A0A077Z700_TRITR Loading...

DUF1794 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z700, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 192 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	52.7	Low	56.9	Low	227 Å²	227	128.2 Å²	128.2	100%	1.118	66%	0.664	S	S	*	*				0	59.5	0	-154.9	169.9	99.1	0	0	110
2	H	58.8	Low	56.7	Low	174 Å²	174	127.2 Å²	127.2	81%	0.806	66%	0.659	S	S	*	*			trans	-138.5	8.4	-171.8	-68.2	-57.3	0	0	0	115.6
3	L	57.3	Low	56.5	Low	159 Å²	159	129 Å²	129	83%	0.832	66%	0.663	S	S	*	*	S	Bend	trans	-86.2	-5.6	-177.8	-118.1	86	0	0	0	115.3
4	L	55.3	Low	56.1	Low	140 Å²	140	126.2 Å²	126.2	73%	0.733	66%	0.655	S	S	*	*	S	Bend	trans	-90.8	-14.9	-174.7	-81.5	156.6	0	0	0	114.5	C8	L4-C8 PolarHBondContact O-N 3.4Å
5	W	56.7	Low	55.9	Low	219 Å²	219	131.5 Å²	131.5	83%	0.83	67%	0.665	S	S	*	*	H	α-helix	trans	-65.3	-45.8	-178.4	-167.9	-73.1	0	0	0	114.6	V7 C8 A9	W5-V7 VanDerWaalsContact C-N 3.31Å; W5-V7 PolarHBondContact O-N 3.41Å; W5-C8 PolarHBondContact O-N 3.39Å; W5-A9 PolarHBondContact O-N 3.39Å
6	P	56.3	Low	55.4	Low	79 Å²	79	129.1 Å²	129.1	51%	0.513	66%	0.663	S	S	.	*	H	α-helix	trans	-69.3	-29.9	-176.9	24.5	-31.4	0	0	0	112.8	A9 L10	P6-A9 PolarHBondContact O-N 3.19Å; P6-L10 PolarHBondContact O-N 3.07Å
7	V	60.7	Low	55.2	Low	81 Å²	81	126.1 Å²	126.1	49%	0.491	66%	0.662	S	S	.	*	H	α-helix	trans	-69.2	-41.7	178.2	-178.1	0	0	0	0	110.9	W5 A9 L10 L11	W5-V7 VanDerWaalsContact C-N 3.31Å; W5-V7 PolarHBondContact O-N 3.41Å; V7-A9 VanDerWaalsContact C-N 3.35Å; V7-A9 PolarHBondContact O-N 3.29Å; V7-L10 PolarHBondContact O-N 2.98Å; V7-L11 HydrophobicContact CG1-CD1 3.9Å; V7-L11 HydrophobicContact CG1-CG 4.46Å; V7-L11 WeakPolarHBondContact O-CB 3.46Å; V7-L11 WeakPolarHBondContact O-CG 3.3Å; V7-L11 PolarHBondContact O-N 2.86Å
8	C	56.7	Low	55.2	Low	70 Å²	70	125.7 Å²	125.7	47%	0.473	67%	0.665	S	S	.	*	H	α-helix	trans	-63.5	-39.4	174.2	-78.9	0	0	0	0	112.2	L4 W5 L11 L12	L4-C8 PolarHBondContact O-N 3.4Å; W5-C8 PolarHBondContact O-N 3.39Å; C8-L11 PolarHBondContact O-N 3.39Å; C8-L12 WeakPolarHBondContact O-CB 3.4Å; C8-L12 VanDerWaalsContact O-CD1 3.3Å; C8-L12 WeakPolarHBondContact O-CD1 3.33Å; C8-L12 PolarHBondContact O-N 3.03Å
9	A	58.3	Low	55.5	Low	46 Å²	46	124.2 Å²	124.2	38%	0.38	67%	0.673	S	S	.	*	H	α-helix	trans	-65.4	-39.9	177.7	0	0	0	0	0	112.5	W5 P6 V7 Q13	W5-A9 PolarHBondContact O-N 3.39Å; P6-A9 PolarHBondContact O-N 3.19Å; V7-A9 VanDerWaalsContact C-N 3.35Å; V7-A9 PolarHBondContact O-N 3.29Å; A9-Q13 WeakPolarHBondContact O-CG 3.43Å; A9-Q13 PolarHBondContact O-N 3.39Å
10	L	56.6	Low	56.2	Low	121 Å²	121	126.7 Å²	126.7	63%	0.634	68%	0.68	S	S	*	*	H	α-helix	trans	-67.2	-42	175.5	-132.5	92.3	0	0	0	111.5	P6 V7 Q13 T14	P6-L10 PolarHBondContact O-N 3.07Å; V7-L10 PolarHBondContact O-N 2.98Å; L10-Q13 PolarHBondContact O-N 3.39Å; L10-T14 PolarHBondContact O-N 2.96Å; L10-T14 PolarHBondContact O-OG1 3.48Å
11	L	57	Low	57.2	Low	94 Å²	94	124.6 Å²	124.6	49%	0.492	67%	0.668	S	S	.	*	H	α-helix	trans	-65.4	-39.6	177.1	-73.8	169	0	0	0	111.8	V7 C8 T14 Y15	V7-L11 HydrophobicContact CG1-CD1 3.9Å; V7-L11 HydrophobicContact CG1-CG 4.46Å; V7-L11 WeakPolarHBondContact O-CB 3.46Å; V7-L11 WeakPolarHBondContact O-CG 3.3Å; V7-L11 PolarHBondContact O-N 2.86Å; C8-L11 PolarHBondContact O-N 3.39Å; L11-T14 WeakPolarHBondContact CA-OG1 3.45Å; L11-T14 PolarHBondContact O-N 3.23Å; L11-T14 PolarHBondContact O-OG1 3.23Å; L11-Y15 WeakPolarHBondContact O-CD2 3.38Å; L11-Y15 PolarHBondContact O-N 3.44Å
12	L	54.1	Low	58.8	Low	116 Å²	116	115.5 Å²	115.5	61%	0.607	63%	0.627	S	S	*	*	H	α-helix	trans	-67.1	-36.3	173.8	-95.5	118.9	0	0	0	112.6	C8 T14 Y15 C16	C8-L12 WeakPolarHBondContact O-CB 3.4Å; C8-L12 VanDerWaalsContact O-CD1 3.3Å; C8-L12 WeakPolarHBondContact O-CD1 3.33Å; C8-L12 PolarHBondContact O-N 3.03Å; L12-T14 VanDerWaalsContact C-N 3.29Å; L12-T14 PolarHBondContact O-N 2.72Å; L12-Y15 PolarHBondContact O-N 3.08Å; L12-C16 PolarHBondContact O-N 3Å; L12-C16 VanDerWaalsContact O-N 3.08Å
13	Q	53.5	Low	60	Low	151 Å²	151	110.4 Å²	110.4	71%	0.706	61%	0.609	S	S	*	*	H	α-helix	trans	-64.2	-33.6	172.1	-78.4	-177.4	-0.6	0	0	112.2	A9 L10	A9-Q13 WeakPolarHBondContact O-CG 3.43Å; A9-Q13 PolarHBondContact O-N 3.39Å; L10-Q13 PolarHBondContact O-N 3.39Å
14	T	52	Low	61.6	Low	90 Å²	90	105.6 Å²	105.6	55%	0.552	58%	0.581	S	S	*	*	H	α-helix	trans	-74.2	-28	173.4	53.3	0	0	0	0	113.8	L10 L11 L12 A17	L10-T14 PolarHBondContact O-N 2.96Å; L10-T14 PolarHBondContact O-OG1 3.48Å; L11-T14 WeakPolarHBondContact CA-OG1 3.45Å; L11-T14 PolarHBondContact O-N 3.23Å; L11-T14 PolarHBondContact O-OG1 3.23Å; L12-T14 VanDerWaalsContact C-N 3.29Å; L12-T14 PolarHBondContact O-N 2.72Å; T14-A17 PolarHBondContact O-N 3.39Å
15	Y	52.9	Low	63.3	Low	205 Å²	205	99.1 Å²	99.1	80%	0.804	55%	0.547	S	S	*	.	H	α-helix	trans	-79.9	-22.9	177.4	-96.6	-85.9	0	0	0	113.6	L11 L12 A17	L11-Y15 WeakPolarHBondContact O-CD2 3.38Å; L11-Y15 PolarHBondContact O-N 3.44Å; L12-Y15 PolarHBondContact O-N 3.08Å; Y15-A17 PolarHBondContact O-N 3.17Å; Y15-A17 VanDerWaalsContact O-N 3.17Å
16	C	48	Very low	64.9	Low	94 Å²	94	89.6 Å²	89.6	64%	0.635	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	33.8	165.7	-71.2	0	0	0	0	112.4	L12 T18	L12-C16 PolarHBondContact O-N 3Å; L12-C16 VanDerWaalsContact O-N 3.08Å; C16-T18 PolarHBondContact O-N 2.96Å
17	A	52.1	Low	66.4	Low	78 Å²	78	90 Å²	90	65%	0.645	51%	0.513	S	S	*	.			trans	-63	79	150.6	0	0	0	0	0	106.9	T14 Y15 A19	T14-A17 PolarHBondContact O-N 3.39Å; Y15-A17 PolarHBondContact O-N 3.17Å; Y15-A17 VanDerWaalsContact O-N 3.17Å; A17-A19 PolarHBondContact O-N 2.75Å
18	T	54.8	Low	67.7	Low	118 Å²	118	96 Å²	96	72%	0.724	53%	0.527	S	S	*	.			trans	-42.5	115.1	162.1	31.1	0	0	0	0	105.6	C16 Q20	C16-T18 PolarHBondContact O-N 2.96Å; T18-Q20 WeakPolarHBondContact O-CA 3.35Å; T18-Q20 PolarHBondContact O-N 3.25Å
19	A	60.5	Low	69.2	Low	98 Å²	98	97.7 Å²	97.7	81%	0.81	52%	0.523	S	S	*	.			trans	-54.5	97.3	177.3	0	0	0	0	0	106.6	A17 I21	A17-A19 PolarHBondContact O-N 2.75Å; A19-I21 PolarHBondContact O-N 2.71Å
20	Q	70.2	Confident	70.6	Confident	173 Å²	173	96 Å²	96	81%	0.808	51%	0.508	S	S	*	.			trans	-71.1	113.7	-167.8	-172.2	175.6	-36.4	0	0	105.3	T18 S22	T18-Q20 WeakPolarHBondContact O-CA 3.35Å; T18-Q20 PolarHBondContact O-N 3.25Å; Q20-S22 PolarHBondContact O-N 3.12Å; Q20-S22 VanDerWaalsContact O-N 3.11Å
21	I	77.2	Confident	72.1	Confident	83 Å²	83	90.9 Å²	90.9	43%	0.426	48%	0.482	S	S	.	.			trans	-51.7	124.4	178.2	-63.5	171.7	0	0	0	106.9	A19 P23 D26	A19-I21 PolarHBondContact O-N 2.71Å; I21-P23 WeakPolarHBondContact O-CD 3.23Å; I21-D26 HydrophobicContact CG2-CB 4.19Å
22	S	85.1	Confident	73.5	Confident	37 Å²	37	92 Å²	92	26%	0.259	49%	0.488	S	S	.	.			trans	-55.9	127.4	177.6	175.5	0	0	0	0	108.2	Q20 K24 Y25 D26	Q20-S22 PolarHBondContact O-N 3.12Å; Q20-S22 VanDerWaalsContact O-N 3.11Å; S22-K24 PolarHBondContact O-N 2.66Å; S22-Y25 PolarHBondContact O-N 2.94Å; S22-D26 PolarHBondContact O-N 3.36Å
23	P	85	Confident	75	Confident	66 Å²	66	88.1 Å²	88.1	43%	0.429	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-26.6	-179.5	-28.1	34.6	0	0	0	113.3	I21 Y25 D26 R29	I21-P23 WeakPolarHBondContact O-CD 3.23Å; P23-Y25 PolarHBondContact O-N 2.88Å; P23-D26 PolarHBondContact O-N 3.02Å; P23-R29 PolarHBondContact O-NH1 3.11Å
24	K	89.7	Confident	76.8	Confident	58 Å²	58	81 Å²	81	25%	0.252	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.1	175.5	-174.9	-178.9	-177.4	-171.3	0	113.7	S22 D64 I67	S22-K24 PolarHBondContact O-N 2.66Å; K24-D64 WeakPolarHBondContact CE-OD1 3.48Å; K24-D64 IonicContact NZ-OD1 3.56Å; K24-D64 PolarHBondContact NZ-OD1 2.75Å; K24-D64 IonicContact NZ-OD2 2.75Å; K24-I67 WeakPolarHBondContact O-CG1 3.33Å; K24-I67 PolarHBondContact O-N 2.76Å
25	Y	91.9	Very high	78.7	Confident	5 Å²	5	84.4 Å²	84.4	2%	0.02	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-0.7	-175.7	-50.9	-48.3	0	0	0	113.1	S22 P23 V27 G42 D64 F65 Q191	S22-Y25 PolarHBondContact O-N 2.94Å; P23-Y25 PolarHBondContact O-N 2.88Å; Y25-V27 PolarHBondContact O-N 3.05Å; Y25-G42 VanDerWaalsContact CD1-CA 3.47Å; Y25-D64 VanDerWaalsContact OH-CG 3.31Å; Y25-D64 PolarHBondContact OH-OD1 2.81Å; Y25-D64 PolarHBondContact OH-OD2 3.49Å; Y25-F65 WeakPolarHBondContact CD1-O 3.23Å; Y25-F65 WeakPolarHBondContact CE1-O 3.47Å; Y25-Q191 HydrophobicContact CD2-CG 4.19Å; Y25-Q191 HydrophobicContact CE2-CB 4.25Å; Y25-Q191 HydrophobicContact CE2-CG 3.77Å
26	D	89.4	Confident	80.6	Confident	18 Å²	18	76 Å²	76	10%	0.096	41%	0.408	C	S	.	.			trans	-68.3	104.8	-179.2	-173.1	-7.2	0	0	0	111.6	I21 S22 P23 R28 R29 I67	I21-D26 HydrophobicContact CG2-CB 4.19Å; S22-D26 PolarHBondContact O-N 3.36Å; P23-D26 PolarHBondContact O-N 3.02Å; D26-R28 PolarHBondContact O-N 3.31Å; D26-R28 VanDerWaalsContact OD1-CB 3.23Å; D26-R28 WeakPolarHBondContact OD1-CB 3.29Å; D26-R28 WeakPolarHBondContact OD1-CG 3.32Å; D26-R28 IonicContact OD1-CZ 3.72Å; D26-R28 PolarHBondContact OD1-N 2.9Å; D26-R28 IonicContact OD1-NE 2.88Å; D26-R28 PolarHBondContact OD1-NE 3.06Å; D26-R28 IonicContact OD1-NH2 3.69Å; D26-R28 IonicContact OD2-CZ 3.31Å; D26-R28 VanDerWaalsContact OD2-CZ 3.31Å; D26-R28 IonicContact OD2-NE 3.12Å; D26-R28 PolarHBondContact OD2-NE 2.95Å; D26-R28 VanDerWaalsContact OD2-NE 3.12Å; D26-R28 IonicContact OD2-NH2 2.71Å; D26-R28 PolarHBondContact OD2-NH2 3.03Å; D26-R29 HydrophobicContact CB-CG 4.19Å; D26-R29 WeakPolarHBondContact O-CB 3.2Å; D26-R29 PolarHBondContact O-N 3.28Å; D26-I67 WeakPolarHBondContact O-CD1 3.34Å
27	V	88.6	Confident	82.9	Confident	88 Å²	88	71.5 Å²	71.5	53%	0.533	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-56.3	-25.5	179.2	-176.1	0	0	0	0	112.4	Y25 R29 L30 L41	Y25-V27 PolarHBondContact O-N 3.05Å; V27-R29 PolarHBondContact O-N 2.85Å; V27-L30 HydrophobicContact CG1-CD2 4.48Å; V27-L30 WeakPolarHBondContact O-CB 3.4Å; V27-L30 PolarHBondContact O-N 3.18Å; V27-L41 HydrophobicContact CG2-CD1 4Å
28	R	88.1	Confident	84.9	Confident	206 Å²	206	68 Å²	68	78%	0.777	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-67	-25.2	177.2	-58.3	171.4	-65.2	-178.8	3.3	112.2	D26 L30	D26-R28 PolarHBondContact O-N 3.31Å; D26-R28 VanDerWaalsContact OD1-CB 3.23Å; D26-R28 WeakPolarHBondContact OD1-CB 3.29Å; D26-R28 WeakPolarHBondContact OD1-CG 3.32Å; D26-R28 IonicContact OD1-CZ 3.72Å; D26-R28 PolarHBondContact OD1-N 2.9Å; D26-R28 IonicContact OD1-NE 2.88Å; D26-R28 PolarHBondContact OD1-NE 3.06Å; D26-R28 IonicContact OD1-NH2 3.69Å; D26-R28 IonicContact OD2-CZ 3.31Å; D26-R28 VanDerWaalsContact OD2-CZ 3.31Å; D26-R28 IonicContact OD2-NE 3.12Å; D26-R28 PolarHBondContact OD2-NE 2.95Å; D26-R28 VanDerWaalsContact OD2-NE 3.12Å; D26-R28 IonicContact OD2-NH2 2.71Å; D26-R28 PolarHBondContact OD2-NH2 3.03Å; R28-L30 VanDerWaalsContact C-N 3.33Å
29	R	87.3	Confident	86.8	Confident	107 Å²	107	65.5 Å²	65.5	40%	0.404	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-87.4	-5	175.3	-60.5	-179.5	69	-142.2	1.5	112.4	P23 D26 V27 P31 I67 D68	P23-R29 PolarHBondContact O-NH1 3.11Å; D26-R29 HydrophobicContact CB-CG 4.19Å; D26-R29 WeakPolarHBondContact O-CB 3.2Å; D26-R29 PolarHBondContact O-N 3.28Å; V27-R29 PolarHBondContact O-N 2.85Å; R29-P31 VanDerWaalsContact O-CD 3.32Å; R29-P31 WeakPolarHBondContact O-CD 3.12Å; R29-I67 HydrophobicContact CB-CD1 4.22Å; R29-D68 IonicContact CZ-OD2 3.46Å; R29-D68 IonicContact NH1-OD2 3.61Å; R29-D68 PolarHBondContact NH1-OD2 3.15Å; R29-D68 IonicContact NH2-OD1 3.79Å; R29-D68 IonicContact NH2-OD2 3.25Å; R29-D68 PolarHBondContact NH2-OD2 3.33Å
30	L	89.1	Confident	88.5	Confident	9 Å²	9	60.8 Å²	60.8	5%	0.047	29%	0.29	C	S	.	.	S	Bend	trans	-71.8	122.4	-177.1	-170.2	65.8	0	0	0	110.7	V27 R28 L34 R35 L41 I67 L78	V27-L30 HydrophobicContact CG1-CD2 4.48Å; V27-L30 WeakPolarHBondContact O-CB 3.4Å; V27-L30 PolarHBondContact O-N 3.18Å; R28-L30 VanDerWaalsContact C-N 3.33Å; L30-L34 HydrophobicContact CD1-CB 3.51Å; L30-L34 HydrophobicContact CD1-CD1 4.11Å; L30-L34 HydrophobicContact CD1-CG 4.47Å; L30-L34 HydrophobicContact CD2-CB 4.41Å; L30-L34 HydrophobicContact CG-CB 3.91Å; L30-R35 HydrophobicContact CD2-CG 4.45Å; L30-L41 HydrophobicContact CD1-CD1 4.11Å; L30-L41 HydrophobicContact CD2-CD1 4.15Å; L30-I67 HydrophobicContact CB-CD1 4.07Å; L30-I67 HydrophobicContact CD1-CD1 4.07Å; L30-I67 HydrophobicContact CD1-CG1 3.93Å; L30-L78 HydrophobicContact CD1-CD2 3.72Å
31	P	87.8	Confident	89.7	Confident	14 Å²	14	52.7 Å²	52.7	9%	0.091	25%	0.252	C	S	.	.			trans	-54	148.5	171.6	-29.2	38.8	0	0	0	113	R29 D33 L34 R35 L70 R76	R29-P31 VanDerWaalsContact O-CD 3.32Å; R29-P31 WeakPolarHBondContact O-CD 3.12Å; P31-D33 WeakPolarHBondContact CB-OD1 3.28Å; P31-D33 PolarHBondContact O-N 2.82Å; P31-L34 HydrophobicContact CG-CD1 4.41Å; P31-L34 PolarHBondContact O-N 3.01Å; P31-R35 PolarHBondContact O-N 3.2Å; P31-L70 HydrophobicContact CG-CD1 4.38Å; P31-L70 HydrophobicContact CG-CD2 4.24Å; P31-R76 VanDerWaalsContact CB-CD 3.47Å
32	L	86.4	Confident	90.6	Very high	118 Å²	118	48.8 Å²	48.8	62%	0.618	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-57.2	-35.8	-175	-69.4	178.3	0	0	0	113.1	L34 R35	L32-L34 VanDerWaalsContact C-N 3.32Å; L32-R35 WeakPolarHBondContact O-CB 3.45Å; L32-R35 PolarHBondContact O-N 3.39Å
33	D	86.2	Confident	91.2	Very high	35 Å²	35	51.4 Å²	51.4	19%	0.187	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-66.9	-26.7	176.7	52.2	-27.8	0	0	0	114.6	P31 P36 R76 V101 N103	P31-D33 WeakPolarHBondContact CB-OD1 3.28Å; P31-D33 PolarHBondContact O-N 2.82Å; D33-P36 WeakPolarHBondContact O-CD 3.46Å; D33-R76 WeakPolarHBondContact OD2-CB 3.35Å; D33-R76 WeakPolarHBondContact OD2-CD 3.46Å; D33-V101 VanDerWaalsContact O-CB 3.31Å; D33-V101 WeakPolarHBondContact O-CB 3.47Å; D33-V101 VanDerWaalsContact O-CG1 3.24Å; D33-V101 WeakPolarHBondContact O-CG1 3.31Å; D33-N103 VanDerWaalsContact CA-ND2 3.25Å; D33-N103 WeakPolarHBondContact CA-ND2 3.32Å; D33-N103 PolarHBondContact O-OD1 3Å
34	L	91.4	Very high	91.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-94.1	-6.4	178.7	-60.6	-179.9	0	0	0	113.4	L30 P31 L32 P36 V37 G38 R76 S77 L78 V101	L30-L34 HydrophobicContact CD1-CB 3.51Å; L30-L34 HydrophobicContact CD1-CD1 4.11Å; L30-L34 HydrophobicContact CD1-CG 4.47Å; L30-L34 HydrophobicContact CD2-CB 4.41Å; L30-L34 HydrophobicContact CG-CB 3.91Å; P31-L34 HydrophobicContact CG-CD1 4.41Å; P31-L34 PolarHBondContact O-N 3.01Å; L32-L34 VanDerWaalsContact C-N 3.32Å; L34-P36 VanDerWaalsContact C-N 3.3Å; L34-V37 VanDerWaalsContact O-CG2 3.23Å; L34-V37 WeakPolarHBondContact O-CG2 3.25Å; L34-V37 PolarHBondContact O-N 3.22Å; L34-G38 PolarHBondContact O-N 3Å; L34-G38 VanDerWaalsContact O-N 3.12Å; L34-R76 HydrophobicContact CD1-CB 4.15Å; L34-R76 HydrophobicContact CG-CB 4.4Å; L34-S77 VanDerWaalsContact CD1-C 3.46Å; L34-S77 WeakPolarHBondContact CD1-O 3.36Å; L34-L78 HydrophobicContact CD1-CD2 4.13Å; L34-L78 HydrophobicContact CD1-CG 4.49Å; L34-V101 HydrophobicContact CD2-CB 4.18Å; L34-V101 HydrophobicContact CD2-CG2 4.19Å
