å; C289-V299 WeakPolarHBondContact O-CA 3.17Å; I290-V299 HydrophobicContact CG1-CG1 4.23Å; I290-V299 HydrophobicContact CG1-CG2 4.23Å; I290-V299 HydrophobicContact CG2-CG2 4.38Å; R297-V299 HydrophobicContact CG-CG2 4.27Å
300	L	94.9	Very high	90.7	Very high	14 Å²	14	57.8 Å²	57.8	7%	0.073	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.6	176.6	-65.9	179.5	0	0	0	109.7	E288 C289 D306 F314 C316	E288-L300 CarbonylContact C-O 3.59Å; E288-L300 WeakPolarHBondContact CA-O 3.13Å; C289-L300 PolarHBondContact N-O 2.83Å; C289-L300 PolarHBondContact O-N 3.08Å; L300-D306 HydrophobicContact CD1-CB 4.39Å; L300-D306 HydrophobicContact CD2-CB 3.7Å; L300-F314 HydrophobicContact CB-CD1 4.4Å; L300-F314 HydrophobicContact CB-CE1 4.07Å; L300-F314 HydrophobicContact CD1-CB 4.05Å; L300-F314 HydrophobicContact CD1-CD1 3.24Å; L300-F314 HydrophobicContact CD1-CD2 4.46Å; L300-F314 HydrophobicContact CD1-CE1 3.72Å; L300-F314 HydrophobicContact CD1-CG 3.66Å; L300-F314 HydrophobicContact CD1-CZ 4.48Å; L300-F314 VanDerWaalsContact CD1-O 3.24Å; L300-F314 WeakPolarHBondContact CD1-O 3.02Å; L300-F314 HydrophobicContact CG-CD1 3.52Å; L300-F314 HydrophobicContact CG-CE1 3.66Å; L300-F314 HydrophobicContact CG-CG 4.42Å; L300-C316 HydrophobicContact CB-CB 3.94Å
301	A	95.3	Very high	90.2	Very high	48 Å²	48	60.9 Å²	60.9	40%	0.397	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	153.8	167.2	0	0	0	0	0	110.2	V287 G303 H304	V287-A301 WeakPolarHBondContact O-CA 3.5Å; A301-G303 PolarHBondContact O-N 3.02Å; A301-H304 WeakPolarHBondContact O-CB 3.42Å; A301-H304 PolarHBondContact O-N 3.25Å; A301-H304 VanDerWaalsContact O-N 3.16Å; A301-H304 PolarHBondContact O-ND1 3.38Å
302	V	93.4	Very high	90	Very high	44 Å²	44	64.2 Å²	64.2	27%	0.267	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	139.1	173.6	177.7	0	0	0	0	110.7	V286 V287 H304 C316 I324	V286-V302 HydrophobicContact CB-CG2 4.4Å; V286-V302 HydrophobicContact CG1-CG2 4.01Å; V286-V302 WeakPolarHBondContact O-CG2 3.47Å; V287-V302 PolarHBondContact O-N 3.33Å; V302-H304 VanDerWaalsContact C-N 3.34Å; V302-H304 PolarHBondContact O-ND1 3.22Å; V302-C316 CarbonylContact C-O 3.53Å; V302-I324 HydrophobicContact CG1-CD1 3.57Å; V302-I324 HydrophobicContact CG1-CG1 4.2Å; V302-I324 HydrophobicContact CG1-CG2 4.41Å; V302-I324 HydrophobicContact CG2-CD1 4.5Å; V302-I324 HydrophobicContact CG2-CG1 4.23Å; V302-I324 HydrophobicContact CG2-CG2 3.93Å
303	G	91.3	Very high	89.8	Confident	52 Å²	52	59.5 Å²	59.5	54%	0.536	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-3.4	-176	0	0	0	0	0	114.3	A301 C316	A301-G303 PolarHBondContact O-N 3.02Å; G303-C316 PolarHBondContact N-O 2.82Å
304	H	91.9	Very high	90	Very high	89 Å²	89	57 Å²	57	41%	0.412	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	159.7	-177.6	-61.5	72	0	0	0	112.3	A301 V302 C316	A301-H304 WeakPolarHBondContact O-CB 3.42Å; A301-H304 PolarHBondContact O-N 3.25Å; A301-H304 VanDerWaalsContact O-N 3.16Å; A301-H304 PolarHBondContact O-ND1 3.38Å; V302-H304 VanDerWaalsContact C-N 3.34Å; V302-H304 PolarHBondContact O-ND1 3.22Å; H304-C316 PolarHBondContact O-N 2.87Å
305	C	90.5	Very high	90.3	Very high	21 Å²	21	51.3 Å²	51.3	14%	0.142	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	153.4	174.3	51.9	0	0	0	0	108.3	F314 T315 C349	C305-F314 CarbonylContact C-O 3.57Å; C305-F314 VanDerWaalsContact CA-O 3.22Å; C305-F314 WeakPolarHBondContact CA-O 3.03Å; C305-T315 HydrophobicContact CB-CG2 3.78Å; C305-C349 HydrophobicContact CB-CB 3.81Å; C305-C349 WeakPolarHBondContact CB-SG 3.3Å; C305-C349 PolarHBondContact O-SG 3.01Å; C305-C349 WeakPolarHBondContact SG-CA 3.41Å; C305-C349 WeakPolarHBondContact SG-CB 3.21Å; C305-C349 CovalentContact SG-SG 2Å; C305-C349 PolarHBondContact SG-SG 2.81Å
