A0A075B5Q5_MOUSE Loading...

Immunoglobulin heavy variable 2-9

AlphaFold DB , UniProt , Accession A0A075B5Q5, Species MOUSE (Mus musculus, Mouse), Gene Ighv2-9, Length 116 aa.

						>A0A075B5Q5_MOUSE|A0A075B5Q5|Ighv2-9
MAVLVLFLCLVAFPSCVLSQVQLKESGPGLVAPSQSLSITCTVSGFSLTSYGVDWVRQPPGKGLEWLGVIWGGGSTNYNSALMSRLSISKDNSKSQVFLKMNSLQTDDTAMYYCAK
					

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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	70.1	Confident	75.2	Confident	205 Å²	205	113 Å²	113	100%	1.01	63%	0.628	S	S	*	*				0	-52.9	0	-126.3	161.9	69.1	0	0	112.5	V3 L4 V5	M1-V3 PolarHBondContact O-N 3.5Å; M1-L4 WeakPolarHBondContact O-CB 3.12Å; M1-L4 PolarHBondContact O-N 3.31Å; M1-L4 VanDerWaalsContact O-N 3.09Å; M1-V5 PolarHBondContact O-N 2.82Å; M1-V5 VanDerWaalsContact O-N 3.13Å
2	A	78.6	Confident	74.4	Confident	80 Å²	80	108.9 Å²	108.9	66%	0.661	62%	0.619	S	S	*	*	H	α-helix	trans	-55.7	-41.4	179.8	0	0	0	0	0	114.6	L4 V5 L6	A2-L4 VanDerWaalsContact C-N 3.34Å; A2-L4 PolarHBondContact O-N 3.34Å; A2-V5 PolarHBondContact O-N 3.09Å; A2-L6 PolarHBondContact O-N 3.45Å
3	V	84.4	Confident	73.6	Confident	102 Å²	102	113.2 Å²	113.2	62%	0.618	63%	0.627	S	S	*	*	H	α-helix	trans	-62.2	-41.2	176.6	-179	0	0	0	0	111.6	M1 V5 L6 F7	M1-V3 PolarHBondContact O-N 3.5Å; V3-V5 PolarHBondContact O-N 2.97Å; V3-L6 PolarHBondContact O-N 3.3Å; V3-F7 HydrophobicContact CG1-CD2 3.83Å; V3-F7 HydrophobicContact CG1-CE2 3.92Å; V3-F7 WeakPolarHBondContact O-CD2 3.37Å; V3-F7 PolarHBondContact O-N 3.25Å
4	L	79.5	Confident	72.8	Confident	124 Å²	124	110.9 Å²	110.9	65%	0.649	62%	0.62	S	S	*	*	H	α-helix	trans	-66.5	-39.4	179.9	-146.7	102.3	0	0	0	111.4	M1 A2 F7 L8	M1-L4 WeakPolarHBondContact O-CB 3.12Å; M1-L4 PolarHBondContact O-N 3.31Å; M1-L4 VanDerWaalsContact O-N 3.09Å; A2-L4 VanDerWaalsContact C-N 3.34Å; A2-L4 PolarHBondContact O-N 3.34Å; L4-F7 PolarHBondContact O-N 2.96Å; L4-L8 HydrophobicContact CD2-CD1 4.4Å; L4-L8 WeakPolarHBondContact O-CB 3.48Å; L4-L8 VanDerWaalsContact O-CG 3.26Å; L4-L8 WeakPolarHBondContact O-CG 3.4Å; L4-L8 PolarHBondContact O-N 2.97Å
5	V	79.4	Confident	72	Confident	82 Å²	82	110.7 Å²	110.7	50%	0.497	63%	0.629	S	S	.	*	H	α-helix	trans	-66.3	-40.9	174.9	177.5	0	0	0	0	111	M1 A2 V3 L8 C9	M1-V5 PolarHBondContact O-N 2.82Å; M1-V5 VanDerWaalsContact O-N 3.13Å; A2-V5 PolarHBondContact O-N 3.09Å; V3-V5 PolarHBondContact O-N 2.97Å; V5-L8 PolarHBondContact O-N 3.23Å; V5-C9 PolarHBondContact O-N 2.76Å; V5-C9 PolarHBondContact O-SG 3.28Å; V5-C9 VanDerWaalsContact O-SG 3.37Å
6	L	75.3	Confident	71.5	Confident	120 Å²	120	111 Å²	111	63%	0.628	64%	0.639	S	S	*	*	H	α-helix	trans	-63.3	-43.2	176.7	-138.1	97.6	0	0	0	111.8	A2 V3 C9 L10	A2-L6 PolarHBondContact O-N 3.45Å; V3-L6 PolarHBondContact O-N 3.3Å; L6-C9 PolarHBondContact O-N 3.03Å; L6-L10 WeakPolarHBondContact O-CG 3.29Å; L6-L10 PolarHBondContact O-N 3.43Å
7	F	76	Confident	71.2	Confident	136 Å²	136	111.6 Å²	111.6	60%	0.596	64%	0.644	S	S	*	*	H	α-helix	trans	-61.9	-44.5	174.3	-94.9	-82.1	0	0	0	111.7	V3 L4 C9 L10 V11	V3-F7 HydrophobicContact CG1-CD2 3.83Å; V3-F7 HydrophobicContact CG1-CE2 3.92Å; V3-F7 WeakPolarHBondContact O-CD2 3.37Å; V3-F7 PolarHBondContact O-N 3.25Å; L4-F7 PolarHBondContact O-N 2.96Å; F7-C9 PolarHBondContact O-N 3.36Å; F7-L10 PolarHBondContact O-N 3.49Å; F7-V11 WeakPolarHBondContact O-CG2 3.43Å; F7-V11 PolarHBondContact O-N 3.14Å; F7-V11 VanDerWaalsContact O-N 3.14Å
8	L	71.1	Confident	71	Confident	102 Å²	102	114.3 Å²	114.3	53%	0.534	66%	0.655	S	S	.	*	H	α-helix	trans	-62.2	-39.4	176.2	-73.5	167.8	0	0	0	112.4	L4 V5 V11 A12	L4-L8 HydrophobicContact CD2-CD1 4.4Å; L4-L8 WeakPolarHBondContact O-CB 3.48Å; L4-L8 VanDerWaalsContact O-CG 3.26Å; L4-L8 WeakPolarHBondContact O-CG 3.4Å; L4-L8 PolarHBondContact O-N 2.97Å; V5-L8 PolarHBondContact O-N 3.23Å; L8-V11 VanDerWaalsContact O-CG2 3.28Å; L8-V11 WeakPolarHBondContact O-CG2 3.4Å; L8-V11 PolarHBondContact O-N 3.27Å; L8-A12 VanDerWaalsContact O-CB 3.25Å; L8-A12 WeakPolarHBondContact O-CB 3.46Å; L8-A12 PolarHBondContact O-N 3Å
9	C	71.5	Confident	71.1	Confident	62 Å²	62	113 Å²	113	42%	0.419	65%	0.654	S	S	.	*	H	α-helix	trans	-62.7	-44.6	172.9	-73.2	0	0	0	0	111.7	V5 L6 F7 V11 A12 F13	V5-C9 PolarHBondContact O-N 2.76Å; V5-C9 PolarHBondContact O-SG 3.28Å; V5-C9 VanDerWaalsContact O-SG 3.37Å; L6-C9 PolarHBondContact O-N 3.03Å; F7-C9 PolarHBondContact O-N 3.36Å; C9-V11 VanDerWaalsContact C-N 3.28Å; C9-V11 PolarHBondContact O-N 3.13Å; C9-A12 PolarHBondContact O-N 2.99Å; C9-F13 VanDerWaalsContact O-CD2 3.29Å; C9-F13 WeakPolarHBondContact O-CD2 3.27Å; C9-F13 PolarHBondContact O-N 3.49Å
10	L	69.6	Low	72	Confident	126 Å²	126	114.6 Å²	114.6	66%	0.66	66%	0.655	S	S	*	*	H	α-helix	trans	-62.9	-32.8	179.5	-72.7	168.8	0	0	0	112.9	L6 F7	L6-L10 WeakPolarHBondContact O-CG 3.29Å; L6-L10 PolarHBondContact O-N 3.43Å; F7-L10 PolarHBondContact O-N 3.49Å
11	V	71.2	Confident	73.1	Confident	104 Å²	104	112.1 Å²	112.1	63%	0.63	64%	0.642	S	S	*	*	H	α-helix	trans	-85.2	-19.5	175.7	-66.3	0	0	0	0	114.4	F7 L8 C9 P14	F7-V11 WeakPolarHBondContact O-CG2 3.43Å; F7-V11 PolarHBondContact O-N 3.14Å; F7-V11 VanDerWaalsContact O-N 3.14Å; L8-V11 VanDerWaalsContact O-CG2 3.28Å; L8-V11 WeakPolarHBondContact O-CG2 3.4Å; L8-V11 PolarHBondContact O-N 3.27Å; C9-V11 VanDerWaalsContact C-N 3.28Å; C9-V11 PolarHBondContact O-N 3.13Å; V11-P14 WeakPolarHBondContact O-CD 3.44Å
12	A	66.3	Low	74.3	Confident	64 Å²	64	106.3 Å²	106.3	53%	0.529	61%	0.612	S	S	.	*	H	α-helix	trans	-83.9	-16.6	-178.1	0	0	0	0	0	114.5	L8 C9 P14	L8-A12 VanDerWaalsContact O-CB 3.25Å; L8-A12 WeakPolarHBondContact O-CB 3.46Å; L8-A12 PolarHBondContact O-N 3Å; C9-A12 PolarHBondContact O-N 2.99Å; A12-P14 VanDerWaalsContact C-CD 3.45Å
13	F	63.4	Low	75.2	Confident	164 Å²	164	105 Å²	105	72%	0.719	59%	0.593	S	S	*	*	S	Bend	trans	-109	20.7	-174.1	-73.6	-75.5	0	0	0	118.5	C9	C9-F13 VanDerWaalsContact O-CD2 3.29Å; C9-F13 WeakPolarHBondContact O-CD2 3.27Å; C9-F13 PolarHBondContact O-N 3.49Å
14	P	63.2	Low	75.9	Confident	82 Å²	82	107.4 Å²	107.4	53%	0.532	60%	0.596	S	S	.	*			trans	-88.9	3.2	172.9	33.8	-31.7	0	0	0	114.3	V11 A12 C16 V17	V11-P14 WeakPolarHBondContact O-CD 3.44Å; A12-P14 VanDerWaalsContact C-CD 3.45Å; P14-C16 PolarHBondContact O-N 3.37Å; P14-C16 VanDerWaalsContact O-N 3.13Å; P14-V17 PolarHBondContact O-N 2.9Å
15	S	60.4	Low	76.8	Confident	108 Å²	108	104.7 Å²	104.7	76%	0.755	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-0.9	-177	39.3	0	0	0	0	115.1
16	C	64.1	Low	77.7	Confident	115 Å²	115	103.6 Å²	103.6	78%	0.777	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	32.6	173.5	-66.8	0	0	0	0	113.1	P14 L18	P14-C16 PolarHBondContact O-N 3.37Å; P14-C16 VanDerWaalsContact O-N 3.13Å; C16-L18 VanDerWaalsContact C-N 3.26Å; C16-L18 PolarHBondContact O-N 3.31Å
17	V	66.7	Low	78.7	Confident	122 Å²	122	100.3 Å²	100.3	74%	0.739	57%	0.571	S	S	*	*			trans	-72.4	91.5	163.6	-177.6	0	0	0	0	107.4	P14 S19	P14-V17 PolarHBondContact O-N 2.9Å; V17-S19 PolarHBondContact O-N 3.02Å
18	L	67	Low	79.5	Confident	159 Å²	159	96.9 Å²	96.9	83%	0.832	56%	0.562	S	S	*	*			trans	-52.8	127.7	161.6	-67.4	173.4	0	0	0	107	C16 Q20	C16-L18 VanDerWaalsContact C-N 3.26Å; C16-L18 PolarHBondContact O-N 3.31Å; L18-Q20 PolarHBondContact O-N 3.37Å
19	S	74	Confident	80.5	Confident	90 Å²	90	95.8 Å²	95.8	63%	0.629	58%	0.575	S	S	*	*			trans	-59.3	114.4	178.8	-166	0	0	0	0	108.7	V17 V21 G45	V17-S19 PolarHBondContact O-N 3.02Å; S19-V21 PolarHBondContact O-N 3.05Å; S19-G45 WeakPolarHBondContact OG-CA 3.33Å
20	Q	89.2	Confident	81.5	Confident	144 Å²	144	101.3 Å²	101.3	67%	0.673	60%	0.6	S	S	*	*			trans	-69.3	128.8	179.8	-170	-179.3	-2.3	0	0	108.9	L18 Q22	L18-Q20 PolarHBondContact O-N 3.37Å; Q20-Q22 VanDerWaalsContact CG-NE2 3.33Å; Q20-Q22 VanDerWaalsContact NE2-NE2 3.17Å; Q20-Q22 PolarHBondContact O-N 3.28Å