35	R	91.8	Very high	92.3	Very high	162 Å²	162	51.3 Å²	51.3	61%	0.611	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-51	-39.2	176.7	-72.2	-173.4	173.6	-169.9	2.6	114.6	L30 P31 L32 V37 G38	L30-R35 HydrophobicContact CD2-CG 4.45Å; P31-R35 PolarHBondContact O-N 3.2Å; L32-R35 WeakPolarHBondContact O-CB 3.45Å; L32-R35 PolarHBondContact O-N 3.39Å; R35-V37 PolarHBondContact O-N 3.45Å; R35-V37 VanDerWaalsContact O-N 3.08Å; R35-G38 PolarHBondContact O-N 2.66Å; R35-G38 VanDerWaalsContact O-N 3.08Å
36	P	92.9	Very high	92.6	Very high	29 Å²	29	51.8 Å²	51.8	19%	0.188	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.7	-24.1	178.7	-27.5	37.6	0	0	0	114.5	D33 L34 H39 V101 I111 V131	D33-P36 WeakPolarHBondContact O-CD 3.46Å; L34-P36 VanDerWaalsContact C-N 3.3Å; P36-H39 PolarHBondContact O-CE1 2.74Å; P36-V101 HydrophobicContact CB-CG1 4.43Å; P36-V101 HydrophobicContact CG-CG1 4.18Å; P36-I111 HydrophobicContact CB-CD1 4.16Å; P36-I111 HydrophobicContact CB-CG2 4.32Å; P36-I111 HydrophobicContact CG-CD1 3.96Å; P36-I111 HydrophobicContact CG-CG2 4.29Å; P36-V131 HydrophobicContact CB-CG1 4Å
37	V	94.8	Very high	93	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-115.5	7.1	179.6	-62.7	0	0	0	0	112.6	L34 R35 H39 F40 L78 L99 V101 V131 V136	L34-V37 VanDerWaalsContact O-CG2 3.23Å; L34-V37 WeakPolarHBondContact O-CG2 3.25Å; L34-V37 PolarHBondContact O-N 3.22Å; R35-V37 PolarHBondContact O-N 3.45Å; R35-V37 VanDerWaalsContact O-N 3.08Å; V37-H39 PolarHBondContact O-N 2.93Å; V37-H39 VanDerWaalsContact O-N 3.14Å; V37-F40 HydrophobicContact CB-CD2 3.93Å; V37-F40 HydrophobicContact CB-CE2 4.2Å; V37-F40 HydrophobicContact CG1-CD2 4.45Å; V37-F40 HydrophobicContact CG1-CE2 4.24Å; V37-F40 WeakPolarHBondContact O-CB 2.96Å; V37-F40 PolarHBondContact O-N 3.08Å; V37-L78 HydrophobicContact CB-CD1 4.25Å; V37-L78 HydrophobicContact CG2-CD1 3.65Å; V37-L78 HydrophobicContact CG2-CG 4.12Å; V37-L99 HydrophobicContact CB-CD2 4.11Å; V37-L99 HydrophobicContact CG1-CD2 4.17Å; V37-L99 HydrophobicContact CG2-CD2 4.25Å; V37-V101 HydrophobicContact CB-CG2 4.33Å; V37-V101 HydrophobicContact CG1-CG2 3.76Å; V37-V101 HydrophobicContact CG2-CG2 3.58Å; V37-V131 HydrophobicContact CG1-CG1 4.16Å; V37-V131 HydrophobicContact CG1-CG2 4.06Å; V37-V136 HydrophobicContact CG1-CG2 3.84Å
38	G	94.4	Very high	93.4	Very high	5 Å²	5	57 Å²	57	5%	0.052	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-63.4	-22.8	-174.1	0	0	0	0	0	114.6	L34 R35 F40 L41	L34-G38 PolarHBondContact O-N 3Å; L34-G38 VanDerWaalsContact O-N 3.12Å; R35-G38 PolarHBondContact O-N 2.66Å; R35-G38 VanDerWaalsContact O-N 3.08Å; G38-F40 PolarHBondContact O-N 3.08Å; G38-L41 VanDerWaalsContact O-CB 3.3Å; G38-L41 WeakPolarHBondContact O-CB 3.43Å; G38-L41 WeakPolarHBondContact O-CG 3.46Å; G38-L41 PolarHBondContact O-N 2.9Å; G38-L41 VanDerWaalsContact O-N 3.09Å
39	H	94.8	Very high	93.9	Very high	64 Å²	64	49.3 Å²	49.3	30%	0.296	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-67.9	-18.1	176.4	54.5	-91.8	0	0	0	112.9	P36 V37 L41 G134 I163	P36-H39 PolarHBondContact O-CE1 2.74Å; V37-H39 PolarHBondContact O-N 2.93Å; V37-H39 VanDerWaalsContact O-N 3.14Å; H39-L41 VanDerWaalsContact C-N 3.3Å; H39-G134 WeakPolarHBondContact CE1-CA 3.33Å; H39-G134 PolarHBondContact CE1-O 3.23Å; H39-G134 PolarHBondContact NE2-O 3.01Å; H39-G134 VanDerWaalsContact NE2-O 3.15Å; H39-I163 HydrophobicContact CB-CG1 4.4Å
40	F	96.8	Very high	94.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-76.1	-14.7	171.9	-59.3	-37.9	0	0	0	113.6	V37 G38 G42 W44 F65 L99 V136 L161 I163 L168	V37-F40 HydrophobicContact CB-CD2 3.93Å; V37-F40 HydrophobicContact CB-CE2 4.2Å; V37-F40 HydrophobicContact CG1-CD2 4.45Å; V37-F40 HydrophobicContact CG1-CE2 4.24Å; V37-F40 WeakPolarHBondContact O-CB 2.96Å; V37-F40 PolarHBondContact O-N 3.08Å; G38-F40 PolarHBondContact O-N 3.08Å; F40-G42 PolarHBondContact O-N 2.88Å; F40-W44 PolarHBondContact O-NE1 2.79Å; F40-F65 HydrophobicContact CB-CB 4.35Å; F40-F65 HydrophobicContact CB-CD1 4.25Å; F40-F65 HydrophobicContact CB-CD2 4.07Å; F40-F65 HydrophobicContact CB-CE2 4.43Å; F40-F65 HydrophobicContact CB-CG 3.98Å; F40-F65 WeakPolarHBondContact O-CB 3.31Å; F40-F65 WeakPolarHBondContact O-CD2 3.24Å; F40-L99 HydrophobicContact CD2-CD2 4.18Å; F40-V136 HydrophobicContact CE2-CB 4.35Å; F40-V136 HydrophobicContact CE2-CG2 3.6Å; F40-V136 HydrophobicContact CZ-CG2 4.05Å; F40-L161 HydrophobicContact CE1-CB 4.31Å; F40-L161 HydrophobicContact CE2-CB 4.16Å; F40-L161 HydrophobicContact CZ-CB 3.78Å; F40-L161 WeakPolarHBondContact CZ-O 3.33Å; F40-I163 HydrophobicContact CD1-CD1 4.1Å; F40-I163 HydrophobicContact CE1-CD1 4.25Å; F40-I163 HydrophobicContact CE1-CG1 4.48Å; F40-L168 HydrophobicContact CD1-CD1 3.71Å; F40-L168 HydrophobicContact CE1-CD1 3.65Å
41	L	95.8	Very high	94.8	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.016	24%	0.242	C	C	.	.			trans	-53.4	133.7	178.8	-74.5	175	0	0	0	111.7	V27 L30 G38 H39 I67 L78 K189	V27-L41 HydrophobicContact CG2-CD1 4Å; L30-L41 HydrophobicContact CD1-CD1 4.11Å; L30-L41 HydrophobicContact CD2-CD1 4.15Å; G38-L41 VanDerWaalsContact O-CB 3.3Å; G38-L41 WeakPolarHBondContact O-CB 3.43Å; G38-L41 WeakPolarHBondContact O-CG 3.46Å; G38-L41 PolarHBondContact O-N 2.9Å; G38-L41 VanDerWaalsContact O-N 3.09Å; H39-L41 VanDerWaalsContact C-N 3.3Å; L41-I67 HydrophobicContact CD1-CD1 3.84Å; L41-I67 HydrophobicContact CD1-CG1 4.03Å; L41-I67 HydrophobicContact CD2-CD1 4.34Å; L41-I67 HydrophobicContact CD2-CG1 3.63Å; L41-I67 HydrophobicContact CG-CG1 4.5Å; L41-L78 HydrophobicContact CD2-CD1 4.42Å; L41-L78 HydrophobicContact CD2-CD2 3.55Å; L41-L78 HydrophobicContact CG-CD2 4.32Å; L41-K189 PolarHBondContact O-NZ 3.32Å
42	G	96.2	Very high	95.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	125.5	-179.5	-178.1	0	0	0	0	0	112.8	Y25 F40 F65 Q191	Y25-G42 VanDerWaalsContact CD1-CA 3.47Å; F40-G42 PolarHBondContact O-N 2.88Å; G42-F65 PolarHBondContact N-O 2.94Å; G42-F65 PolarHBondContact O-N 2.77Å; G42-Q191 CarbonylContact C-O 3.46Å; G42-Q191 WeakPolarHBondContact CA-O 3.21Å
43	R	97.2	Very high	95.7	Very high	92 Å²	92	51 Å²	51	35%	0.347	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.7	172.9	-170.4	175.5	-76.2	175.9	-6.5	109.6	I62 L63 D64 I190 Q191	R43-I62 HydrophobicContact CG-CG2 3.71Å; R43-L63 CarbonylContact C-O 3.54Å; R43-L63 WeakPolarHBondContact CA-O 3.41Å; R43-D64 IonicContact CZ-OD2 3.48Å; R43-D64 IonicContact NE-OD2 3.21Å; R43-D64 PolarHBondContact NE-OD2 2.9Å; R43-D64 IonicContact NH2-OD2 2.66Å; R43-D64 PolarHBondContact NH2-OD2 3.28Å; R43-I190 HydrophobicContact CB-CD1 4.49Å; R43-I190 HydrophobicContact CB-CG1 4.01Å; R43-I190 HydrophobicContact CG-CD1 3.82Å; R43-I190 HydrophobicContact CG-CG1 3.84Å; R43-I190 VanDerWaalsContact O-CG1 3.32Å; R43-I190 WeakPolarHBondContact O-CG1 3.49Å; R43-I190 PolarHBondContact O-N 3.09Å; R43-Q191 HydrophobicContact CB-CB 3.93Å; R43-Q191 PolarHBondContact N-O 2.84Å; R43-Q191 PolarHBondContact O-N 2.86Å
44	W	98.4	Very high	96.1	Very high	3 Å²	3	51.3 Å²	51.3	1%	0.011	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.7	-172.6	-56.4	87	0	0	0	109.9	F40 I62 L63 F65 I163 L168 Y187 R188 K189	F40-W44 PolarHBondContact O-NE1 2.79Å; W44-I62 CarbonylContact O-C 3.6Å; W44-I62 VanDerWaalsContact O-CA 3.27Å; W44-I62 WeakPolarHBondContact O-CA 3.25Å; W44-L63 HydrophobicContact CB-CB 4.34Å; W44-L63 PolarHBondContact N-O 3.49Å; W44-L63 PolarHBondContact O-N 3.11Å; W44-F65 AromaticContact CD1-CD2 3.96Å; W44-I163 HydrophobicContact CH2-CD1 3.62Å; W44-I163 HydrophobicContact CZ2-CD1 4.05Å; W44-I163 HydrophobicContact CZ3-CD1 4.37Å; W44-L168 HydrophobicContact CB-CD2 4.24Å; W44-L168 HydrophobicContact CD2-CB 3.76Å; W44-L168 HydrophobicContact CD2-CD2 3.97Å; W44-L168 HydrophobicContact CE3-CB 3.47Å; W44-L168 VanDerWaalsContact CE3-CB 3.47Å; W44-L168 HydrophobicContact CG-CB 4.4Å; W44-L168 HydrophobicContact CG-CD2 3.84Å; W44-L168 HydrophobicContact CH2-CB 4.08Å; W44-L168 HydrophobicContact CZ2-CB 4.32Å; W44-L168 HydrophobicContact CZ3-CB 3.66Å; W44-Y187 HydrophobicContact CB-CD1 4.41Å; W44-Y187 HydrophobicContact CB-CG 4.32Å; W44-R188 CarbonylContact C-O 3.49Å; W44-R188 WeakPolarHBondContact CA-O 3.34Å; W44-K189 HydrophobicContact CD2-CB 4.26Å; W44-K189 HydrophobicContact CD2-CG 4.5Å; W44-K189 HydrophobicContact CE3-CB 3.75Å; W44-K189 HydrophobicContact CE3-CG 4.46Å; W44-K189 HydrophobicContact CH2-CB 4.15Å; W44-K189 HydrophobicContact CH2-CD 4.42Å; W44-K189 HydrophobicContact CZ2-CD 4.41Å; W44-K189 HydrophobicContact CZ3-CB 3.68Å; W44-K189 HydrophobicContact CZ3-CG 4.47Å
45	K	98.3	Very high	96.2	Very high	120 Å²	120	58.4 Å²	58.4	52%	0.522	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.9	178.9	177.8	169.6	-176.6	-177	0	110.7	Y47 I62 Y187 R188 I190	K45-Y47 PolarHBondContact O-N 2.86Å; K45-I62 HydrophobicContact CB-CD1 3.6Å; K45-I62 HydrophobicContact CD-CD1 3.97Å; K45-I62 HydrophobicContact CG-CD1 3.52Å; K45-Y187 CarbonylContact O-C 3.54Å; K45-Y187 VanDerWaalsContact O-CA 3.27Å; K45-Y187 WeakPolarHBondContact O-CA 3.38Å; K45-R188 PolarHBondContact N-O 3.34Å; K45-R188 PolarHBondContact O-N 3.31Å; K45-I190 HydrophobicContact CB-CD1 4.17Å; K45-I190 HydrophobicContact CB-CG1 4.44Å; K45-I190 HydrophobicContact CB-CG2 3.76Å
46	A	98.3	Very high	96.3	Very high	15 Å²	15	51.1 Å²	51.1	12%	0.124	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	133.5	175.5	0	0	0	0	0	109.8	R61 V185 M186 Y187	A46-R61 HydrophobicContact CB-CB 4.24Å; A46-R61 VanDerWaalsContact CB-O 3.26Å; A46-R61 WeakPolarHBondContact CB-O 3.23Å; A46-R61 PolarHBondContact N-O 3.14Å; A46-V185 HydrophobicContact CB-CG1 3.66Å; A46-M186 CarbonylContact C-O 3.51Å; A46-M186 WeakPolarHBondContact CA-O 3.36Å; A46-Y187 HydrophobicContact CB-CD1 3.73Å; A46-Y187 HydrophobicContact CB-CE1 3.7Å; A46-Y187 VanDerWaalsContact N-CD1 3.32Å
47	Y	97.9	Very high	96.5	Very high	104 Å²	104	49.9 Å²	49.9	41%	0.408	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	-14.3	176.2	70.4	-95.4	0	0	0	113	K45 D167 M186 R188	K45-Y47 PolarHBondContact O-N 2.86Å; Y47-D167 HydrophobicContact CE1-CB 4.29Å; Y47-D167 VanDerWaalsContact CE1-OD2 3.3Å; Y47-D167 WeakPolarHBondContact CE1-OD2 3.46Å; Y47-D167 VanDerWaalsContact CZ-OD2 3.24Å; Y47-D167 PolarHBondContact OH-OD2 2.74Å; Y47-M186 HydrophobicContact CD1-CB 4.25Å; Y47-M186 WeakPolarHBondContact CD1-O 3.33Å; Y47-M186 HydrophobicContact CE1-CB 3.62Å; Y47-M186 HydrophobicContact CE2-CB 3.96Å; Y47-M186 VanDerWaalsContact CZ-CB 3.45Å; Y47-M186 PolarHBondContact N-O 2.88Å; Y47-R188 HydrophobicContact CD1-CB 3.91Å; Y47-R188 HydrophobicContact CE1-CB 4.2Å
48	K	97.7	Very high	96.5	Very high	111 Å²	111	50.6 Å²	50.6	48%	0.483	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	138.7	178.8	-168.2	178.4	178.9	179.8	0	110.4	I50 V185 M186	K48-I50 HydrophobicContact CD-CD1 4.17Å; K48-I50 HydrophobicContact CD-CG1 4.24Å; K48-I50 HydrophobicContact CG-CG1 4.16Å; K48-V185 WeakPolarHBondContact O-CA 3.26Å; K48-M186 HydrophobicContact CB-CB 4.01Å; K48-M186 HydrophobicContact CB-CG 4.12Å; K48-M186 HydrophobicContact CD-CG 4.48Å; K48-M186 PolarHBondContact O-N 3.25Å
49	V	97.7	Very high	96.5	Very high	45 Å²	45	50.4 Å²	50.4	27%	0.273	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.1	169.3	-178.9	0	0	0	0	108	Y183 S184 V185	V49-Y183 HydrophobicContact CG1-CD2 3.97Å; V49-S184 CarbonylContact C-O 3.53Å; V49-S184 VanDerWaalsContact CA-O 3.3Å; V49-S184 WeakPolarHBondContact CA-O 3.15Å; V49-V185 HydrophobicContact CG2-CG1 4.16Å; V49-V185 HydrophobicContact CG2-CG2 4.19Å
50	I	97.9	Very high	96.6	Very high	81 Å²	81	47.3 Å²	47.3	42%	0.415	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.1	-179.1	-54.3	172.7	0	0	0	107.1	K48 Y183 S184	K48-I50 HydrophobicContact CD-CD1 4.17Å; K48-I50 HydrophobicContact CD-CG1 4.24Å; K48-I50 HydrophobicContact CG-CG1 4.16Å; I50-Y183 CarbonylContact O-C 3.59Å; I50-Y183 WeakPolarHBondContact O-CA 3.45Å; I50-Y183 VanDerWaalsContact O-CB 3.24Å; I50-Y183 WeakPolarHBondContact O-CB 3.3Å; I50-S184 PolarHBondContact N-O 3.19Å; I50-S184 PolarHBondContact O-N 2.79Å
51	G	97.8	Very high	96.6	Very high	43 Å²	43	51.4 Å²	51.4	44%	0.443	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	98.4	-161.3	-176	0	0	0	0	0	112.5
52	Q	96.9	Very high	96.7	Very high	155 Å²	155	53.6 Å²	53.6	72%	0.724	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	160.9	-167.9	-64.3	-63.5	-25.5	0	0	112.7	A182	Q52-A182 PolarHBondContact N-O 3.17Å; Q52-A182 CarbonylContact O-C 3.56Å; Q52-A182 PolarHBondContact O-N 2.98Å
53	G	95.9	Very high	96.8	Very high	5 Å²	5	53.6 Å²	53.6	5%	0.052	26%	0.258	C	S	.	.			trans	88.1	14.9	173.5	0	0	0	0	0	115.5	H55 V56 F57 A181	G53-H55 PolarHBondContact O-N 2.88Å; G53-V56 WeakPolarHBondContact O-CA 3.15Å; G53-V56 VanDerWaalsContact O-CB 3.27Å; G53-V56 WeakPolarHBondContact O-CB 3.3Å; G53-V56 PolarHBondContact O-N 3.38Å; G53-F57 PolarHBondContact O-N 3.04Å; G53-A181 VanDerWaalsContact O-CB 3.27Å; G53-A181 WeakPolarHBondContact O-CB 3.32Å
54	E	95.4	Very high	96.8	Very high	40 Å²	40	49.3 Å²	49.3	19%	0.187	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.2	172.9	-171.2	-169.2	166.8	0	0	112.5	V56 F57 P58 R61 Y183	E54-V56 VanDerWaalsContact C-N 3.26Å; E54-V56 PolarHBondContact O-N 3.12Å; E54-F57 CarbonylContact O-C 3.44Å; E54-P58 WeakPolarHBondContact O-CA 3.46Å; E54-P58 WeakPolarHBondContact O-CB 3.3Å; E54-R61 IonicContact OE1-CZ 3.01Å; E54-R61 IonicContact OE1-NE 2.73Å; E54-R61 PolarHBondContact OE1-NE 3.46Å; E54-R61 IonicContact OE1-NH2 2.74Å; E54-R61 PolarHBondContact OE1-NH2 2.8Å; E54-R61 IonicContact OE2-CZ 3.52Å; E54-R61 IonicContact OE2-NH2 2.67Å; E54-R61 PolarHBondContact OE2-NH2 2.86Å; E54-Y183 HydrophobicContact CB-CD1 4.41Å; E54-Y183 HydrophobicContact CB-CD2 4.46Å; E54-Y183 HydrophobicContact CB-CE1 4.17Å; E54-Y183 HydrophobicContact CB-CE2 4.2Å; E54-Y183 HydrophobicContact CG-CE1 4.49Å; E54-Y183 HydrophobicContact CG-CE2 3.98Å
55	H	93.1	Very high	96.8	Very high	150 Å²	150	49.2 Å²	49.2	69%	0.694	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.1	175.3	61.5	-84.5	0	0	0	112.8	G53	G53-H55 PolarHBondContact O-N 2.88Å