306	D	89.7	Confident	90.9	Very high	60 Å²	60	47 Å²	47	32%	0.321	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	163.3	179.8	-161	-5.4	0	0	0	110.2	K298 L300 F314	K298-D306 WeakPolarHBondContact CE-OD2 3.35Å; K298-D306 IonicContact NZ-OD2 2.74Å; K298-D306 PolarHBondContact NZ-OD2 3Å; L300-D306 HydrophobicContact CD1-CB 4.39Å; L300-D306 HydrophobicContact CD2-CB 3.7Å; D306-F314 PolarHBondContact N-O 2.87Å; D306-F314 PolarHBondContact O-N 3.01Å
307	K	87.5	Confident	90.9	Very high	60 Å²	60	48.1 Å²	48.1	26%	0.261	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	138.6	171.9	-150.3	-168.2	-177.5	-162.4	0	110	G309 D310 I331 F341	K307-G309 WeakPolarHBondContact CD-O 3.44Å; K307-G309 WeakPolarHBondContact CE-O 3.24Å; K307-G309 WeakPolarHBondContact CG-O 3.29Å; K307-G309 PolarHBondContact NZ-O 2.53Å; K307-D310 IonicContact NZ-OD1 3.11Å; K307-D310 PolarHBondContact NZ-OD1 2.76Å; K307-I331 HydrophobicContact CG-CD1 3.82Å; K307-F341 HydrophobicContact CB-CE2 4.22Å; K307-F341 HydrophobicContact CB-CZ 4.08Å; K307-F341 HydrophobicContact CD-CE1 4.07Å; K307-F341 HydrophobicContact CD-CZ 3.98Å; K307-F341 HydrophobicContact CG-CE1 4.23Å; K307-F341 HydrophobicContact CG-CZ 4.1Å
308	Y	88.2	Confident	90.7	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.035	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	92.6	172.2	-166.8	-82.9	0	0	0	107.6	A291 L293 Q295 G296 K298 R312 F314 L328	A291-Y308 HydrophobicContact CB-CD2 4.05Å; A291-Y308 HydrophobicContact CB-CE2 3.66Å; L293-Y308 WeakPolarHBondContact CA-OH 3.27Å; L293-Y308 HydrophobicContact CB-CE1 3.92Å; L293-Y308 VanDerWaalsContact CB-OH 3.27Å; L293-Y308 WeakPolarHBondContact CB-OH 3.32Å; L293-Y308 HydrophobicContact CD1-CE1 3.88Å; L293-Y308 HydrophobicContact CG-CE1 4.44Å; L293-Y308 PolarHBondContact N-OH 2.87Å; Q295-Y308 HydrophobicContact CB-CE1 4.07Å; Q295-Y308 VanDerWaalsContact OE1-C 3.26Å; Q295-Y308 PolarHBondContact OE1-O 2.85Å; G296-Y308 PolarHBondContact O-OH 3.46Å; K298-Y308 HydrophobicContact CB-CD2 3.6Å; K298-Y308 HydrophobicContact CB-CE2 3.53Å; K298-Y308 HydrophobicContact CG-CD2 4.15Å; Y308-R312 CarbonylContact C-O 3.53Å; Y308-R312 PolarHBondContact N-O 3.45Å; Y308-R312 WeakPolarHBondContact O-CB 3.05Å; Y308-R312 PolarHBondContact O-N 3.25Å; Y308-F314 HydrophobicContact CD2-CB 4.3Å; Y308-L328 HydrophobicContact CD1-CD2 3.96Å; Y308-L328 HydrophobicContact CD2-CD2 4.18Å; Y308-L328 HydrophobicContact CG-CD2 3.72Å
309	G	85.8	Confident	90.3	Very high	30 Å²	30	49.3 Å²	49.3	31%	0.309	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	-148.6	-171.4	0	0	0	0	0	113.5	Q295 K307	Q295-G309 VanDerWaalsContact CD-CA 3.45Å; K307-G309 WeakPolarHBondContact CD-O 3.44Å; K307-G309 WeakPolarHBondContact CE-O 3.24Å; K307-G309 WeakPolarHBondContact CG-O 3.29Å; K307-G309 PolarHBondContact NZ-O 2.53Å
310	D	83.7	Confident	89.7	Confident	126 Å²	126	56 Å²	56	67%	0.674	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-20.3	179.8	-69.9	-37.7	0	0	0	114.5	K307	K307-D310 IonicContact NZ-OD1 3.11Å; K307-D310 PolarHBondContact NZ-OD1 2.76Å
311	D	86.6	Confident	89.2	Confident	68 Å²	68	59.3 Å²	59.3	36%	0.364	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-12.1	-168.7	63.6	-39	0	0	0	113.7	A330 I331	D311-A330 CarbonylContact O-C 3.58Å; D311-A330 VanDerWaalsContact O-CA 3.29Å; D311-A330 WeakPolarHBondContact O-CA 3.47Å; D311-I331 PolarHBondContact O-N 3.44Å
