G4VQN0_SCHMA Loading...

mRNA export protein rae1-related

AlphaFold DB , UniProt , Accession G4VQN0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 365 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	38.4	Very low	50.9	Low	227 Å²	227	100.5 Å²	100.5	100%	1.118	58%	0.576	S	S	*	*				0	105.3	0	-158.4	179.4	-89.9	0	0	105.9	L3	M1-L3 PolarHBondContact O-N 2.85Å
2	T	45.3	Very low	52	Low	127 Å²	127	93.8 Å²	93.8	78%	0.779	54%	0.535	S	S	*	.			trans	-73.1	108	-177	15	0	0	0	0	108.8
3	L	64.5	Low	52.2	Low	104 Å²	104	95.6 Å²	95.6	55%	0.545	54%	0.542	S	S	.	.			trans	-83.9	-12.6	-177.9	-73.9	163.1	0	0	0	113.1	M1 S34 P77	M1-L3 PolarHBondContact O-N 2.85Å; L3-S34 WeakPolarHBondContact CD1-OG 3.45Å; L3-P77 HydrophobicContact CB-CG 4.5Å
4	F	65.1	Low	52	Low	16 Å²	16	93.4 Å²	93.4	7%	0.07	54%	0.535	C	S	.	.	S	Bend	trans	-99.5	132.4	173.5	-64.7	-87.4	0	0	0	109	S6 R65 W67 P77 A79 E80	F4-S6 PolarHBondContact O-N 2.97Å; F4-R65 HydrophobicContact CE1-CB 4.08Å; F4-R65 HydrophobicContact CE1-CG 4.25Å; F4-R65 HydrophobicContact CE2-CG 4.34Å; F4-R65 HydrophobicContact CZ-CB 4.1Å; F4-R65 HydrophobicContact CZ-CG 4.03Å; F4-W67 AromaticContact CZ-CE2 3.84Å; F4-W67 AromaticContact CZ-CZ2 3.97Å; F4-W67 HydrophobicContact CZ-CZ2 3.97Å; F4-W67 AromaticContact CZ-NE1 3.7Å; F4-P77 HydrophobicContact CD1-CB 3.75Å; F4-P77 HydrophobicContact CD2-CB 4.47Å; F4-P77 HydrophobicContact CE1-CB 3.48Å; F4-P77 VanDerWaalsContact CE1-CB 3.48Å; F4-P77 HydrophobicContact CE1-CG 4.44Å; F4-P77 HydrophobicContact CE2-CB 4.21Å; F4-P77 HydrophobicContact CG-CB 4.25Å; F4-P77 HydrophobicContact CZ-CB 3.71Å; F4-P77 HydrophobicContact CZ-CG 4.25Å; F4-A79 WeakPolarHBondContact CD1-O 3.17Å; F4-E80 HydrophobicContact CB-CB 4.16Å; F4-E80 HydrophobicContact CB-CG 3.73Å; F4-E80 HydrophobicContact CD1-CB 4.32Å; F4-E80 HydrophobicContact CG-CB 4.17Å; F4-E80 HydrophobicContact CG-CG 4.2Å
5	T	50.3	Low	51.1	Low	76 Å²	76	93.8 Å²	93.8	47%	0.466	54%	0.54	S	S	.	.			trans	-76.7	124	177.6	58	0	0	0	0	109	G7 K78	T5-G7 VanDerWaalsContact C-N 3.28Å; T5-G7 PolarHBondContact O-N 2.93Å; T5-K78 PolarHBondContact OG1-O 2.99Å
6	S	46.9	Very low	50.6	Low	118 Å²	118	95.8 Å²	95.8	83%	0.825	55%	0.548	S	S	*	.			trans	-94.3	27.7	176.3	65.7	0	0	0	0	112.3	F4	F4-S6 PolarHBondContact O-N 2.97Å
7	G	41.4	Very low	49.6	Very low	35 Å²	35	99.6 Å²	99.6	36%	0.361	57%	0.565	S	S	.	*	S	Bend	trans	-103.2	154.7	-171.3	0	0	0	0	0	113.8	T5 Q9 N116	T5-G7 VanDerWaalsContact C-N 3.28Å; T5-G7 PolarHBondContact O-N 2.93Å; G7-Q9 PolarHBondContact O-N 2.82Å; G7-Q9 VanDerWaalsContact O-N 3.1Å; G7-N116 PolarHBondContact O-ND2 3.31Å
8	T	43.8	Very low	48.7	Very low	130 Å²	130	96.9 Å²	96.9	80%	0.798	56%	0.562	S	S	*	*	S	Bend	trans	-73.9	15.5	175.5	49.9	0	0	0	0	114.2
9	Q	46.5	Very low	47.9	Very low	160 Å²	160	97.3 Å²	97.3	75%	0.748	58%	0.578	S	S	*	*	S	Bend	trans	-84.4	150.1	177.7	-72.1	-163.4	-6.5	0	0	111.2	G7 V11	G7-Q9 PolarHBondContact O-N 2.82Å; G7-Q9 VanDerWaalsContact O-N 3.1Å; Q9-V11 VanDerWaalsContact C-N 3.29Å; Q9-V11 WeakPolarHBondContact O-CG2 3.48Å; Q9-V11 PolarHBondContact O-N 2.92Å
10	N	58.2	Low	47.2	Very low	84 Å²	84	99.2 Å²	99.2	45%	0.449	59%	0.585	S	S	.	*			trans	-73.2	76.3	-174.7	-149.5	-24.2	0	0	0	110.6	F12 N13 G114	N10-F12 PolarHBondContact O-N 3.5Å; N10-N13 PolarHBondContact ND2-ND2 3.32Å; N10-N13 PolarHBondContact OD1-ND2 2.78Å; N10-G114 WeakPolarHBondContact OD1-CA 3.49Å; N10-G114 PolarHBondContact OD1-O 3.3Å
11	V	59.1	Low	46.9	Very low	29 Å²	29	102.7 Å²	102.7	18%	0.176	59%	0.593	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-17.5	-167.6	-150.9	0	0	0	0	113.5	Q9 K78	Q9-V11 VanDerWaalsContact C-N 3.29Å; Q9-V11 WeakPolarHBondContact O-CG2 3.48Å; Q9-V11 PolarHBondContact O-N 2.92Å; V11-K78 WeakPolarHBondContact O-CE 3.48Å; V11-K78 PolarHBondContact O-NZ 2.9Å; V11-K78 VanDerWaalsContact O-NZ 3.08Å
12	F	65	Low	47.2	Very low	19 Å²	19	97.8 Å²	97.8	8%	0.083	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.3	-11.6	-170.9	-63.2	-86.7	0	0	0	114.2	N10 F54 I66 K78 A79 L113	N10-F12 PolarHBondContact O-N 3.5Å; F12-F54 HydrophobicContact CB-CZ 4.5Å; F12-F54 HydrophobicContact CD1-CD1 4.2Å; F12-F54 AromaticContact CD1-CE1 3.67Å; F12-F54 HydrophobicContact CD1-CE1 3.67Å; F12-F54 HydrophobicContact CD1-CE2 4.03Å; F12-F54 AromaticContact CD1-CZ 3.58Å; F12-F54 HydrophobicContact CD1-CZ 3.58Å; F12-F54 HydrophobicContact CE1-CD1 4.18Å; F12-F54 HydrophobicContact CE1-CE1 4.03Å; F12-F54 HydrophobicContact CE1-CZ 4.36Å; F12-I66 HydrophobicContact CE1-CB 4.42Å; F12-I66 HydrophobicContact CE1-CD1 4.37Å; F12-I66 HydrophobicContact CE1-CG2 3.81Å; F12-I66 HydrophobicContact CZ-CB 4.45Å; F12-I66 HydrophobicContact CZ-CD1 4.11Å; F12-I66 HydrophobicContact CZ-CG2 4.33Å; F12-K78 HydrophobicContact CE1-CB 4.09Å; F12-K78 HydrophobicContact CZ-CB 4.34Å; F12-A79 HydrophobicContact CE2-CB 4.09Å; F12-A79 HydrophobicContact CZ-CB 3.84Å; F12-L113 HydrophobicContact CD1-CD1 4.29Å; F12-L113 HydrophobicContact CD2-CB 3.64Å; F12-L113 WeakPolarHBondContact CD2-O 3.48Å; F12-L113 HydrophobicContact CE1-CD1 4.17Å; F12-L113 HydrophobicContact CE2-CB 3.78Å; F12-L113 HydrophobicContact CE2-CD2 3.86Å; F12-L113 HydrophobicContact CE2-CG 4.26Å; F12-L113 HydrophobicContact CG-CB 4.03Å; F12-L113 HydrophobicContact CZ-CB 4.33Å; F12-L113 HydrophobicContact CZ-CD1 4.27Å; F12-L113 HydrophobicContact CZ-CD2 3.82Å; F12-L113 HydrophobicContact CZ-CG 4.37Å
13	N	54	Low	47.4	Very low	118 Å²	118	93.4 Å²	93.4	63%	0.631	55%	0.547	S	S	*	.			trans	-92.9	7.4	-176.9	-82.7	-13	0	0	0	114.8	N10 V15	N10-N13 PolarHBondContact ND2-ND2 3.32Å; N10-N13 PolarHBondContact OD1-ND2 2.78Å; N13-V15 PolarHBondContact O-N 2.86Å
14	S	49.6	Very low	46.3	Very low	64 Å²	64	91.8 Å²	91.8	45%	0.448	54%	0.544	S	S	.	.			trans	-81	111.1	177.7	62.9	0	0	0	0	111.4	N16	S14-N16 PolarHBondContact O-N 2.91Å
15	V	38.3	Very low	45.3	Very low	100 Å²	100	95.5 Å²	95.5	61%	0.606	58%	0.578	S	S	*	*			trans	-75.7	104.8	169.8	-177.1	0	0	0	0	108.4	N13 I17	N13-V15 PolarHBondContact O-N 2.86Å; V15-I17 HydrophobicContact CG1-CD1 4.41Å; V15-I17 HydrophobicContact CG1-CG1 3.87Å
16	N	43.3	Very low	45.1	Very low	125 Å²	125	96.6 Å²	96.6	67%	0.668	60%	0.595	S	S	*	*			trans	-98.9	102.2	174.2	-136.4	-3	0	0	0	109.3	S14 G18	S14-N16 PolarHBondContact O-N 2.91Å; N16-G18 PolarHBondContact O-N 3.25Å
17	I	32.8	Very low	45.6	Very low	162 Å²	162	97.4 Å²	97.4	83%	0.831	59%	0.586	S	S	*	*			trans	-83.7	72.4	175.8	-50.3	178.5	0	0	0	107.8	V15	V15-I17 HydrophobicContact CG1-CD1 4.41Å; V15-I17 HydrophobicContact CG1-CG1 3.87Å
18	G	33.8	Very low	47.5	Very low	50 Å²	50	100 Å²	100	52%	0.515	59%	0.587	S	S	.	*			trans	-89.2	133.7	171.4	0	0	0	0	0	110.7	N16 N20	N16-G18 PolarHBondContact O-N 3.25Å; G18-N20 PolarHBondContact O-N 2.85Å
19	A	33	Very low	49.5	Very low	104 Å²	104	96.3 Å²	96.3	86%	0.86	56%	0.564	S	S	*	*			trans	-55.7	118.7	179.5	0	0	0	0	0	111.9	K21	A19-K21 PolarHBondContact O-N 3.38Å; A19-K21 VanDerWaalsContact O-N 3.1Å
20	N	35.4	Very low	51.6	Low	135 Å²	135	89.8 Å²	89.8	72%	0.722	54%	0.538	S	S	*	.			trans	-61.1	106.9	-179.2	-83.2	-24.7	0	0	0	111.8	G18 A71	G18-N20 PolarHBondContact O-N 2.85Å; N20-A71 WeakPolarHBondContact OD1-CB 3.44Å
21	K	39.3	Very low	53.2	Low	174 Å²	174	90.2 Å²	90.2	76%	0.757	54%	0.537	S	S	*	.			trans	-101.2	114	154.3	-77.3	-177.2	176.6	178.8	0	107.5	A19 N72	A19-K21 PolarHBondContact O-N 3.38Å; A19-K21 VanDerWaalsContact O-N 3.1Å; K21-N72 VanDerWaalsContact O-CA 3.26Å; K21-N72 WeakPolarHBondContact O-CA 3.46Å; K21-N72 WeakPolarHBondContact O-CB 3.42Å; K21-N72 PolarHBondContact O-N 2.82Å
22	T	45.5	Very low	55	Low	123 Å²	123	88.9 Å²	88.9	76%	0.755	53%	0.529	S	S	*	.			trans	-59.5	150.6	172	-4.6	0	0	0	0	110	S24	T22-S24 PolarHBondContact O-N 3.13Å; T22-S24 VanDerWaalsContact O-N 3.14Å
23	M	48.8	Very low	56.2	Low	35 Å²	35	93.6 Å²	93.6	17%	0.172	55%	0.551	C	S	.	*			trans	-45.8	124.9	167.9	-83.8	-174.1	67.8	0	0	109.5	A25 Q27 N72 L354	M23-A25 PolarHBondContact O-N 2.87Å; M23-Q27 WeakPolarHBondContact CE-O 3.28Å; M23-N72 WeakPolarHBondContact CG-O 3.4Å; M23-L354 HydrophobicContact CB-CD1 4.03Å; M23-L354 HydrophobicContact CE-CD1 4.13Å; M23-L354 HydrophobicContact CE-CG 4.02Å; M23-L354 HydrophobicContact SD-CD1 4.22Å; M23-L354 HydrophobicContact SD-CD2 3.99Å; M23-L354 HydrophobicContact SD-CG 3.94Å
24	S	42.6	Very low	58	Low	70 Å²	70	89.9 Å²	89.9	49%	0.49	53%	0.534	S	S	.	.			trans	-65.1	137.1	175.7	82	0	0	0	0	108.8	T22 A26 Q27	T22-S24 PolarHBondContact O-N 3.13Å; T22-S24 VanDerWaalsContact O-N 3.14Å; S24-A26 PolarHBondContact O-N 3.38Å; S24-Q27 PolarHBondContact O-N 2.96Å
25	A	44.8	Very low	60.1	Low	94 Å²	94	88.9 Å²	88.9	78%	0.777	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-17.6	179.4	0	0	0	0	0	113.7	M23 Q27	M23-A25 PolarHBondContact O-N 2.87Å; A25-Q27 VanDerWaalsContact C-N 3.33Å
26	A	45.7	Very low	62.8	Low	100 Å²	100	84.3 Å²	84.3	83%	0.826	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-19.9	177.9	0	0	0	0	0	114	S24	S24-A26 PolarHBondContact O-N 3.38Å
27	Q	57.3	Low	65.2	Low	134 Å²	134	81.6 Å²	81.6	63%	0.626	50%	0.5	S	S	*	.			trans	-122.3	85.5	-178.1	-135.1	172.6	0.3	0	0	109.1	M23 S24 A25 T29	M23-Q27 WeakPolarHBondContact CE-O 3.28Å; S24-Q27 PolarHBondContact O-N 2.96Å; A25-Q27 VanDerWaalsContact C-N 3.33Å; Q27-T29 PolarHBondContact O-N 3.26Å
28	K	80.2	Confident	68.3	Low	91 Å²	91	77.3 Å²	77.3	40%	0.396	48%	0.479	S	S	.	.			trans	-66.6	-13.1	-179.8	-73.4	-166.6	174	-164.8	0	113.7	R353 L354	K28-R353 CarbonylContact O-C 3.47Å; K28-R353 VanDerWaalsContact O-CA 3.27Å; K28-R353 WeakPolarHBondContact O-CA 2.95Å; K28-L354 PolarHBondContact O-N 2.98Å
29	T	85.6	Confident	71.3	Confident	52 Å²	52	75.4 Å²	75.4	32%	0.319	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.9	-173.9	53	0	0	0	0	112.3	Q27 M352 R353	Q27-T29 PolarHBondContact O-N 3.26Å; T29-M352 CarbonylContact C-O 3.49Å; T29-M352 WeakPolarHBondContact CA-O 3.12Å; T29-R353 HydrophobicContact CG2-CB 3.97Å; T29-R353 HydrophobicContact CG2-CG 3.92Å
30	A	90.8	Very high	74.5	Confident	22 Å²	22	70.5 Å²	70.5	18%	0.182	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.7	173.7	0	0	0	0	0	110.5	M351 M352	A30-M351 CarbonylContact O-C 3.58Å; A30-M351 WeakPolarHBondContact O-CA 3.5Å; A30-M352 HydrophobicContact CB-CE 4.36Å; A30-M352 PolarHBondContact N-O 3.37Å; A30-M352 PolarHBondContact O-N 3.37Å
31	E	93.3	Very high	77.5	Confident	93 Å²	93	65.4 Å²	65.4	44%	0.435	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.3	173.6	-172.8	170.5	154	0	0	109.5	M351	E31-M351 HydrophobicContact CB-CE 4.28Å; E31-M351 HydrophobicContact CB-SD 3.99Å; E31-M351 HydrophobicContact CG-SD 3.9Å
32	V	95.1	Very high	80.3	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-70.6	132	176	177.7	0	0	0	0	109.4	L55 W67 T75 I350 M352	V32-L55 HydrophobicContact CG2-CD2 4.06Å; V32-W67 HydrophobicContact CG1-CD2 3.76Å; V32-W67 HydrophobicContact CG1-CE3 4.43Å; V32-W67 HydrophobicContact CG1-CG 3.84Å; V32-W67 HydrophobicContact CG1-CZ2 4.14Å; V32-T75 WeakPolarHBondContact CA-OG1 3.41Å; V32-T75 HydrophobicContact CB-CG2 4.43Å; V32-T75 HydrophobicContact CG1-CG2 4.13Å; V32-T75 HydrophobicContact CG2-CG2 4.09Å; V32-I350 HydrophobicContact CB-CB 3.92Å; V32-I350 HydrophobicContact CB-CG2 4.27Å; V32-I350 HydrophobicContact CG2-CB 3.78Å; V32-I350 HydrophobicContact CG2-CG2 3.57Å; V32-I350 PolarHBondContact N-O 2.8Å; V32-M352 HydrophobicContact CG2-CE 4.15Å; V32-M352 HydrophobicContact CG2-CG 4.19Å; V32-M352 HydrophobicContact CG2-SD 4.26Å
33	Q	91.4	Very high	82.8	Confident	117 Å²	117	51.7 Å²	51.7	55%	0.547	32%	0.323	S	S	.	.	S	Bend	trans	-70.8	141.2	-179.8	-65	-166.2	-14.4	0	0	111.4	W67 T75	Q33-W67 PolarHBondContact O-NE1 2.91Å; Q33-T75 PolarHBondContact N-OG1 3.15Å
34	S	92.4	Very high	85.2	Confident	40 Å²	40	53.3 Å²	53.3	28%	0.28	33%	0.327	S	S	.	.	S	Bend	trans	54.9	62	177.4	-48.7	0	0	0	0	112.6	L3	L3-S34 WeakPolarHBondContact CD1-OG 3.45Å
35	P	91.8	Very high	87.8	Confident	43 Å²	43	50.9 Å²	50.9	28%	0.279	31%	0.307	S	S	.	.			trans	-62	163.5	178.7	29	-35.3	0	0	0	111.2	I348	P35-I348 WeakPolarHBondContact CB-O 3.5Å; P35-I348 WeakPolarHBondContact CG-O 3.43Å
36	P	96.1	Very high	90.3	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.032	27%	0.271	C	S	.	.			trans	-53.9	155.3	174.8	-29.8	39.9	0	0	0	114	D38 V40 W67 I350	P36-D38 VanDerWaalsContact C-N 3.28Å; P36-D38 PolarHBondContact O-N 2.96Å; P36-V40 HydrophobicContact CB-CG2 4.38Å; P36-V40 HydrophobicContact CG-CG2 3.92Å; P36-W67 HydrophobicContact CG-CH2 4.21Å; P36-I350 HydrophobicContact CG-CD1 4.33Å
37	G	94.3	Very high	92.7	Very high	67 Å²	67	43.2 Å²	43.2	69%	0.691	24%	0.242	S	C	*	.	S	Bend	trans	-79	-9.5	-177.9	0	0	0	0	0	114.5	D61	G37-D61 PolarHBondContact N-OD2 2.94Å
38	D	97	Very high	94.4	Very high	72 Å²	72	42.8 Å²	42.8	39%	0.385	24%	0.239	S	C	.	.	S	Bend	trans	-147.2	172.9	176.8	-160.3	-6.3	0	0	0	109.3	P36 V40 S59 W60 D61	P36-D38 VanDerWaalsContact C-N 3.28Å; P36-D38 PolarHBondContact O-N 2.96Å; D38-V40 PolarHBondContact O-N 3.16Å; D38-S59 VanDerWaalsContact C-OG 3.29Å; D38-S59 PolarHBondContact O-OG 2.8Å; D38-W60 HydrophobicContact CB-CB 4.1Å; D38-W60 WeakPolarHBondContact OD2-CB 3.27Å; D38-D61 HydrophobicContact CB-CB 3.82Å
39	T	97.7	Very high	94.9	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.067	25%	0.25	C	C	.	.			trans	-46.4	133.4	-173.2	-70.3	0	0	0	0	112.6	S59 W60 T316 Y333	T39-S59 VanDerWaalsContact O-CA 3.31Å; T39-S59 WeakPolarHBondContact O-CA 3.41Å; T39-S59 PolarHBondContact O-OG 3.06Å; T39-S59 VanDerWaalsContact O-OG 3.1Å; T39-W60 VanDerWaalsContact O-CD1 3.31Å; T39-W60 PolarHBondContact O-N 2.83Å; T39-T316 HydrophobicContact CG2-CG2 3.64Å; T39-Y333 WeakPolarHBondContact CB-O 3.49Å; T39-Y333 VanDerWaalsContact CG2-O 3.27Å; T39-Y333 WeakPolarHBondContact CG2-O 3.34Å; T39-Y333 PolarHBondContact OG1-N 3.42Å; T39-Y333 PolarHBondContact OG1-O 2.88Å
40	V	98.6	Very high	95.2	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	133	174.2	-171.8	0	0	0	0	109.4	P36 D38 L43 A57 T58 T316 A330 I348 I350	P36-V40 HydrophobicContact CB-CG2 4.38Å; P36-V40 HydrophobicContact CG-CG2 3.92Å; D38-V40 PolarHBondContact O-N 3.16Å; V40-L43 HydrophobicContact CG1-CD2 4.09Å; V40-L43 HydrophobicContact CG1-CG 4.25Å; V40-A57 HydrophobicContact CG1-CB 4.02Å; V40-T58 WeakPolarHBondContact CA-O 3.24Å; V40-T58 WeakPolarHBondContact CG1-O 3.37Å; V40-T316 VanDerWaalsContact O-CB 3.31Å; V40-T316 WeakPolarHBondContact O-CB 3.46Å; V40-T316 PolarHBondContact O-OG1 3.27Å; V40-A330 HydrophobicContact CB-CB 3.54Å; V40-A330 HydrophobicContact CG1-CB 3.96Å; V40-A330 HydrophobicContact CG2-CB 3.87Å; V40-I348 HydrophobicContact CG2-CG2 3.73Å; V40-I350 HydrophobicContact CG2-CD1 4.11Å; V40-I350 HydrophobicContact CG2-CG1 3.95Å
41	S	98.7	Very high	95.2	Very high	27 Å²	27	49.6 Å²	49.6	19%	0.189	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-25.6	-177.2	57.9	0	0	0	0	113.5	T58 V87	S41-T58 PolarHBondContact N-O 3.08Å; S41-T58 PolarHBondContact OG-O 3.15Å; S41-T58 VanDerWaalsContact OG-O 3.06Å; S41-T58 PolarHBondContact OG-OG1 3.12Å; S41-V87 WeakPolarHBondContact CB-O 3.46Å; S41-V87 PolarHBondContact OG-O 3.48Å
42	C	98.7	Very high	95.2	Very high	10 Å²	10	46.9 Å²	46.9	7%	0.068	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	144.6	-180	-172	0	0	0	0	111.1	R44 A57 T58	C42-R44 PolarHBondContact SG-NH1 3.2Å; C42-A57 WeakPolarHBondContact O-CA 3.46Å; C42-T58 WeakPolarHBondContact CB-OG1 3.22Å; C42-T58 PolarHBondContact N-OG1 2.8Å; C42-T58 PolarHBondContact O-N 2.63Å
43	L	98.7	Very high	95.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.6	172.4	-68.1	167.5	0	0	0	109.8	V40 L55 A56 A57 V319 A330 I350	V40-L43 HydrophobicContact CG1-CD2 4.09Å; V40-L43 HydrophobicContact CG1-CG 4.25Å; L43-L55 HydrophobicContact CB-CD1 4.48Å; L43-L55 HydrophobicContact CD2-CD1 4.27Å; L43-A56 WeakPolarHBondContact CA-O 3.27Å; L43-A57 HydrophobicContact CD2-CB 3.72Å; L43-V319 HydrophobicContact CB-CB 4.21Å; L43-V319 HydrophobicContact CB-CG1 3.56Å; L43-A330 HydrophobicContact CD1-CB 4.16Å; L43-I350 HydrophobicContact CD1-CG2 4.37Å; L43-I350 HydrophobicContact CD2-CD1 4.07Å; L43-I350 HydrophobicContact CD2-CG1 4.44Å; L43-I350 HydrophobicContact CD2-CG2 4.01Å
44	R	98.4	Very high	95.4	Very high	69 Å²	69	43.7 Å²	43.7	26%	0.26	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	124.3	176.8	-65.7	-66.2	179.7	-107	9.9	111.5	C42 A56 A90 W92	C42-R44 PolarHBondContact SG-NH1 3.2Å; R44-A56 PolarHBondContact N-O 3.22Å; R44-A56 PolarHBondContact O-N 3.16Å; R44-A90 HydrophobicContact CG-CB 4.5Å; R44-A90 VanDerWaalsContact CG-O 3.29Å; R44-A90 WeakPolarHBondContact CG-O 3.41Å; R44-A90 PolarHBondContact NE-O 2.91Å; R44-W92 PolarHBondContact O-NE1 3.04Å
45	F	97.8	Very high	95.7	Very high	18 Å²	18	41.8 Å²	41.8	8%	0.079	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	149.5	165	-79.6	-81.4	0	0	0	111.5	T53 F54 L55 V69 W92 V319 F320 D321 P322 V326 C328	F45-T53 HydrophobicContact CD1-CG2 3.67Å; F45-T53 HydrophobicContact CE1-CG2 3.96Å; F45-F54 CarbonylContact C-O 3.39Å; F45-F54 VanDerWaalsContact CA-O 3.31Å; F45-F54 WeakPolarHBondContact CA-O 3.14Å; F45-L55 HydrophobicContact CD1-CB 4.42Å; F45-L55 HydrophobicContact CD1-CD1 4.34Å; F45-L55 HydrophobicContact CD2-CD1 4.19Å; F45-L55 HydrophobicContact CE1-CB 4.24Å; F45-L55 HydrophobicContact CE1-CD1 4.25Å; F45-L55 HydrophobicContact CE2-CD1 4.1Å; F45-L55 HydrophobicContact CG-CD1 4.33Å; F45-L55 HydrophobicContact CZ-CD1 4.12Å; F45-V69 HydrophobicContact CE1-CG2 4.09Å; F45-W92 PolarHBondContact O-NE1 2.89Å; F45-V319 HydrophobicContact CD2-CG1 3.65Å; F45-V319 HydrophobicContact CD2-CG2 4.28Å; F45-V319 HydrophobicContact CE2-CG1 3.79Å; F45-F320 VanDerWaalsContact CD2-C 3.48Å; F45-F320 VanDerWaalsContact CD2-O 3.26Å; F45-F320 WeakPolarHBondContact CD2-O 3.24Å; F45-D321 HydrophobicContact CD1-CB 4.2Å; F45-D321 VanDerWaalsContact CD2-CA 3.45Å; F45-D321 HydrophobicContact CD2-CB 4.1Å; F45-D321 HydrophobicContact CE1-CB 4.1Å; F45-D321 HydrophobicContact CE2-CB 4Å; F45-D321 HydrophobicContact CG-CB 4.18Å; F45-D321 HydrophobicContact CZ-CB 4.01Å; F45-P322 HydrophobicContact CB-CG 4.46Å; F45-V326 HydrophobicContact CZ-CG1 4.45Å; F45-C328 HydrophobicContact CE2-CB 3.83Å; F45-C328 HydrophobicContact CZ-CB 4.15Å
46	S	97.4	Very high	96	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.014	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-60	155.1	167.7	60	0	0	0	0	111	F54 P322	S46-F54 PolarHBondContact N-O 2.9Å; S46-F54 PolarHBondContact OG-N 3.03Å; S46-P322 WeakPolarHBondContact O-CG 3.29Å
47	P	95.9	Very high	96.1	Very high	32 Å²	32	39.6 Å²	39.6	21%	0.208	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-64.9	153.7	177.6	28.2	-35.1	0	0	0	111.8	S49 M50	P47-S49 PolarHBondContact O-N 2.79Å; P47-S49 VanDerWaalsContact O-N 3.16Å; P47-M50 HydrophobicContact CG-CG 4.19Å; P47-M50 PolarHBondContact O-N 3.03Å; P47-M50 VanDerWaalsContact O-N 3.12Å
48	E	92.2	Very high	96.3	Very high	124 Å²	124	36.4 Å²	36.4	58%	0.579	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-21.3	178.9	-168.8	172.5	-167.1	0	0	113.4	M50 P322 K323	E48-M50 PolarHBondContact O-N 2.77Å; E48-P322 HydrophobicContact CB-CB 3.73Å; E48-P322 HydrophobicContact CB-CG 4.39Å; E48-P322 HydrophobicContact CG-CB 4.34Å; E48-K323 WeakPolarHBondContact OE1-CE 3.13Å
49	S	90.6	Very high	96.4	Very high	87 Å²	87	33 Å²	33	61%	0.608	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.9	175.2	54	0	0	0	0	113.2	P47 T94	P47-S49 PolarHBondContact O-N 2.79Å; P47-S49 VanDerWaalsContact O-N 3.16Å; S49-T94 PolarHBondContact OG-O 2.77Å
50	M	93.3	Very high	96.4	Very high	48 Å²	48	38.1 Å²	38.1	24%	0.236	19%	0.194	C	C	.	.	S	Bend	trans	-79.8	138.5	175	-67	-160.9	76.9	0	0	111.8	P47 E48 T52 F54 W92	P47-M50 HydrophobicContact CG-CG 4.19Å; P47-M50 PolarHBondContact O-N 3.03Å; P47-M50 VanDerWaalsContact O-N 3.12Å; E48-M50 PolarHBondContact O-N 2.77Å; M50-T52 VanDerWaalsContact C-N 3.3Å; M50-T52 WeakPolarHBondContact CB-O 3.35Å; M50-T52 PolarHBondContact O-N 3.25Å; M50-F54 HydrophobicContact CE-CD2 4.03Å; M50-F54 HydrophobicContact CE-CE2 3.7Å; M50-F54 HydrophobicContact SD-CD2 4.09Å; M50-F54 HydrophobicContact SD-CE2 4.37Å; M50-W92 HydrophobicContact SD-CZ3 4.38Å
51	Q	90.3	Very high	96.4	Very high	173 Å²	173	39.6 Å²	39.6	81%	0.808	20%	0.201	S	C	*	.	S	Bend	trans	-65.2	-36.4	174.1	-174.6	176.7	7.8	0	0	112.3
52	T	92.1	Very high	96.4	Very high	37 Å²	37	40.8 Å²	40.8	23%	0.227	21%	0.206	C	C	.	.	S	Bend	trans	-101.3	133.4	179.4	-56.2	0	0	0	0	109.6	M50 F54 E68	M50-T52 VanDerWaalsContact C-N 3.3Å; M50-T52 WeakPolarHBondContact CB-O 3.35Å; M50-T52 PolarHBondContact O-N 3.25Å; T52-F54 HydrophobicContact CG2-CD1 4.43Å; T52-F54 HydrophobicContact CG2-CD2 4.37Å; T52-F54 HydrophobicContact CG2-CE1 3.79Å; T52-F54 HydrophobicContact CG2-CE2 3.73Å; T52-F54 HydrophobicContact CG2-CZ 3.39Å; T52-E68 HydrophobicContact CG2-CG 3.53Å
53	T	94.9	Very high	96.4	Very high	51 Å²	51	43.8 Å²	43.8	31%	0.313	22%	0.216	S	C	.	.			trans	-85	121.3	174.3	-59.3	0	0	0	0	109.9	F45 V69	F45-T53 HydrophobicContact CD1-CG2 3.67Å; F45-T53 HydrophobicContact CE1-CG2 3.96Å; T53-V69 HydrophobicContact CG2-CB 4.13Å; T53-V69 HydrophobicContact CG2-CG2 4.47Å; T53-V69 PolarHBondContact O-N 3.5Å
54	F	97.1	Very high	96.4	Very high	1 Å²	1	43.8 Å²	43.8	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.2	172.6	-62	-74.5	0	0	0	110.8	F12 F45 S46 M50 T52 I66 W67 E68 K78 W92	F12-F54 HydrophobicContact CB-CZ 4.5Å; F12-F54 HydrophobicContact CD1-CD1 4.2Å; F12-F54 AromaticContact CD1-CE1 3.67Å; F12-F54 HydrophobicContact CD1-CE1 3.67Å; F12-F54 HydrophobicContact CD1-CE2 4.03Å; F12-F54 AromaticContact CD1-CZ 3.58Å; F12-F54 HydrophobicContact CD1-CZ 3.58Å; F12-F54 HydrophobicContact CE1-CD1 4.18Å; F12-F54 HydrophobicContact CE1-CE1 4.03Å; F12-F54 HydrophobicContact CE1-CZ 4.36Å; F45-F54 CarbonylContact C-O 3.39Å; F45-F54 VanDerWaalsContact CA-O 3.31Å; F45-F54 WeakPolarHBondContact CA-O 3.14Å; S46-F54 PolarHBondContact N-O 2.9Å; S46-F54 PolarHBondContact OG-N 3.03Å; M50-F54 HydrophobicContact CE-CD2 4.03Å; M50-F54 HydrophobicContact CE-CE2 3.7Å; M50-F54 HydrophobicContact SD-CD2 4.09Å; M50-F54 HydrophobicContact SD-CE2 4.37Å; T52-F54 HydrophobicContact CG2-CD1 4.43Å; T52-F54 HydrophobicContact CG2-CD2 4.37Å; T52-F54 HydrophobicContact CG2-CE1 3.79Å; T52-F54 HydrophobicContact CG2-CE2 3.73Å; T52-F54 HydrophobicContact CG2-CZ 3.39Å; F54-I66 HydrophobicContact CB-CG2 3.85Å; F54-I66 HydrophobicContact CD1-CG2 3.88Å; F54-I66 HydrophobicContact CG-CG2 4.13Å; F54-W67 CarbonylContact C-O 3.04Å; F54-W67 VanDerWaalsContact CA-O 3.24Å; F54-W67 WeakPolarHBondContact CA-O 3.42Å; F54-E68 HydrophobicContact CD1-CB 4.09Å; F54-E68 HydrophobicContact CD1-CG 4.5Å; F54-E68 HydrophobicContact CE1-CB 3.87Å; F54-E68 HydrophobicContact CE1-CG 4.04Å; F54-K78 HydrophobicContact CD1-CG 4.43Å; F54-K78 HydrophobicContact CE1-CG 4.12Å; F54-W92 HydrophobicContact CB-CH2 3.78Å; F54-W92 HydrophobicContact CB-CZ2 3.89Å; F54-W92 HydrophobicContact CD2-CH2 4.41Å; F54-W92 HydrophobicContact CG-CH2 4.33Å
55	L	97.9	Very high	96.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.6	166	178.5	65.3	0	0	0	108.1	V32 L43 F45 I66 W67 V69 V319 I350	V32-L55 HydrophobicContact CG2-CD2 4.06Å; L43-L55 HydrophobicContact CB-CD1 4.48Å; L43-L55 HydrophobicContact CD2-CD1 4.27Å; F45-L55 HydrophobicContact CD1-CB 4.42Å; F45-L55 HydrophobicContact CD1-CD1 4.34Å; F45-L55 HydrophobicContact CD2-CD1 4.19Å; F45-L55 HydrophobicContact CE1-CB 4.24Å; F45-L55 HydrophobicContact CE1-CD1 4.25Å; F45-L55 HydrophobicContact CE2-CD1 4.1Å; F45-L55 HydrophobicContact CG-CD1 4.33Å; F45-L55 HydrophobicContact CZ-CD1 4.12Å; L55-I66 CarbonylContact O-C 3.59Å; L55-I66 WeakPolarHBondContact O-CA 3.27Å; L55-W67 PolarHBondContact N-O 2.78Å; L55-W67 PolarHBondContact O-N 3.22Å; L55-V69 HydrophobicContact CB-CG2 3.84Å; L55-V319 HydrophobicContact CD1-CG1 4.38Å; L55-I350 HydrophobicContact CD2-CG2 4.14Å
56	A	98.4	Very high	96.4	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.7	169.4	0	0	0	0	0	110	L43 R44 R65 I66 W92 L99	L43-A56 WeakPolarHBondContact CA-O 3.27Å; R44-A56 PolarHBondContact N-O 3.22Å; R44-A56 PolarHBondContact O-N 3.16Å; A56-R65 CarbonylContact C-O 3.49Å; A56-R65 VanDerWaalsContact CA-O 3.3Å; A56-R65 WeakPolarHBondContact CA-O 3.4Å; A56-I66 HydrophobicContact CB-CG1 4.09Å; A56-W92 HydrophobicContact CB-CZ2 3.98Å; A56-L99 HydrophobicContact CB-CD1 3.68Å; A56-L99 HydrophobicContact CB-CD2 4.33Å
57	A	98.7	Very high	96.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.7	172	0	0	0	0	0	111	V40 C42 L43 I64 R65 W67 I350	V40-A57 HydrophobicContact CG1-CB 4.02Å; C42-A57 WeakPolarHBondContact O-CA 3.46Å; L43-A57 HydrophobicContact CD2-CB 3.72Å; A57-I64 WeakPolarHBondContact O-CA 3.34Å; A57-R65 PolarHBondContact N-O 2.92Å; A57-R65 PolarHBondContact O-N 3.1Å; A57-W67 HydrophobicContact CB-CH2 3.85Å; A57-W67 HydrophobicContact CB-CZ3 3.5Å; A57-W67 VanDerWaalsContact CB-CZ3 3.5Å; A57-I350 HydrophobicContact CB-CD1 3.86Å
58	T	98.8	Very high	96.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	147.1	171	61.9	0	0	0	0	110	V40 S41 C42 I64 V87 A90	V40-T58 WeakPolarHBondContact CA-O 3.24Å; V40-T58 WeakPolarHBondContact CG1-O 3.37Å; S41-T58 PolarHBondContact N-O 3.08Å; S41-T58 PolarHBondContact OG-O 3.15Å; S41-T58 VanDerWaalsContact OG-O 3.06Å; S41-T58 PolarHBondContact OG-OG1 3.12Å; C42-T58 WeakPolarHBondContact CB-OG1 3.22Å; C42-T58 PolarHBondContact N-OG1 2.8Å; C42-T58 PolarHBondContact O-N 2.63Å; T58-I64 HydrophobicContact CG2-CG1 3.92Å; T58-I64 HydrophobicContact CG2-CG2 4.3Å; T58-V87 HydrophobicContact CG2-CB 4.24Å; T58-V87 HydrophobicContact CG2-CG1 3.49Å; T58-V87 VanDerWaalsContact CG2-CG1 3.49Å; T58-A90 HydrophobicContact CG2-CB 3.63Å
59	S	98.7	Very high	96.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	161.5	-174.1	168.3	0	0	0	0	113.1	D38 T39 D61 N62 R63 V87	D38-S59 VanDerWaalsContact C-OG 3.29Å; D38-S59 PolarHBondContact O-OG 2.8Å; T39-S59 VanDerWaalsContact O-CA 3.31Å; T39-S59 WeakPolarHBondContact O-CA 3.41Å; T39-S59 PolarHBondContact O-OG 3.06Å; T39-S59 VanDerWaalsContact O-OG 3.1Å; S59-D61 WeakPolarHBondContact CB-OD1 3.46Å; S59-D61 PolarHBondContact O-N 2.85Å; S59-D61 PolarHBondContact OG-N 2.96Å; S59-D61 VanDerWaalsContact OG-N 3.1Å; S59-D61 PolarHBondContact OG-OD1 2.85Å; S59-N62 PolarHBondContact O-N 2.64Å; S59-R63 PolarHBondContact N-O 3.46Å; S59-R63 VanDerWaalsContact N-O 3.12Å; S59-V87 PolarHBondContact O-N 3Å
60	W	98.4	Very high	96.5	Very high	119 Å²	119	33.3 Å²	33.3	45%	0.451	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.3	169.1	-75.2	81.5	0	0	0	113.5	D38 T39 N62 P86 F88	D38-W60 HydrophobicContact CB-CB 4.1Å; D38-W60 WeakPolarHBondContact OD2-CB 3.27Å; T39-W60 VanDerWaalsContact O-CD1 3.31Å; T39-W60 PolarHBondContact O-N 2.83Å; W60-N62 PolarHBondContact O-N 3.38Å; W60-N62 VanDerWaalsContact O-N 3.13Å; W60-N62 PolarHBondContact O-OD1 3.18Å; W60-P86 HydrophobicContact CD2-CB 4.09Å; W60-P86 HydrophobicContact CD2-CG 4.44Å; W60-P86 HydrophobicContact CE3-CB 3.78Å; W60-P86 HydrophobicContact CE3-CG 3.69Å; W60-P86 HydrophobicContact CG-CB 4.47Å; W60-P86 HydrophobicContact CZ3-CB 4.3Å; W60-P86 HydrophobicContact CZ3-CG 4.16Å; W60-F88 AromaticContact CH2-CE1 3.95Å; W60-F88 HydrophobicContact CH2-CE1 3.95Å; W60-F88 HydrophobicContact CH2-CZ 4.33Å; W60-F88 AromaticContact CZ2-CE1 3.82Å; W60-F88 HydrophobicContact CZ2-CE1 3.82Å; W60-F88 HydrophobicContact CZ3-CE1 4.37Å
61	D	97.7	Very high	95.9	Very high	31 Å²	31	33.9 Å²	33.9	17%	0.166	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	17.1	170.5	75.8	-2.9	0	0	0	113.9	G37 D38 S59 R63 R65	G37-D61 PolarHBondContact N-OD2 2.94Å; D38-D61 HydrophobicContact CB-CB 3.82Å; S59-D61 WeakPolarHBondContact CB-OD1 3.46Å; S59-D61 PolarHBondContact O-N 2.85Å; S59-D61 PolarHBondContact OG-N 2.96Å; S59-D61 VanDerWaalsContact OG-N 3.1Å; S59-D61 PolarHBondContact OG-OD1 2.85Å; D61-R63 PolarHBondContact O-N 3.12Å; D61-R63 WeakPolarHBondContact OD1-CB 3.45Å; D61-R63 PolarHBondContact OD1-N 2.84Å; D61-R63 VanDerWaalsContact OD1-N 3.14Å; D61-R65 IonicContact OD1-NH1 3.37Å; D61-R65 PolarHBondContact OD1-NH1 2.87Å; D61-R65 IonicContact OD2-CZ 3.33Å; D61-R65 IonicContact OD2-NH1 2.87Å; D61-R65 PolarHBondContact OD2-NH1 3.3Å; D61-R65 IonicContact OD2-NH2 3.03Å; D61-R65 PolarHBondContact OD2-NH2 2.87Å
62	N	98.6	Very high	95.4	Very high	52 Å²	52	29.3 Å²	29.3	28%	0.278	15%	0.151	S	C	.	.	S	Bend	trans	66.6	8.9	179.3	-48.3	-20.3	0	0	0	115.1	S59 W60 H83 G85 P86 V87	S59-N62 PolarHBondContact O-N 2.64Å; W60-N62 PolarHBondContact O-N 3.38Å; W60-N62 VanDerWaalsContact O-N 3.13Å; W60-N62 PolarHBondContact O-OD1 3.18Å; N62-H83 PolarHBondContact O-N 3.45Å; N62-G85 WeakPolarHBondContact CA-O 3.43Å; N62-G85 VanDerWaalsContact CG-C 3.43Å; N62-G85 WeakPolarHBondContact OD1-CA 3.29Å; N62-G85 PolarHBondContact OD1-O 2.83Å; N62-P86 WeakPolarHBondContact OD1-CA 3.11Å; N62-P86 WeakPolarHBondContact OD1-CD 3.46Å; N62-V87 WeakPolarHBondContact O-CG2 3.45Å
