A0A060XNK3_ONCMY Loading...

Transthyretin

Thyroid hormone-binding protein. Probably transports thyroxine from the bloodstream to the brain.

AlphaFold DB , UniProt , Accession A0A060XNK3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 149 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	Low	51	Low	240 Å²	240	117.9 Å²	117.9	100%	1.182	68%	0.682	S	S	*	*				0	99.2	0	-80.8	164.1	67	0	0	105.9
2	D	53.2	Low	50.7	Low	121 Å²	121	115.3 Å²	115.3	65%	0.647	67%	0.669	S	S	*	*			trans	-75.5	135	-164	-63.1	-33.8	0	0	0	112.3	S4 L5	D2-S4 PolarHBondContact O-N 2.95Å; D2-L5 PolarHBondContact O-N 2.99Å
3	S	55.2	Low	50.3	Low	107 Å²	107	112.5 Å²	112.5	75%	0.748	67%	0.669	S	S	*	*	H	α-helix	trans	-54.6	-20.1	179.6	-83.5	0	0	0	0	114.6	L5 L6	S3-L5 VanDerWaalsContact C-N 3.34Å; S3-L6 PolarHBondContact O-N 3.42Å
4	S	56.2	Low	50.3	Low	98 Å²	98	112.8 Å²	112.8	69%	0.685	67%	0.671	S	S	*	*	H	α-helix	trans	-70.5	-27.2	175.2	-75.6	0	0	0	0	113.3	D2 V8	D2-S4 PolarHBondContact O-N 2.95Å; S4-V8 WeakPolarHBondContact O-CG2 3.45Å
5	L	52.3	Low	50.3	Low	120 Å²	120	115.4 Å²	115.4	63%	0.628	68%	0.679	S	S	*	*	H	α-helix	trans	-74.3	-29	176.4	-97	129.7	0	0	0	112.4	D2 S3 L9	D2-L5 PolarHBondContact O-N 2.99Å; S3-L5 VanDerWaalsContact C-N 3.34Å; L5-L9 WeakPolarHBondContact O-CD1 3.5Å; L5-L9 WeakPolarHBondContact O-CG 3.39Å; L5-L9 PolarHBondContact O-N 3.47Å
6	L	49.7	Very low	50	Low	119 Å²	119	117.8 Å²	117.8	62%	0.623	69%	0.687	S	S	*	*	H	α-helix	trans	-72.4	-34.5	-180	-140.6	82.4	0	0	0	112.3	S3 L10	S3-L6 PolarHBondContact O-N 3.42Å; L6-L10 PolarHBondContact O-N 3.43Å
7	C	48.1	Very low	49.7	Very low	90 Å²	90	118.1 Å²	118.1	61%	0.608	70%	0.695	S	S	*	*	H	α-helix	trans	-73.7	-32.3	178.6	-75.5	0	0	0	0	113.4	L9 L10 A11	C7-L9 VanDerWaalsContact C-N 3.34Å; C7-L10 PolarHBondContact O-N 3.41Å; C7-A11 PolarHBondContact O-N 3.25Å
8	V	51.4	Low	49.8	Very low	100 Å²	100	117.2 Å²	117.2	61%	0.606	70%	0.696	S	S	*	*	H	α-helix	trans	-72.4	-30.5	176.7	178.6	0	0	0	0	111.5	S4 A11 T12	S4-V8 WeakPolarHBondContact O-CG2 3.45Å; V8-A11 PolarHBondContact O-N 3.32Å; V8-T12 PolarHBondContact O-OG1 3.31Å
9	L	47.2	Very low	49.8	Very low	114 Å²	114	115.7 Å²	115.7	60%	0.597	70%	0.699	S	S	*	*	H	α-helix	trans	-70.4	-30	174.7	-72.3	165.8	0	0	0	113	L5 C7 T12	L5-L9 WeakPolarHBondContact O-CD1 3.5Å; L5-L9 WeakPolarHBondContact O-CG 3.39Å; L5-L9 PolarHBondContact O-N 3.47Å; C7-L9 VanDerWaalsContact C-N 3.34Å; L9-T12 PolarHBondContact O-OG1 3.38Å
10	L	48.6	Very low	49.8	Very low	124 Å²	124	113.6 Å²	113.6	65%	0.649	69%	0.694	S	S	*	*	H	α-helix	trans	-78.7	-27.9	176	-79.5	157.5	0	0	0	113.1	L6 C7	L6-L10 PolarHBondContact O-N 3.43Å; C7-L10 PolarHBondContact O-N 3.41Å
11	A	46.7	Very low	49.4	Very low	64 Å²	64	113.2 Å²	113.2	53%	0.529	69%	0.693	S	S	.	*	H	α-helix	trans	-77.5	-19.6	179.6	0	0	0	0	0	113.9	C7 V8	C7-A11 PolarHBondContact O-N 3.25Å; V8-A11 PolarHBondContact O-N 3.32Å
12	T	47.8	Very low	49.1	Very low	86 Å²	86	108.1 Å²	108.1	53%	0.528	68%	0.676	S	S	.	*	H	α-helix	trans	-88.4	-18.6	178.8	45.8	0	0	0	0	113.5	V8 L9 V14	V8-T12 PolarHBondContact O-OG1 3.31Å; L9-T12 PolarHBondContact O-OG1 3.38Å; T12-V14 VanDerWaalsContact C-N 3.3Å; T12-V14 PolarHBondContact O-N 3.49Å
13	A	45.8	Very low	48.6	Very low	80 Å²	80	107.6 Å²	107.6	66%	0.661	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-12.8	177.6	0	0	0	0	0	114.2
14	V	50.1	Low	47.9	Very low	116 Å²	116	112.1 Å²	112.1	70%	0.703	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-9.9	-177.6	-178.7	0	0	0	0	112.7	T12	T12-V14 VanDerWaalsContact C-N 3.3Å; T12-V14 PolarHBondContact O-N 3.49Å
15	L	50.7	Low	47.6	Very low	152 Å²	152	112 Å²	112	80%	0.796	66%	0.662	S	S	*	*	S	Bend	trans	-105.6	14.8	-174.1	-96.8	131.6	0	0	0	115.1
16	L	44.8	Very low	47.5	Very low	154 Å²	154	108.6 Å²	108.6	81%	0.806	66%	0.656	S	S	*	*			trans	-117.9	33.2	171.4	-76.5	154.7	0	0	0	111.7	S18	L16-S18 PolarHBondContact O-N 2.95Å
17	C	45.7	Very low	47.1	Very low	122 Å²	122	110.2 Å²	110.2	82%	0.824	66%	0.661	S	S	*	*			trans	-74.1	75.6	150.4	-79	0	0	0	0	107.1	A19	C17-A19 PolarHBondContact O-N 3.06Å
18	S	50.1	Low	47.1	Very low	102 Å²	102	109 Å²	109	71%	0.713	65%	0.653	S	S	*	*			trans	-56.8	102.2	154	-178.4	0	0	0	0	104.5	L16 A20	L16-S18 PolarHBondContact O-N 2.95Å; S18-A20 VanDerWaalsContact C-N 3.27Å; S18-A20 PolarHBondContact O-N 3.22Å
19	A	51.2	Low	47.2	Very low	90 Å²	90	106.6 Å²	106.6	74%	0.744	64%	0.637	S	S	*	*			trans	-52.1	107	161.6	0	0	0	0	0	104.4	C17	C17-A19 PolarHBondContact O-N 3.06Å
20	A	48.8	Very low	47.6	Very low	72 Å²	72	106.2 Å²	106.2	60%	0.595	64%	0.639	S	S	*	*			trans	-49.6	139	169.6	0	0	0	0	0	106	S18 V22	S18-A20 VanDerWaalsContact C-N 3.27Å; S18-A20 PolarHBondContact O-N 3.22Å; A20-V22 PolarHBondContact O-N 3.29Å
21	P	41.1	Very low	48.4	Very low	106 Å²	106	106.8 Å²	106.8	69%	0.688	64%	0.638	S	S	*	*			trans	-52.2	116.1	173.7	23.3	-31	0	0	0	106.1	D23	P21-D23 PolarHBondContact O-N 3.1Å
22	V	47.1	Very low	50.1	Low	133 Å²	133	103.9 Å²	103.9	81%	0.806	61%	0.614	S	S	*	*			trans	-67.9	91.8	164.3	175.5	0	0	0	0	102.6	A20 R24	A20-V22 PolarHBondContact O-N 3.29Å; V22-R24 PolarHBondContact O-N 2.62Å
23	D	42.4	Very low	52.2	Low	111 Å²	111	99.8 Å²	99.8	59%	0.594	59%	0.589	S	S	*	*			trans	-51.3	115.4	166.9	-81	-32.1	0	0	0	105.4	P21 H25	P21-D23 PolarHBondContact O-N 3.1Å; D23-H25 PolarHBondContact O-N 3.45Å; D23-H25 PolarHBondContact O-ND1 3Å; D23-H25 VanDerWaalsContact O-ND1 3.07Å
24	R	40.4	Very low	54.6	Low	202 Å²	202	96 Å²	96	76%	0.762	56%	0.558	S	S	*	*			trans	-63.9	84.6	174.4	-69.5	-175.6	176.1	175.2	-1.3	106.9	V22 G26	V22-R24 PolarHBondContact O-N 2.62Å; R24-G26 PolarHBondContact O-N 3.34Å
25	H	49.6	Very low	56.9	Low	94 Å²	94	91.2 Å²	91.2	44%	0.435	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	104.2	170.8	-81.4	70.1	0	0	0	106.6	D23 T74 E76	D23-H25 PolarHBondContact O-N 3.45Å; D23-H25 PolarHBondContact O-ND1 3Å; D23-H25 VanDerWaalsContact O-ND1 3.07Å; H25-T74 VanDerWaalsContact CE1-CG2 3.49Å; H25-T74 WeakPolarHBondContact CE1-CG2 3.13Å; H25-T74 WeakPolarHBondContact NE2-CG2 3.49Å; H25-T74 PolarHBondContact NE2-OG1 3.3Å; H25-E76 IonicContact CD2-OE2 3.87Å; H25-E76 PolarHBondContact CD2-OE2 3.31Å
26	G	50.1	Low	59.1	Low	50 Å²	50	84 Å²	84	52%	0.515	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	151.1	-5	-179.4	0	0	0	0	0	115.2	R24	R24-G26 PolarHBondContact O-N 3.34Å
27	E	42.1	Very low	61.7	Low	152 Å²	152	79 Å²	79	71%	0.71	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	2.2	-173.7	-145.5	162.6	153.2	0	0	114.7
28	S	47.8	Very low	64.2	Low	65 Å²	65	73.2 Å²	73.2	46%	0.455	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	22.7	-179.6	-169.6	0	0	0	0	114.8	T30	S28-T30 VanDerWaalsContact C-N 3.28Å; S28-T30 PolarHBondContact O-N 2.92Å
29	D	53.6	Low	66.5	Low	50 Å²	50	71.8 Å²	71.8	27%	0.267	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-78.9	-8.1	-177.4	-72.5	-7.3	0	0	0	113.9	H31 H78 H126	D29-H31 VanDerWaalsContact C-N 3.32Å; D29-H31 PolarHBondContact O-N 3Å; D29-H78 IonicContact OD1-CE1 3.4Å; D29-H126 PolarHBondContact O-ND1 2.81Å
30	T	54.3	Low	68.8	Low	105 Å²	105	67.5 Å²	67.5	64%	0.644	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-81	-6.1	-177.7	36.2	0	0	0	0	114.7	S28 H126	S28-T30 VanDerWaalsContact C-N 3.28Å; S28-T30 PolarHBondContact O-N 2.92Å; T30-H126 PolarHBondContact O-CE1 3.45Å
31	H	66.9	Low	71.1	Confident	136 Å²	136	66.4 Å²	66.4	63%	0.63	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-123.5	5.3	179.6	-72.1	-63.6	0	0	0	114.1	D29 P33	D29-H31 VanDerWaalsContact C-N 3.32Å; D29-H31 PolarHBondContact O-N 3Å; H31-P33 WeakPolarHBondContact O-CD 3.16Å
32	C	82	Confident	73.9	Confident	4 Å²	4	65.9 Å²	65.9	3%	0.027	36%	0.357	C	S	.	.			trans	-113.4	96.7	-177.4	-173.4	0	0	0	0	109.7	L34 N79	C32-L34 PolarHBondContact O-N 2.98Å; C32-L34 PolarHBondContact SG-O 2.63Å; C32-N79 PolarHBondContact SG-N 2.97Å
33	P	92.7	Very high	76.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.338	C	S	.	.	S	Bend	trans	-66.7	-22.3	-177.5	22.9	-33.2	0	0	0	114	H31 I81 D83 F86 H126 Y127	H31-P33 WeakPolarHBondContact O-CD 3.16Å; P33-I81 WeakPolarHBondContact CD-O 3.25Å; P33-I81 HydrophobicContact CG-CG2 4.34Å; P33-I81 VanDerWaalsContact CG-O 3.24Å; P33-I81 WeakPolarHBondContact CG-O 3.34Å; P33-D83 VanDerWaalsContact CB-OD1 3.27Å; P33-D83 WeakPolarHBondContact CB-OD1 3.33Å; P33-D83 WeakPolarHBondContact CG-OD1 3.22Å; P33-F86 HydrophobicContact CB-CB 4.36Å; P33-F86 HydrophobicContact CB-CD1 3.67Å; P33-F86 HydrophobicContact CB-CE1 4.35Å; P33-F86 HydrophobicContact CB-CG 4.35Å; P33-F86 HydrophobicContact CG-CB 4.21Å; P33-F86 HydrophobicContact CG-CD1 4.34Å; P33-H126 WeakPolarHBondContact O-CA 3.18Å; P33-Y127 PolarHBondContact O-N 2.63Å
34	L	96.3	Very high	78.9	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	110.7	177	179.6	63	0	0	0	110.3	C32 V54 L80 I81 F86 V93 F117 Y127 L129	C32-L34 PolarHBondContact O-N 2.98Å; C32-L34 PolarHBondContact SG-O 2.63Å; L34-V54 HydrophobicContact CD2-CG1 4Å; L34-V54 HydrophobicContact CD2-CG2 4.17Å; L34-L80 HydrophobicContact CG-CD1 4.45Å; L34-I81 HydrophobicContact CB-CG2 3.92Å; L34-I81 HydrophobicContact CD2-CG2 4.36Å; L34-F86 HydrophobicContact CB-CZ 4.37Å; L34-F86 HydrophobicContact CD2-CE2 4.3Å; L34-V93 HydrophobicContact CD2-CG2 4.24Å; L34-F117 HydrophobicContact CD1-CZ 4.02Å; L34-Y127 CarbonylContact C-O 3.47Å; L34-Y127 WeakPolarHBondContact CA-O 3.42Å; L34-L129 HydrophobicContact CD1-CD1 4.2Å; L34-L129 HydrophobicContact CD1-CG 4.11Å
35	M	96.5	Very high	81.7	Confident	15 Å²	15	55.5 Å²	55.5	7%	0.074	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	153.9	174.9	-174.6	-90.4	-85.3	0	0	110.1	K37 Y127 T128 L129	M35-K37 HydrophobicContact SD-CB 4.33Å; M35-Y127 PolarHBondContact N-O 2.86Å; M35-T128 HydrophobicContact CE-CG2 3.41Å; M35-T128 VanDerWaalsContact CE-CG2 3.41Å; M35-T128 WeakPolarHBondContact CE-OG1 3.43Å; M35-T128 WeakPolarHBondContact O-CA 3.33Å; M35-T128 HydrophobicContact SD-CG2 3.66Å; M35-L129 PolarHBondContact O-N 3.41Å