312	R	89.3	Confident	88.7	Confident	71 Å²	71	58.1 Å²	58.1	27%	0.268	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	154.3	-171.7	-60.9	171.3	-145.6	169.9	12.5	113.8	Y308 T329 I331	Y308-R312 CarbonylContact C-O 3.53Å; Y308-R312 PolarHBondContact N-O 3.45Å; Y308-R312 WeakPolarHBondContact O-CB 3.05Å; Y308-R312 PolarHBondContact O-N 3.25Å; R312-T329 CarbonylContact C-O 3.57Å; R312-T329 VanDerWaalsContact CA-O 3.27Å; R312-T329 WeakPolarHBondContact CA-O 3.44Å; R312-I331 VanDerWaalsContact C-CD1 3.46Å; R312-I331 VanDerWaalsContact O-CD1 3.25Å; R312-I331 WeakPolarHBondContact O-CD1 3.16Å
313	M	88.3	Confident	88.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.2	171.1	-171.8	171.9	96.5	0	0	108.7	T315 L328 T329 I331 F341 T343 Q347 C349	M313-T315 HydrophobicContact CE-CG2 3.22Å; M313-T315 HydrophobicContact CG-CG2 4.09Å; M313-T315 HydrophobicContact SD-CG2 4.41Å; M313-L328 WeakPolarHBondContact O-CA 3.42Å; M313-T329 PolarHBondContact N-O 2.77Å; M313-T329 PolarHBondContact O-N 3.39Å; M313-I331 HydrophobicContact CB-CD1 4.2Å; M313-I331 HydrophobicContact CB-CG1 3.9Å; M313-F341 HydrophobicContact SD-CB 4.16Å; M313-T343 HydrophobicContact CB-CG2 4.15Å; M313-T343 HydrophobicContact CE-CG2 3.19Å; M313-T343 HydrophobicContact SD-CG2 3.78Å; M313-Q347 HydrophobicContact CE-CB 4.4Å; M313-Q347 HydrophobicContact CE-CG 4.37Å; M313-C349 HydrophobicContact CE-CB 4.04Å; M313-C349 HydrophobicContact SD-CB 3.46Å; M313-C349 WeakPolarHBondContact SD-CB 3.48Å
314	F	92.5	Very high	88.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.3	171.4	-178.8	-144.8	0	0	0	109.4	L269 C289 A291 K298 L300 C305 D306 Y308 A326 R327 L328	L269-F314 HydrophobicContact CD2-CD2 4.49Å; L269-F314 HydrophobicContact CD2-CE2 3.87Å; C289-F314 HydrophobicContact CB-CE1 4.47Å; C289-F314 HydrophobicContact CB-CE2 4.18Å; C289-F314 HydrophobicContact CB-CZ 3.58Å; A291-F314 HydrophobicContact CB-CD1 3.96Å; A291-F314 HydrophobicContact CB-CD2 4.08Å; A291-F314 HydrophobicContact CB-CE1 3.84Å; A291-F314 HydrophobicContact CB-CE2 3.97Å; A291-F314 HydrophobicContact CB-CG 4.1Å; A291-F314 HydrophobicContact CB-CZ 3.85Å; K298-F314 HydrophobicContact CB-CD1 4.18Å; K298-F314 HydrophobicContact CG-CD1 3.92Å; L300-F314 HydrophobicContact CB-CD1 4.4Å; L300-F314 HydrophobicContact CB-CE1 4.07Å; L300-F314 HydrophobicContact CD1-CB 4.05Å; L300-F314 HydrophobicContact CD1-CD1 3.24Å; L300-F314 HydrophobicContact CD1-CD2 4.46Å; L300-F314 HydrophobicContact CD1-CE1 3.72Å; L300-F314 HydrophobicContact CD1-CG 3.66Å; L300-F314 HydrophobicContact CD1-CZ 4.48Å; L300-F314 VanDerWaalsContact CD1-O 3.24Å; L300-F314 WeakPolarHBondContact CD1-O 3.02Å; L300-F314 HydrophobicContact CG-CD1 3.52Å; L300-F314 HydrophobicContact CG-CE1 3.66Å; L300-F314 HydrophobicContact CG-CG 4.42Å; C305-F314 CarbonylContact C-O 3.57Å; C305-F314 VanDerWaalsContact CA-O 3.22Å; C305-F314 WeakPolarHBondContact CA-O 3.03Å; D306-F314 PolarHBondContact N-O 2.87Å; D306-F314 PolarHBondContact O-N 3.01Å; Y308-F314 HydrophobicContact CD2-CB 4.3Å; F314-A326 HydrophobicContact CE2-CB 4.1Å; F314-R327 CarbonylContact C-O 3.57Å; F314-R327 WeakPolarHBondContact CA-O 3.37Å; F314-R327 WeakPolarHBondContact CD2-O 3.44Å; F314-L328 HydrophobicContact CB-CD2 3.9Å; F314-L328 HydrophobicContact CD2-CD2 4.22Å; F314-L328 HydrophobicContact CD2-CG 4.25Å; F314-L328 HydrophobicContact CG-CD2 4.32Å