56	V	94.8	Very high	96.6	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.055	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-46.9	178	176.1	0	0	0	0	110.4	G53 E54 Y152 T176 A178 G179	G53-V56 WeakPolarHBondContact O-CA 3.15Å; G53-V56 VanDerWaalsContact O-CB 3.27Å; G53-V56 WeakPolarHBondContact O-CB 3.3Å; G53-V56 PolarHBondContact O-N 3.38Å; E54-V56 VanDerWaalsContact C-N 3.26Å; E54-V56 PolarHBondContact O-N 3.12Å; V56-Y152 WeakPolarHBondContact O-CE2 3.46Å; V56-Y152 PolarHBondContact O-OH 3.21Å; V56-T176 HydrophobicContact CG1-CG2 4.2Å; V56-T176 WeakPolarHBondContact CG1-OG1 3.2Å; V56-A178 HydrophobicContact CG1-CB 4.12Å; V56-G179 VanDerWaalsContact CG1-C 3.46Å; V56-G179 WeakPolarHBondContact CG1-O 3.45Å
57	F	96	Very high	96.2	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.009	21%	0.211	C	C	.	.	S	Bend	trans	-129.1	88.7	174.1	-172.9	-88.6	0	0	0	109.2	G53 E54 T59 L125 Y152 V154 L157 I172 A174 T176 A181 Y183	G53-F57 PolarHBondContact O-N 3.04Å; E54-F57 CarbonylContact O-C 3.44Å; F57-T59 HydrophobicContact CD1-CG2 4.11Å; F57-T59 HydrophobicContact CE1-CG2 3.84Å; F57-L125 HydrophobicContact CE2-CD1 3.99Å; F57-L125 HydrophobicContact CZ-CD1 3.82Å; F57-Y152 WeakPolarHBondContact CD2-OH 3.42Å; F57-V154 HydrophobicContact CD2-CG1 4.49Å; F57-V154 HydrophobicContact CD2-CG2 4.16Å; F57-V154 HydrophobicContact CE2-CG1 4.2Å; F57-V154 HydrophobicContact CE2-CG2 3.94Å; F57-L157 HydrophobicContact CD1-CD1 4.4Å; F57-L157 HydrophobicContact CE1-CD1 3.82Å; F57-L157 HydrophobicContact CE1-CD2 4.39Å; F57-L157 HydrophobicContact CE2-CD1 4.3Å; F57-L157 HydrophobicContact CE2-CD2 4.11Å; F57-L157 HydrophobicContact CZ-CD1 3.77Å; F57-L157 HydrophobicContact CZ-CD2 3.61Å; F57-L157 HydrophobicContact CZ-CG 4.31Å; F57-I172 HydrophobicContact CD1-CG2 3.74Å; F57-I172 HydrophobicContact CE1-CD1 4.3Å; F57-I172 HydrophobicContact CE1-CG2 4.22Å; F57-A174 HydrophobicContact CB-CB 4.05Å; F57-A174 HydrophobicContact CD1-CB 4.47Å; F57-A174 HydrophobicContact CD2-CB 4.09Å; F57-A174 HydrophobicContact CG-CB 3.95Å; F57-T176 HydrophobicContact CB-CG2 4.32Å; F57-T176 HydrophobicContact CD2-CG2 4.18Å; F57-A181 HydrophobicContact CB-CB 3.93Å; F57-Y183 WeakPolarHBondContact O-CE1 3.45Å; F57-Y183 PolarHBondContact O-OH 3.49Å
58	P	94.9	Very high	95.2	Very high	15 Å²	15	40.3 Å²	40.3	10%	0.097	21%	0.205	C	C	.	.			trans	-77.3	144	-177.9	30.1	-34.8	0	0	0	111	E54 H93	E54-P58 WeakPolarHBondContact O-CA 3.46Å; E54-P58 WeakPolarHBondContact O-CB 3.3Å; P58-H93 PolarHBondContact O-CE1 3Å
59	T	95	Very high	94	Very high	1 Å²	1	40 Å²	40	1%	0.006	22%	0.215	C	C	.	.			trans	-118.8	162	170.4	52.1	0	0	0	0	109.9	F57 R61 T84 Q170 I172 Y183	F57-T59 HydrophobicContact CD1-CG2 4.11Å; F57-T59 HydrophobicContact CE1-CG2 3.84Å; T59-R61 PolarHBondContact O-N 3.06Å; T59-T84 PolarHBondContact O-OG1 2.93Å; T59-Q170 VanDerWaalsContact CG2-NE2 3.34Å; T59-Q170 PolarHBondContact OG1-NE2 3.45Å; T59-I172 HydrophobicContact CG2-CD1 4.02Å; T59-I172 HydrophobicContact CG2-CG1 4.11Å; T59-Y183 WeakPolarHBondContact CG2-OH 3.32Å; T59-Y183 PolarHBondContact N-OH 2.87Å; T59-Y183 PolarHBondContact OG1-OH 2.98Å
60	G	96.6	Very high	92.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.			trans	-62.4	130.4	179.8	0	0	0	0	0	113	I62 L63 Y187	G60-I62 VanDerWaalsContact C-N 3.29Å; G60-L63 WeakPolarHBondContact O-CD2 3.25Å; G60-Y187 WeakPolarHBondContact O-CE1 3.01Å; G60-Y187 PolarHBondContact O-OH 2.93Å
61	R	97.4	Very high	91	Very high	86 Å²	86	39 Å²	39	33%	0.325	21%	0.211	S	C	.	.	S	Bend	trans	-73.5	-20.9	171.1	-67.2	-59.2	-172.7	132.8	4.3	113.3	A46 E54 T59 T83 T84	A46-R61 HydrophobicContact CB-CB 4.24Å; A46-R61 VanDerWaalsContact CB-O 3.26Å; A46-R61 WeakPolarHBondContact CB-O 3.23Å; A46-R61 PolarHBondContact N-O 3.14Å; E54-R61 IonicContact OE1-CZ 3.01Å; E54-R61 IonicContact OE1-NE 2.73Å; E54-R61 PolarHBondContact OE1-NE 3.46Å; E54-R61 IonicContact OE1-NH2 2.74Å; E54-R61 PolarHBondContact OE1-NH2 2.8Å; E54-R61 IonicContact OE2-CZ 3.52Å; E54-R61 IonicContact OE2-NH2 2.67Å; E54-R61 PolarHBondContact OE2-NH2 2.86Å; T59-R61 PolarHBondContact O-N 3.06Å; R61-T83 PolarHBondContact N-O 2.79Å; R61-T84 HydrophobicContact CB-CG2 4.12Å; R61-T84 HydrophobicContact CG-CG2 3.53Å; R61-T84 WeakPolarHBondContact CG-OG1 3.3Å; R61-T84 PolarHBondContact N-OG1 2.85Å
62	I	98	Very high	89.4	Confident	49 Å²	49	43.9 Å²	43.9	25%	0.251	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.1	165.7	-56.1	-62	0	0	0	107.3	R43 W44 K45 G60 G82 T83	R43-I62 HydrophobicContact CG-CG2 3.71Å; W44-I62 CarbonylContact O-C 3.6Å; W44-I62 VanDerWaalsContact O-CA 3.27Å; W44-I62 WeakPolarHBondContact O-CA 3.25Å; K45-I62 HydrophobicContact CB-CD1 3.6Å; K45-I62 HydrophobicContact CD-CD1 3.97Å; K45-I62 HydrophobicContact CG-CD1 3.52Å; G60-I62 VanDerWaalsContact C-N 3.29Å; I62-G82 CarbonylContact O-C 3.51Å; I62-G82 WeakPolarHBondContact O-CA 3.25Å; I62-T83 PolarHBondContact N-O 2.82Å; I62-T83 PolarHBondContact O-N 3.03Å
63	L	98.2	Very high	87.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	141.8	171	-54.2	-175	0	0	0	109.3	R43 W44 G60 F65 Y80 T81 L168 Y187	R43-L63 CarbonylContact C-O 3.54Å; R43-L63 WeakPolarHBondContact CA-O 3.41Å; W44-L63 HydrophobicContact CB-CB 4.34Å; W44-L63 PolarHBondContact N-O 3.49Å; W44-L63 PolarHBondContact O-N 3.11Å; G60-L63 WeakPolarHBondContact O-CD2 3.25Å; L63-F65 HydrophobicContact CB-CE2 3.99Å; L63-F65 HydrophobicContact CD1-CE2 4.29Å; L63-Y80 HydrophobicContact CB-CE2 4.45Å; L63-Y80 HydrophobicContact CD1-CE2 4.5Å; L63-Y80 HydrophobicContact CD2-CE2 3.95Å; L63-Y80 WeakPolarHBondContact CD2-OH 3.49Å; L63-T81 CarbonylContact C-O 3.59Å; L63-T81 WeakPolarHBondContact CA-O 2.9Å; L63-L168 HydrophobicContact CD1-CD2 3.98Å; L63-Y187 HydrophobicContact CD1-CD1 4.19Å; L63-Y187 HydrophobicContact CD1-CD2 4.29Å; L63-Y187 HydrophobicContact CD1-CE1 3.73Å; L63-Y187 HydrophobicContact CD1-CE2 3.82Å; L63-Y187 HydrophobicContact CD1-CG 4.48Å; L63-Y187 HydrophobicContact CD2-CE1 4.31Å; L63-Y187 HydrophobicContact CG-CD1 4.02Å; L63-Y187 HydrophobicContact CG-CE1 3.56Å
64	D	97.1	Very high	86	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.011	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.8	175.7	-163.2	-64.5	0	0	0	108.2	K24 Y25 R43 Y80 T81	K24-D64 WeakPolarHBondContact CE-OD1 3.48Å; K24-D64 IonicContact NZ-OD1 3.56Å; K24-D64 PolarHBondContact NZ-OD1 2.75Å; K24-D64 IonicContact NZ-OD2 2.75Å; Y25-D64 VanDerWaalsContact OH-CG 3.31Å; Y25-D64 PolarHBondContact OH-OD1 2.81Å; Y25-D64 PolarHBondContact OH-OD2 3.49Å; R43-D64 IonicContact CZ-OD2 3.48Å; R43-D64 IonicContact NE-OD2 3.21Å; R43-D64 PolarHBondContact NE-OD2 2.9Å; R43-D64 IonicContact NH2-OD2 2.66Å; R43-D64 PolarHBondContact NH2-OD2 3.28Å; D64-Y80 CarbonylContact O-C 3.56Å; D64-Y80 WeakPolarHBondContact O-CA 3.29Å; D64-T81 VanDerWaalsContact CB-OG1 3.29Å; D64-T81 WeakPolarHBondContact CB-OG1 3.49Å; D64-T81 PolarHBondContact N-O 2.86Å; D64-T81 PolarHBondContact O-N 2.79Å
65	F	97	Very high	85	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.1	172.3	-63.2	-92.6	0	0	0	108.3	Y25 F40 G42 W44 L63 L78 N79 Y80 L99 L161 L168	Y25-F65 WeakPolarHBondContact CD1-O 3.23Å; Y25-F65 WeakPolarHBondContact CE1-O 3.47Å; F40-F65 HydrophobicContact CB-CB 4.35Å; F40-F65 HydrophobicContact CB-CD1 4.25Å; F40-F65 HydrophobicContact CB-CD2 4.07Å; F40-F65 HydrophobicContact CB-CE2 4.43Å; F40-F65 HydrophobicContact CB-CG 3.98Å; F40-F65 WeakPolarHBondContact O-CB 3.31Å; F40-F65 WeakPolarHBondContact O-CD2 3.24Å; G42-F65 PolarHBondContact N-O 2.94Å; G42-F65 PolarHBondContact O-N 2.77Å; W44-F65 AromaticContact CD1-CD2 3.96Å; L63-F65 HydrophobicContact CB-CE2 3.99Å; L63-F65 HydrophobicContact CD1-CE2 4.29Å; F65-L78 HydrophobicContact CB-CD1 4.45Å; F65-N79 WeakPolarHBondContact CA-O 3.32Å; F65-Y80 AromaticContact CD1-CD2 3.98Å; F65-Y80 HydrophobicContact CD1-CD2 3.98Å; F65-Y80 AromaticContact CE1-CD2 3.43Å; F65-Y80 HydrophobicContact CE1-CD2 3.43Å; F65-Y80 VanDerWaalsContact CE1-CD2 3.43Å; F65-Y80 HydrophobicContact CE1-CE2 4.05Å; F65-Y80 HydrophobicContact CE1-CG 4.34Å; F65-Y80 HydrophobicContact CE2-CD2 4.21Å; F65-Y80 HydrophobicContact CE2-CE2 4.3Å; F65-Y80 AromaticContact CZ-CD2 3.56Å; F65-Y80 HydrophobicContact CZ-CD2 3.56Å; F65-Y80 AromaticContact CZ-CE2 3.71Å; F65-Y80 HydrophobicContact CZ-CE2 3.71Å; F65-L99 HydrophobicContact CE1-CD2 4.32Å; F65-L161 HydrophobicContact CZ-CD1 4.3Å; F65-L168 HydrophobicContact CE2-CD2 3.97Å
66	G	94.9	Very high	84.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	157.9	-177.8	0	0	0	0	0	113.7	L78 N79	G66-L78 CarbonylContact O-C 3.49Å; G66-N79 PolarHBondContact N-O 3.36Å; G66-N79 PolarHBondContact O-N 3.1Å
67	I	89.8	Confident	84.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.			trans	-81.7	-35.8	176.7	-54.1	172.4	0	0	0	110.3	K24 D26 R29 L30 L41 P69 L70 L78	K24-I67 WeakPolarHBondContact O-CG1 3.33Å; K24-I67 PolarHBondContact O-N 2.76Å; D26-I67 WeakPolarHBondContact O-CD1 3.34Å; R29-I67 HydrophobicContact CB-CD1 4.22Å; L30-I67 HydrophobicContact CB-CD1 4.07Å; L30-I67 HydrophobicContact CD1-CD1 4.07Å; L30-I67 HydrophobicContact CD1-CG1 3.93Å; L41-I67 HydrophobicContact CD1-CD1 3.84Å; L41-I67 HydrophobicContact CD1-CG1 4.03Å; L41-I67 HydrophobicContact CD2-CD1 4.34Å; L41-I67 HydrophobicContact CD2-CG1 3.63Å; L41-I67 HydrophobicContact CG-CG1 4.5Å; I67-P69 CarbonylContact O-C 3.56Å; I67-L70 HydrophobicContact CG2-CD1 3.87Å; I67-L70 HydrophobicContact CG2-CD2 3.64Å; I67-L70 HydrophobicContact CG2-CG 3.7Å; I67-L70 WeakPolarHBondContact O-CD2 3.35Å; I67-L70 VanDerWaalsContact O-CG 3.29Å; I67-L70 WeakPolarHBondContact O-CG 3.3Å; I67-L70 PolarHBondContact O-N 2.81Å; I67-L78 HydrophobicContact CG1-CD2 4.48Å
68	D	77.5	Confident	84.3	Confident	52 Å²	52	48.1 Å²	48.1	28%	0.278	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-99.9	145	-173	-76.4	-35	0	0	0	113.5	R29 N79	R29-D68 IonicContact CZ-OD2 3.46Å; R29-D68 IonicContact NH1-OD2 3.61Å; R29-D68 PolarHBondContact NH1-OD2 3.15Å; R29-D68 IonicContact NH2-OD1 3.79Å; R29-D68 IonicContact NH2-OD2 3.25Å; R29-D68 PolarHBondContact NH2-OD2 3.33Å; D68-N79 PolarHBondContact O-ND2 3Å
69	P	73.1	Confident	84.3	Confident	105 Å²	105	48.3 Å²	48.3	68%	0.682	27%	0.271	S	S	*	.	S	Bend	cis	-70.3	132.1	-10.3	29.9	-34.4	0	0	0	111.4	I67 N79	I67-P69 CarbonylContact O-C 3.56Å; P69-N79 VanDerWaalsContact CD-ND2 3.33Å; P69-N79 WeakPolarHBondContact CD-ND2 3.45Å; P69-N79 VanDerWaalsContact N-ND2 3.15Å; P69-N79 PolarHBondContact O-ND2 2.89Å
70	L	66.2	Low	84.4	Confident	56 Å²	56	48.3 Å²	48.3	29%	0.293	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-66.3	134.1	167	-77.6	171.4	0	0	0	108.5	P31 I67 V72	P31-L70 HydrophobicContact CG-CD1 4.38Å; P31-L70 HydrophobicContact CG-CD2 4.24Å; I67-L70 HydrophobicContact CG2-CD1 3.87Å; I67-L70 HydrophobicContact CG2-CD2 3.64Å; I67-L70 HydrophobicContact CG2-CG 3.7Å; I67-L70 WeakPolarHBondContact O-CD2 3.35Å; I67-L70 VanDerWaalsContact O-CG 3.29Å; I67-L70 WeakPolarHBondContact O-CG 3.3Å; I67-L70 PolarHBondContact O-N 2.81Å; L70-V72 PolarHBondContact O-N 3.36Å
71	P	64.9	Low	84.4	Confident	48 Å²	48	50.4 Å²	50.4	31%	0.312	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-54.9	125.3	173	-20.7	30	0	0	0	109.9	F73	P71-F73 VanDerWaalsContact CB-O 3.28Å; P71-F73 WeakPolarHBondContact CB-O 3.29Å; P71-F73 PolarHBondContact O-N 3.29Å
72	V	64.3	Low	84.4	Confident	145 Å²	145	46.3 Å²	46.3	88%	0.879	27%	0.268	S	S	*	.	S	Bend	trans	-65	-27.1	176.2	-177.7	0	0	0	0	110.6	L70	L70-V72 PolarHBondContact O-N 3.36Å
73	F	58.1	Low	84.4	Confident	181 Å²	181	45 Å²	45	79%	0.794	26%	0.263	S	S	*	.	S	Bend	trans	-138.9	150.8	177.5	60.2	-88.5	0	0	0	109.7	P71	P71-F73 VanDerWaalsContact CB-O 3.28Å; P71-F73 WeakPolarHBondContact CB-O 3.29Å; P71-F73 PolarHBondContact O-N 3.29Å
74	G	64.4	Low	84.3	Confident	69 Å²	69	46.2 Å²	46.2	71%	0.711	27%	0.27	S	S	*	.	S	Bend	trans	99.2	-170.6	179.9	0	0	0	0	0	114.4
75	A	73.2	Confident	84.2	Confident	64 Å²	64	53.8 Å²	53.8	53%	0.529	30%	0.299	S	S	.	.	S	Bend	trans	-71.8	135.5	178.2	0	0	0	0	0	110.3	M100	A75-M100 HydrophobicContact CB-SD 4.19Å
76	R	85	Confident	84	Confident	134 Å²	134	57.6 Å²	57.6	51%	0.506	32%	0.319	S	S	.	.			trans	-66.9	143.3	175.2	-50.6	-177.8	-162.2	-125.5	-0.8	108.9	P31 D33 L34	P31-R76 VanDerWaalsContact CB-CD 3.47Å; D33-R76 WeakPolarHBondContact OD2-CB 3.35Å; D33-R76 WeakPolarHBondContact OD2-CD 3.46Å; L34-R76 HydrophobicContact CD1-CB 4.15Å; L34-R76 HydrophobicContact CG-CB 4.4Å
77	S	91.7	Very high	83.8	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.014	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	158.1	-177.6	55.5	0	0	0	0	110.8	L34 F98 L99	L34-S77 VanDerWaalsContact CD1-C 3.46Å; L34-S77 WeakPolarHBondContact CD1-O 3.36Å; S77-F98 WeakPolarHBondContact OG-CD1 3.32Å; S77-L99 CarbonylContact C-O 3.41Å; S77-L99 VanDerWaalsContact CA-O 3.25Å; S77-L99 WeakPolarHBondContact CA-O 3.27Å; S77-L99 WeakPolarHBondContact CB-O 3.26Å
78	L	94	Very high	84.1	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	125.1	157.1	-63.8	-174.9	0	0	0	108.1	L30 L34 V37 L41 F65 G66 I67 Y80 F98 L99	L30-L78 HydrophobicContact CD1-CD2 3.72Å; L34-L78 HydrophobicContact CD1-CD2 4.13Å; L34-L78 HydrophobicContact CD1-CG 4.49Å; V37-L78 HydrophobicContact CB-CD1 4.25Å; V37-L78 HydrophobicContact CG2-CD1 3.65Å; V37-L78 HydrophobicContact CG2-CG 4.12Å; L41-L78 HydrophobicContact CD2-CD1 4.42Å; L41-L78 HydrophobicContact CD2-CD2 3.55Å; L41-L78 HydrophobicContact CG-CD2 4.32Å; F65-L78 HydrophobicContact CB-CD1 4.45Å; G66-L78 CarbonylContact O-C 3.49Å; I67-L78 HydrophobicContact CG1-CD2 4.48Å; L78-Y80 PolarHBondContact O-N 3.2Å; L78-F98 WeakPolarHBondContact O-CA 3.16Å; L78-L99 HydrophobicContact CB-CB 4.29Å; L78-L99 PolarHBondContact N-O 3.34Å; L78-L99 PolarHBondContact O-N 3.27Å
79	N	94	Very high	84.7	Confident	19 Å²	19	68.3 Å²	68.3	10%	0.102	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	125.2	169.4	-65.7	-31.2	0	0	0	108.4	F65 G66 D68 P69 F98	F65-N79 WeakPolarHBondContact CA-O 3.32Å; G66-N79 PolarHBondContact N-O 3.36Å; G66-N79 PolarHBondContact O-N 3.1Å; D68-N79 PolarHBondContact O-ND2 3Å; P69-N79 VanDerWaalsContact CD-ND2 3.33Å; P69-N79 WeakPolarHBondContact CD-ND2 3.45Å; P69-N79 VanDerWaalsContact N-ND2 3.15Å; P69-N79 PolarHBondContact O-ND2 2.89Å; N79-F98 VanDerWaalsContact OD1-CD1 3.25Å; N79-F98 WeakPolarHBondContact OD1-CD1 3.36Å; N79-F98 VanDerWaalsContact OD1-CE1 3.23Å; N79-F98 WeakPolarHBondContact OD1-CE1 3.42Å