36	V	98.1	Very high	84	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.5	171.6	-54.5	0	0	0	0	110.8	L52 T71 E76 V77 L80 F95 L129	V36-L52 HydrophobicContact CB-CD2 4.4Å; V36-L52 HydrophobicContact CG1-CD2 4.14Å; V36-L52 HydrophobicContact CG2-CD2 3.62Å; V36-T71 HydrophobicContact CG2-CG2 4.25Å; V36-E76 VanDerWaalsContact O-CA 3.25Å; V36-E76 WeakPolarHBondContact O-CA 3.37Å; V36-V77 HydrophobicContact CG2-CB 3.71Å; V36-V77 HydrophobicContact CG2-CG2 3.71Å; V36-V77 PolarHBondContact N-O 3.16Å; V36-V77 PolarHBondContact O-N 3.34Å; V36-L80 HydrophobicContact CG1-CD1 3.78Å; V36-L80 HydrophobicContact CG2-CD1 4.49Å; V36-F95 HydrophobicContact CB-CE1 4.1Å; V36-F95 HydrophobicContact CB-CZ 4.5Å; V36-F95 HydrophobicContact CG1-CE1 3.92Å; V36-F95 HydrophobicContact CG1-CZ 4.02Å; V36-F95 HydrophobicContact CG2-CE1 4.49Å; V36-L129 CarbonylContact C-O 3.59Å; V36-L129 WeakPolarHBondContact CA-O 3.47Å; V36-L129 HydrophobicContact CG1-CB 4.37Å
37	K	98.3	Very high	86.4	Confident	50 Å²	50	50.9 Å²	50.9	22%	0.217	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.8	171.8	-176	69.9	172	-172.3	0	109.3	M35 T74 G75 E76 L129 A130 L131	M35-K37 HydrophobicContact SD-CB 4.33Å; K37-T74 WeakPolarHBondContact CE-O 3.33Å; K37-T74 PolarHBondContact NZ-O 2.88Å; K37-G75 CarbonylContact C-O 3.59Å; K37-G75 WeakPolarHBondContact CA-O 3.3Å; K37-E76 HydrophobicContact CD-CG 3.33Å; K37-E76 WeakPolarHBondContact CD-OE1 3.44Å; K37-E76 WeakPolarHBondContact CE-OE1 3.47Å; K37-E76 IonicContact NZ-OE1 2.69Å; K37-E76 PolarHBondContact NZ-OE1 3.44Å; K37-L129 PolarHBondContact N-O 2.96Å; K37-A130 CarbonylContact O-C 3.35Å; K37-A130 VanDerWaalsContact O-CA 3.3Å; K37-A130 WeakPolarHBondContact O-CA 3.45Å; K37-L131 PolarHBondContact O-N 2.89Å
38	I	98.8	Very high	89	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.8	-178	-44.1	-175.5	0	0	0	110.3	A47 V50 T71 G75 F95 L131 L133	I38-A47 HydrophobicContact CB-CB 4.08Å; I38-A47 HydrophobicContact CG2-CB 3.66Å; I38-A47 PolarHBondContact O-N 3.5Å; I38-V50 HydrophobicContact CD1-CB 3.99Å; I38-V50 HydrophobicContact CD1-CG1 3.85Å; I38-V50 HydrophobicContact CD1-CG2 4.37Å; I38-T71 HydrophobicContact CD1-CG2 3.64Å; I38-T71 HydrophobicContact CG1-CG2 3.96Å; I38-G75 PolarHBondContact N-O 2.84Å; I38-F95 HydrophobicContact CD1-CD1 3.53Å; I38-F95 HydrophobicContact CD1-CE1 3.8Å; I38-F95 HydrophobicContact CG1-CE1 4.42Å; I38-L131 WeakPolarHBondContact CA-O 3.37Å; I38-L131 HydrophobicContact CG1-CB 4.38Å; I38-L131 HydrophobicContact CG2-CB 4.05Å; I38-L133 HydrophobicContact CG2-CD1 3.54Å; I38-L133 HydrophobicContact CG2-CD2 4.38Å; I38-L133 HydrophobicContact CG2-CG 3.7Å
39	L	98.8	Very high	91.4	Very high	72 Å²	72	45.2 Å²	45.2	38%	0.377	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.4	177.6	-60.3	179.7	0	0	0	110.9	P46 L131 L132 L133	L39-P46 HydrophobicContact CD2-CB 4.3Å; L39-P46 HydrophobicContact CD2-CG 4.31Å; L39-L131 PolarHBondContact N-O 3.17Å; L39-L132 HydrophobicContact CB-CD1 3.68Å; L39-L133 PolarHBondContact O-N 2.85Å
40	D	98.8	Very high	93.6	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	111.8	172	-174.7	-44	0	0	0	109.6	V42 K43 G44 V45 A47 Y100 W101	D40-V42 VanDerWaalsContact C-N 3.31Å; D40-V42 PolarHBondContact O-N 3.32Å; D40-V42 WeakPolarHBondContact OD1-CA 3.32Å; D40-V42 VanDerWaalsContact OD1-CB 3.3Å; D40-V42 WeakPolarHBondContact OD1-CB 3.4Å; D40-V42 PolarHBondContact OD1-N 3.24Å; D40-K43 PolarHBondContact OD1-N 2.98Å; D40-K43 WeakPolarHBondContact OD2-CE 3.45Å; D40-K43 IonicContact OD2-NZ 2.63Å; D40-G44 WeakPolarHBondContact O-CA 3.49Å; D40-G44 PolarHBondContact O-N 2.87Å; D40-V45 HydrophobicContact CB-CG2 4.5Å; D40-V45 WeakPolarHBondContact CB-O 3.35Å; D40-V45 PolarHBondContact N-O 3.19Å; D40-V45 PolarHBondContact O-N 2.87Å; D40-A47 HydrophobicContact CB-CB 4.4Å; D40-Y100 WeakPolarHBondContact OD2-CE1 3.29Å; D40-Y100 PolarHBondContact OD2-OH 2.99Å; D40-W101 WeakPolarHBondContact OD1-CH2 3.22Å; D40-W101 VanDerWaalsContact OD2-CH2 3.3Å; D40-W101 WeakPolarHBondContact OD2-CH2 3.49Å; D40-W101 WeakPolarHBondContact OD2-CZ3 3.23Å
41	A	98.6	Very high	95.7	Very high	48 Å²	48	39.8 Å²	39.8	40%	0.397	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-19.4	-178.7	0	0	0	0	0	113.7	L132 L133 S134	A41-L132 HydrophobicContact CB-CD1 3.74Å; A41-L132 HydrophobicContact CB-CD2 4.47Å; A41-L132 HydrophobicContact CB-CG 3.99Å; A41-L133 VanDerWaalsContact CB-O 3.25Å; A41-L133 WeakPolarHBondContact CB-O 3.34Å; A41-L133 PolarHBondContact N-O 2.91Å; A41-S134 WeakPolarHBondContact CB-OG 3.2Å
42	V	98.4	Very high	97.2	Very high	95 Å²	95	33.8 Å²	33.8	58%	0.576	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-45.5	179.5	178.7	0	0	0	0	109.9	D40 W101 P135	D40-V42 VanDerWaalsContact C-N 3.31Å; D40-V42 PolarHBondContact O-N 3.32Å; D40-V42 WeakPolarHBondContact OD1-CA 3.32Å; D40-V42 VanDerWaalsContact OD1-CB 3.3Å; D40-V42 WeakPolarHBondContact OD1-CB 3.4Å; D40-V42 PolarHBondContact OD1-N 3.24Å; V42-W101 HydrophobicContact CB-CH2 4.32Å; V42-W101 HydrophobicContact CG2-CH2 3.85Å; V42-W101 HydrophobicContact CG2-CZ3 4.24Å; V42-P135 HydrophobicContact CG2-CG 4.13Å
43	K	97.8	Very high	98	Very high	96 Å²	96	34.7 Å²	34.7	42%	0.417	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-18.1	-178.6	-71.4	-178.4	-68.5	174.2	0	113.4	D40 V45 Y100	D40-K43 PolarHBondContact OD1-N 2.98Å; D40-K43 WeakPolarHBondContact OD2-CE 3.45Å; D40-K43 IonicContact OD2-NZ 2.63Å; K43-V45 HydrophobicContact CB-CG2 3.69Å; K43-V45 HydrophobicContact CD-CG2 4.46Å; K43-Y100 WeakPolarHBondContact CE-OH 3.34Å; K43-Y100 PolarHBondContact NZ-OH 3.1Å; K43-Y100 VanDerWaalsContact NZ-OH 3.1Å
44	G	98.1	Very high	98.3	Very high	68 Å²	68	34.7 Å²	34.7	70%	0.701	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	32.5	-175.8	0	0	0	0	0	113.2	D40	D40-G44 WeakPolarHBondContact O-CA 3.49Å; D40-G44 PolarHBondContact O-N 2.87Å
45	V	98.3	Very high	98.4	Very high	64 Å²	64	35.1 Å²	35.1	39%	0.388	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163.6	-176.6	-58.7	0	0	0	0	110.5	D40 K43	D40-V45 HydrophobicContact CB-CG2 4.5Å; D40-V45 WeakPolarHBondContact CB-O 3.35Å; D40-V45 PolarHBondContact N-O 3.19Å; D40-V45 PolarHBondContact O-N 2.87Å; K43-V45 HydrophobicContact CB-CG2 3.69Å; K43-V45 HydrophobicContact CD-CG2 4.46Å
46	P	98.8	Very high	98.4	Very high	48 Å²	48	38.5 Å²	38.5	31%	0.312	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	145.3	169.7	-21.1	32.9	0	0	0	113.1	L39 G48 T74	L39-P46 HydrophobicContact CD2-CB 4.3Å; L39-P46 HydrophobicContact CD2-CG 4.31Å; P46-G48 PolarHBondContact O-N 3.39Å; P46-T74 WeakPolarHBondContact CB-O 3.35Å
47	A	98.6	Very high	98.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.265	C	S	.	.			trans	-91.3	91.3	177.1	0	0	0	0	0	109.8	I38 D40 V50 T71 Y100 L133	I38-A47 HydrophobicContact CB-CB 4.08Å; I38-A47 HydrophobicContact CG2-CB 3.66Å; I38-A47 PolarHBondContact O-N 3.5Å; D40-A47 HydrophobicContact CB-CB 4.4Å; A47-V50 HydrophobicContact CB-CG2 3.96Å; A47-V50 WeakPolarHBondContact O-CG2 3.5Å; A47-T71 PolarHBondContact O-OG1 2.93Å; A47-Y100 HydrophobicContact CB-CE1 4.3Å; A47-Y100 HydrophobicContact CB-CE2 3.91Å; A47-L133 HydrophobicContact CB-CD1 4.46Å
48	G	98.2	Very high	98.1	Very high	19 Å²	19	43.6 Å²	43.6	20%	0.196	27%	0.27	C	S	.	.			trans	-80.3	163.9	173.5	0	0	0	0	0	113.5	P46 V50 T71 D72	P46-G48 PolarHBondContact O-N 3.39Å; G48-V50 PolarHBondContact O-N 2.57Å; G48-T71 WeakPolarHBondContact CA-OG1 3.43Å; G48-D72 WeakPolarHBondContact CA-O 3.35Å
49	A	98.3	Very high	97.4	Very high	79 Å²	79	51.4 Å²	51.4	65%	0.653	31%	0.312	S	S	*	.	S	Bend	trans	58.5	30.1	-179.8	0	0	0	0	0	114.6	T71	A49-T71 WeakPolarHBondContact CA-O 3.44Å; A49-T71 PolarHBondContact N-O 3.4Å; A49-T71 PolarHBondContact N-OG1 3.48Å
50	V	98.8	Very high	96.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	32%	0.321	C	S	.	.			trans	-89.5	114.6	173.1	-176	0	0	0	0	108.4	I38 A47 G48 V70 T71 F95 Y100	I38-V50 HydrophobicContact CD1-CB 3.99Å; I38-V50 HydrophobicContact CD1-CG1 3.85Å; I38-V50 HydrophobicContact CD1-CG2 4.37Å; A47-V50 HydrophobicContact CB-CG2 3.96Å; A47-V50 WeakPolarHBondContact O-CG2 3.5Å; G48-V50 PolarHBondContact O-N 2.57Å; V50-V70 WeakPolarHBondContact O-CA 3.29Å; V50-T71 HydrophobicContact CB-CG2 4.28Å; V50-T71 WeakPolarHBondContact CB-OG1 3.41Å; V50-T71 PolarHBondContact N-OG1 3Å; V50-T71 PolarHBondContact O-N 2.86Å; V50-F95 HydrophobicContact CG1-CB 4.49Å; V50-Y100 HydrophobicContact CG2-CD2 3.5Å; V50-Y100 VanDerWaalsContact CG2-CD2 3.5Å; V50-Y100 HydrophobicContact CG2-CE2 4.12Å; V50-Y100 HydrophobicContact CG2-CG 3.85Å
51	A	98.8	Very high	96	Very high	41 Å²	41	58 Å²	58	34%	0.339	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	145.7	173.9	0	0	0	0	0	111	G69 V70 D96	A51-G69 WeakPolarHBondContact CA-O 3.41Å; A51-V70 HydrophobicContact CB-CG2 4.34Å; A51-D96 HydrophobicContact CB-CB 4.26Å; A51-D96 PolarHBondContact O-N 3.44Å
52	L	98.8	Very high	95.8	Very high	10 Å²	10	59.7 Å²	59.7	5%	0.052	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157.2	175.4	70.2	88.3	0	0	0	112.4	V36 V54 S68 G69 V77 L80 V93 E94 F95	V36-L52 HydrophobicContact CB-CD2 4.4Å; V36-L52 HydrophobicContact CG1-CD2 4.14Å; V36-L52 HydrophobicContact CG2-CD2 3.62Å; L52-V54 HydrophobicContact CD1-CG2 4.05Å; L52-S68 VanDerWaalsContact O-CA 3.29Å; L52-S68 WeakPolarHBondContact O-CA 3.27Å; L52-S68 WeakPolarHBondContact O-CB 3.07Å; L52-G69 PolarHBondContact N-O 2.82Å; L52-G69 PolarHBondContact O-N 2.83Å; L52-V77 HydrophobicContact CD2-CG2 3.91Å; L52-L80 HydrophobicContact CD1-CD1 4.07Å; L52-L80 HydrophobicContact CD1-CD2 3.68Å; L52-V93 HydrophobicContact CD1-CG1 4.1Å; L52-E94 CarbonylContact C-O 3.52Å; L52-E94 WeakPolarHBondContact CA-O 3.39Å; L52-E94 WeakPolarHBondContact CB-O 3.21Å; L52-F95 HydrophobicContact CB-CD1 3.85Å; L52-F95 HydrophobicContact CB-CE1 4.34Å; L52-F95 HydrophobicContact CB-CG 4.4Å; L52-F95 HydrophobicContact CD2-CD1 3.97Å; L52-F95 HydrophobicContact CD2-CE1 3.81Å