63	R	98.5	Very high	94.8	Very high	74 Å²	74	27.9 Å²	27.9	28%	0.279	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	155.7	-173.3	-65.8	163.1	177.2	-100.5	-6.9	113.3	S59 D61 E80 Q81 M82	S59-R63 PolarHBondContact N-O 3.46Å; S59-R63 VanDerWaalsContact N-O 3.12Å; D61-R63 PolarHBondContact O-N 3.12Å; D61-R63 WeakPolarHBondContact OD1-CB 3.45Å; D61-R63 PolarHBondContact OD1-N 2.84Å; D61-R63 VanDerWaalsContact OD1-N 3.14Å; R63-E80 IonicContact CZ-OE1 3.37Å; R63-E80 IonicContact NH1-OE1 2.77Å; R63-E80 PolarHBondContact NH1-OE1 2.89Å; R63-E80 IonicContact NH1-OE2 3.55Å; R63-E80 PolarHBondContact NH1-OE2 3.26Å; R63-Q81 WeakPolarHBondContact CA-O 3.43Å; R63-M82 HydrophobicContact CG-CB 4.3Å; R63-M82 HydrophobicContact CG-CG 4.25Å
64	I	98.4	Very high	94.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.2	161.8	-52.4	118.6	0	0	0	107.6	A57 T58 E80 Q81 V87 L99 S101 W111 F118	A57-I64 WeakPolarHBondContact O-CA 3.34Å; T58-I64 HydrophobicContact CG2-CG1 3.92Å; T58-I64 HydrophobicContact CG2-CG2 4.3Å; I64-E80 CarbonylContact O-C 3.56Å; I64-E80 WeakPolarHBondContact O-CA 3.46Å; I64-E80 WeakPolarHBondContact O-CB 3.48Å; I64-Q81 HydrophobicContact CD1-CB 4.49Å; I64-Q81 PolarHBondContact N-O 2.94Å; I64-Q81 PolarHBondContact O-N 2.84Å; I64-V87 HydrophobicContact CD1-CG1 4.34Å; I64-V87 HydrophobicContact CD1-CG2 4.42Å; I64-V87 HydrophobicContact CG1-CG1 3.92Å; I64-V87 HydrophobicContact CG1-CG2 4.3Å; I64-L99 HydrophobicContact CG2-CD2 3.49Å; I64-L99 VanDerWaalsContact CG2-CD2 3.49Å; I64-S101 VanDerWaalsContact CD1-OG 3.26Å; I64-S101 WeakPolarHBondContact CD1-OG 3.2Å; I64-W111 HydrophobicContact CB-CZ3 4.25Å; I64-W111 HydrophobicContact CG2-CE3 4.24Å; I64-W111 HydrophobicContact CG2-CZ3 3.94Å; I64-F118 HydrophobicContact CD1-CE2 3.98Å; I64-F118 HydrophobicContact CD1-CZ 3.63Å
65	R	98.3	Very high	94.3	Very high	22 Å²	22	27.8 Å²	27.8	8%	0.083	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.9	176.9	-69.8	179	-176.6	89.2	-10.8	110.2	F4 A56 A57 D61 W67 E80	F4-R65 HydrophobicContact CE1-CB 4.08Å; F4-R65 HydrophobicContact CE1-CG 4.25Å; F4-R65 HydrophobicContact CE2-CG 4.34Å; F4-R65 HydrophobicContact CZ-CB 4.1Å; F4-R65 HydrophobicContact CZ-CG 4.03Å; A56-R65 CarbonylContact C-O 3.49Å; A56-R65 VanDerWaalsContact CA-O 3.3Å; A56-R65 WeakPolarHBondContact CA-O 3.4Å; A57-R65 PolarHBondContact N-O 2.92Å; A57-R65 PolarHBondContact O-N 3.1Å; D61-R65 IonicContact OD1-NH1 3.37Å; D61-R65 PolarHBondContact OD1-NH1 2.87Å; D61-R65 IonicContact OD2-CZ 3.33Å; D61-R65 IonicContact OD2-NH1 2.87Å; D61-R65 PolarHBondContact OD2-NH1 3.3Å; D61-R65 IonicContact OD2-NH2 3.03Å; D61-R65 PolarHBondContact OD2-NH2 2.87Å; R65-W67 HydrophobicContact CB-CE3 4.34Å; R65-W67 HydrophobicContact CB-CH2 3.33Å; R65-W67 HydrophobicContact CB-CZ2 3.79Å; R65-W67 HydrophobicContact CB-CZ3 3.63Å; R65-W67 HydrophobicContact CG-CH2 4.31Å; R65-W67 WeakPolarHBondContact O-CZ3 3.3Å; R65-E80 HydrophobicContact CG-CB 3.91Å; R65-E80 IonicContact NE-OE2 2.83Å; R65-E80 PolarHBondContact NE-OE2 3.11Å
66	I	98.1	Very high	94.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.1	175	-61.6	174.3	0	0	0	109.7	F12 F54 L55 A56 K78 A79 W92 W111 L113	F12-I66 HydrophobicContact CE1-CB 4.42Å; F12-I66 HydrophobicContact CE1-CD1 4.37Å; F12-I66 HydrophobicContact CE1-CG2 3.81Å; F12-I66 HydrophobicContact CZ-CB 4.45Å; F12-I66 HydrophobicContact CZ-CD1 4.11Å; F12-I66 HydrophobicContact CZ-CG2 4.33Å; F54-I66 HydrophobicContact CB-CG2 3.85Å; F54-I66 HydrophobicContact CD1-CG2 3.88Å; F54-I66 HydrophobicContact CG-CG2 4.13Å; L55-I66 CarbonylContact O-C 3.59Å; L55-I66 WeakPolarHBondContact O-CA 3.27Å; A56-I66 HydrophobicContact CB-CG1 4.09Å; I66-K78 PolarHBondContact O-N 3.13Å; I66-A79 PolarHBondContact N-O 3.13Å; I66-A79 PolarHBondContact O-N 2.84Å; I66-W92 HydrophobicContact CD1-CH2 4.1Å; I66-W92 HydrophobicContact CD1-CZ2 4.39Å; I66-W92 HydrophobicContact CG2-CH2 4.49Å; I66-W111 HydrophobicContact CB-CH2 4.48Å; I66-W111 HydrophobicContact CD1-CD2 4.45Å; I66-W111 HydrophobicContact CD1-CE3 3.8Å; I66-W111 HydrophobicContact CD1-CH2 3.67Å; I66-W111 HydrophobicContact CD1-CZ2 4.33Å; I66-W111 HydrophobicContact CD1-CZ3 3.38Å; I66-W111 HydrophobicContact CG1-CE3 4.47Å; I66-W111 HydrophobicContact CG1-CH2 3.92Å; I66-W111 HydrophobicContact CG1-CZ3 3.64Å; I66-L113 HydrophobicContact CD1-CD1 4.17Å; I66-L113 HydrophobicContact CD1-CD2 3.55Å
67	W	97.5	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	142.4	171.7	-59.3	-101.7	0	0	0	110.3	F4 V32 Q33 P36 F54 L55 A57 R65 T75 I76 I350	F4-W67 AromaticContact CZ-CE2 3.84Å; F4-W67 AromaticContact CZ-CZ2 3.97Å; F4-W67 HydrophobicContact CZ-CZ2 3.97Å; F4-W67 AromaticContact CZ-NE1 3.7Å; V32-W67 HydrophobicContact CG1-CD2 3.76Å; V32-W67 HydrophobicContact CG1-CE3 4.43Å; V32-W67 HydrophobicContact CG1-CG 3.84Å; V32-W67 HydrophobicContact CG1-CZ2 4.14Å; Q33-W67 PolarHBondContact O-NE1 2.91Å; P36-W67 HydrophobicContact CG-CH2 4.21Å; F54-W67 CarbonylContact C-O 3.04Å; F54-W67 VanDerWaalsContact CA-O 3.24Å; F54-W67 WeakPolarHBondContact CA-O 3.42Å; L55-W67 PolarHBondContact N-O 2.78Å; L55-W67 PolarHBondContact O-N 3.22Å; A57-W67 HydrophobicContact CB-CH2 3.85Å; A57-W67 HydrophobicContact CB-CZ3 3.5Å; A57-W67 VanDerWaalsContact CB-CZ3 3.5Å; R65-W67 HydrophobicContact CB-CE3 4.34Å; R65-W67 HydrophobicContact CB-CH2 3.33Å; R65-W67 HydrophobicContact CB-CZ2 3.79Å; R65-W67 HydrophobicContact CB-CZ3 3.63Å; R65-W67 HydrophobicContact CG-CH2 4.31Å; R65-W67 WeakPolarHBondContact O-CZ3 3.3Å; W67-T75 HydrophobicContact CB-CG2 4.38Å; W67-I76 CarbonylContact C-O 3.51Å; W67-I76 VanDerWaalsContact CA-O 3.26Å; W67-I76 WeakPolarHBondContact CA-O 3.22Å; W67-I350 HydrophobicContact CH2-CD1 3.96Å; W67-I350 HydrophobicContact CZ3-CD1 4.31Å
68	E	96	Very high	93.9	Very high	15 Å²	15	32.9 Å²	32.9	7%	0.07	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.6	163.9	-173	178.1	145	0	0	108.8	T52 F54 Q70 T75 I76 K78	T52-E68 HydrophobicContact CG2-CG 3.53Å; F54-E68 HydrophobicContact CD1-CB 4.09Å; F54-E68 HydrophobicContact CD1-CG 4.5Å; F54-E68 HydrophobicContact CE1-CB 3.87Å; F54-E68 HydrophobicContact CE1-CG 4.04Å; E68-Q70 VanDerWaalsContact CD-NE2 3.31Å; E68-Q70 PolarHBondContact OE1-NE2 2.97Å; E68-T75 WeakPolarHBondContact O-CA 3.34Å; E68-I76 HydrophobicContact CB-CB 4.35Å; E68-I76 PolarHBondContact N-O 2.92Å; E68-I76 PolarHBondContact O-N 3.19Å; E68-K78 HydrophobicContact CB-CD 3.8Å; E68-K78 HydrophobicContact CB-CG 3.72Å; E68-K78 WeakPolarHBondContact OE2-CE 3.48Å; E68-K78 IonicContact OE2-NZ 3.26Å; E68-K78 PolarHBondContact OE2-NZ 3.2Å
69	V	94.1	Very high	93.8	Very high	22 Å²	22	32.9 Å²	32.9	13%	0.133	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	115.4	179.3	-173.5	0	0	0	0	108.4	F45 T53 L55 T75 M352	F45-V69 HydrophobicContact CE1-CG2 4.09Å; T53-V69 HydrophobicContact CG2-CB 4.13Å; T53-V69 HydrophobicContact CG2-CG2 4.47Å; T53-V69 PolarHBondContact O-N 3.5Å; L55-V69 HydrophobicContact CB-CG2 3.84Å; V69-T75 HydrophobicContact CG2-CG2 4.25Å; V69-M352 HydrophobicContact CG1-CE 4.46Å; V69-M352 HydrophobicContact CG1-SD 4.09Å; V69-M352 HydrophobicContact CG2-SD 4.49Å
70	Q	89.9	Confident	93.7	Very high	53 Å²	53	34.4 Å²	34.4	25%	0.248	18%	0.179	C	C	.	.			trans	-80.2	157.3	-179.8	-60.3	-63.1	-63.1	0	0	110.9	E68 N72 G73 S74 I76	E68-Q70 VanDerWaalsContact CD-NE2 3.31Å; E68-Q70 PolarHBondContact OE1-NE2 2.97Å; Q70-N72 WeakPolarHBondContact CB-OD1 3.37Å; Q70-N72 PolarHBondContact O-N 2.93Å; Q70-N72 VanDerWaalsContact O-N 3.12Å; Q70-G73 PolarHBondContact O-N 2.9Å; Q70-S74 WeakPolarHBondContact CB-O 3.33Å; Q70-S74 WeakPolarHBondContact CG-O 3.49Å; Q70-S74 PolarHBondContact N-O 2.79Å; Q70-I76 HydrophobicContact CG-CD1 4.04Å; Q70-I76 HydrophobicContact CG-CG1 4.26Å
71	A	82.4	Confident	93.7	Very high	59 Å²	59	30.8 Å²	30.8	49%	0.488	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.7	178.6	0	0	0	0	0	114.1	N20 G73	N20-A71 WeakPolarHBondContact OD1-CB 3.44Å; A71-G73 VanDerWaalsContact C-N 3.26Å
72	N	78.8	Confident	93.7	Very high	77 Å²	77	33.6 Å²	33.6	41%	0.412	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	4.9	174.4	70.2	-7.1	0	0	0	113.1	K21 M23 Q70 S74	K21-N72 VanDerWaalsContact O-CA 3.26Å; K21-N72 WeakPolarHBondContact O-CA 3.46Å; K21-N72 WeakPolarHBondContact O-CB 3.42Å; K21-N72 PolarHBondContact O-N 2.82Å; M23-N72 WeakPolarHBondContact CG-O 3.4Å; Q70-N72 WeakPolarHBondContact CB-OD1 3.37Å; Q70-N72 PolarHBondContact O-N 2.93Å; Q70-N72 VanDerWaalsContact O-N 3.12Å; N72-S74 VanDerWaalsContact C-N 3.27Å; N72-S74 PolarHBondContact ND2-OG 2.78Å; N72-S74 PolarHBondContact O-N 3Å; N72-S74 WeakPolarHBondContact OD1-CB 3.28Å; N72-S74 PolarHBondContact OD1-N 2.9Å; N72-S74 PolarHBondContact OD1-OG 3.19Å
73	G	79.8	Confident	93.7	Very high	8 Å²	8	31.3 Å²	31.3	8%	0.082	17%	0.168	C	C	.	.	S	Bend	trans	77.7	-0.3	-177.3	0	0	0	0	0	115.2	Q70 A71 M352	Q70-G73 PolarHBondContact O-N 2.9Å; A71-G73 VanDerWaalsContact C-N 3.26Å; G73-M352 WeakPolarHBondContact O-CE 3.19Å
74	S	87.4	Confident	93.7	Very high	47 Å²	47	35.1 Å²	35.1	33%	0.329	19%	0.189	S	C	.	.			trans	-75.5	153.6	172.6	75.8	0	0	0	0	110.8	Q70 N72	Q70-S74 WeakPolarHBondContact CB-O 3.33Å; Q70-S74 WeakPolarHBondContact CG-O 3.49Å; Q70-S74 PolarHBondContact N-O 2.79Å; N72-S74 VanDerWaalsContact C-N 3.27Å; N72-S74 PolarHBondContact ND2-OG 2.78Å; N72-S74 PolarHBondContact O-N 3Å; N72-S74 WeakPolarHBondContact OD1-CB 3.28Å; N72-S74 PolarHBondContact OD1-N 2.9Å; N72-S74 PolarHBondContact OD1-OG 3.19Å
75	T	94.1	Very high	93.7	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.2	179.7	47.7	0	0	0	0	111.7	V32 Q33 W67 E68 V69 M352	V32-T75 WeakPolarHBondContact CA-OG1 3.41Å; V32-T75 HydrophobicContact CB-CG2 4.43Å; V32-T75 HydrophobicContact CG1-CG2 4.13Å; V32-T75 HydrophobicContact CG2-CG2 4.09Å; Q33-T75 PolarHBondContact N-OG1 3.15Å; W67-T75 HydrophobicContact CB-CG2 4.38Å; E68-T75 WeakPolarHBondContact O-CA 3.34Å; V69-T75 HydrophobicContact CG2-CG2 4.25Å; T75-M352 HydrophobicContact CG2-CE 3.44Å; T75-M352 VanDerWaalsContact CG2-CE 3.44Å; T75-M352 HydrophobicContact CG2-SD 4.19Å
76	I	95.6	Very high	93.7	Very high	67 Å²	67	35.8 Å²	35.8	34%	0.344	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.5	176.4	-54.6	176.2	0	0	0	107.8	W67 E68 Q70 K78	W67-I76 CarbonylContact C-O 3.51Å; W67-I76 VanDerWaalsContact CA-O 3.26Å; W67-I76 WeakPolarHBondContact CA-O 3.22Å; E68-I76 HydrophobicContact CB-CB 4.35Å; E68-I76 PolarHBondContact N-O 2.92Å; E68-I76 PolarHBondContact O-N 3.19Å; Q70-I76 HydrophobicContact CG-CD1 4.04Å; Q70-I76 HydrophobicContact CG-CG1 4.26Å; I76-K78 PolarHBondContact O-N 3.28Å
77	P	96.2	Very high	93.8	Very high	23 Å²	23	35.8 Å²	35.8	15%	0.149	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	128.1	169.6	-29.3	38.4	0	0	0	111.5	L3 F4	L3-P77 HydrophobicContact CB-CG 4.5Å; F4-P77 HydrophobicContact CD1-CB 3.75Å; F4-P77 HydrophobicContact CD2-CB 4.47Å; F4-P77 HydrophobicContact CE1-CB 3.48Å; F4-P77 VanDerWaalsContact CE1-CB 3.48Å; F4-P77 HydrophobicContact CE1-CG 4.44Å; F4-P77 HydrophobicContact CE2-CB 4.21Å; F4-P77 HydrophobicContact CG-CB 4.25Å; F4-P77 HydrophobicContact CZ-CB 3.71Å; F4-P77 HydrophobicContact CZ-CG 4.25Å
78	K	94.9	Very high	93.8	Very high	19 Å²	19	36.5 Å²	36.5	8%	0.083	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-56.6	-178.9	-64.1	-64.4	-69	-154.4	0	112.6	T5 V11 F12 F54 I66 E68 I76	T5-K78 PolarHBondContact OG1-O 2.99Å; V11-K78 WeakPolarHBondContact O-CE 3.48Å; V11-K78 PolarHBondContact O-NZ 2.9Å; V11-K78 VanDerWaalsContact O-NZ 3.08Å; F12-K78 HydrophobicContact CE1-CB 4.09Å; F12-K78 HydrophobicContact CZ-CB 4.34Å; F54-K78 HydrophobicContact CD1-CG 4.43Å; F54-K78 HydrophobicContact CE1-CG 4.12Å; I66-K78 PolarHBondContact O-N 3.13Å; E68-K78 HydrophobicContact CB-CD 3.8Å; E68-K78 HydrophobicContact CB-CG 3.72Å; E68-K78 WeakPolarHBondContact OE2-CE 3.48Å; E68-K78 IonicContact OE2-NZ 3.26Å; E68-K78 PolarHBondContact OE2-NZ 3.2Å; I76-K78 PolarHBondContact O-N 3.28Å
79	A	95.6	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	163	-177	0	0	0	0	0	111.3	F4 F12 I66 W111	F4-A79 WeakPolarHBondContact CD1-O 3.17Å; F12-A79 HydrophobicContact CE2-CB 4.09Å; F12-A79 HydrophobicContact CZ-CB 3.84Å; I66-A79 PolarHBondContact N-O 3.13Å; I66-A79 PolarHBondContact O-N 2.84Å; A79-W111 HydrophobicContact CB-CH2 3.76Å; A79-W111 HydrophobicContact CB-CZ2 3.47Å; A79-W111 VanDerWaalsContact CB-CZ2 3.47Å
80	E	97.3	Very high	94.1	Very high	32 Å²	32	35.1 Å²	35.1	15%	0.15	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	152.4	172.4	68.2	176.7	-177.4	0	0	111.3	F4 R63 I64 R65	F4-E80 HydrophobicContact CB-CB 4.16Å; F4-E80 HydrophobicContact CB-CG 3.73Å; F4-E80 HydrophobicContact CD1-CB 4.32Å; F4-E80 HydrophobicContact CG-CB 4.17Å; F4-E80 HydrophobicContact CG-CG 4.2Å; R63-E80 IonicContact CZ-OE1 3.37Å; R63-E80 IonicContact NH1-OE1 2.77Å; R63-E80 PolarHBondContact NH1-OE1 2.89Å; R63-E80 IonicContact NH1-OE2 3.55Å; R63-E80 PolarHBondContact NH1-OE2 3.26Å; I64-E80 CarbonylContact O-C 3.56Å; I64-E80 WeakPolarHBondContact O-CA 3.46Å; I64-E80 WeakPolarHBondContact O-CB 3.48Å; R65-E80 HydrophobicContact CG-CB 3.91Å; R65-E80 IonicContact NE-OE2 2.83Å; R65-E80 PolarHBondContact NE-OE2 3.11Å
81	Q	98	Very high	94.5	Very high	43 Å²	43	33 Å²	33	20%	0.201	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	163.1	170.6	-73.4	-67.7	-2.7	0	0	109.8	R63 I64 W111 N116 F118	R63-Q81 WeakPolarHBondContact CA-O 3.43Å; I64-Q81 HydrophobicContact CD1-CB 4.49Å; I64-Q81 PolarHBondContact N-O 2.94Å; I64-Q81 PolarHBondContact O-N 2.84Å; Q81-W111 HydrophobicContact CB-CD2 4.24Å; Q81-W111 HydrophobicContact CB-CE3 4.21Å; Q81-W111 HydrophobicContact CB-CZ3 4.33Å; Q81-W111 HydrophobicContact CG-CD2 3.53Å; Q81-W111 HydrophobicContact CG-CE3 3.97Å; Q81-W111 HydrophobicContact CG-CG 3.96Å; Q81-W111 HydrophobicContact CG-CH2 4.09Å; Q81-W111 HydrophobicContact CG-CZ2 3.65Å; Q81-W111 HydrophobicContact CG-CZ3 4.22Å; Q81-N116 PolarHBondContact NE2-O 2.84Å; Q81-N116 PolarHBondContact NE2-OD1 2.83Å; Q81-F118 HydrophobicContact CB-CD1 4.3Å; Q81-F118 HydrophobicContact CB-CD2 4.01Å; Q81-F118 HydrophobicContact CB-CE1 4.36Å; Q81-F118 HydrophobicContact CB-CE2 4.09Å; Q81-F118 HydrophobicContact CB-CG 4.12Å; Q81-F118 HydrophobicContact CB-CZ 4.25Å; Q81-F118 HydrophobicContact CG-CB 4.18Å; Q81-F118 HydrophobicContact CG-CD2 3.99Å; Q81-F118 HydrophobicContact CG-CG 4.07Å
82	M	98.1	Very high	95.3	Very high	90 Å²	90	31.3 Å²	31.3	44%	0.443	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.3	-171.5	-175.6	177.4	70.9	0	0	111.6	R63	R63-M82 HydrophobicContact CG-CB 4.3Å; R63-M82 HydrophobicContact CG-CG 4.25Å
83	H	98.6	Very high	96.2	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.019	15%	0.148	C	C	.	.			trans	-90.1	171.8	166	-87.5	-95.3	0	0	0	111.4	N62 G85 V87 S101 S103 D105 T107 Q109 F118	N62-H83 PolarHBondContact O-N 3.45Å; H83-G85 WeakPolarHBondContact CB-O 3.23Å; H83-G85 PolarHBondContact O-N 3.25Å; H83-V87 HydrophobicContact CB-CG2 3.79Å; H83-V87 VanDerWaalsContact CD2-CG2 3.47Å; H83-V87 WeakPolarHBondContact CD2-CG2 3.34Å; H83-S101 PolarHBondContact NE2-OG 3.42Å; H83-S101 VanDerWaalsContact NE2-OG 3.14Å; H83-S103 WeakPolarHBondContact ND1-CB 3.45Å; H83-D105 WeakPolarHBondContact CB-OD2 3.4Å; H83-D105 IonicContact CG-OD2 2.91Å; H83-D105 IonicContact ND1-OD1 3.77Å; H83-D105 PolarHBondContact ND1-OD1 3.47Å; H83-D105 IonicContact ND1-OD2 3.48Å; H83-D105 PolarHBondContact ND1-OD2 3.03Å; H83-T107 PolarHBondContact ND1-OG1 2.85Å; H83-Q109 WeakPolarHBondContact CE1-CG 3.32Å; H83-F118 AromaticContact CD2-CZ 3.67Å; H83-F118 AromaticContact NE2-CZ 3.55Å
84	Q	98.4	Very high	96.9	Very high	155 Å²	155	31.1 Å²	31.1	72%	0.724	17%	0.167	S	C	*	.	S	Bend	trans	-87.9	10.5	174.3	-59.3	-57.1	-46.5	0	0	113.1	D105	Q84-D105 HydrophobicContact CB-CB 4.04Å; Q84-D105 PolarHBondContact N-OD2 2.96Å
85	G	98.6	Very high	97.3	Very high	7 Å²	7	33.4 Å²	33.4	7%	0.072	18%	0.175	C	C	.	.	S	Bend	trans	-169.9	175.3	176.6	0	0	0	0	0	112.1	N62 H83 V87 S103	N62-G85 WeakPolarHBondContact CA-O 3.43Å; N62-G85 VanDerWaalsContact CG-C 3.43Å; N62-G85 WeakPolarHBondContact OD1-CA 3.29Å; N62-G85 PolarHBondContact OD1-O 2.83Å; H83-G85 WeakPolarHBondContact CB-O 3.23Å; H83-G85 PolarHBondContact O-N 3.25Å; G85-V87 PolarHBondContact O-N 2.79Å; G85-S103 VanDerWaalsContact C-OG 3.31Å; G85-S103 PolarHBondContact O-OG 2.83Å
86	P	98.7	Very high	97.4	Very high	29 Å²	29	33.3 Å²	33.3	19%	0.188	18%	0.175	C	C	.	.			trans	-49.2	129.8	-176.8	-35.1	37.7	0	0	0	112.7	W60 N62 F88 S103 A104	W60-P86 HydrophobicContact CD2-CB 4.09Å; W60-P86 HydrophobicContact CD2-CG 4.44Å; W60-P86 HydrophobicContact CE3-CB 3.78Å; W60-P86 HydrophobicContact CE3-CG 3.69Å; W60-P86 HydrophobicContact CG-CB 4.47Å; W60-P86 HydrophobicContact CZ3-CB 4.3Å; W60-P86 HydrophobicContact CZ3-CG 4.16Å; N62-P86 WeakPolarHBondContact OD1-CA 3.11Å; N62-P86 WeakPolarHBondContact OD1-CD 3.46Å; P86-F88 HydrophobicContact CB-CD1 4.37Å; P86-F88 HydrophobicContact CB-CE1 3.75Å; P86-F88 HydrophobicContact CB-CZ 4.32Å; P86-S103 CarbonylContact O-C 3.57Å; P86-S103 VanDerWaalsContact O-CA 3.32Å; P86-S103 WeakPolarHBondContact O-CA 3.45Å; P86-S103 WeakPolarHBondContact O-CB 3.46Å; P86-S103 PolarHBondContact O-OG 2.81Å; P86-A104 HydrophobicContact CB-CB 4.14Å; P86-A104 HydrophobicContact CG-CB 4.35Å; P86-A104 PolarHBondContact O-N 2.88Å
87	V	98.9	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.8	179.5	-169.5	0	0	0	0	107.8	S41 T58 S59 N62 I64 H83 G85 V102	S41-V87 WeakPolarHBondContact CB-O 3.46Å; S41-V87 PolarHBondContact OG-O 3.48Å; T58-V87 HydrophobicContact CG2-CB 4.24Å; T58-V87 HydrophobicContact CG2-CG1 3.49Å; T58-V87 VanDerWaalsContact CG2-CG1 3.49Å; S59-V87 PolarHBondContact O-N 3Å; N62-V87 WeakPolarHBondContact O-CG2 3.45Å; I64-V87 HydrophobicContact CD1-CG1 4.34Å; I64-V87 HydrophobicContact CD1-CG2 4.42Å; I64-V87 HydrophobicContact CG1-CG1 3.92Å; I64-V87 HydrophobicContact CG1-CG2 4.3Å; H83-V87 HydrophobicContact CB-CG2 3.79Å; H83-V87 VanDerWaalsContact CD2-CG2 3.47Å; H83-V87 WeakPolarHBondContact CD2-CG2 3.34Å; G85-V87 PolarHBondContact O-N 2.79Å; V87-V102 VanDerWaalsContact CG1-O 3.31Å; V87-V102 WeakPolarHBondContact CG1-O 3.49Å
88	F	98.7	Very high	97.4	Very high	14 Å²	14	33 Å²	33	6%	0.061	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-20.8	-171	-68.4	-28.7	0	0	0	115	W60 P86 V102 A104 P127 V128 K129 W147	W60-F88 AromaticContact CH2-CE1 3.95Å; W60-F88 HydrophobicContact CH2-CE1 3.95Å; W60-F88 HydrophobicContact CH2-CZ 4.33Å; W60-F88 AromaticContact CZ2-CE1 3.82Å; W60-F88 HydrophobicContact CZ2-CE1 3.82Å; W60-F88 HydrophobicContact CZ3-CE1 4.37Å; P86-F88 HydrophobicContact CB-CD1 4.37Å; P86-F88 HydrophobicContact CB-CE1 3.75Å; P86-F88 HydrophobicContact CB-CZ 4.32Å; F88-V102 PolarHBondContact N-O 3.14Å; F88-A104 HydrophobicContact CE2-CB 3.87Å; F88-A104 HydrophobicContact CZ-CB 3.79Å; F88-P127 HydrophobicContact CE2-CB 3.86Å; F88-V128 WeakPolarHBondContact CD2-O 3.2Å; F88-K129 HydrophobicContact CB-CD 4.36Å; F88-K129 HydrophobicContact CD2-CD 4.48Å; F88-W147 AromaticContact CE2-CH2 3.76Å; F88-W147 HydrophobicContact CE2-CH2 3.76Å; F88-W147 HydrophobicContact CE2-CZ2 4.15Å; F88-W147 HydrophobicContact CE2-CZ3 4.2Å; F88-W147 AromaticContact CZ-CH2 3.97Å; F88-W147 HydrophobicContact CZ-CH2 3.97Å
89	G	98.3	Very high	97.6	Very high	5 Å²	5	32.1 Å²	32.1	5%	0.052	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	157.4	-177	0	0	0	0	0	111.9	S101 V102	G89-S101 WeakPolarHBondContact O-CA 3.33Å; G89-V102 PolarHBondContact N-O 2.84Å; G89-V102 WeakPolarHBondContact O-CG2 3.07Å; G89-V102 PolarHBondContact O-N 3.03Å
90	A	98.6	Very high	97.8	Very high	3 Å²	3	32.3 Å²	32.3	3%	0.025	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	159.8	172.1	0	0	0	0	0	110.9	R44 T58 L99 F100	R44-A90 HydrophobicContact CG-CB 4.5Å; R44-A90 VanDerWaalsContact CG-O 3.29Å; R44-A90 WeakPolarHBondContact CG-O 3.41Å; R44-A90 PolarHBondContact NE-O 2.91Å; T58-A90 HydrophobicContact CG2-CB 3.63Å; A90-L99 HydrophobicContact CB-CD1 4.47Å; A90-L99 HydrophobicContact CB-CD2 4.29Å; A90-L99 HydrophobicContact CB-CG 4.44Å; A90-F100 CarbonylContact C-O 3.58Å; A90-F100 WeakPolarHBondContact CA-O 3.19Å; A90-F100 VanDerWaalsContact CB-O 3.28Å; A90-F100 WeakPolarHBondContact CB-O 3.2Å
91	C	98.6	Very high	97.8	Very high	10 Å²	10	30.8 Å²	30.8	7%	0.068	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	148.9	168.8	61.2	0	0	0	0	110.5	F100 F133	C91-F100 PolarHBondContact N-O 3.02Å; C91-F100 PolarHBondContact O-N 3.5Å; C91-F133 PolarHBondContact SG-N 2.91Å
92	W	98.3	Very high	97.9	Very high	22 Å²	22	28.7 Å²	28.7	8%	0.083	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	150.5	174.9	-69.3	88	0	0	0	111.1	R44 F45 M50 F54 A56 I66 G96 L99 L113 F133	R44-W92 PolarHBondContact O-NE1 3.04Å; F45-W92 PolarHBondContact O-NE1 2.89Å; M50-W92 HydrophobicContact SD-CZ3 4.38Å; F54-W92 HydrophobicContact CB-CH2 3.78Å; F54-W92 HydrophobicContact CB-CZ2 3.89Å; F54-W92 HydrophobicContact CD2-CH2 4.41Å; F54-W92 HydrophobicContact CG-CH2 4.33Å; A56-W92 HydrophobicContact CB-CZ2 3.98Å; I66-W92 HydrophobicContact CD1-CH2 4.1Å; I66-W92 HydrophobicContact CD1-CZ2 4.39Å; I66-W92 HydrophobicContact CG2-CH2 4.49Å; W92-G96 WeakPolarHBondContact CZ3-O 3.41Å; W92-L99 HydrophobicContact CD2-CD1 3.61Å; W92-L99 HydrophobicContact CE3-CD1 4.29Å; W92-L99 HydrophobicContact CG-CD1 3.86Å; W92-L99 HydrophobicContact CZ2-CD1 3.88Å; W92-L113 HydrophobicContact CE3-CD1 4.32Å; W92-L113 HydrophobicContact CH2-CD1 3.62Å; W92-L113 HydrophobicContact CZ3-CD1 3.26Å; W92-F133 WeakPolarHBondContact O-CB 3.32Å
93	S	97.4	Very high	97.9	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.028	13%	0.133	C	C	.	.			trans	-66.6	155.5	158.1	58.8	0	0	0	0	110.2	D95 G96 S97 K98	S93-D95 VanDerWaalsContact CB-OD1 3.26Å; S93-D95 WeakPolarHBondContact CB-OD1 3.43Å; S93-D95 PolarHBondContact O-N 3.02Å; S93-D95 PolarHBondContact OG-OD1 3.35Å; S93-G96 PolarHBondContact O-N 2.86Å; S93-S97 PolarHBondContact OG-N 2.92Å; S93-K98 PolarHBondContact N-O 2.74Å; S93-K98 PolarHBondContact OG-N 2.92Å; S93-K98 PolarHBondContact OG-O 3.45Å
94	T	95.4	Very high	97.9	Very high	77 Å²	77	25.6 Å²	25.6	47%	0.472	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.9	-176.6	45.2	0	0	0	0	114.2	S49 G96 F133 T135	S49-T94 PolarHBondContact OG-O 2.77Å; T94-G96 VanDerWaalsContact C-N 3.32Å; T94-F133 HydrophobicContact CG2-CD1 4.49Å; T94-T135 HydrophobicContact CG2-CG2 4.4Å; T94-T135 WeakPolarHBondContact CG2-OG1 3.34Å; T94-T135 PolarHBondContact OG1-OG1 3.36Å
95	D	94.8	Very high	98	Very high	95 Å²	95	20 Å²	20	51%	0.508	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-6.7	173.8	68.8	-12.3	0	0	0	113	S93 S97	S93-D95 VanDerWaalsContact CB-OD1 3.26Å; S93-D95 WeakPolarHBondContact CB-OD1 3.43Å; S93-D95 PolarHBondContact O-N 3.02Å; S93-D95 PolarHBondContact OG-OD1 3.35Å; D95-S97 VanDerWaalsContact CG-OG 3.23Å; D95-S97 PolarHBondContact O-N 2.95Å; D95-S97 PolarHBondContact OD1-N 2.82Å; D95-S97 PolarHBondContact OD1-OG 2.82Å; D95-S97 VanDerWaalsContact OD1-OG 3.11Å; D95-S97 WeakPolarHBondContact OD2-CB 3.37Å; D95-S97 PolarHBondContact OD2-OG 3.38Å
96	G	96.3	Very high	98	Very high	1 Å²	1	24 Å²	24	1%	0.01	13%	0.134	C	C	.	.	S	Bend	trans	70.8	3.8	-177	0	0	0	0	0	115.2	W92 S93 T94 K98	W92-G96 WeakPolarHBondContact CZ3-O 3.41Å; S93-G96 PolarHBondContact O-N 2.86Å; T94-G96 VanDerWaalsContact C-N 3.32Å; G96-K98 VanDerWaalsContact C-N 3.32Å; G96-K98 PolarHBondContact O-N 3.35Å
97	S	95.7	Very high	98	Very high	39 Å²	39	23.4 Å²	23.4	27%	0.273	13%	0.13	S	C	.	.	S	Bend	trans	-77.3	-20	-177.4	76.9	0	0	0	0	113.4	S93 D95 L113	S93-S97 PolarHBondContact OG-N 2.92Å; D95-S97 VanDerWaalsContact CG-OG 3.23Å; D95-S97 PolarHBondContact O-N 2.95Å; D95-S97 PolarHBondContact OD1-N 2.82Å; D95-S97 PolarHBondContact OD1-OG 2.82Å; D95-S97 VanDerWaalsContact OD1-OG 3.11Å; D95-S97 WeakPolarHBondContact OD2-CB 3.37Å; D95-S97 PolarHBondContact OD2-OG 3.38Å; S97-L113 PolarHBondContact O-N 3.13Å; S97-L113 VanDerWaalsContact O-N 3.17Å
98	K	97.4	Very high	97.9	Very high	45 Å²	45	23.4 Å²	23.4	20%	0.196	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147	-178.9	-48.8	-64	179	-86.6	0	111.4	S93 G96 F100 M110 W111 D112	S93-K98 PolarHBondContact N-O 2.74Å; S93-K98 PolarHBondContact OG-N 2.92Å; S93-K98 PolarHBondContact OG-O 3.45Å; G96-K98 VanDerWaalsContact C-N 3.32Å; G96-K98 PolarHBondContact O-N 3.35Å; K98-F100 HydrophobicContact CB-CE2 4.17Å; K98-F100 HydrophobicContact CB-CZ 4.28Å; K98-M110 HydrophobicContact CB-CG 4.16Å; K98-M110 HydrophobicContact CD-CG 4.09Å; K98-M110 HydrophobicContact CD-SD 3.95Å; K98-M110 HydrophobicContact CG-CG 4.26Å; K98-M110 HydrophobicContact CG-SD 4.05Å; K98-W111 VanDerWaalsContact CA-O 3.28Å; K98-W111 WeakPolarHBondContact CA-O 3.29Å; K98-D112 HydrophobicContact CD-CB 3.73Å; K98-D112 WeakPolarHBondContact CE-OD2 3.44Å; K98-D112 IonicContact NZ-OD2 2.69Å; K98-D112 PolarHBondContact NZ-OD2 2.85Å
99	L	98.5	Very high	97.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.4	162.2	-172.3	99.3	0	0	0	109	A56 I64 A90 W92 W111	A56-L99 HydrophobicContact CB-CD1 3.68Å; A56-L99 HydrophobicContact CB-CD2 4.33Å; I64-L99 HydrophobicContact CG2-CD2 3.49Å; I64-L99 VanDerWaalsContact CG2-CD2 3.49Å; A90-L99 HydrophobicContact CB-CD1 4.47Å; A90-L99 HydrophobicContact CB-CD2 4.29Å; A90-L99 HydrophobicContact CB-CG 4.44Å; W92-L99 HydrophobicContact CD2-CD1 3.61Å; W92-L99 HydrophobicContact CE3-CD1 4.29Å; W92-L99 HydrophobicContact CG-CD1 3.86Å; W92-L99 HydrophobicContact CZ2-CD1 3.88Å; L99-W111 HydrophobicContact CB-CB 4.31Å; L99-W111 HydrophobicContact CD2-CE3 3.99Å; L99-W111 PolarHBondContact N-O 3.23Å; L99-W111 WeakPolarHBondContact O-CB 3.42Å; L99-W111 PolarHBondContact O-N 2.78Å
100	F	98.7	Very high	97.9	Very high	3 Å²	3	25.2 Å²	25.2	1%	0.013	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	145.3	170	-57.7	-85.1	0	0	0	110	A90 C91 K98 Q109 M110 V121 F133 L142 T156	A90-F100 CarbonylContact C-O 3.58Å; A90-F100 WeakPolarHBondContact CA-O 3.19Å; A90-F100 VanDerWaalsContact CB-O 3.28Å; A90-F100 WeakPolarHBondContact CB-O 3.2Å; C91-F100 PolarHBondContact N-O 3.02Å; C91-F100 PolarHBondContact O-N 3.5Å; K98-F100 HydrophobicContact CB-CE2 4.17Å; K98-F100 HydrophobicContact CB-CZ 4.28Å; F100-Q109 CarbonylContact C-O 3.58Å; F100-Q109 VanDerWaalsContact CA-O 3.29Å; F100-Q109 WeakPolarHBondContact CA-O 3.09Å; F100-M110 HydrophobicContact CD1-CB 3.79Å; F100-M110 HydrophobicContact CD1-CG 3.97Å; F100-M110 HydrophobicContact CE1-CB 3.65Å; F100-M110 HydrophobicContact CE1-CG 3.48Å; F100-M110 VanDerWaalsContact CE1-CG 3.48Å; F100-M110 HydrophobicContact CE1-SD 3.71Å; F100-M110 HydrophobicContact CZ-CG 4.04Å; F100-M110 HydrophobicContact CZ-SD 3.99Å; F100-V121 HydrophobicContact CD1-CG2 4.18Å; F100-V121 HydrophobicContact CE1-CG2 4.45Å; F100-F133 HydrophobicContact CD2-CB 4.35Å; F100-F133 AromaticContact CD2-CD2 3.88Å; F100-F133 HydrophobicContact CD2-CD2 3.88Å; F100-F133 HydrophobicContact CD2-CG 4.35Å; F100-F133 HydrophobicContact CE2-CB 4.38Å; F100-F133 AromaticContact CE2-CD2 3.24Å; F100-F133 HydrophobicContact CE2-CD2 3.24Å; F100-F133 AromaticContact CE2-CE2 3.57Å; F100-F133 HydrophobicContact CE2-CE2 3.57Å; F100-F133 AromaticContact CE2-CG 3.9Å; F100-F133 HydrophobicContact CE2-CG 3.9Å; F100-F133 HydrophobicContact CE2-CZ 4.45Å; F100-F133 AromaticContact CZ-CD2 3.73Å; F100-F133 HydrophobicContact CZ-CD2 3.73Å; F100-F133 AromaticContact CZ-CE2 3.65Å; F100-F133 HydrophobicContact CZ-CE2 3.65Å; F100-L142 HydrophobicContact CB-CD1 3.72Å; F100-L142 HydrophobicContact CB-CD2 4.26Å; F100-L142 HydrophobicContact CD1-CD1 4.18Å; F100-L142 HydrophobicContact CD1-CD2 3.84Å; F100-L142 HydrophobicContact CD1-CG 4.44Å; F100-L142 HydrophobicContact CD2-CD1 4.25Å; F100-L142 HydrophobicContact CG-CD1 3.78Å; F100-L142 HydrophobicContact CG-CD2 4.23Å; F100-T156 HydrophobicContact CE1-CG2 3.56Å; F100-T156 HydrophobicContact CZ-CG2 3.91Å
101	S	98.8	Very high	97.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	149.9	-179.8	50.1	0	0	0	0	111.2	I64 H83 G89 A108 Q109	I64-S101 VanDerWaalsContact CD1-OG 3.26Å; I64-S101 WeakPolarHBondContact CD1-OG 3.2Å; H83-S101 PolarHBondContact NE2-OG 3.42Å; H83-S101 VanDerWaalsContact NE2-OG 3.14Å; G89-S101 WeakPolarHBondContact O-CA 3.33Å; S101-A108 CarbonylContact O-C 3.59Å; S101-A108 VanDerWaalsContact O-CA 3.3Å; S101-A108 WeakPolarHBondContact O-CA 3.23Å; S101-Q109 PolarHBondContact N-O 3.34Å; S101-Q109 PolarHBondContact O-N 2.79Å
102	V	98.9	Very high	97.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.1	-176.2	-72.9	0	0	0	0	111.2	V87 F88 G89 A108 V128 A131 T144	V87-V102 VanDerWaalsContact CG1-O 3.31Å; V87-V102 WeakPolarHBondContact CG1-O 3.49Å; F88-V102 PolarHBondContact N-O 3.14Å; G89-V102 PolarHBondContact N-O 2.84Å; G89-V102 WeakPolarHBondContact O-CG2 3.07Å; G89-V102 PolarHBondContact O-N 3.03Å; V102-A108 HydrophobicContact CG1-CB 3.8Å; V102-V128 HydrophobicContact CB-CB 3.77Å; V102-V128 HydrophobicContact CB-CG1 3.55Å; V102-V128 HydrophobicContact CG1-CB 4.11Å; V102-V128 HydrophobicContact CG1-CG1 3.44Å; V102-V128 VanDerWaalsContact CG1-CG1 3.44Å; V102-V128 HydrophobicContact CG2-CG1 4.22Å; V102-A131 HydrophobicContact CB-CB 4.33Å; V102-A131 HydrophobicContact CG1-CB 3.7Å; V102-A131 HydrophobicContact CG2-CB 3.73Å; V102-T144 HydrophobicContact CG1-CG2 3.91Å