315	T	92.1	Very high	88.3	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	143.6	180	63.4	0	0	0	0	110.6	C305 M313 A326 R327	C305-T315 HydrophobicContact CB-CG2 3.78Å; M313-T315 HydrophobicContact CE-CG2 3.22Å; M313-T315 HydrophobicContact CG-CG2 4.09Å; M313-T315 HydrophobicContact SD-CG2 4.41Å; T315-A326 VanDerWaalsContact O-CA 3.27Å; T315-A326 WeakPolarHBondContact O-CA 3.34Å; T315-R327 PolarHBondContact N-O 2.04Å; T315-R327 PolarHBondContact O-N 2.83Å; T315-R327 WeakPolarHBondContact OG1-CB 3.46Å; T315-R327 PolarHBondContact OG1-O 3.12Å
316	C	94.5	Very high	88.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	77.5	174.9	-172.6	0	0	0	0	109.4	C289 L300 V302 G303 H304	C289-C316 HydrophobicContact CB-CB 3.47Å; C289-C316 VanDerWaalsContact CB-CB 3.47Å; C289-C316 WeakPolarHBondContact CB-SG 3.24Å; C289-C316 PolarHBondContact N-SG 3.27Å; C289-C316 WeakPolarHBondContact SG-CA 3.35Å; C289-C316 WeakPolarHBondContact SG-CB 2.93Å; C289-C316 CovalentContact SG-SG 2.03Å; C289-C316 PolarHBondContact SG-SG 2.88Å; L300-C316 HydrophobicContact CB-CB 3.94Å; V302-C316 CarbonylContact C-O 3.53Å; G303-C316 PolarHBondContact N-O 2.82Å; H304-C316 PolarHBondContact O-N 2.87Å
317	L	91.4	Very high	88.5	Confident	55 Å²	55	55.1 Å²	55.1	29%	0.288	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150.9	-169.7	-58.7	-169.6	0	0	0	112.9	L325	L317-L325 PolarHBondContact N-O 2.86Å; L317-L325 VanDerWaalsContact N-O 3.17Å; L317-L325 PolarHBondContact O-N 3.23Å
318	K	88.8	Confident	88.6	Confident	141 Å²	141	54.5 Å²	54.5	61%	0.613	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	121.9	171.1	-171.7	169.6	-176.3	177.6	0	109.3	I324	K318-I324 HydrophobicContact CB-CD1 3.56Å; K318-I324 HydrophobicContact CD-CD1 4.27Å; K318-I324 HydrophobicContact CG-CD1 3.77Å
319	H	85.9	Confident	88.6	Confident	92 Å²	92	54.9 Å²	54.9	43%	0.426	29%	0.286	S	S	.	.			trans	-75.6	162.6	173.7	-172	-105.8	0	0	0	111	S321 G322 A323	H319-S321 PolarHBondContact ND1-N 2.95Å; H319-S321 PolarHBondContact ND1-OG 2.9Å; H319-S321 PolarHBondContact O-N 3.06Å; H319-S321 VanDerWaalsContact O-N 3.14Å; H319-G322 WeakPolarHBondContact O-CA 3.41Å; H319-G322 PolarHBondContact O-N 3.47Å; H319-A323 WeakPolarHBondContact CB-O 3.07Å; H319-A323 PolarHBondContact N-O 2.88Å
320	E	82	Confident	88.7	Confident	194 Å²	194	55.6 Å²	55.6	91%	0.907	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.2	178.1	-65.1	-176	169	0	0	112.9	G322	E320-G322 PolarHBondContact O-N 2.82Å
321	S	85.1	Confident	88.6	Confident	82 Å²	82	50.5 Å²	50.5	57%	0.573	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-3.7	175	61.6	0	0	0	0	114.3	H319 A323	H319-S321 PolarHBondContact ND1-N 2.95Å; H319-S321 PolarHBondContact ND1-OG 2.9Å; H319-S321 PolarHBondContact O-N 3.06Å; H319-S321 VanDerWaalsContact O-N 3.14Å; S321-A323 VanDerWaalsContact C-N 3.28Å; S321-A323 PolarHBondContact O-N 3.46Å
322	G	83.8	Confident	87.9	Confident	24 Å²	24	51.1 Å²	51.1	25%	0.247	26%	0.262	C	S	.	.	S	Bend	trans	85.1	-10.3	-174.8	0	0	0	0	0	114.8	H319 E320	H319-G322 WeakPolarHBondContact O-CA 3.41Å; H319-G322 PolarHBondContact O-N 3.47Å; E320-G322 PolarHBondContact O-N 2.82Å
323	A	87.6	Confident	86.5	Confident	15 Å²	15	55.5 Å²	55.5	12%	0.124	29%	0.286	C	S	.	.			trans	-69.1	141.5	176.5	0	0	0	0	0	111.3	L4 H319 S321	L4-A323 HydrophobicContact CD2-CB 4.47Å; H319-A323 WeakPolarHBondContact CB-O 3.07Å; H319-A323 PolarHBondContact N-O 2.88Å; S321-A323 VanDerWaalsContact C-N 3.28Å; S321-A323 PolarHBondContact O-N 3.46Å