53	S	98.6	Very high	95.7	Very high	23 Å²	23	58.4 Å²	58.4	16%	0.161	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.1	171.2	71.2	0	0	0	0	111.2	V93 E94	S53-V93 WeakPolarHBondContact O-CA 3.48Å; S53-E94 PolarHBondContact N-O 2.84Å; S53-E94 PolarHBondContact O-N 2.88Å
54	V	98.6	Very high	95.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.5	173.8	-171.9	0	0	0	0	107.8	L34 L52 Q65 V66 A67 L80 Y91 R92 V93	L34-V54 HydrophobicContact CD2-CG1 4Å; L34-V54 HydrophobicContact CD2-CG2 4.17Å; L52-V54 HydrophobicContact CD1-CG2 4.05Å; V54-Q65 WeakPolarHBondContact O-CA 3.38Å; V54-V66 HydrophobicContact CB-CG2 4.18Å; V54-V66 HydrophobicContact CG1-CG2 3.87Å; V54-V66 WeakPolarHBondContact O-CG2 2.88Å; V54-V66 PolarHBondContact O-N 3.36Å; V54-A67 HydrophobicContact CB-CB 4.02Å; V54-A67 HydrophobicContact CG2-CB 4.15Å; V54-A67 PolarHBondContact N-O 3.39Å; V54-A67 PolarHBondContact O-N 2.81Å; V54-L80 HydrophobicContact CG2-CD1 4.42Å; V54-L80 HydrophobicContact CG2-CD2 4.49Å; V54-Y91 HydrophobicContact CG1-CD1 4.07Å; V54-R92 CarbonylContact C-O 3.54Å; V54-R92 WeakPolarHBondContact CA-O 3.49Å; V54-V93 HydrophobicContact CG1-CG2 4.26Å; V54-V93 HydrophobicContact CG2-CG1 4.5Å; V54-V93 HydrophobicContact CG2-CG2 4.2Å
55	S	98.3	Very high	95.7	Very high	8 Å²	8	58.5 Å²	58.5	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.2	176.6	-61.7	0	0	0	0	110.9	A64 Y91 R92	S55-A64 CarbonylContact C-O 3.51Å; S55-A64 WeakPolarHBondContact CA-O 3.3Å; S55-Y91 CarbonylContact O-C 3.52Å; S55-Y91 VanDerWaalsContact O-CA 3.29Å; S55-Y91 WeakPolarHBondContact O-CA 3.37Å; S55-R92 PolarHBondContact N-O 2.83Å; S55-R92 PolarHBondContact O-N 2.94Å
56	R	97.6	Very high	95.6	Very high	86 Å²	86	58.6 Å²	58.6	33%	0.325	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	139.7	171	-170	177.6	-179.7	-131.8	0.2	109.8	A64 V66 S88 Y91	R56-A64 PolarHBondContact N-O 2.76Å; R56-A64 PolarHBondContact O-N 2.98Å; R56-V66 HydrophobicContact CB-CG1 3.87Å; R56-V66 HydrophobicContact CB-CG2 4.5Å; R56-S88 PolarHBondContact NH2-O 3.17Å; R56-Y91 HydrophobicContact CB-CD1 4.03Å; R56-Y91 HydrophobicContact CB-CE1 3.77Å; R56-Y91 WeakPolarHBondContact CD-OH 3.3Å; R56-Y91 HydrophobicContact CG-CD1 4.29Å; R56-Y91 HydrophobicContact CG-CE1 3.85Å; R56-Y91 HydrophobicContact CG-CE2 4.36Å
57	R	97.3	Very high	95.6	Very high	105 Å²	105	57 Å²	57	40%	0.396	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.5	176.3	-155.3	176.7	-160	-168	-3	110	G60 T62 W63 V90	R57-G60 WeakPolarHBondContact CD-O 3.49Å; R57-G60 VanDerWaalsContact CG-O 3.31Å; R57-G60 WeakPolarHBondContact CG-O 3.16Å; R57-G60 VanDerWaalsContact CZ-O 3.25Å; R57-G60 PolarHBondContact NE-O 3.14Å; R57-T62 CarbonylContact C-O 3.52Å; R57-T62 WeakPolarHBondContact CA-O 3.09Å; R57-W63 HydrophobicContact CB-CD2 4.49Å; R57-W63 HydrophobicContact CB-CE3 3.96Å; R57-W63 HydrophobicContact CB-CH2 4.03Å; R57-W63 HydrophobicContact CB-CZ3 3.71Å; R57-W63 HydrophobicContact CG-CD2 4.44Å; R57-W63 HydrophobicContact CG-CE3 4.39Å; R57-W63 HydrophobicContact CG-CH2 4.26Å; R57-W63 HydrophobicContact CG-CZ2 4.3Å; R57-W63 HydrophobicContact CG-CZ3 4.3Å; R57-V90 HydrophobicContact CB-CB 3.99Å; R57-V90 WeakPolarHBondContact CB-O 3.38Å; R57-V90 PolarHBondContact N-O 2.68Å
58	V	92.8	Very high	95.5	Very high	52 Å²	52	60.6 Å²	60.6	32%	0.315	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.8	177.2	-59	0	0	0	0	109.9	G60 T62 A64	V58-G60 PolarHBondContact O-N 2.77Å; V58-T62 HydrophobicContact CG2-CG2 3.71Å; V58-T62 PolarHBondContact N-O 3.2Å; V58-T62 WeakPolarHBondContact O-CB 3.5Å; V58-T62 PolarHBondContact O-N 3.17Å; V58-A64 HydrophobicContact CG1-CB 3.84Å; V58-A64 HydrophobicContact CG2-CB 4.29Å
59	N	83.7	Confident	95.5	Very high	165 Å²	165	60.5 Å²	60.5	88%	0.882	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.5	70.2	173.9	-63.6	-18.6	0	0	0	115	M61	N59-M61 PolarHBondContact O-N 2.94Å
60	G	82.1	Confident	95.5	Very high	55 Å²	55	61 Å²	61	57%	0.567	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-105.3	-179.9	0	0	0	0	0	111.8	R57 V58	R57-G60 WeakPolarHBondContact CD-O 3.49Å; R57-G60 VanDerWaalsContact CG-O 3.31Å; R57-G60 WeakPolarHBondContact CG-O 3.16Å; R57-G60 VanDerWaalsContact CZ-O 3.25Å; R57-G60 PolarHBondContact NE-O 3.14Å; V58-G60 PolarHBondContact O-N 2.77Å
61	M	85.1	Confident	95.5	Very high	155 Å²	155	61.3 Å²	61.3	76%	0.764	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	4.3	-170.6	-58	-160.2	-78.9	0	0	115.5	N59	N59-M61 PolarHBondContact O-N 2.94Å
62	T	94.6	Very high	95.5	Very high	85 Å²	85	62.4 Å²	62.4	52%	0.521	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	148	-178.8	-52	0	0	0	0	110	R57 V58	R57-T62 CarbonylContact C-O 3.52Å; R57-T62 WeakPolarHBondContact CA-O 3.09Å; V58-T62 HydrophobicContact CG2-CG2 3.71Å; V58-T62 PolarHBondContact N-O 3.2Å; V58-T62 WeakPolarHBondContact O-CB 3.5Å; V58-T62 PolarHBondContact O-N 3.17Å
63	W	96.9	Very high	95.4	Very high	68 Å²	68	69.8 Å²	69.8	26%	0.258	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.6	176.6	-65.4	98.6	0	0	0	109.5	R57 V90 R92 V116	R57-W63 HydrophobicContact CB-CD2 4.49Å; R57-W63 HydrophobicContact CB-CE3 3.96Å; R57-W63 HydrophobicContact CB-CH2 4.03Å; R57-W63 HydrophobicContact CB-CZ3 3.71Å; R57-W63 HydrophobicContact CG-CD2 4.44Å; R57-W63 HydrophobicContact CG-CE3 4.39Å; R57-W63 HydrophobicContact CG-CH2 4.26Å; R57-W63 HydrophobicContact CG-CZ2 4.3Å; R57-W63 HydrophobicContact CG-CZ3 4.3Å; W63-V90 HydrophobicContact CH2-CG1 3.86Å; W63-V90 HydrophobicContact CZ3-CG1 4.43Å; W63-R92 HydrophobicContact CD2-CB 4.36Å; W63-R92 HydrophobicContact CE3-CB 3.84Å; W63-R92 HydrophobicContact CH2-CB 3.76Å; W63-R92 HydrophobicContact CZ2-CB 4.28Å; W63-R92 HydrophobicContact CZ3-CB 3.52Å; W63-V116 HydrophobicContact CH2-CG1 3.84Å; W63-V116 HydrophobicContact CZ2-CG1 4.31Å
64	A	97.1	Very high	95.4	Very high	40 Å²	40	70.2 Å²	70.2	33%	0.331	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.8	171.7	0	0	0	0	0	108.8	S55 R56 V58 V66	S55-A64 CarbonylContact C-O 3.51Å; S55-A64 WeakPolarHBondContact CA-O 3.3Å; R56-A64 PolarHBondContact N-O 2.76Å; R56-A64 PolarHBondContact O-N 2.98Å; V58-A64 HydrophobicContact CG1-CB 3.84Å; V58-A64 HydrophobicContact CG2-CB 4.29Å; A64-V66 PolarHBondContact O-N 2.88Å
65	Q	97.6	Very high	95.3	Very high	125 Å²	125	70.2 Å²	70.2	58%	0.584	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	129	175	-173.8	177.6	-37.5	0	0	109.5	V54	V54-Q65 WeakPolarHBondContact O-CA 3.38Å
66	V	97.5	Very high	95.3	Very high	66 Å²	66	70.7 Å²	70.7	40%	0.4	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-23.1	-178.9	-65.9	0	0	0	0	112.4	V54 R56 A64 I81 Y91	V54-V66 HydrophobicContact CB-CG2 4.18Å; V54-V66 HydrophobicContact CG1-CG2 3.87Å; V54-V66 WeakPolarHBondContact O-CG2 2.88Å; V54-V66 PolarHBondContact O-N 3.36Å; R56-V66 HydrophobicContact CB-CG1 3.87Å; R56-V66 HydrophobicContact CB-CG2 4.5Å; A64-V66 PolarHBondContact O-N 2.88Å; V66-I81 HydrophobicContact CB-CD1 4.24Å; V66-I81 HydrophobicContact CG2-CD1 3.89Å; V66-Y91 HydrophobicContact CG2-CD1 4.46Å; V66-Y91 HydrophobicContact CG2-CE1 4.23Å
67	A	97.7	Very high	95.3	Very high	14 Å²	14	67.4 Å²	67.4	12%	0.116	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	169.8	175.6	0	0	0	0	0	112.3	V54 L80	V54-A67 HydrophobicContact CB-CB 4.02Å; V54-A67 HydrophobicContact CG2-CB 4.15Å; V54-A67 PolarHBondContact N-O 3.39Å; V54-A67 PolarHBondContact O-N 2.81Å; A67-L80 WeakPolarHBondContact CB-O 3.47Å
68	S	98.1	Very high	95.1	Very high	77 Å²	77	65 Å²	65	54%	0.538	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	157.1	171.1	54	0	0	0	0	110.1	L52	L52-S68 VanDerWaalsContact O-CA 3.29Å; L52-S68 WeakPolarHBondContact O-CA 3.27Å; L52-S68 WeakPolarHBondContact O-CB 3.07Å
69	G	97.8	Very high	94.8	Very high	17 Å²	17	67.5 Å²	67.5	18%	0.175	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	175.4	178.7	0	0	0	0	0	112.6	A51 L52	A51-G69 WeakPolarHBondContact CA-O 3.41Å; L52-G69 PolarHBondContact N-O 2.82Å; L52-G69 PolarHBondContact O-N 2.83Å
70	V	98.6	Very high	95.2	Very high	90 Å²	90	60.4 Å²	60.4	55%	0.545	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	129	173.6	-179.4	0	0	0	0	107.5	V50 A51 V77	V50-V70 WeakPolarHBondContact O-CA 3.29Å; A51-V70 HydrophobicContact CB-CG2 4.34Å; V70-V77 WeakPolarHBondContact O-CG2 3.41Å
71	T	98.5	Very high	95.7	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.031	32%	0.324	C	S	.	.			trans	-62.3	139.2	180	54.3	0	0	0	0	112.2	V36 I38 A47 G48 A49 V50 E76 V77	V36-T71 HydrophobicContact CG2-CG2 4.25Å; I38-T71 HydrophobicContact CD1-CG2 3.64Å; I38-T71 HydrophobicContact CG1-CG2 3.96Å; A47-T71 PolarHBondContact O-OG1 2.93Å; G48-T71 WeakPolarHBondContact CA-OG1 3.43Å; A49-T71 WeakPolarHBondContact CA-O 3.44Å; A49-T71 PolarHBondContact N-O 3.4Å; A49-T71 PolarHBondContact N-OG1 3.48Å; V50-T71 HydrophobicContact CB-CG2 4.28Å; V50-T71 WeakPolarHBondContact CB-OG1 3.41Å; V50-T71 PolarHBondContact N-OG1 3Å; V50-T71 PolarHBondContact O-N 2.86Å; T71-E76 VanDerWaalsContact CA-O 3.3Å; T71-E76 WeakPolarHBondContact CA-O 3.43Å; T71-V77 HydrophobicContact CG2-CG2 3.83Å
72	D	98	Very high	96.1	Very high	65 Å²	65	53.2 Å²	53.2	35%	0.348	30%	0.304	S	S	.	.			trans	-75.6	-174.3	172.3	67.9	23	0	0	0	112.4	G48 T74 G75 E76	G48-D72 WeakPolarHBondContact CA-O 3.35Å; D72-T74 PolarHBondContact O-N 2.91Å; D72-T74 VanDerWaalsContact O-N 3.14Å; D72-T74 VanDerWaalsContact OD1-CA 3.27Å; D72-T74 WeakPolarHBondContact OD1-CA 3.49Å; D72-T74 WeakPolarHBondContact OD1-CB 3.4Å; D72-T74 PolarHBondContact OD1-N 2.81Å; D72-T74 PolarHBondContact OD1-OG1 3.46Å; D72-G75 PolarHBondContact O-N 2.82Å; D72-G75 PolarHBondContact OD1-N 2.9Å; D72-E76 PolarHBondContact N-O 3.07Å; D72-E76 PolarHBondContact OD1-N 2.91Å
