A0A087Y3L0_POEFO Loading...

Si:busm1-57f23.1

AlphaFold DB , UniProt , Accession A0A087Y3L0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 142 aa.

						>A0A087Y3L0_POEFO|A0A087Y3L0
MSLPLSFLICLSVFHLCLGTGPVEELIKVKKVHLLGGWSERSLESKDVQRAAQYAVEMYNKDSQDKELFKLVSVPSAKSQVTNMINFKIDAILGRTKCLKTQNLDIKSCDLDKEQVKCQFFVTLNPHNDKHELNTKTCNKVT
					

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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	51.1	Low	55.6	Low	240 Å²	240	118.3 Å²	118.3	100%	1.182	65%	0.652	S	S	*	*				0	101.8	0	-64.3	173.2	78.9	0	0	106.8
2	S	58	Low	55.7	Low	114 Å²	114	113.8 Å²	113.8	80%	0.797	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-74.8	120.3	-175.6	45.9	0	0	0	0	109.7	P4	S2-P4 WeakPolarHBondContact O-CD 3.28Å
3	L	50.2	Low	55.5	Low	129 Å²	129	111.6 Å²	111.6	68%	0.675	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-59.9	121.3	166.7	-108.6	83.4	0	0	0	107.6	L5	L3-L5 PolarHBondContact O-N 2.77Å
4	P	62.8	Low	55.3	Low	75 Å²	75	115 Å²	115	49%	0.487	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-60.1	132.9	178.8	20.9	-31.1	0	0	0	110	S2 S6 F7	S2-P4 WeakPolarHBondContact O-CD 3.28Å; P4-S6 PolarHBondContact O-N 2.87Å; P4-F7 HydrophobicContact CG-CD2 3.89Å; P4-F7 WeakPolarHBondContact O-CB 3.22Å; P4-F7 PolarHBondContact O-N 2.74Å
5	L	55.5	Low	55	Low	132 Å²	132	117.6 Å²	117.6	69%	0.691	64%	0.637	S	S	*	*	H	α-helix	trans	-52.5	-24.6	-178.7	-156.6	72	0	0	0	112.6	L3 F7 L8 I9	L3-L5 PolarHBondContact O-N 2.77Å; L5-F7 VanDerWaalsContact C-N 3.32Å; L5-F7 PolarHBondContact O-N 2.74Å; L5-L8 HydrophobicContact CD1-CD1 4.4Å; L5-L8 PolarHBondContact O-N 2.76Å; L5-I9 WeakPolarHBondContact O-CG1 3.37Å; L5-I9 PolarHBondContact O-N 3.45Å
6	S	57.3	Low	54.7	Low	83 Å²	83	119.6 Å²	119.6	58%	0.58	65%	0.646	S	S	*	*	H	α-helix	trans	-59.3	-33.9	171.5	179.8	0	0	0	0	114.1	P4 C10	P4-S6 PolarHBondContact O-N 2.87Å; S6-C10 PolarHBondContact O-N 2.98Å
7	F	55.9	Low	54.6	Low	135 Å²	135	118.7 Å²	118.7	59%	0.592	65%	0.649	S	S	*	*	H	α-helix	trans	-73.6	-33.8	177.1	-102.2	-95.4	0	0	0	112.6	P4 L5 I9 C10 L11	P4-F7 HydrophobicContact CG-CD2 3.89Å; P4-F7 WeakPolarHBondContact O-CB 3.22Å; P4-F7 PolarHBondContact O-N 2.74Å; L5-F7 VanDerWaalsContact C-N 3.32Å; L5-F7 PolarHBondContact O-N 2.74Å; F7-I9 VanDerWaalsContact C-N 3.34Å; F7-C10 PolarHBondContact O-N 2.86Å; F7-L11 PolarHBondContact O-N 3.26Å
8	L	55.6	Low	54.6	Low	100 Å²	100	119.3 Å²	119.3	52%	0.524	65%	0.651	S	S	.	*	H	α-helix	trans	-69.1	-33.3	176.9	-84	159	0	0	0	112	L5	L5-L8 HydrophobicContact CD1-CD1 4.4Å; L5-L8 PolarHBondContact O-N 2.76Å
9	I	56.8	Low	54.7	Low	103 Å²	103	116 Å²	116	53%	0.528	65%	0.647	S	S	.	*	H	α-helix	trans	-72.3	-31.5	177	-62.4	164.4	0	0	0	111.2	L5 F7 S12 V13	L5-I9 WeakPolarHBondContact O-CG1 3.37Å; L5-I9 PolarHBondContact O-N 3.45Å; F7-I9 VanDerWaalsContact C-N 3.34Å; I9-S12 PolarHBondContact O-OG 3.4Å; I9-V13 WeakPolarHBondContact O-CG2 3.47Å
10	C	53.9	Low	54.8	Low	77 Å²	77	116.8 Å²	116.8	52%	0.52	66%	0.655	S	S	.	*	H	α-helix	trans	-70.5	-32.4	176.3	-74.3	0	0	0	0	113.6	S6 F7 F14	S6-C10 PolarHBondContact O-N 2.98Å; F7-C10 PolarHBondContact O-N 2.86Å; C10-F14 PolarHBondContact O-N 3.31Å
11	L	54.9	Low	55.1	Low	113 Å²	113	113.7 Å²	113.7	59%	0.592	65%	0.649	S	S	*	*	H	α-helix	trans	-72.3	-32.6	180	-78.1	161.3	0	0	0	112.8	F7	F7-L11 PolarHBondContact O-N 3.26Å
12	S	56.1	Low	55.2	Low	65 Å²	65	107.8 Å²	107.8	46%	0.455	63%	0.629	S	S	.	*	H	α-helix	trans	-72.6	-31.8	178.4	58.9	0	0	0	0	113	I9 H15	I9-S12 PolarHBondContact O-OG 3.4Å; S12-H15 PolarHBondContact O-N 2.82Å
13	V	53.8	Low	55.2	Low	85 Å²	85	108.4 Å²	108.4	52%	0.515	63%	0.627	S	S	.	*	H	α-helix	trans	-69.8	-34.4	176.2	-179.7	0	0	0	0	111.5	I9 H15 L16 C17	I9-V13 WeakPolarHBondContact O-CG2 3.47Å; V13-H15 VanDerWaalsContact C-N 3.31Å; V13-H15 PolarHBondContact O-N 2.96Å; V13-L16 PolarHBondContact O-N 3.28Å; V13-C17 PolarHBondContact O-N 2.83Å
14	F	52.6	Low	55.8	Low	159 Å²	159	110.9 Å²	110.9	70%	0.697	64%	0.636	S	S	*	*	H	α-helix	trans	-64.7	-32.8	176.7	-107.1	-89.5	0	0	0	113.2	C10	C10-F14 PolarHBondContact O-N 3.31Å
15	H	51.3	Low	55.8	Low	154 Å²	154	115.2 Å²	115.2	71%	0.713	65%	0.65	S	S	*	*	H	α-helix	trans	-74.8	-24.3	177	-89	-40.9	0	0	0	114	S12 V13	S12-H15 PolarHBondContact O-N 2.82Å; V13-H15 VanDerWaalsContact C-N 3.31Å; V13-H15 PolarHBondContact O-N 2.96Å
16	L	49.7	Very low	56.1	Low	149 Å²	149	116.2 Å²	116.2	78%	0.78	66%	0.655	S	S	*	*	H	α-helix	trans	-80.1	-19.7	174	-93.5	102.6	0	0	0	113.7	V13	V13-L16 PolarHBondContact O-N 3.28Å
17	C	52.5	Low	56.4	Low	105 Å²	105	119.6 Å²	119.6	71%	0.709	67%	0.665	S	S	*	*	H	α-helix	trans	-86.9	-11.8	177.8	-70.1	0	0	0	0	114.1	V13 G19	V13-C17 PolarHBondContact O-N 2.83Å; C17-G19 PolarHBondContact O-N 2.84Å