21	V	93.8	Very high	82.7	Confident	63 Å²	63	97.3 Å²	97.3	38%	0.382	58%	0.581	S	S	.	*			trans	-66.4	128.8	173.2	173.6	0	0	0	0	109	S19 L23 S44 F46 K116	S19-V21 PolarHBondContact O-N 3.05Å; V21-L23 HydrophobicContact CG1-CD1 3.83Å; V21-S44 WeakPolarHBondContact CA-O 3.41Å; V21-F46 HydrophobicContact CG1-CD1 3.85Å; V21-F46 HydrophobicContact CG1-CE1 3.86Å; V21-F46 HydrophobicContact CG2-CD1 4.26Å; V21-K116 HydrophobicContact CG1-CD 4.2Å
22	Q	96.2	Very high	83.7	Confident	84 Å²	84	94.6 Å²	94.6	39%	0.393	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.1	143.5	173.6	-55.6	-68.1	-26.6	0	0	109.7	Q20 V43 S44	Q20-Q22 VanDerWaalsContact CG-NE2 3.33Å; Q20-Q22 VanDerWaalsContact NE2-NE2 3.17Å; Q20-Q22 PolarHBondContact O-N 3.28Å; Q22-V43 WeakPolarHBondContact O-CA 3.45Å; Q22-S44 WeakPolarHBondContact CB-OG 3.47Å; Q22-S44 PolarHBondContact N-O 2.82Å; Q22-S44 PolarHBondContact O-N 3.21Å
23	L	98	Very high	85	Confident	51 Å²	51	95.5 Å²	95.5	27%	0.267	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.2	127.7	172.6	-62.6	97.9	0	0	0	106.9	V21 V43 C114 K116	V21-L23 HydrophobicContact CG1-CD1 3.83Å; L23-V43 HydrophobicContact CD2-CG1 4.47Å; L23-V43 HydrophobicContact CG-CG1 4.49Å; L23-C114 HydrophobicContact CD2-CB 4.18Å; L23-K116 HydrophobicContact CD2-CB 4.46Å
24	K	98.1	Very high	86.5	Confident	153 Å²	153	92.8 Å²	92.8	67%	0.665	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-130.4	106.9	-178.2	-176.9	179.3	178.9	179.3	0	110.4	C41 T42	K24-C41 WeakPolarHBondContact O-CA 3.42Å; K24-T42 PolarHBondContact N-O 2.8Å; K24-T42 PolarHBondContact O-N 3.43Å
25	E	98.3	Very high	88.1	Confident	68 Å²	68	93.9 Å²	93.9	32%	0.318	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.6	143.1	175.8	-59.6	84.1	169.8	0	0	111.3	I39 T40 W55 Y113 C114	E25-I39 HydrophobicContact CB-CG2 4.45Å; E25-T40 CarbonylContact C-O 3.57Å; E25-T40 WeakPolarHBondContact CA-O 3.42Å; E25-W55 HydrophobicContact CG-CZ3 4.42Å; E25-Y113 WeakPolarHBondContact OE1-CA 3.49Å; E25-C114 PolarHBondContact OE1-N 3.03Å; E25-C114 PolarHBondContact OE1-SG 2.84Å
26	S	97.9	Very high	89.8	Confident	58 Å²	58	91.7 Å²	91.7	41%	0.406	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-150.6	140.9	175.6	55.4	0	0	0	0	109.2	I39 T40	S26-I39 CarbonylContact O-C 3.42Å; S26-I39 WeakPolarHBondContact O-CA 3.5Å; S26-I39 WeakPolarHBondContact O-CG2 3.32Å; S26-T40 PolarHBondContact N-O 2.88Å; S26-T40 PolarHBondContact O-N 3.24Å; S26-T40 PolarHBondContact OG-O 3.02Å
27	G	96.1	Very high	91.3	Very high	51 Å²	51	86.9 Å²	86.9	53%	0.526	52%	0.52	S	S	.	.			trans	-179	179.4	-176.2	0	0	0	0	0	111.1
28	P	93	Very high	92.8	Very high	64 Å²	64	84 Å²	84	42%	0.416	51%	0.505	S	S	.	.			trans	-66.2	142.1	172.2	31.2	-34.9	0	0	0	109.7	V31 L37 S38	P28-V31 HydrophobicContact CB-CG2 3.7Å; P28-V31 HydrophobicContact CG-CG2 3.46Å; P28-V31 VanDerWaalsContact CG-CG2 3.46Å; P28-L37 HydrophobicContact CG-CD1 3.6Å; P28-S38 WeakPolarHBondContact CD-O 3.12Å
29	G	91.8	Very high	94.3	Very high	79 Å²	79	77 Å²	77	81%	0.814	47%	0.469	S	S	*	.	S	Bend	trans	-72.2	-61.2	179.5	0	0	0	0	0	112.7
30	L	92.6	Very high	95.4	Very high	178 Å²	178	74 Å²	74	93%	0.932	45%	0.446	S	S	*	.			trans	-116.5	133.2	177	-66.5	173	0	0	0	109.2
31	V	94.8	Very high	95.9	Very high	43 Å²	43	67.1 Å²	67.1	26%	0.261	41%	0.414	S	S	.	.			trans	-129.4	135.3	177.5	-174.8	0	0	0	0	107.8	P28 Q35 L37 L104	P28-V31 HydrophobicContact CB-CG2 3.7Å; P28-V31 HydrophobicContact CG-CG2 3.46Å; P28-V31 VanDerWaalsContact CG-CG2 3.46Å; V31-Q35 HydrophobicContact CG1-CB 3.68Å; V31-L37 HydrophobicContact CG2-CD1 4.1Å; V31-L104 HydrophobicContact CB-CD1 3.73Å; V31-L104 HydrophobicContact CG1-CD1 3.42Å; V31-L104 VanDerWaalsContact CG1-CD1 3.42Å
32	A	92.7	Very high	96.1	Very high	47 Å²	47	66.4 Å²	66.4	39%	0.388	41%	0.41	S	S	.	.			trans	-71.8	154.2	-178	0	0	0	0	0	111.2	Q35	A32-Q35 HydrophobicContact CB-CG 4.19Å; A32-Q35 VanDerWaalsContact N-OE1 3.16Å; A32-Q35 VanDerWaalsContact O-CB 3.32Å; A32-Q35 WeakPolarHBondContact O-CB 3.34Å; A32-Q35 PolarHBondContact O-N 3.28Å
33	P	93.8	Very high	96.2	Very high	83 Å²	83	62.6 Å²	62.6	54%	0.539	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	153.1	170.4	-25.8	35	0	0	0	112.4	Q35	P33-Q35 PolarHBondContact O-N 2.68Å
34	S	94.6	Very high	96.1	Very high	106 Å²	106	63 Å²	63	74%	0.741	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	-6.8	-175.9	-51.5	0	0	0	0	115.8	L104	S34-L104 PolarHBondContact N-O 3.31Å
35	Q	96.3	Very high	96	Very high	106 Å²	106	57.1 Å²	57.1	50%	0.495	38%	0.382	S	S	.	.	S	Bend	trans	-82.8	-176.6	171.3	-60.2	-174.4	-28.4	0	0	111.1	V31 A32 P33 S103 L104	V31-Q35 HydrophobicContact CG1-CB 3.68Å; A32-Q35 HydrophobicContact CB-CG 4.19Å; A32-Q35 VanDerWaalsContact N-OE1 3.16Å; A32-Q35 VanDerWaalsContact O-CB 3.32Å; A32-Q35 WeakPolarHBondContact O-CB 3.34Å; A32-Q35 PolarHBondContact O-N 3.28Å; P33-Q35 PolarHBondContact O-N 2.68Å; Q35-S103 PolarHBondContact O-N 3.16Å; Q35-L104 WeakPolarHBondContact O-CG 3.46Å; Q35-L104 PolarHBondContact O-N 3.4Å
36	S	96.6	Very high	95.8	Very high	62 Å²	62	55.2 Å²	55.2	43%	0.434	37%	0.373	S	S	.	.			trans	-112.1	135.7	177.2	-55.5	0	0	0	0	111.1	M101 N102	S36-M101 CarbonylContact C-O 3.57Å; S36-M101 WeakPolarHBondContact CA-O 3.04Å; S36-N102 PolarHBondContact OG-OD1 3Å
37	L	96.3	Very high	95.7	Very high	13 Å²	13	55 Å²	55	7%	0.068	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	139.6	171.8	175.9	60.4	0	0	0	109.1	P28 V31 I39 K100 M101 L104 Y112	P28-L37 HydrophobicContact CG-CD1 3.6Å; V31-L37 HydrophobicContact CG2-CD1 4.1Å; L37-I39 HydrophobicContact CD1-CD1 3.98Å; L37-I39 HydrophobicContact CD1-CG1 3.74Å; L37-I39 HydrophobicContact CD2-CD1 3.67Å; L37-I39 HydrophobicContact CD2-CG1 4.27Å; L37-I39 HydrophobicContact CG-CD1 3.87Å; L37-I39 HydrophobicContact CG-CG1 3.89Å; L37-K100 CarbonylContact O-C 3.48Å; L37-K100 VanDerWaalsContact O-CA 3.29Å; L37-K100 WeakPolarHBondContact O-CA 3.28Å; L37-M101 HydrophobicContact CB-CB 4.26Å; L37-M101 PolarHBondContact N-O 3.33Å; L37-M101 PolarHBondContact O-N 3.24Å; L37-L104 HydrophobicContact CB-CD1 3.86Å; L37-L104 HydrophobicContact CB-CD2 3.89Å; L37-L104 HydrophobicContact CB-CG 4.27Å; L37-L104 HydrophobicContact CD2-CD2 4.39Å; L37-Y112 HydrophobicContact CD2-CD2 4.31Å; L37-Y112 HydrophobicContact CD2-CE1 4.23Å; L37-Y112 HydrophobicContact CD2-CE2 3.86Å
38	S	97.6	Very high	95.8	Very high	62 Å²	62	52.9 Å²	52.9	43%	0.434	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	115.1	170.7	-173.3	0	0	0	0	109.2	P28 L99	P28-S38 WeakPolarHBondContact CD-O 3.12Å; S38-L99 WeakPolarHBondContact CA-O 2.92Å
39	I	98.1	Very high	96	Very high	13 Å²	13	53.6 Å²	53.6	7%	0.067	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	142.2	178.9	-57.8	163.8	0	0	0	108.3	E25 S26 L37 W55 F98 L99 Y112	E25-I39 HydrophobicContact CB-CG2 4.45Å; S26-I39 CarbonylContact O-C 3.42Å; S26-I39 WeakPolarHBondContact O-CA 3.5Å; S26-I39 WeakPolarHBondContact O-CG2 3.32Å; L37-I39 HydrophobicContact CD1-CD1 3.98Å; L37-I39 HydrophobicContact CD1-CG1 3.74Å; L37-I39 HydrophobicContact CD2-CD1 3.67Å; L37-I39 HydrophobicContact CD2-CG1 4.27Å; L37-I39 HydrophobicContact CG-CD1 3.87Å; L37-I39 HydrophobicContact CG-CG1 3.89Å; I39-W55 HydrophobicContact CB-CH2 4.23Å; I39-W55 HydrophobicContact CB-CZ3 4.36Å; I39-W55 HydrophobicContact CG2-CH2 3.76Å; I39-W55 HydrophobicContact CG2-CZ3 3.82Å; I39-F98 WeakPolarHBondContact O-CA 3.26Å; I39-L99 PolarHBondContact N-O 2.81Å; I39-L99 PolarHBondContact O-N 2.99Å; I39-Y112 VanDerWaalsContact CD1-CB 3.47Å; I39-Y112 HydrophobicContact CD1-CD1 3.97Å; I39-Y112 HydrophobicContact CD1-CD2 3.96Å; I39-Y112 HydrophobicContact CD1-CG 3.53Å