80	Y	96	Very high	85.7	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.008	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.6	-178.1	169.7	-103.6	0	0	0	110	L63 D64 F65 L78 E95 Y96 G97 L115 T117	L63-Y80 HydrophobicContact CB-CE2 4.45Å; L63-Y80 HydrophobicContact CD1-CE2 4.5Å; L63-Y80 HydrophobicContact CD2-CE2 3.95Å; L63-Y80 WeakPolarHBondContact CD2-OH 3.49Å; D64-Y80 CarbonylContact O-C 3.56Å; D64-Y80 WeakPolarHBondContact O-CA 3.29Å; F65-Y80 AromaticContact CD1-CD2 3.98Å; F65-Y80 HydrophobicContact CD1-CD2 3.98Å; F65-Y80 AromaticContact CE1-CD2 3.43Å; F65-Y80 HydrophobicContact CE1-CD2 3.43Å; F65-Y80 VanDerWaalsContact CE1-CD2 3.43Å; F65-Y80 HydrophobicContact CE1-CE2 4.05Å; F65-Y80 HydrophobicContact CE1-CG 4.34Å; F65-Y80 HydrophobicContact CE2-CD2 4.21Å; F65-Y80 HydrophobicContact CE2-CE2 4.3Å; F65-Y80 AromaticContact CZ-CD2 3.56Å; F65-Y80 HydrophobicContact CZ-CD2 3.56Å; F65-Y80 AromaticContact CZ-CE2 3.71Å; F65-Y80 HydrophobicContact CZ-CE2 3.71Å; L78-Y80 PolarHBondContact O-N 3.2Å; Y80-E95 HydrophobicContact CE1-CG 3.83Å; Y80-E95 PolarHBondContact OH-OE1 2.82Å; Y80-Y96 CarbonylContact O-C 3.59Å; Y80-Y96 VanDerWaalsContact O-CA 3.3Å; Y80-Y96 WeakPolarHBondContact O-CA 3.36Å; Y80-G97 PolarHBondContact N-O 2.96Å; Y80-G97 PolarHBondContact O-N 2.78Å; Y80-L115 HydrophobicContact CD1-CD1 4.34Å; Y80-L115 HydrophobicContact CG-CD1 4.39Å; Y80-T117 HydrophobicContact CD1-CG2 3.82Å; Y80-T117 HydrophobicContact CE1-CG2 3.8Å
81	T	97.1	Very high	87	Confident	43 Å²	43	65.9 Å²	65.9	26%	0.264	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	136.7	161.1	64.6	0	0	0	0	110.7	L63 D64 E95	L63-T81 CarbonylContact C-O 3.59Å; L63-T81 WeakPolarHBondContact CA-O 2.9Å; D64-T81 VanDerWaalsContact CB-OG1 3.29Å; D64-T81 WeakPolarHBondContact CB-OG1 3.49Å; D64-T81 PolarHBondContact N-O 2.86Å; D64-T81 PolarHBondContact O-N 2.79Å; T81-E95 CarbonylContact C-O 3.55Å; T81-E95 VanDerWaalsContact CA-O 3.26Å; T81-E95 WeakPolarHBondContact CA-O 3.42Å
82	G	98	Very high	88.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.7	167.5	0	0	0	0	0	109.7	I62 F94 E95	I62-G82 CarbonylContact O-C 3.51Å; I62-G82 WeakPolarHBondContact O-CA 3.25Å; G82-F94 CarbonylContact O-C 3.48Å; G82-F94 WeakPolarHBondContact O-CA 3.3Å; G82-E95 PolarHBondContact N-O 2.78Å; G82-E95 PolarHBondContact O-N 2.88Å
83	T	97.8	Very high	89.8	Confident	23 Å²	23	58.8 Å²	58.8	14%	0.141	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136	179.9	-53.6	0	0	0	0	111.8	R61 I62 R85 H93 F94	R61-T83 PolarHBondContact N-O 2.79Å; I62-T83 PolarHBondContact N-O 2.82Å; I62-T83 PolarHBondContact O-N 3.03Å; T83-R85 HydrophobicContact CG2-CG 4.32Å; T83-H93 WeakPolarHBondContact CA-O 3.35Å; T83-F94 HydrophobicContact CG2-CD2 4.38Å; T83-F94 WeakPolarHBondContact OG1-CD2 3.35Å
84	T	97.2	Very high	91.6	Very high	25 Å²	25	53.6 Å²	53.6	15%	0.153	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.5	169	-54.1	0	0	0	0	108.4	T59 R61 A92 H93	T59-T84 PolarHBondContact O-OG1 2.93Å; R61-T84 HydrophobicContact CB-CG2 4.12Å; R61-T84 HydrophobicContact CG-CG2 3.53Å; R61-T84 WeakPolarHBondContact CG-OG1 3.3Å; R61-T84 PolarHBondContact N-OG1 2.85Å; T84-A92 HydrophobicContact CG2-CB 4.23Å; T84-A92 PolarHBondContact O-N 2.84Å; T84-H93 PolarHBondContact N-O 2.85Å; T84-H93 PolarHBondContact O-N 3.49Å; T84-H93 VanDerWaalsContact O-N 3.11Å
85	R	94.3	Very high	93.1	Very high	161 Å²	161	50.4 Å²	50.4	61%	0.608	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.4	175.7	-67.5	-178.6	-179.9	-90.3	-0.2	110.2	T83 G89 S90	T83-R85 HydrophobicContact CG2-CG 4.32Å; R85-G89 PolarHBondContact NH1-O 2.9Å; R85-S90 CarbonylContact C-O 3.43Å; R85-S90 WeakPolarHBondContact CA-O 3.49Å
86	N	92.6	Very high	94.2	Very high	81 Å²	81	52.3 Å²	52.3	43%	0.433	29%	0.286	S	S	.	.			trans	-73.2	169.8	167.2	-68.8	-41.4	0	0	0	110.3	D88 G89 S90 A92	N86-D88 WeakPolarHBondContact CB-OD1 3.26Å; N86-D88 PolarHBondContact O-N 2.83Å; N86-G89 PolarHBondContact O-N 2.82Å; N86-S90 WeakPolarHBondContact CB-OG 3.23Å; N86-S90 PolarHBondContact N-O 3.41Å; N86-S90 PolarHBondContact ND2-OG 2.86Å; N86-A92 WeakPolarHBondContact OD1-CB 3.44Å
87	A	91.7	Very high	94.7	Very high	117 Å²	117	46.1 Å²	46.1	97%	0.967	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-29.5	179	0	0	0	0	0	113.2	G89	A87-G89 PolarHBondContact O-N 3.15Å
88	D	94.1	Very high	94.8	Very high	126 Å²	126	50 Å²	50	67%	0.674	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-0.7	174.9	67.8	-4.2	0	0	0	113.5	N86 S90	N86-D88 WeakPolarHBondContact CB-OD1 3.26Å; N86-D88 PolarHBondContact O-N 2.83Å; D88-S90 VanDerWaalsContact C-N 3.31Å; D88-S90 PolarHBondContact O-N 2.86Å; D88-S90 VanDerWaalsContact OD1-CB 3.24Å; D88-S90 WeakPolarHBondContact OD1-CB 3.32Å; D88-S90 PolarHBondContact OD1-N 2.97Å; D88-S90 PolarHBondContact OD1-OG 3.11Å; D88-S90 PolarHBondContact OD2-OG 2.86Å
89	G	91.9	Very high	94.9	Very high	34 Å²	34	50 Å²	50	35%	0.351	28%	0.281	S	S	.	.	S	Bend	trans	86	-7.9	-178.5	0	0	0	0	0	114.9	R85 N86 A87	R85-G89 PolarHBondContact NH1-O 2.9Å; N86-G89 PolarHBondContact O-N 2.82Å; A87-G89 PolarHBondContact O-N 3.15Å
90	S	94	Very high	94.8	Very high	48 Å²	48	51.3 Å²	51.3	34%	0.336	29%	0.287	S	S	.	.			trans	-64	153.6	175.3	68.6	0	0	0	0	111.4	R85 N86 D88 A92	R85-S90 CarbonylContact C-O 3.43Å; R85-S90 WeakPolarHBondContact CA-O 3.49Å; N86-S90 WeakPolarHBondContact CB-OG 3.23Å; N86-S90 PolarHBondContact N-O 3.41Å; N86-S90 PolarHBondContact ND2-OG 2.86Å; D88-S90 VanDerWaalsContact C-N 3.31Å; D88-S90 PolarHBondContact O-N 2.86Å; D88-S90 VanDerWaalsContact OD1-CB 3.24Å; D88-S90 WeakPolarHBondContact OD1-CB 3.32Å; D88-S90 PolarHBondContact OD1-N 2.97Å; D88-S90 PolarHBondContact OD1-OG 3.11Å; D88-S90 PolarHBondContact OD2-OG 2.86Å; S90-A92 PolarHBondContact O-N 2.89Å
91	V	93	Very high	94.6	Very high	61 Å²	61	51.9 Å²	51.9	37%	0.37	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	109.7	-177.4	177.7	0	0	0	0	109.3	H93 F94 I120	V91-H93 WeakPolarHBondContact CG1-O 3.38Å; V91-F94 HydrophobicContact CG1-CB 3.68Å; V91-I120 HydrophobicContact CG1-CD1 4.41Å
92	A	93.1	Very high	94.3	Very high	41 Å²	41	56.3 Å²	56.3	34%	0.339	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-35	176.6	0	0	0	0	0	112.1	T84 N86 S90	T84-A92 HydrophobicContact CG2-CB 4.23Å; T84-A92 PolarHBondContact O-N 2.84Å; N86-A92 WeakPolarHBondContact OD1-CB 3.44Å; S90-A92 PolarHBondContact O-N 2.89Å
93	H	94.6	Very high	93.6	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.019	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	139.7	177.3	176.5	93.3	0	0	0	109.3	P58 T83 T84 V91 E95	P58-H93 PolarHBondContact O-CE1 3Å; T83-H93 WeakPolarHBondContact CA-O 3.35Å; T84-H93 PolarHBondContact N-O 2.85Å; T84-H93 PolarHBondContact O-N 3.49Å; T84-H93 VanDerWaalsContact O-N 3.11Å; V91-H93 WeakPolarHBondContact CG1-O 3.38Å; H93-E95 IonicContact NE2-OE1 2.9Å
94	F	96.5	Very high	93	Very high	71 Å²	71	65.3 Å²	65.3	31%	0.311	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	136.9	170.9	179.7	-100.4	0	0	0	109.5	G82 T83 V91 Y96 T119 I120	G82-F94 CarbonylContact O-C 3.48Å; G82-F94 WeakPolarHBondContact O-CA 3.3Å; T83-F94 HydrophobicContact CG2-CD2 4.38Å; T83-F94 WeakPolarHBondContact OG1-CD2 3.35Å; V91-F94 HydrophobicContact CG1-CB 3.68Å; F94-Y96 AromaticContact CE1-CD1 3.82Å; F94-Y96 HydrophobicContact CE1-CD1 3.82Å; F94-Y96 HydrophobicContact CE1-CG 4.46Å; F94-T119 WeakPolarHBondContact O-CA 3.08Å; F94-T119 PolarHBondContact O-OG1 2.81Å; F94-I120 HydrophobicContact CB-CB 4.24Å; F94-I120 HydrophobicContact CB-CG2 4.26Å; F94-I120 PolarHBondContact O-N 2.9Å
95	E	95.9	Very high	92.4	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.009	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	147.5	168.9	60.6	-177.5	164.9	0	0	109.6	Y80 T81 G82 H93 T118	Y80-E95 HydrophobicContact CE1-CG 3.83Å; Y80-E95 PolarHBondContact OH-OE1 2.82Å; T81-E95 CarbonylContact C-O 3.55Å; T81-E95 VanDerWaalsContact CA-O 3.26Å; T81-E95 WeakPolarHBondContact CA-O 3.42Å; G82-E95 PolarHBondContact N-O 2.78Å; G82-E95 PolarHBondContact O-N 2.88Å; H93-E95 IonicContact NE2-OE1 2.9Å; E95-T118 VanDerWaalsContact CA-O 3.26Å; E95-T118 WeakPolarHBondContact CA-O 3.32Å
96	Y	95.8	Very high	91.9	Very high	105 Å²	105	71.1 Å²	71.1	41%	0.412	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	155.2	172.4	70.1	-84.4	0	0	0	109.1	Y80 F94 T117 T118	Y80-Y96 CarbonylContact O-C 3.59Å; Y80-Y96 VanDerWaalsContact O-CA 3.3Å; Y80-Y96 WeakPolarHBondContact O-CA 3.36Å; F94-Y96 AromaticContact CE1-CD1 3.82Å; F94-Y96 HydrophobicContact CE1-CD1 3.82Å; F94-Y96 HydrophobicContact CE1-CG 4.46Å; Y96-T117 CarbonylContact O-C 3.59Å; Y96-T117 VanDerWaalsContact O-CA 3.29Å; Y96-T117 WeakPolarHBondContact O-CA 3.42Å; Y96-T118 HydrophobicContact CE1-CG2 3.86Å; Y96-T118 PolarHBondContact N-O 2.86Å; Y96-T118 PolarHBondContact O-N 2.83Å
97	G	94.9	Very high	91.6	Very high	4 Å²	4	73 Å²	73	4%	0.041	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-172.3	-173.2	0	0	0	0	0	114.8	Y80 I116	Y80-G97 PolarHBondContact N-O 2.96Å; Y80-G97 PolarHBondContact O-N 2.78Å; G97-I116 CarbonylContact C-O 3.54Å; G97-I116 WeakPolarHBondContact CA-O 3.49Å
98	F	94.5	Very high	91.3	Very high	83 Å²	83	70 Å²	70	36%	0.364	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	117.7	-175.9	-55.3	-78.1	0	0	0	109.5	S77 L78 N79 I116	S77-F98 WeakPolarHBondContact OG-CD1 3.32Å; L78-F98 WeakPolarHBondContact O-CA 3.16Å; N79-F98 VanDerWaalsContact OD1-CD1 3.25Å; N79-F98 WeakPolarHBondContact OD1-CD1 3.36Å; N79-F98 VanDerWaalsContact OD1-CE1 3.23Å; N79-F98 WeakPolarHBondContact OD1-CE1 3.42Å; F98-I116 PolarHBondContact N-O 2.98Å; F98-I116 PolarHBondContact O-N 2.78Å; F98-I116 VanDerWaalsContact O-N 3.15Å
99	L	95.1	Very high	91	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	105.1	170.1	177.6	62.6	0	0	0	108.8	V37 F40 F65 S77 L78 C113 G114 L115	V37-L99 HydrophobicContact CB-CD2 4.11Å; V37-L99 HydrophobicContact CG1-CD2 4.17Å; V37-L99 HydrophobicContact CG2-CD2 4.25Å; F40-L99 HydrophobicContact CD2-CD2 4.18Å; F65-L99 HydrophobicContact CE1-CD2 4.32Å; S77-L99 CarbonylContact C-O 3.41Å; S77-L99 VanDerWaalsContact CA-O 3.25Å; S77-L99 WeakPolarHBondContact CA-O 3.27Å; S77-L99 WeakPolarHBondContact CB-O 3.26Å; L78-L99 HydrophobicContact CB-CB 4.29Å; L78-L99 PolarHBondContact N-O 3.34Å; L78-L99 PolarHBondContact O-N 3.27Å; L99-C113 HydrophobicContact CD1-CB 4.4Å; L99-G114 WeakPolarHBondContact CA-O 3.17Å; L99-L115 HydrophobicContact CB-CD1 4.12Å; L99-L115 HydrophobicContact CD1-CB 4.22Å
100	M	92.9	Very high	90.9	Very high	47 Å²	47	70.5 Å²	70.5	23%	0.232	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	146.8	179.8	-63.5	171.6	-69.5	0	0	110.3	A75 C113 G114 I116	A75-M100 HydrophobicContact CB-SD 4.19Å; M100-C113 CarbonylContact O-C 3.56Å; M100-C113 WeakPolarHBondContact O-CA 3.28Å; M100-C113 VanDerWaalsContact O-CB 3.25Å; M100-C113 WeakPolarHBondContact O-CB 3.24Å; M100-G114 PolarHBondContact N-O 3.01Å; M100-G114 PolarHBondContact O-N 2.99Å; M100-I116 HydrophobicContact CE-CD1 3.55Å; M100-I116 HydrophobicContact CE-CG1 3.92Å
101	V	92.5	Very high	90.9	Very high	13 Å²	13	69.5 Å²	69.5	8%	0.079	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.6	174.5	-179.9	0	0	0	0	109.5	D33 L34 P36 V37 I111 C113	D33-V101 VanDerWaalsContact O-CB 3.31Å; D33-V101 WeakPolarHBondContact O-CB 3.47Å; D33-V101 VanDerWaalsContact O-CG1 3.24Å; D33-V101 WeakPolarHBondContact O-CG1 3.31Å; L34-V101 HydrophobicContact CD2-CB 4.18Å; L34-V101 HydrophobicContact CD2-CG2 4.19Å; P36-V101 HydrophobicContact CB-CG1 4.43Å; P36-V101 HydrophobicContact CG-CG1 4.18Å; V37-V101 HydrophobicContact CB-CG2 4.33Å; V37-V101 HydrophobicContact CG1-CG2 3.76Å; V37-V101 HydrophobicContact CG2-CG2 3.58Å; V101-I111 HydrophobicContact CG1-CG2 3.44Å; V101-I111 VanDerWaalsContact CG1-CG2 3.44Å; V101-C113 HydrophobicContact CG2-CB 4.42Å
102	K	89.6	Confident	90.9	Very high	136 Å²	136	69.1 Å²	69.1	59%	0.591	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	112	170.2	-177.8	178.3	179.5	179.7	0	108.4	L112	K102-L112 HydrophobicContact CB-CB 4.27Å; K102-L112 PolarHBondContact N-O 2.95Å; K102-L112 PolarHBondContact O-N 2.88Å
103	N	84.6	Confident	91	Very high	68 Å²	68	67.4 Å²	67.4	36%	0.364	32%	0.32	S	S	.	.			trans	-62.5	156	179.7	-80.9	-19.1	0	0	0	113.2	D33	D33-N103 VanDerWaalsContact CA-ND2 3.25Å; D33-N103 WeakPolarHBondContact CA-ND2 3.32Å; D33-N103 PolarHBondContact O-OD1 3Å
104	R	83.9	Confident	91.1	Very high	144 Å²	144	67.3 Å²	67.3	54%	0.543	32%	0.321	S	S	.	.			trans	-55	143.2	172.6	-53.9	-175.6	161	-164.2	-15.1	110.2	P109 I111	R104-P109 WeakPolarHBondContact CD-O 3.38Å; R104-P109 VanDerWaalsContact CG-O 3.3Å; R104-P109 WeakPolarHBondContact CG-O 3.27Å; R104-P109 PolarHBondContact NE-O 2.86Å; R104-I111 HydrophobicContact CG-CB 4.45Å; R104-I111 HydrophobicContact CG-CD1 4.27Å; R104-I111 HydrophobicContact CG-CG1 3.36Å
105	T	84.3	Confident	91.1	Very high	69 Å²	69	64 Å²	64	42%	0.423	31%	0.306	S	S	.	.			trans	-122.6	168.7	169.6	60.2	0	0	0	0	108.8	T107 N108	T105-T107 PolarHBondContact O-N 2.58Å; T105-T107 PolarHBondContact OG1-OG1 3.42Å; T105-N108 PolarHBondContact N-O 3.47Å; T105-N108 CarbonylContact O-C 3.5Å; T105-N108 PolarHBondContact O-N 3.06Å; T105-N108 PolarHBondContact OG1-N 3.19Å; T105-N108 VanDerWaalsContact OG1-N 3.1Å
106	R	84.5	Confident	91.1	Very high	240 Å²	240	66.7 Å²	66.7	91%	0.906	32%	0.32	S	S	*	.	S	Bend	trans	-57.8	-31.5	176.3	-170.3	176.9	67.5	90.9	-0.7	112.6
107	T	87.3	Confident	91.1	Very high	121 Å²	121	61.8 Å²	61.8	74%	0.742	30%	0.301	S	S	*	.	S	Bend	trans	-90.1	-30.8	-178.2	51	0	0	0	0	113.2	T105	T105-T107 PolarHBondContact O-N 2.58Å; T105-T107 PolarHBondContact OG1-OG1 3.42Å
108	N	85.3	Confident	91.2	Very high	53 Å²	53	62.8 Å²	62.8	28%	0.283	31%	0.306	S	S	.	.			trans	-122.7	101.7	172.7	-171.5	-17.2	0	0	0	110	T105 Q110	T105-N108 PolarHBondContact N-O 3.47Å; T105-N108 CarbonylContact O-C 3.5Å; T105-N108 PolarHBondContact O-N 3.06Å; T105-N108 PolarHBondContact OG1-N 3.19Å; T105-N108 VanDerWaalsContact OG1-N 3.1Å; N108-Q110 PolarHBondContact O-N 2.95Å; N108-Q110 VanDerWaalsContact OD1-CB 3.28Å; N108-Q110 WeakPolarHBondContact OD1-CB 3.29Å; N108-Q110 PolarHBondContact OD1-N 2.88Å