73	L	97.1	Very high	95.9	Very high	164 Å²	164	51.7 Å²	51.7	86%	0.859	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.1	179.8	-63.2	178.7	0	0	0	113.7	G75	L73-G75 VanDerWaalsContact C-N 3.32Å
74	T	97.7	Very high	95.6	Very high	32 Å²	32	56 Å²	56	20%	0.196	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	4.3	175.5	79.9	0	0	0	0	112.5	H25 K37 P46 D72 E76	H25-T74 VanDerWaalsContact CE1-CG2 3.49Å; H25-T74 WeakPolarHBondContact CE1-CG2 3.13Å; H25-T74 WeakPolarHBondContact NE2-CG2 3.49Å; H25-T74 PolarHBondContact NE2-OG1 3.3Å; K37-T74 WeakPolarHBondContact CE-O 3.33Å; K37-T74 PolarHBondContact NZ-O 2.88Å; P46-T74 WeakPolarHBondContact CB-O 3.35Å; D72-T74 PolarHBondContact O-N 2.91Å; D72-T74 VanDerWaalsContact O-N 3.14Å; D72-T74 VanDerWaalsContact OD1-CA 3.27Å; D72-T74 WeakPolarHBondContact OD1-CA 3.49Å; D72-T74 WeakPolarHBondContact OD1-CB 3.4Å; D72-T74 PolarHBondContact OD1-N 2.81Å; D72-T74 PolarHBondContact OD1-OG1 3.46Å; T74-E76 VanDerWaalsContact C-N 3.29Å
75	G	98.1	Very high	95.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	73.8	21.8	178.8	0	0	0	0	0	112.8	K37 I38 D72 L73	K37-G75 CarbonylContact C-O 3.59Å; K37-G75 WeakPolarHBondContact CA-O 3.3Å; I38-G75 PolarHBondContact N-O 2.84Å; D72-G75 PolarHBondContact O-N 2.82Å; D72-G75 PolarHBondContact OD1-N 2.9Å; L73-G75 VanDerWaalsContact C-N 3.32Å
76	E	98.3	Very high	95.2	Very high	19 Å²	19	53 Å²	53	9%	0.089	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	150.8	-175.8	-68.5	177.5	-172	0	0	112.1	H25 V36 K37 T71 D72 T74 H78	H25-E76 IonicContact CD2-OE2 3.87Å; H25-E76 PolarHBondContact CD2-OE2 3.31Å; V36-E76 VanDerWaalsContact O-CA 3.25Å; V36-E76 WeakPolarHBondContact O-CA 3.37Å; K37-E76 HydrophobicContact CD-CG 3.33Å; K37-E76 WeakPolarHBondContact CD-OE1 3.44Å; K37-E76 WeakPolarHBondContact CE-OE1 3.47Å; K37-E76 IonicContact NZ-OE1 2.69Å; K37-E76 PolarHBondContact NZ-OE1 3.44Å; T71-E76 VanDerWaalsContact CA-O 3.3Å; T71-E76 WeakPolarHBondContact CA-O 3.43Å; D72-E76 PolarHBondContact N-O 3.07Å; D72-E76 PolarHBondContact OD1-N 2.91Å; T74-E76 VanDerWaalsContact C-N 3.29Å; E76-H78 IonicContact OE2-CD2 3.47Å; E76-H78 IonicContact OE2-CE1 2.71Å; E76-H78 PolarHBondContact OE2-CE1 2.77Å; E76-H78 IonicContact OE2-NE2 3.85Å; E76-H78 PolarHBondContact OE2-NE2 2.85Å
77	V	97	Very high	95.1	Very high	16 Å²	16	54.8 Å²	54.8	10%	0.097	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.4	157.8	-167.6	0	0	0	0	108.5	V36 L52 V70 T71 L80	V36-V77 HydrophobicContact CG2-CB 3.71Å; V36-V77 HydrophobicContact CG2-CG2 3.71Å; V36-V77 PolarHBondContact N-O 3.16Å; V36-V77 PolarHBondContact O-N 3.34Å; L52-V77 HydrophobicContact CD2-CG2 3.91Å; V70-V77 WeakPolarHBondContact O-CG2 3.41Å; T71-V77 HydrophobicContact CG2-CG2 3.83Å; V77-L80 HydrophobicContact CB-CD1 4.23Å; V77-L80 HydrophobicContact CB-CD2 4.21Å; V77-L80 HydrophobicContact CB-CG 4.06Å; V77-L80 HydrophobicContact CG1-CD1 4.38Å; V77-L80 HydrophobicContact CG1-CD2 3.58Å; V77-L80 HydrophobicContact CG1-CG 3.67Å
78	H	93.1	Very high	95	Very high	56 Å²	56	56.9 Å²	56.9	26%	0.259	32%	0.315	S	S	.	.			trans	-100.4	159.1	173.5	-65.6	-81.5	0	0	0	110.5	D29 E76 L80	D29-H78 IonicContact OD1-CE1 3.4Å; E76-H78 IonicContact OE2-CD2 3.47Å; E76-H78 IonicContact OE2-CE1 2.71Å; E76-H78 PolarHBondContact OE2-CE1 2.77Å; E76-H78 IonicContact OE2-NE2 3.85Å; E76-H78 PolarHBondContact OE2-NE2 2.85Å; H78-L80 VanDerWaalsContact C-N 3.25Å; H78-L80 PolarHBondContact O-N 2.85Å
79	N	86.2	Confident	94.9	Very high	103 Å²	103	54 Å²	54	55%	0.551	30%	0.298	S	S	*	.			trans	53.1	39	174.2	-53.6	-46.3	0	0	0	113.7	C32 I81	C32-N79 PolarHBondContact SG-N 2.97Å; N79-I81 VanDerWaalsContact C-N 3.26Å; N79-I81 PolarHBondContact O-N 3.45Å
80	L	92.1	Very high	94.9	Very high	16 Å²	16	55 Å²	55	8%	0.084	30%	0.3	C	S	.	.	S	Bend	trans	-60.1	-39.3	178.5	-84.7	168.6	0	0	0	112	L34 V36 L52 V54 A67 V77 H78	L34-L80 HydrophobicContact CG-CD1 4.45Å; V36-L80 HydrophobicContact CG1-CD1 3.78Å; V36-L80 HydrophobicContact CG2-CD1 4.49Å; L52-L80 HydrophobicContact CD1-CD1 4.07Å; L52-L80 HydrophobicContact CD1-CD2 3.68Å; V54-L80 HydrophobicContact CG2-CD1 4.42Å; V54-L80 HydrophobicContact CG2-CD2 4.49Å; A67-L80 WeakPolarHBondContact CB-O 3.47Å; V77-L80 HydrophobicContact CB-CD1 4.23Å; V77-L80 HydrophobicContact CB-CD2 4.21Å; V77-L80 HydrophobicContact CB-CG 4.06Å; V77-L80 HydrophobicContact CG1-CD1 4.38Å; V77-L80 HydrophobicContact CG1-CD2 3.58Å; V77-L80 HydrophobicContact CG1-CG 3.67Å; H78-L80 VanDerWaalsContact C-N 3.25Å; H78-L80 PolarHBondContact O-N 2.85Å
81	I	93.5	Very high	94.8	Very high	11 Å²	11	50.7 Å²	50.7	6%	0.056	27%	0.274	C	S	.	.	S	Bend	trans	-146.7	145.6	-178.7	-171.2	162.7	0	0	0	108.4	P33 L34 V66 N79 D85 F86	P33-I81 WeakPolarHBondContact CD-O 3.25Å; P33-I81 HydrophobicContact CG-CG2 4.34Å; P33-I81 VanDerWaalsContact CG-O 3.24Å; P33-I81 WeakPolarHBondContact CG-O 3.34Å; L34-I81 HydrophobicContact CB-CG2 3.92Å; L34-I81 HydrophobicContact CD2-CG2 4.36Å; V66-I81 HydrophobicContact CB-CD1 4.24Å; V66-I81 HydrophobicContact CG2-CD1 3.89Å; N79-I81 VanDerWaalsContact C-N 3.26Å; N79-I81 PolarHBondContact O-N 3.45Å; I81-D85 HydrophobicContact CD1-CB 4.01Å; I81-D85 HydrophobicContact CG1-CB 3.7Å; I81-F86 HydrophobicContact CD1-CB 4.18Å; I81-F86 HydrophobicContact CD1-CD2 4.13Å; I81-F86 HydrophobicContact CG1-CB 4.14Å; I81-F86 HydrophobicContact CG2-CB 3.88Å; I81-F86 HydrophobicContact CG2-CD2 3.84Å; I81-F86 HydrophobicContact CG2-CG 3.93Å
82	S	92.3	Very high	94.8	Very high	49 Å²	49	52.9 Å²	52.9	34%	0.343	28%	0.282	S	S	.	.			trans	-75.5	156.5	177.1	78.8	0	0	0	0	111	Q84 D85 F86	S82-Q84 PolarHBondContact O-N 3.47Å; S82-Q84 PolarHBondContact OG-N 2.72Å; S82-D85 PolarHBondContact O-N 3.38Å; S82-D85 VanDerWaalsContact O-N 3.1Å; S82-D85 WeakPolarHBondContact OG-CB 3.42Å; S82-D85 PolarHBondContact OG-N 3.21Å; S82-D85 PolarHBondContact OG-OD2 3.09Å; S82-F86 WeakPolarHBondContact O-CB 3.25Å; S82-F86 PolarHBondContact O-N 3.07Å
83	D	90.4	Very high	94.9	Very high	53 Å²	53	49.8 Å²	49.8	28%	0.283	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-34.4	171.8	-78.2	-52.3	0	0	0	112.4	P33 H124	P33-D83 VanDerWaalsContact CB-OD1 3.27Å; P33-D83 WeakPolarHBondContact CB-OD1 3.33Å; P33-D83 WeakPolarHBondContact CG-OD1 3.22Å; D83-H124 IonicContact OD1-CE1 2.65Å; D83-H124 PolarHBondContact OD1-CE1 3.46Å; D83-H124 VanDerWaalsContact OD1-CE1 3.31Å; D83-H124 IonicContact OD1-NE2 3.85Å; D83-H124 PolarHBondContact OD1-NE2 3.05Å
84	Q	90.8	Very high	95	Very high	158 Å²	158	44.8 Å²	44.8	74%	0.738	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-37.1	178.7	-176.7	175	11	0	0	111.9	S82 Q87	S82-Q84 PolarHBondContact O-N 3.47Å; S82-Q84 PolarHBondContact OG-N 2.72Å; Q84-Q87 PolarHBondContact O-NE2 2.68Å
85	D	92.1	Very high	95	Very high	101 Å²	101	43.3 Å²	43.3	54%	0.54	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-21.1	-177.4	-60.9	-47	0	0	0	112.4	I81 S82 Q87	I81-D85 HydrophobicContact CD1-CB 4.01Å; I81-D85 HydrophobicContact CG1-CB 3.7Å; S82-D85 PolarHBondContact O-N 3.38Å; S82-D85 VanDerWaalsContact O-N 3.1Å; S82-D85 WeakPolarHBondContact OG-CB 3.42Å; S82-D85 PolarHBondContact OG-N 3.21Å; S82-D85 PolarHBondContact OG-OD2 3.09Å; D85-Q87 VanDerWaalsContact C-N 3.29Å; D85-Q87 PolarHBondContact O-N 3.37Å
86	F	95.3	Very high	95	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.009	25%	0.245	C	C	.	.			trans	-84.9	69.1	179.2	-162.8	-127	0	0	0	112.3	P33 L34 I81 S82 Y91 F117 A119 H120 Y127	P33-F86 HydrophobicContact CB-CB 4.36Å; P33-F86 HydrophobicContact CB-CD1 3.67Å; P33-F86 HydrophobicContact CB-CE1 4.35Å; P33-F86 HydrophobicContact CB-CG 4.35Å; P33-F86 HydrophobicContact CG-CB 4.21Å; P33-F86 HydrophobicContact CG-CD1 4.34Å; L34-F86 HydrophobicContact CB-CZ 4.37Å; L34-F86 HydrophobicContact CD2-CE2 4.3Å; I81-F86 HydrophobicContact CD1-CB 4.18Å; I81-F86 HydrophobicContact CD1-CD2 4.13Å; I81-F86 HydrophobicContact CG1-CB 4.14Å; I81-F86 HydrophobicContact CG2-CB 3.88Å; I81-F86 HydrophobicContact CG2-CD2 3.84Å; I81-F86 HydrophobicContact CG2-CG 3.93Å; S82-F86 WeakPolarHBondContact O-CB 3.25Å; S82-F86 PolarHBondContact O-N 3.07Å; F86-Y91 HydrophobicContact CD2-CD1 4.22Å; F86-Y91 HydrophobicContact CD2-CD2 4.45Å; F86-Y91 AromaticContact CD2-CE1 3.64Å; F86-Y91 HydrophobicContact CD2-CE1 3.64Å; F86-Y91 AromaticContact CD2-CE2 3.92Å; F86-Y91 HydrophobicContact CD2-CE2 3.92Å; F86-Y91 AromaticContact CD2-CZ 3.47Å; F86-Y91 VanDerWaalsContact CD2-CZ 3.47Å; F86-Y91 AromaticContact CE2-CD1 3.84Å; F86-Y91 HydrophobicContact CE2-CD1 3.84Å; F86-Y91 AromaticContact CE2-CD2 3.74Å; F86-Y91 HydrophobicContact CE2-CD2 3.74Å; F86-Y91 AromaticContact CE2-CE1 3.72Å; F86-Y91 HydrophobicContact CE2-CE1 3.72Å; F86-Y91 AromaticContact CE2-CE2 3.63Å; F86-Y91 HydrophobicContact CE2-CE2 3.63Å; F86-Y91 AromaticContact CE2-CG 3.84Å; F86-Y91 HydrophobicContact CE2-CG 3.84Å; F86-Y91 AromaticContact CE2-CZ 3.6Å; F86-Y91 HydrophobicContact CZ-CD2 4.41Å; F86-Y91 HydrophobicContact CZ-CE2 4.42Å; F86-F117 HydrophobicContact CZ-CE2 4.09Å; F86-F117 HydrophobicContact CZ-CZ 4.25Å; F86-A119 HydrophobicContact CE1-CB 4.02Å; F86-A119 HydrophobicContact CE2-CB 4.09Å; F86-A119 HydrophobicContact CZ-CB 3.57Å; F86-H120 AromaticContact CD1-CE1 3.78Å; F86-H120 AromaticContact CD1-NE2 3.02Å; F86-H120 WeakPolarHBondContact CD1-NE2 3.32Å; F86-H120 AromaticContact CE1-CE1 3.87Å; F86-H120 AromaticContact CE1-NE2 3.33Å; F86-H120 VanDerWaalsContact CE1-NE2 3.33Å; F86-H120 WeakPolarHBondContact CE1-NE2 3.34Å; F86-H120 AromaticContact CG-NE2 3.89Å; F86-H120 PolarHBondContact O-CD2 2.97Å; F86-H120 VanDerWaalsContact O-CD2 3.3Å; F86-H120 PolarHBondContact O-NE2 3.31Å; F86-H120 VanDerWaalsContact O-NE2 3.08Å; F86-Y127 AromaticContact CE1-CD2 3.65Å; F86-Y127 HydrophobicContact CE1-CD2 3.65Å; F86-Y127 AromaticContact CE1-CE2 3.89Å; F86-Y127 HydrophobicContact CE1-CE2 3.89Å; F86-Y127 HydrophobicContact CZ-CD2 4.13Å; F86-Y127 HydrophobicContact CZ-CE2 4.42Å