40	T	98.7	Very high	96.2	Very high	25 Å²	25	53.9 Å²	53.9	15%	0.153	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.6	176.6	-54.6	0	0	0	0	109.3	E25 S26 Q96 V97 F98	E25-T40 CarbonylContact C-O 3.57Å; E25-T40 WeakPolarHBondContact CA-O 3.42Å; S26-T40 PolarHBondContact N-O 2.88Å; S26-T40 PolarHBondContact O-N 3.24Å; S26-T40 PolarHBondContact OG-O 3.02Å; T40-Q96 HydrophobicContact CG2-CB 4.03Å; T40-Q96 HydrophobicContact CG2-CG 3.78Å; T40-V97 CarbonylContact C-O 3.53Å; T40-V97 WeakPolarHBondContact CA-O 3.28Å; T40-F98 HydrophobicContact CG2-CD1 3.86Å; T40-F98 HydrophobicContact CG2-CE1 3.52Å; T40-F98 HydrophobicContact CG2-CZ 4.34Å; T40-F98 WeakPolarHBondContact OG1-CD1 3.16Å; T40-F98 WeakPolarHBondContact OG1-CE1 3.33Å
41	C	98.7	Very high	96.3	Very high	0 Å²	0	51 Å²	51	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.1	167.8	176.6	0	0	0	0	108.9	K24 W55 Q96 V97 C114	K24-C41 WeakPolarHBondContact O-CA 3.42Å; C41-W55 HydrophobicContact CB-CH2 3.51Å; C41-W55 HydrophobicContact CB-CZ2 3.66Å; C41-W55 HydrophobicContact CB-CZ3 4.41Å; C41-Q96 CarbonylContact O-C 3.58Å; C41-Q96 VanDerWaalsContact O-CA 3.31Å; C41-Q96 WeakPolarHBondContact O-CA 3.46Å; C41-V97 HydrophobicContact CB-CB 4.39Å; C41-V97 PolarHBondContact N-O 3.44Å; C41-V97 PolarHBondContact O-N 2.91Å; C41-C114 HydrophobicContact CB-CB 3.45Å; C41-C114 VanDerWaalsContact CB-CB 3.45Å; C41-C114 WeakPolarHBondContact CB-SG 3.18Å; C41-C114 WeakPolarHBondContact SG-CB 3.25Å; C41-C114 CovalentContact SG-SG 2.01Å; C41-C114 PolarHBondContact SG-SG 3.33Å
42	T	98.5	Very high	96.5	Very high	49 Å²	49	49.5 Å²	49.5	30%	0.301	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.3	170.3	-55.8	0	0	0	0	108.8	K24 S95 Q96	K24-T42 PolarHBondContact N-O 2.8Å; K24-T42 PolarHBondContact O-N 3.43Å; T42-S95 WeakPolarHBondContact CA-O 3.29Å; T42-Q96 HydrophobicContact CG2-CG 4.41Å; T42-Q96 PolarHBondContact OG1-NE2 2.84Å
43	V	98	Very high	96.8	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	148.3	-176.8	-55.3	0	0	0	0	112	Q22 L23 F46 L48 V53 S95	Q22-V43 WeakPolarHBondContact O-CA 3.45Å; L23-V43 HydrophobicContact CD2-CG1 4.47Å; L23-V43 HydrophobicContact CG-CG1 4.49Å; V43-F46 HydrophobicContact CB-CE1 3.65Å; V43-F46 HydrophobicContact CB-CE2 4.41Å; V43-F46 HydrophobicContact CB-CZ 3.59Å; V43-F46 HydrophobicContact CG1-CE1 4.1Å; V43-F46 HydrophobicContact CG1-CZ 3.68Å; V43-F46 HydrophobicContact CG2-CE1 4.21Å; V43-F46 HydrophobicContact CG2-CE2 4.23Å; V43-F46 HydrophobicContact CG2-CZ 3.89Å; V43-L48 HydrophobicContact CG1-CD2 4.48Å; V43-L48 HydrophobicContact CG2-CD1 4Å; V43-L48 HydrophobicContact CG2-CD2 3.64Å; V43-L48 HydrophobicContact CG2-CG 3.65Å; V43-V53 HydrophobicContact CG1-CG2 4.31Å; V43-S95 PolarHBondContact N-O 2.89Å; V43-S95 VanDerWaalsContact O-CB 3.26Å; V43-S95 WeakPolarHBondContact O-CB 3.31Å
44	S	96.2	Very high	97	Very high	58 Å²	58	45.1 Å²	45.1	41%	0.406	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	164.9	168.4	70.5	0	0	0	0	111.1	V21 Q22 F46	V21-S44 WeakPolarHBondContact CA-O 3.41Å; Q22-S44 WeakPolarHBondContact CB-OG 3.47Å; Q22-S44 PolarHBondContact N-O 2.82Å; Q22-S44 PolarHBondContact O-N 3.21Å; S44-F46 VanDerWaalsContact C-N 3.29Å; S44-F46 WeakPolarHBondContact O-CD1 3.44Å; S44-F46 PolarHBondContact O-N 2.87Å
45	G	94.8	Very high	97.2	Very high	30 Å²	30	40.1 Å²	40.1	31%	0.309	24%	0.242	S	C	.	.	S	Bend	trans	83.5	-1.3	-177.3	0	0	0	0	0	114.9	S19	S19-G45 WeakPolarHBondContact OG-CA 3.33Å
46	F	94.5	Very high	97.3	Very high	28 Å²	28	36.1 Å²	36.1	12%	0.123	23%	0.225	C	C	.	.	S	Bend	trans	-156.2	164.8	173.4	68	-81.3	0	0	0	111.8	V21 V43 S44 L48 Y51 V53 K116	V21-F46 HydrophobicContact CG1-CD1 3.85Å; V21-F46 HydrophobicContact CG1-CE1 3.86Å; V21-F46 HydrophobicContact CG2-CD1 4.26Å; V43-F46 HydrophobicContact CB-CE1 3.65Å; V43-F46 HydrophobicContact CB-CE2 4.41Å; V43-F46 HydrophobicContact CB-CZ 3.59Å; V43-F46 HydrophobicContact CG1-CE1 4.1Å; V43-F46 HydrophobicContact CG1-CZ 3.68Å; V43-F46 HydrophobicContact CG2-CE1 4.21Å; V43-F46 HydrophobicContact CG2-CE2 4.23Å; V43-F46 HydrophobicContact CG2-CZ 3.89Å; S44-F46 VanDerWaalsContact C-N 3.29Å; S44-F46 WeakPolarHBondContact O-CD1 3.44Å; S44-F46 PolarHBondContact O-N 2.87Å; F46-L48 HydrophobicContact CE2-CD2 4.04Å; F46-Y51 HydrophobicContact CB-CD2 3.91Å; F46-Y51 HydrophobicContact CB-CE2 4.24Å; F46-Y51 AromaticContact CD2-CD2 3.95Å; F46-Y51 HydrophobicContact CD2-CD2 3.95Å; F46-Y51 HydrophobicContact CD2-CG 4.14Å; F46-Y51 HydrophobicContact CG-CD2 4.38Å; F46-V53 HydrophobicContact CE2-CG2 4.01Å; F46-V53 HydrophobicContact CZ-CG2 3.98Å; F46-K116 HydrophobicContact CB-CD 4.34Å; F46-K116 HydrophobicContact CD1-CD 3.6Å; F46-K116 HydrophobicContact CD2-CD 3.89Å; F46-K116 HydrophobicContact CD2-CG 4.45Å; F46-K116 HydrophobicContact CE1-CB 4.31Å; F46-K116 HydrophobicContact CE1-CD 3.68Å; F46-K116 HydrophobicContact CE1-CG 4.29Å; F46-K116 HydrophobicContact CE2-CD 3.95Å; F46-K116 HydrophobicContact CE2-CG 4.09Å; F46-K116 HydrophobicContact CG-CD 3.69Å; F46-K116 HydrophobicContact CZ-CB 4.05Å; F46-K116 HydrophobicContact CZ-CD 3.83Å; F46-K116 HydrophobicContact CZ-CG 3.99Å
47	S	95.9	Very high	97.3	Very high	54 Å²	54	33.6 Å²	33.6	38%	0.378	21%	0.206	S	C	.	.			trans	-95.5	130.3	176.6	-177.8	0	0	0	0	112.3	T49 S50 Y51	S47-T49 PolarHBondContact O-N 2.8Å; S47-T49 PolarHBondContact OG-N 2.78Å; S47-T49 PolarHBondContact OG-OG1 2.69Å; S47-S50 PolarHBondContact O-N 3.39Å; S47-Y51 PolarHBondContact O-N 2.72Å; S47-Y51 VanDerWaalsContact O-N 3.09Å
48	L	97.7	Very high	97.4	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.031	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12	172.1	-71.1	-180	0	0	0	113.9	V43 F46 V53 G72 K90 N92 V97	V43-L48 HydrophobicContact CG1-CD2 4.48Å; V43-L48 HydrophobicContact CG2-CD1 4Å; V43-L48 HydrophobicContact CG2-CD2 3.64Å; V43-L48 HydrophobicContact CG2-CG 3.65Å; F46-L48 HydrophobicContact CE2-CD2 4.04Å; L48-V53 HydrophobicContact CD2-CG2 3.55Å; L48-G72 WeakPolarHBondContact O-CA 3.35Å; L48-K90 PolarHBondContact O-NZ 3.39Å; L48-N92 WeakPolarHBondContact CB-OD1 3.5Å; L48-V97 HydrophobicContact CD1-CG2 3.88Å; L48-V97 HydrophobicContact CD2-CG2 3.6Å; L48-V97 HydrophobicContact CG-CG2 4.42Å
49	T	97.3	Very high	97.4	Very high	80 Å²	80	34.2 Å²	34.2	49%	0.491	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-23.4	171.2	58.5	0	0	0	0	112.4	S47 G72 N92	S47-T49 PolarHBondContact O-N 2.8Å; S47-T49 PolarHBondContact OG-N 2.78Å; S47-T49 PolarHBondContact OG-OG1 2.69Å; T49-G72 CarbonylContact O-C 3.37Å; T49-G72 WeakPolarHBondContact O-CA 3.4Å; T49-N92 WeakPolarHBondContact CG2-ND2 3.43Å
50	S	95.9	Very high	97.3	Very high	84 Å²	84	38.5 Å²	38.5	59%	0.587	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-24.2	-174.5	-54.5	0	0	0	0	113.3	S47	S47-S50 PolarHBondContact O-N 3.39Å
51	Y	96.4	Very high	97.2	Very high	118 Å²	118	41.8 Å²	41.8	46%	0.463	27%	0.27	S	S	.	.	S	Bend	trans	-126.8	150.8	-177.3	-62.6	-83.8	0	0	0	111.7	F46 S47 G72	F46-Y51 HydrophobicContact CB-CD2 3.91Å; F46-Y51 HydrophobicContact CB-CE2 4.24Å; F46-Y51 AromaticContact CD2-CD2 3.95Å; F46-Y51 HydrophobicContact CD2-CD2 3.95Å; F46-Y51 HydrophobicContact CD2-CG 4.14Å; F46-Y51 HydrophobicContact CG-CD2 4.38Å; S47-Y51 PolarHBondContact O-N 2.72Å; S47-Y51 VanDerWaalsContact O-N 3.09Å; Y51-G72 PolarHBondContact O-N 2.78Å
52	G	97.8	Very high	97.1	Very high	11 Å²	11	48.6 Å²	48.6	11%	0.113	30%	0.3	C	S	.	.			trans	-82	164.1	168.6	0	0	0	0	0	112.1	I70	G52-I70 CarbonylContact C-O 3.44Å; G52-I70 WeakPolarHBondContact CA-O 3.37Å