109	P	86.6	Confident	91.2	Very high	85 Å²	85	59.1 Å²	59.1	55%	0.552	29%	0.291	S	S	*	.			trans	-77.8	1.8	-178.6	33.6	-36.3	0	0	0	113	R104	R104-P109 WeakPolarHBondContact CD-O 3.38Å; R104-P109 VanDerWaalsContact CG-O 3.3Å; R104-P109 WeakPolarHBondContact CG-O 3.27Å; R104-P109 PolarHBondContact NE-O 2.86Å
110	Q	91	Very high	90.9	Very high	85 Å²	85	64.2 Å²	64.2	40%	0.397	32%	0.317	S	S	.	.	S	Bend	trans	-85.8	145.6	175.9	-59.7	173	-33.3	0	0	110.3	N108 L112 M130	N108-Q110 PolarHBondContact O-N 2.95Å; N108-Q110 VanDerWaalsContact OD1-CB 3.28Å; N108-Q110 WeakPolarHBondContact OD1-CB 3.29Å; N108-Q110 PolarHBondContact OD1-N 2.88Å; Q110-L112 HydrophobicContact CB-CD2 4.08Å; Q110-M130 HydrophobicContact CB-SD 4.28Å; Q110-M130 VanDerWaalsContact CD-SD 3.57Å; Q110-M130 HydrophobicContact CG-SD 4.17Å
111	I	92.9	Very high	90.7	Very high	28 Å²	28	66.3 Å²	66.3	14%	0.144	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.9	165.6	-60.8	167.6	0	0	0	105.3	P36 V101 R104 M130 V131	P36-I111 HydrophobicContact CB-CD1 4.16Å; P36-I111 HydrophobicContact CB-CG2 4.32Å; P36-I111 HydrophobicContact CG-CD1 3.96Å; P36-I111 HydrophobicContact CG-CG2 4.29Å; V101-I111 HydrophobicContact CG1-CG2 3.44Å; V101-I111 VanDerWaalsContact CG1-CG2 3.44Å; R104-I111 HydrophobicContact CG-CB 4.45Å; R104-I111 HydrophobicContact CG-CD1 4.27Å; R104-I111 HydrophobicContact CG-CG1 3.36Å; I111-M130 WeakPolarHBondContact O-CA 3.49Å; I111-V131 HydrophobicContact CB-CB 4.16Å; I111-V131 HydrophobicContact CG2-CB 3.83Å; I111-V131 HydrophobicContact CG2-CG2 3.98Å; I111-V131 PolarHBondContact O-N 2.92Å
112	L	94	Very high	90.6	Very high	52 Å²	52	66.3 Å²	66.3	27%	0.272	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	152.5	176.5	-53.8	-179.9	0	0	0	109.1	K102 Q110 G129 M130	K102-L112 HydrophobicContact CB-CB 4.27Å; K102-L112 PolarHBondContact N-O 2.95Å; K102-L112 PolarHBondContact O-N 2.88Å; Q110-L112 HydrophobicContact CB-CD2 4.08Å; L112-G129 CarbonylContact C-O 3.48Å; L112-G129 WeakPolarHBondContact CA-O 3.3Å; L112-M130 HydrophobicContact CD2-CG 3.84Å
113	C	94.8	Very high	90.8	Very high	5 Å²	5	60 Å²	60	3%	0.034	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160.4	171.5	62.3	0	0	0	0	110.8	L99 M100 V101 F128 G129 V131	L99-C113 HydrophobicContact CD1-CB 4.4Å; M100-C113 CarbonylContact O-C 3.56Å; M100-C113 WeakPolarHBondContact O-CA 3.28Å; M100-C113 VanDerWaalsContact O-CB 3.25Å; M100-C113 WeakPolarHBondContact O-CB 3.24Å; V101-C113 HydrophobicContact CG2-CB 4.42Å; C113-F128 WeakPolarHBondContact O-CA 3.35Å; C113-G129 PolarHBondContact N-O 3.1Å; C113-G129 PolarHBondContact O-N 3.13Å; C113-V131 HydrophobicContact CB-CG2 3.57Å
114	G	95.7	Very high	91.3	Very high	3 Å²	3	57.1 Å²	57.1	3%	0.031	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	137.6	171.6	0	0	0	0	0	110.1	L99 M100 E127	L99-G114 WeakPolarHBondContact CA-O 3.17Å; M100-G114 PolarHBondContact N-O 3.01Å; M100-G114 PolarHBondContact O-N 2.99Å; G114-E127 CarbonylContact C-O 3.21Å; G114-E127 WeakPolarHBondContact CA-O 3.23Å
115	L	97	Very high	91.9	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.9	173.5	177.7	61.6	0	0	0	108	Y80 L99 T117 E127 L138	Y80-L115 HydrophobicContact CD1-CD1 4.34Å; Y80-L115 HydrophobicContact CG-CD1 4.39Å; L99-L115 HydrophobicContact CB-CD1 4.12Å; L99-L115 HydrophobicContact CD1-CB 4.22Å; L115-T117 HydrophobicContact CD1-CG2 3.96Å; L115-T117 HydrophobicContact CD2-CG2 4.19Å; L115-T117 HydrophobicContact CG-CG2 3.86Å; L115-E127 HydrophobicContact CB-CB 4.4Å; L115-E127 PolarHBondContact N-O 2.84Å; L115-E127 PolarHBondContact O-N 3.11Å; L115-L138 HydrophobicContact CB-CD1 3.67Å; L115-L138 HydrophobicContact CB-CD2 4.33Å; L115-L138 HydrophobicContact CD2-CD1 3.93Å; L115-L138 HydrophobicContact CG-CD1 4.46Å
116	I	95.9	Very high	92.6	Very high	59 Å²	59	47.9 Å²	47.9	30%	0.303	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	122.3	172.9	-58.1	175.6	0	0	0	107.3	G97 F98 M100 L125 V126	G97-I116 CarbonylContact C-O 3.54Å; G97-I116 WeakPolarHBondContact CA-O 3.49Å; F98-I116 PolarHBondContact N-O 2.98Å; F98-I116 PolarHBondContact O-N 2.78Å; F98-I116 VanDerWaalsContact O-N 3.15Å; M100-I116 HydrophobicContact CE-CD1 3.55Å; M100-I116 HydrophobicContact CE-CG1 3.92Å; I116-L125 VanDerWaalsContact CA-O 3.32Å; I116-L125 WeakPolarHBondContact CA-O 3.39Å; I116-V126 HydrophobicContact CG1-CG1 4.26Å; I116-V126 HydrophobicContact CG1-CG2 4.38Å; I116-V126 HydrophobicContact CG2-CG2 4.42Å
117	T	96.7	Very high	93.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148.4	175	67	0	0	0	0	111.7	Y80 Y96 L115 S124 L125	Y80-T117 HydrophobicContact CD1-CG2 3.82Å; Y80-T117 HydrophobicContact CE1-CG2 3.8Å; Y96-T117 CarbonylContact O-C 3.59Å; Y96-T117 VanDerWaalsContact O-CA 3.29Å; Y96-T117 WeakPolarHBondContact O-CA 3.42Å; L115-T117 HydrophobicContact CD1-CG2 3.96Å; L115-T117 HydrophobicContact CD2-CG2 4.19Å; L115-T117 HydrophobicContact CG-CG2 3.86Å; T117-S124 CarbonylContact O-C 3.58Å; T117-S124 WeakPolarHBondContact O-CA 3.26Å; T117-S124 VanDerWaalsContact O-CB 3.24Å; T117-S124 WeakPolarHBondContact O-CB 3.21Å; T117-L125 PolarHBondContact N-O 2.86Å; T117-L125 PolarHBondContact O-N 2.87Å
118	T	95.5	Very high	93.7	Very high	25 Å²	25	35.4 Å²	35.4	15%	0.153	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.8	167.9	-62.1	0	0	0	0	108	E95 Y96 S124	E95-T118 VanDerWaalsContact CA-O 3.26Å; E95-T118 WeakPolarHBondContact CA-O 3.32Å; Y96-T118 HydrophobicContact CE1-CG2 3.86Å; Y96-T118 PolarHBondContact N-O 2.86Å; Y96-T118 PolarHBondContact O-N 2.83Å; T118-S124 PolarHBondContact OG1-OG 2.97Å
119	T	94.3	Very high	94.3	Very high	7 Å²	7	34 Å²	34	4%	0.043	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	153.9	-178.2	177.6	0	0	0	0	112.2	F94 R121 G122 Y123	F94-T119 WeakPolarHBondContact O-CA 3.08Å; F94-T119 PolarHBondContact O-OG1 2.81Å; T119-R121 HydrophobicContact CG2-CB 3.99Å; T119-R121 PolarHBondContact O-N 2.98Å; T119-R121 VanDerWaalsContact O-N 3.13Å; T119-R121 PolarHBondContact OG1-N 3.21Å; T119-G122 PolarHBondContact O-N 2.9Å; T119-G122 VanDerWaalsContact O-N 3.1Å; T119-Y123 HydrophobicContact CG2-CD1 3.44Å; T119-Y123 VanDerWaalsContact CG2-CD1 3.44Å; T119-Y123 HydrophobicContact CG2-CD2 3.43Å; T119-Y123 VanDerWaalsContact CG2-CD2 3.43Å; T119-Y123 HydrophobicContact CG2-CE1 3.41Å; T119-Y123 VanDerWaalsContact CG2-CE1 3.41Å; T119-Y123 HydrophobicContact CG2-CE2 3.38Å; T119-Y123 HydrophobicContact CG2-CG 3.44Å; T119-Y123 VanDerWaalsContact CG2-CG 3.44Å; T119-Y123 WeakPolarHBondContact CG2-O 3.43Å; T119-Y123 PolarHBondContact N-O 2.96Å
120	I	90	Very high	94.7	Very high	106 Å²	106	32.7 Å²	32.7	54%	0.544	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.7	169.4	-163.4	168.5	0	0	0	113.3	V91 F94 G122	V91-I120 HydrophobicContact CG1-CD1 4.41Å; F94-I120 HydrophobicContact CB-CB 4.24Å; F94-I120 HydrophobicContact CB-CG2 4.26Å; F94-I120 PolarHBondContact O-N 2.9Å; I120-G122 PolarHBondContact O-N 3.21Å
121	R	87.7	Confident	94.9	Very high	92 Å²	92	28.7 Å²	28.7	35%	0.347	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	9.1	174.9	-67.9	-176.6	173.6	-172.2	-3.8	114	T119 Y123 Q150	T119-R121 HydrophobicContact CG2-CB 3.99Å; T119-R121 PolarHBondContact O-N 2.98Å; T119-R121 VanDerWaalsContact O-N 3.13Å; T119-R121 PolarHBondContact OG1-N 3.21Å; R121-Y123 HydrophobicContact CB-CD1 3.87Å; R121-Y123 HydrophobicContact CB-CE1 3.57Å; R121-Y123 HydrophobicContact CG-CE1 4.47Å; R121-Q150 PolarHBondContact O-NE2 2.97Å
122	G	90.6	Very high	94.9	Very high	12 Å²	12	31.9 Å²	31.9	12%	0.124	16%	0.164	C	C	.	.	S	Bend	trans	74.7	29.8	172.7	0	0	0	0	0	114.2	T119 I120 R146	T119-G122 PolarHBondContact O-N 2.9Å; T119-G122 VanDerWaalsContact O-N 3.1Å; I120-G122 PolarHBondContact O-N 3.21Å; G122-R146 WeakPolarHBondContact O-CA 3.16Å; G122-R146 WeakPolarHBondContact O-CB 3.33Å; G122-R146 PolarHBondContact O-N 2.91Å
123	Y	93.5	Very high	94.8	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	164.5	168.6	63.7	-96.8	0	0	0	111.2	T119 R121 L125 F143 I144 Y152 V154	T119-Y123 HydrophobicContact CG2-CD1 3.44Å; T119-Y123 VanDerWaalsContact CG2-CD1 3.44Å; T119-Y123 HydrophobicContact CG2-CD2 3.43Å; T119-Y123 VanDerWaalsContact CG2-CD2 3.43Å; T119-Y123 HydrophobicContact CG2-CE1 3.41Å; T119-Y123 VanDerWaalsContact CG2-CE1 3.41Å; T119-Y123 HydrophobicContact CG2-CE2 3.38Å; T119-Y123 HydrophobicContact CG2-CG 3.44Å; T119-Y123 VanDerWaalsContact CG2-CG 3.44Å; T119-Y123 WeakPolarHBondContact CG2-O 3.43Å; T119-Y123 PolarHBondContact N-O 2.96Å; R121-Y123 HydrophobicContact CB-CD1 3.87Å; R121-Y123 HydrophobicContact CB-CE1 3.57Å; R121-Y123 HydrophobicContact CG-CE1 4.47Å; Y123-L125 HydrophobicContact CD2-CD2 4.03Å; Y123-L125 HydrophobicContact CD2-CG 4.05Å; Y123-L125 HydrophobicContact CE2-CD1 4.05Å; Y123-L125 HydrophobicContact CE2-CD2 4.1Å; Y123-L125 HydrophobicContact CE2-CG 3.95Å; Y123-F143 HydrophobicContact CD1-CE2 4.26Å; Y123-F143 HydrophobicContact CD2-CD2 4.26Å; Y123-F143 AromaticContact CD2-CE2 3.6Å; Y123-F143 HydrophobicContact CD2-CE2 3.6Å; Y123-F143 HydrophobicContact CD2-CZ 4.49Å; Y123-F143 HydrophobicContact CE2-CE2 4.39Å; Y123-F143 AromaticContact CG-CE2 3.55Å; Y123-F143 HydrophobicContact CG-CE2 3.55Å; Y123-F143 HydrophobicContact CG-CZ 4Å; Y123-I144 CarbonylContact C-O 3.55Å; Y123-I144 VanDerWaalsContact CA-O 3.29Å; Y123-I144 WeakPolarHBondContact CA-O 3.3Å; Y123-Y152 AromaticContact CD1-CD1 3.75Å; Y123-Y152 HydrophobicContact CD1-CD1 3.75Å; Y123-Y152 HydrophobicContact CD1-CE1 4.31Å; Y123-Y152 AromaticContact CE1-CD1 3.27Å; Y123-Y152 HydrophobicContact CE1-CD1 3.27Å; Y123-Y152 AromaticContact CE1-CE1 3.48Å; Y123-Y152 HydrophobicContact CE1-CE1 3.48Å; Y123-Y152 VanDerWaalsContact CE1-CE1 3.48Å; Y123-Y152 HydrophobicContact CE1-CG 4.34Å; Y123-Y152 HydrophobicContact CE2-CE1 4.4Å; Y123-Y152 AromaticContact CZ-CD1 3.87Å; Y123-Y152 AromaticContact CZ-CE1 3.56Å; Y123-V154 HydrophobicContact CE2-CG2 4.44Å
124	S	95.9	Very high	94.6	Very high	8 Å²	8	39.1 Å²	39.1	6%	0.056	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146	171.7	-59.4	0	0	0	0	110.1	T117 T118 I144	T117-S124 CarbonylContact O-C 3.58Å; T117-S124 WeakPolarHBondContact O-CA 3.26Å; T117-S124 VanDerWaalsContact O-CB 3.24Å; T117-S124 WeakPolarHBondContact O-CB 3.21Å; T118-S124 PolarHBondContact OG1-OG 2.97Å; S124-I144 PolarHBondContact N-O 2.8Å; S124-I144 PolarHBondContact O-N 2.83Å
125	L	97.5	Very high	94.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	137.6	177.8	-58.3	174.5	0	0	0	108.3	F57 I116 T117 Y123 E127 L140 F143 V154 L157	F57-L125 HydrophobicContact CE2-CD1 3.99Å; F57-L125 HydrophobicContact CZ-CD1 3.82Å; I116-L125 VanDerWaalsContact CA-O 3.32Å; I116-L125 WeakPolarHBondContact CA-O 3.39Å; T117-L125 PolarHBondContact N-O 2.86Å; T117-L125 PolarHBondContact O-N 2.87Å; Y123-L125 HydrophobicContact CD2-CD2 4.03Å; Y123-L125 HydrophobicContact CD2-CG 4.05Å; Y123-L125 HydrophobicContact CE2-CD1 4.05Å; Y123-L125 HydrophobicContact CE2-CD2 4.1Å; Y123-L125 HydrophobicContact CE2-CG 3.95Å; L125-E127 HydrophobicContact CB-CG 4.44Å; L125-L140 HydrophobicContact CB-CD1 4.48Å; L125-L140 HydrophobicContact CD2-CD1 3.91Å; L125-F143 HydrophobicContact CD2-CD2 3.66Å; L125-F143 HydrophobicContact CD2-CE2 4.37Å; L125-V154 HydrophobicContact CD2-CB 4.18Å; L125-V154 HydrophobicContact CD2-CG2 4.14Å; L125-L157 HydrophobicContact CD1-CD2 3.79Å
126	V	97.8	Very high	94.7	Very high	19 Å²	19	42.7 Å²	42.7	12%	0.115	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	110.3	167.5	-178.7	0	0	0	0	106.2	I116 F128 N141 N142 I144	I116-V126 HydrophobicContact CG1-CG1 4.26Å; I116-V126 HydrophobicContact CG1-CG2 4.38Å; I116-V126 HydrophobicContact CG2-CG2 4.42Å; V126-F128 HydrophobicContact CG1-CD2 4.11Å; V126-F128 HydrophobicContact CG1-CE2 3.46Å; V126-F128 VanDerWaalsContact CG1-CE2 3.46Å; V126-F128 HydrophobicContact CG1-CZ 3.84Å; V126-N141 WeakPolarHBondContact O-CA 3.49Å; V126-N141 WeakPolarHBondContact O-CB 3.44Å; V126-N141 PolarHBondContact O-N 2.81Å; V126-N142 HydrophobicContact CB-CB 4.07Å; V126-N142 HydrophobicContact CG2-CB 4.37Å; V126-N142 PolarHBondContact N-O 2.86Å; V126-N142 PolarHBondContact O-N 2.91Å; V126-I144 HydrophobicContact CG2-CD1 4.25Å
127	E	98.3	Very high	94.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	139.1	178.2	-51.1	173.1	-124.4	0	0	108.9	G114 L115 L125 L138 E139 L157 R159	G114-E127 CarbonylContact C-O 3.21Å; G114-E127 WeakPolarHBondContact CA-O 3.23Å; L115-E127 HydrophobicContact CB-CB 4.4Å; L115-E127 PolarHBondContact N-O 2.84Å; L115-E127 PolarHBondContact O-N 3.11Å; L125-E127 HydrophobicContact CB-CG 4.44Å; E127-L138 HydrophobicContact CB-CB 4.02Å; E127-L138 HydrophobicContact CB-CD2 4.31Å; E127-E139 CarbonylContact C-O 3.55Å; E127-E139 WeakPolarHBondContact CA-O 3.43Å; E127-L157 HydrophobicContact CG-CD2 4.07Å; E127-R159 IonicContact OE1-CZ 3.24Å; E127-R159 IonicContact OE1-NE 3.25Å; E127-R159 PolarHBondContact OE1-NE 3.46Å; E127-R159 IonicContact OE1-NH2 2.72Å; E127-R159 PolarHBondContact OE1-NH2 3.23Å; E127-R159 VanDerWaalsContact OE2-CB 3.28Å; E127-R159 WeakPolarHBondContact OE2-CB 3.35Å; E127-R159 IonicContact OE2-NE 2.9Å; E127-R159 PolarHBondContact OE2-NE 2.93Å
128	F	97	Very high	94.9	Very high	99 Å²	99	41.6 Å²	41.6	43%	0.434	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	154.1	175.3	-73.5	-65.7	0	0	0	111.1	C113 V126 E139 N141	C113-F128 WeakPolarHBondContact O-CA 3.35Å; V126-F128 HydrophobicContact CG1-CD2 4.11Å; V126-F128 HydrophobicContact CG1-CE2 3.46Å; V126-F128 VanDerWaalsContact CG1-CE2 3.46Å; V126-F128 HydrophobicContact CG1-CZ 3.84Å; F128-E139 PolarHBondContact N-O 3.13Å; F128-E139 PolarHBondContact O-N 3.29Å; F128-N141 HydrophobicContact CD2-CB 3.53Å; F128-N141 HydrophobicContact CE2-CB 4.17Å
129	G	96.7	Very high	95	Very high	23 Å²	23	46.8 Å²	46.8	24%	0.237	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.7	-138.1	169.9	0	0	0	0	0	112	L112 C113 D137	L112-G129 CarbonylContact C-O 3.48Å; L112-G129 WeakPolarHBondContact CA-O 3.3Å; C113-G129 PolarHBondContact N-O 3.1Å; C113-G129 PolarHBondContact O-N 3.13Å; G129-D137 CarbonylContact C-O 3.52Å; G129-D137 WeakPolarHBondContact CA-O 3.2Å
130	M	95.9	Very high	95.2	Very high	59 Å²	59	47.8 Å²	47.8	29%	0.291	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.9	-166.6	-65.8	-173	-75	0	0	113	Q110 I111 L112 D137	Q110-M130 HydrophobicContact CB-SD 4.28Å; Q110-M130 VanDerWaalsContact CD-SD 3.57Å; Q110-M130 HydrophobicContact CG-SD 4.17Å; I111-M130 WeakPolarHBondContact O-CA 3.49Å; L112-M130 HydrophobicContact CD2-CG 3.84Å; M130-D137 PolarHBondContact N-O 3.29Å; M130-D137 PolarHBondContact O-N 2.96Å