324	I	91.6	Very high	85.1	Confident	25 Å²	25	63.4 Å²	63.4	13%	0.128	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	131.2	170.5	-55.6	-47.4	0	0	0	109.2	V286 V302 K318	V286-I324 HydrophobicContact CB-CB 4Å; V286-I324 HydrophobicContact CB-CG1 3.86Å; V286-I324 HydrophobicContact CB-CG2 4.24Å; V286-I324 HydrophobicContact CG1-CB 4.13Å; V286-I324 HydrophobicContact CG1-CG1 4.38Å; V286-I324 HydrophobicContact CG1-CG2 3.84Å; V286-I324 HydrophobicContact CG2-CB 4.09Å; V286-I324 HydrophobicContact CG2-CG1 4.24Å; V302-I324 HydrophobicContact CG1-CD1 3.57Å; V302-I324 HydrophobicContact CG1-CG1 4.2Å; V302-I324 HydrophobicContact CG1-CG2 4.41Å; V302-I324 HydrophobicContact CG2-CD1 4.5Å; V302-I324 HydrophobicContact CG2-CG1 4.23Å; V302-I324 HydrophobicContact CG2-CG2 3.93Å; K318-I324 HydrophobicContact CB-CD1 3.56Å; K318-I324 HydrophobicContact CD-CD1 4.27Å; K318-I324 HydrophobicContact CG-CD1 3.77Å
325	L	90.2	Very high	83.1	Confident	54 Å²	54	67.3 Å²	67.3	28%	0.283	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.7	-178.8	-169.3	62.2	0	0	0	110.7	L317 R327	L317-L325 PolarHBondContact N-O 2.86Å; L317-L325 VanDerWaalsContact N-O 3.17Å; L317-L325 PolarHBondContact O-N 3.23Å; L325-R327 HydrophobicContact CD2-CG 4.13Å; L325-R327 HydrophobicContact CG-CG 3.99Å
326	A	92.8	Very high	81.2	Confident	6 Å²	6	72 Å²	72	5%	0.05	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.7	166.5	0	0	0	0	0	109.6	L269 Y271 C289 F314 T315	L269-A326 HydrophobicContact CD1-CB 4.02Å; L269-A326 WeakPolarHBondContact CD1-O 3.34Å; L269-A326 HydrophobicContact CD2-CB 4.35Å; Y271-A326 HydrophobicContact CE1-CB 3.63Å; Y271-A326 PolarHBondContact OH-N 3.1Å; C289-A326 HydrophobicContact CB-CB 3.82Å; F314-A326 HydrophobicContact CE2-CB 4.1Å; T315-A326 VanDerWaalsContact O-CA 3.27Å; T315-A326 WeakPolarHBondContact O-CA 3.34Å
327	R	91.2	Very high	79.4	Confident	102 Å²	102	76.8 Å²	76.8	39%	0.385	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142.3	172.1	-61.7	-174.9	178.4	173.7	2	112.1	F314 T315 L325	F314-R327 CarbonylContact C-O 3.57Å; F314-R327 WeakPolarHBondContact CA-O 3.37Å; F314-R327 WeakPolarHBondContact CD2-O 3.44Å; T315-R327 PolarHBondContact N-O 2.04Å; T315-R327 PolarHBondContact O-N 2.83Å; T315-R327 WeakPolarHBondContact OG1-CB 3.46Å; T315-R327 PolarHBondContact OG1-O 3.12Å; L325-R327 HydrophobicContact CD2-CG 4.13Å; L325-R327 HydrophobicContact CG-CG 3.99Å
328	L	89	Confident	78	Confident	47 Å²	47	80 Å²	80	25%	0.246	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.4	162.5	-76.9	159.7	0	0	0	107.8	L269 A291 L293 Y308 M313 F314	L269-L328 HydrophobicContact CD2-CD1 3.92Å; L269-L328 HydrophobicContact CD2-CG 4.29Å; A291-L328 HydrophobicContact CB-CD1 4.3Å; A291-L328 HydrophobicContact CB-CD2 4.48Å; L293-L328 HydrophobicContact CD1-CD1 3.36Å; L293-L328 HydrophobicContact CG-CD1 4.4Å; Y308-L328 HydrophobicContact CD1-CD2 3.96Å; Y308-L328 HydrophobicContact CD2-CD2 4.18Å; Y308-L328 HydrophobicContact CG-CD2 3.72Å; M313-L328 WeakPolarHBondContact O-CA 3.42Å; F314-L328 HydrophobicContact CB-CD2 3.9Å; F314-L328 HydrophobicContact CD2-CD2 4.22Å; F314-L328 HydrophobicContact CD2-CG 4.25Å; F314-L328 HydrophobicContact CG-CD2 4.32Å
329	T	89.2	Confident	76.8	Confident	18 Å²	18	80.3 Å²	80.3	11%	0.11	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.4	-178	-47.2	0	0	0	0	109.4	R312 M313 T343	R312-T329 CarbonylContact C-O 3.57Å; R312-T329 VanDerWaalsContact CA-O 3.27Å; R312-T329 WeakPolarHBondContact CA-O 3.44Å; M313-T329 PolarHBondContact N-O 2.77Å; M313-T329 PolarHBondContact O-N 3.39Å; T329-T343 HydrophobicContact CG2-CG2 3.8Å