53	V	98.7	Very high	97	Very high	1 Å²	1	49 Å²	49	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	121.9	170	177.2	0	0	0	0	108.5	V43 F46 L48 V69 I70 V97 C114 A115	V43-V53 HydrophobicContact CG1-CG2 4.31Å; F46-V53 HydrophobicContact CE2-CG2 4.01Å; F46-V53 HydrophobicContact CZ-CG2 3.98Å; L48-V53 HydrophobicContact CD2-CG2 3.55Å; V53-V69 WeakPolarHBondContact O-CA 3.19Å; V53-I70 PolarHBondContact N-O 3.01Å; V53-I70 PolarHBondContact O-N 3.43Å; V53-I70 VanDerWaalsContact O-N 3.12Å; V53-V97 HydrophobicContact CB-CB 4.49Å; V53-V97 HydrophobicContact CB-CG1 4.35Å; V53-V97 HydrophobicContact CB-CG2 3.93Å; V53-V97 HydrophobicContact CG1-CB 4.34Å; V53-V97 HydrophobicContact CG1-CG1 4.31Å; V53-V97 HydrophobicContact CG1-CG2 4.21Å; V53-V97 HydrophobicContact CG2-CG2 3.88Å; V53-C114 HydrophobicContact CG1-CB 3.79Å; V53-A115 CarbonylContact C-O 3.59Å; V53-A115 VanDerWaalsContact CA-O 3.32Å; V53-A115 WeakPolarHBondContact CA-O 3.48Å
54	D	98.6	Very high	97	Very high	38 Å²	38	54.5 Å²	54.5	20%	0.203	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	150.5	176	-71.4	-89.3	0	0	0	110.6	W66 G68 V69 C114 A115	D54-W66 PolarHBondContact OD1-NE1 3.04Å; D54-G68 CarbonylContact C-O 3.59Å; D54-G68 WeakPolarHBondContact CA-O 3.29Å; D54-V69 WeakPolarHBondContact OD1-CB 3.44Å; D54-C114 CarbonylContact O-C 3.56Å; D54-C114 VanDerWaalsContact O-CA 3.22Å; D54-C114 WeakPolarHBondContact O-CA 3.42Å; D54-A115 HydrophobicContact CB-CB 4.27Å; D54-A115 PolarHBondContact N-O 3.31Å; D54-A115 PolarHBondContact O-N 3.08Å
55	W	98.7	Very high	97	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.6	167.4	-74.6	100.8	0	0	0	109.6	E25 I39 C41 L67 G68 V97 L99 C114	E25-W55 HydrophobicContact CG-CZ3 4.42Å; I39-W55 HydrophobicContact CB-CH2 4.23Å; I39-W55 HydrophobicContact CB-CZ3 4.36Å; I39-W55 HydrophobicContact CG2-CH2 3.76Å; I39-W55 HydrophobicContact CG2-CZ3 3.82Å; C41-W55 HydrophobicContact CB-CH2 3.51Å; C41-W55 HydrophobicContact CB-CZ2 3.66Å; C41-W55 HydrophobicContact CB-CZ3 4.41Å; W55-L67 HydrophobicContact CB-CB 4.09Å; W55-L67 HydrophobicContact CB-CD1 4.32Å; W55-L67 WeakPolarHBondContact O-CB 2.95Å; W55-L67 PolarHBondContact O-N 3.22Å; W55-G68 PolarHBondContact N-O 3.47Å; W55-V97 HydrophobicContact CZ2-CG1 4.28Å; W55-L99 HydrophobicContact CB-CD1 4.31Å; W55-L99 HydrophobicContact CB-CD2 4.18Å; W55-L99 HydrophobicContact CD2-CB 3.62Å; W55-L99 HydrophobicContact CD2-CD2 3.92Å; W55-L99 HydrophobicContact CD2-CG 4.24Å; W55-L99 VanDerWaalsContact CE2-CB 3.48Å; W55-L99 HydrophobicContact CE3-CB 4.07Å; W55-L99 HydrophobicContact CE3-CD2 3.89Å; W55-L99 HydrophobicContact CG-CB 4Å; W55-L99 HydrophobicContact CG-CD1 4.09Å; W55-L99 HydrophobicContact CG-CD2 4.06Å; W55-L99 HydrophobicContact CG-CG 4.28Å; W55-L99 HydrophobicContact CH2-CB 4.21Å; W55-L99 HydrophobicContact CZ2-CB 3.79Å; W55-L99 HydrophobicContact CZ3-CB 4.35Å; W55-C114 HydrophobicContact CD2-CB 4.37Å; W55-C114 HydrophobicContact CE3-CB 4.1Å; W55-C114 HydrophobicContact CH2-CB 4.16Å; W55-C114 HydrophobicContact CZ2-CB 4.39Å; W55-C114 HydrophobicContact CZ3-CB 3.99Å
56	V	98.3	Very high	97.2	Very high	23 Å²	23	57.4 Å²	57.4	14%	0.139	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	143.9	-179.2	-176.4	0	0	0	0	108	L64 E65 Y113	V56-L64 HydrophobicContact CG1-CB 3.75Å; V56-L64 HydrophobicContact CG1-CD1 4.45Å; V56-L64 HydrophobicContact CG1-CD2 3.91Å; V56-L64 HydrophobicContact CG1-CG 4.24Å; V56-E65 WeakPolarHBondContact CA-O 3.42Å; V56-E65 WeakPolarHBondContact CG1-O 3.47Å; V56-Y113 PolarHBondContact N-O 2.85Å; V56-Y113 PolarHBondContact O-N 3.24Å; V56-Y113 VanDerWaalsContact O-O 3.13Å
57	R	97.2	Very high	97.4	Very high	8 Å²	8	56.1 Å²	56.1	3%	0.03	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	155.4	169.4	71.5	175.7	-179.8	-172.9	1.9	111.9	L64 E65 L67 D108 A110 M111 Y112	R57-L64 WeakPolarHBondContact O-CA 3.48Å; R57-E65 HydrophobicContact CG-CB 4.04Å; R57-E65 IonicContact CZ-OE2 2.68Å; R57-E65 PolarHBondContact N-O 3.46Å; R57-E65 IonicContact NE-OE2 3.38Å; R57-E65 PolarHBondContact NE-OE2 3.13Å; R57-E65 IonicContact NH2-OE1 2.72Å; R57-E65 PolarHBondContact NH2-OE1 2.94Å; R57-E65 IonicContact NH2-OE2 3.24Å; R57-E65 PolarHBondContact NH2-OE2 2.8Å; R57-E65 PolarHBondContact O-N 2.85Å; R57-L67 HydrophobicContact CB-CD1 4.15Å; R57-L67 HydrophobicContact CB-CG 4.48Å; R57-L67 HydrophobicContact CG-CD1 4.36Å; R57-L67 HydrophobicContact CG-CD2 3.88Å; R57-L67 HydrophobicContact CG-CG 4.28Å; R57-D108 IonicContact CZ-OD1 3.64Å; R57-D108 IonicContact NH1-OD1 3.57Å; R57-D108 PolarHBondContact NH1-OD1 3.21Å; R57-A110 HydrophobicContact CB-CB 3.84Å; R57-A110 HydrophobicContact CG-CB 4.19Å; R57-M111 CarbonylContact C-O 3.48Å; R57-M111 WeakPolarHBondContact CA-O 3.41Å; R57-Y112 HydrophobicContact CB-CD1 3.88Å; R57-Y112 HydrophobicContact CB-CE1 3.89Å; R57-Y112 HydrophobicContact CB-CG 4.28Å
58	Q	97.8	Very high	97.5	Very high	79 Å²	79	53.5 Å²	53.5	37%	0.369	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	98.1	174.9	-166.3	177.5	19	0	0	109.8	L64 A110 M111 Y113	Q58-L64 HydrophobicContact CB-CD2 3.85Å; Q58-L64 HydrophobicContact CG-CD2 4.05Å; Q58-A110 WeakPolarHBondContact O-CA 3.44Å; Q58-A110 WeakPolarHBondContact O-CB 3.36Å; Q58-M111 PolarHBondContact N-O 3.41Å; Q58-M111 PolarHBondContact O-N 3.09Å; Q58-Y113 HydrophobicContact CB-CE2 3.96Å
59	P	96.8	Very high	97.5	Very high	10 Å²	10	53.3 Å²	53.3	7%	0.065	31%	0.312	C	S	.	.			trans	-65.8	149.2	172.5	-17.4	30.7	0	0	0	111.1	G61 K62 A110	P59-G61 PolarHBondContact O-N 2.76Å; P59-K62 HydrophobicContact CB-CB 4.05Å; P59-K62 HydrophobicContact CB-CD 3.99Å; P59-K62 HydrophobicContact CB-CG 4.22Å; P59-K62 HydrophobicContact CG-CB 4.31Å; P59-K62 HydrophobicContact CG-CD 4.31Å; P59-K62 PolarHBondContact O-N 3.24Å; P59-A110 HydrophobicContact CB-CB 4.42Å; P59-A110 HydrophobicContact CG-CB 4.27Å
60	P	96.3	Very high	97.6	Very high	103 Å²	103	49.9 Å²	49.9	67%	0.669	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	127.5	177.7	-25.2	33.2	0	0	0	112.1	K62 T109	P60-K62 PolarHBondContact O-N 2.88Å; P60-T109 WeakPolarHBondContact CD-O 3.46Å
61	G	97.3	Very high	97.7	Very high	93 Å²	93	51.3 Å²	51.3	96%	0.959	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	9.1	179.7	0	0	0	0	0	115.1	P59	P59-G61 PolarHBondContact O-N 2.76Å
62	K	96.3	Very high	97.8	Very high	144 Å²	144	46.4 Å²	46.4	63%	0.626	27%	0.268	S	S	*	.	S	Bend	trans	-118.3	168.1	176.7	-58.8	-170.7	-175.1	174.4	0	111.4	P59 P60	P59-K62 HydrophobicContact CB-CB 4.05Å; P59-K62 HydrophobicContact CB-CD 3.99Å; P59-K62 HydrophobicContact CB-CG 4.22Å; P59-K62 HydrophobicContact CG-CB 4.31Å; P59-K62 HydrophobicContact CG-CD 4.31Å; P59-K62 PolarHBondContact O-N 3.24Å; P60-K62 PolarHBondContact O-N 2.88Å
63	G	96.4	Very high	97.8	Very high	56 Å²	56	49.8 Å²	49.8	58%	0.577	30%	0.303	S	S	*	.			trans	-72.4	178.7	172.7	0	0	0	0	0	113
64	L	97.5	Very high	97.7	Very high	120 Å²	120	51.4 Å²	51.4	63%	0.628	32%	0.32	S	S	*	.			trans	-67.9	137.1	171.9	-64.6	177.3	0	0	0	110.6	V56 R57 Q58	V56-L64 HydrophobicContact CG1-CB 3.75Å; V56-L64 HydrophobicContact CG1-CD1 4.45Å; V56-L64 HydrophobicContact CG1-CD2 3.91Å; V56-L64 HydrophobicContact CG1-CG 4.24Å; R57-L64 WeakPolarHBondContact O-CA 3.48Å; Q58-L64 HydrophobicContact CB-CD2 3.85Å; Q58-L64 HydrophobicContact CG-CD2 4.05Å
65	E	97.6	Very high	97.7	Very high	55 Å²	55	53 Å²	53	26%	0.257	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.4	174.7	-176.8	-178.8	-172.6	0	0	109.2	V56 R57	V56-E65 WeakPolarHBondContact CA-O 3.42Å; V56-E65 WeakPolarHBondContact CG1-O 3.47Å; R57-E65 HydrophobicContact CG-CB 4.04Å; R57-E65 IonicContact CZ-OE2 2.68Å; R57-E65 PolarHBondContact N-O 3.46Å; R57-E65 IonicContact NE-OE2 3.38Å; R57-E65 PolarHBondContact NE-OE2 3.13Å; R57-E65 IonicContact NH2-OE1 2.72Å; R57-E65 PolarHBondContact NH2-OE1 2.94Å; R57-E65 IonicContact NH2-OE2 3.24Å; R57-E65 PolarHBondContact NH2-OE2 2.8Å; R57-E65 PolarHBondContact O-N 2.85Å