18	L	55.7	Low	57.3	Low	130 Å²	130	121.9 Å²	121.9	68%	0.681	67%	0.674	S	S	*	*			trans	-85.6	44.4	166.7	-76.5	146.9	0	0	0	110.2	T20	L18-T20 PolarHBondContact O-N 2.86Å
19	G	55.1	Low	58.1	Low	56 Å²	56	123.3 Å²	123.3	58%	0.577	69%	0.687	S	S	*	*			trans	-56.7	113	153.7	0	0	0	0	0	105.3	C17 G21	C17-G19 PolarHBondContact O-N 2.84Å; G19-G21 PolarHBondContact O-N 2.85Å
20	T	57.9	Low	59	Low	132 Å²	132	127 Å²	127	81%	0.81	70%	0.699	S	S	*	*			trans	-42.6	109.2	167	42.9	0	0	0	0	106.3	L18	L18-T20 PolarHBondContact O-N 2.86Å
21	G	59.8	Low	59.9	Low	51 Å²	51	133 Å²	133	53%	0.526	72%	0.716	S	S	.	*			trans	-49.9	152.6	171.9	0	0	0	0	0	108	G19 V23	G19-G21 PolarHBondContact O-N 2.85Å; G21-V23 PolarHBondContact O-N 2.87Å
22	P	54.2	Low	60.8	Low	117 Å²	117	132.8 Å²	132.8	76%	0.76	72%	0.72	S	S	*	*			trans	-48.9	116.8	179.2	22.2	-31.7	0	0	0	107.2	E24	P22-E24 PolarHBondContact O-N 2.8Å
23	V	57.9	Low	61.6	Low	126 Å²	126	134.2 Å²	134.2	76%	0.764	72%	0.719	S	S	*	*			trans	-63.1	98.4	170.7	176.3	0	0	0	0	103	G21 E25	G21-V23 PolarHBondContact O-N 2.87Å; V23-E25 PolarHBondContact O-N 3.42Å
24	E	62.5	Low	62.9	Low	182 Å²	182	136.6 Å²	136.6	85%	0.85	73%	0.728	S	S	*	*			trans	-66.7	78.9	168.2	-83.9	172.8	143.5	0	0	106	P22 L26	P22-E24 PolarHBondContact O-N 2.8Å; E24-L26 PolarHBondContact O-N 2.82Å
25	E	63	Low	64.4	Low	166 Å²	166	133.8 Å²	133.8	78%	0.776	72%	0.72	S	S	*	*			trans	-65.7	93.2	165.4	-165.5	177	-163.5	0	0	105.2	V23 I27	V23-E25 PolarHBondContact O-N 3.42Å; E25-I27 PolarHBondContact O-N 2.76Å
26	L	61.2	Low	66.3	Low	153 Å²	153	128.9 Å²	128.9	80%	0.801	71%	0.711	S	S	*	*			trans	-51.9	108.1	173.8	-173.8	82.7	0	0	0	106.8	E24 K28	E24-L26 PolarHBondContact O-N 2.82Å; L26-K28 PolarHBondContact O-N 3.34Å
27	I	65.1	Low	68.3	Low	154 Å²	154	123.3 Å²	123.3	79%	0.79	69%	0.69	S	S	*	*			trans	-63.5	87.6	177.8	-58.3	176.1	0	0	0	106.9	E25 V29	E25-I27 PolarHBondContact O-N 2.76Å; I27-V29 PolarHBondContact O-N 3.46Å
28	K	73.4	Confident	70.4	Confident	183 Å²	183	123.3 Å²	123.3	80%	0.796	68%	0.675	S	S	*	*			trans	-75.2	98.6	176.6	-164.7	174.6	-173.3	176.4	0	105.8	L26 K30	L26-K28 PolarHBondContact O-N 3.34Å; K28-K30 PolarHBondContact O-N 3.4Å
29	V	73	Confident	72.3	Confident	130 Å²	130	117.4 Å²	117.4	79%	0.788	64%	0.644	S	S	*	*			trans	-53.3	103.3	177	179.3	0	0	0	0	108.3	I27 K31	I27-V29 PolarHBondContact O-N 3.46Å; V29-K31 PolarHBondContact O-N 2.93Å
30	K	75.8	Confident	74.2	Confident	179 Å²	179	119.9 Å²	119.9	78%	0.778	64%	0.641	S	S	*	*			trans	-78	115.2	176	-168.8	174.7	-178.3	179.1	0	106.6	K28 V32	K28-K30 PolarHBondContact O-N 3.4Å; K30-V32 WeakPolarHBondContact O-CG2 3.45Å; K30-V32 PolarHBondContact O-N 2.92Å
31	K	72.2	Confident	76	Confident	203 Å²	203	116.7 Å²	116.7	88%	0.883	61%	0.614	S	S	*	*			trans	-64.7	102.7	171.9	-170.1	176.3	-177.7	178.8	0	108.1	V29	V29-K31 PolarHBondContact O-N 2.93Å
32	V	73.6	Confident	77.8	Confident	110 Å²	110	117.9 Å²	117.9	67%	0.667	61%	0.614	S	S	*	*			trans	-86.7	139	176	-173	0	0	0	0	108.8	K30 L34	K30-V32 WeakPolarHBondContact O-CG2 3.45Å; K30-V32 PolarHBondContact O-N 2.92Å; V32-L34 PolarHBondContact O-N 2.94Å
33	H	73.2	Confident	79.8	Confident	95 Å²	95	115.2 Å²	115.2	44%	0.44	59%	0.593	S	S	.	*			trans	-83.7	113.7	175.8	-147.3	42.4	0	0	0	109.6	L35 S39 E40	H33-L35 PolarHBondContact O-N 2.99Å; H33-S39 WeakPolarHBondContact CE1-CB 3.42Å; H33-S39 WeakPolarHBondContact NE2-CB 3.36Å; H33-S39 PolarHBondContact NE2-OG 3.23Å; H33-E40 PolarHBondContact NE2-O 2.02Å; H33-E40 VanDerWaalsContact NE2-O 3.08Å
34	L	80.4	Confident	81.5	Confident	135 Å²	135	116.4 Å²	116.4	71%	0.707	59%	0.591	S	S	*	*			trans	-74.7	120.9	175.9	-60.4	178.5	0	0	0	109	V32	V32-L34 PolarHBondContact O-N 2.94Å
35	L	85.4	Confident	83.1	Confident	99 Å²	99	108.8 Å²	108.8	52%	0.518	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-29.6	-175.9	-61.9	179.8	0	0	0	113	H33 G37 V81	H33-L35 PolarHBondContact O-N 2.99Å; L35-G37 VanDerWaalsContact C-N 3.29Å; L35-G37 PolarHBondContact O-N 2.68Å; L35-V81 HydrophobicContact CB-CB 3.99Å; L35-V81 HydrophobicContact CB-CG2 3.95Å; L35-V81 HydrophobicContact CD2-CG2 4.36Å; L35-V81 WeakPolarHBondContact O-CB 3.21Å; L35-V81 PolarHBondContact O-N 3.36Å
36	G	89.9	Confident	84.7	Confident	52 Å²	52	108.9 Å²	108.9	54%	0.536	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-15.6	-178.3	0	0	0	0	0	115	Q80	G36-Q80 WeakPolarHBondContact O-CG 3.46Å; G36-Q80 PolarHBondContact O-NE2 2.89Å
37	G	93.2	Very high	86.4	Confident	32 Å²	32	103.1 Å²	103.1	33%	0.33	53%	0.525	S	S	.	.	S	Bend	trans	-102	170.9	175.8	0	0	0	0	0	112.4	L35 S39	L35-G37 VanDerWaalsContact C-N 3.29Å; L35-G37 PolarHBondContact O-N 2.68Å; G37-S39 PolarHBondContact O-N 2.89Å