87	Q	94.3	Very high	95.1	Very high	102 Å²	102	45.6 Å²	45.6	48%	0.477	24%	0.241	S	C	.	.			trans	-77.8	160.1	179.2	-64.1	-60.9	-48.4	0	0	112.2	Q84 D85 G89 Y91	Q84-Q87 PolarHBondContact O-NE2 2.68Å; D85-Q87 VanDerWaalsContact C-N 3.29Å; D85-Q87 PolarHBondContact O-N 3.37Å; Q87-G89 PolarHBondContact O-N 2.71Å; Q87-Y91 PolarHBondContact N-OH 3.26Å; Q87-Y91 VanDerWaalsContact N-OH 3.1Å; Q87-Y91 WeakPolarHBondContact O-CE2 3.32Å; Q87-Y91 PolarHBondContact O-OH 2.65Å
88	S	95.8	Very high	95.2	Very high	58 Å²	58	47.2 Å²	47.2	41%	0.406	25%	0.247	S	C	.	.	S	Bend	trans	-54.7	140.7	173.4	-177.3	0	0	0	0	112.1	R56 A119	R56-S88 PolarHBondContact NH2-O 3.17Å; S88-A119 WeakPolarHBondContact CA-O 3.44Å; S88-A119 PolarHBondContact OG-O 2.84Å; S88-A119 VanDerWaalsContact OG-O 3.1Å
89	G	95.8	Very high	95.4	Very high	16 Å²	16	46.7 Å²	46.7	17%	0.165	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.9	-176	178.5	0	0	0	0	0	112.9	Q87 Y91 A119	Q87-G89 PolarHBondContact O-N 2.71Å; G89-Y91 VanDerWaalsContact O-CD2 3.32Å; G89-Y91 WeakPolarHBondContact O-CD2 2.99Å; G89-A119 PolarHBondContact N-O 2.89Å; G89-A119 VanDerWaalsContact N-O 3.17Å; G89-A119 PolarHBondContact O-N 2.66Å
90	V	97.6	Very high	96	Very high	38 Å²	38	42.1 Å²	42.1	23%	0.23	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	127	-178.6	-171.6	0	0	0	0	110.3	R57 W63 V116 F117	R57-V90 HydrophobicContact CB-CB 3.99Å; R57-V90 WeakPolarHBondContact CB-O 3.38Å; R57-V90 PolarHBondContact N-O 2.68Å; W63-V90 HydrophobicContact CH2-CG1 3.86Å; W63-V90 HydrophobicContact CZ3-CG1 4.43Å; V90-V116 HydrophobicContact CG1-CG1 3.85Å; V90-F117 CarbonylContact C-O 3.57Å; V90-F117 WeakPolarHBondContact CA-O 3.17Å
91	Y	98.1	Very high	96.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	153.7	177	-69.7	-96	0	0	0	111.1	V54 S55 R56 V66 F86 Q87 G89 V116 F117 A119	V54-Y91 HydrophobicContact CG1-CD1 4.07Å; S55-Y91 CarbonylContact O-C 3.52Å; S55-Y91 VanDerWaalsContact O-CA 3.29Å; S55-Y91 WeakPolarHBondContact O-CA 3.37Å; R56-Y91 HydrophobicContact CB-CD1 4.03Å; R56-Y91 HydrophobicContact CB-CE1 3.77Å; R56-Y91 WeakPolarHBondContact CD-OH 3.3Å; R56-Y91 HydrophobicContact CG-CD1 4.29Å; R56-Y91 HydrophobicContact CG-CE1 3.85Å; R56-Y91 HydrophobicContact CG-CE2 4.36Å; V66-Y91 HydrophobicContact CG2-CD1 4.46Å; V66-Y91 HydrophobicContact CG2-CE1 4.23Å; F86-Y91 HydrophobicContact CD2-CD1 4.22Å; F86-Y91 HydrophobicContact CD2-CD2 4.45Å; F86-Y91 AromaticContact CD2-CE1 3.64Å; F86-Y91 HydrophobicContact CD2-CE1 3.64Å; F86-Y91 AromaticContact CD2-CE2 3.92Å; F86-Y91 HydrophobicContact CD2-CE2 3.92Å; F86-Y91 AromaticContact CD2-CZ 3.47Å; F86-Y91 VanDerWaalsContact CD2-CZ 3.47Å; F86-Y91 AromaticContact CE2-CD1 3.84Å; F86-Y91 HydrophobicContact CE2-CD1 3.84Å; F86-Y91 AromaticContact CE2-CD2 3.74Å; F86-Y91 HydrophobicContact CE2-CD2 3.74Å; F86-Y91 AromaticContact CE2-CE1 3.72Å; F86-Y91 HydrophobicContact CE2-CE1 3.72Å; F86-Y91 AromaticContact CE2-CE2 3.63Å; F86-Y91 HydrophobicContact CE2-CE2 3.63Å; F86-Y91 AromaticContact CE2-CG 3.84Å; F86-Y91 HydrophobicContact CE2-CG 3.84Å; F86-Y91 AromaticContact CE2-CZ 3.6Å; F86-Y91 HydrophobicContact CZ-CD2 4.41Å; F86-Y91 HydrophobicContact CZ-CE2 4.42Å; Q87-Y91 PolarHBondContact N-OH 3.26Å; Q87-Y91 VanDerWaalsContact N-OH 3.1Å; Q87-Y91 WeakPolarHBondContact O-CE2 3.32Å; Q87-Y91 PolarHBondContact O-OH 2.65Å; G89-Y91 VanDerWaalsContact O-CD2 3.32Å; G89-Y91 WeakPolarHBondContact O-CD2 2.99Å; Y91-V116 VanDerWaalsContact O-CA 3.3Å; Y91-V116 WeakPolarHBondContact O-CA 3.17Å; Y91-F117 PolarHBondContact N-O 3.4Å; Y91-F117 PolarHBondContact O-N 2.78Å; Y91-A119 HydrophobicContact CD2-CB 3.66Å; Y91-A119 HydrophobicContact CE2-CB 3.71Å
92	R	98.5	Very high	96.6	Very high	52 Å²	52	47.3 Å²	47.3	20%	0.196	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.4	169.3	177	173.9	64.8	172.1	5.5	108.5	V54 S55 W63 E114 V115 V116	V54-R92 CarbonylContact C-O 3.54Å; V54-R92 WeakPolarHBondContact CA-O 3.49Å; S55-R92 PolarHBondContact N-O 2.83Å; S55-R92 PolarHBondContact O-N 2.94Å; W63-R92 HydrophobicContact CD2-CB 4.36Å; W63-R92 HydrophobicContact CE3-CB 3.84Å; W63-R92 HydrophobicContact CH2-CB 3.76Å; W63-R92 HydrophobicContact CZ2-CB 4.28Å; W63-R92 HydrophobicContact CZ3-CB 3.52Å; R92-E114 WeakPolarHBondContact CD-OE2 3.37Å; R92-E114 IonicContact NH1-OE2 3.63Å; R92-V115 CarbonylContact C-O 3.55Å; R92-V115 WeakPolarHBondContact CA-O 3.37Å; R92-V116 HydrophobicContact CB-CG2 4.06Å; R92-V116 HydrophobicContact CG-CG2 3.88Å
93	V	98.7	Very high	96.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.7	167	-172.4	0	0	0	0	107.9	L34 L52 S53 V54 F95 E114 V115 F117 L129	L34-V93 HydrophobicContact CD2-CG2 4.24Å; L52-V93 HydrophobicContact CD1-CG1 4.1Å; S53-V93 WeakPolarHBondContact O-CA 3.48Å; V54-V93 HydrophobicContact CG1-CG2 4.26Å; V54-V93 HydrophobicContact CG2-CG1 4.5Å; V54-V93 HydrophobicContact CG2-CG2 4.2Å; V93-F95 HydrophobicContact CB-CE2 3.94Å; V93-F95 HydrophobicContact CB-CZ 4.14Å; V93-F95 HydrophobicContact CG1-CD2 4.19Å; V93-F95 HydrophobicContact CG1-CE1 3.93Å; V93-F95 HydrophobicContact CG1-CE2 3.53Å; V93-F95 HydrophobicContact CG1-CZ 3.39Å; V93-E114 WeakPolarHBondContact O-CA 3.45Å; V93-V115 PolarHBondContact N-O 2.91Å; V93-V115 PolarHBondContact O-N 2.84Å; V93-F117 HydrophobicContact CG2-CE1 4.11Å; V93-L129 HydrophobicContact CB-CD1 3.97Å; V93-L129 HydrophobicContact CG2-CD1 3.64Å
94	E	98.8	Very high	97.2	Very high	59 Å²	59	50.4 Å²	50.4	28%	0.276	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.7	179	-175.1	-177.6	118.2	0	0	108.7	L52 S53 T112 E114	L52-E94 CarbonylContact C-O 3.52Å; L52-E94 WeakPolarHBondContact CA-O 3.39Å; L52-E94 WeakPolarHBondContact CB-O 3.21Å; S53-E94 PolarHBondContact N-O 2.84Å; S53-E94 PolarHBondContact O-N 2.88Å; E94-T112 HydrophobicContact CG-CG2 3.93Å; E94-E114 HydrophobicContact CB-CG 4.27Å; E94-E114 HydrophobicContact CG-CG 3.99Å
95	F	98.9	Very high	97.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129	-178.3	-55.9	-95.7	0	0	0	109.7	V36 I38 V50 L52 V93 T97 T112 A113 V115 L131	V36-F95 HydrophobicContact CB-CE1 4.1Å; V36-F95 HydrophobicContact CB-CZ 4.5Å; V36-F95 HydrophobicContact CG1-CE1 3.92Å; V36-F95 HydrophobicContact CG1-CZ 4.02Å; V36-F95 HydrophobicContact CG2-CE1 4.49Å; I38-F95 HydrophobicContact CD1-CD1 3.53Å; I38-F95 HydrophobicContact CD1-CE1 3.8Å; I38-F95 HydrophobicContact CG1-CE1 4.42Å; V50-F95 HydrophobicContact CG1-CB 4.49Å; L52-F95 HydrophobicContact CB-CD1 3.85Å; L52-F95 HydrophobicContact CB-CE1 4.34Å; L52-F95 HydrophobicContact CB-CG 4.4Å; L52-F95 HydrophobicContact CD2-CD1 3.97Å; L52-F95 HydrophobicContact CD2-CE1 3.81Å; V93-F95 HydrophobicContact CB-CE2 3.94Å; V93-F95 HydrophobicContact CB-CZ 4.14Å; V93-F95 HydrophobicContact CG1-CD2 4.19Å; V93-F95 HydrophobicContact CG1-CE1 3.93Å; V93-F95 HydrophobicContact CG1-CE2 3.53Å; V93-F95 HydrophobicContact CG1-CZ 3.39Å; F95-T97 HydrophobicContact CB-CG2 4.1Å; F95-T97 PolarHBondContact O-N 2.85Å; F95-T112 WeakPolarHBondContact O-CA 3.42Å; F95-A113 HydrophobicContact CB-CB 4.37Å; F95-A113 HydrophobicContact CD2-CB 4.49Å; F95-A113 WeakPolarHBondContact CD2-O 3.44Å; F95-A113 PolarHBondContact N-O 2.75Å; F95-A113 PolarHBondContact O-N 3.02Å; F95-V115 HydrophobicContact CE2-CG2 3.92Å; F95-L131 HydrophobicContact CB-CD2 4.46Å; F95-L131 HydrophobicContact CD1-CD2 4.19Å; F95-L131 HydrophobicContact CD2-CD1 4.46Å; F95-L131 HydrophobicContact CD2-CD2 3.58Å; F95-L131 HydrophobicContact CE1-CD1 4.14Å; F95-L131 HydrophobicContact CE1-CD2 4.28Å; F95-L131 HydrophobicContact CE2-CD1 3.75Å; F95-L131 HydrophobicContact CE2-CD2 3.72Å; F95-L131 HydrophobicContact CE2-CG 4.41Å; F95-L131 HydrophobicContact CG-CD2 3.83Å; F95-L131 HydrophobicContact CZ-CD1 3.54Å; F95-L131 HydrophobicContact CZ-CD2 4.06Å; F95-L131 HydrophobicContact CZ-CG 4.49Å
96	D	98.8	Very high	97.8	Very high	64 Å²	64	44 Å²	44	34%	0.342	26%	0.256	S	S	.	.			trans	-79.4	65.7	178.4	-167.4	-8.5	0	0	0	111.3	A51 K98 A99 Y100	A51-D96 HydrophobicContact CB-CB 4.26Å; A51-D96 PolarHBondContact O-N 3.44Å; D96-K98 PolarHBondContact O-N 2.73Å; D96-A99 HydrophobicContact CB-CB 4.41Å; D96-A99 PolarHBondContact O-N 2.82Å; D96-A99 WeakPolarHBondContact OD1-CB 3.3Å; D96-A99 PolarHBondContact OD1-N 2.85Å; D96-A99 VanDerWaalsContact OD2-CB 3.22Å; D96-A99 WeakPolarHBondContact OD2-CB 3.43Å; D96-Y100 PolarHBondContact O-N 2.8Å
97	T	98.8	Very high	98	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-26.4	-179.9	56.8	0	0	0	0	112	F95 W101 A113 L133	F95-T97 HydrophobicContact CB-CG2 4.1Å; F95-T97 PolarHBondContact O-N 2.85Å; T97-W101 PolarHBondContact O-N 2.81Å; T97-A113 HydrophobicContact CG2-CB 3.69Å; T97-A113 PolarHBondContact OG1-N 3.1Å; T97-L133 HydrophobicContact CG2-CD1 3.92Å; T97-L133 HydrophobicContact CG2-CD2 3.86Å
98	K	98.8	Very high	98.2	Very high	51 Å²	51	45.4 Å²	45.4	22%	0.222	27%	0.272	C	S	.	.	H	α-helix	trans	-69.1	-46.8	176.6	179.7	163.8	177.2	179.8	0	111.9	D96 Y100 W101 K102 P108 E111	D96-K98 PolarHBondContact O-N 2.73Å; K98-Y100 VanDerWaalsContact C-N 3.3Å; K98-Y100 PolarHBondContact O-N 2.85Å; K98-W101 PolarHBondContact O-N 2.81Å; K98-K102 HydrophobicContact CG-CD 4.27Å; K98-K102 WeakPolarHBondContact O-CB 3.29Å; K98-K102 WeakPolarHBondContact O-CG 3.43Å; K98-K102 PolarHBondContact O-N 2.79Å; K98-P108 HydrophobicContact CB-CG 4.23Å; K98-P108 HydrophobicContact CG-CG 3.86Å; K98-E111 WeakPolarHBondContact CB-O 3.32Å; K98-E111 VanDerWaalsContact CD-OE2 3.23Å; K98-E111 WeakPolarHBondContact CD-OE2 3.42Å; K98-E111 WeakPolarHBondContact CE-OE2 3.24Å; K98-E111 IonicContact NZ-OE1 2.63Å; K98-E111 PolarHBondContact NZ-OE1 2.92Å; K98-E111 IonicContact NZ-OE2 3.57Å; K98-E111 PolarHBondContact NZ-OE2 3.24Å