66	W	98.2	Very high	97.7	Very high	95 Å²	95	55.2 Å²	55.2	36%	0.36	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	135.3	176.1	-178.5	81.5	0	0	0	110.7	D54 V69 N77 N79	D54-W66 PolarHBondContact OD1-NE1 3.04Å; W66-V69 HydrophobicContact CZ2-CB 4.16Å; W66-V69 HydrophobicContact CZ2-CG1 3.96Å; W66-N77 HydrophobicContact CH2-CB 4.05Å; W66-N79 HydrophobicContact CE3-CB 3.96Å; W66-N79 HydrophobicContact CZ3-CB 4.16Å; W66-N79 VanDerWaalsContact CZ3-N 3.27Å; W66-N79 VanDerWaalsContact O-CB 3.32Å; W66-N79 WeakPolarHBondContact O-CB 3.22Å; W66-N79 PolarHBondContact O-ND2 2.92Å
67	L	98.2	Very high	97.7	Very high	0 Å²	0	58 Å²	58	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-42	-177.6	-60.3	-178	0	0	0	112.3	W55 R57 N79 L82 L86 L99 Y112	W55-L67 HydrophobicContact CB-CB 4.09Å; W55-L67 HydrophobicContact CB-CD1 4.32Å; W55-L67 WeakPolarHBondContact O-CB 2.95Å; W55-L67 PolarHBondContact O-N 3.22Å; R57-L67 HydrophobicContact CB-CD1 4.15Å; R57-L67 HydrophobicContact CB-CG 4.48Å; R57-L67 HydrophobicContact CG-CD1 4.36Å; R57-L67 HydrophobicContact CG-CD2 3.88Å; R57-L67 HydrophobicContact CG-CG 4.28Å; L67-N79 WeakPolarHBondContact O-CB 3.38Å; L67-N79 PolarHBondContact O-N 2.01Å; L67-L82 HydrophobicContact CD2-CD1 3.32Å; L67-L86 HydrophobicContact CB-CD1 3.94Å; L67-L86 WeakPolarHBondContact O-CD1 3.32Å; L67-L99 HydrophobicContact CD1-CD2 3.73Å; L67-Y112 HydrophobicContact CD1-CD1 3.75Å; L67-Y112 HydrophobicContact CD1-CE1 3.63Å
68	G	98.4	Very high	97.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.7	174.5	-175.3	0	0	0	0	0	112.2	D54 W55 N77 I88	D54-G68 CarbonylContact C-O 3.59Å; D54-G68 WeakPolarHBondContact CA-O 3.29Å; W55-G68 PolarHBondContact N-O 3.47Å; G68-N77 CarbonylContact C-O 3.52Å; G68-N77 WeakPolarHBondContact CA-O 2.99Å; G68-I88 VanDerWaalsContact C-CD1 3.49Å
69	V	98.6	Very high	97.7	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.6	-179.3	64.7	0	0	0	0	109.6	V53 D54 W66 W71 T76 N77	V53-V69 WeakPolarHBondContact O-CA 3.19Å; D54-V69 WeakPolarHBondContact OD1-CB 3.44Å; W66-V69 HydrophobicContact CZ2-CB 4.16Å; W66-V69 HydrophobicContact CZ2-CG1 3.96Å; V69-W71 HydrophobicContact CG1-CD2 4.35Å; V69-W71 HydrophobicContact CG1-CZ2 3.74Å; V69-W71 HydrophobicContact CG2-CD2 4.3Å; V69-W71 HydrophobicContact CG2-CE3 4.41Å; V69-W71 HydrophobicContact CG2-CZ2 4.44Å; V69-T76 WeakPolarHBondContact O-CA 3.35Å; V69-N77 HydrophobicContact CG1-CB 3.89Å; V69-N77 PolarHBondContact N-O 2.99Å; V69-N77 PolarHBondContact O-N 3.41Å
70	I	98.8	Very high	97.7	Very high	9 Å²	9	63 Å²	63	5%	0.046	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.4	160.8	-172.5	163.4	0	0	0	109.2	G52 V53 S75 T76 I88 K90 V97	G52-I70 CarbonylContact C-O 3.44Å; G52-I70 WeakPolarHBondContact CA-O 3.37Å; V53-I70 PolarHBondContact N-O 3.01Å; V53-I70 PolarHBondContact O-N 3.43Å; V53-I70 VanDerWaalsContact O-N 3.12Å; I70-S75 WeakPolarHBondContact CA-O 3.37Å; I70-T76 HydrophobicContact CB-CG2 4.04Å; I70-T76 HydrophobicContact CD1-CG2 4.05Å; I70-T76 HydrophobicContact CG1-CG2 3.9Å; I70-I88 HydrophobicContact CB-CG2 3.68Å; I70-I88 HydrophobicContact CG2-CG2 3.65Å; I70-K90 HydrophobicContact CD1-CB 4.06Å; I70-K90 HydrophobicContact CD1-CD 3.86Å; I70-K90 HydrophobicContact CD1-CG 3.71Å; I70-K90 HydrophobicContact CG1-CD 4.06Å; I70-K90 HydrophobicContact CG1-CG 4.46Å; I70-K90 HydrophobicContact CG2-CB 4.5Å; I70-K90 HydrophobicContact CG2-CD 4.42Å; I70-V97 HydrophobicContact CG2-CG1 3.66Å
71	W	98.5	Very high	97.7	Very high	113 Å²	113	61.8 Å²	61.8	43%	0.428	40%	0.395	S	S	.	.			trans	-78.8	165.8	-176.8	-62.7	105.4	0	0	0	112.1	V69 G73 G74 S75 N77 K90	V69-W71 HydrophobicContact CG1-CD2 4.35Å; V69-W71 HydrophobicContact CG1-CZ2 3.74Å; V69-W71 HydrophobicContact CG2-CD2 4.3Å; V69-W71 HydrophobicContact CG2-CE3 4.41Å; V69-W71 HydrophobicContact CG2-CZ2 4.44Å; W71-G73 PolarHBondContact O-N 2.85Å; W71-G74 WeakPolarHBondContact O-CA 3.45Å; W71-G74 PolarHBondContact O-N 2.86Å; W71-S75 VanDerWaalsContact CD1-O 3.29Å; W71-S75 VanDerWaalsContact CD1-OG 3.27Å; W71-S75 PolarHBondContact N-O 3.33Å; W71-N77 PolarHBondContact NE1-ND2 3.5Å; W71-K90 PolarHBondContact O-NZ 3.11Å
72	G	97.8	Very high	97.5	Very high	15 Å²	15	57.8 Å²	57.8	16%	0.155	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-40.2	174.5	0	0	0	0	0	113.2	L48 T49 Y51 G74 K90	L48-G72 WeakPolarHBondContact O-CA 3.35Å; T49-G72 CarbonylContact O-C 3.37Å; T49-G72 WeakPolarHBondContact O-CA 3.4Å; Y51-G72 PolarHBondContact O-N 2.78Å; G72-G74 VanDerWaalsContact C-N 3.25Å; G72-G74 PolarHBondContact O-N 2.9Å; G72-K90 VanDerWaalsContact C-NZ 3.33Å; G72-K90 PolarHBondContact O-NZ 3.36Å
73	G	97.4	Very high	97.4	Very high	82 Å²	82	56.3 Å²	56.3	85%	0.845	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-7.2	175	0	0	0	0	0	115.6	W71	W71-G73 PolarHBondContact O-N 2.85Å
74	G	97.8	Very high	97.5	Very high	35 Å²	35	59 Å²	59	36%	0.361	36%	0.358	S	S	.	.	S	Bend	trans	92.9	-4.9	177.5	0	0	0	0	0	115.6	W71 G72	W71-G74 WeakPolarHBondContact O-CA 3.45Å; W71-G74 PolarHBondContact O-N 2.86Å; G72-G74 VanDerWaalsContact C-N 3.25Å; G72-G74 PolarHBondContact O-N 2.9Å
75	S	98.2	Very high	97.4	Very high	72 Å²	72	54.6 Å²	54.6	50%	0.503	33%	0.333	S	S	.	.			trans	-66.5	151.2	169.9	52.9	0	0	0	0	111.2	I70 W71	I70-S75 WeakPolarHBondContact CA-O 3.37Å; W71-S75 VanDerWaalsContact CD1-O 3.29Å; W71-S75 VanDerWaalsContact CD1-OG 3.27Å; W71-S75 PolarHBondContact N-O 3.33Å
76	T	98.5	Very high	97.4	Very high	47 Å²	47	52.6 Å²	52.6	29%	0.288	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.5	-178.8	55.4	0	0	0	0	111.5	V69 I70 Y78 I88	V69-T76 WeakPolarHBondContact O-CA 3.35Å; I70-T76 HydrophobicContact CB-CG2 4.04Å; I70-T76 HydrophobicContact CD1-CG2 4.05Å; I70-T76 HydrophobicContact CG1-CG2 3.9Å; T76-Y78 VanDerWaalsContact OG1-CE2 3.27Å; T76-Y78 WeakPolarHBondContact OG1-CE2 3.37Å; T76-Y78 PolarHBondContact OG1-OH 3.38Å; T76-I88 HydrophobicContact CG2-CB 4.5Å
77	N	98.2	Very high	97.4	Very high	82 Å²	82	50.7 Å²	50.7	44%	0.439	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	149.3	165.1	-60	-33	0	0	0	109.3	W66 G68 V69 W71	W66-N77 HydrophobicContact CH2-CB 4.05Å; G68-N77 CarbonylContact C-O 3.52Å; G68-N77 WeakPolarHBondContact CA-O 2.99Å; V69-N77 HydrophobicContact CG1-CB 3.89Å; V69-N77 PolarHBondContact N-O 2.99Å; V69-N77 PolarHBondContact O-N 3.41Å; W71-N77 PolarHBondContact NE1-ND2 3.5Å
78	Y	98.4	Very high	97.4	Very high	58 Å²	58	51.1 Å²	51.1	23%	0.227	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	154.2	-176.9	-60.2	-81.9	0	0	0	110.9	T76 S80 M83 L86 I88	T76-Y78 VanDerWaalsContact OG1-CE2 3.27Å; T76-Y78 WeakPolarHBondContact OG1-CE2 3.37Å; T76-Y78 PolarHBondContact OG1-OH 3.38Å; Y78-S80 PolarHBondContact O-N 2.95Å; Y78-M83 HydrophobicContact CD2-CG 4.16Å; Y78-M83 HydrophobicContact CG-CG 4.21Å; Y78-L86 HydrophobicContact CD1-CB 3.84Å; Y78-L86 HydrophobicContact CD1-CD1 4.34Å; Y78-L86 HydrophobicContact CE1-CB 4.12Å; Y78-I88 HydrophobicContact CD1-CD1 4.05Å; Y78-I88 HydrophobicContact CE1-CB 4.2Å; Y78-I88 HydrophobicContact CE1-CD1 3.76Å; Y78-I88 HydrophobicContact CE1-CG1 3.83Å; Y78-I88 PolarHBondContact OH-N 3.27Å
79	N	97.4	Very high	97.4	Very high	32 Å²	32	53.8 Å²	53.8	17%	0.171	35%	0.347	C	S	.	.			trans	-64.1	121.9	163.1	-177.8	-29.2	0	0	0	108.7	W66 L67 A81 L82 M83	W66-N79 HydrophobicContact CE3-CB 3.96Å; W66-N79 HydrophobicContact CZ3-CB 4.16Å; W66-N79 VanDerWaalsContact CZ3-N 3.27Å; W66-N79 VanDerWaalsContact O-CB 3.32Å; W66-N79 WeakPolarHBondContact O-CB 3.22Å; W66-N79 PolarHBondContact O-ND2 2.92Å; L67-N79 WeakPolarHBondContact O-CB 3.38Å; L67-N79 PolarHBondContact O-N 2.01Å; N79-A81 PolarHBondContact O-N 3Å; N79-A81 VanDerWaalsContact O-N 3.16Å; N79-A81 WeakPolarHBondContact OD1-CB 3.32Å; N79-A81 PolarHBondContact OD1-N 3.27Å; N79-L82 PolarHBondContact O-N 3.42Å; N79-M83 PolarHBondContact O-N 2.85Å