103	S	98.9	Very high	97.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	163.2	-166.7	170.6	0	0	0	0	114.4	H83 G85 P86 D105 K106 T107 V128	H83-S103 WeakPolarHBondContact ND1-CB 3.45Å; G85-S103 VanDerWaalsContact C-OG 3.31Å; G85-S103 PolarHBondContact O-OG 2.83Å; P86-S103 CarbonylContact O-C 3.57Å; P86-S103 VanDerWaalsContact O-CA 3.32Å; P86-S103 WeakPolarHBondContact O-CA 3.45Å; P86-S103 WeakPolarHBondContact O-CB 3.46Å; P86-S103 PolarHBondContact O-OG 2.81Å; S103-D105 VanDerWaalsContact CB-OD1 3.29Å; S103-D105 WeakPolarHBondContact CB-OD1 3.46Å; S103-D105 PolarHBondContact O-N 3.1Å; S103-D105 VanDerWaalsContact OG-CG 3.28Å; S103-D105 PolarHBondContact OG-N 3.43Å; S103-D105 PolarHBondContact OG-OD1 2.63Å; S103-K106 PolarHBondContact O-N 3.02Å; S103-K106 VanDerWaalsContact O-N 3.1Å; S103-T107 PolarHBondContact N-O 3.41Å; S103-V128 PolarHBondContact O-N 3.1Å
104	A	98.9	Very high	97.4	Very high	28 Å²	28	26.5 Å²	26.5	23%	0.231	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-21.7	164.4	0	0	0	0	0	113.9	P86 F88 K106	P86-A104 HydrophobicContact CB-CB 4.14Å; P86-A104 HydrophobicContact CG-CB 4.35Å; P86-A104 PolarHBondContact O-N 2.88Å; F88-A104 HydrophobicContact CE2-CB 3.87Å; F88-A104 HydrophobicContact CZ-CB 3.79Å; A104-K106 PolarHBondContact O-N 3.39Å; A104-K106 VanDerWaalsContact O-N 3.1Å
105	D	98.7	Very high	97.4	Very high	37 Å²	37	25.2 Å²	25.2	20%	0.198	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	3.1	171.4	72.5	15.4	0	0	0	113.9	H83 Q84 S103 T107	H83-D105 WeakPolarHBondContact CB-OD2 3.4Å; H83-D105 IonicContact CG-OD2 2.91Å; H83-D105 IonicContact ND1-OD1 3.77Å; H83-D105 PolarHBondContact ND1-OD1 3.47Å; H83-D105 IonicContact ND1-OD2 3.48Å; H83-D105 PolarHBondContact ND1-OD2 3.03Å; Q84-D105 HydrophobicContact CB-CB 4.04Å; Q84-D105 PolarHBondContact N-OD2 2.96Å; S103-D105 VanDerWaalsContact CB-OD1 3.29Å; S103-D105 WeakPolarHBondContact CB-OD1 3.46Å; S103-D105 PolarHBondContact O-N 3.1Å; S103-D105 VanDerWaalsContact OG-CG 3.28Å; S103-D105 PolarHBondContact OG-N 3.43Å; S103-D105 PolarHBondContact OG-OD1 2.63Å; D105-T107 PolarHBondContact O-N 3.49Å; D105-T107 WeakPolarHBondContact OD1-CB 3.46Å; D105-T107 PolarHBondContact OD1-N 3.45Å; D105-T107 PolarHBondContact OD1-OG1 3.32Å; D105-T107 PolarHBondContact OD2-OG1 3.24Å
106	K	98.8	Very high	97.3	Very high	93 Å²	93	21.5 Å²	21.5	40%	0.404	13%	0.126	S	C	.	.	S	Bend	trans	73.2	8.2	176.9	-38.7	175.8	179.5	-165.9	0	114.3	S103 A104 V123 H124 D125	S103-K106 PolarHBondContact O-N 3.02Å; S103-K106 VanDerWaalsContact O-N 3.1Å; A104-K106 PolarHBondContact O-N 3.39Å; A104-K106 VanDerWaalsContact O-N 3.1Å; K106-V123 CarbonylContact O-C 3.39Å; K106-H124 VanDerWaalsContact CB-O 3.29Å; K106-H124 WeakPolarHBondContact CB-O 3.44Å; K106-H124 PolarHBondContact O-N 3.34Å; K106-D125 WeakPolarHBondContact CE-O 3.41Å; K106-D125 PolarHBondContact NZ-O 3.32Å
107	T	98.6	Very high	97.3	Very high	16 Å²	16	24.5 Å²	24.5	10%	0.098	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	155.6	-178.9	72.3	0	0	0	0	112.4	H83 S103 D105 Q109 Q120	H83-T107 PolarHBondContact ND1-OG1 2.85Å; S103-T107 PolarHBondContact N-O 3.41Å; D105-T107 PolarHBondContact O-N 3.49Å; D105-T107 WeakPolarHBondContact OD1-CB 3.46Å; D105-T107 PolarHBondContact OD1-N 3.45Å; D105-T107 PolarHBondContact OD1-OG1 3.32Å; D105-T107 PolarHBondContact OD2-OG1 3.24Å; T107-Q109 PolarHBondContact OG1-NE2 3.25Å; T107-Q120 HydrophobicContact CG2-CG 4.49Å
108	A	98.6	Very high	97.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.5	162	0	0	0	0	0	108.4	S101 V102 V121 G122 L142 T144	S101-A108 CarbonylContact O-C 3.59Å; S101-A108 VanDerWaalsContact O-CA 3.3Å; S101-A108 WeakPolarHBondContact O-CA 3.23Å; V102-A108 HydrophobicContact CG1-CB 3.8Å; A108-V121 HydrophobicContact CB-CG2 4.33Å; A108-V121 WeakPolarHBondContact O-CG2 3.49Å; A108-V121 PolarHBondContact O-N 2.82Å; A108-G122 PolarHBondContact N-O 2.87Å; A108-G122 PolarHBondContact O-N 2.92Å; A108-L142 HydrophobicContact CB-CD2 4.07Å; A108-T144 HydrophobicContact CB-CG2 3.96Å
109	Q	98.4	Very high	97.4	Very high	24 Å²	24	26.2 Å²	26.2	11%	0.112	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.7	-177.1	-60.8	-77	-13.6	0	0	109.8	H83 F100 S101 T107 F118 T119	H83-Q109 WeakPolarHBondContact CE1-CG 3.32Å; F100-Q109 CarbonylContact C-O 3.58Å; F100-Q109 VanDerWaalsContact CA-O 3.29Å; F100-Q109 WeakPolarHBondContact CA-O 3.09Å; S101-Q109 PolarHBondContact N-O 3.34Å; S101-Q109 PolarHBondContact O-N 2.79Å; T107-Q109 PolarHBondContact OG1-NE2 3.25Å; Q109-F118 HydrophobicContact CB-CD1 4.28Å; Q109-F118 HydrophobicContact CB-CD2 4.02Å; Q109-F118 HydrophobicContact CB-CE1 3.68Å; Q109-F118 HydrophobicContact CB-CE2 3.37Å; Q109-F118 HydrophobicContact CB-CG 4.43Å; Q109-F118 HydrophobicContact CB-CZ 3.18Å; Q109-F118 HydrophobicContact CG-CD1 4.24Å; Q109-F118 HydrophobicContact CG-CE1 3.54Å; Q109-F118 HydrophobicContact CG-CE2 4.21Å; Q109-F118 HydrophobicContact CG-CZ 3.53Å; Q109-T119 CarbonylContact C-O 3.58Å; Q109-T119 WeakPolarHBondContact CA-O 3.26Å; Q109-T119 PolarHBondContact OE1-O 3.15Å
110	M	98.3	Very high	97.3	Very high	33 Å²	33	31.3 Å²	31.3	16%	0.163	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.2	168.6	-178.9	179.3	68.2	0	0	108.7	K98 F100 T119 V121	K98-M110 HydrophobicContact CB-CG 4.16Å; K98-M110 HydrophobicContact CD-CG 4.09Å; K98-M110 HydrophobicContact CD-SD 3.95Å; K98-M110 HydrophobicContact CG-CG 4.26Å; K98-M110 HydrophobicContact CG-SD 4.05Å; F100-M110 HydrophobicContact CD1-CB 3.79Å; F100-M110 HydrophobicContact CD1-CG 3.97Å; F100-M110 HydrophobicContact CE1-CB 3.65Å; F100-M110 HydrophobicContact CE1-CG 3.48Å; F100-M110 VanDerWaalsContact CE1-CG 3.48Å; F100-M110 HydrophobicContact CE1-SD 3.71Å; F100-M110 HydrophobicContact CZ-CG 4.04Å; F100-M110 HydrophobicContact CZ-SD 3.99Å; M110-T119 PolarHBondContact N-O 3.28Å; M110-T119 PolarHBondContact O-N 2.78Å; M110-V121 HydrophobicContact CB-CB 4.46Å; M110-V121 HydrophobicContact CB-CG1 3.51Å; M110-V121 HydrophobicContact CB-CG2 4.1Å; M110-V121 HydrophobicContact CE-CG1 4.36Å; M110-V121 HydrophobicContact SD-CG1 4.49Å
111	W	98.2	Very high	97.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	108.5	171.7	-170.8	2.8	0	0	0	109.4	I64 I66 A79 Q81 K98 L99 L113 N116 T117 F118	I64-W111 HydrophobicContact CB-CZ3 4.25Å; I64-W111 HydrophobicContact CG2-CE3 4.24Å; I64-W111 HydrophobicContact CG2-CZ3 3.94Å; I66-W111 HydrophobicContact CB-CH2 4.48Å; I66-W111 HydrophobicContact CD1-CD2 4.45Å; I66-W111 HydrophobicContact CD1-CE3 3.8Å; I66-W111 HydrophobicContact CD1-CH2 3.67Å; I66-W111 HydrophobicContact CD1-CZ2 4.33Å; I66-W111 HydrophobicContact CD1-CZ3 3.38Å; I66-W111 HydrophobicContact CG1-CE3 4.47Å; I66-W111 HydrophobicContact CG1-CH2 3.92Å; I66-W111 HydrophobicContact CG1-CZ3 3.64Å; A79-W111 HydrophobicContact CB-CH2 3.76Å; A79-W111 HydrophobicContact CB-CZ2 3.47Å; A79-W111 VanDerWaalsContact CB-CZ2 3.47Å; Q81-W111 HydrophobicContact CB-CD2 4.24Å; Q81-W111 HydrophobicContact CB-CE3 4.21Å; Q81-W111 HydrophobicContact CB-CZ3 4.33Å; Q81-W111 HydrophobicContact CG-CD2 3.53Å; Q81-W111 HydrophobicContact CG-CE3 3.97Å; Q81-W111 HydrophobicContact CG-CG 3.96Å; Q81-W111 HydrophobicContact CG-CH2 4.09Å; Q81-W111 HydrophobicContact CG-CZ2 3.65Å; Q81-W111 HydrophobicContact CG-CZ3 4.22Å; K98-W111 VanDerWaalsContact CA-O 3.28Å; K98-W111 WeakPolarHBondContact CA-O 3.29Å; L99-W111 HydrophobicContact CB-CB 4.31Å; L99-W111 HydrophobicContact CD2-CE3 3.99Å; L99-W111 PolarHBondContact N-O 3.23Å; L99-W111 WeakPolarHBondContact O-CB 3.42Å; L99-W111 PolarHBondContact O-N 2.78Å; W111-L113 HydrophobicContact CD2-CD2 3.64Å; W111-L113 HydrophobicContact CE3-CD2 4.19Å; W111-L113 HydrophobicContact CG-CD2 3.83Å; W111-L113 HydrophobicContact CZ2-CD2 4.19Å; W111-N116 PolarHBondContact NE1-OD1 3.42Å; W111-T117 CarbonylContact C-O 3.44Å; W111-T117 WeakPolarHBondContact CA-O 3.49Å; W111-F118 HydrophobicContact CB-CD2 3.71Å; W111-F118 HydrophobicContact CB-CE2 4.02Å; W111-F118 HydrophobicContact CG-CD2 4.11Å
112	D	97.1	Very high	97.2	Very high	31 Å²	31	31.5 Å²	31.5	17%	0.166	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	116.2	168.2	-179.4	-68.6	0	0	0	109.8	K98 G114 S115 N116 T117	K98-D112 HydrophobicContact CD-CB 3.73Å; K98-D112 WeakPolarHBondContact CE-OD2 3.44Å; K98-D112 IonicContact NZ-OD2 2.69Å; K98-D112 PolarHBondContact NZ-OD2 2.85Å; D112-G114 PolarHBondContact OD1-N 2.86Å; D112-G114 VanDerWaalsContact OD1-N 3.08Å; D112-S115 WeakPolarHBondContact CB-OG 3.35Å; D112-S115 WeakPolarHBondContact OD1-CB 3.3Å; D112-S115 PolarHBondContact OD1-N 3.22Å; D112-S115 PolarHBondContact OD1-OG 3.42Å; D112-N116 CarbonylContact O-C 3.58Å; D112-N116 WeakPolarHBondContact O-CA 3.4Å; D112-N116 PolarHBondContact O-N 3.32Å; D112-T117 PolarHBondContact N-O 2.86Å; D112-T117 PolarHBondContact O-N 3.16Å; D112-T117 VanDerWaalsContact O-N 3.12Å
113	L	94.3	Very high	97.2	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-30.1	-173.2	-61	-173.2	0	0	0	112.9	F12 I66 W92 S97 W111	F12-L113 HydrophobicContact CD1-CD1 4.29Å; F12-L113 HydrophobicContact CD2-CB 3.64Å; F12-L113 WeakPolarHBondContact CD2-O 3.48Å; F12-L113 HydrophobicContact CE1-CD1 4.17Å; F12-L113 HydrophobicContact CE2-CB 3.78Å; F12-L113 HydrophobicContact CE2-CD2 3.86Å; F12-L113 HydrophobicContact CE2-CG 4.26Å; F12-L113 HydrophobicContact CG-CB 4.03Å; F12-L113 HydrophobicContact CZ-CB 4.33Å; F12-L113 HydrophobicContact CZ-CD1 4.27Å; F12-L113 HydrophobicContact CZ-CD2 3.82Å; F12-L113 HydrophobicContact CZ-CG 4.37Å; I66-L113 HydrophobicContact CD1-CD1 4.17Å; I66-L113 HydrophobicContact CD1-CD2 3.55Å; W92-L113 HydrophobicContact CE3-CD1 4.32Å; W92-L113 HydrophobicContact CH2-CD1 3.62Å; W92-L113 HydrophobicContact CZ3-CD1 3.26Å; S97-L113 PolarHBondContact O-N 3.13Å; S97-L113 VanDerWaalsContact O-N 3.17Å; W111-L113 HydrophobicContact CD2-CD2 3.64Å; W111-L113 HydrophobicContact CE3-CD2 4.19Å; W111-L113 HydrophobicContact CG-CD2 3.83Å; W111-L113 HydrophobicContact CZ2-CD2 4.19Å
114	G	92.6	Very high	97.2	Very high	31 Å²	31	35 Å²	35	32%	0.32	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-40	-179.4	0	0	0	0	0	112.8	N10 D112	N10-G114 WeakPolarHBondContact OD1-CA 3.49Å; N10-G114 PolarHBondContact OD1-O 3.3Å; D112-G114 PolarHBondContact OD1-N 2.86Å; D112-G114 VanDerWaalsContact OD1-N 3.08Å
115	S	94.2	Very high	97.2	Very high	49 Å²	49	38.2 Å²	38.2	34%	0.343	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-10.1	177.1	61.8	0	0	0	0	113.5	D112 T117	D112-S115 WeakPolarHBondContact CB-OG 3.35Å; D112-S115 WeakPolarHBondContact OD1-CB 3.3Å; D112-S115 PolarHBondContact OD1-N 3.22Å; D112-S115 PolarHBondContact OD1-OG 3.42Å; S115-T117 PolarHBondContact O-N 3.07Å; S115-T117 WeakPolarHBondContact OG-CG2 3.36Å; S115-T117 PolarHBondContact OG-OG1 2.92Å
116	N	93.9	Very high	97.2	Very high	17 Å²	17	37.4 Å²	37.4	9%	0.091	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	40.2	-169.9	-163.4	22.4	0	0	0	113.1	G7 Q81 W111 D112	G7-N116 PolarHBondContact O-ND2 3.31Å; Q81-N116 PolarHBondContact NE2-O 2.84Å; Q81-N116 PolarHBondContact NE2-OD1 2.83Å; W111-N116 PolarHBondContact NE1-OD1 3.42Å; D112-N116 CarbonylContact O-C 3.58Å; D112-N116 WeakPolarHBondContact O-CA 3.4Å; D112-N116 PolarHBondContact O-N 3.32Å
117	T	96.2	Very high	97.2	Very high	65 Å²	65	34.3 Å²	34.3	40%	0.399	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142	179.4	57.9	0	0	0	0	111.6	W111 D112 S115	W111-T117 CarbonylContact C-O 3.44Å; W111-T117 WeakPolarHBondContact CA-O 3.49Å; D112-T117 PolarHBondContact N-O 2.86Å; D112-T117 PolarHBondContact O-N 3.16Å; D112-T117 VanDerWaalsContact O-N 3.12Å; S115-T117 PolarHBondContact O-N 3.07Å; S115-T117 WeakPolarHBondContact OG-CG2 3.36Å; S115-T117 PolarHBondContact OG-OG1 2.92Å
118	F	97.1	Very high	97.2	Very high	46 Å²	46	33.6 Å²	33.6	20%	0.202	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	106.7	-177.4	-161.6	-126.7	0	0	0	109.6	I64 Q81 H83 Q109 W111	I64-F118 HydrophobicContact CD1-CE2 3.98Å; I64-F118 HydrophobicContact CD1-CZ 3.63Å; Q81-F118 HydrophobicContact CB-CD1 4.3Å; Q81-F118 HydrophobicContact CB-CD2 4.01Å; Q81-F118 HydrophobicContact CB-CE1 4.36Å; Q81-F118 HydrophobicContact CB-CE2 4.09Å; Q81-F118 HydrophobicContact CB-CG 4.12Å; Q81-F118 HydrophobicContact CB-CZ 4.25Å; Q81-F118 HydrophobicContact CG-CB 4.18Å; Q81-F118 HydrophobicContact CG-CD2 3.99Å; Q81-F118 HydrophobicContact CG-CG 4.07Å; H83-F118 AromaticContact CD2-CZ 3.67Å; H83-F118 AromaticContact NE2-CZ 3.55Å; Q109-F118 HydrophobicContact CB-CD1 4.28Å; Q109-F118 HydrophobicContact CB-CD2 4.02Å; Q109-F118 HydrophobicContact CB-CE1 3.68Å; Q109-F118 HydrophobicContact CB-CE2 3.37Å; Q109-F118 HydrophobicContact CB-CG 4.43Å; Q109-F118 HydrophobicContact CB-CZ 3.18Å; Q109-F118 HydrophobicContact CG-CD1 4.24Å; Q109-F118 HydrophobicContact CG-CE1 3.54Å; Q109-F118 HydrophobicContact CG-CE2 4.21Å; Q109-F118 HydrophobicContact CG-CZ 3.53Å; W111-F118 HydrophobicContact CB-CD2 3.71Å; W111-F118 HydrophobicContact CB-CE2 4.02Å; W111-F118 HydrophobicContact CG-CD2 4.11Å
119	T	97	Very high	97.2	Very high	74 Å²	74	36.5 Å²	36.5	45%	0.454	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.7	-168.6	-53.8	0	0	0	0	111.1	Q109 M110 V121	Q109-T119 CarbonylContact C-O 3.58Å; Q109-T119 WeakPolarHBondContact CA-O 3.26Å; Q109-T119 PolarHBondContact OE1-O 3.15Å; M110-T119 PolarHBondContact N-O 3.28Å; M110-T119 PolarHBondContact O-N 2.78Å; T119-V121 PolarHBondContact O-N 2.85Å
120	Q	97.7	Very high	97.2	Very high	106 Å²	106	35.8 Å²	35.8	50%	0.495	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	127.1	178.1	-174.6	177.8	-40.7	0	0	110.2	T107	T107-Q120 HydrophobicContact CG2-CG 4.49Å
121	V	98	Very high	97.3	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.036	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	-7.7	-179.5	-66.4	0	0	0	0	113.5	F100 A108 M110 T119 L142	F100-V121 HydrophobicContact CD1-CG2 4.18Å; F100-V121 HydrophobicContact CE1-CG2 4.45Å; A108-V121 HydrophobicContact CB-CG2 4.33Å; A108-V121 WeakPolarHBondContact O-CG2 3.49Å; A108-V121 PolarHBondContact O-N 2.82Å; M110-V121 HydrophobicContact CB-CB 4.46Å; M110-V121 HydrophobicContact CB-CG1 3.51Å; M110-V121 HydrophobicContact CB-CG2 4.1Å; M110-V121 HydrophobicContact CE-CG1 4.36Å; M110-V121 HydrophobicContact SD-CG1 4.49Å; T119-V121 PolarHBondContact O-N 2.85Å; V121-L142 HydrophobicContact CG2-CD2 3.9Å
122	G	97.7	Very high	97.3	Very high	2 Å²	2	35.1 Å²	35.1	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	158.9	177.4	0	0	0	0	0	112.5	A108	A108-G122 PolarHBondContact N-O 2.87Å; A108-G122 PolarHBondContact O-N 2.92Å
123	V	98.3	Very high	97.3	Very high	68 Å²	68	35.7 Å²	35.7	41%	0.412	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	146.2	-179.6	65.1	0	0	0	0	111.1	K106 R152 W154	K106-V123 CarbonylContact O-C 3.39Å; V123-R152 PolarHBondContact O-NH1 2.79Å; V123-W154 HydrophobicContact CG1-CH2 4.42Å; V123-W154 VanDerWaalsContact N-CH2 3.28Å; V123-W154 VanDerWaalsContact O-CH2 3.23Å; V123-W154 WeakPolarHBondContact O-CH2 3.12Å; V123-W154 WeakPolarHBondContact O-CZ2 3.47Å
124	H	98.7	Very high	97.5	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.019	20%	0.204	C	C	.	.			trans	-130.2	166.6	174.3	-79.7	-97.3	0	0	0	113	K106 A126 V128 T144 S146 D148 R152 W154	K106-H124 VanDerWaalsContact CB-O 3.29Å; K106-H124 WeakPolarHBondContact CB-O 3.44Å; K106-H124 PolarHBondContact O-N 3.34Å; H124-A126 VanDerWaalsContact C-N 3.31Å; H124-A126 WeakPolarHBondContact CB-O 3.33Å; H124-V128 HydrophobicContact CB-CG2 3.64Å; H124-V128 VanDerWaalsContact CD2-CG2 3.46Å; H124-V128 WeakPolarHBondContact CD2-CG2 3.19Å; H124-T144 PolarHBondContact NE2-OG1 3.4Å; H124-S146 VanDerWaalsContact CG-CB 3.47Å; H124-S146 WeakPolarHBondContact ND1-CB 3.23Å; H124-D148 VanDerWaalsContact CB-OD2 3.24Å; H124-D148 WeakPolarHBondContact CB-OD2 3.49Å; H124-D148 IonicContact CE1-OD1 3.9Å; H124-D148 IonicContact CG-OD2 3.46Å; H124-D148 VanDerWaalsContact ND1-CG 3.32Å; H124-D148 IonicContact ND1-OD1 2.82Å; H124-D148 PolarHBondContact ND1-OD1 3.14Å; H124-D148 VanDerWaalsContact ND1-OD1 3.16Å; H124-D148 IonicContact ND1-OD2 3.95Å; H124-D148 PolarHBondContact ND1-OD2 2.87Å; H124-R152 VanDerWaalsContact CA-NH1 3.3Å; H124-R152 PolarHBondContact ND1-NH1 2.95Å; H124-R152 VanDerWaalsContact ND1-NH1 3.12Å; H124-W154 AromaticContact NE2-CZ2 3.98Å
125	D	98.6	Very high	97.7	Very high	96 Å²	96	36.7 Å²	36.7	51%	0.513	20%	0.204	S	C	.	.	S	Bend	trans	-85.7	-13	-179.6	-58.7	-55.2	0	0	0	111.5	K106 D148 R150 R152	K106-D125 WeakPolarHBondContact CE-O 3.41Å; K106-D125 PolarHBondContact NZ-O 3.32Å; D125-D148 HydrophobicContact CB-CB 3.92Å; D125-D148 PolarHBondContact N-OD2 3.48Å; D125-R150 IonicContact OD2-NH1 2.85Å; D125-R150 PolarHBondContact OD2-NH1 2.97Å; D125-R152 IonicContact OD2-NH2 3.28Å
126	A	98.9	Very high	97.8	Very high	21 Å²	21	34.8 Å²	34.8	17%	0.174	19%	0.192	C	C	.	.	S	Bend	trans	-145	172.6	176.7	0	0	0	0	0	110.7	H124 V128 S146 W147 D148	H124-A126 VanDerWaalsContact C-N 3.31Å; H124-A126 WeakPolarHBondContact CB-O 3.33Å; A126-V128 PolarHBondContact O-N 2.84Å; A126-S146 PolarHBondContact O-OG 2.9Å; A126-W147 HydrophobicContact CB-CB 4.22Å; A126-D148 HydrophobicContact CB-CB 3.82Å
127	P	98.9	Very high	97.9	Very high	28 Å²	28	39.6 Å²	39.6	18%	0.182	22%	0.224	C	C	.	.			trans	-47.9	137.3	-180	-35.4	40.8	0	0	0	115.2	F88 S146 W147	F88-P127 HydrophobicContact CE2-CB 3.86Å; P127-S146 WeakPolarHBondContact O-CA 3.21Å; P127-S146 PolarHBondContact O-OG 2.99Å; P127-W147 HydrophobicContact CB-CD2 4.05Å; P127-W147 HydrophobicContact CB-CE3 3.52Å; P127-W147 HydrophobicContact CB-CZ3 3.83Å; P127-W147 HydrophobicContact CG-CE3 3.66Å; P127-W147 HydrophobicContact CG-CZ3 3.9Å; P127-W147 PolarHBondContact O-N 2.99Å
128	V	98.9	Very high	97.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117	-179.2	-170.3	0	0	0	0	109.4	F88 V102 S103 H124 A126 T144	F88-V128 WeakPolarHBondContact CD2-O 3.2Å; V102-V128 HydrophobicContact CB-CB 3.77Å; V102-V128 HydrophobicContact CB-CG1 3.55Å; V102-V128 HydrophobicContact CG1-CB 4.11Å; V102-V128 HydrophobicContact CG1-CG1 3.44Å; V102-V128 VanDerWaalsContact CG1-CG1 3.44Å; V102-V128 HydrophobicContact CG2-CG1 4.22Å; S103-V128 PolarHBondContact O-N 3.1Å; H124-V128 HydrophobicContact CB-CG2 3.64Å; H124-V128 VanDerWaalsContact CD2-CG2 3.46Å; H124-V128 WeakPolarHBondContact CD2-CG2 3.19Å; A126-V128 PolarHBondContact O-N 2.84Å; V128-T144 HydrophobicContact CG1-CG2 4.31Å
129	K	98.8	Very high	97.7	Very high	61 Å²	61	41.1 Å²	41.1	27%	0.265	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-31.2	-168.4	178.9	61.1	-165	76	0	114.1	F88 G145 W147 Y172	F88-K129 HydrophobicContact CB-CD 4.36Å; F88-K129 HydrophobicContact CD2-CD 4.48Å; K129-G145 PolarHBondContact N-O 3.15Å; K129-W147 HydrophobicContact CD-CZ2 4.26Å; K129-Y172 WeakPolarHBondContact CG-O 3.41Å
130	T	98.8	Very high	97.6	Very high	9 Å²	9	40.5 Å²	40.5	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.9	-175	67.5	0	0	0	0	111.6	T144 G145 I171 A174	T130-T144 WeakPolarHBondContact O-CA 3.43Å; T130-G145 PolarHBondContact N-O 3.45Å; T130-G145 VanDerWaalsContact N-O 3.13Å; T130-G145 PolarHBondContact O-N 2.91Å; T130-G145 VanDerWaalsContact O-N 3.11Å; T130-G145 WeakPolarHBondContact OG1-CA 3.39Å; T130-G145 PolarHBondContact OG1-N 3.09Å; T130-I171 HydrophobicContact CG2-CG2 4.29Å; T130-A174 HydrophobicContact CG2-CB 3.89Å
131	A	98.6	Very high	97.6	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.017	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	127.8	177.7	0	0	0	0	0	109.5	V102 L142 M143	V102-A131 HydrophobicContact CB-CB 4.33Å; V102-A131 HydrophobicContact CG1-CB 3.7Å; V102-A131 HydrophobicContact CG2-CB 3.73Å; A131-L142 HydrophobicContact CB-CD1 4.39Å; A131-M143 WeakPolarHBondContact CA-O 3.22Å
132	H	98.7	Very high	97.7	Very high	18 Å²	18	35.1 Å²	35.1	8%	0.083	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	129.9	176	-62	-97.8	0	0	0	109.9	M143 A174 D175 V176	H132-M143 HydrophobicContact CB-CE 4.19Å; H132-M143 PolarHBondContact N-O 2.71Å; H132-M143 PolarHBondContact O-N 3.26Å; H132-A174 PolarHBondContact CE1-O 3.24Å; H132-A174 PolarHBondContact NE2-O 3.02Å; H132-D175 IonicContact CE1-OD1 3.83Å; H132-V176 HydrophobicContact CB-CB 3.88Å; H132-V176 HydrophobicContact CB-CG2 3.43Å; H132-V176 VanDerWaalsContact CB-CG2 3.43Å
133	F	98.2	Very high	97.7	Very high	42 Å²	42	35 Å²	35	18%	0.184	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.1	173.1	-165.1	-106.2	0	0	0	109.2	C91 W92 T94 F100 T135	C91-F133 PolarHBondContact SG-N 2.91Å; W92-F133 WeakPolarHBondContact O-CB 3.32Å; T94-F133 HydrophobicContact CG2-CD1 4.49Å; F100-F133 HydrophobicContact CD2-CB 4.35Å; F100-F133 AromaticContact CD2-CD2 3.88Å; F100-F133 HydrophobicContact CD2-CD2 3.88Å; F100-F133 HydrophobicContact CD2-CG 4.35Å; F100-F133 HydrophobicContact CE2-CB 4.38Å; F100-F133 AromaticContact CE2-CD2 3.24Å; F100-F133 HydrophobicContact CE2-CD2 3.24Å; F100-F133 AromaticContact CE2-CE2 3.57Å; F100-F133 HydrophobicContact CE2-CE2 3.57Å; F100-F133 AromaticContact CE2-CG 3.9Å; F100-F133 HydrophobicContact CE2-CG 3.9Å; F100-F133 HydrophobicContact CE2-CZ 4.45Å; F100-F133 AromaticContact CZ-CD2 3.73Å; F100-F133 HydrophobicContact CZ-CD2 3.73Å; F100-F133 AromaticContact CZ-CE2 3.65Å; F100-F133 HydrophobicContact CZ-CE2 3.65Å; F133-T135 WeakPolarHBondContact CE1-OG1 3.3Å
134	I	98.2	Very high	97.7	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.1	179	-62.3	163.7	0	0	0	107.5	Y139 S140 C141 M143 F153 V176 L195	I134-Y139 HydrophobicContact CG2-CE2 3.94Å; I134-S140 CarbonylContact O-C 3.6Å; I134-S140 WeakPolarHBondContact O-CA 3.15Å; I134-C141 PolarHBondContact N-O 3.04Å; I134-C141 PolarHBondContact O-N 3.26Å; I134-M143 HydrophobicContact CD1-CB 3.79Å; I134-M143 HydrophobicContact CD1-SD 4.36Å; I134-M143 HydrophobicContact CG1-CB 4.49Å; I134-F153 HydrophobicContact CD1-CD1 3.99Å; I134-F153 HydrophobicContact CD1-CE1 3.67Å; I134-V176 HydrophobicContact CG1-CG1 3.94Å; I134-L195 HydrophobicContact CD1-CD1 4.01Å; I134-L195 HydrophobicContact CD1-CD2 4.08Å; I134-L195 HydrophobicContact CG1-CD1 4.11Å; I134-L195 HydrophobicContact CG2-CD1 4.01Å
135	T	96	Very high	97.7	Very high	54 Å²	54	31.6 Å²	31.6	33%	0.331	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	104.7	167.5	-62	0	0	0	0	108	T94 F133	T94-T135 HydrophobicContact CG2-CG2 4.4Å; T94-T135 WeakPolarHBondContact CG2-OG1 3.34Å; T94-T135 PolarHBondContact OG1-OG1 3.36Å; F133-T135 WeakPolarHBondContact CE1-OG1 3.3Å
136	A	96	Very high	97.8	Very high	10 Å²	10	27 Å²	27	8%	0.083	16%	0.156	C	C	.	.			trans	-99.3	164.9	170.5	0	0	0	0	0	109.6	N138 Y139 Y178	A136-N138 PolarHBondContact O-N 2.86Å; A136-Y139 WeakPolarHBondContact CA-O 3.31Å; A136-Y139 HydrophobicContact CB-CD1 3.68Å; A136-Y139 HydrophobicContact CB-CE1 3.41Å; A136-Y139 VanDerWaalsContact CB-CE1 3.41Å; A136-Y139 HydrophobicContact CB-CE2 4.35Å; A136-Y139 HydrophobicContact CB-CG 4.23Å; A136-Y139 WeakPolarHBondContact CB-O 3.44Å; A136-Y139 PolarHBondContact N-O 3.25Å; A136-Y139 VanDerWaalsContact O-O 3.08Å; A136-Y178 HydrophobicContact CB-CD2 4.01Å; A136-Y178 HydrophobicContact CB-CE2 3.45Å; A136-Y178 VanDerWaalsContact CB-CE2 3.45Å
137	P	95.8	Very high	97.8	Very high	117 Å²	117	30.4 Å²	30.4	76%	0.76	16%	0.164	S	C	*	.	S	Bend	trans	-58.6	-27.8	177.4	-26.1	35.7	0	0	0	114.5	Y178	P137-Y178 WeakPolarHBondContact CD-OH 2.87Å
138	N	94.2	Very high	97.8	Very high	101 Å²	101	30.4 Å²	30.4	54%	0.54	16%	0.162	S	C	.	.	S	Bend	trans	-113.8	-11.8	-172.4	58.6	-27	0	0	0	114.4	A136 E196	A136-N138 PolarHBondContact O-N 2.86Å; N138-E196 PolarHBondContact OD1-O 3.33Å
139	Y	95.5	Very high	97.8	Very high	43 Å²	43	34 Å²	34	17%	0.169	18%	0.178	C	C	.	.			trans	-155.6	157.9	176.8	71.4	-85.1	0	0	0	112	I134 A136 C141 L195	I134-Y139 HydrophobicContact CG2-CE2 3.94Å; A136-Y139 WeakPolarHBondContact CA-O 3.31Å; A136-Y139 HydrophobicContact CB-CD1 3.68Å; A136-Y139 HydrophobicContact CB-CE1 3.41Å; A136-Y139 VanDerWaalsContact CB-CE1 3.41Å; A136-Y139 HydrophobicContact CB-CE2 4.35Å; A136-Y139 HydrophobicContact CB-CG 4.23Å; A136-Y139 WeakPolarHBondContact CB-O 3.44Å; A136-Y139 PolarHBondContact N-O 3.25Å; A136-Y139 VanDerWaalsContact O-O 3.08Å; Y139-C141 HydrophobicContact CD2-CB 4.32Å; Y139-C141 VanDerWaalsContact CE2-SG 3.56Å; Y139-L195 VanDerWaalsContact CE1-O 3.28Å; Y139-L195 WeakPolarHBondContact CE1-O 3.23Å; Y139-L195 PolarHBondContact OH-O 3.13Å
140	S	96	Very high	97.8	Very high	60 Å²	60	34.7 Å²	34.7	42%	0.42	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.9	164	-60.2	0	0	0	0	109.4	I134	I134-S140 CarbonylContact O-C 3.6Å; I134-S140 WeakPolarHBondContact O-CA 3.15Å
141	C	97.6	Very high	97.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	158.8	176.3	69.1	0	0	0	0	111.9	I134 Y139 W154 I162	I134-C141 PolarHBondContact N-O 3.04Å; I134-C141 PolarHBondContact O-N 3.26Å; Y139-C141 HydrophobicContact CD2-CB 4.32Å; Y139-C141 VanDerWaalsContact CE2-SG 3.56Å; C141-W154 CarbonylContact C-O 3.58Å; C141-W154 WeakPolarHBondContact CA-O 3.44Å; C141-W154 WeakPolarHBondContact CB-O 3.36Å; C141-I162 HydrophobicContact CB-CD1 3.83Å
142	L	98.5	Very high	97.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.8	167.3	179	67.6	0	0	0	109	F100 A108 V121 A131 T144 F153 W154 T156	F100-L142 HydrophobicContact CB-CD1 3.72Å; F100-L142 HydrophobicContact CB-CD2 4.26Å; F100-L142 HydrophobicContact CD1-CD1 4.18Å; F100-L142 HydrophobicContact CD1-CD2 3.84Å; F100-L142 HydrophobicContact CD1-CG 4.44Å; F100-L142 HydrophobicContact CD2-CD1 4.25Å; F100-L142 HydrophobicContact CG-CD1 3.78Å; F100-L142 HydrophobicContact CG-CD2 4.23Å; A108-L142 HydrophobicContact CB-CD2 4.07Å; V121-L142 HydrophobicContact CG2-CD2 3.9Å; A131-L142 HydrophobicContact CB-CD1 4.39Å; L142-T144 HydrophobicContact CD2-CG2 3.84Å; L142-T144 HydrophobicContact CG-CG2 3.9Å; L142-F153 CarbonylContact O-C 3.49Å; L142-F153 VanDerWaalsContact O-CA 3.27Å; L142-F153 WeakPolarHBondContact O-CA 3.25Å; L142-W154 HydrophobicContact CB-CB 4.33Å; L142-W154 PolarHBondContact N-O 2.79Å; L142-W154 VanDerWaalsContact O-CD1 3.27Å; L142-W154 PolarHBondContact O-N 3.04Å; L142-T156 HydrophobicContact CB-CG2 4.21Å
143	M	98.7	Very high	97.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126	167.5	-176.8	-177.5	84.2	0	0	109.7	A131 H132 I134 L151 R152 F153 A174 V176 A181	A131-M143 WeakPolarHBondContact CA-O 3.22Å; H132-M143 HydrophobicContact CB-CE 4.19Å; H132-M143 PolarHBondContact N-O 2.71Å; H132-M143 PolarHBondContact O-N 3.26Å; I134-M143 HydrophobicContact CD1-CB 3.79Å; I134-M143 HydrophobicContact CD1-SD 4.36Å; I134-M143 HydrophobicContact CG1-CB 4.49Å; M143-L151 HydrophobicContact CE-CD1 4.38Å; M143-L151 HydrophobicContact CG-CD1 3.78Å; M143-L151 HydrophobicContact CG-CD2 4.49Å; M143-L151 HydrophobicContact CG-CG 4.13Å; M143-L151 HydrophobicContact SD-CD1 4Å; M143-L151 HydrophobicContact SD-CD2 4.12Å; M143-L151 HydrophobicContact SD-CG 4.36Å; M143-R152 CarbonylContact C-O 3.58Å; M143-R152 WeakPolarHBondContact CA-O 3.25Å; M143-F153 HydrophobicContact CB-CD1 3.88Å; M143-F153 HydrophobicContact CB-CE1 3.73Å; M143-F153 HydrophobicContact CG-CD1 4Å; M143-F153 HydrophobicContact CG-CE1 3.47Å; M143-F153 VanDerWaalsContact CG-CE1 3.47Å; M143-F153 HydrophobicContact CG-CZ 3.81Å; M143-F153 HydrophobicContact SD-CE1 3.71Å; M143-F153 HydrophobicContact SD-CZ 3.86Å; M143-A174 HydrophobicContact CE-CB 4.16Å; M143-V176 HydrophobicContact CE-CG2 3.31Å; M143-V176 HydrophobicContact SD-CG2 4.11Å; M143-A181 HydrophobicContact CE-CB 4.44Å; M143-A181 HydrophobicContact SD-CB 4.11Å
144	T	98.9	Very high	97.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.3	174.7	60.5	0	0	0	0	111.9	V102 A108 H124 V128 T130 L142 L151 R152 W154	V102-T144 HydrophobicContact CG1-CG2 3.91Å; A108-T144 HydrophobicContact CB-CG2 3.96Å; H124-T144 PolarHBondContact NE2-OG1 3.4Å; V128-T144 HydrophobicContact CG1-CG2 4.31Å; T130-T144 WeakPolarHBondContact O-CA 3.43Å; L142-T144 HydrophobicContact CD2-CG2 3.84Å; L142-T144 HydrophobicContact CG-CG2 3.9Å; T144-L151 WeakPolarHBondContact O-CA 3.44Å; T144-R152 PolarHBondContact N-O 2.75Å; T144-R152 PolarHBondContact O-N 2.88Å; T144-W154 PolarHBondContact OG1-NE1 2.79Å
145	G	98.9	Very high	97.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.6	175.5	0	0	0	0	0	111.8	K129 T130	K129-G145 PolarHBondContact N-O 3.15Å; T130-G145 PolarHBondContact N-O 3.45Å; T130-G145 VanDerWaalsContact N-O 3.13Å; T130-G145 PolarHBondContact O-N 2.91Å; T130-G145 VanDerWaalsContact O-N 3.11Å; T130-G145 WeakPolarHBondContact OG1-CA 3.39Å; T130-G145 PolarHBondContact OG1-N 3.09Å
146	S	98.9	Very high	97.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	163.4	-173.1	171.5	0	0	0	0	114	H124 A126 P127 D148 K149 R150 I171	H124-S146 VanDerWaalsContact CG-CB 3.47Å; H124-S146 WeakPolarHBondContact ND1-CB 3.23Å; A126-S146 PolarHBondContact O-OG 2.9Å; P127-S146 WeakPolarHBondContact O-CA 3.21Å; P127-S146 PolarHBondContact O-OG 2.99Å; S146-D148 WeakPolarHBondContact CB-OD1 3.21Å; S146-D148 PolarHBondContact O-N 3.5Å; S146-D148 VanDerWaalsContact OG-CG 3.29Å; S146-D148 PolarHBondContact OG-N 3.33Å; S146-D148 PolarHBondContact OG-OD1 2.91Å; S146-K149 PolarHBondContact O-N 2.82Å; S146-R150 PolarHBondContact N-O 3.48Å; S146-I171 PolarHBondContact O-N 2.91Å