99	A	98.6	Very high	98.3	Very high	44 Å²	44	49.1 Å²	49.1	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-62.4	-41	174.6	0	0	0	0	0	111.3	D96 K102 S103	D96-A99 HydrophobicContact CB-CB 4.41Å; D96-A99 PolarHBondContact O-N 2.82Å; D96-A99 WeakPolarHBondContact OD1-CB 3.3Å; D96-A99 PolarHBondContact OD1-N 2.85Å; D96-A99 VanDerWaalsContact OD2-CB 3.22Å; D96-A99 WeakPolarHBondContact OD2-CB 3.43Å; A99-K102 PolarHBondContact O-N 2.88Å; A99-S103 PolarHBondContact O-N 2.77Å
100	Y	98.7	Very high	98.4	Very high	7 Å²	7	50.7 Å²	50.7	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-53.5	-58.3	173.9	175.3	-101.3	0	0	0	111.3	D40 K43 A47 V50 D96 K98 K102 S103 Q104 L133	D40-Y100 WeakPolarHBondContact OD2-CE1 3.29Å; D40-Y100 PolarHBondContact OD2-OH 2.99Å; K43-Y100 WeakPolarHBondContact CE-OH 3.34Å; K43-Y100 PolarHBondContact NZ-OH 3.1Å; K43-Y100 VanDerWaalsContact NZ-OH 3.1Å; A47-Y100 HydrophobicContact CB-CE1 4.3Å; A47-Y100 HydrophobicContact CB-CE2 3.91Å; V50-Y100 HydrophobicContact CG2-CD2 3.5Å; V50-Y100 VanDerWaalsContact CG2-CD2 3.5Å; V50-Y100 HydrophobicContact CG2-CE2 4.12Å; V50-Y100 HydrophobicContact CG2-CG 3.85Å; D96-Y100 PolarHBondContact O-N 2.8Å; K98-Y100 VanDerWaalsContact C-N 3.3Å; K98-Y100 PolarHBondContact O-N 2.85Å; Y100-K102 VanDerWaalsContact C-N 3.34Å; Y100-K102 PolarHBondContact O-N 2.88Å; Y100-S103 WeakPolarHBondContact O-CB 3.27Å; Y100-S103 PolarHBondContact O-N 3.39Å; Y100-S103 VanDerWaalsContact O-N 3.1Å; Y100-S103 PolarHBondContact O-OG 3.39Å; Y100-Q104 HydrophobicContact CE1-CG 4.19Å; Y100-Q104 HydrophobicContact CE2-CG 4.33Å; Y100-Q104 WeakPolarHBondContact O-CG 3.42Å; Y100-Q104 PolarHBondContact O-N 3.06Å; Y100-L133 HydrophobicContact CD1-CD1 4.23Å
101	W	98.8	Very high	98.5	Very high	8 Å²	8	54.7 Å²	54.7	3%	0.03	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-36	-177.6	-73.4	122	0	0	0	113.8	D40 V42 T97 K98 S103 Q104 G105 T106 P108 L133 S134 P135	D40-W101 WeakPolarHBondContact OD1-CH2 3.22Å; D40-W101 VanDerWaalsContact OD2-CH2 3.3Å; D40-W101 WeakPolarHBondContact OD2-CH2 3.49Å; D40-W101 WeakPolarHBondContact OD2-CZ3 3.23Å; V42-W101 HydrophobicContact CB-CH2 4.32Å; V42-W101 HydrophobicContact CG2-CH2 3.85Å; V42-W101 HydrophobicContact CG2-CZ3 4.24Å; T97-W101 PolarHBondContact O-N 2.81Å; K98-W101 PolarHBondContact O-N 2.81Å; W101-S103 VanDerWaalsContact C-N 3.32Å; W101-S103 PolarHBondContact O-N 3.06Å; W101-Q104 HydrophobicContact CE3-CB 4.35Å; W101-Q104 HydrophobicContact CE3-CG 4.43Å; W101-Q104 CarbonylContact O-C 3.6Å; W101-Q104 WeakPolarHBondContact O-CA 3.35Å; W101-Q104 WeakPolarHBondContact O-CB 3.43Å; W101-Q104 PolarHBondContact O-N 3.1Å; W101-G105 PolarHBondContact O-N 2.92Å; W101-T106 CarbonylContact C-O 3.46Å; W101-T106 HydrophobicContact CE3-CG2 4.49Å; W101-T106 PolarHBondContact O-N 3.39Å; W101-T106 VanDerWaalsContact O-O 3.1Å; W101-P108 HydrophobicContact CB-CB 3.7Å; W101-P108 HydrophobicContact CB-CG 3.88Å; W101-P108 HydrophobicContact CG-CB 3.94Å; W101-L133 HydrophobicContact CZ2-CB 3.69Å; W101-S134 VanDerWaalsContact CZ2-C 3.44Å; W101-S134 PolarHBondContact NE1-O 3.23Å; W101-P135 HydrophobicContact CD2-CB 4.45Å; W101-P135 HydrophobicContact CD2-CG 4.17Å; W101-P135 HydrophobicContact CE3-CG 4.1Å; W101-P135 HydrophobicContact CH2-CG 4.21Å; W101-P135 HydrophobicContact CZ2-CG 4.27Å; W101-P135 HydrophobicContact CZ3-CG 4.12Å
102	K	98.5	Very high	98.5	Very high	129 Å²	129	56.4 Å²	56.4	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-60.5	-41.7	173.2	-78.7	-179.8	172.5	-174.9	0	111.9	K98 A99 Y100 Q104 G105	K98-K102 HydrophobicContact CG-CD 4.27Å; K98-K102 WeakPolarHBondContact O-CB 3.29Å; K98-K102 WeakPolarHBondContact O-CG 3.43Å; K98-K102 PolarHBondContact O-N 2.79Å; A99-K102 PolarHBondContact O-N 2.88Å; Y100-K102 VanDerWaalsContact C-N 3.34Å; Y100-K102 PolarHBondContact O-N 2.88Å; K102-Q104 PolarHBondContact O-N 3.41Å; K102-G105 PolarHBondContact O-N 3.25Å
103	S	98.2	Very high	98.5	Very high	86 Å²	86	54 Å²	54	60%	0.601	30%	0.302	S	S	*	.	H	α-helix	trans	-63.1	-26.7	175.5	80.7	0	0	0	0	112.6	A99 Y100 W101 G105	A99-S103 PolarHBondContact O-N 2.77Å; Y100-S103 WeakPolarHBondContact O-CB 3.27Å; Y100-S103 PolarHBondContact O-N 3.39Å; Y100-S103 VanDerWaalsContact O-N 3.1Å; Y100-S103 PolarHBondContact O-OG 3.39Å; W101-S103 VanDerWaalsContact C-N 3.32Å; W101-S103 PolarHBondContact O-N 3.06Å; S103-G105 VanDerWaalsContact C-N 3.28Å
104	Q	97.6	Very high	98.5	Very high	80 Å²	80	57.7 Å²	57.7	37%	0.374	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	7.9	174.6	-54.6	-52.7	-67.6	0	0	113.1	Y100 W101 K102 T106	Y100-Q104 HydrophobicContact CE1-CG 4.19Å; Y100-Q104 HydrophobicContact CE2-CG 4.33Å; Y100-Q104 WeakPolarHBondContact O-CG 3.42Å; Y100-Q104 PolarHBondContact O-N 3.06Å; W101-Q104 HydrophobicContact CE3-CB 4.35Å; W101-Q104 HydrophobicContact CE3-CG 4.43Å; W101-Q104 CarbonylContact O-C 3.6Å; W101-Q104 WeakPolarHBondContact O-CA 3.35Å; W101-Q104 WeakPolarHBondContact O-CB 3.43Å; W101-Q104 PolarHBondContact O-N 3.1Å; K102-Q104 PolarHBondContact O-N 3.41Å; Q104-T106 PolarHBondContact O-N 3.23Å
105	G	98.1	Very high	98.5	Very high	74 Å²	74	55.6 Å²	55.6	76%	0.763	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	20.5	-178.9	0	0	0	0	0	114.2	W101 K102 S103	W101-G105 PolarHBondContact O-N 2.92Å; K102-G105 PolarHBondContact O-N 3.25Å; S103-G105 VanDerWaalsContact C-N 3.28Å
106	T	97.8	Very high	98.5	Very high	52 Å²	52	59.4 Å²	59.4	32%	0.319	33%	0.334	S	S	.	.			trans	-111.6	141.5	-178.1	-59.2	0	0	0	0	110.5	W101 Q104 P108 P135	W101-T106 CarbonylContact C-O 3.46Å; W101-T106 HydrophobicContact CE3-CG2 4.49Å; W101-T106 PolarHBondContact O-N 3.39Å; W101-T106 VanDerWaalsContact O-O 3.1Å; Q104-T106 PolarHBondContact O-N 3.23Å; T106-P108 WeakPolarHBondContact O-CD 3.47Å; T106-P135 HydrophobicContact CG2-CB 3.62Å; T106-P135 HydrophobicContact CG2-CG 3.51Å
107	T	98.3	Very high	98.4	Very high	114 Å²	114	58 Å²	58	70%	0.699	32%	0.324	S	S	*	.			trans	-83.2	111.7	171.8	-57.6	0	0	0	0	109.8	F136	T107-F136 WeakPolarHBondContact O-CE2 3.36Å
108	P	98.5	Very high	98.3	Very high	19 Å²	19	63.6 Å²	63.6	12%	0.123	35%	0.351	C	S	.	.			trans	-85.4	159.6	176.4	35.1	-33.9	0	0	0	112	K98 W101 T106 P135	K98-P108 HydrophobicContact CB-CG 4.23Å; K98-P108 HydrophobicContact CG-CG 3.86Å; W101-P108 HydrophobicContact CB-CB 3.7Å; W101-P108 HydrophobicContact CB-CG 3.88Å; W101-P108 HydrophobicContact CG-CB 3.94Å; T106-P108 WeakPolarHBondContact O-CD 3.47Å; P108-P135 CarbonylContact C-O 3.34Å; P108-P135 WeakPolarHBondContact CA-O 3.33Å
109	F	98.8	Very high	98.2	Very high	136 Å²	136	61.2 Å²	61.2	60%	0.596	34%	0.34	S	S	*	.	S	Bend	trans	-84.5	-46	172	-179.8	-102	0	0	0	112.8	P135 F136	F109-P135 PolarHBondContact N-O 3.14Å; F109-F136 HydrophobicContact CB-CB 4.31Å; F109-F136 HydrophobicContact CB-CD1 3.59Å; F109-F136 HydrophobicContact CB-CE1 3.94Å; F109-F136 HydrophobicContact CB-CG 3.92Å; F109-F136 HydrophobicContact CD2-CD1 4.02Å; F109-F136 HydrophobicContact CD2-CE1 4.07Å; F109-F136 HydrophobicContact CG-CD1 4.05Å; F109-F136 HydrophobicContact CG-CE1 4.42Å
110	H	98.8	Very high	98	Very high	48 Å²	48	59.9 Å²	59.9	22%	0.222	33%	0.326	C	S	.	.			trans	-80.4	143.2	-174.3	-55.5	92.9	0	0	0	111.2	Y138	H110-Y138 AromaticContact CD2-CE1 3.63Å; H110-Y138 AromaticContact CE1-CD1 3.83Å; H110-Y138 AromaticContact CG-CE1 3.99Å; H110-Y138 AromaticContact ND1-CD1 3.9Å; H110-Y138 AromaticContact NE2-CD1 3.89Å; H110-Y138 AromaticContact NE2-CE1 3.77Å
111	E	98.7	Very high	97.6	Very high	122 Å²	122	62.7 Å²	62.7	57%	0.57	35%	0.351	S	S	*	.	S	Bend	trans	-74.2	-43.4	170.5	-68.2	-61.8	136.8	0	0	111.4	K98	K98-E111 WeakPolarHBondContact CB-O 3.32Å; K98-E111 VanDerWaalsContact CD-OE2 3.23Å; K98-E111 WeakPolarHBondContact CD-OE2 3.42Å; K98-E111 WeakPolarHBondContact CE-OE2 3.24Å; K98-E111 IonicContact NZ-OE1 2.63Å; K98-E111 PolarHBondContact NZ-OE1 2.92Å; K98-E111 IonicContact NZ-OE2 3.57Å; K98-E111 PolarHBondContact NZ-OE2 3.24Å
112	T	98.7	Very high	97.2	Very high	37 Å²	37	69.5 Å²	69.5	23%	0.227	38%	0.383	C	S	.	.			trans	-146.7	165.3	175.4	57.2	0	0	0	0	108.6	E94 F95	E94-T112 HydrophobicContact CG-CG2 3.93Å; F95-T112 WeakPolarHBondContact O-CA 3.42Å
113	A	98.8	Very high	96.8	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.4	158.9	0	0	0	0	0	108.3	F95 T97 L131 Y138	F95-A113 HydrophobicContact CB-CB 4.37Å; F95-A113 HydrophobicContact CD2-CB 4.49Å; F95-A113 WeakPolarHBondContact CD2-O 3.44Å; F95-A113 PolarHBondContact N-O 2.75Å; F95-A113 PolarHBondContact O-N 3.02Å; T97-A113 HydrophobicContact CG2-CB 3.69Å; T97-A113 PolarHBondContact OG1-N 3.1Å; A113-L131 HydrophobicContact CB-CD2 4.14Å; A113-Y138 HydrophobicContact CB-CD1 4.09Å; A113-Y138 HydrophobicContact CB-CD2 4.07Å; A113-Y138 HydrophobicContact CB-CE1 3.97Å; A113-Y138 HydrophobicContact CB-CE2 3.95Å; A113-Y138 HydrophobicContact CB-CG 4.14Å
114	E	98.3	Very high	96.4	Very high	78 Å²	78	65.4 Å²	65.4	36%	0.364	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.8	-179.1	-72.2	-176.7	-155.6	0	0	110.4	R92 V93 E94	R92-E114 WeakPolarHBondContact CD-OE2 3.37Å; R92-E114 IonicContact NH1-OE2 3.63Å; V93-E114 WeakPolarHBondContact O-CA 3.45Å; E94-E114 HydrophobicContact CB-CG 4.27Å; E94-E114 HydrophobicContact CG-CG 3.99Å
115	V	98.6	Very high	96.2	Very high	16 Å²	16	64.2 Å²	64.2	10%	0.097	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	117	171.9	-175.2	0	0	0	0	108.3	R92 V93 F95 F117 L129 L131 T140	R92-V115 CarbonylContact C-O 3.55Å; R92-V115 WeakPolarHBondContact CA-O 3.37Å; V93-V115 PolarHBondContact N-O 2.91Å; V93-V115 PolarHBondContact O-N 2.84Å; F95-V115 HydrophobicContact CE2-CG2 3.92Å; V115-F117 HydrophobicContact CG1-CD1 4.23Å; V115-L129 HydrophobicContact CB-CD1 4.23Å; V115-L129 HydrophobicContact CG1-CD1 4.12Å; V115-L129 HydrophobicContact CG1-CD2 4.18Å; V115-L131 HydrophobicContact CG2-CD1 4.43Å; V115-T140 HydrophobicContact CG2-CG2 4.2Å; V115-T140 VanDerWaalsContact CG2-OG1 3.29Å; V115-T140 WeakPolarHBondContact CG2-OG1 3.48Å