80	S	96.4	Very high	97.4	Very high	111 Å²	111	55.9 Å²	55.9	78%	0.776	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.8	-175.1	54.3	0	0	0	0	113.2	Y78 L82	Y78-S80 PolarHBondContact O-N 2.95Å; S80-L82 VanDerWaalsContact C-N 3.28Å; S80-L82 PolarHBondContact O-N 2.81Å
81	A	95.1	Very high	97.4	Very high	77 Å²	77	57.4 Å²	57.4	64%	0.636	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-24.5	178.4	0	0	0	0	0	113.3	N79	N79-A81 PolarHBondContact O-N 3Å; N79-A81 VanDerWaalsContact O-N 3.16Å; N79-A81 WeakPolarHBondContact OD1-CB 3.32Å; N79-A81 PolarHBondContact OD1-N 3.27Å
82	L	94.6	Very high	97.3	Very high	9 Å²	9	55.6 Å²	55.6	5%	0.047	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-9.1	-173.7	-61.7	175.8	0	0	0	113.2	L67 N79 S80 S84 R85 L86	L67-L82 HydrophobicContact CD2-CD1 3.32Å; N79-L82 PolarHBondContact O-N 3.42Å; S80-L82 VanDerWaalsContact C-N 3.28Å; S80-L82 PolarHBondContact O-N 2.81Å; L82-S84 PolarHBondContact O-N 2.77Å; L82-R85 PolarHBondContact O-N 2.86Å; L82-L86 HydrophobicContact CB-CD1 3.62Å; L82-L86 HydrophobicContact CB-CG 3.88Å; L82-L86 HydrophobicContact CD1-CD1 4.49Å; L82-L86 WeakPolarHBondContact O-CG 3.44Å; L82-L86 PolarHBondContact O-N 3.03Å
83	M	94.7	Very high	97.3	Very high	114 Å²	114	59.8 Å²	59.8	56%	0.562	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-37.5	-172.5	-174.9	179.8	79.3	0	0	114	Y78 N79 R85	Y78-M83 HydrophobicContact CD2-CG 4.16Å; Y78-M83 HydrophobicContact CG-CG 4.21Å; N79-M83 PolarHBondContact O-N 2.85Å; M83-R85 PolarHBondContact O-N 2.79Å
84	S	96.4	Very high	97.3	Very high	113 Å²	113	61.8 Å²	61.8	79%	0.79	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.7	-179.4	59.1	0	0	0	0	114.1	L82	L82-S84 PolarHBondContact O-N 2.77Å
85	R	96.4	Very high	97.3	Very high	26 Å²	26	62.4 Å²	62.4	10%	0.098	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-17.1	-176.9	-58.5	-166.5	-62.5	114.8	-9.1	113.2	L82 M83 M101 N102 S103 Q105 D108	L82-R85 PolarHBondContact O-N 2.86Å; M83-R85 PolarHBondContact O-N 2.79Å; R85-M101 CarbonylContact O-C 3.52Å; R85-M101 WeakPolarHBondContact O-CA 3.46Å; R85-N102 PolarHBondContact O-N 3.42Å; R85-S103 PolarHBondContact NH1-O 2.86Å; R85-Q105 VanDerWaalsContact NH2-OE1 3.09Å; R85-D108 IonicContact CZ-OD1 3.79Å; R85-D108 IonicContact CZ-OD2 3.16Å; R85-D108 IonicContact NH1-OD1 2.69Å; R85-D108 IonicContact NH1-OD2 2.78Å; R85-D108 PolarHBondContact NH1-OD2 2.74Å; R85-D108 IonicContact NH2-OD1 3.4Å; R85-D108 PolarHBondContact NH2-OD1 3.22Å; R85-D108 IonicContact NH2-OD2 3.39Å; R85-D108 PolarHBondContact NH2-OD2 2.76Å
86	L	97.4	Very high	97.3	Very high	13 Å²	13	61.2 Å²	61.2	7%	0.068	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	146	-175.7	-64	-176.8	0	0	0	112.9	L67 Y78 L82 L99 K100 M101	L67-L86 HydrophobicContact CB-CD1 3.94Å; L67-L86 WeakPolarHBondContact O-CD1 3.32Å; Y78-L86 HydrophobicContact CD1-CB 3.84Å; Y78-L86 HydrophobicContact CD1-CD1 4.34Å; Y78-L86 HydrophobicContact CE1-CB 4.12Å; L82-L86 HydrophobicContact CB-CD1 3.62Å; L82-L86 HydrophobicContact CB-CG 3.88Å; L82-L86 HydrophobicContact CD1-CD1 4.49Å; L82-L86 WeakPolarHBondContact O-CG 3.44Å; L82-L86 PolarHBondContact O-N 3.03Å; L86-L99 HydrophobicContact CD2-CD1 4.18Å; L86-K100 CarbonylContact C-O 3.5Å; L86-K100 WeakPolarHBondContact CA-O 3.41Å; L86-M101 HydrophobicContact CD2-CB 4.27Å; L86-M101 HydrophobicContact CD2-CE 3.55Å; L86-M101 HydrophobicContact CD2-CG 3.38Å; L86-M101 HydrophobicContact CD2-SD 3.59Å; L86-M101 VanDerWaalsContact CD2-SD 3.59Å
87	S	98.2	Very high	97.4	Very high	56 Å²	56	59 Å²	59	39%	0.392	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	129.2	164.6	179.5	0	0	0	0	109	K100	S87-K100 PolarHBondContact N-O 2.84Å; S87-K100 PolarHBondContact O-N 2.86Å
88	I	98.5	Very high	97.4	Very high	8 Å²	8	57.2 Å²	57.2	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134	177.3	-59.5	163	0	0	0	108.5	G68 I70 T76 Y78 V97 F98 L99	G68-I88 VanDerWaalsContact C-CD1 3.49Å; I70-I88 HydrophobicContact CB-CG2 3.68Å; I70-I88 HydrophobicContact CG2-CG2 3.65Å; T76-I88 HydrophobicContact CG2-CB 4.5Å; Y78-I88 HydrophobicContact CD1-CD1 4.05Å; Y78-I88 HydrophobicContact CE1-CB 4.2Å; Y78-I88 HydrophobicContact CE1-CD1 3.76Å; Y78-I88 HydrophobicContact CE1-CG1 3.83Å; Y78-I88 PolarHBondContact OH-N 3.27Å; I88-V97 HydrophobicContact CG2-CG1 4.11Å; I88-F98 VanDerWaalsContact CA-O 3.31Å; I88-F98 WeakPolarHBondContact CA-O 3.18Å; I88-L99 HydrophobicContact CD1-CD1 4.39Å; I88-L99 HydrophobicContact CG1-CD1 3.75Å
89	S	98.4	Very high	97.4	Very high	57 Å²	57	54.5 Å²	54.5	40%	0.399	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	170.6	175.5	68.8	0	0	0	0	110.9	V97 F98	S89-V97 CarbonylContact O-C 3.55Å; S89-V97 WeakPolarHBondContact O-CA 3.46Å; S89-V97 WeakPolarHBondContact O-CG1 3.48Å; S89-F98 PolarHBondContact N-O 2.98Å; S89-F98 PolarHBondContact O-N 3.12Å
90	K	98.3	Very high	97.4	Very high	44 Å²	44	57.6 Å²	57.6	19%	0.191	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	151	177.9	70	-176.4	-174.9	178.3	0	112.4	L48 I70 W71 G72 Q96 V97	L48-K90 PolarHBondContact O-NZ 3.39Å; I70-K90 HydrophobicContact CD1-CB 4.06Å; I70-K90 HydrophobicContact CD1-CD 3.86Å; I70-K90 HydrophobicContact CD1-CG 3.71Å; I70-K90 HydrophobicContact CG1-CD 4.06Å; I70-K90 HydrophobicContact CG1-CG 4.46Å; I70-K90 HydrophobicContact CG2-CB 4.5Å; I70-K90 HydrophobicContact CG2-CD 4.42Å; W71-K90 PolarHBondContact O-NZ 3.11Å; G72-K90 VanDerWaalsContact C-NZ 3.33Å; G72-K90 PolarHBondContact O-NZ 3.36Å; K90-Q96 CarbonylContact C-O 3.57Å; K90-Q96 VanDerWaalsContact CA-O 3.29Å; K90-Q96 WeakPolarHBondContact CA-O 3.31Å; K90-V97 HydrophobicContact CB-CG2 4.13Å
91	D	98.1	Very high	97.5	Very high	41 Å²	41	52.3 Å²	52.3	22%	0.219	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	102.2	170.9	-176.1	-16.1	0	0	0	108.5	S93 K94 S95 Q96 F98	D91-S93 PolarHBondContact O-N 2.81Å; D91-S93 WeakPolarHBondContact OD1-CB 3.44Å; D91-S93 PolarHBondContact OD1-N 2.86Å; D91-S93 PolarHBondContact OD1-OG 3.04Å; D91-K94 HydrophobicContact CB-CB 4.4Å; D91-K94 PolarHBondContact O-N 2.8Å; D91-K94 PolarHBondContact OD1-N 2.82Å; D91-K94 WeakPolarHBondContact OD2-CD 3.26Å; D91-K94 VanDerWaalsContact OD2-CE 3.27Å; D91-K94 WeakPolarHBondContact OD2-CE 3.29Å; D91-K94 WeakPolarHBondContact OD2-CG 3.24Å; D91-K94 IonicContact OD2-NZ 2.8Å; D91-K94 PolarHBondContact OD2-NZ 2.88Å; D91-S95 PolarHBondContact O-N 3.2Å; D91-S95 VanDerWaalsContact O-N 3.11Å; D91-Q96 PolarHBondContact N-O 3.03Å; D91-Q96 PolarHBondContact O-N 3.22Å; D91-F98 HydrophobicContact CB-CE2 3.91Å; D91-F98 HydrophobicContact CB-CZ 4.47Å
92	N	97.7	Very high	97.5	Very high	75 Å²	75	51.3 Å²	51.3	40%	0.401	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-64.5	-29.8	-179.3	-63.7	-20.5	0	0	0	112.1	L48 T49 K94 S95	L48-N92 WeakPolarHBondContact CB-OD1 3.5Å; T49-N92 WeakPolarHBondContact CG2-ND2 3.43Å; N92-K94 VanDerWaalsContact C-N 3.25Å; N92-K94 PolarHBondContact O-N 3.04Å; N92-S95 PolarHBondContact O-N 2.88Å
93	S	97.3	Very high	97.6	Very high	103 Å²	103	54.5 Å²	54.5	72%	0.72	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-70.9	-25.5	-178.1	73.4	0	0	0	0	112.4	D91	D91-S93 PolarHBondContact O-N 2.81Å; D91-S93 WeakPolarHBondContact OD1-CB 3.44Å; D91-S93 PolarHBondContact OD1-N 2.86Å; D91-S93 PolarHBondContact OD1-OG 3.04Å