131	V	95.6	Very high	95.6	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.2	168.8	-166	0	0	0	0	109.2	P36 V37 I111 C113 F135 V136	P36-V131 HydrophobicContact CB-CG1 4Å; V37-V131 HydrophobicContact CG1-CG1 4.16Å; V37-V131 HydrophobicContact CG1-CG2 4.06Å; I111-V131 HydrophobicContact CB-CB 4.16Å; I111-V131 HydrophobicContact CG2-CB 3.83Å; I111-V131 HydrophobicContact CG2-CG2 3.98Å; I111-V131 PolarHBondContact O-N 2.92Å; C113-V131 HydrophobicContact CB-CG2 3.57Å; V131-F135 CarbonylContact C-O 3.58Å; V131-F135 VanDerWaalsContact CA-O 3.3Å; V131-F135 WeakPolarHBondContact CA-O 3.47Å; V131-V136 HydrophobicContact CB-CG2 4.47Å; V131-V136 HydrophobicContact CG1-CG2 4.03Å; V131-V136 HydrophobicContact CG2-CG2 4Å
132	Q	93.4	Very high	96	Very high	94 Å²	94	47.1 Å²	47.1	44%	0.439	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	116.9	175.7	-62.6	-172.2	6	0	0	109.7	G134 F135	Q132-G134 PolarHBondContact O-N 2.61Å; Q132-G134 VanDerWaalsContact O-N 3.11Å; Q132-F135 PolarHBondContact N-O 3.27Å; Q132-F135 WeakPolarHBondContact O-CA 3.24Å; Q132-F135 VanDerWaalsContact O-CB 3.23Å; Q132-F135 WeakPolarHBondContact O-CB 3.22Å; Q132-F135 PolarHBondContact O-N 3.39Å
133	H	90.2	Very high	96.3	Very high	194 Å²	194	48.3 Å²	48.3	90%	0.898	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	35.3	178.2	-49	105.4	0	0	0	114	F135	H133-F135 PolarHBondContact O-N 2.85Å
134	G	90.9	Very high	96.3	Very high	16 Å²	16	51.6 Å²	51.6	17%	0.165	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	2.7	-177	0	0	0	0	0	115.6	H39 Q132	H39-G134 WeakPolarHBondContact CE1-CA 3.33Å; H39-G134 PolarHBondContact CE1-O 3.23Å; H39-G134 PolarHBondContact NE2-O 3.01Å; H39-G134 VanDerWaalsContact NE2-O 3.15Å; Q132-G134 PolarHBondContact O-N 2.61Å; Q132-G134 VanDerWaalsContact O-N 3.11Å
135	F	97.5	Very high	96.1	Very high	79 Å²	79	54.7 Å²	54.7	35%	0.346	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124.1	164	-173	-90.6	0	0	0	109.6	V131 Q132 H133 D137 N160 Y162	V131-F135 CarbonylContact C-O 3.58Å; V131-F135 VanDerWaalsContact CA-O 3.3Å; V131-F135 WeakPolarHBondContact CA-O 3.47Å; Q132-F135 PolarHBondContact N-O 3.27Å; Q132-F135 WeakPolarHBondContact O-CA 3.24Å; Q132-F135 VanDerWaalsContact O-CB 3.23Å; Q132-F135 WeakPolarHBondContact O-CB 3.22Å; Q132-F135 PolarHBondContact O-N 3.39Å; H133-F135 PolarHBondContact O-N 2.85Å; F135-D137 HydrophobicContact CD1-CB 4.26Å; F135-D137 HydrophobicContact CE1-CB 3.83Å; F135-N160 HydrophobicContact CE1-CB 4.45Å; F135-N160 WeakPolarHBondContact CE1-ND2 3.45Å; F135-N160 HydrophobicContact CE2-CB 4.19Å; F135-N160 HydrophobicContact CZ-CB 3.77Å; F135-N160 VanDerWaalsContact CZ-ND2 3.28Å; F135-N160 WeakPolarHBondContact CZ-ND2 3.44Å; F135-Y162 AromaticContact CD2-CD1 3.53Å; F135-Y162 HydrophobicContact CD2-CD1 3.53Å; F135-Y162 HydrophobicContact CD2-CD2 4.39Å; F135-Y162 HydrophobicContact CD2-CE1 4.19Å; F135-Y162 AromaticContact CD2-CG 3.64Å; F135-Y162 HydrophobicContact CD2-CG 3.64Å; F135-Y162 AromaticContact CE2-CD1 3.36Å; F135-Y162 HydrophobicContact CE2-CD1 3.36Å; F135-Y162 AromaticContact CE2-CE1 3.59Å; F135-Y162 HydrophobicContact CE2-CE1 3.59Å; F135-Y162 AromaticContact CE2-CG 3.93Å; F135-Y162 HydrophobicContact CE2-CG 3.93Å; F135-Y162 HydrophobicContact CZ-CD1 4.41Å
136	V	98.2	Very high	95.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.9	173.5	169.5	0	0	0	0	108.7	V37 F40 V131 L138 N160 L161	V37-V136 HydrophobicContact CG1-CG2 3.84Å; F40-V136 HydrophobicContact CE2-CB 4.35Å; F40-V136 HydrophobicContact CE2-CG2 3.6Å; F40-V136 HydrophobicContact CZ-CG2 4.05Å; V131-V136 HydrophobicContact CB-CG2 4.47Å; V131-V136 HydrophobicContact CG1-CG2 4.03Å; V131-V136 HydrophobicContact CG2-CG2 4Å; V136-L138 HydrophobicContact CG1-CD1 3.75Å; V136-L138 HydrophobicContact CG1-CD2 4.33Å; V136-L138 HydrophobicContact CG1-CG 3.67Å; V136-N160 CarbonylContact O-C 3.5Å; V136-N160 VanDerWaalsContact O-CA 3.23Å; V136-N160 WeakPolarHBondContact O-CA 3.24Å; V136-L161 HydrophobicContact CB-CB 4.15Å; V136-L161 PolarHBondContact N-O 2.85Å; V136-L161 PolarHBondContact O-N 2.91Å
137	D	98.1	Very high	94.5	Very high	35 Å²	35	64 Å²	64	19%	0.187	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.6	174.6	-166.3	14.7	0	0	0	108.5	G129 M130 F135 R158 N160	G129-D137 CarbonylContact C-O 3.52Å; G129-D137 WeakPolarHBondContact CA-O 3.2Å; M130-D137 PolarHBondContact N-O 3.29Å; M130-D137 PolarHBondContact O-N 2.96Å; F135-D137 HydrophobicContact CD1-CB 4.26Å; F135-D137 HydrophobicContact CE1-CB 3.83Å; D137-R158 IonicContact OD1-CZ 3.5Å; D137-R158 IonicContact OD1-NE 2.93Å; D137-R158 PolarHBondContact OD1-NE 3.43Å; D137-R158 IonicContact OD1-NH2 3.32Å; D137-R158 PolarHBondContact OD1-NH2 3.01Å; D137-R158 IonicContact OD2-CZ 3.67Å; D137-R158 IonicContact OD2-NE 3.89Å; D137-R158 IonicContact OD2-NH2 2.86Å; D137-R158 PolarHBondContact OD2-NH2 2.73Å; D137-N160 WeakPolarHBondContact CA-ND2 3.36Å; D137-N160 VanDerWaalsContact CG-ND2 3.32Å; D137-N160 PolarHBondContact OD1-ND2 3.47Å
138	L	98.6	Very high	93.2	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.1	-176	-69	164.6	0	0	0	109.5	L115 E127 V136 R158 R159	L115-L138 HydrophobicContact CB-CD1 3.67Å; L115-L138 HydrophobicContact CB-CD2 4.33Å; L115-L138 HydrophobicContact CD2-CD1 3.93Å; L115-L138 HydrophobicContact CG-CD1 4.46Å; E127-L138 HydrophobicContact CB-CB 4.02Å; E127-L138 HydrophobicContact CB-CD2 4.31Å; V136-L138 HydrophobicContact CG1-CD1 3.75Å; V136-L138 HydrophobicContact CG1-CD2 4.33Å; V136-L138 HydrophobicContact CG1-CG 3.67Å; L138-R158 CarbonylContact O-C 3.56Å; L138-R158 VanDerWaalsContact O-CA 3.3Å; L138-R158 WeakPolarHBondContact O-CA 3.35Å; L138-R158 WeakPolarHBondContact O-CG 3.42Å; L138-R159 HydrophobicContact CB-CB 4.27Å; L138-R159 WeakPolarHBondContact CB-O 3.44Å; L138-R159 PolarHBondContact N-O 3.25Å; L138-R159 PolarHBondContact O-N 2.72Å
139	E	98.4	Very high	92.3	Very high	135 Å²	135	76.3 Å²	76.3	63%	0.631	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	146.2	173.3	-173.2	177.1	171.9	0	0	109.7	E127 F128 N141 L157	E127-E139 CarbonylContact C-O 3.55Å; E127-E139 WeakPolarHBondContact CA-O 3.43Å; F128-E139 PolarHBondContact N-O 3.13Å; F128-E139 PolarHBondContact O-N 3.29Å; E139-N141 PolarHBondContact O-N 3.31Å; E139-L157 CarbonylContact C-O 3.54Å; E139-L157 WeakPolarHBondContact CA-O 3.44Å
140	L	98.5	Very high	91.4	Very high	28 Å²	28	77.6 Å²	77.6	15%	0.147	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	120.7	175.4	-172.3	64.1	0	0	0	110.5	L125 N142 V154 L157	L125-L140 HydrophobicContact CB-CD1 4.48Å; L125-L140 HydrophobicContact CD2-CD1 3.91Å; L140-N142 WeakPolarHBondContact CD1-O 3.43Å; L140-V154 HydrophobicContact CD2-CB 4.45Å; L140-V154 HydrophobicContact CD2-CG1 4Å; L140-L157 HydrophobicContact CB-CB 3.99Å; L140-L157 HydrophobicContact CD2-CB 4.48Å; L140-L157 PolarHBondContact N-O 2.9Å
141	N	97.9	Very high	90.8	Very high	104 Å²	104	85.1 Å²	85.1	56%	0.556	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	-37.7	171.1	176.9	83.3	0	0	0	111.7	V126 F128 E139	V126-N141 WeakPolarHBondContact O-CA 3.49Å; V126-N141 WeakPolarHBondContact O-CB 3.44Å; V126-N141 PolarHBondContact O-N 2.81Å; F128-N141 HydrophobicContact CD2-CB 3.53Å; F128-N141 HydrophobicContact CE2-CB 4.17Å; E139-N141 PolarHBondContact O-N 3.31Å
142	N	96.7	Very high	90.6	Very high	80 Å²	80	86 Å²	86	43%	0.428	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	141.5	178.3	-155.7	-9.3	0	0	0	112.6	V126 L140	V126-N142 HydrophobicContact CB-CB 4.07Å; V126-N142 HydrophobicContact CG2-CB 4.37Å; V126-N142 PolarHBondContact N-O 2.86Å; V126-N142 PolarHBondContact O-N 2.91Å; L140-N142 WeakPolarHBondContact CD1-O 3.43Å
143	F	96	Very high	90.6	Very high	37 Å²	37	84 Å²	84	16%	0.162	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.2	171	173.1	-92.3	0	0	0	108.7	Y123 L125 T145 Y152 N153 V154	Y123-F143 HydrophobicContact CD1-CE2 4.26Å; Y123-F143 HydrophobicContact CD2-CD2 4.26Å; Y123-F143 AromaticContact CD2-CE2 3.6Å; Y123-F143 HydrophobicContact CD2-CE2 3.6Å; Y123-F143 HydrophobicContact CD2-CZ 4.49Å; Y123-F143 HydrophobicContact CE2-CE2 4.39Å; Y123-F143 AromaticContact CG-CE2 3.55Å; Y123-F143 HydrophobicContact CG-CE2 3.55Å; Y123-F143 HydrophobicContact CG-CZ 4Å; L125-F143 HydrophobicContact CD2-CD2 3.66Å; L125-F143 HydrophobicContact CD2-CE2 4.37Å; F143-T145 HydrophobicContact CD1-CG2 4.45Å; F143-T145 HydrophobicContact CE1-CG2 3.54Å; F143-T145 HydrophobicContact CZ-CG2 4.16Å; F143-Y152 WeakPolarHBondContact CZ-O 3.29Å; F143-N153 HydrophobicContact CE1-CB 4.39Å; F143-N153 WeakPolarHBondContact CE1-OD1 3.46Å; F143-V154 HydrophobicContact CD2-CB 3.75Å; F143-V154 HydrophobicContact CD2-CG2 3.94Å; F143-V154 HydrophobicContact CE2-CB 4.18Å; F143-V154 HydrophobicContact CE2-CG2 3.9Å
144	I	94.2	Very high	90.9	Very high	71 Å²	71	75 Å²	75	36%	0.364	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.9	-175	-55.9	170.6	0	0	0	108.7	Y123 S124 V126	Y123-I144 CarbonylContact C-O 3.55Å; Y123-I144 VanDerWaalsContact CA-O 3.29Å; Y123-I144 WeakPolarHBondContact CA-O 3.3Å; S124-I144 PolarHBondContact N-O 2.8Å; S124-I144 PolarHBondContact O-N 2.83Å; V126-I144 HydrophobicContact CG2-CD1 4.25Å
145	T	90.8	Very high	91.2	Very high	73 Å²	73	79.9 Å²	79.9	45%	0.448	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	133.3	169.4	51.9	0	0	0	0	109.9	F143	F143-T145 HydrophobicContact CD1-CG2 4.45Å; F143-T145 HydrophobicContact CE1-CG2 3.54Å; F143-T145 HydrophobicContact CZ-CG2 4.16Å
146	R	82.8	Confident	91.2	Very high	168 Å²	168	81 Å²	81	63%	0.634	38%	0.38	S	S	*	.	S	Bend	trans	-100.4	-20.8	176.3	-65.3	-71.9	-59	-154.6	-1.6	112.4	G122	G122-R146 WeakPolarHBondContact O-CA 3.16Å; G122-R146 WeakPolarHBondContact O-CB 3.33Å; G122-R146 PolarHBondContact O-N 2.91Å
147	S	78.5	Confident	91.2	Very high	48 Å²	48	81.2 Å²	81.2	34%	0.336	38%	0.381	S	S	.	.	S	Bend	trans	-125.2	135.3	178.9	-47.5	0	0	0	0	109.6	D149 Q150	S147-D149 WeakPolarHBondContact CB-OD1 3.48Å; S147-D149 PolarHBondContact O-N 3.04Å; S147-Q150 PolarHBondContact O-N 2.89Å
148	F	71.6	Confident	91.3	Very high	225 Å²	225	84.9 Å²	84.9	99%	0.987	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.4	-176.8	-68.3	-79.4	0	0	0	113.7
149	D	77	Confident	91.3	Very high	132 Å²	132	84.8 Å²	84.8	71%	0.706	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-3.9	-178.2	62	-27.2	0	0	0	113.7	S147 R151	S147-D149 WeakPolarHBondContact CB-OD1 3.48Å; S147-D149 PolarHBondContact O-N 3.04Å; D149-R151 PolarHBondContact O-N 2.82Å
150	Q	78.9	Confident	91.3	Very high	50 Å²	50	79.4 Å²	79.4	23%	0.234	37%	0.367	C	S	.	.			trans	-73.1	121.8	178.3	174.1	51.5	-56.2	0	0	111.7	R121 S147 Y152	R121-Q150 PolarHBondContact O-NE2 2.97Å; S147-Q150 PolarHBondContact O-N 2.89Å; Q150-Y152 VanDerWaalsContact CD-CB 3.49Å; Q150-Y152 VanDerWaalsContact CD-N 3.29Å; Q150-Y152 VanDerWaalsContact NE2-CB 3.3Å
151	R	84	Confident	91.3	Very high	216 Å²	216	78.1 Å²	78.1	82%	0.815	36%	0.36	S	S	*	.			trans	-98.4	-12.5	176.7	-55.2	-173.2	-179.6	-163.5	-0.9	115.4	D149 N153 S177	D149-R151 PolarHBondContact O-N 2.82Å; R151-N153 PolarHBondContact O-ND2 3.22Å; R151-S177 PolarHBondContact O-OG 2.9Å
152	Y	91.1	Very high	91.3	Very high	21 Å²	21	75.1 Å²	75.1	8%	0.082	34%	0.341	C	S	.	.			trans	-74.1	127.9	175.4	-174.4	-99.7	0	0	0	109.8	V56 F57 Y123 F143 Q150 V154 T176 S177 A178	V56-Y152 WeakPolarHBondContact O-CE2 3.46Å; V56-Y152 PolarHBondContact O-OH 3.21Å; F57-Y152 WeakPolarHBondContact CD2-OH 3.42Å; Y123-Y152 AromaticContact CD1-CD1 3.75Å; Y123-Y152 HydrophobicContact CD1-CD1 3.75Å; Y123-Y152 HydrophobicContact CD1-CE1 4.31Å; Y123-Y152 AromaticContact CE1-CD1 3.27Å; Y123-Y152 HydrophobicContact CE1-CD1 3.27Å; Y123-Y152 AromaticContact CE1-CE1 3.48Å; Y123-Y152 HydrophobicContact CE1-CE1 3.48Å; Y123-Y152 VanDerWaalsContact CE1-CE1 3.48Å; Y123-Y152 HydrophobicContact CE1-CG 4.34Å; Y123-Y152 HydrophobicContact CE2-CE1 4.4Å; Y123-Y152 AromaticContact CZ-CD1 3.87Å; Y123-Y152 AromaticContact CZ-CE1 3.56Å; F143-Y152 WeakPolarHBondContact CZ-O 3.29Å; Q150-Y152 VanDerWaalsContact CD-CB 3.49Å; Q150-Y152 VanDerWaalsContact CD-N 3.29Å; Q150-Y152 VanDerWaalsContact NE2-CB 3.3Å; Y152-V154 HydrophobicContact CD1-CG2 4.29Å; Y152-V154 HydrophobicContact CE1-CG2 3.52Å; Y152-T176 HydrophobicContact CE2-CG2 4.47Å; Y152-T176 WeakPolarHBondContact OH-CG2 3.46Å; Y152-S177 WeakPolarHBondContact CA-OG 3.42Å; Y152-A178 HydrophobicContact CD2-CB 4.36Å; Y152-A178 HydrophobicContact CE2-CB 4.09Å
153	N	93.4	Very high	91.4	Very high	52 Å²	52	74.3 Å²	74.3	28%	0.278	34%	0.336	S	S	.	.			trans	-128.4	144.6	177.1	-69.2	-61.4	0	0	0	109.8	F143 R151 Y155 T176 S177	F143-N153 HydrophobicContact CE1-CB 4.39Å; F143-N153 WeakPolarHBondContact CE1-OD1 3.46Å; R151-N153 PolarHBondContact O-ND2 3.22Å; N153-Y155 HydrophobicContact CB-CD1 4.33Å; N153-Y155 HydrophobicContact CB-CE1 3.68Å; N153-T176 CarbonylContact O-C 3.56Å; N153-T176 WeakPolarHBondContact O-CA 3.13Å; N153-T176 VanDerWaalsContact O-CB 3.26Å; N153-T176 WeakPolarHBondContact O-CB 3.18Å; N153-S177 PolarHBondContact N-OG 2.78Å; N153-S177 PolarHBondContact O-N 2.79Å
154	V	96.1	Very high	91.4	Very high	5 Å²	5	79.2 Å²	79.2	3%	0.03	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	116.9	169.5	-172.9	0	0	0	0	106.7	F57 Y123 L125 L140 F143 Y152 L157 T176	F57-V154 HydrophobicContact CD2-CG1 4.49Å; F57-V154 HydrophobicContact CD2-CG2 4.16Å; F57-V154 HydrophobicContact CE2-CG1 4.2Å; F57-V154 HydrophobicContact CE2-CG2 3.94Å; Y123-V154 HydrophobicContact CE2-CG2 4.44Å; L125-V154 HydrophobicContact CD2-CB 4.18Å; L125-V154 HydrophobicContact CD2-CG2 4.14Å; L140-V154 HydrophobicContact CD2-CB 4.45Å; L140-V154 HydrophobicContact CD2-CG1 4Å; F143-V154 HydrophobicContact CD2-CB 3.75Å; F143-V154 HydrophobicContact CD2-CG2 3.94Å; F143-V154 HydrophobicContact CE2-CB 4.18Å; F143-V154 HydrophobicContact CE2-CG2 3.9Å; Y152-V154 HydrophobicContact CD1-CG2 4.29Å; Y152-V154 HydrophobicContact CE1-CG2 3.52Å; V154-L157 HydrophobicContact CG1-CB 3.93Å; V154-T176 HydrophobicContact CG1-CG2 4.47Å; V154-T176 HydrophobicContact CG2-CG2 4.38Å
155	Y	96.7	Very high	91.4	Very high	118 Å²	118	80.5 Å²	80.5	46%	0.463	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-40.3	-177	-53.4	-59.8	0	0	0	111.3	N153 R175 T176 S177	N153-Y155 HydrophobicContact CB-CD1 4.33Å; N153-Y155 HydrophobicContact CB-CE1 3.68Å; Y155-R175 HydrophobicContact CD2-CG 4.21Å; Y155-R175 PolarHBondContact N-O 2.9Å; Y155-T176 VanDerWaalsContact CE2-C 3.4Å; Y155-S177 WeakPolarHBondContact OH-CB 3.2Å