116	V	98.3	Very high	96	Very high	80 Å²	80	61.5 Å²	61.5	49%	0.485	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.1	179.6	-176.8	0	0	0	0	109.2	W63 V90 Y91 R92	W63-V116 HydrophobicContact CH2-CG1 3.84Å; W63-V116 HydrophobicContact CZ2-CG1 4.31Å; V90-V116 HydrophobicContact CG1-CG1 3.85Å; Y91-V116 VanDerWaalsContact O-CA 3.3Å; Y91-V116 WeakPolarHBondContact O-CA 3.17Å; R92-V116 HydrophobicContact CB-CG2 4.06Å; R92-V116 HydrophobicContact CG-CG2 3.88Å
117	F	97.6	Very high	95.9	Very high	34 Å²	34	59.9 Å²	59.9	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	158.6	-175.1	65.5	-80.2	0	0	0	112.1	L34 F86 V90 Y91 V93 V115 A119 Y127 L129	L34-F117 HydrophobicContact CD1-CZ 4.02Å; F86-F117 HydrophobicContact CZ-CE2 4.09Å; F86-F117 HydrophobicContact CZ-CZ 4.25Å; V90-F117 CarbonylContact C-O 3.57Å; V90-F117 WeakPolarHBondContact CA-O 3.17Å; Y91-F117 PolarHBondContact N-O 3.4Å; Y91-F117 PolarHBondContact O-N 2.78Å; V93-F117 HydrophobicContact CG2-CE1 4.11Å; V115-F117 HydrophobicContact CG1-CD1 4.23Å; F117-A119 HydrophobicContact CD2-CB 4.46Å; F117-A119 HydrophobicContact CE2-CB 4.08Å; F117-Y127 HydrophobicContact CD2-CD1 4.34Å; F117-Y127 HydrophobicContact CD2-CE1 4.33Å; F117-Y127 HydrophobicContact CE2-CD1 4.06Å; F117-Y127 HydrophobicContact CE2-CE1 4.32Å; F117-Y127 HydrophobicContact CE2-CG 4.33Å; F117-L129 HydrophobicContact CE1-CD1 3.9Å; F117-L129 HydrophobicContact CE1-CD2 4.43Å
118	E	97	Very high	95.8	Very high	121 Å²	121	55.4 Å²	55.4	57%	0.565	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.4	172	-171.7	170.8	-166.8	0	0	110	A121	E118-A121 HydrophobicContact CG-CB 4.19Å
119	A	96.5	Very high	95.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	141.4	177.9	0	0	0	0	0	111.1	F86 S88 G89 Y91 F117 A121 Y127	F86-A119 HydrophobicContact CE1-CB 4.02Å; F86-A119 HydrophobicContact CE2-CB 4.09Å; F86-A119 HydrophobicContact CZ-CB 3.57Å; S88-A119 WeakPolarHBondContact CA-O 3.44Å; S88-A119 PolarHBondContact OG-O 2.84Å; S88-A119 VanDerWaalsContact OG-O 3.1Å; G89-A119 PolarHBondContact N-O 2.89Å; G89-A119 VanDerWaalsContact N-O 3.17Å; G89-A119 PolarHBondContact O-N 2.66Å; Y91-A119 HydrophobicContact CD2-CB 3.66Å; Y91-A119 HydrophobicContact CE2-CB 3.71Å; F117-A119 HydrophobicContact CD2-CB 4.46Å; F117-A119 HydrophobicContact CE2-CB 4.08Å; A119-A121 VanDerWaalsContact C-N 3.26Å; A119-A121 PolarHBondContact O-N 2.9Å; A119-Y127 HydrophobicContact CB-CE2 4.34Å
120	H	94.5	Very high	95.8	Very high	17 Å²	17	49.8 Å²	49.8	8%	0.079	27%	0.267	C	S	.	.	S	Bend	trans	58.8	22.5	172	-48.6	-62.6	0	0	0	117.2	F86 E122 G123 H124 R125 Y127	F86-H120 AromaticContact CD1-CE1 3.78Å; F86-H120 AromaticContact CD1-NE2 3.02Å; F86-H120 WeakPolarHBondContact CD1-NE2 3.32Å; F86-H120 AromaticContact CE1-CE1 3.87Å; F86-H120 AromaticContact CE1-NE2 3.33Å; F86-H120 VanDerWaalsContact CE1-NE2 3.33Å; F86-H120 WeakPolarHBondContact CE1-NE2 3.34Å; F86-H120 AromaticContact CG-NE2 3.89Å; F86-H120 PolarHBondContact O-CD2 2.97Å; F86-H120 VanDerWaalsContact O-CD2 3.3Å; F86-H120 PolarHBondContact O-NE2 3.31Å; F86-H120 VanDerWaalsContact O-NE2 3.08Å; H120-E122 PolarHBondContact O-N 3.39Å; H120-G123 WeakPolarHBondContact CA-O 3.35Å; H120-G123 WeakPolarHBondContact CB-O 3.49Å; H120-G123 PolarHBondContact ND1-O 2.78Å; H120-G123 PolarHBondContact O-N 2.82Å; H120-H124 AromaticContact CE1-ND1 3.55Å; H120-H124 AromaticContact ND1-ND1 3.95Å; H120-R125 PolarHBondContact CE1-N 3.4Å; H120-R125 PolarHBondContact CE1-O 3.36Å; H120-R125 PolarHBondContact ND1-N 3.44Å; H120-R125 VanDerWaalsContact ND1-N 3.19Å; H120-Y127 AromaticContact CE1-CE2 3.88Å; H120-Y127 PolarHBondContact N-OH 2.84Å; H120-Y127 AromaticContact ND1-CE2 3.98Å
121	A	90.1	Very high	95.8	Very high	66 Å²	66	47.7 Å²	47.7	55%	0.545	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-31	175.3	0	0	0	0	0	112.8	E118 A119	E118-A121 HydrophobicContact CG-CB 4.19Å; A119-A121 VanDerWaalsContact C-N 3.26Å; A119-A121 PolarHBondContact O-N 2.9Å
122	E	89.1	Confident	95.8	Very high	151 Å²	151	45.6 Å²	45.6	71%	0.706	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.9	35.6	179.6	-63	179.1	-171.3	0	0	111.9	H120 R125	H120-E122 PolarHBondContact O-N 3.39Å; E122-R125 IonicContact OE2-CZ 3.36Å; E122-R125 IonicContact OE2-NH1 2.78Å; E122-R125 IonicContact OE2-NH2 3.31Å; E122-R125 PolarHBondContact OE2-NH2 3.32Å
123	G	89.8	Confident	95.8	Very high	40 Å²	40	43.9 Å²	43.9	41%	0.412	24%	0.239	S	C	.	.	S	Bend	trans	97.1	-177.3	178	0	0	0	0	0	115	H120 R125	H120-G123 WeakPolarHBondContact CA-O 3.35Å; H120-G123 WeakPolarHBondContact CB-O 3.49Å; H120-G123 PolarHBondContact ND1-O 2.78Å; H120-G123 PolarHBondContact O-N 2.82Å; G123-R125 PolarHBondContact O-N 3.08Å
124	H	90.8	Very high	95.8	Very high	89 Å²	89	45.8 Å²	45.8	41%	0.412	25%	0.252	S	S	.	.	S	Bend	trans	-73.1	126.4	-173.5	-166.3	60.3	0	0	0	111.9	D83 H120 A147	D83-H124 IonicContact OD1-CE1 2.65Å; D83-H124 PolarHBondContact OD1-CE1 3.46Å; D83-H124 VanDerWaalsContact OD1-CE1 3.31Å; D83-H124 IonicContact OD1-NE2 3.85Å; D83-H124 PolarHBondContact OD1-NE2 3.05Å; H120-H124 AromaticContact CE1-ND1 3.55Å; H120-H124 AromaticContact ND1-ND1 3.95Å; H124-A147 VanDerWaalsContact CD2-CB 3.44Å; H124-A147 WeakPolarHBondContact CD2-CB 3.34Å
125	R	92.8	Very high	95.8	Very high	55 Å²	55	43.1 Å²	43.1	21%	0.208	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	148.1	-169	-66.7	-173.4	-173.3	-148.6	3.2	110.7	H120 E122 G123 Y127 V144 M145	H120-R125 PolarHBondContact CE1-N 3.4Å; H120-R125 PolarHBondContact CE1-O 3.36Å; H120-R125 PolarHBondContact ND1-N 3.44Å; H120-R125 VanDerWaalsContact ND1-N 3.19Å; E122-R125 IonicContact OE2-CZ 3.36Å; E122-R125 IonicContact OE2-NH1 2.78Å; E122-R125 IonicContact OE2-NH2 3.31Å; E122-R125 PolarHBondContact OE2-NH2 3.32Å; G123-R125 PolarHBondContact O-N 3.08Å; R125-Y127 HydrophobicContact CB-CE2 3.78Å; R125-Y127 WeakPolarHBondContact O-CD2 3.02Å; R125-Y127 VanDerWaalsContact O-CE2 3.25Å; R125-Y127 WeakPolarHBondContact O-CE2 3.31Å; R125-V144 HydrophobicContact CB-CG1 3.86Å; R125-V144 HydrophobicContact CG-CG1 4.23Å; R125-M145 CarbonylContact C-O 3.43Å; R125-M145 WeakPolarHBondContact CA-O 3.37Å; R125-M145 WeakPolarHBondContact CB-O 3.3Å
126	H	93.7	Very high	95.8	Very high	16 Å²	16	49.1 Å²	49.1	7%	0.074	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	143.3	171.3	-60.5	178	0	0	0	109.8	D29 T30 P33 V144 M145	D29-H126 PolarHBondContact O-ND1 2.81Å; T30-H126 PolarHBondContact O-CE1 3.45Å; P33-H126 WeakPolarHBondContact O-CA 3.18Å; H126-V144 WeakPolarHBondContact O-CA 3.27Å; H126-M145 PolarHBondContact N-O 3.19Å; H126-M145 PolarHBondContact O-N 3.3Å
127	Y	96	Very high	95.9	Very high	18 Å²	18	48.3 Å²	48.3	7%	0.071	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.1	-173	-64.1	-100.1	0	0	0	110.3	P33 L34 M35 F86 F117 A119 H120 R125 V144	P33-Y127 PolarHBondContact O-N 2.63Å; L34-Y127 CarbonylContact C-O 3.47Å; L34-Y127 WeakPolarHBondContact CA-O 3.42Å; M35-Y127 PolarHBondContact N-O 2.86Å; F86-Y127 AromaticContact CE1-CD2 3.65Å; F86-Y127 HydrophobicContact CE1-CD2 3.65Å; F86-Y127 AromaticContact CE1-CE2 3.89Å; F86-Y127 HydrophobicContact CE1-CE2 3.89Å; F86-Y127 HydrophobicContact CZ-CD2 4.13Å; F86-Y127 HydrophobicContact CZ-CE2 4.42Å; F117-Y127 HydrophobicContact CD2-CD1 4.34Å; F117-Y127 HydrophobicContact CD2-CE1 4.33Å; F117-Y127 HydrophobicContact CE2-CD1 4.06Å; F117-Y127 HydrophobicContact CE2-CE1 4.32Å; F117-Y127 HydrophobicContact CE2-CG 4.33Å; A119-Y127 HydrophobicContact CB-CE2 4.34Å; H120-Y127 AromaticContact CE1-CE2 3.88Å; H120-Y127 PolarHBondContact N-OH 2.84Å; H120-Y127 AromaticContact ND1-CE2 3.98Å; R125-Y127 HydrophobicContact CB-CE2 3.78Å; R125-Y127 WeakPolarHBondContact O-CD2 3.02Å; R125-Y127 VanDerWaalsContact O-CE2 3.25Å; R125-Y127 WeakPolarHBondContact O-CE2 3.31Å; Y127-V144 HydrophobicContact CD1-CG1 4.07Å; Y127-V144 HydrophobicContact CD1-CG2 3.76Å; Y127-V144 HydrophobicContact CE1-CG1 3.78Å; Y127-V144 HydrophobicContact CE1-CG2 3.93Å
128	T	97.1	Very high	95.9	Very high	21 Å²	21	50.1 Å²	50.1	13%	0.129	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.3	166.8	-62.2	0	0	0	0	108.9	M35 A142 V143	M35-T128 HydrophobicContact CE-CG2 3.41Å; M35-T128 VanDerWaalsContact CE-CG2 3.41Å; M35-T128 WeakPolarHBondContact CE-OG1 3.43Å; M35-T128 WeakPolarHBondContact O-CA 3.33Å; M35-T128 HydrophobicContact SD-CG2 3.66Å; T128-A142 CarbonylContact O-C 3.5Å; T128-A142 WeakPolarHBondContact O-CA 3.36Å; T128-V143 PolarHBondContact N-O 3.18Å; T128-V143 PolarHBondContact O-N 2.86Å
129	L	98.4	Very high	96	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	112.2	172	-56	-176.1	0	0	0	109.4	L34 M35 V36 K37 V93 V115 F117 L131 A142	L34-L129 HydrophobicContact CD1-CD1 4.2Å; L34-L129 HydrophobicContact CD1-CG 4.11Å; M35-L129 PolarHBondContact O-N 3.41Å; V36-L129 CarbonylContact C-O 3.59Å; V36-L129 WeakPolarHBondContact CA-O 3.47Å; V36-L129 HydrophobicContact CG1-CB 4.37Å; K37-L129 PolarHBondContact N-O 2.96Å; V93-L129 HydrophobicContact CB-CD1 3.97Å; V93-L129 HydrophobicContact CG2-CD1 3.64Å; V115-L129 HydrophobicContact CB-CD1 4.23Å; V115-L129 HydrophobicContact CG1-CD1 4.12Å; V115-L129 HydrophobicContact CG1-CD2 4.18Å; F117-L129 HydrophobicContact CE1-CD1 3.9Å; F117-L129 HydrophobicContact CE1-CD2 4.43Å; L129-L131 HydrophobicContact CB-CD1 4.36Å; L129-A142 HydrophobicContact CD2-CB 4.14Å
130	A	98.5	Very high	96.1	Very high	34 Å²	34	50.8 Å²	50.8	28%	0.281	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.5	177.7	0	0	0	0	0	110.4	K37 T140 T141	K37-A130 CarbonylContact O-C 3.35Å; K37-A130 VanDerWaalsContact O-CA 3.3Å; K37-A130 WeakPolarHBondContact O-CA 3.45Å; A130-T140 CarbonylContact O-C 3.58Å; A130-T140 WeakPolarHBondContact O-CA 3.5Å; A130-T141 PolarHBondContact N-O 3.17Å; A130-T141 PolarHBondContact O-N 2.93Å