147	W	98.9	Very high	97.3	Very high	92 Å²	92	42.1 Å²	42.1	35%	0.348	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3	169.1	-62.2	-11.8	0	0	0	113.5	F88 A126 P127 K129 K149 R170 I171	F88-W147 AromaticContact CE2-CH2 3.76Å; F88-W147 HydrophobicContact CE2-CH2 3.76Å; F88-W147 HydrophobicContact CE2-CZ2 4.15Å; F88-W147 HydrophobicContact CE2-CZ3 4.2Å; F88-W147 AromaticContact CZ-CH2 3.97Å; F88-W147 HydrophobicContact CZ-CH2 3.97Å; A126-W147 HydrophobicContact CB-CB 4.22Å; P127-W147 HydrophobicContact CB-CD2 4.05Å; P127-W147 HydrophobicContact CB-CE3 3.52Å; P127-W147 HydrophobicContact CB-CZ3 3.83Å; P127-W147 HydrophobicContact CG-CE3 3.66Å; P127-W147 HydrophobicContact CG-CZ3 3.9Å; P127-W147 PolarHBondContact O-N 2.99Å; K129-W147 HydrophobicContact CD-CZ2 4.26Å; W147-K149 PolarHBondContact O-N 2.84Å; W147-R170 HydrophobicContact CB-CB 4.38Å; W147-R170 HydrophobicContact CB-CG 4Å; W147-R170 HydrophobicContact CG-CB 4.46Å; W147-R170 HydrophobicContact CG-CG 4.48Å; W147-R170 VanDerWaalsContact O-CG 3.29Å; W147-R170 WeakPolarHBondContact O-CG 3.45Å; W147-I171 PolarHBondContact NE1-O 2.85Å
148	D	98.8	Very high	97.1	Very high	27 Å²	27	41 Å²	41	14%	0.144	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	6.1	167.2	68.2	2.1	0	0	0	112.7	H124 D125 A126 S146 R150 R152	H124-D148 VanDerWaalsContact CB-OD2 3.24Å; H124-D148 WeakPolarHBondContact CB-OD2 3.49Å; H124-D148 IonicContact CE1-OD1 3.9Å; H124-D148 IonicContact CG-OD2 3.46Å; H124-D148 VanDerWaalsContact ND1-CG 3.32Å; H124-D148 IonicContact ND1-OD1 2.82Å; H124-D148 PolarHBondContact ND1-OD1 3.14Å; H124-D148 VanDerWaalsContact ND1-OD1 3.16Å; H124-D148 IonicContact ND1-OD2 3.95Å; H124-D148 PolarHBondContact ND1-OD2 2.87Å; D125-D148 HydrophobicContact CB-CB 3.92Å; D125-D148 PolarHBondContact N-OD2 3.48Å; A126-D148 HydrophobicContact CB-CB 3.82Å; S146-D148 WeakPolarHBondContact CB-OD1 3.21Å; S146-D148 PolarHBondContact O-N 3.5Å; S146-D148 VanDerWaalsContact OG-CG 3.29Å; S146-D148 PolarHBondContact OG-N 3.33Å; S146-D148 PolarHBondContact OG-OD1 2.91Å; D148-R150 VanDerWaalsContact C-N 3.29Å; D148-R150 VanDerWaalsContact OD1-CB 3.27Å; D148-R150 WeakPolarHBondContact OD1-CB 3.41Å; D148-R150 PolarHBondContact OD1-N 2.83Å; D148-R152 IonicContact OD2-NH1 3.85Å; D148-R152 PolarHBondContact OD2-NH1 2.65Å
149	K	98.8	Very high	96.8	Very high	77 Å²	77	40.6 Å²	40.6	34%	0.335	19%	0.19	S	C	.	.	S	Bend	trans	67.3	26.5	-178.4	-42.5	-175.7	167.8	-160.2	0	113	S146 W147 L167 P168 E169	S146-K149 PolarHBondContact O-N 2.82Å; W147-K149 PolarHBondContact O-N 2.84Å; K149-L167 WeakPolarHBondContact CB-O 3.19Å; K149-L167 WeakPolarHBondContact O-CB 3.47Å; K149-L167 PolarHBondContact O-N 2.54Å; K149-P168 PolarHBondContact NZ-O 2.53Å; K149-E169 IonicContact NZ-OE1 2.99Å; K149-E169 PolarHBondContact NZ-OE1 3.05Å
150	R	98.8	Very high	96.7	Very high	75 Å²	75	44.8 Å²	44.8	28%	0.283	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.4	177.9	-61.4	177.1	162.7	161.4	-6.3	112.3	D125 S146 D148 R152 N164 L165 D166 I171	D125-R150 IonicContact OD2-NH1 2.85Å; D125-R150 PolarHBondContact OD2-NH1 2.97Å; S146-R150 PolarHBondContact N-O 3.48Å; D148-R150 VanDerWaalsContact C-N 3.29Å; D148-R150 VanDerWaalsContact OD1-CB 3.27Å; D148-R150 WeakPolarHBondContact OD1-CB 3.41Å; D148-R150 PolarHBondContact OD1-N 2.83Å; R150-R152 HydrophobicContact CB-CG 4.47Å; R150-N164 WeakPolarHBondContact CD-OD1 3.38Å; R150-L165 WeakPolarHBondContact CA-O 3.2Å; R150-D166 WeakPolarHBondContact CG-OD1 3.41Å; R150-D166 IonicContact CZ-OD1 3.77Å; R150-D166 IonicContact NE-OD1 3.89Å; R150-D166 PolarHBondContact NE-OD1 3.28Å; R150-D166 IonicContact NH2-OD1 3.31Å; R150-I171 WeakPolarHBondContact O-CD1 3.42Å
151	L	98.8	Very high	96.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.9	163.4	-168.2	73.3	0	0	0	107.7	M143 T144 F153 L165 L167 I171 V183 Y193	M143-L151 HydrophobicContact CE-CD1 4.38Å; M143-L151 HydrophobicContact CG-CD1 3.78Å; M143-L151 HydrophobicContact CG-CD2 4.49Å; M143-L151 HydrophobicContact CG-CG 4.13Å; M143-L151 HydrophobicContact SD-CD1 4Å; M143-L151 HydrophobicContact SD-CD2 4.12Å; M143-L151 HydrophobicContact SD-CG 4.36Å; T144-L151 WeakPolarHBondContact O-CA 3.44Å; L151-F153 HydrophobicContact CD2-CE2 3.86Å; L151-F153 HydrophobicContact CD2-CZ 3.73Å; L151-F153 HydrophobicContact CG-CE2 3.99Å; L151-F153 HydrophobicContact CG-CZ 4.13Å; L151-L165 HydrophobicContact CB-CB 4.34Å; L151-L165 HydrophobicContact CD2-CD1 4.42Å; L151-L165 PolarHBondContact N-O 2.96Å; L151-L165 PolarHBondContact O-N 2.99Å; L151-L167 HydrophobicContact CB-CD1 4.48Å; L151-I171 HydrophobicContact CB-CD1 4.15Å; L151-I171 HydrophobicContact CD1-CD1 3.99Å; L151-V183 HydrophobicContact CD1-CG2 3.92Å; L151-V183 HydrophobicContact CD2-CG2 3.89Å; L151-Y193 HydrophobicContact CD2-CD2 4.37Å; L151-Y193 HydrophobicContact CD2-CE1 4.49Å; L151-Y193 HydrophobicContact CD2-CE2 3.85Å
152	R	98.7	Very high	96.7	Very high	22 Å²	22	47.2 Å²	47.2	8%	0.083	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.2	-178.9	-73.1	-176.1	176.6	131.5	-3.4	111.2	V123 H124 D125 M143 T144 D148 R150 W154 P161 L163 N164	V123-R152 PolarHBondContact O-NH1 2.79Å; H124-R152 VanDerWaalsContact CA-NH1 3.3Å; H124-R152 PolarHBondContact ND1-NH1 2.95Å; H124-R152 VanDerWaalsContact ND1-NH1 3.12Å; D125-R152 IonicContact OD2-NH2 3.28Å; M143-R152 CarbonylContact C-O 3.58Å; M143-R152 WeakPolarHBondContact CA-O 3.25Å; T144-R152 PolarHBondContact N-O 2.75Å; T144-R152 PolarHBondContact O-N 2.88Å; D148-R152 IonicContact OD2-NH1 3.85Å; D148-R152 PolarHBondContact OD2-NH1 2.65Å; R150-R152 HydrophobicContact CB-CG 4.47Å; R152-W154 HydrophobicContact CB-CH2 4.43Å; R152-W154 HydrophobicContact CB-CZ2 3.56Å; R152-W154 HydrophobicContact CG-CZ2 4.07Å; R152-P161 HydrophobicContact CB-CB 4.15Å; R152-P161 HydrophobicContact CG-CB 4.24Å; R152-P161 HydrophobicContact CG-CG 4.47Å; R152-L163 WeakPolarHBondContact CA-O 3.49Å; R152-N164 HydrophobicContact CG-CB 4.36Å; R152-N164 VanDerWaalsContact CG-OD1 3.28Å; R152-N164 WeakPolarHBondContact CG-OD1 3.33Å; R152-N164 PolarHBondContact NE-OD1 3.3Å
153	F	98.5	Very high	96.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.4	175.3	-59.9	-96.8	0	0	0	109.1	I134 L142 M143 L151 P161 I162 L163 L165 P199	I134-F153 HydrophobicContact CD1-CD1 3.99Å; I134-F153 HydrophobicContact CD1-CE1 3.67Å; L142-F153 CarbonylContact O-C 3.49Å; L142-F153 VanDerWaalsContact O-CA 3.27Å; L142-F153 WeakPolarHBondContact O-CA 3.25Å; M143-F153 HydrophobicContact CB-CD1 3.88Å; M143-F153 HydrophobicContact CB-CE1 3.73Å; M143-F153 HydrophobicContact CG-CD1 4Å; M143-F153 HydrophobicContact CG-CE1 3.47Å; M143-F153 VanDerWaalsContact CG-CE1 3.47Å; M143-F153 HydrophobicContact CG-CZ 3.81Å; M143-F153 HydrophobicContact SD-CE1 3.71Å; M143-F153 HydrophobicContact SD-CZ 3.86Å; L151-F153 HydrophobicContact CD2-CE2 3.86Å; L151-F153 HydrophobicContact CD2-CZ 3.73Å; L151-F153 HydrophobicContact CG-CE2 3.99Å; L151-F153 HydrophobicContact CG-CZ 4.13Å; F153-P161 CarbonylContact O-C 3.58Å; F153-P161 WeakPolarHBondContact O-CA 3.5Å; F153-P161 WeakPolarHBondContact O-CB 3.18Å; F153-I162 HydrophobicContact CB-CD1 4.24Å; F153-I162 HydrophobicContact CB-CG1 3.83Å; F153-I162 VanDerWaalsContact O-CG1 3.22Å; F153-I162 WeakPolarHBondContact O-CG1 3.32Å; F153-I162 PolarHBondContact O-N 3.48Å; F153-L163 HydrophobicContact CB-CB 4.13Å; F153-L163 HydrophobicContact CD2-CB 3.86Å; F153-L163 HydrophobicContact CD2-CD2 3.81Å; F153-L163 HydrophobicContact CD2-CG 3.99Å; F153-L163 HydrophobicContact CE2-CD2 3.99Å; F153-L163 HydrophobicContact CE2-CG 4.48Å; F153-L163 HydrophobicContact CG-CB 4.34Å; F153-L163 PolarHBondContact N-O 2.78Å; F153-L165 HydrophobicContact CE2-CD1 3.99Å; F153-L165 HydrophobicContact CE2-CG 4.43Å; F153-P199 HydrophobicContact CD1-CB 4.22Å; F153-P199 HydrophobicContact CD1-CG 3.47Å; F153-P199 VanDerWaalsContact CD1-CG 3.47Å; F153-P199 HydrophobicContact CD2-CB 4.33Å; F153-P199 HydrophobicContact CD2-CG 4.07Å; F153-P199 HydrophobicContact CE1-CB 3.59Å; F153-P199 HydrophobicContact CE1-CG 3.3Å; F153-P199 HydrophobicContact CE2-CB 3.73Å; F153-P199 HydrophobicContact CE2-CG 3.94Å; F153-P199 HydrophobicContact CG-CG 3.85Å; F153-P199 HydrophobicContact CZ-CB 3.32Å; F153-P199 HydrophobicContact CZ-CG 3.56Å
154	W	98.1	Very high	96.6	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.4	-173	-43.3	87.9	0	0	0	110	V123 H124 C141 L142 T144 R152 T156 S159 P161	V123-W154 HydrophobicContact CG1-CH2 4.42Å; V123-W154 VanDerWaalsContact N-CH2 3.28Å; V123-W154 VanDerWaalsContact O-CH2 3.23Å; V123-W154 WeakPolarHBondContact O-CH2 3.12Å; V123-W154 WeakPolarHBondContact O-CZ2 3.47Å; H124-W154 AromaticContact NE2-CZ2 3.98Å; C141-W154 CarbonylContact C-O 3.58Å; C141-W154 WeakPolarHBondContact CA-O 3.44Å; C141-W154 WeakPolarHBondContact CB-O 3.36Å; L142-W154 HydrophobicContact CB-CB 4.33Å; L142-W154 PolarHBondContact N-O 2.79Å; L142-W154 VanDerWaalsContact O-CD1 3.27Å; L142-W154 PolarHBondContact O-N 3.04Å; T144-W154 PolarHBondContact OG1-NE1 2.79Å; R152-W154 HydrophobicContact CB-CH2 4.43Å; R152-W154 HydrophobicContact CB-CZ2 3.56Å; R152-W154 HydrophobicContact CG-CZ2 4.07Å; W154-T156 PolarHBondContact O-N 2.97Å; W154-S159 WeakPolarHBondContact CZ3-O 3.43Å; W154-P161 HydrophobicContact CD2-CB 4.19Å; W154-P161 HydrophobicContact CE3-CB 3.85Å; W154-P161 HydrophobicContact CH2-CB 4.04Å; W154-P161 HydrophobicContact CH2-CG 4.24Å; W154-P161 HydrophobicContact CZ2-CB 4.4Å; W154-P161 HydrophobicContact CZ3-CB 3.76Å; W154-P161 HydrophobicContact CZ3-CG 4.08Å
155	D	95.4	Very high	96.5	Very high	20 Å²	20	54.3 Å²	54.3	11%	0.107	26%	0.258	C	S	.	.			trans	-83.3	1.9	173.7	82.7	-17.7	0	0	0	113.5	R157 Q158 I162	D155-R157 PolarHBondContact O-N 3.49Å; D155-R157 VanDerWaalsContact O-N 3.13Å; D155-R157 PolarHBondContact OD1-N 2.95Å; D155-R157 IonicContact OD2-CZ 2.84Å; D155-R157 IonicContact OD2-NE 2.65Å; D155-R157 PolarHBondContact OD2-NE 2.9Å; D155-R157 IonicContact OD2-NH2 3.82Å; D155-R157 PolarHBondContact OD2-NH2 3.19Å; D155-Q158 WeakPolarHBondContact OD1-CG 3.29Å; D155-Q158 PolarHBondContact OD1-N 3.11Å; D155-I162 HydrophobicContact CB-CG2 3.86Å
156	T	94.2	Very high	96.5	Very high	35 Å²	35	59.7 Å²	59.7	22%	0.215	29%	0.287	C	S	.	.	S	Bend	trans	64.6	1.6	179.8	77.6	0	0	0	0	116.8	F100 L142 W154	F100-T156 HydrophobicContact CE1-CG2 3.56Å; F100-T156 HydrophobicContact CZ-CG2 3.91Å; L142-T156 HydrophobicContact CB-CG2 4.21Å; W154-T156 PolarHBondContact O-N 2.97Å
157	R	92.2	Very high	96.5	Very high	213 Å²	213	60.3 Å²	60.3	80%	0.804	29%	0.29	S	S	*	.	S	Bend	trans	-106.6	-23.2	-178.3	-61.5	170.7	-60.6	-170.7	1.6	112.8	D155	D155-R157 PolarHBondContact O-N 3.49Å; D155-R157 VanDerWaalsContact O-N 3.13Å; D155-R157 PolarHBondContact OD1-N 2.95Å; D155-R157 IonicContact OD2-CZ 2.84Å; D155-R157 IonicContact OD2-NE 2.65Å; D155-R157 PolarHBondContact OD2-NE 2.9Å; D155-R157 IonicContact OD2-NH2 3.82Å; D155-R157 PolarHBondContact OD2-NH2 3.19Å
158	Q	90	Very high	96.4	Very high	95 Å²	95	59.1 Å²	59.1	44%	0.444	29%	0.294	S	S	.	.	S	Bend	trans	-124.8	159.8	178.9	72.7	-166.8	-0.8	0	0	111.5	D155 Q160	D155-Q158 WeakPolarHBondContact OD1-CG 3.29Å; D155-Q158 PolarHBondContact OD1-N 3.11Å; Q158-Q160 VanDerWaalsContact C-N 3.34Å; Q158-Q160 WeakPolarHBondContact CG-O 3.35Å
159	S	88.1	Confident	96.4	Very high	91 Å²	91	60 Å²	60	64%	0.636	30%	0.297	S	S	*	.	S	Bend	trans	-78.3	-16.6	-177.8	57.3	0	0	0	0	114.2	W154	W154-S159 WeakPolarHBondContact CZ3-O 3.43Å
160	Q	94.3	Very high	96.4	Very high	131 Å²	131	61.4 Å²	61.4	61%	0.612	30%	0.301	S	S	*	.	S	Bend	trans	-92.4	138.2	179.5	-66.1	-60.6	-30.8	0	0	110.9	Q158	Q158-Q160 VanDerWaalsContact C-N 3.34Å; Q158-Q160 WeakPolarHBondContact CG-O 3.35Å
161	P	97.3	Very high	96.4	Very high	30 Å²	30	57.9 Å²	57.9	20%	0.195	29%	0.287	C	S	.	.			trans	-65	140.6	174.1	29.4	-33.2	0	0	0	109.7	R152 F153 W154 L163 N164	R152-P161 HydrophobicContact CB-CB 4.15Å; R152-P161 HydrophobicContact CG-CB 4.24Å; R152-P161 HydrophobicContact CG-CG 4.47Å; F153-P161 CarbonylContact O-C 3.58Å; F153-P161 WeakPolarHBondContact O-CA 3.5Å; F153-P161 WeakPolarHBondContact O-CB 3.18Å; W154-P161 HydrophobicContact CD2-CB 4.19Å; W154-P161 HydrophobicContact CE3-CB 3.85Å; W154-P161 HydrophobicContact CH2-CB 4.04Å; W154-P161 HydrophobicContact CH2-CG 4.24Å; W154-P161 HydrophobicContact CZ2-CB 4.4Å; W154-P161 HydrophobicContact CZ3-CB 3.76Å; W154-P161 HydrophobicContact CZ3-CG 4.08Å; P161-L163 PolarHBondContact O-N 2.71Å; P161-N164 HydrophobicContact CG-CB 4.44Å
162	I	96.4	Very high	96.4	Very high	82 Å²	82	59.9 Å²	59.9	42%	0.421	30%	0.295	S	S	.	.	S	Bend	trans	-71.5	-23.2	172	56	168.4	0	0	0	111.9	C141 F153 D155	C141-I162 HydrophobicContact CB-CD1 3.83Å; F153-I162 HydrophobicContact CB-CD1 4.24Å; F153-I162 HydrophobicContact CB-CG1 3.83Å; F153-I162 VanDerWaalsContact O-CG1 3.22Å; F153-I162 WeakPolarHBondContact O-CG1 3.32Å; F153-I162 PolarHBondContact O-N 3.48Å; D155-I162 HydrophobicContact CB-CG2 3.86Å
163	L	97.1	Very high	96.4	Very high	53 Å²	53	59.1 Å²	59.1	28%	0.277	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	137.6	174.2	-179.8	63.8	0	0	0	109.8	R152 F153 P161 L165 P199	R152-L163 WeakPolarHBondContact CA-O 3.49Å; F153-L163 HydrophobicContact CB-CB 4.13Å; F153-L163 HydrophobicContact CD2-CB 3.86Å; F153-L163 HydrophobicContact CD2-CD2 3.81Å; F153-L163 HydrophobicContact CD2-CG 3.99Å; F153-L163 HydrophobicContact CE2-CD2 3.99Å; F153-L163 HydrophobicContact CE2-CG 4.48Å; F153-L163 HydrophobicContact CG-CB 4.34Å; F153-L163 PolarHBondContact N-O 2.78Å; P161-L163 PolarHBondContact O-N 2.71Å; L163-L165 HydrophobicContact CD1-CD2 3.82Å; L163-L165 HydrophobicContact CD1-CG 4.48Å; L163-L165 HydrophobicContact CD2-CD1 4.19Å; L163-L165 HydrophobicContact CD2-CD2 4.09Å; L163-L165 HydrophobicContact CD2-CG 4.14Å; L163-L165 HydrophobicContact CG-CD2 3.92Å; L163-L165 HydrophobicContact CG-CG 4.04Å; L163-P199 HydrophobicContact CD2-CB 3.85Å; L163-P199 HydrophobicContact CD2-CG 3.99Å; L163-P199 WeakPolarHBondContact CD2-O 3.48Å
164	N	97.3	Very high	96.4	Very high	55 Å²	55	59.7 Å²	59.7	29%	0.294	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.9	174.8	178.4	88.3	0	0	0	109	R150 R152 P161	R150-N164 WeakPolarHBondContact CD-OD1 3.38Å; R152-N164 HydrophobicContact CG-CB 4.36Å; R152-N164 VanDerWaalsContact CG-OD1 3.28Å; R152-N164 WeakPolarHBondContact CG-OD1 3.33Å; R152-N164 PolarHBondContact NE-OD1 3.3Å; P161-N164 HydrophobicContact CG-CB 4.44Å
165	L	97.9	Very high	96.5	Very high	41 Å²	41	61.1 Å²	61.1	22%	0.215	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.7	178.1	-54.8	-179.3	0	0	0	109.3	R150 L151 F153 L163 Y193	R150-L165 WeakPolarHBondContact CA-O 3.2Å; L151-L165 HydrophobicContact CB-CB 4.34Å; L151-L165 HydrophobicContact CD2-CD1 4.42Å; L151-L165 PolarHBondContact N-O 2.96Å; L151-L165 PolarHBondContact O-N 2.99Å; F153-L165 HydrophobicContact CE2-CD1 3.99Å; F153-L165 HydrophobicContact CE2-CG 4.43Å; L163-L165 HydrophobicContact CD1-CD2 3.82Å; L163-L165 HydrophobicContact CD1-CG 4.48Å; L163-L165 HydrophobicContact CD2-CD1 4.19Å; L163-L165 HydrophobicContact CD2-CD2 4.09Å; L163-L165 HydrophobicContact CD2-CG 4.14Å; L163-L165 HydrophobicContact CG-CD2 3.92Å; L163-L165 HydrophobicContact CG-CG 4.04Å; L165-Y193 HydrophobicContact CD1-CD1 4.16Å; L165-Y193 HydrophobicContact CD1-CE1 3.49Å; L165-Y193 VanDerWaalsContact CD1-CE1 3.49Å
166	D	98.2	Very high	96.6	Very high	113 Å²	113	61.4 Å²	61.4	60%	0.604	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.5	174.3	-62.7	-56.4	0	0	0	110.2	R150	R150-D166 WeakPolarHBondContact CG-OD1 3.41Å; R150-D166 IonicContact CZ-OD1 3.77Å; R150-D166 IonicContact NE-OD1 3.89Å; R150-D166 PolarHBondContact NE-OD1 3.28Å; R150-D166 IonicContact NH2-OD1 3.31Å
167	L	98.4	Very high	96.7	Very high	13 Å²	13	63.5 Å²	63.5	7%	0.068	32%	0.315	C	S	.	.			trans	-114.6	155.6	176.8	-63.9	-176.9	0	0	0	110.1	K149 L151 E169 I171 V183 T185 F191 Y193	K149-L167 WeakPolarHBondContact CB-O 3.19Å; K149-L167 WeakPolarHBondContact O-CB 3.47Å; K149-L167 PolarHBondContact O-N 2.54Å; L151-L167 HydrophobicContact CB-CD1 4.48Å; L167-E169 VanDerWaalsContact C-N 3.25Å; L167-E169 PolarHBondContact O-N 2.99Å; L167-I171 HydrophobicContact CD1-CD1 3.59Å; L167-I171 HydrophobicContact CD1-CG1 3.55Å; L167-V183 HydrophobicContact CD1-CG1 3.86Å; L167-T185 HydrophobicContact CD1-CG2 3.9Å; L167-F191 HydrophobicContact CD1-CD2 4.49Å; L167-F191 HydrophobicContact CD2-CD1 4.13Å; L167-F191 HydrophobicContact CD2-CD2 3.92Å; L167-F191 HydrophobicContact CD2-CE1 4.14Å; L167-F191 HydrophobicContact CD2-CE2 3.93Å; L167-F191 HydrophobicContact CD2-CG 4.03Å; L167-F191 HydrophobicContact CD2-CZ 4.06Å; L167-Y193 WeakPolarHBondContact CD2-OH 3.17Å
168	P	97.8	Very high	97	Very high	66 Å²	66	56.8 Å²	56.8	43%	0.429	29%	0.29	S	S	.	.	S	Bend	trans	-68.7	-24.8	-178.9	27	-35.4	0	0	0	113.2	K149 F191	K149-P168 PolarHBondContact NZ-O 2.53Å; P168-F191 VanDerWaalsContact CD-CZ 3.46Å; P168-F191 HydrophobicContact CG-CE2 4.22Å; P168-F191 HydrophobicContact CG-CZ 3.75Å
169	E	98.6	Very high	97.3	Very high	45 Å²	45	53.8 Å²	53.8	21%	0.21	28%	0.279	C	S	.	.	S	Bend	trans	-143.2	168.5	-174.9	-100.5	-54.4	137.6	0	0	113.1	K149 L167 A186	K149-E169 IonicContact NZ-OE1 2.99Å; K149-E169 PolarHBondContact NZ-OE1 3.05Å; L167-E169 VanDerWaalsContact C-N 3.25Å; L167-E169 PolarHBondContact O-N 2.99Å; E169-A186 HydrophobicContact CB-CB 4.11Å; E169-A186 HydrophobicContact CG-CB 4.22Å; E169-A186 WeakPolarHBondContact OE2-CB 3.47Å
170	R	98.8	Very high	97.8	Very high	108 Å²	108	49.8 Å²	49.8	41%	0.408	25%	0.25	S	S	.	.			trans	-56.7	139.9	177.6	-69.7	161.4	-71.5	-179.5	-0.4	110.8	W147 Y172 T185 A186	W147-R170 HydrophobicContact CB-CB 4.38Å; W147-R170 HydrophobicContact CB-CG 4Å; W147-R170 HydrophobicContact CG-CB 4.46Å; W147-R170 HydrophobicContact CG-CG 4.48Å; W147-R170 VanDerWaalsContact O-CG 3.29Å; W147-R170 WeakPolarHBondContact O-CG 3.45Å; R170-Y172 HydrophobicContact CB-CD1 4.46Å; R170-Y172 HydrophobicContact CB-CE1 4.13Å; R170-T185 CarbonylContact O-C 3.51Å; R170-T185 WeakPolarHBondContact O-CA 3.35Å; R170-T185 WeakPolarHBondContact O-CB 3.39Å; R170-A186 HydrophobicContact CB-CB 4.18Å; R170-A186 PolarHBondContact O-N 3.34Å
171	I	98.9	Very high	98	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.9	174.3	-63.6	170.5	0	0	0	109.7	T130 S146 W147 R150 L151 L167 V183 T185	T130-I171 HydrophobicContact CG2-CG2 4.29Å; S146-I171 PolarHBondContact O-N 2.91Å; W147-I171 PolarHBondContact NE1-O 2.85Å; R150-I171 WeakPolarHBondContact O-CD1 3.42Å; L151-I171 HydrophobicContact CB-CD1 4.15Å; L151-I171 HydrophobicContact CD1-CD1 3.99Å; L167-I171 HydrophobicContact CD1-CD1 3.59Å; L167-I171 HydrophobicContact CD1-CG1 3.55Å; I171-V183 HydrophobicContact CB-CG1 4.35Å; I171-V183 HydrophobicContact CD1-CG1 4.01Å; I171-V183 HydrophobicContact CG1-CG1 3.78Å; I171-V183 HydrophobicContact CG2-CG1 3.77Å; I171-T185 HydrophobicContact CG1-CG2 4.45Å
172	Y	98.7	Very high	98	Very high	43 Å²	43	42.1 Å²	42.1	17%	0.169	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-41.5	178.7	-76.9	-7.6	0	0	0	112.8	K129 R170 G184 A186 Q212 S213	K129-Y172 WeakPolarHBondContact CG-O 3.41Å; R170-Y172 HydrophobicContact CB-CD1 4.46Å; R170-Y172 HydrophobicContact CB-CE1 4.13Å; Y172-G184 PolarHBondContact N-O 3.32Å; Y172-A186 HydrophobicContact CD1-CB 4.36Å; Y172-A186 HydrophobicContact CD2-CB 4.11Å; Y172-A186 HydrophobicContact CE1-CB 3.79Å; Y172-A186 HydrophobicContact CE2-CB 3.45Å; Y172-A186 VanDerWaalsContact CE2-CB 3.45Å; Y172-A186 WeakPolarHBondContact OH-CB 3.37Å; Y172-Q212 HydrophobicContact CD2-CG 3.86Å; Y172-Q212 VanDerWaalsContact CE2-CD 3.49Å; Y172-Q212 HydrophobicContact CE2-CG 3.5Å; Y172-Q212 VanDerWaalsContact CE2-CG 3.5Å; Y172-Q212 PolarHBondContact OH-NE2 2.81Å; Y172-S213 WeakPolarHBondContact CD2-O 3.31Å
173	C	98.7	Very high	98.2	Very high	6 Å²	6	38.2 Å²	38.2	4%	0.041	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	155.2	179.6	55.9	0	0	0	0	110.4	G184 I216	C173-G184 PolarHBondContact N-O 3.17Å; C173-G184 PolarHBondContact O-N 3.02Å; C173-I216 HydrophobicContact CB-CB 4.45Å; C173-I216 HydrophobicContact CB-CG2 3.94Å
174	A	98.8	Very high	98.2	Very high	11 Å²	11	35.7 Å²	35.7	9%	0.091	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	155.7	174.4	0	0	0	0	0	108.6	T130 H132 M143 L182 V183	T130-A174 HydrophobicContact CG2-CB 3.89Å; H132-A174 PolarHBondContact CE1-O 3.24Å; H132-A174 PolarHBondContact NE2-O 3.02Å; M143-A174 HydrophobicContact CE-CB 4.16Å; A174-L182 CarbonylContact C-O 3.47Å; A174-L182 WeakPolarHBondContact CA-O 3.26Å; A174-L182 WeakPolarHBondContact CB-O 3.35Å; A174-V183 HydrophobicContact CB-CG2 4.3Å
175	D	98.8	Very high	98.3	Very high	32 Å²	32	33.1 Å²	33.1	17%	0.171	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	154.1	167.9	-162.8	17.7	0	0	0	110.4	H132 A181 L182 I216 S217 I218	H132-D175 IonicContact CE1-OD1 3.83Å; D175-A181 WeakPolarHBondContact O-CA 3.29Å; D175-L182 PolarHBondContact N-O 3.01Å; D175-L182 PolarHBondContact O-N 3.23Å; D175-I216 HydrophobicContact CB-CG2 4.14Å; D175-S217 VanDerWaalsContact OD2-CA 3.3Å; D175-S217 WeakPolarHBondContact OD2-CA 3.29Å; D175-I218 HydrophobicContact CB-CD1 4.14Å; D175-I218 HydrophobicContact CB-CG1 4.17Å; D175-I218 PolarHBondContact OD2-N 3.03Å
176	V	98.3	Very high	98.3	Very high	26 Å²	26	32.2 Å²	32.2	16%	0.158	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	125.7	-177.9	176.6	0	0	0	0	109.5	H132 I134 M143 A181 L195	H132-V176 HydrophobicContact CB-CB 3.88Å; H132-V176 HydrophobicContact CB-CG2 3.43Å; H132-V176 VanDerWaalsContact CB-CG2 3.43Å; I134-V176 HydrophobicContact CG1-CG1 3.94Å; M143-V176 HydrophobicContact CE-CG2 3.31Å; M143-V176 HydrophobicContact SD-CG2 4.11Å; V176-A181 HydrophobicContact CG2-CB 3.88Å; V176-L195 HydrophobicContact CG1-CD1 3.95Å
177	H	96.8	Very high	98.2	Very high	80 Å²	80	28.2 Å²	28.2	37%	0.37	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	105.4	162.4	-170.4	-56.8	0	0	0	106.9	L180 I218 M220 P227	H177-L180 CarbonylContact C-O 3.59Å; H177-L180 PolarHBondContact N-O 2.84Å; H177-L180 WeakPolarHBondContact O-CA 3.28Å; H177-L180 WeakPolarHBondContact O-CB 3.07Å; H177-L180 PolarHBondContact O-N 2.82Å; H177-L180 VanDerWaalsContact O-O 3.05Å; H177-I218 HydrophobicContact CB-CB 4.31Å; H177-I218 HydrophobicContact CB-CD1 4.15Å; H177-I218 HydrophobicContact CB-CG2 3.86Å; H177-M220 PolarHBondContact CD2-SD 3.24Å; H177-M220 WeakPolarHBondContact CE1-CE 3.28Å; H177-M220 PolarHBondContact CE1-SD 3.05Å; H177-M220 PolarHBondContact NE2-SD 2.97Å; H177-P227 HydrophobicContact CB-CG 4.19Å; H177-P227 VanDerWaalsContact O-CG 3.23Å; H177-P227 WeakPolarHBondContact O-CG 3.43Å
178	Y	97.1	Very high	98.2	Very high	71 Å²	71	31 Å²	31	28%	0.278	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	134.2	-176.1	178.8	-89	0	0	0	111	A136 P137 L195 E196	A136-Y178 HydrophobicContact CB-CD2 4.01Å; A136-Y178 HydrophobicContact CB-CE2 3.45Å; A136-Y178 VanDerWaalsContact CB-CE2 3.45Å; P137-Y178 WeakPolarHBondContact CD-OH 2.87Å; Y178-L195 HydrophobicContact CD2-CB 3.89Å; Y178-L195 HydrophobicContact CE2-CB 4.07Å; Y178-E196 WeakPolarHBondContact OH-CA 3.38Å
179	P	97.1	Very high	98.2	Very high	32 Å²	32	30 Å²	30	21%	0.208	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89.3	15	6.2	35.7	-36	0	0	0	115.9	N194 L195 E196	P179-N194 CarbonylContact O-C 3.59Å; P179-N194 WeakPolarHBondContact O-CA 3.23Å; P179-L195 WeakPolarHBondContact O-CB 3.44Å; P179-L195 WeakPolarHBondContact O-CG 3.49Å; P179-L195 PolarHBondContact O-N 3.04Å; P179-E196 HydrophobicContact CB-CG 3.57Å; P179-E196 HydrophobicContact CG-CG 4.33Å
180	L	98.1	Very high	98.2	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	135.4	-174.4	-171.8	72.2	0	0	0	112.4	H177 L182 V192 F202 I218 P227 L244	H177-L180 CarbonylContact C-O 3.59Å; H177-L180 PolarHBondContact N-O 2.84Å; H177-L180 WeakPolarHBondContact O-CA 3.28Å; H177-L180 WeakPolarHBondContact O-CB 3.07Å; H177-L180 PolarHBondContact O-N 2.82Å; H177-L180 VanDerWaalsContact O-O 3.05Å; L180-L182 HydrophobicContact CD2-CD1 4.37Å; L180-L182 HydrophobicContact CD2-CG 4.28Å; L180-L182 HydrophobicContact CG-CG 4.39Å; L180-V192 HydrophobicContact CD1-CG1 3.52Å; L180-F202 HydrophobicContact CD1-CE1 3.92Å; L180-F202 HydrophobicContact CD1-CZ 4.01Å; L180-I218 HydrophobicContact CB-CD1 4.39Å; L180-I218 HydrophobicContact CD2-CD1 3.89Å; L180-I218 HydrophobicContact CD2-CG1 4.02Å; L180-I218 HydrophobicContact CD2-CG2 4.1Å; L180-I218 HydrophobicContact CG-CD1 4.14Å; L180-P227 HydrophobicContact CB-CB 3.8Å; L180-P227 HydrophobicContact CB-CG 3.89Å; L180-P227 HydrophobicContact CD2-CB 3.7Å; L180-P227 HydrophobicContact CG-CB 4.4Å; L180-L244 HydrophobicContact CD1-CD1 3.9Å; L180-L244 HydrophobicContact CD2-CD1 3.74Å; L180-L244 HydrophobicContact CG-CD1 4.48Å
181	A	98.6	Very high	98.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.4	159.6	0	0	0	0	0	111.2	M143 D175 V176 Y193 L195	M143-A181 HydrophobicContact CE-CB 4.44Å; M143-A181 HydrophobicContact SD-CB 4.11Å; D175-A181 WeakPolarHBondContact O-CA 3.29Å; V176-A181 HydrophobicContact CG2-CB 3.88Å; A181-Y193 PolarHBondContact N-O 3.47Å; A181-Y193 PolarHBondContact O-N 2.85Å; A181-L195 HydrophobicContact CB-CD1 4.06Å; A181-L195 HydrophobicContact CB-CD2 4.1Å; A181-L195 HydrophobicContact CB-CG 4.28Å
182	L	98.6	Very high	98.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.4	176.9	-65.5	173.5	0	0	0	110.4	A174 D175 L180 I190 F191 V192 I216 I218 F230	A174-L182 CarbonylContact C-O 3.47Å; A174-L182 WeakPolarHBondContact CA-O 3.26Å; A174-L182 WeakPolarHBondContact CB-O 3.35Å; D175-L182 PolarHBondContact N-O 3.01Å; D175-L182 PolarHBondContact O-N 3.23Å; L180-L182 HydrophobicContact CD2-CD1 4.37Å; L180-L182 HydrophobicContact CD2-CG 4.28Å; L180-L182 HydrophobicContact CG-CG 4.39Å; L182-I190 HydrophobicContact CD2-CG2 4.36Å; L182-F191 WeakPolarHBondContact CA-O 3.29Å; L182-V192 HydrophobicContact CD2-CB 4.08Å; L182-V192 HydrophobicContact CD2-CG1 3.69Å; L182-V192 HydrophobicContact CD2-CG2 3.8Å; L182-I216 HydrophobicContact CB-CD1 3.79Å; L182-I216 HydrophobicContact CD1-CD1 3.89Å; L182-I216 HydrophobicContact CD1-CG1 4.33Å; L182-I216 HydrophobicContact CG-CD1 4.42Å; L182-I218 HydrophobicContact CD1-CD1 4.13Å; L182-I218 HydrophobicContact CD1-CG1 3.51Å; L182-I218 HydrophobicContact CG-CD1 4.2Å; L182-I218 HydrophobicContact CG-CG1 4.13Å; L182-F230 HydrophobicContact CD1-CB 3.33Å; L182-F230 HydrophobicContact CD1-CD1 3.56Å; L182-F230 HydrophobicContact CD1-CD2 4.36Å; L182-F230 HydrophobicContact CD1-CE1 4.45Å; L182-F230 HydrophobicContact CD1-CG 3.5Å; L182-F230 HydrophobicContact CD2-CD1 4.25Å; L182-F230 HydrophobicContact CD2-CE1 4.47Å
183	V	98.8	Very high	98.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	116.8	176.7	-176.9	0	0	0	0	110.1	L151 L167 I171 A174 T185 I190 F191 Y193	L151-V183 HydrophobicContact CD1-CG2 3.92Å; L151-V183 HydrophobicContact CD2-CG2 3.89Å; L167-V183 HydrophobicContact CD1-CG1 3.86Å; I171-V183 HydrophobicContact CB-CG1 4.35Å; I171-V183 HydrophobicContact CD1-CG1 4.01Å; I171-V183 HydrophobicContact CG1-CG1 3.78Å; I171-V183 HydrophobicContact CG2-CG1 3.77Å; A174-V183 HydrophobicContact CB-CG2 4.3Å; V183-T185 HydrophobicContact CG1-CG2 4.35Å; V183-I190 CarbonylContact O-C 3.52Å; V183-I190 WeakPolarHBondContact O-CA 3.45Å; V183-F191 HydrophobicContact CB-CB 4.37Å; V183-F191 PolarHBondContact N-O 3.41Å; V183-F191 PolarHBondContact O-N 3.29Å; V183-Y193 HydrophobicContact CB-CE2 4.3Å; V183-Y193 HydrophobicContact CG2-CD2 4.29Å; V183-Y193 HydrophobicContact CG2-CE2 3.87Å
184	G	98.6	Very high	98.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.2	173	0	0	0	0	0	111.4	Y172 C173	Y172-G184 PolarHBondContact N-O 3.32Å; C173-G184 PolarHBondContact N-O 3.17Å; C173-G184 PolarHBondContact O-N 3.02Å
185	T	98.7	Very high	98	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	166.1	-176	63.1	0	0	0	0	112.9	L167 R170 I171 V183 G187 R188 Q189 F191	L167-T185 HydrophobicContact CD1-CG2 3.9Å; R170-T185 CarbonylContact O-C 3.51Å; R170-T185 WeakPolarHBondContact O-CA 3.35Å; R170-T185 WeakPolarHBondContact O-CB 3.39Å; I171-T185 HydrophobicContact CG1-CG2 4.45Å; V183-T185 HydrophobicContact CG1-CG2 4.35Å; T185-G187 PolarHBondContact O-N 3.13Å; T185-R188 PolarHBondContact O-N 3.33Å; T185-Q189 PolarHBondContact N-O 3.24Å; T185-Q189 PolarHBondContact OG1-O 3.25Å; T185-Q189 VanDerWaalsContact OG1-O 3.1Å; T185-Q189 PolarHBondContact OG1-OE1 2.86Å; T185-F191 HydrophobicContact CG2-CD2 3.97Å; T185-F191 HydrophobicContact CG2-CE2 3.78Å
186	A	98	Very high	97.9	Very high	22 Å²	22	25.4 Å²	25.4	18%	0.182	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.6	-179	0	0	0	0	0	114.2	E169 R170 Y172 R188	E169-A186 HydrophobicContact CB-CB 4.11Å; E169-A186 HydrophobicContact CG-CB 4.22Å; E169-A186 WeakPolarHBondContact OE2-CB 3.47Å; R170-A186 HydrophobicContact CB-CB 4.18Å; R170-A186 PolarHBondContact O-N 3.34Å; Y172-A186 HydrophobicContact CD1-CB 4.36Å; Y172-A186 HydrophobicContact CD2-CB 4.11Å; Y172-A186 HydrophobicContact CE1-CB 3.79Å; Y172-A186 HydrophobicContact CE2-CB 3.45Å; Y172-A186 VanDerWaalsContact CE2-CB 3.45Å; Y172-A186 WeakPolarHBondContact OH-CB 3.37Å; A186-R188 PolarHBondContact O-N 3.24Å