38	W	96.1	Very high	88	Confident	105 Å²	105	95.8 Å²	95.8	40%	0.398	49%	0.488	S	S	.	.			trans	-69	132.4	170.1	-72.9	102.5	0	0	0	111	K78 S79 Q80 N86 K88 F121	W38-K78 HydrophobicContact CE3-CB 3.78Å; W38-K78 HydrophobicContact CZ3-CB 4.36Å; W38-S79 WeakPolarHBondContact CA-O 3.25Å; W38-Q80 HydrophobicContact CD2-CB 3.82Å; W38-Q80 HydrophobicContact CE3-CB 3.79Å; W38-Q80 HydrophobicContact CG-CB 4.43Å; W38-Q80 HydrophobicContact CH2-CB 4.07Å; W38-Q80 HydrophobicContact CZ2-CB 4.06Å; W38-Q80 HydrophobicContact CZ3-CB 3.94Å; W38-N86 HydrophobicContact CH2-CB 3.74Å; W38-N86 HydrophobicContact CZ2-CB 4.41Å; W38-N86 HydrophobicContact CZ3-CB 4.4Å; W38-K88 HydrophobicContact CE3-CB 4.43Å; W38-K88 HydrophobicContact CH2-CB 4.16Å; W38-K88 HydrophobicContact CZ3-CB 3.86Å; W38-F121 HydrophobicContact CH2-CD2 4.22Å; W38-F121 AromaticContact CH2-CE2 3.51Å; W38-F121 HydrophobicContact CH2-CE2 3.51Å; W38-F121 HydrophobicContact CH2-CZ 4.27Å; W38-F121 AromaticContact CZ2-CE2 3.63Å; W38-F121 HydrophobicContact CZ2-CE2 3.63Å; W38-F121 HydrophobicContact CZ2-CZ 4.37Å
39	S	94.8	Very high	89.2	Confident	5 Å²	5	89.3 Å²	89.3	4%	0.035	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	124.2	-160.7	77.2	0	0	0	0	107.8	H33 G37 K78 S79	H33-S39 WeakPolarHBondContact CE1-CB 3.42Å; H33-S39 WeakPolarHBondContact NE2-CB 3.36Å; H33-S39 PolarHBondContact NE2-OG 3.23Å; G37-S39 PolarHBondContact O-N 2.89Å; S39-K78 CarbonylContact O-C 3.55Å; S39-K78 VanDerWaalsContact O-CA 3.26Å; S39-K78 WeakPolarHBondContact O-CA 3.32Å; S39-S79 PolarHBondContact N-O 2.82Å; S39-S79 PolarHBondContact O-N 2.91Å; S39-S79 PolarHBondContact OG-O 2.91Å; S39-S79 PolarHBondContact OG-OG 2.92Å
40	E	96.3	Very high	90.3	Very high	108 Å²	108	88.3 Å²	88.3	51%	0.505	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	139.3	-177.1	-63.6	-67	176.1	0	0	110.9	H33 K78	H33-E40 PolarHBondContact NE2-O 2.02Å; H33-E40 VanDerWaalsContact NE2-O 3.08Å; E40-K78 WeakPolarHBondContact OE1-CE 3.16Å; E40-K78 IonicContact OE1-NZ 2.63Å; E40-K78 PolarHBondContact OE1-NZ 2.71Å; E40-K78 VanDerWaalsContact OE2-CE 3.27Å; E40-K78 WeakPolarHBondContact OE2-CE 3.49Å; E40-K78 VanDerWaalsContact OE2-CG 3.3Å; E40-K78 WeakPolarHBondContact OE2-CG 3.09Å
41	R	96.2	Very high	91.4	Very high	66 Å²	66	79.8 Å²	79.8	25%	0.249	41%	0.405	C	S	.	.			trans	-115.8	152.6	178.1	-70.6	-56.8	-165.8	100.9	10.4	111.6	L43 D47 V48 A77 S79	R41-L43 PolarHBondContact O-N 2.96Å; R41-D47 IonicContact CZ-OD2 2.76Å; R41-D47 IonicContact NH1-OD2 3.73Å; R41-D47 PolarHBondContact NH1-OD2 2.8Å; R41-V48 HydrophobicContact CB-CG2 3.72Å; R41-V48 HydrophobicContact CG-CG2 4.36Å; R41-A77 HydrophobicContact CB-CB 4.38Å; R41-A77 PolarHBondContact N-O 3.23Å; R41-S79 PolarHBondContact NE-OG 2.9Å; R41-S79 PolarHBondContact NH2-OG 2.78Å
42	S	96.1	Very high	92.7	Very high	76 Å²	76	70.1 Å²	70.1	53%	0.531	36%	0.363	S	S	.	.			trans	-61.9	129.4	168.7	175	0	0	0	0	109.2	E44 S45	S42-E44 PolarHBondContact O-N 2.8Å; S42-E44 PolarHBondContact OG-N 2.95Å; S42-S45 VanDerWaalsContact O-CB 3.24Å; S42-S45 WeakPolarHBondContact O-CB 3.3Å; S42-S45 PolarHBondContact O-N 2.04Å; S42-S45 VanDerWaalsContact O-N 3.09Å; S42-S45 PolarHBondContact O-OG 3.17Å
43	L	96.9	Very high	93.8	Very high	61 Å²	61	70 Å²	70	32%	0.319	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-30.5	179.4	-49.4	175.7	0	0	0	110.8	R41 S45 Q49 V74 A77	R41-L43 PolarHBondContact O-N 2.96Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 2.83Å; L43-Q49 PolarHBondContact O-NE2 3Å; L43-V74 WeakPolarHBondContact CD1-O 3.3Å; L43-V74 HydrophobicContact CD2-CG1 4.23Å; L43-A77 HydrophobicContact CD2-CB 4.09Å
44	E	93.9	Very high	95	Very high	151 Å²	151	68.2 Å²	68.2	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	1.3	177.8	-56.4	-50.7	130.2	0	0	113.5	S42 K46	S42-E44 PolarHBondContact O-N 2.8Å; S42-E44 PolarHBondContact OG-N 2.95Å; E44-K46 PolarHBondContact O-N 2.8Å
45	S	96.2	Very high	95.9	Very high	21 Å²	21	61.8 Å²	61.8	15%	0.147	31%	0.311	C	S	.	.			trans	-67	136.6	179.5	65.9	0	0	0	0	111.1	S42 L43 D47 V48 Q49	S42-S45 VanDerWaalsContact O-CB 3.24Å; S42-S45 WeakPolarHBondContact O-CB 3.3Å; S42-S45 PolarHBondContact O-N 2.04Å; S42-S45 VanDerWaalsContact O-N 3.09Å; S42-S45 PolarHBondContact O-OG 3.17Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 2.83Å; S45-D47 WeakPolarHBondContact CB-OD1 3.33Å; S45-D47 PolarHBondContact O-N 2.82Å; S45-D47 PolarHBondContact OG-OD1 2.74Å; S45-V48 PolarHBondContact O-N 2.95Å; S45-V48 VanDerWaalsContact OG-CB 3.25Å; S45-V48 WeakPolarHBondContact OG-CB 3.4Å; S45-V48 WeakPolarHBondContact OG-CG2 3.38Å; S45-Q49 WeakPolarHBondContact O-CG 3.24Å; S45-Q49 PolarHBondContact O-N 2.73Å