156	E	98.1	Very high	91.6	Very high	103 Å²	103	79.7 Å²	79.7	48%	0.481	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	143	176	-70.2	155.8	-156.5	0	0	108	A174 R175	E156-A174 CarbonylContact O-C 3.56Å; E156-A174 VanDerWaalsContact O-CA 3.26Å; E156-A174 WeakPolarHBondContact O-CA 3.25Å; E156-R175 HydrophobicContact CB-CB 3.98Å; E156-R175 PolarHBondContact N-O 3.24Å; E156-R175 PolarHBondContact O-N 2.89Å; E156-R175 IonicContact OE1-CZ 3.23Å; E156-R175 VanDerWaalsContact OE1-CZ 3.23Å; E156-R175 IonicContact OE1-NE 3.01Å; E156-R175 PolarHBondContact OE1-NE 3.26Å; E156-R175 IonicContact OE1-NH2 2.68Å; E156-R175 PolarHBondContact OE1-NH2 2.93Å; E156-R175 IonicContact OE2-NE 3.19Å; E156-R175 PolarHBondContact OE2-NE 2.89Å
157	L	98.6	Very high	92.3	Very high	4 Å²	4	72.8 Å²	72.8	2%	0.021	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	132.1	170	163.3	72.4	0	0	0	108.3	F57 L125 E127 E139 L140 V154 I172 E173 A174	F57-L157 HydrophobicContact CD1-CD1 4.4Å; F57-L157 HydrophobicContact CE1-CD1 3.82Å; F57-L157 HydrophobicContact CE1-CD2 4.39Å; F57-L157 HydrophobicContact CE2-CD1 4.3Å; F57-L157 HydrophobicContact CE2-CD2 4.11Å; F57-L157 HydrophobicContact CZ-CD1 3.77Å; F57-L157 HydrophobicContact CZ-CD2 3.61Å; F57-L157 HydrophobicContact CZ-CG 4.31Å; L125-L157 HydrophobicContact CD1-CD2 3.79Å; E127-L157 HydrophobicContact CG-CD2 4.07Å; E139-L157 CarbonylContact C-O 3.54Å; E139-L157 WeakPolarHBondContact CA-O 3.44Å; L140-L157 HydrophobicContact CB-CB 3.99Å; L140-L157 HydrophobicContact CD2-CB 4.48Å; L140-L157 PolarHBondContact N-O 2.9Å; V154-L157 HydrophobicContact CG1-CB 3.93Å; L157-I172 HydrophobicContact CD1-CD1 4.36Å; L157-I172 HydrophobicContact CD1-CG2 4.21Å; L157-E173 CarbonylContact C-O 3.57Å; L157-E173 VanDerWaalsContact CA-O 3.31Å; L157-E173 WeakPolarHBondContact CA-O 3.15Å; L157-A174 HydrophobicContact CB-CB 4.45Å; L157-A174 HydrophobicContact CD1-CB 3.97Å
158	R	98.6	Very high	93.3	Very high	111 Å²	111	70.5 Å²	70.5	42%	0.419	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.9	163.4	-168.6	177.3	-172	154.7	-0.6	108.5	D137 L138 E173	D137-R158 IonicContact OD1-CZ 3.5Å; D137-R158 IonicContact OD1-NE 2.93Å; D137-R158 PolarHBondContact OD1-NE 3.43Å; D137-R158 IonicContact OD1-NH2 3.32Å; D137-R158 PolarHBondContact OD1-NH2 3.01Å; D137-R158 IonicContact OD2-CZ 3.67Å; D137-R158 IonicContact OD2-NE 3.89Å; D137-R158 IonicContact OD2-NH2 2.86Å; D137-R158 PolarHBondContact OD2-NH2 2.73Å; L138-R158 CarbonylContact O-C 3.56Å; L138-R158 VanDerWaalsContact O-CA 3.3Å; L138-R158 WeakPolarHBondContact O-CA 3.35Å; L138-R158 WeakPolarHBondContact O-CG 3.42Å; R158-E173 HydrophobicContact CB-CB 4.4Å; R158-E173 PolarHBondContact N-O 2.86Å; R158-E173 PolarHBondContact O-N 2.86Å
159	R	98.6	Very high	94.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.6	177.5	-176.9	-170.4	-52.2	-122.3	11	109.5	E127 L138 L161 Q170 D171 I172	E127-R159 IonicContact OE1-CZ 3.24Å; E127-R159 IonicContact OE1-NE 3.25Å; E127-R159 PolarHBondContact OE1-NE 3.46Å; E127-R159 IonicContact OE1-NH2 2.72Å; E127-R159 PolarHBondContact OE1-NH2 3.23Å; E127-R159 VanDerWaalsContact OE2-CB 3.28Å; E127-R159 WeakPolarHBondContact OE2-CB 3.35Å; E127-R159 IonicContact OE2-NE 2.9Å; E127-R159 PolarHBondContact OE2-NE 2.93Å; L138-R159 HydrophobicContact CB-CB 4.27Å; L138-R159 WeakPolarHBondContact CB-O 3.44Å; L138-R159 PolarHBondContact N-O 3.25Å; L138-R159 PolarHBondContact O-N 2.72Å; R159-L161 HydrophobicContact CG-CG 4.34Å; R159-Q170 HydrophobicContact CG-CG 4.11Å; R159-Q170 VanDerWaalsContact NH1-OE1 3.08Å; R159-D171 WeakPolarHBondContact CA-O 3.28Å; R159-I172 HydrophobicContact CB-CD1 4.07Å; R159-I172 HydrophobicContact CG-CD1 3.76Å
160	N	98.5	Very high	95.6	Very high	21 Å²	21	55.1 Å²	55.1	11%	0.112	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.2	167.9	-56.8	105.4	0	0	0	110.5	F135 V136 D137 Y162 Q170 D171	F135-N160 HydrophobicContact CE1-CB 4.45Å; F135-N160 WeakPolarHBondContact CE1-ND2 3.45Å; F135-N160 HydrophobicContact CE2-CB 4.19Å; F135-N160 HydrophobicContact CZ-CB 3.77Å; F135-N160 VanDerWaalsContact CZ-ND2 3.28Å; F135-N160 WeakPolarHBondContact CZ-ND2 3.44Å; V136-N160 CarbonylContact O-C 3.5Å; V136-N160 VanDerWaalsContact O-CA 3.23Å; V136-N160 WeakPolarHBondContact O-CA 3.24Å; D137-N160 WeakPolarHBondContact CA-ND2 3.36Å; D137-N160 VanDerWaalsContact CG-ND2 3.32Å; D137-N160 PolarHBondContact OD1-ND2 3.47Å; N160-Y162 HydrophobicContact CB-CD1 4.29Å; N160-Y162 HydrophobicContact CB-CE1 4.16Å; N160-Q170 CarbonylContact O-C 3.44Å; N160-Q170 WeakPolarHBondContact O-CA 3.4Å; N160-D171 HydrophobicContact CB-CB 4.14Å; N160-D171 PolarHBondContact N-O 3.2Å; N160-D171 PolarHBondContact O-N 3.04Å
161	L	98.5	Very high	96.6	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	127.9	173.7	-66.6	168.4	0	0	0	108.7	F40 F65 V136 R159 L168 Q170	F40-L161 HydrophobicContact CE1-CB 4.31Å; F40-L161 HydrophobicContact CE2-CB 4.16Å; F40-L161 HydrophobicContact CZ-CB 3.78Å; F40-L161 WeakPolarHBondContact CZ-O 3.33Å; F65-L161 HydrophobicContact CZ-CD1 4.3Å; V136-L161 HydrophobicContact CB-CB 4.15Å; V136-L161 PolarHBondContact N-O 2.85Å; V136-L161 PolarHBondContact O-N 2.91Å; R159-L161 HydrophobicContact CG-CG 4.34Å; L161-L168 HydrophobicContact CD2-CD1 4.38Å; L161-Q170 HydrophobicContact CD2-CB 3.73Å; L161-Q170 HydrophobicContact CD2-CG 3.61Å
162	Y	98.4	Very high	97.2	Very high	41 Å²	41	43.9 Å²	43.9	16%	0.161	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	158.9	178.2	55.4	-80.2	0	0	0	111.4	F135 N160 Y164 K169 D171	F135-Y162 AromaticContact CD2-CD1 3.53Å; F135-Y162 HydrophobicContact CD2-CD1 3.53Å; F135-Y162 HydrophobicContact CD2-CD2 4.39Å; F135-Y162 HydrophobicContact CD2-CE1 4.19Å; F135-Y162 AromaticContact CD2-CG 3.64Å; F135-Y162 HydrophobicContact CD2-CG 3.64Å; F135-Y162 AromaticContact CE2-CD1 3.36Å; F135-Y162 HydrophobicContact CE2-CD1 3.36Å; F135-Y162 AromaticContact CE2-CE1 3.59Å; F135-Y162 HydrophobicContact CE2-CE1 3.59Å; F135-Y162 AromaticContact CE2-CG 3.93Å; F135-Y162 HydrophobicContact CE2-CG 3.93Å; F135-Y162 HydrophobicContact CZ-CD1 4.41Å; N160-Y162 HydrophobicContact CB-CD1 4.29Å; N160-Y162 HydrophobicContact CB-CE1 4.16Å; Y162-Y164 HydrophobicContact CE2-CD2 4.42Å; Y162-Y164 HydrophobicContact CE2-CG 4.5Å; Y162-K169 HydrophobicContact CD2-CB 4.39Å; Y162-K169 HydrophobicContact CE1-CB 4.39Å; Y162-K169 HydrophobicContact CE1-CG 4.29Å; Y162-K169 HydrophobicContact CE2-CB 4.07Å; Y162-K169 HydrophobicContact CE2-CD 3.98Å; Y162-K169 HydrophobicContact CE2-CG 4.31Å; Y162-K169 PolarHBondContact N-O 2.54Å; Y162-K169 VanDerWaalsContact N-O 3.13Å; Y162-K169 PolarHBondContact O-N 2.87Å; Y162-K169 VanDerWaalsContact OH-CD 3.3Å; Y162-K169 WeakPolarHBondContact OH-CD 3.05Å; Y162-K169 PolarHBondContact OH-NZ 2.6Å; Y162-D171 VanDerWaalsContact CE1-OD2 3.24Å; Y162-D171 WeakPolarHBondContact CE1-OD2 3.3Å; Y162-D171 PolarHBondContact OH-OD2 3.29Å
163	I	98	Very high	97.6	Very high	63 Å²	63	48.8 Å²	48.8	32%	0.323	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.8	171.6	-54.9	-55.2	0	0	0	109.3	H39 F40 W44 D167 L168	H39-I163 HydrophobicContact CB-CG1 4.4Å; F40-I163 HydrophobicContact CD1-CD1 4.1Å; F40-I163 HydrophobicContact CE1-CD1 4.25Å; F40-I163 HydrophobicContact CE1-CG1 4.48Å; W44-I163 HydrophobicContact CH2-CD1 3.62Å; W44-I163 HydrophobicContact CZ2-CD1 4.05Å; W44-I163 HydrophobicContact CZ3-CD1 4.37Å; I163-D167 CarbonylContact C-O 3.47Å; I163-D167 VanDerWaalsContact CA-O 3.31Å; I163-D167 WeakPolarHBondContact CA-O 3.28Å; I163-L168 HydrophobicContact CD1-CB 4.13Å; I163-L168 HydrophobicContact CD1-CD1 4.26Å
164	Y	96.5	Very high	97.9	Very high	141 Å²	141	46.7 Å²	46.7	55%	0.553	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.6	176.2	-179.2	-98	0	0	0	109.3	Y162 G166 D167 M186	Y162-Y164 HydrophobicContact CE2-CD2 4.42Å; Y162-Y164 HydrophobicContact CE2-CG 4.5Å; Y164-G166 PolarHBondContact O-N 2.83Å; Y164-D167 PolarHBondContact N-O 2.67Å; Y164-D167 PolarHBondContact O-N 2.93Å; Y164-M186 HydrophobicContact CD1-CE 4Å
165	A	94.6	Very high	98	Very high	97 Å²	97	51.7 Å²	51.7	80%	0.802	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	36	-178.2	0	0	0	0	0	114.1	D167	A165-D167 VanDerWaalsContact C-N 3.28Å; A165-D167 PolarHBondContact O-N 2.65Å
166	G	95.3	Very high	98	Very high	57 Å²	57	46.4 Å²	46.4	59%	0.588	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	-10.7	179.6	0	0	0	0	0	115.2	Y164	Y164-G166 PolarHBondContact O-N 2.83Å
167	D	98	Very high	97.9	Very high	23 Å²	23	44 Å²	44	12%	0.123	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.5	175.1	-75.1	-33.9	0	0	0	110.7	Y47 I163 Y164 A165 M186 Y187	Y47-D167 HydrophobicContact CE1-CB 4.29Å; Y47-D167 VanDerWaalsContact CE1-OD2 3.3Å; Y47-D167 WeakPolarHBondContact CE1-OD2 3.46Å; Y47-D167 VanDerWaalsContact CZ-OD2 3.24Å; Y47-D167 PolarHBondContact OH-OD2 2.74Å; I163-D167 CarbonylContact C-O 3.47Å; I163-D167 VanDerWaalsContact CA-O 3.31Å; I163-D167 WeakPolarHBondContact CA-O 3.28Å; Y164-D167 PolarHBondContact N-O 2.67Å; Y164-D167 PolarHBondContact O-N 2.93Å; A165-D167 VanDerWaalsContact C-N 3.28Å; A165-D167 PolarHBondContact O-N 2.65Å; D167-M186 HydrophobicContact CB-CE 4.15Å; D167-Y187 WeakPolarHBondContact CA-O 3.06Å; D167-Y187 VanDerWaalsContact CB-O 3.29Å; D167-Y187 WeakPolarHBondContact CB-O 3.44Å
168	L	98.6	Very high	97.7	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	130.6	169.8	170.2	65	0	0	0	108.5	F40 W44 L63 F65 L161 I163 Y187	F40-L168 HydrophobicContact CD1-CD1 3.71Å; F40-L168 HydrophobicContact CE1-CD1 3.65Å; W44-L168 HydrophobicContact CB-CD2 4.24Å; W44-L168 HydrophobicContact CD2-CB 3.76Å; W44-L168 HydrophobicContact CD2-CD2 3.97Å; W44-L168 HydrophobicContact CE3-CB 3.47Å; W44-L168 VanDerWaalsContact CE3-CB 3.47Å; W44-L168 HydrophobicContact CG-CB 4.4Å; W44-L168 HydrophobicContact CG-CD2 3.84Å; W44-L168 HydrophobicContact CH2-CB 4.08Å; W44-L168 HydrophobicContact CZ2-CB 4.32Å; W44-L168 HydrophobicContact CZ3-CB 3.66Å; L63-L168 HydrophobicContact CD1-CD2 3.98Å; F65-L168 HydrophobicContact CE2-CD2 3.97Å; L161-L168 HydrophobicContact CD2-CD1 4.38Å; I163-L168 HydrophobicContact CD1-CB 4.13Å; I163-L168 HydrophobicContact CD1-CD1 4.26Å; L168-Y187 HydrophobicContact CB-CD2 4.48Å; L168-Y187 HydrophobicContact CD2-CD2 4.29Å; L168-Y187 HydrophobicContact CG-CD2 4.12Å; L168-Y187 PolarHBondContact N-O 2.73Å; L168-Y187 WeakPolarHBondContact O-CD2 3.36Å; L168-Y187 PolarHBondContact O-N 2.79Å
169	K	98.6	Very high	97.7	Very high	34 Å²	34	43 Å²	43	15%	0.148	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.4	170.2	-174.6	162.8	-174	-97.6	0	109.3	Y162 D171 S184 V185 M186	Y162-K169 HydrophobicContact CD2-CB 4.39Å; Y162-K169 HydrophobicContact CE1-CB 4.39Å; Y162-K169 HydrophobicContact CE1-CG 4.29Å; Y162-K169 HydrophobicContact CE2-CB 4.07Å; Y162-K169 HydrophobicContact CE2-CD 3.98Å; Y162-K169 HydrophobicContact CE2-CG 4.31Å; Y162-K169 PolarHBondContact N-O 2.54Å; Y162-K169 VanDerWaalsContact N-O 3.13Å; Y162-K169 PolarHBondContact O-N 2.87Å; Y162-K169 VanDerWaalsContact OH-CD 3.3Å; Y162-K169 WeakPolarHBondContact OH-CD 3.05Å; Y162-K169 PolarHBondContact OH-NZ 2.6Å; K169-D171 WeakPolarHBondContact CE-OD1 3.3Å; K169-D171 IonicContact NZ-OD1 2.71Å; K169-D171 PolarHBondContact NZ-OD1 2.71Å; K169-D171 IonicContact NZ-OD2 2.93Å; K169-D171 PolarHBondContact NZ-OD2 3.29Å; K169-S184 PolarHBondContact NZ-OG 2.68Å; K169-V185 WeakPolarHBondContact CA-O 3.13Å; K169-M186 HydrophobicContact CB-CE 4.28Å; K169-M186 HydrophobicContact CB-SD 3.87Å; K169-M186 HydrophobicContact CD-CE 4.41Å; K169-M186 HydrophobicContact CD-SD 3.52Å; K169-M186 VanDerWaalsContact CD-SD 3.52Å; K169-M186 HydrophobicContact CG-SD 3.62Å
170	Q	98.7	Very high	97.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.9	168.9	-174.7	-178.8	-97.4	0	0	109.1	T59 R159 N160 L161 I172 S184 V185 Y187	T59-Q170 VanDerWaalsContact CG2-NE2 3.34Å; T59-Q170 PolarHBondContact OG1-NE2 3.45Å; R159-Q170 HydrophobicContact CG-CG 4.11Å; R159-Q170 VanDerWaalsContact NH1-OE1 3.08Å; N160-Q170 CarbonylContact O-C 3.44Å; N160-Q170 WeakPolarHBondContact O-CA 3.4Å; L161-Q170 HydrophobicContact CD2-CB 3.73Å; L161-Q170 HydrophobicContact CD2-CG 3.61Å; Q170-I172 HydrophobicContact CG-CD1 3.99Å; Q170-I172 HydrophobicContact CG-CG1 4.12Å; Q170-S184 CarbonylContact O-C 3.11Å; Q170-S184 VanDerWaalsContact O-CA 3.25Å; Q170-S184 WeakPolarHBondContact O-CA 3.27Å; Q170-V185 PolarHBondContact N-O 3.12Å; Q170-V185 PolarHBondContact O-N 3.25Å; Q170-Y187 HydrophobicContact CB-CE2 3.75Å; Q170-Y187 PolarHBondContact NE2-OH 2.75Å
171	D	98.6	Very high	97.6	Very high	28 Å²	28	47.8 Å²	47.8	15%	0.15	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.8	170.8	-58.7	-36.8	0	0	0	109.1	R159 N160 Y162 K169 S184	R159-D171 WeakPolarHBondContact CA-O 3.28Å; N160-D171 HydrophobicContact CB-CB 4.14Å; N160-D171 PolarHBondContact N-O 3.2Å; N160-D171 PolarHBondContact O-N 3.04Å; Y162-D171 VanDerWaalsContact CE1-OD2 3.24Å; Y162-D171 WeakPolarHBondContact CE1-OD2 3.3Å; Y162-D171 PolarHBondContact OH-OD2 3.29Å; K169-D171 WeakPolarHBondContact CE-OD1 3.3Å; K169-D171 IonicContact NZ-OD1 2.71Å; K169-D171 PolarHBondContact NZ-OD1 2.71Å; K169-D171 IonicContact NZ-OD2 2.93Å; K169-D171 PolarHBondContact NZ-OD2 3.29Å; D171-S184 WeakPolarHBondContact OD1-CB 3.24Å; D171-S184 PolarHBondContact OD1-OG 3.01Å
172	I	98.6	Very high	97.6	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.7	-177	-63.4	-66.2	0	0	0	108.9	F57 T59 L157 R159 Q170 A174 A182 Y183	F57-I172 HydrophobicContact CD1-CG2 3.74Å; F57-I172 HydrophobicContact CE1-CD1 4.3Å; F57-I172 HydrophobicContact CE1-CG2 4.22Å; T59-I172 HydrophobicContact CG2-CD1 4.02Å; T59-I172 HydrophobicContact CG2-CG1 4.11Å; L157-I172 HydrophobicContact CD1-CD1 4.36Å; L157-I172 HydrophobicContact CD1-CG2 4.21Å; R159-I172 HydrophobicContact CB-CD1 4.07Å; R159-I172 HydrophobicContact CG-CD1 3.76Å; Q170-I172 HydrophobicContact CG-CD1 3.99Å; Q170-I172 HydrophobicContact CG-CG1 4.12Å; I172-A174 HydrophobicContact CG2-CB 4.38Å; I172-A182 CarbonylContact O-C 3.54Å; I172-A182 VanDerWaalsContact O-CA 3.3Å; I172-A182 WeakPolarHBondContact O-CA 3.31Å; I172-Y183 HydrophobicContact CB-CD1 4.21Å; I172-Y183 HydrophobicContact CB-CE1 3.89Å; I172-Y183 HydrophobicContact CB-CE2 4.42Å; I172-Y183 HydrophobicContact CG1-CE1 4.41Å; I172-Y183 HydrophobicContact CG1-CE2 4.28Å; I172-Y183 HydrophobicContact CG2-CD1 4.27Å; I172-Y183 HydrophobicContact CG2-CE1 3.7Å; I172-Y183 PolarHBondContact N-O 3.4Å; I172-Y183 PolarHBondContact O-N 2.65Å