187	G	96.8	Very high	97.6	Very high	29 Å²	29	31 Å²	31	30%	0.299	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	13.9	176.1	0	0	0	0	0	113.8	T185 Q189	T185-G187 PolarHBondContact O-N 3.13Å; G187-Q189 PolarHBondContact O-N 3.32Å; G187-Q189 PolarHBondContact O-OE1 3.1Å
188	R	97.3	Very high	97.4	Very high	71 Å²	71	28 Å²	28	27%	0.268	15%	0.15	S	C	.	.	S	Bend	trans	63.2	12.9	-175.9	-56.1	-171.7	-59.8	111.4	9.4	114.3	T185 A186 E206 S207 L209	T185-R188 PolarHBondContact O-N 3.33Å; A186-R188 PolarHBondContact O-N 3.24Å; R188-E206 IonicContact CZ-OE1 2.8Å; R188-E206 VanDerWaalsContact CZ-OE1 3.26Å; R188-E206 IonicContact NH1-OE1 3.58Å; R188-E206 PolarHBondContact NH1-OE1 2.61Å; R188-E206 VanDerWaalsContact NH1-OE1 3.08Å; R188-E206 IonicContact NH2-OE1 3.19Å; R188-E206 PolarHBondContact NH2-OE1 2.98Å; R188-S207 VanDerWaalsContact O-CB 3.3Å; R188-S207 WeakPolarHBondContact O-CB 3.49Å; R188-S207 PolarHBondContact O-N 3.18Å; R188-L209 PolarHBondContact NH1-O 3.14Å; R188-L209 VanDerWaalsContact NH1-O 3.15Å
189	Q	98.2	Very high	97.4	Very high	46 Å²	46	25.6 Å²	25.6	22%	0.215	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	140.9	170	-55.4	88.8	-8.3	0	0	110.3	T185 G187 F191	T185-Q189 PolarHBondContact N-O 3.24Å; T185-Q189 PolarHBondContact OG1-O 3.25Å; T185-Q189 VanDerWaalsContact OG1-O 3.1Å; T185-Q189 PolarHBondContact OG1-OE1 2.86Å; G187-Q189 PolarHBondContact O-N 3.32Å; G187-Q189 PolarHBondContact O-OE1 3.1Å; Q189-F191 HydrophobicContact CB-CD2 4.32Å; Q189-F191 HydrophobicContact CB-CE2 3.59Å; Q189-F191 HydrophobicContact CB-CZ 3.94Å; Q189-F191 HydrophobicContact CG-CZ 4.49Å
190	I	98.5	Very high	97.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.4	171.9	-54.4	171.6	0	0	0	107.2	L182 V183 Q204 L205 I216 F230 L232	L182-I190 HydrophobicContact CD2-CG2 4.36Å; V183-I190 CarbonylContact O-C 3.52Å; V183-I190 WeakPolarHBondContact O-CA 3.45Å; I190-Q204 WeakPolarHBondContact O-CA 3.36Å; I190-L205 HydrophobicContact CB-CB 4.32Å; I190-L205 PolarHBondContact N-O 3.08Å; I190-L205 PolarHBondContact O-N 2.9Å; I190-I216 HydrophobicContact CG2-CD1 4.16Å; I190-F230 HydrophobicContact CD1-CE2 3.8Å; I190-F230 HydrophobicContact CD1-CZ 4.02Å; I190-F230 HydrophobicContact CG2-CZ 4.32Å; I190-L232 HydrophobicContact CD1-CD1 4.34Å; I190-L232 HydrophobicContact CD1-CD2 3.7Å
191	F	98.5	Very high	97.3	Very high	6 Å²	6	32 Å²	32	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	138	176.4	-63.5	-90.1	0	0	0	109.7	L167 P168 L182 V183 T185 Q189 Y193 Q204	L167-F191 HydrophobicContact CD1-CD2 4.49Å; L167-F191 HydrophobicContact CD2-CD1 4.13Å; L167-F191 HydrophobicContact CD2-CD2 3.92Å; L167-F191 HydrophobicContact CD2-CE1 4.14Å; L167-F191 HydrophobicContact CD2-CE2 3.93Å; L167-F191 HydrophobicContact CD2-CG 4.03Å; L167-F191 HydrophobicContact CD2-CZ 4.06Å; P168-F191 VanDerWaalsContact CD-CZ 3.46Å; P168-F191 HydrophobicContact CG-CE2 4.22Å; P168-F191 HydrophobicContact CG-CZ 3.75Å; L182-F191 WeakPolarHBondContact CA-O 3.29Å; V183-F191 HydrophobicContact CB-CB 4.37Å; V183-F191 PolarHBondContact N-O 3.41Å; V183-F191 PolarHBondContact O-N 3.29Å; T185-F191 HydrophobicContact CG2-CD2 3.97Å; T185-F191 HydrophobicContact CG2-CE2 3.78Å; Q189-F191 HydrophobicContact CB-CD2 4.32Å; Q189-F191 HydrophobicContact CB-CE2 3.59Å; Q189-F191 HydrophobicContact CB-CZ 3.94Å; Q189-F191 HydrophobicContact CG-CZ 4.49Å; F191-Y193 HydrophobicContact CB-CD2 4.35Å; F191-Y193 HydrophobicContact CB-CE2 3.47Å; F191-Y193 VanDerWaalsContact CB-CE2 3.47Å; F191-Q204 HydrophobicContact CD1-CB 4.46Å; F191-Q204 HydrophobicContact CD1-CG 4.16Å; F191-Q204 HydrophobicContact CE1-CG 3.95Å; F191-Q204 HydrophobicContact CZ-CG 4.45Å
192	V	98.3	Very high	97.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.7	-176.8	-162.8	0	0	0	0	108.7	L180 L182 F202 S203 L205 L244	L180-V192 HydrophobicContact CD1-CG1 3.52Å; L182-V192 HydrophobicContact CD2-CB 4.08Å; L182-V192 HydrophobicContact CD2-CG1 3.69Å; L182-V192 HydrophobicContact CD2-CG2 3.8Å; V192-F202 HydrophobicContact CB-CD1 4.48Å; V192-F202 HydrophobicContact CB-CE1 4.05Å; V192-F202 HydrophobicContact CB-CZ 4.14Å; V192-F202 HydrophobicContact CG1-CD1 4.18Å; V192-F202 HydrophobicContact CG1-CE1 3.3Å; V192-F202 HydrophobicContact CG1-CE2 4.07Å; V192-F202 HydrophobicContact CG1-CZ 3.24Å; V192-F202 WeakPolarHBondContact O-CD1 3.26Å; V192-F202 PolarHBondContact O-N 3.12Å; V192-S203 PolarHBondContact N-O 2.78Å; V192-S203 PolarHBondContact O-N 3.37Å; V192-L205 HydrophobicContact CG2-CD1 4.28Å; V192-L244 HydrophobicContact CG1-CD2 4.11Å
193	Y	98.2	Very high	97	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.6	-175.9	-61.2	-90.1	0	0	0	111	L151 L165 L167 A181 V183 F191 T200 Q201	L151-Y193 HydrophobicContact CD2-CD2 4.37Å; L151-Y193 HydrophobicContact CD2-CE1 4.49Å; L151-Y193 HydrophobicContact CD2-CE2 3.85Å; L165-Y193 HydrophobicContact CD1-CD1 4.16Å; L165-Y193 HydrophobicContact CD1-CE1 3.49Å; L165-Y193 VanDerWaalsContact CD1-CE1 3.49Å; L167-Y193 WeakPolarHBondContact CD2-OH 3.17Å; A181-Y193 PolarHBondContact N-O 3.47Å; A181-Y193 PolarHBondContact O-N 2.85Å; V183-Y193 HydrophobicContact CB-CE2 4.3Å; V183-Y193 HydrophobicContact CG2-CD2 4.29Å; V183-Y193 HydrophobicContact CG2-CE2 3.87Å; F191-Y193 HydrophobicContact CB-CD2 4.35Å; F191-Y193 HydrophobicContact CB-CE2 3.47Å; F191-Y193 VanDerWaalsContact CB-CE2 3.47Å; Y193-T200 CarbonylContact C-O 3.55Å; Y193-T200 VanDerWaalsContact CA-O 3.27Å; Y193-T200 WeakPolarHBondContact CA-O 3.48Å; Y193-Q201 HydrophobicContact CD1-CB 3.9Å; Y193-Q201 HydrophobicContact CE1-CB 3.65Å; Y193-Q201 HydrophobicContact CE1-CG 4.31Å
194	N	97.3	Very high	96.9	Very high	51 Å²	51	44.7 Å²	44.7	27%	0.273	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.2	164.8	-176.6	-11.4	0	0	0	107.4	P179 E196 P199 T200 F202	P179-N194 CarbonylContact O-C 3.59Å; P179-N194 WeakPolarHBondContact O-CA 3.23Å; N194-E196 PolarHBondContact ND2-OE2 3.14Å; N194-E196 WeakPolarHBondContact OD1-CB 3.02Å; N194-E196 WeakPolarHBondContact OD1-CG 3.02Å; N194-E196 PolarHBondContact OD1-N 3.01Å; N194-E196 PolarHBondContact OD1-OE2 3.13Å; N194-P199 WeakPolarHBondContact O-CA 3.49Å; N194-T200 PolarHBondContact N-O 2.88Å; N194-T200 PolarHBondContact O-N 3.1Å; N194-F202 HydrophobicContact CB-CD1 3.87Å; N194-F202 HydrophobicContact CB-CE1 4.3Å
195	L	97.5	Very high	96.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.255	C	S	.	.			trans	-108.1	-4.3	-176.3	-57.6	-179.8	0	0	0	113.9	I134 Y139 V176 Y178 P179 A181 N197 G198 P199	I134-L195 HydrophobicContact CD1-CD1 4.01Å; I134-L195 HydrophobicContact CD1-CD2 4.08Å; I134-L195 HydrophobicContact CG1-CD1 4.11Å; I134-L195 HydrophobicContact CG2-CD1 4.01Å; Y139-L195 VanDerWaalsContact CE1-O 3.28Å; Y139-L195 WeakPolarHBondContact CE1-O 3.23Å; Y139-L195 PolarHBondContact OH-O 3.13Å; V176-L195 HydrophobicContact CG1-CD1 3.95Å; Y178-L195 HydrophobicContact CD2-CB 3.89Å; Y178-L195 HydrophobicContact CE2-CB 4.07Å; P179-L195 WeakPolarHBondContact O-CB 3.44Å; P179-L195 WeakPolarHBondContact O-CG 3.49Å; P179-L195 PolarHBondContact O-N 3.04Å; A181-L195 HydrophobicContact CB-CD1 4.06Å; A181-L195 HydrophobicContact CB-CD2 4.1Å; A181-L195 HydrophobicContact CB-CG 4.28Å; L195-N197 PolarHBondContact O-N 2.74Å; L195-G198 PolarHBondContact O-N 2.96Å; L195-P199 HydrophobicContact CD2-CB 3.94Å; L195-P199 HydrophobicContact CD2-CG 4.22Å
196	E	96.1	Very high	96.7	Very high	89 Å²	89	53.9 Å²	53.9	42%	0.416	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-45.6	-171.2	-71.3	172.7	134.6	0	0	114.1	N138 Y178 P179 N194	N138-E196 PolarHBondContact OD1-O 3.33Å; Y178-E196 WeakPolarHBondContact OH-CA 3.38Å; P179-E196 HydrophobicContact CB-CG 3.57Å; P179-E196 HydrophobicContact CG-CG 4.33Å; N194-E196 PolarHBondContact ND2-OE2 3.14Å; N194-E196 WeakPolarHBondContact OD1-CB 3.02Å; N194-E196 WeakPolarHBondContact OD1-CG 3.02Å; N194-E196 PolarHBondContact OD1-N 3.01Å; N194-E196 PolarHBondContact OD1-OE2 3.13Å
197	N	92.6	Very high	96.7	Very high	145 Å²	145	53.1 Å²	53.1	78%	0.775	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	31.2	-177.2	-64.7	-57.5	0	0	0	111.7	L195	L195-N197 PolarHBondContact O-N 2.74Å
198	G	93.4	Very high	96.7	Very high	16 Å²	16	54.2 Å²	54.2	17%	0.165	28%	0.278	C	S	.	.	S	Bend	trans	95.1	158.5	-168.2	0	0	0	0	0	112.1	L195 T200	L195-G198 PolarHBondContact O-N 2.96Å; G198-T200 PolarHBondContact O-N 3.12Å; G198-T200 VanDerWaalsContact O-N 3.13Å; G198-T200 PolarHBondContact O-OG1 2.69Å
199	P	95.7	Very high	96.7	Very high	20 Å²	20	51 Å²	51	13%	0.13	27%	0.266	C	S	.	.			trans	-66.9	114.4	-170.9	-16.4	29.4	0	0	0	112	F153 L163 N194 L195	F153-P199 HydrophobicContact CD1-CB 4.22Å; F153-P199 HydrophobicContact CD1-CG 3.47Å; F153-P199 VanDerWaalsContact CD1-CG 3.47Å; F153-P199 HydrophobicContact CD2-CB 4.33Å; F153-P199 HydrophobicContact CD2-CG 4.07Å; F153-P199 HydrophobicContact CE1-CB 3.59Å; F153-P199 HydrophobicContact CE1-CG 3.3Å; F153-P199 HydrophobicContact CE2-CB 3.73Å; F153-P199 HydrophobicContact CE2-CG 3.94Å; F153-P199 HydrophobicContact CG-CG 3.85Å; F153-P199 HydrophobicContact CZ-CB 3.32Å; F153-P199 HydrophobicContact CZ-CG 3.56Å; L163-P199 HydrophobicContact CD2-CB 3.85Å; L163-P199 HydrophobicContact CD2-CG 3.99Å; L163-P199 WeakPolarHBondContact CD2-O 3.48Å; N194-P199 WeakPolarHBondContact O-CA 3.49Å; L195-P199 HydrophobicContact CD2-CB 3.94Å; L195-P199 HydrophobicContact CD2-CG 4.22Å
200	T	96.4	Very high	96.7	Very high	85 Å²	85	57.4 Å²	57.4	52%	0.521	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.2	-179	-52.4	0	0	0	0	109.8	Y193 N194 G198 F202	Y193-T200 CarbonylContact C-O 3.55Å; Y193-T200 VanDerWaalsContact CA-O 3.27Å; Y193-T200 WeakPolarHBondContact CA-O 3.48Å; N194-T200 PolarHBondContact N-O 2.88Å; N194-T200 PolarHBondContact O-N 3.1Å; G198-T200 PolarHBondContact O-N 3.12Å; G198-T200 VanDerWaalsContact O-N 3.13Å; G198-T200 PolarHBondContact O-OG1 2.69Å; T200-F202 PolarHBondContact O-N 3.17Å
201	Q	96.5	Very high	96.6	Very high	91 Å²	91	62 Å²	62	43%	0.425	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.6	174.4	-176.4	-178.1	-42.9	0	0	109.2	Y193	Y193-Q201 HydrophobicContact CD1-CB 3.9Å; Y193-Q201 HydrophobicContact CE1-CB 3.65Å; Y193-Q201 HydrophobicContact CE1-CG 4.31Å
202	F	94.9	Very high	96.6	Very high	117 Å²	117	65.3 Å²	65.3	51%	0.513	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-15.7	175.1	77.8	-89.8	0	0	0	113.6	L180 V192 N194 T200	L180-F202 HydrophobicContact CD1-CE1 3.92Å; L180-F202 HydrophobicContact CD1-CZ 4.01Å; V192-F202 HydrophobicContact CB-CD1 4.48Å; V192-F202 HydrophobicContact CB-CE1 4.05Å; V192-F202 HydrophobicContact CB-CZ 4.14Å; V192-F202 HydrophobicContact CG1-CD1 4.18Å; V192-F202 HydrophobicContact CG1-CE1 3.3Å; V192-F202 HydrophobicContact CG1-CE2 4.07Å; V192-F202 HydrophobicContact CG1-CZ 3.24Å; V192-F202 WeakPolarHBondContact O-CD1 3.26Å; V192-F202 PolarHBondContact O-N 3.12Å; N194-F202 HydrophobicContact CB-CD1 3.87Å; N194-F202 HydrophobicContact CB-CE1 4.3Å; T200-F202 PolarHBondContact O-N 3.17Å
203	S	95.8	Very high	96.6	Very high	41 Å²	41	65.4 Å²	65.4	29%	0.287	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.6	175.3	-175.4	0	0	0	0	111.5	V192	V192-S203 PolarHBondContact N-O 2.78Å; V192-S203 PolarHBondContact O-N 3.37Å
204	Q	96.7	Very high	96.6	Very high	107 Å²	107	69.1 Å²	69.1	50%	0.5	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130	171.7	179.5	-176.6	-32.4	0	0	107.8	I190 F191	I190-Q204 WeakPolarHBondContact O-CA 3.36Å; F191-Q204 HydrophobicContact CD1-CB 4.46Å; F191-Q204 HydrophobicContact CD1-CG 4.16Å; F191-Q204 HydrophobicContact CE1-CG 3.95Å; F191-Q204 HydrophobicContact CZ-CG 4.45Å
205	L	96.6	Very high	96.7	Very high	65 Å²	65	67 Å²	67	34%	0.34	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	151.2	-179	-55.9	169.8	0	0	0	109.4	I190 V192 F230	I190-L205 HydrophobicContact CB-CB 4.32Å; I190-L205 PolarHBondContact N-O 3.08Å; I190-L205 PolarHBondContact O-N 2.9Å; V192-L205 HydrophobicContact CG2-CD1 4.28Å; L205-F230 HydrophobicContact CD1-CE1 4.07Å; L205-F230 HydrophobicContact CD1-CZ 3.99Å
206	E	96.8	Very high	96.8	Very high	130 Å²	130	67.5 Å²	67.5	61%	0.607	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	142	161.4	-166.8	-179.1	152.3	0	0	109.1	R188	R188-E206 IonicContact CZ-OE1 2.8Å; R188-E206 VanDerWaalsContact CZ-OE1 3.26Å; R188-E206 IonicContact NH1-OE1 3.58Å; R188-E206 PolarHBondContact NH1-OE1 2.61Å; R188-E206 VanDerWaalsContact NH1-OE1 3.08Å; R188-E206 IonicContact NH2-OE1 3.19Å; R188-E206 PolarHBondContact NH2-OE1 2.98Å
207	S	97.7	Very high	96.9	Very high	6 Å²	6	63.9 Å²	63.9	4%	0.042	32%	0.32	C	S	.	.			trans	-54.5	130	175.5	-176.4	0	0	0	0	110.8	R188 L209 S213 L232	R188-S207 VanDerWaalsContact O-CB 3.3Å; R188-S207 WeakPolarHBondContact O-CB 3.49Å; R188-S207 PolarHBondContact O-N 3.18Å; S207-L209 PolarHBondContact O-N 2.53Å; S207-L209 VanDerWaalsContact O-N 3.12Å; S207-L209 WeakPolarHBondContact OG-CB 3.34Å; S207-L209 PolarHBondContact OG-N 3.35Å; S207-L209 VanDerWaalsContact OG-N 3.14Å; S207-S213 PolarHBondContact OG-OG 3.43Å; S207-L232 WeakPolarHBondContact OG-CD2 3.19Å
208	P	97.3	Very high	97.2	Very high	51 Å²	51	57.5 Å²	57.5	33%	0.331	29%	0.286	S	S	.	.	S	Bend	trans	-68.6	-4.8	170.6	32.2	-39.1	0	0	0	112.5	A240 Q242	P208-A240 HydrophobicContact CB-CB 4.2Å; P208-A240 HydrophobicContact CG-CB 3.35Å; P208-Q242 HydrophobicContact CG-CG 3.83Å
209	L	98.2	Very high	97.4	Very high	3 Å²	3	57 Å²	57	2%	0.016	28%	0.279	C	S	.	.	S	Bend	trans	-98.1	141.2	177.6	-55.6	173.3	0	0	0	110	R188 S207 F211 L232 R238 A240 T254	R188-L209 PolarHBondContact NH1-O 3.14Å; R188-L209 VanDerWaalsContact NH1-O 3.15Å; S207-L209 PolarHBondContact O-N 2.53Å; S207-L209 VanDerWaalsContact O-N 3.12Å; S207-L209 WeakPolarHBondContact OG-CB 3.34Å; S207-L209 PolarHBondContact OG-N 3.35Å; S207-L209 VanDerWaalsContact OG-N 3.14Å; L209-F211 VanDerWaalsContact C-N 3.34Å; L209-L232 HydrophobicContact CD1-CB 4.29Å; L209-L232 HydrophobicContact CD1-CD2 3.85Å; L209-L232 HydrophobicContact CD1-CG 3.95Å; L209-L232 WeakPolarHBondContact CD1-O 3.31Å; L209-L232 HydrophobicContact CG-CD2 4.25Å; L209-R238 HydrophobicContact CD2-CB 4.27Å; L209-R238 HydrophobicContact CD2-CG 3.74Å; L209-A240 HydrophobicContact CD1-CB 4.37Å; L209-A240 HydrophobicContact CD2-CB 3.86Å; L209-A240 HydrophobicContact CG-CB 4.02Å; L209-T254 HydrophobicContact CD2-CG2 4.19Å
210	K	97.1	Very high	97.5	Very high	182 Å²	182	58.1 Å²	58.1	79%	0.791	28%	0.283	S	S	*	.	S	Bend	trans	-76.8	-21.7	-179	-65.4	-174.6	177.5	-175.3	0	113.4
211	F	97.8	Very high	97.4	Very high	97 Å²	97	55.9 Å²	55.9	43%	0.425	27%	0.268	S	S	.	.	S	Bend	trans	-110.1	171	-174.9	-67.3	-94.1	0	0	0	111.5	L209 S213 I235 E236	L209-F211 VanDerWaalsContact C-N 3.34Å; F211-S213 PolarHBondContact O-N 2.83Å; F211-I235 HydrophobicContact CB-CG1 3.9Å; F211-E236 HydrophobicContact CB-CB 3.92Å; F211-E236 HydrophobicContact CD1-CB 4.41Å; F211-E236 HydrophobicContact CD2-CB 3.44Å; F211-E236 VanDerWaalsContact CD2-CB 3.44Å; F211-E236 HydrophobicContact CD2-CG 3.44Å; F211-E236 VanDerWaalsContact CD2-CG 3.44Å; F211-E236 WeakPolarHBondContact CD2-OE2 3.45Å; F211-E236 HydrophobicContact CE2-CB 4.02Å; F211-E236 VanDerWaalsContact CE2-CD 3.43Å; F211-E236 HydrophobicContact CE2-CG 3.45Å; F211-E236 VanDerWaalsContact CE2-CG 3.45Å; F211-E236 WeakPolarHBondContact CE2-OE2 3.38Å; F211-E236 HydrophobicContact CG-CB 3.67Å; F211-E236 HydrophobicContact CG-CG 4.05Å; F211-E236 HydrophobicContact CZ-CG 4.05Å
212	Q	98.3	Very high	97	Very high	74 Å²	74	59.8 Å²	59.8	35%	0.346	28%	0.283	S	S	.	.			trans	-49.5	127.5	179.3	-171	-177.6	70.7	0	0	111.8	Y172 S234 I235	Y172-Q212 HydrophobicContact CD2-CG 3.86Å; Y172-Q212 VanDerWaalsContact CE2-CD 3.49Å; Y172-Q212 HydrophobicContact CE2-CG 3.5Å; Y172-Q212 VanDerWaalsContact CE2-CG 3.5Å; Y172-Q212 PolarHBondContact OH-NE2 2.81Å; Q212-S234 VanDerWaalsContact O-CA 3.26Å; Q212-S234 WeakPolarHBondContact O-CA 3.33Å; Q212-S234 WeakPolarHBondContact O-CB 3.43Å; Q212-I235 HydrophobicContact CB-CD1 3.73Å; Q212-I235 HydrophobicContact CB-CG1 3.94Å; Q212-I235 HydrophobicContact CB-CG2 4.26Å; Q212-I235 PolarHBondContact O-N 2.81Å; Q212-I235 VanDerWaalsContact O-N 3.13Å
213	S	98	Very high	96.7	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.014	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137.4	171.4	-59.8	0	0	0	0	110.2	Y172 S207 F211	Y172-S213 WeakPolarHBondContact CD2-O 3.31Å; S207-S213 PolarHBondContact OG-OG 3.43Å; F211-S213 PolarHBondContact O-N 2.83Å
214	R	98.6	Very high	96.4	Very high	80 Å²	80	64 Å²	64	30%	0.302	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-41.7	-173.6	-172.2	158.2	-179.1	109.6	-8.2	113.3	G233 I235 V273 N274	R214-G233 PolarHBondContact N-O 3.06Å; R214-I235 HydrophobicContact CB-CG2 4.43Å; R214-V273 WeakPolarHBondContact CB-O 3.44Å; R214-V273 VanDerWaalsContact CD-O 3.29Å; R214-V273 WeakPolarHBondContact CD-O 3.49Å; R214-V273 WeakPolarHBondContact CG-O 3.37Å; R214-N274 PolarHBondContact NE-OD1 2.85Å; R214-N274 PolarHBondContact NH2-OD1 3.3Å
215	C	98.8	Very high	96	Very high	6 Å²	6	65.2 Å²	65.2	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	155.1	179.6	52.7	0	0	0	0	110.3	G233 V273 M276	C215-G233 PolarHBondContact O-N 2.97Å; C215-V273 PolarHBondContact SG-O 2.95Å; C215-M276 HydrophobicContact CB-CG 4.32Å
216	I	98.8	Very high	95.9	Very high	11 Å²	11	66.5 Å²	66.5	6%	0.056	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	141.9	179.5	-164.4	169.3	0	0	0	108.1	C173 D175 L182 I190 F230 A231 L232	C173-I216 HydrophobicContact CB-CB 4.45Å; C173-I216 HydrophobicContact CB-CG2 3.94Å; D175-I216 HydrophobicContact CB-CG2 4.14Å; L182-I216 HydrophobicContact CB-CD1 3.79Å; L182-I216 HydrophobicContact CD1-CD1 3.89Å; L182-I216 HydrophobicContact CD1-CG1 4.33Å; L182-I216 HydrophobicContact CG-CD1 4.42Å; I190-I216 HydrophobicContact CG2-CD1 4.16Å; I216-F230 HydrophobicContact CD1-CD2 3.93Å; I216-F230 HydrophobicContact CD1-CE2 4.37Å; I216-F230 HydrophobicContact CD1-CG 4.38Å; I216-F230 HydrophobicContact CG1-CB 4.34Å; I216-F230 HydrophobicContact CG1-CD2 4.05Å; I216-F230 HydrophobicContact CG1-CG 4.48Å; I216-A231 CarbonylContact C-O 3.51Å; I216-A231 WeakPolarHBondContact CA-O 3.44Å; I216-A231 WeakPolarHBondContact CG1-O 3.1Å; I216-L232 HydrophobicContact CB-CD1 3.96Å; I216-L232 HydrophobicContact CD1-CD1 3.92Å; I216-L232 HydrophobicContact CG1-CD1 3.92Å
217	S	98.8	Very high	95.9	Very high	12 Å²	12	61.1 Å²	61.1	8%	0.084	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	130.9	175.9	-175.7	0	0	0	0	111.1	D175 F230 A231 F278	D175-S217 VanDerWaalsContact OD2-CA 3.3Å; D175-S217 WeakPolarHBondContact OD2-CA 3.29Å; S217-F230 CarbonylContact O-C 3.56Å; S217-F230 WeakPolarHBondContact O-CA 3.43Å; S217-F230 WeakPolarHBondContact O-CB 3.08Å; S217-A231 PolarHBondContact N-O 2.74Å; S217-A231 PolarHBondContact O-N 2.78Å; S217-F278 WeakPolarHBondContact OG-CD2 3.47Å
218	I	98.7	Very high	95.8	Very high	12 Å²	12	62.2 Å²	62.2	6%	0.062	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	140.4	178.3	-68.1	164.8	0	0	0	109.5	D175 H177 L180 L182 P227 G229 F278	D175-I218 HydrophobicContact CB-CD1 4.14Å; D175-I218 HydrophobicContact CB-CG1 4.17Å; D175-I218 PolarHBondContact OD2-N 3.03Å; H177-I218 HydrophobicContact CB-CB 4.31Å; H177-I218 HydrophobicContact CB-CD1 4.15Å; H177-I218 HydrophobicContact CB-CG2 3.86Å; L180-I218 HydrophobicContact CB-CD1 4.39Å; L180-I218 HydrophobicContact CD2-CD1 3.89Å; L180-I218 HydrophobicContact CD2-CG1 4.02Å; L180-I218 HydrophobicContact CD2-CG2 4.1Å; L180-I218 HydrophobicContact CG-CD1 4.14Å; L182-I218 HydrophobicContact CD1-CD1 4.13Å; L182-I218 HydrophobicContact CD1-CG1 3.51Å; L182-I218 HydrophobicContact CG-CD1 4.2Å; L182-I218 HydrophobicContact CG-CG1 4.13Å; I218-P227 HydrophobicContact CG2-CB 3.86Å; I218-G229 WeakPolarHBondContact CA-O 3.26Å; I218-F278 WeakPolarHBondContact O-CD2 3.4Å
219	F	98.2	Very high	95.9	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.5	168.4	61.3	-100.5	0	0	0	112.4	S228 G229 F230 I241 Y243 F278 K299	F219-S228 VanDerWaalsContact CD2-OG 3.25Å; F219-S228 WeakPolarHBondContact CD2-OG 3.49Å; F219-S228 VanDerWaalsContact CE2-OG 3.25Å; F219-S228 WeakPolarHBondContact CE2-OG 3.27Å; F219-S228 PolarHBondContact O-N 2.85Å; F219-S228 PolarHBondContact O-OG 2.7Å; F219-G229 VanDerWaalsContact CZ-CA 3.45Å; F219-G229 PolarHBondContact N-O 2.97Å; F219-G229 PolarHBondContact O-N 3.46Å; F219-F230 VanDerWaalsContact CE1-C 3.43Å; F219-F230 WeakPolarHBondContact CE1-O 3.15Å; F219-I241 HydrophobicContact CE1-CG2 3.88Å; F219-I241 HydrophobicContact CZ-CG2 4.03Å; F219-Y243 AromaticContact CE2-CD1 3.79Å; F219-Y243 HydrophobicContact CE2-CD1 3.79Å; F219-Y243 AromaticContact CE2-CE1 3.56Å; F219-Y243 HydrophobicContact CE2-CE1 3.56Å; F219-Y243 HydrophobicContact CE2-CG 4.47Å; F219-Y243 AromaticContact CZ-CD1 3.92Å; F219-Y243 HydrophobicContact CZ-CD1 3.92Å; F219-Y243 HydrophobicContact CZ-CD2 4.28Å; F219-Y243 AromaticContact CZ-CE1 3.85Å; F219-Y243 HydrophobicContact CZ-CE1 3.85Å; F219-Y243 HydrophobicContact CZ-CE2 4.18Å; F219-Y243 HydrophobicContact CZ-CG 4.15Å; F219-Y243 AromaticContact CZ-CZ 3.98Å; F219-F278 HydrophobicContact CB-CD1 3.9Å; F219-F278 HydrophobicContact CB-CD2 3.8Å; F219-F278 HydrophobicContact CB-CE1 3.74Å; F219-F278 HydrophobicContact CB-CE2 3.65Å; F219-F278 HydrophobicContact CB-CG 3.94Å; F219-F278 HydrophobicContact CB-CZ 3.62Å; F219-F278 HydrophobicContact CD1-CE1 4.22Å; F219-F278 AromaticContact CD1-CE2 3.79Å; F219-F278 HydrophobicContact CD1-CE2 3.79Å; F219-F278 AromaticContact CD1-CZ 3.48Å; F219-F278 HydrophobicContact CD1-CZ 3.48Å; F219-F278 VanDerWaalsContact CD1-CZ 3.48Å; F219-F278 HydrophobicContact CE1-CZ 4.48Å; F219-F278 HydrophobicContact CG-CE1 4.26Å; F219-F278 HydrophobicContact CG-CE2 4.21Å; F219-F278 AromaticContact CG-CZ 3.91Å; F219-F278 HydrophobicContact CG-CZ 3.91Å; F219-K299 HydrophobicContact CD1-CD 4.31Å; F219-K299 HydrophobicContact CE1-CD 4.29Å; F219-K299 HydrophobicContact CG-CD 4.43Å; F219-K299 HydrophobicContact CZ-CD 4.42Å
220	M	97	Very high	95.9	Very high	44 Å²	44	59.7 Å²	59.7	22%	0.217	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	158.4	179	-56.4	-57	-77.6	0	0	111.7	H177 K224 N226 P227 S228	H177-M220 PolarHBondContact CD2-SD 3.24Å; H177-M220 WeakPolarHBondContact CE1-CE 3.28Å; H177-M220 PolarHBondContact CE1-SD 3.05Å; H177-M220 PolarHBondContact NE2-SD 2.97Å; M220-K224 HydrophobicContact CB-CB 4.47Å; M220-N226 WeakPolarHBondContact CA-O 3.31Å; M220-P227 HydrophobicContact CE-CG 4.41Å; M220-P227 HydrophobicContact SD-CB 4.36Å; M220-P227 HydrophobicContact SD-CG 4.09Å; M220-S228 VanDerWaalsContact C-OG 3.26Å; M220-S228 PolarHBondContact O-OG 3.49Å
221	D	94.3	Very high	96	Very high	38 Å²	38	51 Å²	51	20%	0.203	24%	0.241	C	C	.	.			trans	-61.1	171.1	165.7	67.4	37.3	0	0	0	111.5	Q223 K224 Q225 N226 S228	D221-Q223 PolarHBondContact O-N 3.04Å; D221-Q223 VanDerWaalsContact OD1-C 3.26Å; D221-Q223 WeakPolarHBondContact OD1-CA 3.34Å; D221-Q223 WeakPolarHBondContact OD1-CB 3.4Å; D221-Q223 PolarHBondContact OD1-N 2.98Å; D221-K224 PolarHBondContact O-N 3.5Å; D221-K224 WeakPolarHBondContact OD1-CA 3.44Å; D221-K224 PolarHBondContact OD1-N 2.8Å; D221-Q225 PolarHBondContact OD1-N 3.44Å; D221-N226 PolarHBondContact N-O 3.27Å; D221-N226 PolarHBondContact OD2-N 3.33Å; D221-S228 PolarHBondContact N-OG 3.05Å
222	K	88.4	Confident	96	Very high	174 Å²	174	46.4 Å²	46.4	76%	0.757	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.6	-179.1	-69.2	-178.9	179.8	170.5	0	113.7	K224	K222-K224 VanDerWaalsContact C-N 3.27Å
223	Q	89.6	Confident	96	Very high	151 Å²	151	42.9 Å²	42.9	71%	0.706	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.8	179.1	-60.4	175.3	2.1	0	0	111.7	D221 Q225	D221-Q223 PolarHBondContact O-N 3.04Å; D221-Q223 VanDerWaalsContact OD1-C 3.26Å; D221-Q223 WeakPolarHBondContact OD1-CA 3.34Å; D221-Q223 WeakPolarHBondContact OD1-CB 3.4Å; D221-Q223 PolarHBondContact OD1-N 2.98Å; Q223-Q225 HydrophobicContact CB-CG 3.82Å; Q223-Q225 PolarHBondContact O-N 2.86Å; Q223-Q225 PolarHBondContact O-NE2 2.92Å; Q223-Q225 VanDerWaalsContact O-NE2 3.09Å
224	K	88	Confident	96.1	Very high	95 Å²	95	42.8 Å²	42.8	41%	0.413	20%	0.204	S	C	.	.	S	Bend	trans	54.9	29.5	-174.7	-52.8	-179.1	-172.5	178.4	0	113.6	M220 D221 K222 P280 V281	M220-K224 HydrophobicContact CB-CB 4.47Å; D221-K224 PolarHBondContact O-N 3.5Å; D221-K224 WeakPolarHBondContact OD1-CA 3.44Å; D221-K224 PolarHBondContact OD1-N 2.8Å; K222-K224 VanDerWaalsContact C-N 3.27Å; K224-P280 PolarHBondContact NZ-O 2.88Å; K224-V281 VanDerWaalsContact CE-O 3.27Å; K224-V281 WeakPolarHBondContact CE-O 3.35Å; K224-V281 PolarHBondContact NZ-O 3.46Å
225	Q	88.7	Confident	96.1	Very high	132 Å²	132	41.9 Å²	41.9	62%	0.617	20%	0.204	S	C	*	.	S	Bend	trans	-89.2	-39.7	-179.2	-62.6	-55.8	-51.7	0	0	110.6	D221 Q223	D221-Q225 PolarHBondContact OD1-N 3.44Å; Q223-Q225 HydrophobicContact CB-CG 3.82Å; Q223-Q225 PolarHBondContact O-N 2.86Å; Q223-Q225 PolarHBondContact O-NE2 2.92Å; Q223-Q225 VanDerWaalsContact O-NE2 3.09Å
226	N	94.5	Very high	96	Very high	92 Å²	92	43.1 Å²	43.1	49%	0.492	21%	0.21	S	C	.	.	S	Bend	trans	-133.4	146.8	-175	-57.3	-77.2	0	0	0	112.5	M220 D221 S228	M220-N226 WeakPolarHBondContact CA-O 3.31Å; D221-N226 PolarHBondContact N-O 3.27Å; D221-N226 PolarHBondContact OD2-N 3.33Å; N226-S228 PolarHBondContact O-N 3.24Å
227	P	97.3	Very high	96	Very high	18 Å²	18	42.6 Å²	42.6	12%	0.117	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	127.5	161	-23.5	34.3	0	0	0	110.2	H177 L180 I218 M220	H177-P227 HydrophobicContact CB-CG 4.19Å; H177-P227 VanDerWaalsContact O-CG 3.23Å; H177-P227 WeakPolarHBondContact O-CG 3.43Å; L180-P227 HydrophobicContact CB-CB 3.8Å; L180-P227 HydrophobicContact CB-CG 3.89Å; L180-P227 HydrophobicContact CD2-CB 3.7Å; L180-P227 HydrophobicContact CG-CB 4.4Å; I218-P227 HydrophobicContact CG2-CB 3.86Å; M220-P227 HydrophobicContact CE-CG 4.41Å; M220-P227 HydrophobicContact SD-CB 4.36Å; M220-P227 HydrophobicContact SD-CG 4.09Å
228	S	96.4	Very high	96	Very high	28 Å²	28	44.2 Å²	44.2	20%	0.196	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-16	-175.1	67.7	0	0	0	0	114.2	F219 M220 D221 N226 L244	F219-S228 VanDerWaalsContact CD2-OG 3.25Å; F219-S228 WeakPolarHBondContact CD2-OG 3.49Å; F219-S228 VanDerWaalsContact CE2-OG 3.25Å; F219-S228 WeakPolarHBondContact CE2-OG 3.27Å; F219-S228 PolarHBondContact O-N 2.85Å; F219-S228 PolarHBondContact O-OG 2.7Å; M220-S228 VanDerWaalsContact C-OG 3.26Å; M220-S228 PolarHBondContact O-OG 3.49Å; D221-S228 PolarHBondContact N-OG 3.05Å; N226-S228 PolarHBondContact O-N 3.24Å; S228-L244 PolarHBondContact O-N 2.84Å
229	G	97.6	Very high	96	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.7	-167.8	-179.3	0	0	0	0	0	112.1	I218 F219 Q242	I218-G229 WeakPolarHBondContact CA-O 3.26Å; F219-G229 VanDerWaalsContact CZ-CA 3.45Å; F219-G229 PolarHBondContact N-O 2.97Å; F219-G229 PolarHBondContact O-N 3.46Å; G229-Q242 CarbonylContact C-O 3.5Å; G229-Q242 WeakPolarHBondContact CA-O 3.29Å
230	F	98.5	Very high	96	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	152.9	179.4	59.6	-87.6	0	0	0	113	L182 I190 L205 I216 S217 F219 L232 Q242 L244	L182-F230 HydrophobicContact CD1-CB 3.33Å; L182-F230 HydrophobicContact CD1-CD1 3.56Å; L182-F230 HydrophobicContact CD1-CD2 4.36Å; L182-F230 HydrophobicContact CD1-CE1 4.45Å; L182-F230 HydrophobicContact CD1-CG 3.5Å; L182-F230 HydrophobicContact CD2-CD1 4.25Å; L182-F230 HydrophobicContact CD2-CE1 4.47Å; I190-F230 HydrophobicContact CD1-CE2 3.8Å; I190-F230 HydrophobicContact CD1-CZ 4.02Å; I190-F230 HydrophobicContact CG2-CZ 4.32Å; L205-F230 HydrophobicContact CD1-CE1 4.07Å; L205-F230 HydrophobicContact CD1-CZ 3.99Å; I216-F230 HydrophobicContact CD1-CD2 3.93Å; I216-F230 HydrophobicContact CD1-CE2 4.37Å; I216-F230 HydrophobicContact CD1-CG 4.38Å; I216-F230 HydrophobicContact CG1-CB 4.34Å; I216-F230 HydrophobicContact CG1-CD2 4.05Å; I216-F230 HydrophobicContact CG1-CG 4.48Å; S217-F230 CarbonylContact O-C 3.56Å; S217-F230 WeakPolarHBondContact O-CA 3.43Å; S217-F230 WeakPolarHBondContact O-CB 3.08Å; F219-F230 VanDerWaalsContact CE1-C 3.43Å; F219-F230 WeakPolarHBondContact CE1-O 3.15Å; F230-L232 HydrophobicContact CD2-CB 4.33Å; F230-L232 HydrophobicContact CE2-CB 4.36Å; F230-Q242 HydrophobicContact CD1-CB 4.21Å; F230-Q242 HydrophobicContact CD2-CB 4.18Å; F230-Q242 HydrophobicContact CE1-CB 3.73Å; F230-Q242 HydrophobicContact CE2-CB 3.7Å; F230-Q242 HydrophobicContact CE2-CG 3.81Å; F230-Q242 HydrophobicContact CG-CB 4.43Å; F230-Q242 HydrophobicContact CZ-CB 3.45Å; F230-Q242 VanDerWaalsContact CZ-CB 3.45Å; F230-Q242 HydrophobicContact CZ-CG 3.81Å; F230-Q242 PolarHBondContact N-O 2.91Å; F230-Q242 PolarHBondContact O-N 3.27Å; F230-L244 HydrophobicContact CD1-CD2 4.5Å; F230-L244 HydrophobicContact CE1-CD2 4.41Å