46	K	96.9	Very high	96.5	Very high	168 Å²	168	57.6 Å²	57.6	73%	0.73	29%	0.29	S	S	*	.	H	α-helix	trans	-62	-28.9	-175	-67.6	-175.9	179.5	-179.7	0	113	E44 R50	E44-K46 PolarHBondContact O-N 2.8Å; K46-R50 WeakPolarHBondContact O-CB 2.94Å; K46-R50 VanDerWaalsContact O-CG 3.32Å; K46-R50 WeakPolarHBondContact O-CG 2.94Å; K46-R50 PolarHBondContact O-N 2.85Å; K46-R50 PolarHBondContact O-NE 3.21Å
47	D	96.3	Very high	96.8	Very high	33 Å²	33	59.5 Å²	59.5	18%	0.176	29%	0.285	C	S	.	.	H	α-helix	trans	-72.3	-46.8	175.5	54.2	-32.3	0	0	0	111.3	R41 S45 Q49 R50 A51 F87	R41-D47 IonicContact CZ-OD2 2.76Å; R41-D47 IonicContact NH1-OD2 3.73Å; R41-D47 PolarHBondContact NH1-OD2 2.8Å; S45-D47 WeakPolarHBondContact CB-OD1 3.33Å; S45-D47 PolarHBondContact O-N 2.82Å; S45-D47 PolarHBondContact OG-OD1 2.74Å; D47-Q49 PolarHBondContact O-N 2.81Å; D47-R50 PolarHBondContact O-N 2.84Å; D47-A51 WeakPolarHBondContact O-CB 3.49Å; D47-A51 PolarHBondContact O-N 2.78Å; D47-F87 HydrophobicContact CB-CE1 4.29Å; D47-F87 HydrophobicContact CB-CZ 3.94Å
48	V	97.9	Very high	97	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-45.4	174.1	169.7	0	0	0	0	111.3	R41 S45 R50 A51 A52 V74 A77 F87	R41-V48 HydrophobicContact CB-CG2 3.72Å; R41-V48 HydrophobicContact CG-CG2 4.36Å; S45-V48 PolarHBondContact O-N 2.95Å; S45-V48 VanDerWaalsContact OG-CB 3.25Å; S45-V48 WeakPolarHBondContact OG-CB 3.4Å; S45-V48 WeakPolarHBondContact OG-CG2 3.38Å; V48-R50 PolarHBondContact O-N 2.86Å; V48-A51 PolarHBondContact O-N 2.87Å; V48-A52 VanDerWaalsContact O-CB 3.31Å; V48-A52 WeakPolarHBondContact O-CB 3.29Å; V48-A52 PolarHBondContact O-N 2.68Å; V48-V74 HydrophobicContact CG1-CG1 4.13Å; V48-A77 HydrophobicContact CB-CB 4.35Å; V48-A77 HydrophobicContact CG1-CB 3.51Å; V48-A77 HydrophobicContact CG2-CB 3.81Å; V48-F87 HydrophobicContact CG2-CD1 4.27Å; V48-F87 HydrophobicContact CG2-CE1 4.25Å
49	Q	98.1	Very high	97	Very high	46 Å²	46	56 Å²	56	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-41.4	-179.9	-71.7	-65.6	-32.6	0	0	112.2	L43 S45 D47 Q53	L43-Q49 PolarHBondContact O-NE2 3Å; S45-Q49 WeakPolarHBondContact O-CG 3.24Å; S45-Q49 PolarHBondContact O-N 2.73Å; D47-Q49 PolarHBondContact O-N 2.81Å; Q49-Q53 WeakPolarHBondContact O-CB 3.42Å; Q49-Q53 WeakPolarHBondContact O-CG 2.77Å; Q49-Q53 PolarHBondContact O-N 3.21Å
50	R	98	Very high	97	Very high	109 Å²	109	56.1 Å²	56.1	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-66.3	-45.2	175.4	-81.4	-178.3	-77.8	150.8	-5.3	112.2	K46 D47 V48 A52 Q53 Y54 D129	K46-R50 WeakPolarHBondContact O-CB 2.94Å; K46-R50 VanDerWaalsContact O-CG 3.32Å; K46-R50 WeakPolarHBondContact O-CG 2.94Å; K46-R50 PolarHBondContact O-N 2.85Å; K46-R50 PolarHBondContact O-NE 3.21Å; D47-R50 PolarHBondContact O-N 2.84Å; V48-R50 PolarHBondContact O-N 2.86Å; R50-A52 VanDerWaalsContact C-N 3.34Å; R50-A52 PolarHBondContact O-N 3.19Å; R50-Q53 PolarHBondContact O-N 3.12Å; R50-Y54 WeakPolarHBondContact O-CB 3.3Å; R50-Y54 PolarHBondContact O-N 3.09Å; R50-D129 IonicContact NH1-OD1 3.86Å; R50-D129 IonicContact NH1-OD2 2.82Å
51	A	98.5	Very high	96.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-40.9	177.3	0	0	0	0	0	112	D47 V48 A55 F87 I89 V122	D47-A51 WeakPolarHBondContact O-CB 3.49Å; D47-A51 PolarHBondContact O-N 2.78Å; V48-A51 PolarHBondContact O-N 2.87Å; A51-A55 WeakPolarHBondContact O-CB 3.45Å; A51-A55 PolarHBondContact O-N 2.82Å; A51-F87 HydrophobicContact CB-CB 4.44Å; A51-F87 HydrophobicContact CB-CD2 3.85Å; A51-F87 HydrophobicContact CB-CE2 4.24Å; A51-F87 HydrophobicContact CB-CG 4.07Å; A51-I89 HydrophobicContact CB-CD1 3.67Å; A51-V122 HydrophobicContact CB-CB 4.36Å; A51-V122 HydrophobicContact CB-CG1 4.14Å
52	A	98.4	Very high	96.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.6	-45.9	175.6	0	0	0	0	0	112	V48 R50 Y54 A55 V56 L71 V74 I89	V48-A52 VanDerWaalsContact O-CB 3.31Å; V48-A52 WeakPolarHBondContact O-CB 3.29Å; V48-A52 PolarHBondContact O-N 2.68Å; R50-A52 VanDerWaalsContact C-N 3.34Å; R50-A52 PolarHBondContact O-N 3.19Å; A52-Y54 PolarHBondContact O-N 3.08Å; A52-A55 PolarHBondContact O-N 2.93Å; A52-V56 WeakPolarHBondContact O-CG2 3.27Å; A52-V56 PolarHBondContact O-N 3.48Å; A52-L71 HydrophobicContact CB-CD2 3.87Å; A52-V74 HydrophobicContact CB-CG2 3.97Å; A52-I89 HydrophobicContact CB-CD1 4.23Å; A52-I89 HydrophobicContact CB-CG2 4.16Å
53	Q	97.7	Very high	96.6	Very high	107 Å²	107	54.8 Å²	54.8	50%	0.5	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-45.1	177	-74.7	169.9	10.8	0	0	111.8	Q49 R50 A55 V56 E57 L71	Q49-Q53 WeakPolarHBondContact O-CB 3.42Å; Q49-Q53 WeakPolarHBondContact O-CG 2.77Å; Q49-Q53 PolarHBondContact O-N 3.21Å; R50-Q53 PolarHBondContact O-N 3.12Å; Q53-A55 VanDerWaalsContact C-N 3.33Å; Q53-A55 PolarHBondContact O-N 3.35Å; Q53-V56 PolarHBondContact O-N 2.95Å; Q53-E57 PolarHBondContact O-N 3.37Å; Q53-L71 HydrophobicContact CG-CD2 4.44Å