330	A	87.1	Confident	75.9	Confident	45 Å²	45	81 Å²	81	37%	0.372	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	141.6	175.4	0	0	0	0	0	111.2	D311 I344	D311-A330 CarbonylContact O-C 3.58Å; D311-A330 VanDerWaalsContact O-CA 3.29Å; D311-A330 WeakPolarHBondContact O-CA 3.47Å; A330-I344 HydrophobicContact CB-CD1 3.83Å; A330-I344 PolarHBondContact O-N 3.12Å
331	I	82	Confident	75.4	Confident	18 Å²	18	72.5 Å²	72.5	9%	0.092	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	137	175.4	-63.4	171.2	0	0	0	108.9	K307 D311 R312 M313 Q333 F341	K307-I331 HydrophobicContact CG-CD1 3.82Å; D311-I331 PolarHBondContact O-N 3.44Å; R312-I331 VanDerWaalsContact C-CD1 3.46Å; R312-I331 VanDerWaalsContact O-CD1 3.25Å; R312-I331 WeakPolarHBondContact O-CD1 3.16Å; M313-I331 HydrophobicContact CB-CD1 4.2Å; M313-I331 HydrophobicContact CB-CG1 3.9Å; I331-Q333 PolarHBondContact O-N 2.69Å; I331-F341 HydrophobicContact CD1-CD1 4.15Å
332	H	70.9	Confident	74.7	Confident	81 Å²	81	70.1 Å²	70.1	38%	0.375	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	113.5	169.3	-161.8	42	0	0	0	109.2	E334 I335 I344	H332-E334 IonicContact NE2-OE2 2.7Å; H332-E334 PolarHBondContact O-N 2.99Å; H332-E334 VanDerWaalsContact O-N 3.1Å; H332-I335 PolarHBondContact O-N 3.31Å; H332-I344 HydrophobicContact CB-CG1 4.47Å
333	Q	61.6	Low	73.9	Confident	163 Å²	163	69.2 Å²	69.2	76%	0.762	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	-24.6	-175.2	-79.4	-179.4	-27	0	0	113.7	I331 I335	I331-Q333 PolarHBondContact O-N 2.69Å; Q333-I335 VanDerWaalsContact C-N 3.32Å; Q333-I335 PolarHBondContact O-N 3.41Å
334	E	57.4	Low	72.6	Confident	168 Å²	168	74 Å²	74	79%	0.785	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	-12.6	-175.7	-66.2	-177.2	-179.9	0	0	114.3	H332	H332-E334 IonicContact NE2-OE2 2.7Å; H332-E334 PolarHBondContact O-N 2.99Å; H332-E334 VanDerWaalsContact O-N 3.1Å
335	I	51.8	Low	71.4	Confident	82 Å²	82	78.2 Å²	78.2	42%	0.421	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	54.7	-177.8	-44.7	175.4	0	0	0	110.1	H332 Q333 D337	H332-I335 PolarHBondContact O-N 3.31Å; Q333-I335 VanDerWaalsContact C-N 3.32Å; Q333-I335 PolarHBondContact O-N 3.41Å; I335-D337 PolarHBondContact O-N 2.95Å
336	L	51.3	Low	70.4	Confident	101 Å²	101	78.2 Å²	78.2	53%	0.529	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	85.3	161.8	-74.7	164.4	0	0	0	108	F341 M351	L336-F341 HydrophobicContact CD2-CD1 3.47Å; L336-F341 VanDerWaalsContact CD2-CD1 3.47Å; L336-F341 HydrophobicContact CD2-CE1 3.43Å; L336-F341 VanDerWaalsContact CD2-CE1 3.43Å; L336-M351 HydrophobicContact CD2-CE 4.44Å
337	D	56.3	Low	69.3	Low	99 Å²	99	80.1 Å²	80.1	53%	0.529	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	141.2	159.5	-168.1	-5.4	0	0	0	107.2	I335 K339 K340	I335-D337 PolarHBondContact O-N 2.95Å; D337-K339 PolarHBondContact O-N 2.83Å; D337-K340 PolarHBondContact O-N 3.1Å; D337-K340 VanDerWaalsContact O-O 3.09Å
338	V	62.2	Low	68.4	Low	123 Å²	123	78 Å²	78	75%	0.745	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-18.9	-173.8	-173.8	0	0	0	0	111.9
339	K	63.5	Low	67.7	Low	147 Å²	147	75.9 Å²	75.9	64%	0.639	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-17.7	-176.3	-62.1	-176.9	178.3	-178.7	0	115.4	D337 M351	D337-K339 PolarHBondContact O-N 2.83Å; K339-M351 PolarHBondContact O-N 2.77Å
340	K	67.9	Low	66.7	Low	108 Å²	108	78.8 Å²	78.8	47%	0.47	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	143.6	-170.8	-63.6	-174.6	179.4	176.5	0	113	D337 C349	D337-K340 PolarHBondContact O-N 3.1Å; D337-K340 VanDerWaalsContact O-O 3.09Å; K340-C349 VanDerWaalsContact CA-O 3.25Å; K340-C349 WeakPolarHBondContact CA-O 3.43Å