231	A	98.9	Very high	96.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	140.4	161.8	0	0	0	0	0	109.6	I216 S217 V239 A240 I241 M276 F278 L285	I216-A231 CarbonylContact C-O 3.51Å; I216-A231 WeakPolarHBondContact CA-O 3.44Å; I216-A231 WeakPolarHBondContact CG1-O 3.1Å; S217-A231 PolarHBondContact N-O 2.74Å; S217-A231 PolarHBondContact O-N 2.78Å; A231-V239 HydrophobicContact CB-CG1 4.12Å; A231-A240 CarbonylContact C-O 3.37Å; A231-A240 VanDerWaalsContact CA-O 3.23Å; A231-A240 WeakPolarHBondContact CA-O 3.49Å; A231-I241 HydrophobicContact CB-CD1 3.79Å; A231-M276 HydrophobicContact CB-CE 4.38Å; A231-M276 HydrophobicContact CB-SD 3.53Å; A231-M276 VanDerWaalsContact CB-SD 3.53Å; A231-F278 HydrophobicContact CB-CE2 3.7Å; A231-F278 HydrophobicContact CB-CZ 3.81Å; A231-L285 HydrophobicContact CB-CD1 4.49Å; A231-L285 HydrophobicContact CB-CD2 4.13Å
232	L	98.9	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.7	175.6	-174.3	76.7	0	0	0	109.4	I190 S207 L209 I216 F230 V239 A240	I190-L232 HydrophobicContact CD1-CD1 4.34Å; I190-L232 HydrophobicContact CD1-CD2 3.7Å; S207-L232 WeakPolarHBondContact OG-CD2 3.19Å; L209-L232 HydrophobicContact CD1-CB 4.29Å; L209-L232 HydrophobicContact CD1-CD2 3.85Å; L209-L232 HydrophobicContact CD1-CG 3.95Å; L209-L232 WeakPolarHBondContact CD1-O 3.31Å; L209-L232 HydrophobicContact CG-CD2 4.25Å; I216-L232 HydrophobicContact CB-CD1 3.96Å; I216-L232 HydrophobicContact CD1-CD1 3.92Å; I216-L232 HydrophobicContact CG1-CD1 3.92Å; F230-L232 HydrophobicContact CD2-CB 4.33Å; F230-L232 HydrophobicContact CE2-CB 4.36Å; L232-V239 CarbonylContact O-C 3.55Å; L232-V239 WeakPolarHBondContact O-CA 3.34Å; L232-A240 HydrophobicContact CB-CB 4.46Å; L232-A240 PolarHBondContact N-O 3.42Å; L232-A240 PolarHBondContact O-N 2.95Å
233	G	98.8	Very high	96.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.1	176.3	0	0	0	0	0	112	R214 C215 M276	R214-G233 PolarHBondContact N-O 3.06Å; C215-G233 PolarHBondContact O-N 2.97Å; G233-M276 VanDerWaalsContact CA-CE 3.48Å
234	S	98.7	Very high	97	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	170.3	175.9	63.4	0	0	0	0	112.7	Q212 E236 R238 V273	Q212-S234 VanDerWaalsContact O-CA 3.26Å; Q212-S234 WeakPolarHBondContact O-CA 3.33Å; Q212-S234 WeakPolarHBondContact O-CB 3.43Å; S234-E236 PolarHBondContact O-N 3.18Å; S234-E236 PolarHBondContact OG-N 3.34Å; S234-R238 PolarHBondContact N-O 2.99Å; S234-R238 PolarHBondContact OG-O 3.2Å; S234-V273 PolarHBondContact O-N 3.39Å
235	I	98.6	Very high	97.2	Very high	61 Å²	61	32.6 Å²	32.6	31%	0.313	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-4.9	171.8	63.6	168.9	0	0	0	114.3	F211 Q212 R214 A272	F211-I235 HydrophobicContact CB-CG1 3.9Å; Q212-I235 HydrophobicContact CB-CD1 3.73Å; Q212-I235 HydrophobicContact CB-CG1 3.94Å; Q212-I235 HydrophobicContact CB-CG2 4.26Å; Q212-I235 PolarHBondContact O-N 2.81Å; Q212-I235 VanDerWaalsContact O-N 3.13Å; R214-I235 HydrophobicContact CB-CG2 4.43Å; I235-A272 HydrophobicContact CB-CB 4.19Å; I235-A272 HydrophobicContact CG2-CB 4.25Å
236	E	98.1	Very high	97.5	Very high	32 Å²	32	28.9 Å²	28.9	15%	0.15	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	29.4	-174.8	-166	-125.8	144.6	0	0	113.1	F211 S234 R238 R259 I270	F211-E236 HydrophobicContact CB-CB 3.92Å; F211-E236 HydrophobicContact CD1-CB 4.41Å; F211-E236 HydrophobicContact CD2-CB 3.44Å; F211-E236 VanDerWaalsContact CD2-CB 3.44Å; F211-E236 HydrophobicContact CD2-CG 3.44Å; F211-E236 VanDerWaalsContact CD2-CG 3.44Å; F211-E236 WeakPolarHBondContact CD2-OE2 3.45Å; F211-E236 HydrophobicContact CE2-CB 4.02Å; F211-E236 VanDerWaalsContact CE2-CD 3.43Å; F211-E236 HydrophobicContact CE2-CG 3.45Å; F211-E236 VanDerWaalsContact CE2-CG 3.45Å; F211-E236 WeakPolarHBondContact CE2-OE2 3.38Å; F211-E236 HydrophobicContact CG-CB 3.67Å; F211-E236 HydrophobicContact CG-CG 4.05Å; F211-E236 HydrophobicContact CZ-CG 4.05Å; S234-E236 PolarHBondContact O-N 3.18Å; S234-E236 PolarHBondContact OG-N 3.34Å; E236-R238 VanDerWaalsContact C-N 3.32Å; E236-R238 PolarHBondContact O-N 2.8Å; E236-R238 IonicContact OE1-NE 3.18Å; E236-R238 IonicContact OE1-NH2 2.97Å; E236-R238 PolarHBondContact OE1-NH2 3.16Å; E236-R238 IonicContact OE2-NE 3.96Å; E236-R238 PolarHBondContact OE2-NE 3.03Å; E236-R238 IonicContact OE2-NH2 3.18Å; E236-R259 PolarHBondContact O-NH2 3.19Å; E236-R259 IonicContact OE1-CZ 2.73Å; E236-R259 IonicContact OE1-NH2 2.74Å; E236-R259 PolarHBondContact OE1-NH2 3.45Å; E236-I270 HydrophobicContact CG-CG2 4.28Å; E236-I270 VanDerWaalsContact O-CG2 3.23Å; E236-I270 WeakPolarHBondContact O-CG2 3.33Å
237	G	98.2	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	51.1	178.5	0	0	0	0	0	111.9	K256 C257 R259 F271	G237-K256 WeakPolarHBondContact O-CA 3.44Å; G237-C257 CarbonylContact C-O 3.59Å; G237-C257 WeakPolarHBondContact CA-O 3.43Å; G237-C257 PolarHBondContact O-N 3.12Å; G237-R259 PolarHBondContact O-NE 2.74Å; G237-F271 WeakPolarHBondContact CA-O 3.18Å; G237-F271 PolarHBondContact N-O 2.86Å
238	R	98.6	Very high	97.3	Very high	47 Å²	47	32.8 Å²	32.8	18%	0.177	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	138.6	-174.9	-168.4	-179.5	-58.8	-82.1	-1.6	111	L209 S234 E236 F255	L209-R238 HydrophobicContact CD2-CB 4.27Å; L209-R238 HydrophobicContact CD2-CG 3.74Å; S234-R238 PolarHBondContact N-O 2.99Å; S234-R238 PolarHBondContact OG-O 3.2Å; E236-R238 VanDerWaalsContact C-N 3.32Å; E236-R238 PolarHBondContact O-N 2.8Å; E236-R238 IonicContact OE1-NE 3.18Å; E236-R238 IonicContact OE1-NH2 2.97Å; E236-R238 PolarHBondContact OE1-NH2 3.16Å; E236-R238 IonicContact OE2-NE 3.96Å; E236-R238 PolarHBondContact OE2-NE 3.03Å; E236-R238 IonicContact OE2-NH2 3.18Å; R238-F255 WeakPolarHBondContact CA-O 3.34Å; R238-F255 VanDerWaalsContact CG-O 3.31Å; R238-F255 WeakPolarHBondContact CG-O 3.34Å
239	V	98.9	Very high	97.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.6	172	172.5	0	0	0	0	109.8	A231 L232 I241 T254 F255 V273 M276 L285 T287	A231-V239 HydrophobicContact CB-CG1 4.12Å; L232-V239 CarbonylContact O-C 3.55Å; L232-V239 WeakPolarHBondContact O-CA 3.34Å; V239-I241 HydrophobicContact CG1-CD1 4.25Å; V239-T254 CarbonylContact O-C 3.58Å; V239-T254 VanDerWaalsContact O-CA 3.22Å; V239-T254 WeakPolarHBondContact O-CA 3.35Å; V239-T254 WeakPolarHBondContact O-CB 3.16Å; V239-F255 HydrophobicContact CB-CD1 4.28Å; V239-F255 HydrophobicContact CB-CE1 3.65Å; V239-F255 HydrophobicContact CB-CE2 3.96Å; V239-F255 HydrophobicContact CB-CZ 3.47Å; V239-F255 VanDerWaalsContact CB-CZ 3.47Å; V239-F255 HydrophobicContact CG1-CD1 4.46Å; V239-F255 HydrophobicContact CG1-CE1 3.54Å; V239-F255 HydrophobicContact CG1-CZ 3.6Å; V239-F255 HydrophobicContact CG2-CE2 4.4Å; V239-F255 HydrophobicContact CG2-CZ 4.13Å; V239-F255 PolarHBondContact N-O 3.48Å; V239-F255 PolarHBondContact O-N 3.22Å; V239-V273 HydrophobicContact CG2-CG1 4.15Å; V239-V273 HydrophobicContact CG2-CG2 4.14Å; V239-M276 HydrophobicContact CB-CE 4.48Å; V239-M276 HydrophobicContact CG1-CE 4.01Å; V239-M276 HydrophobicContact CG2-CE 3.67Å; V239-L285 HydrophobicContact CG1-CD2 4.32Å; V239-T287 HydrophobicContact CG2-CG2 4.12Å
240	A	98.8	Very high	97	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.3	168.6	0	0	0	0	0	110.4	P208 L209 A231 L232 F253 T254	P208-A240 HydrophobicContact CB-CB 4.2Å; P208-A240 HydrophobicContact CG-CB 3.35Å; L209-A240 HydrophobicContact CD1-CB 4.37Å; L209-A240 HydrophobicContact CD2-CB 3.86Å; L209-A240 HydrophobicContact CG-CB 4.02Å; A231-A240 CarbonylContact C-O 3.37Å; A231-A240 VanDerWaalsContact CA-O 3.23Å; A231-A240 WeakPolarHBondContact CA-O 3.49Å; L232-A240 HydrophobicContact CB-CB 4.46Å; L232-A240 PolarHBondContact N-O 3.42Å; L232-A240 PolarHBondContact O-N 2.95Å; A240-F253 WeakPolarHBondContact CA-O 3.25Å; A240-T254 HydrophobicContact CB-CG2 3.83Å
241	I	98.7	Very high	96.9	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.1	167.9	-57.5	-56.6	0	0	0	107.2	F219 A231 V239 Y243 N252 F253 F255 L285 K299	F219-I241 HydrophobicContact CE1-CG2 3.88Å; F219-I241 HydrophobicContact CZ-CG2 4.03Å; A231-I241 HydrophobicContact CB-CD1 3.79Å; V239-I241 HydrophobicContact CG1-CD1 4.25Å; I241-Y243 HydrophobicContact CG2-CD2 4.35Å; I241-Y243 HydrophobicContact CG2-CE2 3.8Å; I241-N252 WeakPolarHBondContact O-CA 3.37Å; I241-F253 HydrophobicContact CB-CD1 4.05Å; I241-F253 HydrophobicContact CB-CE1 3.68Å; I241-F253 HydrophobicContact CB-CE2 4.47Å; I241-F253 HydrophobicContact CB-CZ 3.91Å; I241-F253 HydrophobicContact CG1-CE1 3.88Å; I241-F253 HydrophobicContact CG1-CE2 3.97Å; I241-F253 HydrophobicContact CG1-CZ 3.55Å; I241-F253 HydrophobicContact CG2-CD1 4.46Å; I241-F253 HydrophobicContact CG2-CE1 3.86Å; I241-F253 HydrophobicContact CG2-CZ 4.35Å; I241-F253 PolarHBondContact N-O 2.87Å; I241-F253 PolarHBondContact O-N 2.89Å; I241-F253 VanDerWaalsContact O-N 3.15Å; I241-F255 HydrophobicContact CD1-CE1 4.14Å; I241-F255 HydrophobicContact CG1-CE1 4.06Å; I241-L285 HydrophobicContact CD1-CD2 4.44Å; I241-K299 HydrophobicContact CD1-CB 4.22Å; I241-K299 HydrophobicContact CD1-CD 4.5Å; I241-K299 HydrophobicContact CG1-CB 4.22Å; I241-K299 HydrophobicContact CG2-CD 4.1Å
242	Q	98.2	Very high	96.8	Very high	30 Å²	30	49 Å²	49	14%	0.14	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	119.5	-179.4	-64	-63.1	-66.7	0	0	109.9	P208 G229 F230 N252	P208-Q242 HydrophobicContact CG-CG 3.83Å; G229-Q242 CarbonylContact C-O 3.5Å; G229-Q242 WeakPolarHBondContact CA-O 3.29Å; F230-Q242 HydrophobicContact CD1-CB 4.21Å; F230-Q242 HydrophobicContact CD2-CB 4.18Å; F230-Q242 HydrophobicContact CE1-CB 3.73Å; F230-Q242 HydrophobicContact CE2-CB 3.7Å; F230-Q242 HydrophobicContact CE2-CG 3.81Å; F230-Q242 HydrophobicContact CG-CB 4.43Å; F230-Q242 HydrophobicContact CZ-CB 3.45Å; F230-Q242 VanDerWaalsContact CZ-CB 3.45Å; F230-Q242 HydrophobicContact CZ-CG 3.81Å; F230-Q242 PolarHBondContact N-O 2.91Å; F230-Q242 PolarHBondContact O-N 3.27Å; Q242-N252 WeakPolarHBondContact CA-OD1 3.46Å; Q242-N252 PolarHBondContact OE1-ND2 2.94Å
243	Y	97	Very high	96.8	Very high	54 Å²	54	50.5 Å²	50.5	21%	0.212	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.8	169.9	-68.2	-98	0	0	0	109.3	F219 I241 D251 N252 D300	F219-Y243 AromaticContact CE2-CD1 3.79Å; F219-Y243 HydrophobicContact CE2-CD1 3.79Å; F219-Y243 AromaticContact CE2-CE1 3.56Å; F219-Y243 HydrophobicContact CE2-CE1 3.56Å; F219-Y243 HydrophobicContact CE2-CG 4.47Å; F219-Y243 AromaticContact CZ-CD1 3.92Å; F219-Y243 HydrophobicContact CZ-CD1 3.92Å; F219-Y243 HydrophobicContact CZ-CD2 4.28Å; F219-Y243 AromaticContact CZ-CE1 3.85Å; F219-Y243 HydrophobicContact CZ-CE1 3.85Å; F219-Y243 HydrophobicContact CZ-CE2 4.18Å; F219-Y243 HydrophobicContact CZ-CG 4.15Å; F219-Y243 AromaticContact CZ-CZ 3.98Å; I241-Y243 HydrophobicContact CG2-CD2 4.35Å; I241-Y243 HydrophobicContact CG2-CE2 3.8Å; Y243-D251 HydrophobicContact CD2-CB 4.01Å; Y243-D251 WeakPolarHBondContact CD2-O 3.48Å; Y243-D251 HydrophobicContact CE2-CB 4.35Å; Y243-D251 VanDerWaalsContact CE2-O 3.29Å; Y243-D251 WeakPolarHBondContact CE2-O 3.4Å; Y243-N252 PolarHBondContact N-OD1 2.9Å; Y243-D300 PolarHBondContact OH-OD1 3.05Å
244	L	95	Very high	96.8	Very high	44 Å²	44	53.4 Å²	53.4	23%	0.23	29%	0.285	C	S	.	.	S	Bend	trans	-69.2	-37.9	175.9	-68.2	175.3	0	0	0	111.5	L180 V192 S228 F230	L180-L244 HydrophobicContact CD1-CD1 3.9Å; L180-L244 HydrophobicContact CD2-CD1 3.74Å; L180-L244 HydrophobicContact CG-CD1 4.48Å; V192-L244 HydrophobicContact CG1-CD2 4.11Å; S228-L244 PolarHBondContact O-N 2.84Å; F230-L244 HydrophobicContact CD1-CD2 4.5Å; F230-L244 HydrophobicContact CE1-CD2 4.41Å
245	N	93.6	Very high	96.8	Very high	146 Å²	146	55.1 Å²	55.1	78%	0.781	29%	0.293	S	S	*	.	S	Bend	trans	-128.2	72.6	179	-62.4	-58.5	0	0	0	109.6
246	P	93.6	Very high	96.7	Very high	54 Å²	54	58.3 Å²	58.3	35%	0.351	31%	0.305	S	S	.	.			trans	-66.4	140.2	179	29.1	-33.5	0	0	0	110.2	D251	P246-D251 HydrophobicContact CB-CB 3.99Å
247	T	94.3	Very high	96.7	Very high	133 Å²	133	57.1 Å²	57.1	82%	0.816	30%	0.3	S	S	*	.	S	Bend	trans	-78.2	-33.5	173.9	-53.5	0	0	0	0	110.4	D251	T247-D251 WeakPolarHBondContact CA-OD2 3.3Å; T247-D251 PolarHBondContact N-OD2 2.87Å
248	T	94.9	Very high	96.6	Very high	59 Å²	59	57.5 Å²	57.5	36%	0.362	30%	0.301	S	S	.	.	S	Bend	trans	-134.5	152.9	175.7	82.8	0	0	0	0	111.3	K250 D251	T248-K250 PolarHBondContact O-N 2.78Å; T248-K250 PolarHBondContact OG1-N 3.26Å; T248-D251 PolarHBondContact N-OD2 2.81Å; T248-D251 VanDerWaalsContact O-CB 3.32Å; T248-D251 WeakPolarHBondContact O-CB 3.24Å; T248-D251 PolarHBondContact O-N 3.13Å; T248-D251 PolarHBondContact OG1-OD1 3.15Å
249	P	92.7	Very high	96.4	Very high	121 Å²	121	57.6 Å²	57.6	79%	0.786	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-57.3	-22.3	174.6	-26.6	35.1	0	0	0	114.4	D251	P249-D251 VanDerWaalsContact C-N 3.29Å; P249-D251 PolarHBondContact O-N 2.79Å
250	K	94.4	Very high	96.1	Very high	165 Å²	165	58.6 Å²	58.6	72%	0.717	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-76.7	-15	179.4	-65.3	-178.1	-179.1	177.3	0	113.1	T248 N252 R302	T248-K250 PolarHBondContact O-N 2.78Å; T248-K250 PolarHBondContact OG1-N 3.26Å; K250-N252 PolarHBondContact O-N 3.04Å; K250-R302 PolarHBondContact O-NH2 3.38Å
251	D	95.9	Very high	95.4	Very high	41 Å²	41	66.4 Å²	66.4	22%	0.219	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-65.6	-33	178.6	-58.8	-10	0	0	0	110.2	Y243 P246 T247 T248 P249 F253	Y243-D251 HydrophobicContact CD2-CB 4.01Å; Y243-D251 WeakPolarHBondContact CD2-O 3.48Å; Y243-D251 HydrophobicContact CE2-CB 4.35Å; Y243-D251 VanDerWaalsContact CE2-O 3.29Å; Y243-D251 WeakPolarHBondContact CE2-O 3.4Å; P246-D251 HydrophobicContact CB-CB 3.99Å; T247-D251 WeakPolarHBondContact CA-OD2 3.3Å; T247-D251 PolarHBondContact N-OD2 2.87Å; T248-D251 PolarHBondContact N-OD2 2.81Å; T248-D251 VanDerWaalsContact O-CB 3.32Å; T248-D251 WeakPolarHBondContact O-CB 3.24Å; T248-D251 PolarHBondContact O-N 3.13Å; T248-D251 PolarHBondContact OG1-OD1 3.15Å; P249-D251 VanDerWaalsContact C-N 3.29Å; P249-D251 PolarHBondContact O-N 2.79Å; D251-F253 WeakPolarHBondContact O-CD1 3.28Å
252	N	97.9	Very high	94.8	Very high	43 Å²	43	69.3 Å²	69.3	23%	0.23	38%	0.375	C	S	.	.	S	Bend	trans	-84.2	125.7	171.7	-69.1	-8.7	0	0	0	109.5	I241 Q242 Y243 K250	I241-N252 WeakPolarHBondContact O-CA 3.37Å; Q242-N252 WeakPolarHBondContact CA-OD1 3.46Å; Q242-N252 PolarHBondContact OE1-ND2 2.94Å; Y243-N252 PolarHBondContact N-OD1 2.9Å; K250-N252 PolarHBondContact O-N 3.04Å
253	F	98.3	Very high	94.3	Very high	31 Å²	31	71.4 Å²	71.4	14%	0.136	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	170.9	-178.7	68.7	-83.4	0	0	0	111.9	A240 I241 D251 F255 K299 R302	A240-F253 WeakPolarHBondContact CA-O 3.25Å; I241-F253 HydrophobicContact CB-CD1 4.05Å; I241-F253 HydrophobicContact CB-CE1 3.68Å; I241-F253 HydrophobicContact CB-CE2 4.47Å; I241-F253 HydrophobicContact CB-CZ 3.91Å; I241-F253 HydrophobicContact CG1-CE1 3.88Å; I241-F253 HydrophobicContact CG1-CE2 3.97Å; I241-F253 HydrophobicContact CG1-CZ 3.55Å; I241-F253 HydrophobicContact CG2-CD1 4.46Å; I241-F253 HydrophobicContact CG2-CE1 3.86Å; I241-F253 HydrophobicContact CG2-CZ 4.35Å; I241-F253 PolarHBondContact N-O 2.87Å; I241-F253 PolarHBondContact O-N 2.89Å; I241-F253 VanDerWaalsContact O-N 3.15Å; D251-F253 WeakPolarHBondContact O-CD1 3.28Å; F253-F255 HydrophobicContact CD2-CD1 4.44Å; F253-F255 AromaticContact CE2-CD1 3.91Å; F253-F255 HydrophobicContact CE2-CD1 3.91Å; F253-K299 HydrophobicContact CZ-CB 4.32Å; F253-K299 WeakPolarHBondContact CZ-O 3.44Å; F253-R302 HydrophobicContact CE1-CG 4.37Å; F253-R302 HydrophobicContact CE2-CG 4.18Å; F253-R302 HydrophobicContact CZ-CG 3.95Å
254	T	98.6	Very high	93.8	Very high	61 Å²	61	71.9 Å²	71.9	37%	0.374	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.1	171.9	74.3	0	0	0	0	110.2	L209 V239 A240	L209-T254 HydrophobicContact CD2-CG2 4.19Å; V239-T254 CarbonylContact O-C 3.58Å; V239-T254 VanDerWaalsContact O-CA 3.22Å; V239-T254 WeakPolarHBondContact O-CA 3.35Å; V239-T254 WeakPolarHBondContact O-CB 3.16Å; A240-T254 HydrophobicContact CB-CG2 3.83Å
255	F	98.5	Very high	93.5	Very high	35 Å²	35	77.1 Å²	77.1	15%	0.154	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	150.5	173.7	63.5	-86.8	0	0	0	110.9	R238 V239 I241 F253 C257 L285 W297	R238-F255 WeakPolarHBondContact CA-O 3.34Å; R238-F255 VanDerWaalsContact CG-O 3.31Å; R238-F255 WeakPolarHBondContact CG-O 3.34Å; V239-F255 HydrophobicContact CB-CD1 4.28Å; V239-F255 HydrophobicContact CB-CE1 3.65Å; V239-F255 HydrophobicContact CB-CE2 3.96Å; V239-F255 HydrophobicContact CB-CZ 3.47Å; V239-F255 VanDerWaalsContact CB-CZ 3.47Å; V239-F255 HydrophobicContact CG1-CD1 4.46Å; V239-F255 HydrophobicContact CG1-CE1 3.54Å; V239-F255 HydrophobicContact CG1-CZ 3.6Å; V239-F255 HydrophobicContact CG2-CE2 4.4Å; V239-F255 HydrophobicContact CG2-CZ 4.13Å; V239-F255 PolarHBondContact N-O 3.48Å; V239-F255 PolarHBondContact O-N 3.22Å; I241-F255 HydrophobicContact CD1-CE1 4.14Å; I241-F255 HydrophobicContact CG1-CE1 4.06Å; F253-F255 HydrophobicContact CD2-CD1 4.44Å; F253-F255 AromaticContact CE2-CD1 3.91Å; F253-F255 HydrophobicContact CE2-CD1 3.91Å; F255-C257 HydrophobicContact CD2-CB 4.37Å; F255-C257 HydrophobicContact CE2-CB 4.21Å; F255-L285 HydrophobicContact CZ-CD2 4.19Å; F255-W297 HydrophobicContact CD2-CD2 4.34Å; F255-W297 HydrophobicContact CD2-CE3 4.01Å; F255-W297 HydrophobicContact CD2-CH2 4.16Å; F255-W297 AromaticContact CD2-CZ3 3.9Å; F255-W297 HydrophobicContact CD2-CZ3 3.9Å; F255-W297 AromaticContact CE2-CD2 3.63Å; F255-W297 HydrophobicContact CE2-CD2 3.63Å; F255-W297 AromaticContact CE2-CE2 3.75Å; F255-W297 AromaticContact CE2-CE3 3.76Å; F255-W297 HydrophobicContact CE2-CE3 3.76Å; F255-W297 HydrophobicContact CE2-CG 4.14Å; F255-W297 HydrophobicContact CE2-CH2 4.12Å; F255-W297 HydrophobicContact CE2-CZ2 4.02Å; F255-W297 AromaticContact CE2-CZ3 4Å; F255-W297 HydrophobicContact CE2-CZ3 4Å; F255-W297 HydrophobicContact CZ-CD2 4.22Å; F255-W297 HydrophobicContact CZ-CG 4.27Å
256	K	97.7	Very high	93.5	Very high	129 Å²	129	73.4 Å²	73.4	56%	0.561	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	140.6	176.2	-64.2	176.4	-178	174.9	0	109.4	G237	G237-K256 WeakPolarHBondContact O-CA 3.44Å
257	C	97.4	Very high	93.3	Very high	7 Å²	7	79.8 Å²	79.8	5%	0.047	44%	0.442	C	S	.	.			trans	-151.6	167.2	177	53.7	0	0	0	0	109.3	G237 F255 R259 W297	G237-C257 CarbonylContact C-O 3.59Å; G237-C257 WeakPolarHBondContact CA-O 3.43Å; G237-C257 PolarHBondContact O-N 3.12Å; F255-C257 HydrophobicContact CD2-CB 4.37Å; F255-C257 HydrophobicContact CE2-CB 4.21Å; C257-R259 WeakPolarHBondContact O-CG 3.47Å; C257-R259 PolarHBondContact O-N 2.73Å; C257-W297 HydrophobicContact CB-CH2 3.77Å; C257-W297 HydrophobicContact CB-CZ2 3.44Å; C257-W297 VanDerWaalsContact CB-CZ2 3.44Å
258	H	96.6	Very high	93.2	Very high	7 Å²	7	78.4 Å²	78.4	3%	0.032	43%	0.426	C	S	.	.	S	Bend	trans	49.9	59.3	177.5	-55.6	-73.5	0	0	0	113.2	F271 T287 G289 D291 C293	H258-F271 HydrophobicContact CB-CB 4.22Å; H258-F271 WeakPolarHBondContact O-CB 3.39Å; H258-F271 PolarHBondContact O-N 3.33Å; H258-T287 VanDerWaalsContact NE2-CB 3.34Å; H258-T287 WeakPolarHBondContact NE2-CB 3.21Å; H258-T287 PolarHBondContact NE2-OG1 3.44Å; H258-G289 PolarHBondContact CE1-N 3.27Å; H258-G289 VanDerWaalsContact CE1-N 3.34Å; H258-D291 VanDerWaalsContact CA-OD2 3.28Å; H258-D291 WeakPolarHBondContact CA-OD2 3.19Å; H258-D291 IonicContact CE1-OD1 3.52Å; H258-D291 IonicContact CG-OD1 3.27Å; H258-D291 IonicContact CG-OD2 2.8Å; H258-D291 IonicContact ND1-OD1 3.92Å; H258-D291 PolarHBondContact ND1-OD1 3.03Å; H258-D291 IonicContact ND1-OD2 3.16Å; H258-D291 PolarHBondContact ND1-OD2 2.9Å; H258-C293 PolarHBondContact CE1-O 2.7Å
259	R	94.4	Very high	93.1	Very high	50 Å²	50	79.7 Å²	79.7	19%	0.189	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-134	150.6	177.7	-63.2	-178.7	-178.4	-130.4	-8.1	108.6	E236 G237 C257 N261 E269 I270	E236-R259 PolarHBondContact O-NH2 3.19Å; E236-R259 IonicContact OE1-CZ 2.73Å; E236-R259 IonicContact OE1-NH2 2.74Å; E236-R259 PolarHBondContact OE1-NH2 3.45Å; G237-R259 PolarHBondContact O-NE 2.74Å; C257-R259 WeakPolarHBondContact O-CG 3.47Å; C257-R259 PolarHBondContact O-N 2.73Å; R259-N261 PolarHBondContact O-N 3.18Å; R259-E269 CarbonylContact C-O 3.58Å; R259-E269 VanDerWaalsContact CA-O 3.24Å; R259-E269 WeakPolarHBondContact CA-O 3.41Å; R259-I270 HydrophobicContact CG-CG1 4.27Å; R259-I270 HydrophobicContact CG-CG2 4.47Å
260	S	91	Very high	93.3	Very high	21 Å²	21	77.5 Å²	77.5	15%	0.147	41%	0.409	C	S	.	.			trans	-61.8	134.4	176.9	68.6	0	0	0	0	111	A262 H268 E269	S260-A262 VanDerWaalsContact C-N 3.28Å; S260-A262 VanDerWaalsContact CB-O 3.3Å; S260-A262 WeakPolarHBondContact CB-O 3.37Å; S260-A262 PolarHBondContact O-N 3.16Å; S260-A262 PolarHBondContact OG-O 2.92Å; S260-H268 PolarHBondContact O-ND1 2.84Å; S260-H268 WeakPolarHBondContact OG-CA 3.49Å; S260-E269 PolarHBondContact N-O 3.3Å; S260-E269 PolarHBondContact OG-N 2.93Å
261	N	84.4	Confident	93.5	Very high	163 Å²	163	71.2 Å²	71.2	87%	0.872	38%	0.381	S	S	*	.	S	Bend	trans	-61.7	-39.9	177.9	-72.9	-22.4	0	0	0	111.5	R259	R259-N261 PolarHBondContact O-N 3.18Å
262	A	86.2	Confident	93.6	Very high	62 Å²	62	69.8 Å²	69.8	51%	0.512	38%	0.375	S	S	.	.	S	Bend	trans	-112.1	150.1	175.9	0	0	0	0	0	110.9	S260	S260-A262 VanDerWaalsContact C-N 3.28Å; S260-A262 VanDerWaalsContact CB-O 3.3Å; S260-A262 WeakPolarHBondContact CB-O 3.37Å; S260-A262 PolarHBondContact O-N 3.16Å; S260-A262 PolarHBondContact OG-O 2.92Å
263	P	88.6	Confident	93.6	Very high	73 Å²	73	67.7 Å²	67.7	47%	0.474	36%	0.364	S	S	.	.			trans	-61.9	135.9	169.5	-17.5	29.7	0	0	0	111	Y267	P263-Y267 CarbonylContact C-O 3.54Å; P263-Y267 VanDerWaalsContact CA-O 3.3Å; P263-Y267 WeakPolarHBondContact CA-O 3.44Å
264	V	85.3	Confident	93.7	Very high	65 Å²	65	66.9 Å²	66.9	39%	0.394	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-102.8	121.1	167.9	-177.5	0	0	0	0	106.7	G266 Y267 E269	V264-G266 PolarHBondContact O-N 2.96Å; V264-G266 VanDerWaalsContact O-N 3.16Å; V264-Y267 PolarHBondContact N-O 2.69Å; V264-Y267 PolarHBondContact O-N 2.91Å; V264-Y267 VanDerWaalsContact O-O 3.1Å; V264-E269 HydrophobicContact CB-CG 4.2Å; V264-E269 HydrophobicContact CG2-CG 4.16Å
265	N	90.4	Very high	93.7	Very high	154 Å²	154	65.4 Å²	65.4	82%	0.824	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	36.8	-175.6	-58.7	-32.4	0	0	0	113.7	Y267	N265-Y267 VanDerWaalsContact C-N 3.34Å; N265-Y267 VanDerWaalsContact O-CD2 3.29Å; N265-Y267 WeakPolarHBondContact O-CD2 3.41Å; N265-Y267 PolarHBondContact O-N 3.48Å
266	G	91.6	Very high	93.7	Very high	67 Å²	67	64 Å²	64	69%	0.691	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-1.2	179.2	0	0	0	0	0	115.5	V264	V264-G266 PolarHBondContact O-N 2.96Å; V264-G266 VanDerWaalsContact O-N 3.16Å
267	Y	90.6	Very high	93.7	Very high	188 Å²	188	58.6 Å²	58.6	74%	0.737	32%	0.324	S	S	*	.	B	Isolated β-bridge	trans	-122	140.7	179.1	-60	-82.1	0	0	0	111.6	P263 V264 N265 E269	P263-Y267 CarbonylContact C-O 3.54Å; P263-Y267 VanDerWaalsContact CA-O 3.3Å; P263-Y267 WeakPolarHBondContact CA-O 3.44Å; V264-Y267 PolarHBondContact N-O 2.69Å; V264-Y267 PolarHBondContact O-N 2.91Å; V264-Y267 VanDerWaalsContact O-O 3.1Å; N265-Y267 VanDerWaalsContact C-N 3.34Å; N265-Y267 VanDerWaalsContact O-CD2 3.29Å; N265-Y267 WeakPolarHBondContact O-CD2 3.41Å; N265-Y267 PolarHBondContact O-N 3.48Å; Y267-E269 PolarHBondContact O-N 3.1Å
268	H	91.8	Very high	93.8	Very high	104 Å²	104	59.6 Å²	59.6	48%	0.481	33%	0.328	S	S	.	.			trans	-74.4	124.6	166.9	-74.1	-84.6	0	0	0	109.2	S260	S260-H268 PolarHBondContact O-ND1 2.84Å; S260-H268 WeakPolarHBondContact OG-CA 3.49Å
269	E	93.9	Very high	93.8	Very high	86 Å²	86	59.4 Å²	59.4	40%	0.402	33%	0.327	S	S	.	.			trans	-70.2	139.5	171.2	-61.3	-172.7	129.3	0	0	109.2	R259 S260 V264 Y267 F271	R259-E269 CarbonylContact C-O 3.58Å; R259-E269 VanDerWaalsContact CA-O 3.24Å; R259-E269 WeakPolarHBondContact CA-O 3.41Å; S260-E269 PolarHBondContact N-O 3.3Å; S260-E269 PolarHBondContact OG-N 2.93Å; V264-E269 HydrophobicContact CB-CG 4.2Å; V264-E269 HydrophobicContact CG2-CG 4.16Å; Y267-E269 PolarHBondContact O-N 3.1Å; E269-F271 HydrophobicContact CB-CD2 4.44Å; E269-F271 HydrophobicContact CB-CE2 3.52Å; E269-F271 HydrophobicContact CB-CZ 3.73Å
270	I	96.5	Very high	93.8	Very high	76 Å²	76	59.8 Å²	59.8	39%	0.39	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-121.4	128.4	-177.4	-59.3	174.5	0	0	0	107.7	E236 R259	E236-I270 HydrophobicContact CG-CG2 4.28Å; E236-I270 VanDerWaalsContact O-CG2 3.23Å; E236-I270 WeakPolarHBondContact O-CG2 3.33Å; R259-I270 HydrophobicContact CG-CG1 4.27Å; R259-I270 HydrophobicContact CG-CG2 4.47Å
271	F	97.2	Very high	94	Very high	33 Å²	33	61.6 Å²	61.6	15%	0.145	35%	0.346	C	S	.	.			trans	-116.7	153.9	-174.5	-61.1	-91.1	0	0	0	110.7	G237 H258 E269 D291	G237-F271 WeakPolarHBondContact CA-O 3.18Å; G237-F271 PolarHBondContact N-O 2.86Å; H258-F271 HydrophobicContact CB-CB 4.22Å; H258-F271 WeakPolarHBondContact O-CB 3.39Å; H258-F271 PolarHBondContact O-N 3.33Å; E269-F271 HydrophobicContact CB-CD2 4.44Å; E269-F271 HydrophobicContact CB-CE2 3.52Å; E269-F271 HydrophobicContact CB-CZ 3.73Å; F271-D291 HydrophobicContact CB-CB 3.97Å; F271-D291 HydrophobicContact CD1-CB 4.08Å; F271-D291 HydrophobicContact CD2-CB 3.63Å; F271-D291 HydrophobicContact CE1-CB 4.49Å; F271-D291 HydrophobicContact CE2-CB 4.08Å; F271-D291 HydrophobicContact CG-CB 3.62Å; F271-D291 HydrophobicContact CZ-CB 4.49Å
272	A	98.6	Very high	94.5	Very high	10 Å²	10	56.3 Å²	56.3	8%	0.083	32%	0.315	C	S	.	.			trans	-71.4	146	178.3	0	0	0	0	0	111	I235 N274 G289 S290	I235-A272 HydrophobicContact CB-CB 4.19Å; I235-A272 HydrophobicContact CG2-CB 4.25Å; A272-N274 PolarHBondContact O-N 2.94Å; A272-G289 CarbonylContact O-C 3.53Å; A272-G289 WeakPolarHBondContact O-CA 3.32Å; A272-S290 WeakPolarHBondContact CB-OG 3.44Å; A272-S290 PolarHBondContact N-OG 2.72Å; A272-S290 PolarHBondContact O-N 2.96Å
273	V	98.8	Very high	95	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	106.5	164.7	-169.1	0	0	0	0	106.9	R214 C215 S234 V239 M276	R214-V273 WeakPolarHBondContact CB-O 3.44Å; R214-V273 VanDerWaalsContact CD-O 3.29Å; R214-V273 WeakPolarHBondContact CD-O 3.49Å; R214-V273 WeakPolarHBondContact CG-O 3.37Å; C215-V273 PolarHBondContact SG-O 2.95Å; S234-V273 PolarHBondContact O-N 3.39Å; V239-V273 HydrophobicContact CG2-CG1 4.15Å; V239-V273 HydrophobicContact CG2-CG2 4.14Å; V273-M276 HydrophobicContact CG1-CE 4.17Å
274	N	98.8	Very high	95.4	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.07	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-43.3	-173.8	-81	-30.5	0	0	0	112	R214 A272 V288 L315 D334	R214-N274 PolarHBondContact NE-OD1 2.85Å; R214-N274 PolarHBondContact NH2-OD1 3.3Å; A272-N274 PolarHBondContact O-N 2.94Å; N274-V288 HydrophobicContact CB-CG2 4.47Å; N274-V288 PolarHBondContact N-O 3.01Å; N274-L315 VanDerWaalsContact CB-O 3.25Å; N274-L315 WeakPolarHBondContact CB-O 3.37Å; N274-L315 PolarHBondContact ND2-O 2.83Å; N274-D334 PolarHBondContact ND2-OD2 3.36Å; N274-D334 PolarHBondContact OD1-OD2 3.13Å
275	D	98.8	Very high	96	Very high	31 Å²	31	48.1 Å²	48.1	17%	0.166	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	165	-178.1	-160	13.5	0	0	0	111.3	V288 C317 C318	D275-V288 HydrophobicContact CB-CG2 3.65Å; D275-V288 PolarHBondContact N-O 2.91Å; D275-V288 PolarHBondContact O-N 2.73Å; D275-C317 HydrophobicContact CB-CB 4.43Å; D275-C317 WeakPolarHBondContact OD2-CA 3.18Å; D275-C317 WeakPolarHBondContact OD2-CB 3.41Å; D275-C318 PolarHBondContact OD2-N 3.05Å
276	M	98.6	Very high	96.4	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	148.7	-180	58.1	175.4	57.8	0	0	111.6	C215 A231 G233 V239 V273 L285 A286 T287	C215-M276 HydrophobicContact CB-CG 4.32Å; A231-M276 HydrophobicContact CB-CE 4.38Å; A231-M276 HydrophobicContact CB-SD 3.53Å; A231-M276 VanDerWaalsContact CB-SD 3.53Å; G233-M276 VanDerWaalsContact CA-CE 3.48Å; V239-M276 HydrophobicContact CB-CE 4.48Å; V239-M276 HydrophobicContact CG1-CE 4.01Å; V239-M276 HydrophobicContact CG2-CE 3.67Å; V273-M276 HydrophobicContact CG1-CE 4.17Å; M276-L285 HydrophobicContact CB-CD1 4.06Å; M276-A286 VanDerWaalsContact CA-O 3.23Å; M276-A286 WeakPolarHBondContact CA-O 3.34Å; M276-A286 WeakPolarHBondContact CB-O 3.27Å; M276-T287 HydrophobicContact CB-CG2 4.37Å
277	A	98.6	Very high	96.8	Very high	14 Å²	14	37.6 Å²	37.6	12%	0.116	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	139.3	177.4	0	0	0	0	0	110.8	L285 A286 F320	A277-L285 WeakPolarHBondContact O-CD1 3.38Å; A277-A286 PolarHBondContact N-O 3.26Å; A277-A286 PolarHBondContact O-N 2.99Å; A277-F320 HydrophobicContact CB-CD2 3.82Å; A277-F320 HydrophobicContact CB-CE2 3.87Å; A277-F320 WeakPolarHBondContact O-CE2 3.33Å