54	Y	98.3	Very high	96.4	Very high	59 Å²	59	60.6 Å²	60.6	23%	0.231	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-44.4	174.4	176.7	-91.3	0	0	0	111.5	R50 A52 V56 E57 M58 V122 H131 L133	R50-Y54 WeakPolarHBondContact O-CB 3.3Å; R50-Y54 PolarHBondContact O-N 3.09Å; A52-Y54 PolarHBondContact O-N 3.08Å; Y54-V56 VanDerWaalsContact C-N 3.32Å; Y54-V56 PolarHBondContact O-N 3.34Å; Y54-E57 WeakPolarHBondContact O-CB 3.35Å; Y54-E57 PolarHBondContact O-N 3.35Å; Y54-M58 HydrophobicContact CD1-CG 4.16Å; Y54-M58 HydrophobicContact CE1-CG 3.61Å; Y54-M58 HydrophobicContact CE2-CG 4.22Å; Y54-M58 HydrophobicContact CE2-SD 4.36Å; Y54-M58 WeakPolarHBondContact O-CG 3.41Å; Y54-M58 PolarHBondContact O-N 3.21Å; Y54-V122 HydrophobicContact CD1-CG1 4.16Å; Y54-H131 HydrophobicContact CD1-CB 3.56Å; Y54-H131 HydrophobicContact CD2-CB 3.85Å; Y54-H131 HydrophobicContact CE1-CB 3.79Å; Y54-H131 HydrophobicContact CE2-CB 4.04Å; Y54-H131 HydrophobicContact CG-CB 3.59Å; Y54-H131 VanDerWaalsContact CZ-O 3.23Å; Y54-H131 PolarHBondContact OH-O 2.92Å; Y54-L133 HydrophobicContact CE1-CB 4.15Å
55	A	98.5	Very high	96.3	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-38.7	176.9	0	0	0	0	0	112.8	A51 A52 Q53 M58 Y59 F120 V122 L133	A51-A55 WeakPolarHBondContact O-CB 3.45Å; A51-A55 PolarHBondContact O-N 2.82Å; A52-A55 PolarHBondContact O-N 2.93Å; Q53-A55 VanDerWaalsContact C-N 3.33Å; Q53-A55 PolarHBondContact O-N 3.35Å; A55-M58 PolarHBondContact O-N 2.66Å; A55-Y59 VanDerWaalsContact O-CB 3.32Å; A55-Y59 WeakPolarHBondContact O-CB 3.36Å; A55-Y59 PolarHBondContact O-N 3.47Å; A55-F120 HydrophobicContact CB-CB 3.93Å; A55-F120 HydrophobicContact CB-CD1 4Å; A55-F120 HydrophobicContact CB-CD2 3.59Å; A55-F120 HydrophobicContact CB-CE1 4.38Å; A55-F120 HydrophobicContact CB-CE2 4Å; A55-F120 HydrophobicContact CB-CG 3.58Å; A55-F120 HydrophobicContact CB-CZ 4.38Å; A55-V122 HydrophobicContact CB-CG2 3.83Å; A55-L133 HydrophobicContact CB-CD1 4.16Å
56	V	97.6	Very high	96.1	Very high	10 Å²	10	62.6 Å²	62.6	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-68.2	-37.8	175.5	174	0	0	0	0	111.7	A52 Q53 Y54 Y59 N60 F69 L71 L93 F120	A52-V56 WeakPolarHBondContact O-CG2 3.27Å; A52-V56 PolarHBondContact O-N 3.48Å; Q53-V56 PolarHBondContact O-N 2.95Å; Y54-V56 VanDerWaalsContact C-N 3.32Å; Y54-V56 PolarHBondContact O-N 3.34Å; V56-Y59 WeakPolarHBondContact O-CB 3.47Å; V56-Y59 PolarHBondContact O-N 3.45Å; V56-N60 PolarHBondContact O-N 2.86Å; V56-N60 PolarHBondContact O-ND2 2.96Å; V56-F69 WeakPolarHBondContact CG1-O 3.14Å; V56-L71 HydrophobicContact CG2-CB 4.07Å; V56-L71 HydrophobicContact CG2-CD1 4.08Å; V56-L93 HydrophobicContact CG1-CD2 4.41Å; V56-L93 HydrophobicContact CG2-CD1 3.89Å; V56-L93 HydrophobicContact CG2-CD2 4.04Å; V56-L93 HydrophobicContact CG2-CG 3.89Å; V56-F120 HydrophobicContact CG2-CE2 4.39Å
57	E	96.3	Very high	96	Very high	92 Å²	92	57.1 Å²	57.1	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-60.2	-48.5	173.3	-170.7	-169.5	151.3	0	0	111.1	Q53 Y54 N60 K61	Q53-E57 PolarHBondContact O-N 3.37Å; Y54-E57 WeakPolarHBondContact O-CB 3.35Å; Y54-E57 PolarHBondContact O-N 3.35Å; E57-N60 PolarHBondContact O-N 3.45Å; E57-K61 HydrophobicContact CG-CD 4.45Å; E57-K61 WeakPolarHBondContact O-CG 3.39Å; E57-K61 PolarHBondContact O-N 3.46Å; E57-K61 WeakPolarHBondContact OE1-CE 3.42Å; E57-K61 IonicContact OE1-NZ 3.81Å; E57-K61 PolarHBondContact OE1-NZ 2.94Å
58	M	97.6	Very high	96	Very high	40 Å²	40	56.3 Å²	56.3	20%	0.197	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-38.1	177	-65.6	-49.9	-57.7	0	0	112.1	Y54 A55 N60 K61 D62 L133	Y54-M58 HydrophobicContact CD1-CG 4.16Å; Y54-M58 HydrophobicContact CE1-CG 3.61Å; Y54-M58 HydrophobicContact CE2-CG 4.22Å; Y54-M58 HydrophobicContact CE2-SD 4.36Å; Y54-M58 WeakPolarHBondContact O-CG 3.41Å; Y54-M58 PolarHBondContact O-N 3.21Å; A55-M58 PolarHBondContact O-N 2.66Å; M58-N60 VanDerWaalsContact C-N 3.33Å; M58-N60 PolarHBondContact O-N 3.35Å; M58-K61 HydrophobicContact CE-CD 4.39Å; M58-K61 PolarHBondContact O-N 3.15Å; M58-K61 HydrophobicContact SD-CD 3.92Å; M58-D62 WeakPolarHBondContact O-CB 3.06Å; M58-D62 PolarHBondContact O-N 3.09Å; M58-L133 HydrophobicContact CB-CB 4.14Å; M58-L133 HydrophobicContact CB-CD2 3.59Å; M58-L133 HydrophobicContact CG-CB 4.2Å