94	K	97.9	Very high	97.7	Very high	124 Å²	124	49.8 Å²	49.8	54%	0.539	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-104.4	-0.9	178.1	-62.3	-179.6	-168.9	157.6	0	113.4	D91 N92 Q96	D91-K94 HydrophobicContact CB-CB 4.4Å; D91-K94 PolarHBondContact O-N 2.8Å; D91-K94 PolarHBondContact OD1-N 2.82Å; D91-K94 WeakPolarHBondContact OD2-CD 3.26Å; D91-K94 VanDerWaalsContact OD2-CE 3.27Å; D91-K94 WeakPolarHBondContact OD2-CE 3.29Å; D91-K94 WeakPolarHBondContact OD2-CG 3.24Å; D91-K94 IonicContact OD2-NZ 2.8Å; D91-K94 PolarHBondContact OD2-NZ 2.88Å; N92-K94 VanDerWaalsContact C-N 3.25Å; N92-K94 PolarHBondContact O-N 3.04Å; K94-Q96 VanDerWaalsContact C-N 3.25Å; K94-Q96 HydrophobicContact CB-CB 4.27Å; K94-Q96 HydrophobicContact CB-CG 4.15Å; K94-Q96 WeakPolarHBondContact O-CG 3.35Å; K94-Q96 PolarHBondContact O-N 2.86Å
95	S	97.7	Very high	97.6	Very high	48 Å²	48	49.1 Å²	49.1	34%	0.336	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	45.8	-170.9	-57.1	0	0	0	0	112.1	T42 V43 D91 N92	T42-S95 WeakPolarHBondContact CA-O 3.29Å; V43-S95 PolarHBondContact N-O 2.89Å; V43-S95 VanDerWaalsContact O-CB 3.26Å; V43-S95 WeakPolarHBondContact O-CB 3.31Å; D91-S95 PolarHBondContact O-N 3.2Å; D91-S95 VanDerWaalsContact O-N 3.11Å; N92-S95 PolarHBondContact O-N 2.88Å
96	Q	98.7	Very high	97.5	Very high	47 Å²	47	53.3 Å²	53.3	22%	0.22	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.8	-176	-78.2	175.2	-2.1	0	0	112.5	T40 C41 T42 K90 D91 K94 F98	T40-Q96 HydrophobicContact CG2-CB 4.03Å; T40-Q96 HydrophobicContact CG2-CG 3.78Å; C41-Q96 CarbonylContact O-C 3.58Å; C41-Q96 VanDerWaalsContact O-CA 3.31Å; C41-Q96 WeakPolarHBondContact O-CA 3.46Å; T42-Q96 HydrophobicContact CG2-CG 4.41Å; T42-Q96 PolarHBondContact OG1-NE2 2.84Å; K90-Q96 CarbonylContact C-O 3.57Å; K90-Q96 VanDerWaalsContact CA-O 3.29Å; K90-Q96 WeakPolarHBondContact CA-O 3.31Å; D91-Q96 PolarHBondContact N-O 3.03Å; D91-Q96 PolarHBondContact O-N 3.22Å; K94-Q96 VanDerWaalsContact C-N 3.25Å; K94-Q96 HydrophobicContact CB-CB 4.27Å; K94-Q96 HydrophobicContact CB-CG 4.15Å; K94-Q96 WeakPolarHBondContact O-CG 3.35Å; K94-Q96 PolarHBondContact O-N 2.86Å; Q96-F98 HydrophobicContact CB-CE1 4.25Å; Q96-F98 HydrophobicContact CB-CE2 4.02Å; Q96-F98 HydrophobicContact CB-CZ 3.65Å
97	V	98.8	Very high	97.3	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.8	171	-177.1	0	0	0	0	107.8	T40 C41 L48 V53 W55 I70 I88 S89 K90	T40-V97 CarbonylContact C-O 3.53Å; T40-V97 WeakPolarHBondContact CA-O 3.28Å; C41-V97 HydrophobicContact CB-CB 4.39Å; C41-V97 PolarHBondContact N-O 3.44Å; C41-V97 PolarHBondContact O-N 2.91Å; L48-V97 HydrophobicContact CD1-CG2 3.88Å; L48-V97 HydrophobicContact CD2-CG2 3.6Å; L48-V97 HydrophobicContact CG-CG2 4.42Å; V53-V97 HydrophobicContact CB-CB 4.49Å; V53-V97 HydrophobicContact CB-CG1 4.35Å; V53-V97 HydrophobicContact CB-CG2 3.93Å; V53-V97 HydrophobicContact CG1-CB 4.34Å; V53-V97 HydrophobicContact CG1-CG1 4.31Å; V53-V97 HydrophobicContact CG1-CG2 4.21Å; V53-V97 HydrophobicContact CG2-CG2 3.88Å; W55-V97 HydrophobicContact CZ2-CG1 4.28Å; I70-V97 HydrophobicContact CG2-CG1 3.66Å; I88-V97 HydrophobicContact CG2-CG1 4.11Å; S89-V97 CarbonylContact O-C 3.55Å; S89-V97 WeakPolarHBondContact O-CA 3.46Å; S89-V97 WeakPolarHBondContact O-CG1 3.48Å; K90-V97 HydrophobicContact CB-CG2 4.13Å
98	F	98.7	Very high	97.2	Very high	46 Å²	46	54.7 Å²	54.7	20%	0.202	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	136.2	-176	-52.7	-82.8	0	0	0	110.1	I39 T40 I88 S89 D91 Q96	I39-F98 WeakPolarHBondContact O-CA 3.26Å; T40-F98 HydrophobicContact CG2-CD1 3.86Å; T40-F98 HydrophobicContact CG2-CE1 3.52Å; T40-F98 HydrophobicContact CG2-CZ 4.34Å; T40-F98 WeakPolarHBondContact OG1-CD1 3.16Å; T40-F98 WeakPolarHBondContact OG1-CE1 3.33Å; I88-F98 VanDerWaalsContact CA-O 3.31Å; I88-F98 WeakPolarHBondContact CA-O 3.18Å; S89-F98 PolarHBondContact N-O 2.98Å; S89-F98 PolarHBondContact O-N 3.12Å; D91-F98 HydrophobicContact CB-CE2 3.91Å; D91-F98 HydrophobicContact CB-CZ 4.47Å; Q96-F98 HydrophobicContact CB-CE1 4.25Å; Q96-F98 HydrophobicContact CB-CE2 4.02Å; Q96-F98 HydrophobicContact CB-CZ 3.65Å
99	L	98.6	Very high	97	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.2	167.7	176.9	70.5	0	0	0	108.3	S38 I39 W55 L67 L86 I88 M101 Y112	S38-L99 WeakPolarHBondContact CA-O 2.92Å; I39-L99 PolarHBondContact N-O 2.81Å; I39-L99 PolarHBondContact O-N 2.99Å; W55-L99 HydrophobicContact CB-CD1 4.31Å; W55-L99 HydrophobicContact CB-CD2 4.18Å; W55-L99 HydrophobicContact CD2-CB 3.62Å; W55-L99 HydrophobicContact CD2-CD2 3.92Å; W55-L99 HydrophobicContact CD2-CG 4.24Å; W55-L99 VanDerWaalsContact CE2-CB 3.48Å; W55-L99 HydrophobicContact CE3-CB 4.07Å; W55-L99 HydrophobicContact CE3-CD2 3.89Å; W55-L99 HydrophobicContact CG-CB 4Å; W55-L99 HydrophobicContact CG-CD1 4.09Å; W55-L99 HydrophobicContact CG-CD2 4.06Å; W55-L99 HydrophobicContact CG-CG 4.28Å; W55-L99 HydrophobicContact CH2-CB 4.21Å; W55-L99 HydrophobicContact CZ2-CB 3.79Å; W55-L99 HydrophobicContact CZ3-CB 4.35Å; L67-L99 HydrophobicContact CD1-CD2 3.73Å; L86-L99 HydrophobicContact CD2-CD1 4.18Å; I88-L99 HydrophobicContact CD1-CD1 4.39Å; I88-L99 HydrophobicContact CG1-CD1 3.75Å; L99-M101 HydrophobicContact CG-CG 4.37Å; L99-Y112 HydrophobicContact CD2-CD1 3.81Å; L99-Y112 HydrophobicContact CD2-CE1 4.16Å
100	K	98.1	Very high	97	Very high	98 Å²	98	56.9 Å²	56.9	43%	0.426	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.9	170.1	-171.4	175.9	-177.5	-176.5	0	109.8	L37 L86 S87 N102	L37-K100 CarbonylContact O-C 3.48Å; L37-K100 VanDerWaalsContact O-CA 3.29Å; L37-K100 WeakPolarHBondContact O-CA 3.28Å; L86-K100 CarbonylContact C-O 3.5Å; L86-K100 WeakPolarHBondContact CA-O 3.41Å; S87-K100 PolarHBondContact N-O 2.84Å; S87-K100 PolarHBondContact O-N 2.86Å; K100-N102 VanDerWaalsContact CE-OD1 3.24Å; K100-N102 WeakPolarHBondContact CE-OD1 3.07Å
101	M	97.5	Very high	96.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.5	169.9	-53.2	-161.6	48.8	0	0	109.4	S36 L37 R85 L86 L99 L104 Y112	S36-M101 CarbonylContact C-O 3.57Å; S36-M101 WeakPolarHBondContact CA-O 3.04Å; L37-M101 HydrophobicContact CB-CB 4.26Å; L37-M101 PolarHBondContact N-O 3.33Å; L37-M101 PolarHBondContact O-N 3.24Å; R85-M101 CarbonylContact O-C 3.52Å; R85-M101 WeakPolarHBondContact O-CA 3.46Å; L86-M101 HydrophobicContact CD2-CB 4.27Å; L86-M101 HydrophobicContact CD2-CE 3.55Å; L86-M101 HydrophobicContact CD2-CG 3.38Å; L86-M101 HydrophobicContact CD2-SD 3.59Å; L86-M101 VanDerWaalsContact CD2-SD 3.59Å; L99-M101 HydrophobicContact CG-CG 4.37Å; M101-L104 HydrophobicContact CB-CD2 4.03Å; M101-Y112 HydrophobicContact SD-CE1 3.52Å; M101-Y112 VanDerWaalsContact SD-CE1 3.52Å; M101-Y112 PolarHBondContact SD-OH 3.49Å
102	N	96.8	Very high	96.9	Very high	56 Å²	56	59.5 Å²	59.5	30%	0.299	33%	0.325	S	S	.	.			trans	-98.8	158.7	175.9	-56.2	-57.1	0	0	0	110.9	S36 R85 K100 L104	S36-N102 PolarHBondContact OG-OD1 3Å; R85-N102 PolarHBondContact O-N 3.42Å; K100-N102 VanDerWaalsContact CE-OD1 3.24Å; K100-N102 WeakPolarHBondContact CE-OD1 3.07Å; N102-L104 PolarHBondContact O-N 3.41Å
103	S	95.8	Very high	96.9	Very high	75 Å²	75	59.9 Å²	59.9	52%	0.524	32%	0.322	S	S	.	.	S	Bend	trans	50.6	57.5	175.7	-54.9	0	0	0	0	111.7	Q35 R85 Q105	Q35-S103 PolarHBondContact O-N 3.16Å; R85-S103 PolarHBondContact NH1-O 2.86Å; S103-Q105 PolarHBondContact O-N 3.39Å
104	L	96.3	Very high	96.9	Very high	16 Å²	16	55.4 Å²	55.4	8%	0.084	29%	0.29	C	S	.	.			trans	-55.9	136.7	-178.6	-72.6	170.8	0	0	0	111.5	V31 S34 Q35 L37 M101 N102 D108	V31-L104 HydrophobicContact CB-CD1 3.73Å; V31-L104 HydrophobicContact CG1-CD1 3.42Å; V31-L104 VanDerWaalsContact CG1-CD1 3.42Å; S34-L104 PolarHBondContact N-O 3.31Å; Q35-L104 WeakPolarHBondContact O-CG 3.46Å; Q35-L104 PolarHBondContact O-N 3.4Å; L37-L104 HydrophobicContact CB-CD1 3.86Å; L37-L104 HydrophobicContact CB-CD2 3.89Å; L37-L104 HydrophobicContact CB-CG 4.27Å; L37-L104 HydrophobicContact CD2-CD2 4.39Å; M101-L104 HydrophobicContact CB-CD2 4.03Å; N102-L104 PolarHBondContact O-N 3.41Å; L104-D108 WeakPolarHBondContact CA-OD2 3.37Å; L104-D108 HydrophobicContact CD2-CB 4.08Å