278	F	98.4	Very high	97.2	Very high	29 Å²	29	28.6 Å²	28.6	13%	0.127	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	140.7	169.9	-79.7	-82.4	0	0	0	111.1	S217 I218 F219 A231 G283 T284 L285 K299 F320	S217-F278 WeakPolarHBondContact OG-CD2 3.47Å; I218-F278 WeakPolarHBondContact O-CD2 3.4Å; F219-F278 HydrophobicContact CB-CD1 3.9Å; F219-F278 HydrophobicContact CB-CD2 3.8Å; F219-F278 HydrophobicContact CB-CE1 3.74Å; F219-F278 HydrophobicContact CB-CE2 3.65Å; F219-F278 HydrophobicContact CB-CG 3.94Å; F219-F278 HydrophobicContact CB-CZ 3.62Å; F219-F278 HydrophobicContact CD1-CE1 4.22Å; F219-F278 AromaticContact CD1-CE2 3.79Å; F219-F278 HydrophobicContact CD1-CE2 3.79Å; F219-F278 AromaticContact CD1-CZ 3.48Å; F219-F278 HydrophobicContact CD1-CZ 3.48Å; F219-F278 VanDerWaalsContact CD1-CZ 3.48Å; F219-F278 HydrophobicContact CE1-CZ 4.48Å; F219-F278 HydrophobicContact CG-CE1 4.26Å; F219-F278 HydrophobicContact CG-CE2 4.21Å; F219-F278 AromaticContact CG-CZ 3.91Å; F219-F278 HydrophobicContact CG-CZ 3.91Å; A231-F278 HydrophobicContact CB-CE2 3.7Å; A231-F278 HydrophobicContact CB-CZ 3.81Å; F278-G283 WeakPolarHBondContact CD1-O 3.42Å; F278-T284 CarbonylContact C-O 3.54Å; F278-T284 WeakPolarHBondContact CA-O 3.27Å; F278-L285 HydrophobicContact CD1-CB 4.12Å; F278-L285 HydrophobicContact CD1-CD1 4.24Å; F278-L285 HydrophobicContact CD2-CD1 4.01Å; F278-L285 HydrophobicContact CE1-CB 3.83Å; F278-L285 HydrophobicContact CE1-CD1 4.09Å; F278-L285 HydrophobicContact CE1-CG 4.42Å; F278-L285 HydrophobicContact CE2-CD1 3.83Å; F278-L285 HydrophobicContact CG-CD1 4.2Å; F278-L285 HydrophobicContact CZ-CB 4.31Å; F278-L285 HydrophobicContact CZ-CD1 3.87Å; F278-L285 HydrophobicContact CZ-CD2 4.38Å; F278-L285 HydrophobicContact CZ-CG 4.42Å; F278-K299 HydrophobicContact CE1-CD 4.05Å; F278-K299 HydrophobicContact CE1-CG 4.46Å; F278-K299 HydrophobicContact CZ-CD 4.38Å; F278-F320 WeakPolarHBondContact O-CD2 3.41Å
279	H	97.6	Very high	97.4	Very high	3 Å²	3	23.7 Å²	23.7	1%	0.014	13%	0.133	C	C	.	.			trans	-68.5	123.2	173.8	-164.9	-81.2	0	0	0	110	V281 H282 G283 T284 F320 G324 M356 M359	H279-V281 PolarHBondContact ND1-N 3.2Å; H279-V281 VanDerWaalsContact ND1-N 3.15Å; H279-V281 PolarHBondContact O-N 3.29Å; H279-V281 VanDerWaalsContact O-N 3.13Å; H279-H282 HydrophobicContact CB-CB 4.23Å; H279-H282 AromaticContact CE1-CD2 3.3Å; H279-H282 PolarHBondContact CE1-CD2 2.81Å; H279-H282 AromaticContact CE1-NE2 3.87Å; H279-H282 AromaticContact ND1-CD2 3.46Å; H279-H282 PolarHBondContact ND1-CD2 2.93Å; H279-H282 AromaticContact ND1-CG 3.77Å; H279-H282 PolarHBondContact ND1-N 2.92Å; H279-H282 VanDerWaalsContact ND1-N 3.18Å; H279-H282 AromaticContact NE2-CD2 3.74Å; H279-H282 PolarHBondContact O-N 3.26Å; H279-G283 PolarHBondContact O-N 2.99Å; H279-T284 PolarHBondContact N-O 3.13Å; H279-F320 AromaticContact CD2-CE1 3.81Å; H279-G324 PolarHBondContact CE1-O 3.46Å; H279-G324 PolarHBondContact NE2-O 3.37Å; H279-M356 VanDerWaalsContact CE1-SD 3.57Å; H279-M359 HydrophobicContact CB-CE 3.7Å
280	P	94.7	Very high	97.6	Very high	57 Å²	57	20 Å²	20	37%	0.37	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.9	-173.8	24.7	-33.9	0	0	0	112.4	K224 P322	K224-P280 PolarHBondContact NZ-O 2.88Å; P280-P322 WeakPolarHBondContact CG-O 3.49Å
281	V	94.2	Very high	97.6	Very high	60 Å²	60	17.7 Å²	17.7	36%	0.364	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-39	179.3	-172.7	0	0	0	0	114.1	K224 H279 K323 M356	K224-V281 VanDerWaalsContact CE-O 3.27Å; K224-V281 WeakPolarHBondContact CE-O 3.35Å; K224-V281 PolarHBondContact NZ-O 3.46Å; H279-V281 PolarHBondContact ND1-N 3.2Å; H279-V281 VanDerWaalsContact ND1-N 3.15Å; H279-V281 PolarHBondContact O-N 3.29Å; H279-V281 VanDerWaalsContact O-N 3.13Å; V281-K323 WeakPolarHBondContact CG2-O 3.3Å; V281-M356 HydrophobicContact CB-CE 4.13Å; V281-M356 HydrophobicContact CG1-CE 3.97Å; V281-M356 HydrophobicContact CG2-CE 4.33Å
282	H	95.2	Very high	97.6	Very high	51 Å²	51	16.3 Å²	16.3	24%	0.236	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-18.9	-165.5	-66.3	-45.4	0	0	0	113.4	H279 T284 M356	H279-H282 HydrophobicContact CB-CB 4.23Å; H279-H282 AromaticContact CE1-CD2 3.3Å; H279-H282 PolarHBondContact CE1-CD2 2.81Å; H279-H282 AromaticContact CE1-NE2 3.87Å; H279-H282 AromaticContact ND1-CD2 3.46Å; H279-H282 PolarHBondContact ND1-CD2 2.93Å; H279-H282 AromaticContact ND1-CG 3.77Å; H279-H282 PolarHBondContact ND1-N 2.92Å; H279-H282 VanDerWaalsContact ND1-N 3.18Å; H279-H282 AromaticContact NE2-CD2 3.74Å; H279-H282 PolarHBondContact O-N 3.26Å; H282-T284 HydrophobicContact CB-CG2 4.33Å; H282-T284 WeakPolarHBondContact CB-OG1 3.38Å; H282-T284 PolarHBondContact O-N 3.05Å; H282-M356 WeakPolarHBondContact NE2-CE 3.21Å
283	G	96.3	Very high	97.4	Very high	27 Å²	27	17 Å²	17	28%	0.278	10%	0.104	S	C	.	.			trans	70.1	6.4	-173.2	0	0	0	0	0	114	F278 H279	F278-G283 WeakPolarHBondContact CD1-O 3.42Å; H279-G283 PolarHBondContact O-N 2.99Å
284	T	97.7	Very high	97.4	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.006	11%	0.106	C	C	.	.			trans	-75.9	159.9	169.2	44.6	0	0	0	0	110.3	F278 H279 H282 W297 D298 L305 M359 P361	F278-T284 CarbonylContact C-O 3.54Å; F278-T284 WeakPolarHBondContact CA-O 3.27Å; H279-T284 PolarHBondContact N-O 3.13Å; H282-T284 HydrophobicContact CB-CG2 4.33Å; H282-T284 WeakPolarHBondContact CB-OG1 3.38Å; H282-T284 PolarHBondContact O-N 3.05Å; T284-W297 CarbonylContact C-O 3.5Å; T284-W297 WeakPolarHBondContact CA-O 3.34Å; T284-W297 WeakPolarHBondContact CB-O 3.21Å; T284-D298 HydrophobicContact CG2-CB 4.25Å; T284-L305 HydrophobicContact CG2-CD1 3.72Å; T284-M359 WeakPolarHBondContact CG2-O 3.18Å; T284-M359 WeakPolarHBondContact OG1-CE 3.15Å; T284-M359 PolarHBondContact OG1-O 2.98Å; T284-P361 HydrophobicContact CG2-CG 3.79Å
285	L	98.6	Very high	97.3	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.8	-169.1	176.1	66	0	0	0	110.4	A231 V239 I241 F255 M276 A277 F278 T287 F296 W297	A231-L285 HydrophobicContact CB-CD1 4.49Å; A231-L285 HydrophobicContact CB-CD2 4.13Å; V239-L285 HydrophobicContact CG1-CD2 4.32Å; I241-L285 HydrophobicContact CD1-CD2 4.44Å; F255-L285 HydrophobicContact CZ-CD2 4.19Å; M276-L285 HydrophobicContact CB-CD1 4.06Å; A277-L285 WeakPolarHBondContact O-CD1 3.38Å; F278-L285 HydrophobicContact CD1-CB 4.12Å; F278-L285 HydrophobicContact CD1-CD1 4.24Å; F278-L285 HydrophobicContact CD2-CD1 4.01Å; F278-L285 HydrophobicContact CE1-CB 3.83Å; F278-L285 HydrophobicContact CE1-CD1 4.09Å; F278-L285 HydrophobicContact CE1-CG 4.42Å; F278-L285 HydrophobicContact CE2-CD1 3.83Å; F278-L285 HydrophobicContact CG-CD1 4.2Å; F278-L285 HydrophobicContact CZ-CB 4.31Å; F278-L285 HydrophobicContact CZ-CD1 3.87Å; F278-L285 HydrophobicContact CZ-CD2 4.38Å; F278-L285 HydrophobicContact CZ-CG 4.42Å; L285-T287 HydrophobicContact CD2-CG2 4.01Å; L285-T287 HydrophobicContact CG-CG2 4.08Å; L285-F296 CarbonylContact O-C 3.51Å; L285-F296 WeakPolarHBondContact O-CA 3.06Å; L285-W297 HydrophobicContact CB-CB 4.34Å; L285-W297 PolarHBondContact N-O 3.14Å; L285-W297 PolarHBondContact O-N 2.91Å
286	A	98.7	Very high	97.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141.3	161.1	0	0	0	0	0	110.7	M276 A277 S295 F296 F320 F327	M276-A286 VanDerWaalsContact CA-O 3.23Å; M276-A286 WeakPolarHBondContact CA-O 3.34Å; M276-A286 WeakPolarHBondContact CB-O 3.27Å; A277-A286 PolarHBondContact N-O 3.26Å; A277-A286 PolarHBondContact O-N 2.99Å; A286-S295 CarbonylContact C-O 3.56Å; A286-S295 WeakPolarHBondContact CA-O 3.29Å; A286-F296 HydrophobicContact CB-CD1 3.76Å; A286-F296 HydrophobicContact CB-CE1 3.84Å; A286-F320 HydrophobicContact CB-CE2 3.87Å; A286-F320 HydrophobicContact CB-CZ 3.63Å; A286-F327 HydrophobicContact CB-CD2 4.2Å; A286-F327 HydrophobicContact CB-CE2 3.55Å; A286-F327 HydrophobicContact CB-CZ 4.01Å
287	T	98.8	Very high	97.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.3	170.3	64.8	0	0	0	0	109.6	V239 H258 M276 L285 Y294 S295 W297	V239-T287 HydrophobicContact CG2-CG2 4.12Å; H258-T287 VanDerWaalsContact NE2-CB 3.34Å; H258-T287 WeakPolarHBondContact NE2-CB 3.21Å; H258-T287 PolarHBondContact NE2-OG1 3.44Å; M276-T287 HydrophobicContact CB-CG2 4.37Å; L285-T287 HydrophobicContact CD2-CG2 4.01Å; L285-T287 HydrophobicContact CG-CG2 4.08Å; T287-Y294 CarbonylContact O-C 3.54Å; T287-Y294 WeakPolarHBondContact O-CA 3.3Å; T287-S295 PolarHBondContact N-O 2.91Å; T287-S295 PolarHBondContact O-N 3.16Å; T287-W297 PolarHBondContact OG1-NE1 3.02Å
288	V	98.5	Very high	97.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.9	174.1	-60	0	0	0	0	110.3	N274 D275 L315 C318 F327	N274-V288 HydrophobicContact CB-CG2 4.47Å; N274-V288 PolarHBondContact N-O 3.01Å; D275-V288 HydrophobicContact CB-CG2 3.65Å; D275-V288 PolarHBondContact N-O 2.91Å; D275-V288 PolarHBondContact O-N 2.73Å; V288-L315 HydrophobicContact CB-CB 3.73Å; V288-L315 HydrophobicContact CB-CD1 4.27Å; V288-L315 HydrophobicContact CG1-CB 4.34Å; V288-L315 HydrophobicContact CG1-CD1 4.15Å; V288-L315 HydrophobicContact CG2-CB 4.38Å; V288-C318 HydrophobicContact CG1-CB 3.63Å; V288-C318 HydrophobicContact CG2-CB 4.11Å; V288-F327 HydrophobicContact CG1-CZ 3.85Å
289	G	97.9	Very high	97.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	171	-170.2	0	0	0	0	0	116.2	H258 A272 D291 G292 C293 L315	H258-G289 PolarHBondContact CE1-N 3.27Å; H258-G289 VanDerWaalsContact CE1-N 3.34Å; A272-G289 CarbonylContact O-C 3.53Å; A272-G289 WeakPolarHBondContact O-CA 3.32Å; G289-D291 WeakPolarHBondContact CA-OD1 3.36Å; G289-D291 PolarHBondContact O-N 3.44Å; G289-G292 PolarHBondContact O-N 3.42Å; G289-G292 VanDerWaalsContact O-N 3.13Å; G289-C293 PolarHBondContact N-O 2.81Å; G289-L315 PolarHBondContact O-N 3.16Å
290	S	97.7	Very high	97	Very high	10 Å²	10	18.8 Å²	18.8	7%	0.07	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-9.1	176.3	-47.1	0	0	0	0	113.9	A272 G292 D334	A272-S290 WeakPolarHBondContact CB-OG 3.44Å; A272-S290 PolarHBondContact N-OG 2.72Å; A272-S290 PolarHBondContact O-N 2.96Å; S290-G292 PolarHBondContact O-N 3.47Å; S290-D334 WeakPolarHBondContact CB-OD2 3.27Å; S290-D334 PolarHBondContact OG-OD2 2.95Å
291	D	95.8	Very high	97	Very high	27 Å²	27	18.6 Å²	18.6	14%	0.144	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-6	171.8	60.8	-20.9	0	0	0	113	H258 F271 G289 C293	H258-D291 VanDerWaalsContact CA-OD2 3.28Å; H258-D291 WeakPolarHBondContact CA-OD2 3.19Å; H258-D291 IonicContact CE1-OD1 3.52Å; H258-D291 IonicContact CG-OD1 3.27Å; H258-D291 IonicContact CG-OD2 2.8Å; H258-D291 IonicContact ND1-OD1 3.92Å; H258-D291 PolarHBondContact ND1-OD1 3.03Å; H258-D291 IonicContact ND1-OD2 3.16Å; H258-D291 PolarHBondContact ND1-OD2 2.9Å; F271-D291 HydrophobicContact CB-CB 3.97Å; F271-D291 HydrophobicContact CD1-CB 4.08Å; F271-D291 HydrophobicContact CD2-CB 3.63Å; F271-D291 HydrophobicContact CE1-CB 4.49Å; F271-D291 HydrophobicContact CE2-CB 4.08Å; F271-D291 HydrophobicContact CG-CB 3.62Å; F271-D291 HydrophobicContact CZ-CB 4.49Å; G289-D291 WeakPolarHBondContact CA-OD1 3.36Å; G289-D291 PolarHBondContact O-N 3.44Å; D291-C293 VanDerWaalsContact C-N 3.26Å; D291-C293 PolarHBondContact OD1-N 2.79Å
292	G	96.4	Very high	97.1	Very high	4 Å²	4	22.5 Å²	22.5	4%	0.041	12%	0.122	C	C	.	.	S	Bend	trans	81.6	5	-177	0	0	0	0	0	113.9	G289 S290 S310 Q313 L315	G289-G292 PolarHBondContact O-N 3.42Å; G289-G292 VanDerWaalsContact O-N 3.13Å; S290-G292 PolarHBondContact O-N 3.47Å; G292-S310 CarbonylContact C-O 3.57Å; G292-Q313 WeakPolarHBondContact CA-O 3.43Å; G292-L315 WeakPolarHBondContact O-CG 3.37Å
293	C	96.2	Very high	97.2	Very high	24 Å²	24	23.1 Å²	23.1	16%	0.162	13%	0.13	C	C	.	.			trans	-107.1	151.1	-176.8	-62.7	0	0	0	0	112.1	H258 G289 D291 S308 L315	H258-C293 PolarHBondContact CE1-O 2.7Å; G289-C293 PolarHBondContact N-O 2.81Å; D291-C293 VanDerWaalsContact C-N 3.26Å; D291-C293 PolarHBondContact OD1-N 2.79Å; C293-S308 WeakPolarHBondContact CA-OG 3.32Å; C293-L315 VanDerWaalsContact C-CD1 3.48Å
294	Y	97.1	Very high	97.2	Very high	9 Å²	9	27.1 Å²	27.1	4%	0.035	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	152.9	159.4	63.5	-100.8	0	0	0	110.5	T287 F296 H306 S307 S308 L315 F327 Y329 R353	T287-Y294 CarbonylContact O-C 3.54Å; T287-Y294 WeakPolarHBondContact O-CA 3.3Å; Y294-F296 HydrophobicContact CD2-CD1 4.33Å; Y294-F296 AromaticContact CD2-CE1 3.7Å; Y294-F296 HydrophobicContact CD2-CE1 3.7Å; Y294-F296 HydrophobicContact CD2-CE2 4.42Å; Y294-F296 AromaticContact CD2-CZ 3.74Å; Y294-F296 HydrophobicContact CD2-CZ 3.74Å; Y294-F296 HydrophobicContact CE2-CE1 4.15Å; Y294-F296 HydrophobicContact CE2-CE2 4.11Å; Y294-F296 AromaticContact CE2-CZ 3.69Å; Y294-F296 HydrophobicContact CE2-CZ 3.69Å; Y294-H306 AromaticContact CE2-CD2 3.82Å; Y294-S307 WeakPolarHBondContact O-CA 3.11Å; Y294-S308 PolarHBondContact N-OG 2.98Å; Y294-S308 PolarHBondContact O-N 2.98Å; Y294-S308 PolarHBondContact O-OG 3.22Å; Y294-L315 HydrophobicContact CD1-CD1 4.01Å; Y294-F327 HydrophobicContact CD1-CE1 4.01Å; Y294-F327 HydrophobicContact CD2-CE1 4.03Å; Y294-F327 AromaticContact CG-CE1 3.71Å; Y294-F327 HydrophobicContact CG-CE1 3.71Å; Y294-F327 HydrophobicContact CG-CZ 4.46Å; Y294-Y329 HydrophobicContact CD1-CD1 4.2Å; Y294-Y329 AromaticContact CD1-CE1 3.93Å; Y294-Y329 HydrophobicContact CD1-CE1 3.93Å; Y294-Y329 HydrophobicContact CD1-CE2 4.33Å; Y294-Y329 HydrophobicContact CE1-CD1 4.35Å; Y294-Y329 AromaticContact CE1-CE1 3.65Å; Y294-Y329 HydrophobicContact CE1-CE1 3.65Å; Y294-Y329 HydrophobicContact CE1-CE2 4.4Å; Y294-Y329 AromaticContact CE1-CZ 3.68Å; Y294-R353 WeakPolarHBondContact OH-CD 3.22Å; Y294-R353 VanDerWaalsContact OH-CZ 3.29Å; Y294-R353 PolarHBondContact OH-NE 2.71Å; Y294-R353 PolarHBondContact OH-NH1 3.36Å
295	S	97.4	Very high	97.1	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.028	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.3	173.9	-66.8	0	0	0	0	111	A286 T287 W297 H306 S307	A286-S295 CarbonylContact C-O 3.56Å; A286-S295 WeakPolarHBondContact CA-O 3.29Å; T287-S295 PolarHBondContact N-O 2.91Å; T287-S295 PolarHBondContact O-N 3.16Å; S295-W297 VanDerWaalsContact CB-CZ2 3.49Å; S295-W297 PolarHBondContact O-NE1 2.76Å; S295-H306 CarbonylContact C-O 3.53Å; S295-H306 WeakPolarHBondContact CA-O 3.33Å; S295-S307 PolarHBondContact OG-OG 3.46Å
296	F	98.1	Very high	96.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.5	178.3	-57.6	-26.5	0	0	0	110	L285 A286 Y294 L305 H306 F327 C355 D358 M359	L285-F296 CarbonylContact O-C 3.51Å; L285-F296 WeakPolarHBondContact O-CA 3.06Å; A286-F296 HydrophobicContact CB-CD1 3.76Å; A286-F296 HydrophobicContact CB-CE1 3.84Å; Y294-F296 HydrophobicContact CD2-CD1 4.33Å; Y294-F296 AromaticContact CD2-CE1 3.7Å; Y294-F296 HydrophobicContact CD2-CE1 3.7Å; Y294-F296 HydrophobicContact CD2-CE2 4.42Å; Y294-F296 AromaticContact CD2-CZ 3.74Å; Y294-F296 HydrophobicContact CD2-CZ 3.74Å; Y294-F296 HydrophobicContact CE2-CE1 4.15Å; Y294-F296 HydrophobicContact CE2-CE2 4.11Å; Y294-F296 AromaticContact CE2-CZ 3.69Å; Y294-F296 HydrophobicContact CE2-CZ 3.69Å; F296-L305 HydrophobicContact CB-CB 4.12Å; F296-L305 PolarHBondContact O-N 3.08Å; F296-H306 HydrophobicContact CB-CB 4.13Å; F296-H306 HydrophobicContact CD2-CB 3.69Å; F296-H306 AromaticContact CD2-CD2 3.93Å; F296-H306 AromaticContact CE2-CD2 3.95Å; F296-H306 HydrophobicContact CG-CB 4.23Å; F296-H306 PolarHBondContact N-O 3.3Å; F296-H306 PolarHBondContact O-N 3.47Å; F296-F327 AromaticContact CE1-CD1 3.93Å; F296-F327 HydrophobicContact CE1-CD1 3.93Å; F296-F327 HydrophobicContact CE1-CD2 4.43Å; F296-F327 AromaticContact CE1-CE1 3.97Å; F296-F327 HydrophobicContact CE1-CE1 3.97Å; F296-F327 HydrophobicContact CE1-CE2 4.46Å; F296-F327 HydrophobicContact CE1-CG 4.17Å; F296-F327 HydrophobicContact CE1-CZ 4.24Å; F296-F327 HydrophobicContact CZ-CB 4.49Å; F296-F327 AromaticContact CZ-CD1 3.85Å; F296-F327 HydrophobicContact CZ-CD1 3.85Å; F296-F327 HydrophobicContact CZ-CE1 4.28Å; F296-F327 HydrophobicContact CZ-CG 4.16Å; F296-C355 HydrophobicContact CE2-CB 4.29Å; F296-C355 HydrophobicContact CZ-CB 4.26Å; F296-D358 HydrophobicContact CD2-CB 3.83Å; F296-D358 HydrophobicContact CE2-CB 3.81Å; F296-M359 HydrophobicContact CB-SD 3.46Å; F296-M359 WeakPolarHBondContact CB-SD 3.34Å; F296-M359 HydrophobicContact CD1-CE 4.42Å; F296-M359 HydrophobicContact CD1-SD 3.34Å; F296-M359 WeakPolarHBondContact CD1-SD 3.31Å; F296-M359 HydrophobicContact CD2-CG 4.06Å; F296-M359 HydrophobicContact CD2-SD 3.41Å; F296-M359 WeakPolarHBondContact CD2-SD 3.44Å; F296-M359 HydrophobicContact CE1-SD 3.85Å; F296-M359 HydrophobicContact CE2-CG 4.22Å; F296-M359 HydrophobicContact CE2-SD 3.93Å; F296-M359 HydrophobicContact CG-CG 4.34Å; F296-M359 HydrophobicContact CG-SD 3.11Å; F296-M359 WeakPolarHBondContact CG-SD 3.4Å; F296-M359 HydrophobicContact CZ-SD 4.13Å
297	W	98.5	Very high	96.6	Very high	22 Å²	22	33.8 Å²	33.8	8%	0.083	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140.2	-169.3	-47	87.2	0	0	0	111.2	F255 C257 T284 L285 T287 S295 T303 K304	F255-W297 HydrophobicContact CD2-CD2 4.34Å; F255-W297 HydrophobicContact CD2-CE3 4.01Å; F255-W297 HydrophobicContact CD2-CH2 4.16Å; F255-W297 AromaticContact CD2-CZ3 3.9Å; F255-W297 HydrophobicContact CD2-CZ3 3.9Å; F255-W297 AromaticContact CE2-CD2 3.63Å; F255-W297 HydrophobicContact CE2-CD2 3.63Å; F255-W297 AromaticContact CE2-CE2 3.75Å; F255-W297 AromaticContact CE2-CE3 3.76Å; F255-W297 HydrophobicContact CE2-CE3 3.76Å; F255-W297 HydrophobicContact CE2-CG 4.14Å; F255-W297 HydrophobicContact CE2-CH2 4.12Å; F255-W297 HydrophobicContact CE2-CZ2 4.02Å; F255-W297 AromaticContact CE2-CZ3 4Å; F255-W297 HydrophobicContact CE2-CZ3 4Å; F255-W297 HydrophobicContact CZ-CD2 4.22Å; F255-W297 HydrophobicContact CZ-CG 4.27Å; C257-W297 HydrophobicContact CB-CH2 3.77Å; C257-W297 HydrophobicContact CB-CZ2 3.44Å; C257-W297 VanDerWaalsContact CB-CZ2 3.44Å; T284-W297 CarbonylContact C-O 3.5Å; T284-W297 WeakPolarHBondContact CA-O 3.34Å; T284-W297 WeakPolarHBondContact CB-O 3.21Å; L285-W297 HydrophobicContact CB-CB 4.34Å; L285-W297 PolarHBondContact N-O 3.14Å; L285-W297 PolarHBondContact O-N 2.91Å; T287-W297 PolarHBondContact OG1-NE1 3.02Å; S295-W297 VanDerWaalsContact CB-CZ2 3.49Å; S295-W297 PolarHBondContact O-NE1 2.76Å; W297-T303 WeakPolarHBondContact CA-O 3.3Å; W297-K304 HydrophobicContact CE3-CB 3.82Å; W297-K304 HydrophobicContact CE3-CG 4.21Å; W297-K304 HydrophobicContact CH2-CD 4.49Å; W297-K304 HydrophobicContact CH2-CG 4.46Å; W297-K304 HydrophobicContact CZ3-CB 3.76Å; W297-K304 HydrophobicContact CZ3-CD 4.48Å; W297-K304 HydrophobicContact CZ3-CG 4.11Å
298	D	97.6	Very high	96.4	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.064	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	106.8	163	-178.5	-16.5	0	0	0	108.2	T284 D300 A301 R302 T303 L305	T284-D298 HydrophobicContact CG2-CB 4.25Å; D298-D300 VanDerWaalsContact C-N 3.28Å; D298-D300 PolarHBondContact O-N 3.43Å; D298-D300 WeakPolarHBondContact OD1-CA 3.42Å; D298-D300 WeakPolarHBondContact OD1-CB 3.26Å; D298-D300 PolarHBondContact OD1-N 2.79Å; D298-A301 HydrophobicContact CB-CB 4.12Å; D298-A301 VanDerWaalsContact CG-CB 3.48Å; D298-A301 PolarHBondContact OD1-N 2.84Å; D298-A301 VanDerWaalsContact OD2-CB 3.27Å; D298-A301 WeakPolarHBondContact OD2-CB 3.32Å; D298-R302 CarbonylContact O-C 3.55Å; D298-R302 WeakPolarHBondContact O-CA 3.47Å; D298-R302 PolarHBondContact O-N 2.98Å; D298-T303 PolarHBondContact N-O 2.81Å; D298-T303 PolarHBondContact O-N 3.19Å; D298-L305 HydrophobicContact CB-CD1 4.28Å; D298-L305 HydrophobicContact CB-CD2 4.07Å; D298-L305 HydrophobicContact CB-CG 4.23Å
299	K	96.6	Very high	95.5	Very high	15 Å²	15	42 Å²	42	7%	0.065	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-25.1	179.7	62.1	154.9	-177.3	60.6	0	113	F219 I241 F253 F278	F219-K299 HydrophobicContact CD1-CD 4.31Å; F219-K299 HydrophobicContact CE1-CD 4.29Å; F219-K299 HydrophobicContact CG-CD 4.43Å; F219-K299 HydrophobicContact CZ-CD 4.42Å; I241-K299 HydrophobicContact CD1-CB 4.22Å; I241-K299 HydrophobicContact CD1-CD 4.5Å; I241-K299 HydrophobicContact CG1-CB 4.22Å; I241-K299 HydrophobicContact CG2-CD 4.1Å; F253-K299 HydrophobicContact CZ-CB 4.32Å; F253-K299 WeakPolarHBondContact CZ-O 3.44Å; F278-K299 HydrophobicContact CE1-CD 4.05Å; F278-K299 HydrophobicContact CE1-CG 4.46Å; F278-K299 HydrophobicContact CZ-CD 4.38Å
300	D	94.3	Very high	94.2	Very high	72 Å²	72	44.8 Å²	44.8	39%	0.385	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-39.2	-176.6	-64.7	-65	0	0	0	110.2	Y243 D298	Y243-D300 PolarHBondContact OH-OD1 3.05Å; D298-D300 VanDerWaalsContact C-N 3.28Å; D298-D300 PolarHBondContact O-N 3.43Å; D298-D300 WeakPolarHBondContact OD1-CA 3.42Å; D298-D300 WeakPolarHBondContact OD1-CB 3.26Å; D298-D300 PolarHBondContact OD1-N 2.79Å
301	A	95.4	Very high	92.7	Very high	52 Å²	52	49.2 Å²	49.2	43%	0.43	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-14.1	169.8	0	0	0	0	0	113.4	D298 T303	D298-A301 HydrophobicContact CB-CB 4.12Å; D298-A301 VanDerWaalsContact CG-CB 3.48Å; D298-A301 PolarHBondContact OD1-N 2.84Å; D298-A301 VanDerWaalsContact OD2-CB 3.27Å; D298-A301 WeakPolarHBondContact OD2-CB 3.32Å; A301-T303 VanDerWaalsContact C-N 3.3Å; A301-T303 HydrophobicContact CB-CG2 4.25Å; A301-T303 PolarHBondContact O-N 3.44Å
302	R	96.5	Very high	92.1	Very high	142 Å²	142	53.3 Å²	53.3	54%	0.536	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	39.6	-174.6	-52.6	-177.8	-177	-162.2	-4.8	112.8	K250 F253 D298	K250-R302 PolarHBondContact O-NH2 3.38Å; F253-R302 HydrophobicContact CE1-CG 4.37Å; F253-R302 HydrophobicContact CE2-CG 4.18Å; F253-R302 HydrophobicContact CZ-CG 3.95Å; D298-R302 CarbonylContact O-C 3.55Å; D298-R302 WeakPolarHBondContact O-CA 3.47Å; D298-R302 PolarHBondContact O-N 2.98Å
303	T	96.8	Very high	92	Very high	65 Å²	65	54 Å²	54	40%	0.399	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	152.2	-177.7	54.3	0	0	0	0	111.5	W297 D298 A301	W297-T303 WeakPolarHBondContact CA-O 3.3Å; D298-T303 PolarHBondContact N-O 2.81Å; D298-T303 PolarHBondContact O-N 3.19Å; A301-T303 VanDerWaalsContact C-N 3.3Å; A301-T303 HydrophobicContact CB-CG2 4.25Å; A301-T303 PolarHBondContact O-N 3.44Å
304	K	96.6	Very high	92.1	Very high	110 Å²	110	53.7 Å²	53.7	48%	0.478	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	128.1	164.7	179.9	-172.8	-79.6	-159.6	0	107.8	W297 S307	W297-K304 HydrophobicContact CE3-CB 3.82Å; W297-K304 HydrophobicContact CE3-CG 4.21Å; W297-K304 HydrophobicContact CH2-CD 4.49Å; W297-K304 HydrophobicContact CH2-CG 4.46Å; W297-K304 HydrophobicContact CZ3-CB 3.76Å; W297-K304 HydrophobicContact CZ3-CD 4.48Å; W297-K304 HydrophobicContact CZ3-CG 4.11Å; K304-S307 VanDerWaalsContact CD-OG 3.32Å; K304-S307 WeakPolarHBondContact CD-OG 3.34Å; K304-S307 WeakPolarHBondContact CE-OG 3.33Å; K304-S307 PolarHBondContact NZ-OG 3.18Å
305	L	96.4	Very high	92.1	Very high	51 Å²	51	53.5 Å²	53.5	27%	0.267	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-44.3	178.6	-60.1	175.3	0	0	0	111.3	T284 F296 D298	T284-L305 HydrophobicContact CG2-CD1 3.72Å; F296-L305 HydrophobicContact CB-CB 4.12Å; F296-L305 PolarHBondContact O-N 3.08Å; D298-L305 HydrophobicContact CB-CD1 4.28Å; D298-L305 HydrophobicContact CB-CD2 4.07Å; D298-L305 HydrophobicContact CB-CG 4.23Å
306	H	94.3	Very high	92.2	Very high	51 Å²	51	54.1 Å²	54.1	24%	0.236	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	153.3	-174.8	-175.2	73.6	0	0	0	110.6	Y294 S295 F296	Y294-H306 AromaticContact CE2-CD2 3.82Å; S295-H306 CarbonylContact C-O 3.53Å; S295-H306 WeakPolarHBondContact CA-O 3.33Å; F296-H306 HydrophobicContact CB-CB 4.13Å; F296-H306 HydrophobicContact CD2-CB 3.69Å; F296-H306 AromaticContact CD2-CD2 3.93Å; F296-H306 AromaticContact CE2-CD2 3.95Å; F296-H306 HydrophobicContact CG-CB 4.23Å; F296-H306 PolarHBondContact N-O 3.3Å; F296-H306 PolarHBondContact O-N 3.47Å
307	S	92.2	Very high	92.2	Very high	40 Å²	40	54.1 Å²	54.1	28%	0.28	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.7	166.7	-77.1	0	0	0	0	108.3	Y294 S295 K304	Y294-S307 WeakPolarHBondContact O-CA 3.11Å; S295-S307 PolarHBondContact OG-OG 3.46Å; K304-S307 VanDerWaalsContact CD-OG 3.32Å; K304-S307 WeakPolarHBondContact CD-OG 3.34Å; K304-S307 WeakPolarHBondContact CE-OG 3.33Å; K304-S307 PolarHBondContact NZ-OG 3.18Å
308	S	93.3	Very high	92.2	Very high	13 Å²	13	53.2 Å²	53.2	9%	0.091	29%	0.291	C	S	.	.			trans	-78	152.7	172.4	65.8	0	0	0	0	112.2	C293 Y294	C293-S308 WeakPolarHBondContact CA-OG 3.32Å; Y294-S308 PolarHBondContact N-OG 2.98Å; Y294-S308 PolarHBondContact O-N 2.98Å; Y294-S308 PolarHBondContact O-OG 3.22Å
309	D	80.4	Confident	92.2	Very high	159 Å²	159	53.7 Å²	53.7	85%	0.85	29%	0.294	S	S	*	.			trans	-98.3	120	161.6	-54.6	-47.2	0	0	0	107.8
310	S	71.6	Confident	92.3	Very high	58 Å²	58	53.7 Å²	53.7	41%	0.406	29%	0.294	S	S	.	.			trans	163.4	115.1	154.5	-177.6	0	0	0	0	111.4	G292	G292-S310 CarbonylContact C-O 3.57Å
311	P	64.5	Low	92.3	Very high	103 Å²	103	51 Å²	51	67%	0.669	28%	0.28	S	S	*	.			trans	-98.8	13.1	-177.3	37.8	-34.9	0	0	0	114.9	Q313	P311-Q313 VanDerWaalsContact C-N 3.26Å; P311-Q313 PolarHBondContact O-N 3.38Å; P311-Q313 VanDerWaalsContact O-N 3.13Å
312	D	84.1	Confident	92.2	Very high	113 Å²	113	50.3 Å²	50.3	60%	0.604	27%	0.271	S	S	*	.	S	Bend	trans	-58.5	-37.5	-165	-72.8	-16	0	0	0	113.8	K346	D312-K346 PolarHBondContact O-NZ 3.25Å
313	Q	94.7	Very high	92	Very high	19 Å²	19	48.6 Å²	48.6	9%	0.089	27%	0.267	C	S	.	.	S	Bend	trans	-152.7	154.1	175.5	-65.8	-174.5	86.4	0	0	110.9	G292 P311 K346 P347	G292-Q313 WeakPolarHBondContact CA-O 3.43Å; P311-Q313 VanDerWaalsContact C-N 3.26Å; P311-Q313 PolarHBondContact O-N 3.38Å; P311-Q313 VanDerWaalsContact O-N 3.13Å; Q313-K346 HydrophobicContact CG-CB 4.48Å; Q313-K346 HydrophobicContact CG-CD 3.73Å; Q313-P347 PolarHBondContact NE2-O 2.95Å
314	P	97.4	Very high	91.8	Very high	17 Å²	17	45.5 Å²	45.5	11%	0.11	25%	0.249	C	C	.	.			trans	-49.1	149.8	170.3	-29.3	37.2	0	0	0	113.3	S331 G332 D334	P314-S331 WeakPolarHBondContact O-CA 3.48Å; P314-G332 WeakPolarHBondContact CB-O 3.13Å; P314-G332 PolarHBondContact O-N 2.86Å; P314-D334 HydrophobicContact CB-CB 3.93Å; P314-D334 HydrophobicContact CG-CB 4.44Å
315	L	97.9	Very high	91.7	Very high	5 Å²	5	45 Å²	45	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.5	167.6	-58.8	-169	0	0	0	109.2	N274 V288 G289 G292 C293 Y294 Y329 A330	N274-L315 VanDerWaalsContact CB-O 3.25Å; N274-L315 WeakPolarHBondContact CB-O 3.37Å; N274-L315 PolarHBondContact ND2-O 2.83Å; V288-L315 HydrophobicContact CB-CB 3.73Å; V288-L315 HydrophobicContact CB-CD1 4.27Å; V288-L315 HydrophobicContact CG1-CB 4.34Å; V288-L315 HydrophobicContact CG1-CD1 4.15Å; V288-L315 HydrophobicContact CG2-CB 4.38Å; G289-L315 PolarHBondContact O-N 3.16Å; G292-L315 WeakPolarHBondContact O-CG 3.37Å; C293-L315 VanDerWaalsContact C-CD1 3.48Å; Y294-L315 HydrophobicContact CD1-CD1 4.01Å; L315-Y329 HydrophobicContact CD1-CD2 3.83Å; L315-Y329 HydrophobicContact CD1-CE2 4.27Å; L315-Y329 HydrophobicContact CD1-CG 4.41Å; L315-Y329 HydrophobicContact CD2-CD2 3.79Å; L315-Y329 HydrophobicContact CD2-CE2 4.11Å; L315-Y329 HydrophobicContact CG-CD2 4.38Å; L315-A330 CarbonylContact C-O 3.56Å; L315-A330 VanDerWaalsContact CA-O 3.22Å; L315-A330 WeakPolarHBondContact CA-O 3.24Å
316	T	98.4	Very high	91.5	Very high	17 Å²	17	43.8 Å²	43.8	10%	0.104	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-32.2	-164.5	59.1	0	0	0	0	114.3	T39 V40 A330 G332 D334	T39-T316 HydrophobicContact CG2-CG2 3.64Å; V40-T316 VanDerWaalsContact O-CB 3.31Å; V40-T316 WeakPolarHBondContact O-CB 3.46Å; V40-T316 PolarHBondContact O-OG1 3.27Å; T316-A330 PolarHBondContact N-O 2.82Å; T316-G332 VanDerWaalsContact CG2-O 3.29Å; T316-G332 WeakPolarHBondContact CG2-O 3.22Å; T316-D334 HydrophobicContact CG2-CB 3.93Å
317	C	98.7	Very high	91.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.007	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	159	177.3	55.9	0	0	0	0	111.1	D275 Y329 A330	D275-C317 HydrophobicContact CB-CB 4.43Å; D275-C317 WeakPolarHBondContact OD2-CA 3.18Å; D275-C317 WeakPolarHBondContact OD2-CB 3.41Å; C317-Y329 WeakPolarHBondContact O-CA 3.26Å; C317-A330 PolarHBondContact O-N 2.82Å
318	C	98.5	Very high	91.8	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.02	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	157.7	178.8	68.4	0	0	0	0	113.3	D275 V288 F327 C328	D275-C318 PolarHBondContact OD2-N 3.05Å; V288-C318 HydrophobicContact CG1-CB 3.63Å; V288-C318 HydrophobicContact CG2-CB 4.11Å; C318-F327 HydrophobicContact CB-CE2 3.54Å; C318-F327 HydrophobicContact CB-CZ 3.63Å; C318-C328 CarbonylContact C-O 3.57Å; C318-C328 WeakPolarHBondContact CA-O 3.11Å; C318-C328 WeakPolarHBondContact CB-O 3.46Å
319	V	98.4	Very high	92	Very high	21 Å²	21	40.2 Å²	40.2	13%	0.127	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	151.5	178.6	69.2	0	0	0	0	110.7	L43 F45 L55 C328	L43-V319 HydrophobicContact CB-CB 4.21Å; L43-V319 HydrophobicContact CB-CG1 3.56Å; F45-V319 HydrophobicContact CD2-CG1 3.65Å; F45-V319 HydrophobicContact CD2-CG2 4.28Å; F45-V319 HydrophobicContact CE2-CG1 3.79Å; L55-V319 HydrophobicContact CD1-CG1 4.38Å; V319-C328 HydrophobicContact CG1-CB 4.06Å; V319-C328 PolarHBondContact N-O 2.62Å; V319-C328 PolarHBondContact O-N 2.82Å