59	Y	96.5	Very high	95.9	Very high	23 Å²	23	56.4 Å²	56.4	9%	0.09	26%	0.26	C	S	.	.	H	α-helix	trans	-57	-45.9	172.4	176.3	-90.2	0	0	0	111.8	A55 V56 D62 S63 F69 L93 F120 K136 C138	A55-Y59 VanDerWaalsContact O-CB 3.32Å; A55-Y59 WeakPolarHBondContact O-CB 3.36Å; A55-Y59 PolarHBondContact O-N 3.47Å; V56-Y59 WeakPolarHBondContact O-CB 3.47Å; V56-Y59 PolarHBondContact O-N 3.45Å; Y59-D62 PolarHBondContact O-N 3.47Å; Y59-S63 WeakPolarHBondContact O-CB 3.24Å; Y59-S63 PolarHBondContact O-N 2.93Å; Y59-F69 HydrophobicContact CD1-CB 4.19Å; Y59-F69 HydrophobicContact CD1-CD2 4.49Å; Y59-F69 HydrophobicContact CD1-CG 4.43Å; Y59-F69 HydrophobicContact CE1-CB 3.96Å; Y59-F69 HydrophobicContact CE1-CD1 4.32Å; Y59-F69 AromaticContact CE1-CD2 3.66Å; Y59-F69 HydrophobicContact CE1-CD2 3.66Å; Y59-F69 HydrophobicContact CE1-CE2 4.19Å; Y59-F69 AromaticContact CE1-CG 3.72Å; Y59-F69 HydrophobicContact CE1-CG 3.72Å; Y59-L93 HydrophobicContact CD1-CD2 3.66Å; Y59-L93 HydrophobicContact CD2-CD2 4.43Å; Y59-L93 HydrophobicContact CE1-CD2 3.96Å; Y59-L93 HydrophobicContact CG-CD2 3.92Å; Y59-F120 HydrophobicContact CD2-CE1 4.43Å; Y59-K136 HydrophobicContact CD2-CD 4.13Å; Y59-C138 HydrophobicContact CE2-CB 4.35Å; Y59-C138 VanDerWaalsContact CE2-SG 3.54Å
60	N	95.4	Very high	95.7	Very high	8 Å²	8	57.2 Å²	57.2	4%	0.043	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-37.7	178.2	-78.7	-49.5	0	0	0	112.8	V56 E57 M58 L68 F69 K100	V56-N60 PolarHBondContact O-N 2.86Å; V56-N60 PolarHBondContact O-ND2 2.96Å; E57-N60 PolarHBondContact O-N 3.45Å; M58-N60 VanDerWaalsContact C-N 3.33Å; M58-N60 PolarHBondContact O-N 3.35Å; N60-L68 HydrophobicContact CB-CD2 3.93Å; N60-F69 PolarHBondContact ND2-O 3.2Å; N60-F69 PolarHBondContact OD1-N 2.99Å; N60-K100 WeakPolarHBondContact O-CE 3.15Å; N60-K100 PolarHBondContact O-NZ 3.28Å
61	K	94.3	Very high	95.7	Very high	129 Å²	129	53.7 Å²	53.7	56%	0.561	25%	0.251	S	S	*	.	H	α-helix	trans	-64.2	-42.1	175.7	-75.6	170.2	169.6	171	0	112.1	E57 M58	E57-K61 HydrophobicContact CG-CD 4.45Å; E57-K61 WeakPolarHBondContact O-CG 3.39Å; E57-K61 PolarHBondContact O-N 3.46Å; E57-K61 WeakPolarHBondContact OE1-CE 3.42Å; E57-K61 IonicContact OE1-NZ 3.81Å; E57-K61 PolarHBondContact OE1-NZ 2.94Å; M58-K61 HydrophobicContact CE-CD 4.39Å; M58-K61 PolarHBondContact O-N 3.15Å; M58-K61 HydrophobicContact SD-CD 3.92Å
62	D	93.4	Very high	95.6	Very high	74 Å²	74	56.6 Å²	56.6	40%	0.396	27%	0.269	S	S	.	.	H	α-helix	trans	-85.1	-26.7	-175.2	-62.3	-15.1	0	0	0	113.4	M58 Y59 K136	M58-D62 WeakPolarHBondContact O-CB 3.06Å; M58-D62 PolarHBondContact O-N 3.09Å; Y59-D62 PolarHBondContact O-N 3.47Å; D62-K136 IonicContact OD2-NZ 3.87Å; D62-K136 PolarHBondContact OD2-NZ 2.83Å
63	S	91.9	Very high	95.5	Very high	19 Å²	19	59 Å²	59	13%	0.133	29%	0.286	C	S	.	.			trans	-65.6	143.8	-178.2	166.6	0	0	0	0	111.3	Y59 D65 K100	Y59-S63 WeakPolarHBondContact O-CB 3.24Å; Y59-S63 PolarHBondContact O-N 2.93Å; S63-D65 VanDerWaalsContact C-N 3.32Å; S63-D65 VanDerWaalsContact OG-CB 3.32Å; S63-D65 WeakPolarHBondContact OG-CB 3.05Å; S63-D65 PolarHBondContact OG-N 3.5Å; S63-D65 PolarHBondContact OG-OD2 2.88Å; S63-K100 PolarHBondContact O-NZ 3.01Å
64	Q	92.3	Very high	95.5	Very high	183 Å²	183	54.5 Å²	54.5	86%	0.855	27%	0.266	S	S	*	.			trans	-85.9	-3.7	172.4	-59.3	-58.2	-59.7	0	0	113
65	D	91.9	Very high	95.5	Very high	53 Å²	53	54.9 Å²	54.9	28%	0.283	28%	0.276	S	S	.	.			trans	-62	145.5	175	-65.9	-62.2	0	0	0	110.6	S63 F69 R95 K100	S63-D65 VanDerWaalsContact C-N 3.32Å; S63-D65 VanDerWaalsContact OG-CB 3.32Å; S63-D65 WeakPolarHBondContact OG-CB 3.05Å; S63-D65 PolarHBondContact OG-N 3.5Å; S63-D65 PolarHBondContact OG-OD2 2.88Å; D65-F69 HydrophobicContact CB-CE2 4.05Å; D65-R95 IonicContact OD1-NH1 2.74Å; D65-R95 IonicContact OD1-NH2 3.1Å; D65-K100 WeakPolarHBondContact O-CD 3.35Å; D65-K100 WeakPolarHBondContact O-CE 3.32Å; D65-K100 PolarHBondContact O-NZ 2.86Å
66	K	93.1	Very high	95.5	Very high	161 Å²	161	56.5 Å²	56.5	70%	0.7	29%	0.287	S	S	*	.	S	Bend	trans	-77.5	-34.1	177.9	-64.4	-179.7	-178.3	176.7	0	111.2	L99 K100	K66-L99 HydrophobicContact CB-CD2 4.16Å; K66-L99 WeakPolarHBondContact O-CA 3.32Å; K66-K100 PolarHBondContact O-N 3.23Å
67	E	94.3	Very high	95.5	Very high	53 Å²	53	56 Å²	56	25%	0.248	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	154.8	178.7	-58.7	76.3	-163.5	0	0	112.1	R95 T96 C98 L99	E67-R95 HydrophobicContact CB-CG 4.06Å; E67-R95 IonicContact OE2-NH1 2.74Å; E67-R95 PolarHBondContact OE2-NH1 3.3Å; E67-T96 WeakPolarHBondContact CB-O 3.44Å; E67-C98 CarbonylContact C-O 3.57Å; E67-C98 VanDerWaalsContact CA-O 3.24Å; E67-C98 WeakPolarHBondContact CA-O 3.49Å; E67-L99 HydrophobicContact CG-CD2 4.23Å