131	L	98.8	Very high	96.3	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.3	176.9	-79.8	75.8	0	0	0	110.8	K37 I38 L39 F95 A113 V115 L129 L133 T139	K37-L131 PolarHBondContact O-N 2.89Å; I38-L131 WeakPolarHBondContact CA-O 3.37Å; I38-L131 HydrophobicContact CG1-CB 4.38Å; I38-L131 HydrophobicContact CG2-CB 4.05Å; L39-L131 PolarHBondContact N-O 3.17Å; F95-L131 HydrophobicContact CB-CD2 4.46Å; F95-L131 HydrophobicContact CD1-CD2 4.19Å; F95-L131 HydrophobicContact CD2-CD1 4.46Å; F95-L131 HydrophobicContact CD2-CD2 3.58Å; F95-L131 HydrophobicContact CE1-CD1 4.14Å; F95-L131 HydrophobicContact CE1-CD2 4.28Å; F95-L131 HydrophobicContact CE2-CD1 3.75Å; F95-L131 HydrophobicContact CE2-CD2 3.72Å; F95-L131 HydrophobicContact CE2-CG 4.41Å; F95-L131 HydrophobicContact CG-CD2 3.83Å; F95-L131 HydrophobicContact CZ-CD1 3.54Å; F95-L131 HydrophobicContact CZ-CD2 4.06Å; F95-L131 HydrophobicContact CZ-CG 4.49Å; A113-L131 HydrophobicContact CB-CD2 4.14Å; V115-L131 HydrophobicContact CG2-CD1 4.43Å; L129-L131 HydrophobicContact CB-CD1 4.36Å; L131-L133 HydrophobicContact CB-CD2 4.25Å; L131-L133 HydrophobicContact CD2-CD2 4.26Å; L131-T139 CarbonylContact C-O 3.59Å; L131-T139 VanDerWaalsContact CA-O 3.32Å; L131-T139 WeakPolarHBondContact CA-O 3.25Å
132	L	98.9	Very high	96.7	Very high	78 Å²	78	53.4 Å²	53.4	41%	0.408	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	114.1	169.7	-179.1	65.1	0	0	0	108.6	L39 A41 Y138 T139	L39-L132 HydrophobicContact CB-CD1 3.68Å; A41-L132 HydrophobicContact CB-CD1 3.74Å; A41-L132 HydrophobicContact CB-CD2 4.47Å; A41-L132 HydrophobicContact CB-CG 3.99Å; L132-Y138 VanDerWaalsContact O-CA 3.27Å; L132-Y138 WeakPolarHBondContact O-CA 3.16Å; L132-T139 PolarHBondContact N-O 3.18Å; L132-T139 PolarHBondContact O-N 3.49Å
133	L	98.9	Very high	97	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.2	-171.3	-54.6	-174.6	0	0	0	111.8	I38 L39 A41 A47 T97 Y100 W101 L131	I38-L133 HydrophobicContact CG2-CD1 3.54Å; I38-L133 HydrophobicContact CG2-CD2 4.38Å; I38-L133 HydrophobicContact CG2-CG 3.7Å; L39-L133 PolarHBondContact O-N 2.85Å; A41-L133 VanDerWaalsContact CB-O 3.25Å; A41-L133 WeakPolarHBondContact CB-O 3.34Å; A41-L133 PolarHBondContact N-O 2.91Å; A47-L133 HydrophobicContact CB-CD1 4.46Å; T97-L133 HydrophobicContact CG2-CD1 3.92Å; T97-L133 HydrophobicContact CG2-CD2 3.86Å; Y100-L133 HydrophobicContact CD1-CD1 4.23Å; W101-L133 HydrophobicContact CZ2-CB 3.69Å; L131-L133 HydrophobicContact CB-CD2 4.25Å; L131-L133 HydrophobicContact CD2-CD2 4.26Å
134	S	98.8	Very high	97.2	Very high	39 Å²	39	50.9 Å²	50.9	27%	0.273	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.2	159.2	-65.2	0	0	0	0	108.6	A41 W101 F136 S137	A41-S134 WeakPolarHBondContact CB-OG 3.2Å; W101-S134 VanDerWaalsContact CZ2-C 3.44Å; W101-S134 PolarHBondContact NE1-O 3.23Å; S134-F136 PolarHBondContact O-N 2.8Å; S134-F136 VanDerWaalsContact O-N 3.16Å; S134-S137 CarbonylContact C-O 3.57Å; S134-S137 WeakPolarHBondContact CA-O 3.44Å; S134-S137 WeakPolarHBondContact CB-O 3.36Å; S134-S137 PolarHBondContact N-O 3.1Å; S134-S137 PolarHBondContact O-N 3.48Å
135	P	98.6	Very high	97.2	Very high	22 Å²	22	50.7 Å²	50.7	14%	0.143	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.5	-174.2	-24.3	34.7	0	0	0	113.4	V42 W101 T106 P108 F109	V42-P135 HydrophobicContact CG2-CG 4.13Å; W101-P135 HydrophobicContact CD2-CB 4.45Å; W101-P135 HydrophobicContact CD2-CG 4.17Å; W101-P135 HydrophobicContact CE3-CG 4.1Å; W101-P135 HydrophobicContact CH2-CG 4.21Å; W101-P135 HydrophobicContact CZ2-CG 4.27Å; W101-P135 HydrophobicContact CZ3-CG 4.12Å; T106-P135 HydrophobicContact CG2-CB 3.62Å; T106-P135 HydrophobicContact CG2-CG 3.51Å; P108-P135 CarbonylContact C-O 3.34Å; P108-P135 WeakPolarHBondContact CA-O 3.33Å; F109-P135 PolarHBondContact N-O 3.14Å
136	F	98.7	Very high	96.8	Very high	143 Å²	143	52.9 Å²	52.9	63%	0.627	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	8.6	-178.8	-76.2	-106	0	0	0	113.9	T107 F109 S134	T107-F136 WeakPolarHBondContact O-CE2 3.36Å; F109-F136 HydrophobicContact CB-CB 4.31Å; F109-F136 HydrophobicContact CB-CD1 3.59Å; F109-F136 HydrophobicContact CB-CE1 3.94Å; F109-F136 HydrophobicContact CB-CG 3.92Å; F109-F136 HydrophobicContact CD2-CD1 4.02Å; F109-F136 HydrophobicContact CD2-CE1 4.07Å; F109-F136 HydrophobicContact CG-CD1 4.05Å; F109-F136 HydrophobicContact CG-CE1 4.42Å; S134-F136 PolarHBondContact O-N 2.8Å; S134-F136 VanDerWaalsContact O-N 3.16Å
137	S	98.8	Very high	95.7	Very high	63 Å²	63	53.3 Å²	53.3	44%	0.441	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	148.8	-179.1	-177.8	0	0	0	0	110.1	S134	S134-S137 CarbonylContact C-O 3.57Å; S134-S137 WeakPolarHBondContact CA-O 3.44Å; S134-S137 WeakPolarHBondContact CB-O 3.36Å; S134-S137 PolarHBondContact N-O 3.1Å; S134-S137 PolarHBondContact O-N 3.48Å
138	Y	98.8	Very high	94.2	Very high	71 Å²	71	61 Å²	61	28%	0.278	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151	161.8	66.6	-90.4	0	0	0	109.5	H110 A113 L132	H110-Y138 AromaticContact CD2-CE1 3.63Å; H110-Y138 AromaticContact CE1-CD1 3.83Å; H110-Y138 AromaticContact CG-CE1 3.99Å; H110-Y138 AromaticContact ND1-CD1 3.9Å; H110-Y138 AromaticContact NE2-CD1 3.89Å; H110-Y138 AromaticContact NE2-CE1 3.77Å; A113-Y138 HydrophobicContact CB-CD1 4.09Å; A113-Y138 HydrophobicContact CB-CD2 4.07Å; A113-Y138 HydrophobicContact CB-CE1 3.97Å; A113-Y138 HydrophobicContact CB-CE2 3.95Å; A113-Y138 HydrophobicContact CB-CG 4.14Å; L132-Y138 VanDerWaalsContact O-CA 3.27Å; L132-Y138 WeakPolarHBondContact O-CA 3.16Å
139	T	98.8	Very high	91.7	Very high	81 Å²	81	69.8 Å²	69.8	50%	0.497	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.7	169.1	-62.3	0	0	0	0	108.3	L131 L132	L131-T139 CarbonylContact C-O 3.59Å; L131-T139 VanDerWaalsContact CA-O 3.32Å; L131-T139 WeakPolarHBondContact CA-O 3.25Å; L132-T139 PolarHBondContact N-O 3.18Å; L132-T139 PolarHBondContact O-N 3.49Å
140	T	98.8	Very high	91.4	Very high	55 Å²	55	73.2 Å²	73.2	34%	0.337	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.2	171.1	-178.8	0	0	0	0	110	V115 A130	V115-T140 HydrophobicContact CG2-CG2 4.2Å; V115-T140 VanDerWaalsContact CG2-OG1 3.29Å; V115-T140 WeakPolarHBondContact CG2-OG1 3.48Å; A130-T140 CarbonylContact O-C 3.58Å; A130-T140 WeakPolarHBondContact O-CA 3.5Å
141	T	98.4	Very high	91	Very high	82 Å²	82	75.2 Å²	75.2	50%	0.503	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	152.9	174.3	-69.9	0	0	0	0	108.8	A130	A130-T141 PolarHBondContact N-O 3.17Å; A130-T141 PolarHBondContact O-N 2.93Å
142	A	97.8	Very high	90.6	Very high	56 Å²	56	79.2 Å²	79.2	46%	0.463	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.9	173.4	0	0	0	0	0	110.2	T128 L129 V144	T128-A142 CarbonylContact O-C 3.5Å; T128-A142 WeakPolarHBondContact O-CA 3.36Å; L129-A142 HydrophobicContact CD2-CB 4.14Å; A142-V144 HydrophobicContact CB-CG2 4.27Å
143	V	96.4	Very high	90.1	Very high	77 Å²	77	79.2 Å²	79.2	47%	0.467	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.1	161.8	-177.8	0	0	0	0	107	T128 M145	T128-V143 PolarHBondContact N-O 3.18Å; T128-V143 PolarHBondContact O-N 2.86Å; V143-M145 HydrophobicContact CG1-CG 4.43Å
144	V	94.5	Very high	89.6	Confident	61 Å²	61	84.1 Å²	84.1	37%	0.37	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	119.7	-175.3	-170.7	0	0	0	0	109.2	R125 H126 Y127 A142	R125-V144 HydrophobicContact CB-CG1 3.86Å; R125-V144 HydrophobicContact CG-CG1 4.23Å; H126-V144 WeakPolarHBondContact O-CA 3.27Å; Y127-V144 HydrophobicContact CD1-CG1 4.07Å; Y127-V144 HydrophobicContact CD1-CG2 3.76Å; Y127-V144 HydrophobicContact CE1-CG1 3.78Å; Y127-V144 HydrophobicContact CE1-CG2 3.93Å; A142-V144 HydrophobicContact CB-CG2 4.27Å
145	M	89.6	Confident	89	Confident	84 Å²	84	87.1 Å²	87.1	41%	0.414	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	148.2	-178.6	-60.7	-175.1	-67.5	0	0	110	R125 H126 V143	R125-M145 CarbonylContact C-O 3.43Å; R125-M145 WeakPolarHBondContact CA-O 3.37Å; R125-M145 WeakPolarHBondContact CB-O 3.3Å; H126-M145 PolarHBondContact N-O 3.19Å; H126-M145 PolarHBondContact O-N 3.3Å; V143-M145 HydrophobicContact CG1-CG 4.43Å
146	K	85.2	Confident	88.3	Confident	101 Å²	101	91.7 Å²	91.7	44%	0.439	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	142.2	169.8	-61.6	-167.4	-160.2	129.7	0	108.8	H148 E149	K146-H148 PolarHBondContact O-N 2.78Å; K146-H148 VanDerWaalsContact O-N 3.14Å; K146-E149 HydrophobicContact CB-CB 4.44Å; K146-E149 HydrophobicContact CD-CG 4.47Å; K146-E149 WeakPolarHBondContact CD-OE2 3.41Å; K146-E149 IonicContact NZ-OE1 2.73Å; K146-E149 PolarHBondContact NZ-OE1 2.69Å; K146-E149 IonicContact NZ-OE2 3.89Å; K146-E149 PolarHBondContact NZ-OE2 2.73Å
147	A	70.7	Confident	87.5	Confident	26 Å²	26	87.8 Å²	87.8	22%	0.215	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.2	-177.1	0	0	0	0	0	114.6	H124	H124-A147 VanDerWaalsContact CD2-CB 3.44Å; H124-A147 WeakPolarHBondContact CD2-CB 3.34Å
148	H	63	Low	86.5	Confident	178 Å²	178	89.8 Å²	89.8	82%	0.824	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137	25.9	-172.5	-64.7	-47.2	0	0	0	114.5	K146	K146-H148 PolarHBondContact O-N 2.78Å; K146-H148 VanDerWaalsContact O-N 3.14Å
149	E	46.4	Very low	85.4	Confident	206 Å²	206	91.5 Å²	91.5	96%	0.963	50%	0.499	S	S	*	.			trans	-117.5	0	169.1	-81.1	176.5	178.5	0	0	111.1	K146	K146-E149 HydrophobicContact CB-CB 4.44Å; K146-E149 HydrophobicContact CD-CG 4.47Å; K146-E149 WeakPolarHBondContact CD-OE2 3.41Å; K146-E149 IonicContact NZ-OE1 2.73Å; K146-E149 PolarHBondContact NZ-OE1 2.69Å; K146-E149 IonicContact NZ-OE2 3.89Å; K146-E149 PolarHBondContact NZ-OE2 2.73Å

Retrieved 149 of 149 residues in 704.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).