320	F	97.1	Very high	92.8	Very high	15 Å²	15	32.6 Å²	32.6	7%	0.066	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	148.3	167.6	-68.2	-78.4	0	0	0	110.5	F45 A277 F278 H279 A286 V326 F327 C355 M359	F45-F320 VanDerWaalsContact CD2-C 3.48Å; F45-F320 VanDerWaalsContact CD2-O 3.26Å; F45-F320 WeakPolarHBondContact CD2-O 3.24Å; A277-F320 HydrophobicContact CB-CD2 3.82Å; A277-F320 HydrophobicContact CB-CE2 3.87Å; A277-F320 WeakPolarHBondContact O-CE2 3.33Å; F278-F320 WeakPolarHBondContact O-CD2 3.41Å; H279-F320 AromaticContact CD2-CE1 3.81Å; A286-F320 HydrophobicContact CB-CE2 3.87Å; A286-F320 HydrophobicContact CB-CZ 3.63Å; F320-V326 WeakPolarHBondContact CA-O 3.42Å; F320-F327 HydrophobicContact CD1-CB 4.06Å; F320-F327 HydrophobicContact CD1-CD2 4.04Å; F320-F327 HydrophobicContact CE1-CB 3.74Å; F320-F327 AromaticContact CE1-CD2 3.56Å; F320-F327 HydrophobicContact CE1-CD2 3.56Å; F320-F327 HydrophobicContact CE1-CG 4.02Å; F320-F327 HydrophobicContact CE2-CD2 4.21Å; F320-F327 AromaticContact CZ-CD2 3.63Å; F320-F327 HydrophobicContact CZ-CD2 3.63Å; F320-F327 HydrophobicContact CZ-CE2 4.21Å; F320-F327 HydrophobicContact CZ-CG 4.42Å; F320-C355 VanDerWaalsContact CE1-SG 3.6Å; F320-M359 HydrophobicContact CE1-CE 4.07Å; F320-M359 HydrophobicContact CE1-CG 4.38Å; F320-M359 HydrophobicContact CE2-CE 4.17Å; F320-M359 HydrophobicContact CZ-CE 3.42Å; F320-M359 VanDerWaalsContact CZ-CE 3.42Å; F320-M359 HydrophobicContact CZ-SD 4.18Å
321	D	94.8	Very high	94.1	Very high	15 Å²	15	30.7 Å²	30.7	8%	0.08	17%	0.165	C	C	.	.			trans	-63	160.6	162	84.4	-63.1	0	0	0	110.1	F45 K323 G324 Q325 V326	F45-D321 HydrophobicContact CD1-CB 4.2Å; F45-D321 VanDerWaalsContact CD2-CA 3.45Å; F45-D321 HydrophobicContact CD2-CB 4.1Å; F45-D321 HydrophobicContact CE1-CB 4.1Å; F45-D321 HydrophobicContact CE2-CB 4Å; F45-D321 HydrophobicContact CG-CB 4.18Å; F45-D321 HydrophobicContact CZ-CB 4.01Å; D321-K323 PolarHBondContact O-N 3.47Å; D321-K323 WeakPolarHBondContact OD2-CB 3.37Å; D321-K323 PolarHBondContact OD2-N 3.49Å; D321-K323 VanDerWaalsContact OD2-N 3.14Å; D321-G324 PolarHBondContact O-N 3.22Å; D321-G324 VanDerWaalsContact OD1-C 3.28Å; D321-G324 WeakPolarHBondContact OD1-CA 3.39Å; D321-G324 PolarHBondContact OD1-N 3.24Å; D321-G324 VanDerWaalsContact OD1-N 3.08Å; D321-Q325 PolarHBondContact OD1-N 2.91Å; D321-V326 HydrophobicContact CB-CB 4.24Å; D321-V326 PolarHBondContact N-O 2.95Å; D321-V326 PolarHBondContact OD1-N 3.17Å
322	P	92.7	Very high	95.6	Very high	38 Å²	38	25.8 Å²	25.8	25%	0.247	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-28.1	-174.6	-26.2	35.3	0	0	0	114.2	F45 S46 E48 P280	F45-P322 HydrophobicContact CB-CG 4.46Å; S46-P322 WeakPolarHBondContact O-CG 3.29Å; E48-P322 HydrophobicContact CB-CB 3.73Å; E48-P322 HydrophobicContact CB-CG 4.39Å; E48-P322 HydrophobicContact CG-CB 4.34Å; P280-P322 WeakPolarHBondContact CG-O 3.49Å
323	K	92.5	Very high	96.2	Very high	106 Å²	106	22 Å²	22	46%	0.461	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.3	179.9	-60.7	179.7	-179.1	176.1	0	113.4	E48 V281 D321 Q325	E48-K323 WeakPolarHBondContact OE1-CE 3.13Å; V281-K323 WeakPolarHBondContact CG2-O 3.3Å; D321-K323 PolarHBondContact O-N 3.47Å; D321-K323 WeakPolarHBondContact OD2-CB 3.37Å; D321-K323 PolarHBondContact OD2-N 3.49Å; D321-K323 VanDerWaalsContact OD2-N 3.14Å; K323-Q325 HydrophobicContact CB-CG 4.07Å; K323-Q325 PolarHBondContact O-N 3.23Å
324	G	94	Very high	96.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	69	15.1	-176.9	0	0	0	0	0	114.4	H279 D321 C355	H279-G324 PolarHBondContact CE1-O 3.46Å; H279-G324 PolarHBondContact NE2-O 3.37Å; D321-G324 PolarHBondContact O-N 3.22Å; D321-G324 VanDerWaalsContact OD1-C 3.28Å; D321-G324 WeakPolarHBondContact OD1-CA 3.39Å; D321-G324 PolarHBondContact OD1-N 3.24Å; D321-G324 VanDerWaalsContact OD1-N 3.08Å; G324-C355 PolarHBondContact O-SG 3.47Å
325	Q	93.1	Very high	96.4	Very high	101 Å²	101	28.5 Å²	28.5	47%	0.472	13%	0.133	S	C	.	.	S	Bend	trans	-75.1	-33.9	177.3	-62.7	-178	34.8	0	0	111.6	D321 K323 L354 C355	D321-Q325 PolarHBondContact OD1-N 2.91Å; K323-Q325 HydrophobicContact CB-CG 4.07Å; K323-Q325 PolarHBondContact O-N 3.23Å; Q325-L354 WeakPolarHBondContact O-CA 3.35Å; Q325-C355 PolarHBondContact O-N 3.18Å
326	V	94	Very high	96.4	Very high	25 Å²	25	31 Å²	31	15%	0.152	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.6	-174.3	-179.2	0	0	0	0	110.1	F45 F320 D321 M352 R353 L354	F45-V326 HydrophobicContact CZ-CG1 4.45Å; F320-V326 WeakPolarHBondContact CA-O 3.42Å; D321-V326 HydrophobicContact CB-CB 4.24Å; D321-V326 PolarHBondContact N-O 2.95Å; D321-V326 PolarHBondContact OD1-N 3.17Å; V326-M352 HydrophobicContact CG1-CB 3.8Å; V326-M352 HydrophobicContact CG1-CG 4.24Å; V326-R353 CarbonylContact C-O 3.53Å; V326-R353 VanDerWaalsContact CA-O 3.31Å; V326-R353 WeakPolarHBondContact CA-O 3.41Å; V326-L354 HydrophobicContact CG2-CD2 4.19Å
327	F	96	Very high	96.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.7	165.3	177	-117	0	0	0	109.3	A286 V288 Y294 F296 C318 F320 Y329 M352 R353 C355	A286-F327 HydrophobicContact CB-CD2 4.2Å; A286-F327 HydrophobicContact CB-CE2 3.55Å; A286-F327 HydrophobicContact CB-CZ 4.01Å; V288-F327 HydrophobicContact CG1-CZ 3.85Å; Y294-F327 HydrophobicContact CD1-CE1 4.01Å; Y294-F327 HydrophobicContact CD2-CE1 4.03Å; Y294-F327 AromaticContact CG-CE1 3.71Å; Y294-F327 HydrophobicContact CG-CE1 3.71Å; Y294-F327 HydrophobicContact CG-CZ 4.46Å; F296-F327 AromaticContact CE1-CD1 3.93Å; F296-F327 HydrophobicContact CE1-CD1 3.93Å; F296-F327 HydrophobicContact CE1-CD2 4.43Å; F296-F327 AromaticContact CE1-CE1 3.97Å; F296-F327 HydrophobicContact CE1-CE1 3.97Å; F296-F327 HydrophobicContact CE1-CE2 4.46Å; F296-F327 HydrophobicContact CE1-CG 4.17Å; F296-F327 HydrophobicContact CE1-CZ 4.24Å; F296-F327 HydrophobicContact CZ-CB 4.49Å; F296-F327 AromaticContact CZ-CD1 3.85Å; F296-F327 HydrophobicContact CZ-CD1 3.85Å; F296-F327 HydrophobicContact CZ-CE1 4.28Å; F296-F327 HydrophobicContact CZ-CG 4.16Å; C318-F327 HydrophobicContact CB-CE2 3.54Å; C318-F327 HydrophobicContact CB-CZ 3.63Å; F320-F327 HydrophobicContact CD1-CB 4.06Å; F320-F327 HydrophobicContact CD1-CD2 4.04Å; F320-F327 HydrophobicContact CE1-CB 3.74Å; F320-F327 AromaticContact CE1-CD2 3.56Å; F320-F327 HydrophobicContact CE1-CD2 3.56Å; F320-F327 HydrophobicContact CE1-CG 4.02Å; F320-F327 HydrophobicContact CE2-CD2 4.21Å; F320-F327 AromaticContact CZ-CD2 3.63Å; F320-F327 HydrophobicContact CZ-CD2 3.63Å; F320-F327 HydrophobicContact CZ-CE2 4.21Å; F320-F327 HydrophobicContact CZ-CG 4.42Å; F327-Y329 AromaticContact CD1-CD1 3.67Å; F327-Y329 HydrophobicContact CD1-CD1 3.67Å; F327-Y329 HydrophobicContact CD1-CE1 4.24Å; F327-Y329 AromaticContact CE1-CD1 3.47Å; F327-Y329 HydrophobicContact CE1-CD1 3.47Å; F327-Y329 VanDerWaalsContact CE1-CD1 3.47Å; F327-Y329 HydrophobicContact CE1-CE1 4.24Å; F327-Y329 HydrophobicContact CE1-CG 4.07Å; F327-Y329 HydrophobicContact CZ-CD1 4.39Å; F327-M352 CarbonylContact O-C 3.58Å; F327-R353 PolarHBondContact N-O 2.74Å; F327-R353 PolarHBondContact O-N 2.99Å; F327-C355 HydrophobicContact CB-CB 3.74Å; F327-C355 PolarHBondContact N-SG 2.83Å; F327-C355 VanDerWaalsContact N-SG 3.44Å
328	C	96.5	Very high	96.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.2	176.9	-172.7	0	0	0	0	110.6	F45 C318 V319 I350 M351 M352	F45-C328 HydrophobicContact CE2-CB 3.83Å; F45-C328 HydrophobicContact CZ-CB 4.15Å; C318-C328 CarbonylContact C-O 3.57Å; C318-C328 WeakPolarHBondContact CA-O 3.11Å; C318-C328 WeakPolarHBondContact CB-O 3.46Å; V319-C328 HydrophobicContact CG1-CB 4.06Å; V319-C328 PolarHBondContact N-O 2.62Å; V319-C328 PolarHBondContact O-N 2.82Å; C328-I350 WeakPolarHBondContact SG-CG2 3.33Å; C328-M351 CarbonylContact C-O 3.52Å; C328-M351 WeakPolarHBondContact CA-O 3.34Å; C328-M351 PolarHBondContact SG-O 2.99Å; C328-M352 HydrophobicContact CB-CG 4.25Å
329	Y	97.5	Very high	96.1	Very high	28 Å²	28	44.3 Å²	44.3	11%	0.11	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	149.2	178.1	60	-86.5	0	0	0	111.1	Y294 L315 C317 F327 M351	Y294-Y329 HydrophobicContact CD1-CD1 4.2Å; Y294-Y329 AromaticContact CD1-CE1 3.93Å; Y294-Y329 HydrophobicContact CD1-CE1 3.93Å; Y294-Y329 HydrophobicContact CD1-CE2 4.33Å; Y294-Y329 HydrophobicContact CE1-CD1 4.35Å; Y294-Y329 AromaticContact CE1-CE1 3.65Å; Y294-Y329 HydrophobicContact CE1-CE1 3.65Å; Y294-Y329 HydrophobicContact CE1-CE2 4.4Å; Y294-Y329 AromaticContact CE1-CZ 3.68Å; L315-Y329 HydrophobicContact CD1-CD2 3.83Å; L315-Y329 HydrophobicContact CD1-CE2 4.27Å; L315-Y329 HydrophobicContact CD1-CG 4.41Å; L315-Y329 HydrophobicContact CD2-CD2 3.79Å; L315-Y329 HydrophobicContact CD2-CE2 4.11Å; L315-Y329 HydrophobicContact CG-CD2 4.38Å; C317-Y329 WeakPolarHBondContact O-CA 3.26Å; F327-Y329 AromaticContact CD1-CD1 3.67Å; F327-Y329 HydrophobicContact CD1-CD1 3.67Å; F327-Y329 HydrophobicContact CD1-CE1 4.24Å; F327-Y329 AromaticContact CE1-CD1 3.47Å; F327-Y329 HydrophobicContact CE1-CD1 3.47Å; F327-Y329 VanDerWaalsContact CE1-CD1 3.47Å; F327-Y329 HydrophobicContact CE1-CE1 4.24Å; F327-Y329 HydrophobicContact CE1-CG 4.07Å; F327-Y329 HydrophobicContact CZ-CD1 4.39Å; Y329-M351 HydrophobicContact CD1-CB 4.16Å; Y329-M351 HydrophobicContact CD2-CB 4.03Å; Y329-M351 HydrophobicContact CD2-CG 4.28Å; Y329-M351 HydrophobicContact CE1-CB 3.66Å; Y329-M351 HydrophobicContact CE2-CB 3.53Å; Y329-M351 HydrophobicContact CE2-CG 3.6Å; Y329-M351 HydrophobicContact CG-CB 4.34Å; Y329-M351 PolarHBondContact N-O 2.88Å; Y329-M351 PolarHBondContact O-N 2.9Å
330	A	97.6	Very high	96.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.2	175.8	0	0	0	0	0	111.3	V40 L43 L315 T316 C317 K349 I350	V40-A330 HydrophobicContact CB-CB 3.54Å; V40-A330 HydrophobicContact CG1-CB 3.96Å; V40-A330 HydrophobicContact CG2-CB 3.87Å; L43-A330 HydrophobicContact CD1-CB 4.16Å; L315-A330 CarbonylContact C-O 3.56Å; L315-A330 VanDerWaalsContact CA-O 3.22Å; L315-A330 WeakPolarHBondContact CA-O 3.24Å; T316-A330 PolarHBondContact N-O 2.82Å; C317-A330 PolarHBondContact O-N 2.82Å; A330-K349 CarbonylContact C-O 3.54Å; A330-K349 WeakPolarHBondContact CA-O 3Å; A330-I350 HydrophobicContact CB-CG1 4.34Å
331	S	96.8	Very high	96	Very high	17 Å²	17	55.2 Å²	55.2	12%	0.119	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	126.6	175.3	-177.1	0	0	0	0	109.3	P314 K349	P314-S331 WeakPolarHBondContact O-CA 3.48Å; S331-K349 PolarHBondContact N-O 2.93Å; S331-K349 PolarHBondContact O-N 2.96Å
332	G	96.8	Very high	96	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	175.1	167.7	-174.8	0	0	0	0	0	111.4	P314 T316 D334	P314-G332 WeakPolarHBondContact CB-O 3.13Å; P314-G332 PolarHBondContact O-N 2.86Å; T316-G332 VanDerWaalsContact CG2-O 3.29Å; T316-G332 WeakPolarHBondContact CG2-O 3.22Å; G332-D334 PolarHBondContact O-N 3.08Å
333	Y	97.5	Very high	96.1	Very high	34 Å²	34	57.8 Å²	57.8	13%	0.133	28%	0.276	C	S	.	.			trans	-73.9	126	-176.4	-172.8	-119.2	0	0	0	112.1	T39 W335 K337 G338 F341 A342	T39-Y333 WeakPolarHBondContact CB-O 3.49Å; T39-Y333 VanDerWaalsContact CG2-O 3.27Å; T39-Y333 WeakPolarHBondContact CG2-O 3.34Å; T39-Y333 PolarHBondContact OG1-N 3.42Å; T39-Y333 PolarHBondContact OG1-O 2.88Å; Y333-W335 AromaticContact CD1-CE3 3.66Å; Y333-W335 HydrophobicContact CD1-CE3 3.66Å; Y333-W335 HydrophobicContact CD1-CZ3 4.15Å; Y333-W335 HydrophobicContact CE1-CB 4.45Å; Y333-W335 HydrophobicContact CE1-CD2 4.06Å; Y333-W335 AromaticContact CE1-CE3 3.51Å; Y333-W335 HydrophobicContact CE1-CE3 3.51Å; Y333-W335 HydrophobicContact CE1-CG 4.47Å; Y333-W335 HydrophobicContact CE1-CZ3 4.1Å; Y333-K337 VanDerWaalsContact OH-C 3.3Å; Y333-K337 WeakPolarHBondContact OH-CA 3.35Å; Y333-K337 PolarHBondContact OH-N 2.87Å; Y333-K337 VanDerWaalsContact OH-N 3.13Å; Y333-G338 PolarHBondContact OH-N 3.38Å; Y333-G338 VanDerWaalsContact OH-N 3.13Å; Y333-G338 PolarHBondContact OH-O 2.96Å; Y333-F341 HydrophobicContact CE2-CB 4.14Å; Y333-A342 HydrophobicContact CD1-CB 3.83Å; Y333-A342 HydrophobicContact CE1-CB 3.84Å
334	D	97.7	Very high	96	Very high	18 Å²	18	59.1 Å²	59.1	10%	0.096	30%	0.296	C	S	.	.			trans	-100.4	10.8	-172.8	70.3	-10.5	0	0	0	114.6	N274 S290 P314 T316 G332 S336	N274-D334 PolarHBondContact ND2-OD2 3.36Å; N274-D334 PolarHBondContact OD1-OD2 3.13Å; S290-D334 WeakPolarHBondContact CB-OD2 3.27Å; S290-D334 PolarHBondContact OG-OD2 2.95Å; P314-D334 HydrophobicContact CB-CB 3.93Å; P314-D334 HydrophobicContact CG-CB 4.44Å; T316-D334 HydrophobicContact CG2-CB 3.93Å; G332-D334 PolarHBondContact O-N 3.08Å; D334-S336 PolarHBondContact O-N 2.87Å; D334-S336 WeakPolarHBondContact OD1-CB 3.14Å; D334-S336 PolarHBondContact OD1-N 2.86Å; D334-S336 PolarHBondContact OD1-OG 3.27Å
335	W	97.9	Very high	96	Very high	154 Å²	154	63.6 Å²	63.6	58%	0.583	33%	0.327	S	S	*	.	S	Bend	trans	64.7	10.6	-177.6	-138.4	-105.8	0	0	0	115.9	Y333 K337 G338 Y339 A342	Y333-W335 AromaticContact CD1-CE3 3.66Å; Y333-W335 HydrophobicContact CD1-CE3 3.66Å; Y333-W335 HydrophobicContact CD1-CZ3 4.15Å; Y333-W335 HydrophobicContact CE1-CB 4.45Å; Y333-W335 HydrophobicContact CE1-CD2 4.06Å; Y333-W335 AromaticContact CE1-CE3 3.51Å; Y333-W335 HydrophobicContact CE1-CE3 3.51Å; Y333-W335 HydrophobicContact CE1-CG 4.47Å; Y333-W335 HydrophobicContact CE1-CZ3 4.1Å; W335-K337 PolarHBondContact O-N 2.83Å; W335-G338 PolarHBondContact O-N 2.8Å; W335-Y339 VanDerWaalsContact CZ2-CB 3.47Å; W335-A342 HydrophobicContact CE3-CB 4.43Å; W335-A342 HydrophobicContact CH2-CB 4.09Å; W335-A342 HydrophobicContact CZ3-CB 3.66Å
336	S	97.1	Very high	96	Very high	58 Å²	58	63.3 Å²	63.3	41%	0.406	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.1	-176.8	53.3	0	0	0	0	114.7	D334	D334-S336 PolarHBondContact O-N 2.87Å; D334-S336 WeakPolarHBondContact OD1-CB 3.14Å; D334-S336 PolarHBondContact OD1-N 2.86Å; D334-S336 PolarHBondContact OD1-OG 3.27Å
337	K	96.6	Very high	96	Very high	112 Å²	112	65.8 Å²	65.8	49%	0.487	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	8	178.1	-56.1	-177.4	-179.1	-178.8	0	113.4	Y333 W335 F341	Y333-K337 VanDerWaalsContact OH-C 3.3Å; Y333-K337 WeakPolarHBondContact OH-CA 3.35Å; Y333-K337 PolarHBondContact OH-N 2.87Å; Y333-K337 VanDerWaalsContact OH-N 3.13Å; W335-K337 PolarHBondContact O-N 2.83Å; K337-F341 HydrophobicContact CB-CB 3.92Å; K337-F341 HydrophobicContact CB-CD1 4.34Å; K337-F341 HydrophobicContact CB-CD2 3.45Å; K337-F341 VanDerWaalsContact CB-CD2 3.45Å; K337-F341 HydrophobicContact CB-CE2 3.98Å; K337-F341 HydrophobicContact CB-CG 3.65Å; K337-F341 HydrophobicContact CD-CD1 4Å; K337-F341 HydrophobicContact CD-CE1 4.21Å; K337-F341 HydrophobicContact CD-CG 4.16Å; K337-F341 VanDerWaalsContact O-CD2 3.26Å; K337-F341 WeakPolarHBondContact O-CD2 3.09Å
338	G	97.5	Very high	96	Very high	24 Å²	24	66.7 Å²	66.7	25%	0.247	35%	0.345	C	S	.	.			trans	73.5	178.5	-178.8	0	0	0	0	0	115	Y333 W335 Q340 F341	Y333-G338 PolarHBondContact OH-N 3.38Å; Y333-G338 VanDerWaalsContact OH-N 3.13Å; Y333-G338 PolarHBondContact OH-O 2.96Å; W335-G338 PolarHBondContact O-N 2.8Å; G338-Q340 PolarHBondContact O-N 3.31Å; G338-F341 PolarHBondContact O-N 3.34Å; G338-F341 VanDerWaalsContact O-N 3.14Å
339	Y	96.4	Very high	95.9	Very high	165 Å²	165	70 Å²	70	65%	0.647	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-57.5	-27	-168	78.9	-86.5	0	0	0	115	W335 F341 A342	W335-Y339 VanDerWaalsContact CZ2-CB 3.47Å; Y339-F341 PolarHBondContact O-N 3.37Å; Y339-A342 WeakPolarHBondContact O-CB 3.31Å; Y339-A342 PolarHBondContact O-N 3.44Å
340	Q	97.3	Very high	95.9	Very high	145 Å²	145	68.7 Å²	68.7	68%	0.678	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-66.4	-20.9	-177.4	-65.5	177.3	-36.4	0	0	113.4	G338	G338-Q340 PolarHBondContact O-N 3.31Å
341	F	95.8	Very high	95.8	Very high	119 Å²	119	70.2 Å²	70.2	52%	0.522	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-105.5	3.5	179.2	-66	-97.4	0	0	0	112.4	Y333 K337 G338 Y339 D343	Y333-F341 HydrophobicContact CE2-CB 4.14Å; K337-F341 HydrophobicContact CB-CB 3.92Å; K337-F341 HydrophobicContact CB-CD1 4.34Å; K337-F341 HydrophobicContact CB-CD2 3.45Å; K337-F341 VanDerWaalsContact CB-CD2 3.45Å; K337-F341 HydrophobicContact CB-CE2 3.98Å; K337-F341 HydrophobicContact CB-CG 3.65Å; K337-F341 HydrophobicContact CD-CD1 4Å; K337-F341 HydrophobicContact CD-CE1 4.21Å; K337-F341 HydrophobicContact CD-CG 4.16Å; K337-F341 VanDerWaalsContact O-CD2 3.26Å; K337-F341 WeakPolarHBondContact O-CD2 3.09Å; G338-F341 PolarHBondContact O-N 3.34Å; G338-F341 VanDerWaalsContact O-N 3.14Å; Y339-F341 PolarHBondContact O-N 3.37Å; F341-D343 PolarHBondContact O-N 3.32Å
342	A	94.5	Very high	95.7	Very high	38 Å²	38	69.5 Å²	69.5	31%	0.314	36%	0.357	S	S	.	.			trans	-72.6	115.2	172.9	0	0	0	0	0	108.9	Y333 W335 Y339	Y333-A342 HydrophobicContact CD1-CB 3.83Å; Y333-A342 HydrophobicContact CE1-CB 3.84Å; W335-A342 HydrophobicContact CE3-CB 4.43Å; W335-A342 HydrophobicContact CH2-CB 4.09Å; W335-A342 HydrophobicContact CZ3-CB 3.66Å; Y339-A342 WeakPolarHBondContact O-CB 3.31Å; Y339-A342 PolarHBondContact O-N 3.44Å
343	D	94.3	Very high	95.4	Very high	70 Å²	70	71.2 Å²	71.2	37%	0.374	36%	0.363	S	S	.	.			trans	-112.7	101.3	178.7	-177.6	-6.2	0	0	0	109.5	F341 S345 K346	F341-D343 PolarHBondContact O-N 3.32Å; D343-S345 VanDerWaalsContact CG-OG 3.3Å; D343-S345 PolarHBondContact O-N 3.08Å; D343-S345 VanDerWaalsContact OD1-CB 3.3Å; D343-S345 WeakPolarHBondContact OD1-CB 3.38Å; D343-S345 PolarHBondContact OD1-N 3.03Å; D343-S345 PolarHBondContact OD1-OG 2.79Å; D343-S345 PolarHBondContact OD2-OG 3.23Å; D343-K346 HydrophobicContact CB-CD 4.44Å; D343-K346 HydrophobicContact CB-CG 4.2Å; D343-K346 PolarHBondContact O-N 3.34Å
344	P	91.2	Very high	95.2	Very high	134 Å²	134	72.3 Å²	72.3	87%	0.87	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.7	-178	30	-35.4	0	0	0	113.3
345	S	93.5	Very high	95	Very high	93 Å²	93	71.4 Å²	71.4	65%	0.65	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-18.8	175.8	76.4	0	0	0	0	113	D343	D343-S345 VanDerWaalsContact CG-OG 3.3Å; D343-S345 PolarHBondContact O-N 3.08Å; D343-S345 VanDerWaalsContact OD1-CB 3.3Å; D343-S345 WeakPolarHBondContact OD1-CB 3.38Å; D343-S345 PolarHBondContact OD1-N 3.03Å; D343-S345 PolarHBondContact OD1-OG 2.79Å; D343-S345 PolarHBondContact OD2-OG 3.23Å
346	K	93.6	Very high	94.7	Very high	95 Å²	95	67.3 Å²	67.3	41%	0.413	36%	0.355	S	S	.	.	S	Bend	trans	-77.6	126.3	178.9	-71.2	-167.4	174.8	-170.7	0	110.5	D312 Q313 D343	D312-K346 PolarHBondContact O-NZ 3.25Å; Q313-K346 HydrophobicContact CG-CB 4.48Å; Q313-K346 HydrophobicContact CG-CD 3.73Å; D343-K346 HydrophobicContact CB-CD 4.44Å; D343-K346 HydrophobicContact CB-CG 4.2Å; D343-K346 PolarHBondContact O-N 3.34Å
347	P	93.4	Very high	94.5	Very high	78 Å²	78	72 Å²	72	51%	0.506	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-72.4	139.9	-177.5	29.3	-34.5	0	0	0	111	Q313	Q313-P347 PolarHBondContact NE2-O 2.95Å
348	I	95.8	Very high	94.3	Very high	18 Å²	18	68.3 Å²	68.3	9%	0.092	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75.5	137.1	167	-54.5	-57	0	0	0	108.5	P35 V40	P35-I348 WeakPolarHBondContact CB-O 3.5Å; P35-I348 WeakPolarHBondContact CG-O 3.43Å; V40-I348 HydrophobicContact CG2-CG2 3.73Å
349	K	96	Very high	94.2	Very high	70 Å²	70	67.2 Å²	67.2	30%	0.304	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.6	178.7	-58.9	-175.7	179.1	-174.9	0	110.9	A330 S331 M351	A330-K349 CarbonylContact C-O 3.54Å; A330-K349 WeakPolarHBondContact CA-O 3Å; S331-K349 PolarHBondContact N-O 2.93Å; S331-K349 PolarHBondContact O-N 2.96Å; K349-M351 HydrophobicContact CB-SD 4.11Å; K349-M351 HydrophobicContact CD-SD 4.35Å
350	I	97	Very high	94.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.9	163.6	-57.3	168.8	0	0	0	106.4	V32 P36 V40 L43 L55 A57 W67 C328 A330	V32-I350 HydrophobicContact CB-CB 3.92Å; V32-I350 HydrophobicContact CB-CG2 4.27Å; V32-I350 HydrophobicContact CG2-CB 3.78Å; V32-I350 HydrophobicContact CG2-CG2 3.57Å; V32-I350 PolarHBondContact N-O 2.8Å; P36-I350 HydrophobicContact CG-CD1 4.33Å; V40-I350 HydrophobicContact CG2-CD1 4.11Å; V40-I350 HydrophobicContact CG2-CG1 3.95Å; L43-I350 HydrophobicContact CD1-CG2 4.37Å; L43-I350 HydrophobicContact CD2-CD1 4.07Å; L43-I350 HydrophobicContact CD2-CG1 4.44Å; L43-I350 HydrophobicContact CD2-CG2 4.01Å; L55-I350 HydrophobicContact CD2-CG2 4.14Å; A57-I350 HydrophobicContact CB-CD1 3.86Å; W67-I350 HydrophobicContact CH2-CD1 3.96Å; W67-I350 HydrophobicContact CZ3-CD1 4.31Å; C328-I350 WeakPolarHBondContact SG-CG2 3.33Å; A330-I350 HydrophobicContact CB-CG1 4.34Å
351	M	95.2	Very high	93.9	Very high	32 Å²	32	58 Å²	58	16%	0.158	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.3	-176.1	-55.8	-56.6	-66.9	0	0	109.5	A30 E31 C328 Y329 K349	A30-M351 CarbonylContact O-C 3.58Å; A30-M351 WeakPolarHBondContact O-CA 3.5Å; E31-M351 HydrophobicContact CB-CE 4.28Å; E31-M351 HydrophobicContact CB-SD 3.99Å; E31-M351 HydrophobicContact CG-SD 3.9Å; C328-M351 CarbonylContact C-O 3.52Å; C328-M351 WeakPolarHBondContact CA-O 3.34Å; C328-M351 PolarHBondContact SG-O 2.99Å; Y329-M351 HydrophobicContact CD1-CB 4.16Å; Y329-M351 HydrophobicContact CD2-CB 4.03Å; Y329-M351 HydrophobicContact CD2-CG 4.28Å; Y329-M351 HydrophobicContact CE1-CB 3.66Å; Y329-M351 HydrophobicContact CE2-CB 3.53Å; Y329-M351 HydrophobicContact CE2-CG 3.6Å; Y329-M351 HydrophobicContact CG-CB 4.34Å; Y329-M351 PolarHBondContact N-O 2.88Å; Y329-M351 PolarHBondContact O-N 2.9Å; K349-M351 HydrophobicContact CB-SD 4.11Å; K349-M351 HydrophobicContact CD-SD 4.35Å
352	M	93.7	Very high	93.4	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.015	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.5	173.4	-65.6	-173.5	-63	0	0	108.8	T29 A30 V32 V69 G73 T75 V326 F327 C328	T29-M352 CarbonylContact C-O 3.49Å; T29-M352 WeakPolarHBondContact CA-O 3.12Å; A30-M352 HydrophobicContact CB-CE 4.36Å; A30-M352 PolarHBondContact N-O 3.37Å; A30-M352 PolarHBondContact O-N 3.37Å; V32-M352 HydrophobicContact CG2-CE 4.15Å; V32-M352 HydrophobicContact CG2-CG 4.19Å; V32-M352 HydrophobicContact CG2-SD 4.26Å; V69-M352 HydrophobicContact CG1-CE 4.46Å; V69-M352 HydrophobicContact CG1-SD 4.09Å; V69-M352 HydrophobicContact CG2-SD 4.49Å; G73-M352 WeakPolarHBondContact O-CE 3.19Å; T75-M352 HydrophobicContact CG2-CE 3.44Å; T75-M352 VanDerWaalsContact CG2-CE 3.44Å; T75-M352 HydrophobicContact CG2-SD 4.19Å; V326-M352 HydrophobicContact CG1-CB 3.8Å; V326-M352 HydrophobicContact CG1-CG 4.24Å; F327-M352 CarbonylContact O-C 3.58Å; C328-M352 HydrophobicContact CB-CG 4.25Å
353	R	92.4	Very high	92.3	Very high	35 Å²	35	64.9 Å²	64.9	13%	0.132	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.9	-176.4	178.2	178.6	178.1	109.6	-0.7	111	K28 T29 Y294 V326 F327 C355 D358	K28-R353 CarbonylContact O-C 3.47Å; K28-R353 VanDerWaalsContact O-CA 3.27Å; K28-R353 WeakPolarHBondContact O-CA 2.95Å; T29-R353 HydrophobicContact CG2-CB 3.97Å; T29-R353 HydrophobicContact CG2-CG 3.92Å; Y294-R353 WeakPolarHBondContact OH-CD 3.22Å; Y294-R353 VanDerWaalsContact OH-CZ 3.29Å; Y294-R353 PolarHBondContact OH-NE 2.71Å; Y294-R353 PolarHBondContact OH-NH1 3.36Å; V326-R353 CarbonylContact C-O 3.53Å; V326-R353 VanDerWaalsContact CA-O 3.31Å; V326-R353 WeakPolarHBondContact CA-O 3.41Å; F327-R353 PolarHBondContact N-O 2.74Å; F327-R353 PolarHBondContact O-N 2.99Å; R353-C355 PolarHBondContact O-N 2.88Å; R353-D358 IonicContact CZ-OD2 3.08Å; R353-D358 IonicContact NE-OD2 2.63Å; R353-D358 PolarHBondContact NE-OD2 3.06Å; R353-D358 IonicContact NH2-OD2 3.47Å; R353-D358 PolarHBondContact NH2-OD2 2.82Å
354	L	92.9	Very high	90.5	Very high	57 Å²	57	70.1 Å²	70.1	30%	0.298	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	120.6	165.6	-64.8	177.4	0	0	0	110	M23 K28 Q325 V326	M23-L354 HydrophobicContact CB-CD1 4.03Å; M23-L354 HydrophobicContact CE-CD1 4.13Å; M23-L354 HydrophobicContact CE-CG 4.02Å; M23-L354 HydrophobicContact SD-CD1 4.22Å; M23-L354 HydrophobicContact SD-CD2 3.99Å; M23-L354 HydrophobicContact SD-CG 3.94Å; K28-L354 PolarHBondContact O-N 2.98Å; Q325-L354 WeakPolarHBondContact O-CA 3.35Å; V326-L354 HydrophobicContact CG2-CD2 4.19Å
355	C	93.3	Very high	87.9	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	39%	0.388	C	S	.	.			trans	-124.8	-7.7	-169	62.9	0	0	0	0	115.5	F296 F320 G324 Q325 F327 R353 E357 D358 M359	F296-C355 HydrophobicContact CE2-CB 4.29Å; F296-C355 HydrophobicContact CZ-CB 4.26Å; F320-C355 VanDerWaalsContact CE1-SG 3.6Å; G324-C355 PolarHBondContact O-SG 3.47Å; Q325-C355 PolarHBondContact O-N 3.18Å; F327-C355 HydrophobicContact CB-CB 3.74Å; F327-C355 PolarHBondContact N-SG 2.83Å; F327-C355 VanDerWaalsContact N-SG 3.44Å; R353-C355 PolarHBondContact O-N 2.88Å; C355-E357 VanDerWaalsContact C-N 3.34Å; C355-E357 PolarHBondContact O-N 3.12Å; C355-D358 PolarHBondContact O-N 2.96Å; C355-D358 VanDerWaalsContact O-N 3.08Å; C355-M359 HydrophobicContact CB-CG 4.01Å; C355-M359 WeakPolarHBondContact O-CB 3.08Å; C355-M359 VanDerWaalsContact O-CG 3.24Å; C355-M359 WeakPolarHBondContact O-CG 3.11Å; C355-M359 PolarHBondContact O-N 2.87Å
356	M	92.1	Very high	87.7	Confident	67 Å²	67	71.7 Å²	71.7	33%	0.33	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-47.7	-170.1	-164	72.8	177.5	0	0	113.3	H279 V281 H282 M359 T360	H279-M356 VanDerWaalsContact CE1-SD 3.57Å; V281-M356 HydrophobicContact CB-CE 4.13Å; V281-M356 HydrophobicContact CG1-CE 3.97Å; V281-M356 HydrophobicContact CG2-CE 4.33Å; H282-M356 WeakPolarHBondContact NE2-CE 3.21Å; M356-M359 PolarHBondContact O-N 3.39Å; M356-T360 PolarHBondContact O-N 3.17Å; M356-T360 PolarHBondContact O-OG1 2.92Å
357	E	92.1	Very high	87.3	Confident	157 Å²	157	70.5 Å²	70.5	73%	0.734	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-46.3	178.3	-65.4	179	170	0	0	111.9	C355 M359 T360	C355-E357 VanDerWaalsContact C-N 3.34Å; C355-E357 PolarHBondContact O-N 3.12Å; E357-M359 PolarHBondContact O-N 3.1Å; E357-T360 PolarHBondContact O-N 3.01Å
358	D	93.2	Very high	87	Confident	35 Å²	35	70.1 Å²	70.1	19%	0.187	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.5	-178.1	-62.4	-19.7	0	0	0	112.3	F296 R353 C355	F296-D358 HydrophobicContact CD2-CB 3.83Å; F296-D358 HydrophobicContact CE2-CB 3.81Å; R353-D358 IonicContact CZ-OD2 3.08Å; R353-D358 IonicContact NE-OD2 2.63Å; R353-D358 PolarHBondContact NE-OD2 3.06Å; R353-D358 IonicContact NH2-OD2 3.47Å; R353-D358 PolarHBondContact NH2-OD2 2.82Å; C355-D358 PolarHBondContact O-N 2.96Å; C355-D358 VanDerWaalsContact O-N 3.08Å
359	M	95.2	Very high	86.5	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-2.3	-178.2	-67.6	-67.8	-70.7	0	0	113.7	H279 T284 F296 F320 C355 M356 E357 P361	H279-M359 HydrophobicContact CB-CE 3.7Å; T284-M359 WeakPolarHBondContact CG2-O 3.18Å; T284-M359 WeakPolarHBondContact OG1-CE 3.15Å; T284-M359 PolarHBondContact OG1-O 2.98Å; F296-M359 HydrophobicContact CB-SD 3.46Å; F296-M359 WeakPolarHBondContact CB-SD 3.34Å; F296-M359 HydrophobicContact CD1-CE 4.42Å; F296-M359 HydrophobicContact CD1-SD 3.34Å; F296-M359 WeakPolarHBondContact CD1-SD 3.31Å; F296-M359 HydrophobicContact CD2-CG 4.06Å; F296-M359 HydrophobicContact CD2-SD 3.41Å; F296-M359 WeakPolarHBondContact CD2-SD 3.44Å; F296-M359 HydrophobicContact CE1-SD 3.85Å; F296-M359 HydrophobicContact CE2-CG 4.22Å; F296-M359 HydrophobicContact CE2-SD 3.93Å; F296-M359 HydrophobicContact CG-CG 4.34Å; F296-M359 HydrophobicContact CG-SD 3.11Å; F296-M359 WeakPolarHBondContact CG-SD 3.4Å; F296-M359 HydrophobicContact CZ-SD 4.13Å; F320-M359 HydrophobicContact CE1-CE 4.07Å; F320-M359 HydrophobicContact CE1-CG 4.38Å; F320-M359 HydrophobicContact CE2-CE 4.17Å; F320-M359 HydrophobicContact CZ-CE 3.42Å; F320-M359 VanDerWaalsContact CZ-CE 3.42Å; F320-M359 HydrophobicContact CZ-SD 4.18Å; C355-M359 HydrophobicContact CB-CG 4.01Å; C355-M359 WeakPolarHBondContact O-CB 3.08Å; C355-M359 VanDerWaalsContact O-CG 3.24Å; C355-M359 WeakPolarHBondContact O-CG 3.11Å; C355-M359 PolarHBondContact O-N 2.87Å; M356-M359 PolarHBondContact O-N 3.39Å; E357-M359 PolarHBondContact O-N 3.1Å; M359-P361 WeakPolarHBondContact O-CD 3.26Å
360	T	95.2	Very high	85.9	Confident	69 Å²	69	73.3 Å²	73.3	42%	0.423	39%	0.386	S	S	.	.	S	Bend	trans	-75	126.1	-178.5	-64.6	0	0	0	0	110.4	M356 E357	M356-T360 PolarHBondContact O-N 3.17Å; M356-T360 PolarHBondContact O-OG1 2.92Å; E357-T360 PolarHBondContact O-N 3.01Å
361	P	92.1	Very high	85.2	Confident	47 Å²	47	78.2 Å²	78.2	31%	0.305	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-55.2	141.2	173.2	-26.8	35	0	0	0	112.2	T284 M359	T284-P361 HydrophobicContact CG2-CG 3.79Å; M359-P361 WeakPolarHBondContact O-CD 3.26Å
362	G	84	Confident	84.4	Confident	54 Å²	54	81.5 Å²	81.5	56%	0.557	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-58.7	142.8	171.8	0	0	0	0	0	110.9	K364	G362-K364 PolarHBondContact O-N 3.14Å; G362-K364 VanDerWaalsContact O-N 3.16Å
363	R	72.6	Confident	83.7	Confident	248 Å²	248	87.5 Å²	87.5	94%	0.936	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-57.6	124.4	171.2	-69.7	-174.6	-174.1	-177.5	2.4	107.8	S365	R363-S365 PolarHBondContact O-N 3.46Å
364	K	56.8	Low	83	Confident	181 Å²	181	91.9 Å²	91.9	79%	0.787	49%	0.489	S	S	*	.			trans	-59.2	113.9	169.4	-74.3	-173.3	175.1	-171.5	0	107.6	G362	G362-K364 PolarHBondContact O-N 3.14Å; G362-K364 VanDerWaalsContact O-N 3.16Å
365	S	36.7	Very low	82.1	Confident	188 Å²	188	95.1 Å²	95.1	100%	1.315	51%	0.507	S	S	*	.			trans	-65.3	0	170.3	58.1	0	0	0	0	111.1	R363	R363-S365 PolarHBondContact O-N 3.46Å

Retrieved 365 of 365 residues in 70.6 ms (Link to these results)

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