68	L	95.1	Very high	95.6	Very high	17 Å²	17	55 Å²	55	9%	0.089	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	149.8	171.4	-68.9	165.4	0	0	0	110.6	N60 T96 C98 K100 I106	N60-L68 HydrophobicContact CB-CD2 3.93Å; L68-T96 VanDerWaalsContact O-CB 3.32Å; L68-T96 WeakPolarHBondContact O-CB 3.33Å; L68-T96 WeakPolarHBondContact O-CG2 3.41Å; L68-T96 PolarHBondContact O-N 3.5Å; L68-T96 PolarHBondContact O-OG1 3.01Å; L68-C98 HydrophobicContact CD1-CB 4.23Å; L68-C98 PolarHBondContact N-O 3.4Å; L68-K100 HydrophobicContact CD2-CB 4.48Å; L68-K100 HydrophobicContact CD2-CG 3.56Å; L68-K100 HydrophobicContact CG-CG 3.95Å; L68-I106 HydrophobicContact CD1-CD1 4.42Å; L68-I106 HydrophobicContact CD1-CG1 3.89Å; L68-I106 HydrophobicContact CD2-CD1 4.42Å
69	F	95.8	Very high	95.6	Very high	2 Å²	2	53 Å²	53	1%	0.009	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	142.5	169.8	-74.8	-103.4	0	0	0	110.5	V56 Y59 N60 D65 L93 G94 R95 V116	V56-F69 WeakPolarHBondContact CG1-O 3.14Å; Y59-F69 HydrophobicContact CD1-CB 4.19Å; Y59-F69 HydrophobicContact CD1-CD2 4.49Å; Y59-F69 HydrophobicContact CD1-CG 4.43Å; Y59-F69 HydrophobicContact CE1-CB 3.96Å; Y59-F69 HydrophobicContact CE1-CD1 4.32Å; Y59-F69 AromaticContact CE1-CD2 3.66Å; Y59-F69 HydrophobicContact CE1-CD2 3.66Å; Y59-F69 HydrophobicContact CE1-CE2 4.19Å; Y59-F69 AromaticContact CE1-CG 3.72Å; Y59-F69 HydrophobicContact CE1-CG 3.72Å; N60-F69 PolarHBondContact ND2-O 3.2Å; N60-F69 PolarHBondContact OD1-N 2.99Å; D65-F69 HydrophobicContact CB-CE2 4.05Å; F69-L93 HydrophobicContact CB-CB 4.27Å; F69-L93 HydrophobicContact CB-CD2 4.14Å; F69-L93 HydrophobicContact CD1-CB 4.12Å; F69-G94 CarbonylContact C-O 3.55Å; F69-G94 VanDerWaalsContact CA-O 3.3Å; F69-G94 WeakPolarHBondContact CA-O 3.26Å; F69-R95 HydrophobicContact CD1-CB 4.25Å; F69-R95 HydrophobicContact CE1-CB 3.79Å; F69-R95 HydrophobicContact CE1-CG 4.42Å; F69-R95 HydrophobicContact CE2-CG 4.49Å; F69-R95 HydrophobicContact CZ-CB 4.04Å; F69-R95 HydrophobicContact CZ-CG 4.17Å; F69-V116 HydrophobicContact CD1-CG2 4.04Å; F69-V116 HydrophobicContact CE1-CG1 4.13Å; F69-V116 HydrophobicContact CE1-CG2 3.98Å
70	K	95.5	Very high	95.6	Very high	62 Å²	62	54.1 Å²	54.1	27%	0.27	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	144.3	178.6	179.1	175.7	177	178.2	0	110.1	V72 L93 G94 T96 I106 K107 L111	K70-V72 PolarHBondContact O-N 2.97Å; K70-L93 CarbonylContact O-C 3.53Å; K70-L93 VanDerWaalsContact O-CA 3.29Å; K70-L93 WeakPolarHBondContact O-CA 3.07Å; K70-G94 PolarHBondContact N-O 3.37Å; K70-G94 PolarHBondContact O-N 3.06Å; K70-T96 HydrophobicContact CB-CG2 3.79Å; K70-I106 HydrophobicContact CB-CG2 4.12Å; K70-I106 HydrophobicContact CG-CG2 4.25Å; K70-K107 PolarHBondContact NZ-O 2.96Å; K70-L111 HydrophobicContact CB-CD2 4.09Å; K70-L111 HydrophobicContact CD-CD2 4.38Å
71	L	96.8	Very high	95.7	Very high	35 Å²	35	55.9 Å²	55.9	18%	0.183	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	119.8	171.3	-172.4	63.5	0	0	0	109.5	A52 Q53 V56 V74 A91 L93	A52-L71 HydrophobicContact CB-CD2 3.87Å; Q53-L71 HydrophobicContact CG-CD2 4.44Å; V56-L71 HydrophobicContact CG2-CB 4.07Å; V56-L71 HydrophobicContact CG2-CD1 4.08Å; L71-V74 HydrophobicContact CD1-CG2 4.16Å; L71-V74 HydrophobicContact CD2-CG2 4.12Å; L71-A91 HydrophobicContact CD1-CB 3.78Å; L71-L93 HydrophobicContact CD1-CD1 4.37Å
72	V	96.1	Very high	95.7	Very high	61 Å²	61	53 Å²	53	37%	0.37	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-48.3	175.6	173.7	0	0	0	0	110.2	K70 I92 L111	K70-V72 PolarHBondContact O-N 2.97Å; V72-I92 HydrophobicContact CB-CB 4.46Å; V72-I92 HydrophobicContact CB-CG2 4.27Å; V72-I92 WeakPolarHBondContact CB-O 3.09Å; V72-I92 PolarHBondContact N-O 3.39Å; V72-L111 HydrophobicContact CG2-CD1 4.09Å; V72-L111 HydrophobicContact CG2-CD2 4.24Å
73	S	96.8	Very high	95.7	Very high	51 Å²	51	55.4 Å²	55.4	36%	0.357	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	164	178.8	63.1	0	0	0	0	112.1	A91 I92	S73-A91 WeakPolarHBondContact O-CA 3.24Å; S73-I92 PolarHBondContact N-O 3.45Å; S73-I92 PolarHBondContact O-N 2.82Å; S73-I92 WeakPolarHBondContact OG-CG1 3.4Å
74	V	98.4	Very high	96	Very high	12 Å²	12	57 Å²	57	7%	0.073	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	94.1	172.8	178.5	0	0	0	0	108.2	L43 V48 A52 L71 S76 A77 I89 D90	L43-V74 WeakPolarHBondContact CD1-O 3.3Å; L43-V74 HydrophobicContact CD2-CG1 4.23Å; V48-V74 HydrophobicContact CG1-CG1 4.13Å; A52-V74 HydrophobicContact CB-CG2 3.97Å; L71-V74 HydrophobicContact CD1-CG2 4.16Å; L71-V74 HydrophobicContact CD2-CG2 4.12Å; V74-S76 VanDerWaalsContact C-N 3.29Å; V74-S76 PolarHBondContact O-N 3.25Å; V74-A77 HydrophobicContact CG1-CB 4.23Å; V74-I89 HydrophobicContact CG1-CG2 3.75Å; V74-I89 HydrophobicContact CG2-CG2 4.47Å; V74-D90 WeakPolarHBondContact CA-O 3.5Å
75	P	97.6	Very high	96.3	Very high	68 Å²	68	50.1 Å²	50.1	44%	0.442	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-25.4	-178.9	-26.8	36.4	0	0	0	114.9	D90 I92	P75-D90 WeakPolarHBondContact CD-O 3.42Å; P75-I92 HydrophobicContact CG-CD1 4.21Å; P75-I92 HydrophobicContact CG-CG1 3.72Å