173	E	98.7	Very high	97.6	Very high	123 Å²	123	49 Å²	49	58%	0.575	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	121.7	163.7	-66.3	178.6	-177	0	0	107.7	L157 R158 A181	L157-E173 CarbonylContact C-O 3.57Å; L157-E173 VanDerWaalsContact CA-O 3.31Å; L157-E173 WeakPolarHBondContact CA-O 3.15Å; R158-E173 HydrophobicContact CB-CB 4.4Å; R158-E173 PolarHBondContact N-O 2.86Å; R158-E173 PolarHBondContact O-N 2.86Å; E173-A181 CarbonylContact C-O 3.43Å; E173-A181 WeakPolarHBondContact CA-O 3.26Å
174	A	98.5	Very high	97.7	Very high	8 Å²	8	47 Å²	47	7%	0.066	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	143.4	-176.7	0	0	0	0	0	112.3	F57 E156 L157 I172 T176 N180 A181	F57-A174 HydrophobicContact CB-CB 4.05Å; F57-A174 HydrophobicContact CD1-CB 4.47Å; F57-A174 HydrophobicContact CD2-CB 4.09Å; F57-A174 HydrophobicContact CG-CB 3.95Å; E156-A174 CarbonylContact O-C 3.56Å; E156-A174 VanDerWaalsContact O-CA 3.26Å; E156-A174 WeakPolarHBondContact O-CA 3.25Å; L157-A174 HydrophobicContact CB-CB 4.45Å; L157-A174 HydrophobicContact CD1-CB 3.97Å; I172-A174 HydrophobicContact CG2-CB 4.38Å; A174-T176 HydrophobicContact CB-CG2 4.28Å; A174-N180 CarbonylContact O-C 3.51Å; A174-N180 WeakPolarHBondContact O-CA 3.21Å; A174-A181 HydrophobicContact CB-CB 4.34Å; A174-A181 PolarHBondContact N-O 2.78Å; A174-A181 PolarHBondContact O-N 2.87Å
175	R	98.5	Very high	97.8	Very high	110 Å²	110	40.3 Å²	40.3	42%	0.415	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.1	169.4	-172.1	165.8	68.6	104	0.9	108.4	Y155 E156 N180	Y155-R175 HydrophobicContact CD2-CG 4.21Å; Y155-R175 PolarHBondContact N-O 2.9Å; E156-R175 HydrophobicContact CB-CB 3.98Å; E156-R175 PolarHBondContact N-O 3.24Å; E156-R175 PolarHBondContact O-N 2.89Å; E156-R175 IonicContact OE1-CZ 3.23Å; E156-R175 VanDerWaalsContact OE1-CZ 3.23Å; E156-R175 IonicContact OE1-NE 3.01Å; E156-R175 PolarHBondContact OE1-NE 3.26Å; E156-R175 IonicContact OE1-NH2 2.68Å; E156-R175 PolarHBondContact OE1-NH2 2.93Å; E156-R175 IonicContact OE2-NE 3.19Å; E156-R175 PolarHBondContact OE2-NE 2.89Å; R175-N180 WeakPolarHBondContact CG-OD1 3.19Å
176	T	97.2	Very high	98	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.043	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	169.8	-172.4	77.4	0	0	0	0	110.9	V56 F57 Y152 N153 V154 Y155 A174 A178 G179	V56-T176 HydrophobicContact CG1-CG2 4.2Å; V56-T176 WeakPolarHBondContact CG1-OG1 3.2Å; F57-T176 HydrophobicContact CB-CG2 4.32Å; F57-T176 HydrophobicContact CD2-CG2 4.18Å; Y152-T176 HydrophobicContact CE2-CG2 4.47Å; Y152-T176 WeakPolarHBondContact OH-CG2 3.46Å; N153-T176 CarbonylContact O-C 3.56Å; N153-T176 WeakPolarHBondContact O-CA 3.13Å; N153-T176 VanDerWaalsContact O-CB 3.26Å; N153-T176 WeakPolarHBondContact O-CB 3.18Å; V154-T176 HydrophobicContact CG1-CG2 4.47Å; V154-T176 HydrophobicContact CG2-CG2 4.38Å; Y155-T176 VanDerWaalsContact CE2-C 3.4Å; A174-T176 HydrophobicContact CB-CG2 4.28Å; T176-A178 PolarHBondContact O-N 2.94Å; T176-A178 PolarHBondContact OG1-N 3.23Å; T176-A178 VanDerWaalsContact OG1-N 3.12Å; T176-G179 PolarHBondContact N-O 3.39Å; T176-G179 PolarHBondContact O-N 2.95Å; T176-G179 PolarHBondContact OG1-N 3.05Å; T176-G179 PolarHBondContact OG1-O 2.94Å
177	S	95.4	Very high	98.1	Very high	53 Å²	53	33.6 Å²	33.6	37%	0.371	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.9	172	61.8	0	0	0	0	113.8	R151 Y152 N153 Y155	R151-S177 PolarHBondContact O-OG 2.9Å; Y152-S177 WeakPolarHBondContact CA-OG 3.42Å; N153-S177 PolarHBondContact N-OG 2.78Å; N153-S177 PolarHBondContact O-N 2.79Å; Y155-S177 WeakPolarHBondContact OH-CB 3.2Å
178	A	95.4	Very high	98.1	Very high	66 Å²	66	39.5 Å²	39.5	55%	0.545	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.1	176.3	0	0	0	0	0	113.6	V56 Y152 T176	V56-A178 HydrophobicContact CG1-CB 4.12Å; Y152-A178 HydrophobicContact CD2-CB 4.36Å; Y152-A178 HydrophobicContact CE2-CB 4.09Å; T176-A178 PolarHBondContact O-N 2.94Å; T176-A178 PolarHBondContact OG1-N 3.23Å; T176-A178 VanDerWaalsContact OG1-N 3.12Å
179	G	97.7	Very high	98.1	Very high	29 Å²	29	43.8 Å²	43.8	30%	0.299	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	125.6	-157.8	-177.9	0	0	0	0	0	112.9	V56 T176	V56-G179 VanDerWaalsContact CG1-C 3.46Å; V56-G179 WeakPolarHBondContact CG1-O 3.45Å; T176-G179 PolarHBondContact N-O 3.39Å; T176-G179 PolarHBondContact O-N 2.95Å; T176-G179 PolarHBondContact OG1-N 3.05Å; T176-G179 PolarHBondContact OG1-O 2.94Å
180	N	98.3	Very high	97.9	Very high	115 Å²	115	46.7 Å²	46.7	62%	0.615	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	148.5	-177.5	-59.8	-28.2	0	0	0	111.6	A174 R175	A174-N180 CarbonylContact O-C 3.51Å; A174-N180 WeakPolarHBondContact O-CA 3.21Å; R175-N180 WeakPolarHBondContact CG-OD1 3.19Å
181	A	98.3	Very high	97.6	Very high	5 Å²	5	50.7 Å²	50.7	4%	0.041	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.7	172.5	0	0	0	0	0	110	G53 F57 E173 A174 Y183	G53-A181 VanDerWaalsContact O-CB 3.27Å; G53-A181 WeakPolarHBondContact O-CB 3.32Å; F57-A181 HydrophobicContact CB-CB 3.93Å; E173-A181 CarbonylContact C-O 3.43Å; E173-A181 WeakPolarHBondContact CA-O 3.26Å; A174-A181 HydrophobicContact CB-CB 4.34Å; A174-A181 PolarHBondContact N-O 2.78Å; A174-A181 PolarHBondContact O-N 2.87Å; A181-Y183 HydrophobicContact CB-CD1 4.06Å; A181-Y183 HydrophobicContact CB-CE1 4Å
182	A	98.5	Very high	96.8	Very high	62 Å²	62	51.9 Å²	51.9	51%	0.512	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	95.9	174.6	0	0	0	0	0	107.7	Q52 I172	Q52-A182 PolarHBondContact N-O 3.17Å; Q52-A182 CarbonylContact O-C 3.56Å; Q52-A182 PolarHBondContact O-N 2.98Å; I172-A182 CarbonylContact O-C 3.54Å; I172-A182 VanDerWaalsContact O-CA 3.3Å; I172-A182 WeakPolarHBondContact O-CA 3.31Å
183	Y	98.6	Very high	96.7	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.027	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	159	-174.4	71	-86.6	0	0	0	113	V49 I50 E54 F57 T59 I172 A181 V185	V49-Y183 HydrophobicContact CG1-CD2 3.97Å; I50-Y183 CarbonylContact O-C 3.59Å; I50-Y183 WeakPolarHBondContact O-CA 3.45Å; I50-Y183 VanDerWaalsContact O-CB 3.24Å; I50-Y183 WeakPolarHBondContact O-CB 3.3Å; E54-Y183 HydrophobicContact CB-CD1 4.41Å; E54-Y183 HydrophobicContact CB-CD2 4.46Å; E54-Y183 HydrophobicContact CB-CE1 4.17Å; E54-Y183 HydrophobicContact CB-CE2 4.2Å; E54-Y183 HydrophobicContact CG-CE1 4.49Å; E54-Y183 HydrophobicContact CG-CE2 3.98Å; F57-Y183 WeakPolarHBondContact O-CE1 3.45Å; F57-Y183 PolarHBondContact O-OH 3.49Å; T59-Y183 WeakPolarHBondContact CG2-OH 3.32Å; T59-Y183 PolarHBondContact N-OH 2.87Å; T59-Y183 PolarHBondContact OG1-OH 2.98Å; I172-Y183 HydrophobicContact CB-CD1 4.21Å; I172-Y183 HydrophobicContact CB-CE1 3.89Å; I172-Y183 HydrophobicContact CB-CE2 4.42Å; I172-Y183 HydrophobicContact CG1-CE1 4.41Å; I172-Y183 HydrophobicContact CG1-CE2 4.28Å; I172-Y183 HydrophobicContact CG2-CD1 4.27Å; I172-Y183 HydrophobicContact CG2-CE1 3.7Å; I172-Y183 PolarHBondContact N-O 3.4Å; I172-Y183 PolarHBondContact O-N 2.65Å; A181-Y183 HydrophobicContact CB-CD1 4.06Å; A181-Y183 HydrophobicContact CB-CE1 4Å; Y183-V185 HydrophobicContact CD2-CG2 3.68Å; Y183-V185 HydrophobicContact CE2-CG2 3.4Å; Y183-V185 VanDerWaalsContact CE2-CG2 3.4Å
184	S	98.6	Very high	96.6	Very high	21 Å²	21	50.8 Å²	50.8	15%	0.147	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.2	173.2	-59.4	0	0	0	0	110.4	V49 I50 K169 Q170 D171	V49-S184 CarbonylContact C-O 3.53Å; V49-S184 VanDerWaalsContact CA-O 3.3Å; V49-S184 WeakPolarHBondContact CA-O 3.15Å; I50-S184 PolarHBondContact N-O 3.19Å; I50-S184 PolarHBondContact O-N 2.79Å; K169-S184 PolarHBondContact NZ-OG 2.68Å; Q170-S184 CarbonylContact O-C 3.11Å; Q170-S184 VanDerWaalsContact O-CA 3.25Å; Q170-S184 WeakPolarHBondContact O-CA 3.27Å; D171-S184 WeakPolarHBondContact OD1-CB 3.24Å; D171-S184 PolarHBondContact OD1-OG 3.01Å
185	V	98.6	Very high	96.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130	170.2	-169	0	0	0	0	109.6	A46 K48 V49 K169 Q170 Y183 Y187	A46-V185 HydrophobicContact CB-CG1 3.66Å; K48-V185 WeakPolarHBondContact O-CA 3.26Å; V49-V185 HydrophobicContact CG2-CG1 4.16Å; V49-V185 HydrophobicContact CG2-CG2 4.19Å; K169-V185 WeakPolarHBondContact CA-O 3.13Å; Q170-V185 PolarHBondContact N-O 3.12Å; Q170-V185 PolarHBondContact O-N 3.25Å; Y183-V185 HydrophobicContact CD2-CG2 3.68Å; Y183-V185 HydrophobicContact CE2-CG2 3.4Å; Y183-V185 VanDerWaalsContact CE2-CG2 3.4Å; V185-Y187 HydrophobicContact CB-CD2 4.37Å; V185-Y187 HydrophobicContact CB-CE2 3.51Å; V185-Y187 WeakPolarHBondContact CB-OH 3.35Å; V185-Y187 HydrophobicContact CG1-CD1 4.38Å; V185-Y187 HydrophobicContact CG1-CD2 4.11Å; V185-Y187 HydrophobicContact CG1-CE1 3.78Å; V185-Y187 HydrophobicContact CG1-CE2 3.5Å; V185-Y187 VanDerWaalsContact CG1-CE2 3.5Å; V185-Y187 WeakPolarHBondContact CG1-OH 3.27Å; V185-Y187 WeakPolarHBondContact O-CE2 3.35Å
186	M	98.6	Very high	96.3	Very high	13 Å²	13	49.8 Å²	49.8	6%	0.064	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.9	172.3	-55.9	-62.7	-61.3	0	0	110	A46 Y47 K48 Y164 D167 K169	A46-M186 CarbonylContact C-O 3.51Å; A46-M186 WeakPolarHBondContact CA-O 3.36Å; Y47-M186 HydrophobicContact CD1-CB 4.25Å; Y47-M186 WeakPolarHBondContact CD1-O 3.33Å; Y47-M186 HydrophobicContact CE1-CB 3.62Å; Y47-M186 HydrophobicContact CE2-CB 3.96Å; Y47-M186 VanDerWaalsContact CZ-CB 3.45Å; Y47-M186 PolarHBondContact N-O 2.88Å; K48-M186 HydrophobicContact CB-CB 4.01Å; K48-M186 HydrophobicContact CB-CG 4.12Å; K48-M186 HydrophobicContact CD-CG 4.48Å; K48-M186 PolarHBondContact O-N 3.25Å; Y164-M186 HydrophobicContact CD1-CE 4Å; D167-M186 HydrophobicContact CB-CE 4.15Å; K169-M186 HydrophobicContact CB-CE 4.28Å; K169-M186 HydrophobicContact CB-SD 3.87Å; K169-M186 HydrophobicContact CD-CE 4.41Å; K169-M186 HydrophobicContact CD-SD 3.52Å; K169-M186 VanDerWaalsContact CD-SD 3.52Å; K169-M186 HydrophobicContact CG-SD 3.62Å
187	Y	98.7	Very high	96.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.1	-179.4	-49.7	-104.9	0	0	0	111.9	W44 K45 A46 G60 L63 D167 L168 Q170 V185	W44-Y187 HydrophobicContact CB-CD1 4.41Å; W44-Y187 HydrophobicContact CB-CG 4.32Å; K45-Y187 CarbonylContact O-C 3.54Å; K45-Y187 VanDerWaalsContact O-CA 3.27Å; K45-Y187 WeakPolarHBondContact O-CA 3.38Å; A46-Y187 HydrophobicContact CB-CD1 3.73Å; A46-Y187 HydrophobicContact CB-CE1 3.7Å; A46-Y187 VanDerWaalsContact N-CD1 3.32Å; G60-Y187 WeakPolarHBondContact O-CE1 3.01Å; G60-Y187 PolarHBondContact O-OH 2.93Å; L63-Y187 HydrophobicContact CD1-CD1 4.19Å; L63-Y187 HydrophobicContact CD1-CD2 4.29Å; L63-Y187 HydrophobicContact CD1-CE1 3.73Å; L63-Y187 HydrophobicContact CD1-CE2 3.82Å; L63-Y187 HydrophobicContact CD1-CG 4.48Å; L63-Y187 HydrophobicContact CD2-CE1 4.31Å; L63-Y187 HydrophobicContact CG-CD1 4.02Å; L63-Y187 HydrophobicContact CG-CE1 3.56Å; D167-Y187 WeakPolarHBondContact CA-O 3.06Å; D167-Y187 VanDerWaalsContact CB-O 3.29Å; D167-Y187 WeakPolarHBondContact CB-O 3.44Å; L168-Y187 HydrophobicContact CB-CD2 4.48Å; L168-Y187 HydrophobicContact CD2-CD2 4.29Å; L168-Y187 HydrophobicContact CG-CD2 4.12Å; L168-Y187 PolarHBondContact N-O 2.73Å; L168-Y187 WeakPolarHBondContact O-CD2 3.36Å; L168-Y187 PolarHBondContact O-N 2.79Å; Q170-Y187 HydrophobicContact CB-CE2 3.75Å; Q170-Y187 PolarHBondContact NE2-OH 2.75Å; V185-Y187 HydrophobicContact CB-CD2 4.37Å; V185-Y187 HydrophobicContact CB-CE2 3.51Å; V185-Y187 WeakPolarHBondContact CB-OH 3.35Å; V185-Y187 HydrophobicContact CG1-CD1 4.38Å; V185-Y187 HydrophobicContact CG1-CD2 4.11Å; V185-Y187 HydrophobicContact CG1-CE1 3.78Å; V185-Y187 HydrophobicContact CG1-CE2 3.5Å; V185-Y187 VanDerWaalsContact CG1-CE2 3.5Å; V185-Y187 WeakPolarHBondContact CG1-OH 3.27Å; V185-Y187 WeakPolarHBondContact O-CE2 3.35Å
188	R	98.2	Very high	96.3	Very high	147 Å²	147	52.5 Å²	52.5	56%	0.555	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.6	173.3	-177.1	164.9	-65.9	168.4	2.6	110.2	W44 K45 Y47 I190	W44-R188 CarbonylContact C-O 3.49Å; W44-R188 WeakPolarHBondContact CA-O 3.34Å; K45-R188 PolarHBondContact N-O 3.34Å; K45-R188 PolarHBondContact O-N 3.31Å; Y47-R188 HydrophobicContact CD1-CB 3.91Å; Y47-R188 HydrophobicContact CE1-CB 4.2Å; R188-I190 PolarHBondContact O-N 3.2Å
189	K	97.5	Very high	96.4	Very high	89 Å²	89	51.5 Å²	51.5	39%	0.387	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	126.8	174.1	-165.7	171.5	-65	-156.4	0	109.5	L41 W44 Q191	L41-K189 PolarHBondContact O-NZ 3.32Å; W44-K189 HydrophobicContact CD2-CB 4.26Å; W44-K189 HydrophobicContact CD2-CG 4.5Å; W44-K189 HydrophobicContact CE3-CB 3.75Å; W44-K189 HydrophobicContact CE3-CG 4.46Å; W44-K189 HydrophobicContact CH2-CB 4.15Å; W44-K189 HydrophobicContact CH2-CD 4.42Å; W44-K189 HydrophobicContact CZ2-CD 4.41Å; W44-K189 HydrophobicContact CZ3-CB 3.68Å; W44-K189 HydrophobicContact CZ3-CG 4.47Å; K189-Q191 WeakPolarHBondContact CG-O 3.48Å
190	I	95.4	Very high	96.3	Very high	95 Å²	95	53.2 Å²	53.2	49%	0.487	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-16.8	177.4	57.8	164.2	0	0	0	112.7	R43 K45 R188	R43-I190 HydrophobicContact CB-CD1 4.49Å; R43-I190 HydrophobicContact CB-CG1 4.01Å; R43-I190 HydrophobicContact CG-CD1 3.82Å; R43-I190 HydrophobicContact CG-CG1 3.84Å; R43-I190 VanDerWaalsContact O-CG1 3.32Å; R43-I190 WeakPolarHBondContact O-CG1 3.49Å; R43-I190 PolarHBondContact O-N 3.09Å; K45-I190 HydrophobicContact CB-CD1 4.17Å; K45-I190 HydrophobicContact CB-CG1 4.44Å; K45-I190 HydrophobicContact CB-CG2 3.76Å; R188-I190 PolarHBondContact O-N 3.2Å
191	Q	91	Very high	96.1	Very high	84 Å²	84	48.1 Å²	48.1	39%	0.393	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	142.8	174.9	-163.4	177.4	0.4	0	0	108.7	Y25 G42 R43 K189	Y25-Q191 HydrophobicContact CD2-CG 4.19Å; Y25-Q191 HydrophobicContact CE2-CB 4.25Å; Y25-Q191 HydrophobicContact CE2-CG 3.77Å; G42-Q191 CarbonylContact C-O 3.46Å; G42-Q191 WeakPolarHBondContact CA-O 3.21Å; R43-Q191 HydrophobicContact CB-CB 3.93Å; R43-Q191 PolarHBondContact N-O 2.84Å; R43-Q191 PolarHBondContact O-N 2.86Å; K189-Q191 WeakPolarHBondContact CG-O 3.48Å
192	G	81.7	Confident	95.9	Very high	54 Å²	54	52 Å²	52	56%	0.557	28%	0.284	S	S	*	.			trans	174.4	0	178.3	0	0	0	0	0	111.9

Retrieved 192 of 192 residues in 113.2 ms (Link to these results)

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