341	F	71.3	Confident	65.5	Low	15 Å²	15	79.5 Å²	79.5	7%	0.066	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140.2	164.1	-53.6	-83.6	0	0	0	109.8	K307 M313 I331 L336 A348 C349 M351	K307-F341 HydrophobicContact CB-CE2 4.22Å; K307-F341 HydrophobicContact CB-CZ 4.08Å; K307-F341 HydrophobicContact CD-CE1 4.07Å; K307-F341 HydrophobicContact CD-CZ 3.98Å; K307-F341 HydrophobicContact CG-CE1 4.23Å; K307-F341 HydrophobicContact CG-CZ 4.1Å; M313-F341 HydrophobicContact SD-CB 4.16Å; I331-F341 HydrophobicContact CD1-CD1 4.15Å; L336-F341 HydrophobicContact CD2-CD1 3.47Å; L336-F341 VanDerWaalsContact CD2-CD1 3.47Å; L336-F341 HydrophobicContact CD2-CE1 3.43Å; L336-F341 VanDerWaalsContact CD2-CE1 3.43Å; F341-A348 CarbonylContact O-C 3.51Å; F341-A348 WeakPolarHBondContact O-CA 3.21Å; F341-C349 PolarHBondContact N-O 2.84Å; F341-C349 PolarHBondContact O-N 3.2Å; F341-M351 HydrophobicContact CD1-CE 3.73Å; F341-M351 HydrophobicContact CD2-CE 3.88Å; F341-M351 HydrophobicContact CD2-CG 3.84Å; F341-M351 HydrophobicContact CD2-SD 4.26Å; F341-M351 HydrophobicContact CE1-CE 3.24Å; F341-M351 HydrophobicContact CE1-SD 4.17Å; F341-M351 HydrophobicContact CE2-CE 3.43Å; F341-M351 VanDerWaalsContact CE2-CE 3.43Å; F341-M351 HydrophobicContact CE2-CG 3.42Å; F341-M351 VanDerWaalsContact CE2-CG 3.42Å; F341-M351 HydrophobicContact CE2-SD 3.42Å; F341-M351 WeakPolarHBondContact CE2-SD 3.29Å; F341-M351 HydrophobicContact CG-CE 4.03Å; F341-M351 HydrophobicContact CZ-CE 3.07Å; F341-M351 HydrophobicContact CZ-CG 4.03Å; F341-M351 HydrophobicContact CZ-SD 3.36Å; F341-M351 WeakPolarHBondContact CZ-SD 3.11Å
342	T	70.2	Confident	64.2	Low	31 Å²	31	85.1 Å²	85.1	19%	0.19	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.2	170.9	-50.1	0	0	0	0	109.2	Q347	T342-Q347 WeakPolarHBondContact CA-O 3.46Å
343	T	66.1	Low	63.3	Low	5 Å²	5	88.5 Å²	88.5	3%	0.031	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	164.7	173.5	58.9	0	0	0	0	111.2	M313 T329 D345 G346 Q347	M313-T343 HydrophobicContact CB-CG2 4.15Å; M313-T343 HydrophobicContact CE-CG2 3.19Å; M313-T343 HydrophobicContact SD-CG2 3.78Å; T329-T343 HydrophobicContact CG2-CG2 3.8Å; T343-D345 PolarHBondContact O-N 2.89Å; T343-D345 VanDerWaalsContact O-N 3.09Å; T343-D345 PolarHBondContact OG1-N 3.29Å; T343-G346 PolarHBondContact O-N 3.2Å; T343-G346 PolarHBondContact OG1-N 3.46Å; T343-Q347 HydrophobicContact CG2-CB 4.37Å; T343-Q347 PolarHBondContact N-O 2.98Å; T343-Q347 WeakPolarHBondContact OG1-CB 3.45Å; T343-Q347 PolarHBondContact OG1-N 2.93Å
344	I	60.4	Low	62.3	Low	115 Å²	115	94 Å²	94	59%	0.59	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-33.8	168.6	-61.4	175.5	0	0	0	111.6	A330 H332 G346	A330-I344 HydrophobicContact CB-CD1 3.83Å; A330-I344 PolarHBondContact O-N 3.12Å; H332-I344 HydrophobicContact CB-CG1 4.47Å; I344-G346 VanDerWaalsContact C-N 3.27Å; I344-G346 PolarHBondContact O-N 2.64Å
345	D	67.1	Low	62.5	Low	114 Å²	114	90.4 Å²	90.4	61%	0.61	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	7.6	178.9	-53.7	-35.7	0	0	0	114.6	T343 Q347	T343-D345 PolarHBondContact O-N 2.89Å; T343-D345 VanDerWaalsContact O-N 3.09Å; T343-D345 PolarHBondContact OG1-N 3.29Å; D345-Q347 PolarHBondContact O-N 3.11Å
346	G	69.3	Low	63.1	Low	54 Å²	54	90.8 Å²	90.8	56%	0.557	49%	0.485	S	S	*	.			trans	79.2	7.9	178.5	0	0	0	0	0	116	T343 I344 A348	T343-G346 PolarHBondContact O-N 3.2Å; T343-G346 PolarHBondContact OG1-N 3.46Å; I344-G346 VanDerWaalsContact C-N 3.27Å; I344-G346 PolarHBondContact O-N 2.64Å; G346-A348 PolarHBondContact O-N 3.34Å