105	Q	95.5	Very high	96.9	Very high	98 Å²	98	51.3 Å²	51.3	46%	0.458	28%	0.279	S	S	.	.			trans	-111.8	159.6	177.9	-68	173.3	-33.5	0	0	109.2	R85 S103 D107 D108	R85-Q105 VanDerWaalsContact NH2-OE1 3.09Å; S103-Q105 PolarHBondContact O-N 3.39Å; Q105-D107 WeakPolarHBondContact CB-OD1 3.27Å; Q105-D107 PolarHBondContact O-N 2.6Å; Q105-D108 PolarHBondContact N-OD2 2.72Å; Q105-D108 VanDerWaalsContact O-CB 3.28Å; Q105-D108 WeakPolarHBondContact O-CB 3.21Å; Q105-D108 PolarHBondContact O-N 3.35Å
106	T	93.4	Very high	96.6	Very high	114 Å²	114	54.7 Å²	54.7	70%	0.699	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-61.6	-30.6	-178.8	-48.6	0	0	0	0	112.4	D108 T109	T106-D108 PolarHBondContact O-N 2.95Å; T106-T109 WeakPolarHBondContact O-CB 3.4Å; T106-T109 PolarHBondContact O-N 2.81Å; T106-T109 PolarHBondContact O-OG1 3.38Å
107	D	93.2	Very high	96.5	Very high	91 Å²	91	55.1 Å²	55.1	49%	0.487	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-71.9	-10.7	175.8	67.6	-22.6	0	0	0	113.8	Q105 T109	Q105-D107 WeakPolarHBondContact CB-OD1 3.27Å; Q105-D107 PolarHBondContact O-N 2.6Å; D107-T109 PolarHBondContact O-N 3.3Å
108	D	95.7	Very high	96.4	Very high	7 Å²	7	57.9 Å²	57.9	4%	0.037	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-78.6	-3.2	171.7	-61	-42.4	0	0	0	113.2	R57 R85 L104 Q105 T106 A110 Y112	R57-D108 IonicContact CZ-OD1 3.64Å; R57-D108 IonicContact NH1-OD1 3.57Å; R57-D108 PolarHBondContact NH1-OD1 3.21Å; R85-D108 IonicContact CZ-OD1 3.79Å; R85-D108 IonicContact CZ-OD2 3.16Å; R85-D108 IonicContact NH1-OD1 2.69Å; R85-D108 IonicContact NH1-OD2 2.78Å; R85-D108 PolarHBondContact NH1-OD2 2.74Å; R85-D108 IonicContact NH2-OD1 3.4Å; R85-D108 PolarHBondContact NH2-OD1 3.22Å; R85-D108 IonicContact NH2-OD2 3.39Å; R85-D108 PolarHBondContact NH2-OD2 2.76Å; L104-D108 WeakPolarHBondContact CA-OD2 3.37Å; L104-D108 HydrophobicContact CD2-CB 4.08Å; Q105-D108 PolarHBondContact N-OD2 2.72Å; Q105-D108 VanDerWaalsContact O-CB 3.28Å; Q105-D108 WeakPolarHBondContact O-CB 3.21Å; Q105-D108 PolarHBondContact O-N 3.35Å; T106-D108 PolarHBondContact O-N 2.95Å; D108-A110 PolarHBondContact O-N 3.05Å; D108-Y112 PolarHBondContact O-OH 2.87Å
109	T	95.6	Very high	96.3	Very high	89 Å²	89	58.6 Å²	58.6	55%	0.546	31%	0.312	S	S	.	.			trans	-63.2	106.4	175.4	-55.3	0	0	0	0	109.8	P60 T106 D107	P60-T109 WeakPolarHBondContact CD-O 3.46Å; T106-T109 WeakPolarHBondContact O-CB 3.4Å; T106-T109 PolarHBondContact O-N 2.81Å; T106-T109 PolarHBondContact O-OG1 3.38Å; D107-T109 PolarHBondContact O-N 3.3Å
110	A	96.5	Very high	96.1	Very high	23 Å²	23	62.1 Å²	62.1	19%	0.19	33%	0.331	C	S	.	.	S	Bend	trans	-159.8	163.3	-175.4	0	0	0	0	0	111.6	R57 Q58 P59 D108 Y112	R57-A110 HydrophobicContact CB-CB 3.84Å; R57-A110 HydrophobicContact CG-CB 4.19Å; Q58-A110 WeakPolarHBondContact O-CA 3.44Å; Q58-A110 WeakPolarHBondContact O-CB 3.36Å; P59-A110 HydrophobicContact CB-CB 4.42Å; P59-A110 HydrophobicContact CG-CB 4.27Å; D108-A110 PolarHBondContact O-N 3.05Å; A110-Y112 HydrophobicContact CB-CD2 4.44Å; A110-Y112 HydrophobicContact CB-CE2 4.02Å; A110-Y112 VanDerWaalsContact O-CD2 3.29Å; A110-Y112 WeakPolarHBondContact O-CD2 3.45Å; A110-Y112 WeakPolarHBondContact O-CE2 3.27Å
111	M	96.9	Very high	96	Very high	113 Å²	113	59.8 Å²	59.8	56%	0.557	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	137	160.1	-65.2	-57.7	-60.7	0	0	109.2	R57 Q58 Y113	R57-M111 CarbonylContact C-O 3.48Å; R57-M111 WeakPolarHBondContact CA-O 3.41Å; Q58-M111 PolarHBondContact N-O 3.41Å; Q58-M111 PolarHBondContact O-N 3.09Å; M111-Y113 HydrophobicContact CB-CE1 4.41Å; M111-Y113 HydrophobicContact CB-CE2 3.61Å; M111-Y113 VanDerWaalsContact CB-OH 3.27Å; M111-Y113 WeakPolarHBondContact CB-OH 3.21Å
112	Y	97.7	Very high	95.9	Very high	26 Å²	26	63.8 Å²	63.8	10%	0.102	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	133.7	-177.5	-73.4	-100.1	0	0	0	110.1	L37 I39 R57 L67 L99 M101 D108 A110	L37-Y112 HydrophobicContact CD2-CD2 4.31Å; L37-Y112 HydrophobicContact CD2-CE1 4.23Å; L37-Y112 HydrophobicContact CD2-CE2 3.86Å; I39-Y112 VanDerWaalsContact CD1-CB 3.47Å; I39-Y112 HydrophobicContact CD1-CD1 3.97Å; I39-Y112 HydrophobicContact CD1-CD2 3.96Å; I39-Y112 HydrophobicContact CD1-CG 3.53Å; R57-Y112 HydrophobicContact CB-CD1 3.88Å; R57-Y112 HydrophobicContact CB-CE1 3.89Å; R57-Y112 HydrophobicContact CB-CG 4.28Å; L67-Y112 HydrophobicContact CD1-CD1 3.75Å; L67-Y112 HydrophobicContact CD1-CE1 3.63Å; L99-Y112 HydrophobicContact CD2-CD1 3.81Å; L99-Y112 HydrophobicContact CD2-CE1 4.16Å; M101-Y112 HydrophobicContact SD-CE1 3.52Å; M101-Y112 VanDerWaalsContact SD-CE1 3.52Å; M101-Y112 PolarHBondContact SD-OH 3.49Å; D108-Y112 PolarHBondContact O-OH 2.87Å; A110-Y112 HydrophobicContact CB-CD2 4.44Å; A110-Y112 HydrophobicContact CB-CE2 4.02Å; A110-Y112 VanDerWaalsContact O-CD2 3.29Å; A110-Y112 WeakPolarHBondContact O-CD2 3.45Å; A110-Y112 WeakPolarHBondContact O-CE2 3.27Å
113	Y	98.1	Very high	95.9	Very high	84 Å²	84	64.4 Å²	64.4	33%	0.329	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.1	-175.3	-53.4	-74.6	0	0	0	109.9	E25 V56 Q58 M111	E25-Y113 WeakPolarHBondContact OE1-CA 3.49Å; V56-Y113 PolarHBondContact N-O 2.85Å; V56-Y113 PolarHBondContact O-N 3.24Å; V56-Y113 VanDerWaalsContact O-O 3.13Å; Q58-Y113 HydrophobicContact CB-CE2 3.96Å; M111-Y113 HydrophobicContact CB-CE1 4.41Å; M111-Y113 HydrophobicContact CB-CE2 3.61Å; M111-Y113 VanDerWaalsContact CB-OH 3.27Å; M111-Y113 WeakPolarHBondContact CB-OH 3.21Å
114	C	98.3	Very high	95.9	Very high	9 Å²	9	63.5 Å²	63.5	6%	0.061	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	149.3	161.8	53.9	0	0	0	0	110.1	L23 E25 C41 V53 D54 W55	L23-C114 HydrophobicContact CD2-CB 4.18Å; E25-C114 PolarHBondContact OE1-N 3.03Å; E25-C114 PolarHBondContact OE1-SG 2.84Å; C41-C114 HydrophobicContact CB-CB 3.45Å; C41-C114 VanDerWaalsContact CB-CB 3.45Å; C41-C114 WeakPolarHBondContact CB-SG 3.18Å; C41-C114 WeakPolarHBondContact SG-CB 3.25Å; C41-C114 CovalentContact SG-SG 2.01Å; C41-C114 PolarHBondContact SG-SG 3.33Å; V53-C114 HydrophobicContact CG1-CB 3.79Å; D54-C114 CarbonylContact O-C 3.56Å; D54-C114 VanDerWaalsContact O-CA 3.22Å; D54-C114 WeakPolarHBondContact O-CA 3.42Å; W55-C114 HydrophobicContact CD2-CB 4.37Å; W55-C114 HydrophobicContact CE3-CB 4.1Å; W55-C114 HydrophobicContact CH2-CB 4.16Å; W55-C114 HydrophobicContact CZ2-CB 4.39Å; W55-C114 HydrophobicContact CZ3-CB 3.99Å
115	A	97.5	Very high	95.8	Very high	37 Å²	37	67.5 Å²	67.5	31%	0.306	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.2	179.4	0	0	0	0	0	110.6	V53 D54	V53-A115 CarbonylContact C-O 3.59Å; V53-A115 VanDerWaalsContact CA-O 3.32Å; V53-A115 WeakPolarHBondContact CA-O 3.48Å; D54-A115 HydrophobicContact CB-CB 4.27Å; D54-A115 PolarHBondContact N-O 3.31Å; D54-A115 PolarHBondContact O-N 3.08Å
116	K	91.6	Very high	95.9	Very high	119 Å²	119	64.7 Å²	64.7	52%	0.517	35%	0.348	S	S	.	.			trans	-114.2	0	173.4	179	-163.9	170.6	-66.2	0	109.3	V21 L23 F46	V21-K116 HydrophobicContact CG1-CD 4.2Å; L23-K116 HydrophobicContact CD2-CB 4.46Å; F46-K116 HydrophobicContact CB-CD 4.34Å; F46-K116 HydrophobicContact CD1-CD 3.6Å; F46-K116 HydrophobicContact CD2-CD 3.89Å; F46-K116 HydrophobicContact CD2-CG 4.45Å; F46-K116 HydrophobicContact CE1-CB 4.31Å; F46-K116 HydrophobicContact CE1-CD 3.68Å; F46-K116 HydrophobicContact CE1-CG 4.29Å; F46-K116 HydrophobicContact CE2-CD 3.95Å; F46-K116 HydrophobicContact CE2-CG 4.09Å; F46-K116 HydrophobicContact CG-CD 3.69Å; F46-K116 HydrophobicContact CZ-CB 4.05Å; F46-K116 HydrophobicContact CZ-CD 3.83Å; F46-K116 HydrophobicContact CZ-CG 3.99Å

Retrieved 116 of 116 residues in 230.7 ms (Link to these results)

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