347	Q	70.4	Confident	63.7	Low	46 Å²	46	90.2 Å²	90.2	22%	0.215	48%	0.483	C	S	.	.			trans	-78.2	117.1	177.4	-163.9	178	-20.8	0	0	110.1	M313 T342 T343 D345	M313-Q347 HydrophobicContact CE-CB 4.4Å; M313-Q347 HydrophobicContact CE-CG 4.37Å; T342-Q347 WeakPolarHBondContact CA-O 3.46Å; T343-Q347 HydrophobicContact CG2-CB 4.37Å; T343-Q347 PolarHBondContact N-O 2.98Å; T343-Q347 WeakPolarHBondContact OG1-CB 3.45Å; T343-Q347 PolarHBondContact OG1-N 2.93Å; D345-Q347 PolarHBondContact O-N 3.11Å
348	A	71.9	Confident	64.2	Low	59 Å²	59	89.7 Å²	89.7	49%	0.488	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	133.6	179.8	0	0	0	0	0	111.7	F341 G346	F341-A348 CarbonylContact O-C 3.51Å; F341-A348 WeakPolarHBondContact O-CA 3.21Å; G346-A348 PolarHBondContact O-N 3.34Å
349	C	73.2	Confident	64.3	Low	1 Å²	1	87.6 Å²	87.6	1%	0.007	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.5	174.2	-176.8	0	0	0	0	110.7	C305 M313 K340 F341 M351	C305-C349 HydrophobicContact CB-CB 3.81Å; C305-C349 WeakPolarHBondContact CB-SG 3.3Å; C305-C349 PolarHBondContact O-SG 3.01Å; C305-C349 WeakPolarHBondContact SG-CA 3.41Å; C305-C349 WeakPolarHBondContact SG-CB 3.21Å; C305-C349 CovalentContact SG-SG 2Å; C305-C349 PolarHBondContact SG-SG 2.81Å; M313-C349 HydrophobicContact CE-CB 4.04Å; M313-C349 HydrophobicContact SD-CB 3.46Å; M313-C349 WeakPolarHBondContact SD-CB 3.48Å; K340-C349 VanDerWaalsContact CA-O 3.25Å; K340-C349 WeakPolarHBondContact CA-O 3.43Å; F341-C349 PolarHBondContact N-O 2.84Å; F341-C349 PolarHBondContact O-N 3.2Å; C349-M351 PolarHBondContact O-N 3.35Å
350	P	69.1	Low	64.3	Low	79 Å²	79	83.7 Å²	83.7	51%	0.513	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.2	171.6	26.9	-30.9	0	0	0	110.8	L352	P350-L352 PolarHBondContact O-N 2.84Å
351	M	61.1	Low	64.1	Low	60 Å²	60	81.9 Å²	81.9	30%	0.296	45%	0.45	S	S	.	.			trans	-71.1	119.7	163.4	-60.4	-148.6	-156.5	0	0	107.3	L336 K339 F341 C349 D353	L336-M351 HydrophobicContact CD2-CE 4.44Å; K339-M351 PolarHBondContact O-N 2.77Å; F341-M351 HydrophobicContact CD1-CE 3.73Å; F341-M351 HydrophobicContact CD2-CE 3.88Å; F341-M351 HydrophobicContact CD2-CG 3.84Å; F341-M351 HydrophobicContact CD2-SD 4.26Å; F341-M351 HydrophobicContact CE1-CE 3.24Å; F341-M351 HydrophobicContact CE1-SD 4.17Å; F341-M351 HydrophobicContact CE2-CE 3.43Å; F341-M351 VanDerWaalsContact CE2-CE 3.43Å; F341-M351 HydrophobicContact CE2-CG 3.42Å; F341-M351 VanDerWaalsContact CE2-CG 3.42Å; F341-M351 HydrophobicContact CE2-SD 3.42Å; F341-M351 WeakPolarHBondContact CE2-SD 3.29Å; F341-M351 HydrophobicContact CG-CE 4.03Å; F341-M351 HydrophobicContact CZ-CE 3.07Å; F341-M351 HydrophobicContact CZ-CG 4.03Å; F341-M351 HydrophobicContact CZ-SD 3.36Å; F341-M351 WeakPolarHBondContact CZ-SD 3.11Å; C349-M351 PolarHBondContact O-N 3.35Å; M351-D353 PolarHBondContact O-N 2.95Å
352	L	55.7	Low	63.5	Low	137 Å²	137	87.1 Å²	87.1	72%	0.717	48%	0.48	S	S	*	.			trans	-68.3	114.1	163.7	-70.9	167.5	0	0	0	106.2	P350 K354	P350-L352 PolarHBondContact O-N 2.84Å; L352-K354 PolarHBondContact O-N 2.7Å; L352-K354 VanDerWaalsContact O-N 3.1Å
353	D	51.3	Low	63	Low	152 Å²	152	91.8 Å²	91.8	81%	0.813	50%	0.504	S	S	*	.			trans	-52.6	119	167.2	-78.7	-30.7	0	0	0	107.1	M351	M351-D353 PolarHBondContact O-N 2.95Å
354	K	39.9	Very low	62.7	Low	279 Å²	279	99.6 Å²	99.6	100%	1.213	55%	0.547	S	S	*	.			trans	-71.1	0	176.3	-96.2	-172	177.3	179.9	0	111.6	L352	L352-K354 PolarHBondContact O-N 2.7Å; L352-K354 VanDerWaalsContact O-N 3.1Å

Retrieved 354 of 354 residues in 446.4 ms (Link to these results)

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