76	S	98.3	Very high	96.6	Very high	33 Å²	33	48.3 Å²	48.3	23%	0.231	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	140.1	-176.4	175.5	0	0	0	0	110.7	V74 D90	V74-S76 VanDerWaalsContact C-N 3.29Å; V74-S76 PolarHBondContact O-N 3.25Å; S76-D90 PolarHBondContact O-N 3.44Å
77	A	98.4	Very high	96.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	129.3	175.4	0	0	0	0	0	110.6	R41 L43 V48 V74 K88	R41-A77 HydrophobicContact CB-CB 4.38Å; R41-A77 PolarHBondContact N-O 3.23Å; L43-A77 HydrophobicContact CD2-CB 4.09Å; V48-A77 HydrophobicContact CB-CB 4.35Å; V48-A77 HydrophobicContact CG1-CB 3.51Å; V48-A77 HydrophobicContact CG2-CB 3.81Å; V74-A77 HydrophobicContact CG1-CB 4.23Å; A77-K88 WeakPolarHBondContact CA-O 3.47Å
78	K	97.9	Very high	97	Very high	70 Å²	70	41.9 Å²	41.9	30%	0.304	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.2	172.9	-65.9	176.4	173.5	179	0	109.8	W38 S39 E40 F87 K88	W38-K78 HydrophobicContact CE3-CB 3.78Å; W38-K78 HydrophobicContact CZ3-CB 4.36Å; S39-K78 CarbonylContact O-C 3.55Å; S39-K78 VanDerWaalsContact O-CA 3.26Å; S39-K78 WeakPolarHBondContact O-CA 3.32Å; E40-K78 WeakPolarHBondContact OE1-CE 3.16Å; E40-K78 IonicContact OE1-NZ 2.63Å; E40-K78 PolarHBondContact OE1-NZ 2.71Å; E40-K78 VanDerWaalsContact OE2-CE 3.27Å; E40-K78 WeakPolarHBondContact OE2-CE 3.49Å; E40-K78 VanDerWaalsContact OE2-CG 3.3Å; E40-K78 WeakPolarHBondContact OE2-CG 3.09Å; K78-F87 CarbonylContact O-C 3.57Å; K78-F87 WeakPolarHBondContact O-CA 3.06Å; K78-K88 HydrophobicContact CB-CB 4.46Å; K78-K88 PolarHBondContact N-O 2.94Å; K78-K88 PolarHBondContact O-N 3.42Å
79	S	97.6	Very high	97.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	155.2	169.5	76.9	0	0	0	0	112.3	W38 S39 R41 N86	W38-S79 WeakPolarHBondContact CA-O 3.25Å; S39-S79 PolarHBondContact N-O 2.82Å; S39-S79 PolarHBondContact O-N 2.91Å; S39-S79 PolarHBondContact OG-O 2.91Å; S39-S79 PolarHBondContact OG-OG 2.92Å; R41-S79 PolarHBondContact NE-OG 2.9Å; R41-S79 PolarHBondContact NH2-OG 2.78Å; S79-N86 CarbonylContact C-O 3.56Å; S79-N86 WeakPolarHBondContact CA-O 3.31Å
80	Q	97.4	Very high	97.4	Very high	45 Å²	45	42.4 Å²	42.4	21%	0.21	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	132.4	166.6	-178.6	-178.9	35.2	0	0	108.4	G36 W38 T82 N86	G36-Q80 WeakPolarHBondContact O-CG 3.46Å; G36-Q80 PolarHBondContact O-NE2 2.89Å; W38-Q80 HydrophobicContact CD2-CB 3.82Å; W38-Q80 HydrophobicContact CE3-CB 3.79Å; W38-Q80 HydrophobicContact CG-CB 4.43Å; W38-Q80 HydrophobicContact CH2-CB 4.07Å; W38-Q80 HydrophobicContact CZ2-CB 4.06Å; W38-Q80 HydrophobicContact CZ3-CB 3.94Å; Q80-T82 HydrophobicContact CG-CG2 4.27Å; Q80-N86 HydrophobicContact CB-CB 4.36Å; Q80-N86 PolarHBondContact N-O 2.87Å; Q80-N86 PolarHBondContact O-N 3.41Å
81	V	96.3	Very high	97.5	Very high	46 Å²	46	39.5 Å²	39.5	28%	0.279	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.2	177.5	-174.6	0	0	0	0	109.2	L35	L35-V81 HydrophobicContact CB-CB 3.99Å; L35-V81 HydrophobicContact CB-CG2 3.95Å; L35-V81 HydrophobicContact CD2-CG2 4.36Å; L35-V81 WeakPolarHBondContact O-CB 3.21Å; L35-V81 PolarHBondContact O-N 3.36Å
82	T	94.6	Very high	97.5	Very high	68 Å²	68	38.9 Å²	38.9	42%	0.417	21%	0.214	S	C	.	.	S	Bend	trans	-121.6	-138.6	170.9	65.4	0	0	0	0	108.3	Q80 M84	Q80-T82 HydrophobicContact CG-CG2 4.27Å; T82-M84 PolarHBondContact N-O 2.69Å; T82-M84 PolarHBondContact O-N 2.95Å; T82-M84 PolarHBondContact OG1-N 3.26Å; T82-M84 VanDerWaalsContact OG1-N 3.14Å; T82-M84 PolarHBondContact OG1-O 2.85Å
83	N	94.6	Very high	97.6	Very high	124 Å²	124	36 Å²	36	66%	0.663	20%	0.197	S	C	*	.	S	Bend	trans	-66.5	-12.1	158.8	64.8	-44.6	0	0	0	113.3
84	M	97.3	Very high	97.6	Very high	54 Å²	54	33.6 Å²	33.6	27%	0.266	18%	0.18	S	C	.	.	S	Bend	trans	-128.2	166.9	173.6	-60.6	-65	-180	0	0	109.4	T82 N125	T82-M84 PolarHBondContact N-O 2.69Å; T82-M84 PolarHBondContact O-N 2.95Å; T82-M84 PolarHBondContact OG1-N 3.26Å; T82-M84 VanDerWaalsContact OG1-N 3.14Å; T82-M84 PolarHBondContact OG1-O 2.85Å; M84-N125 HydrophobicContact CE-CB 4.21Å; M84-N125 VanDerWaalsContact SD-CA 3.53Å; M84-N125 HydrophobicContact SD-CB 3.57Å; M84-N125 VanDerWaalsContact SD-CB 3.57Å
85	I	97.7	Very high	97.5	Very high	38 Å²	38	34.8 Å²	34.8	20%	0.195	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	111	166.4	-54.8	172.9	0	0	0	107.6	F87 T123 L124	I85-F87 HydrophobicContact CB-CE2 4.23Å; I85-F87 HydrophobicContact CB-CZ 4.47Å; I85-F87 HydrophobicContact CG2-CD2 4.35Å; I85-F87 HydrophobicContact CG2-CE1 4.14Å; I85-F87 HydrophobicContact CG2-CE2 3.6Å; I85-F87 HydrophobicContact CG2-CZ 3.47Å; I85-F87 VanDerWaalsContact CG2-CZ 3.47Å; I85-T123 CarbonylContact O-C 3.48Å; I85-L124 HydrophobicContact CB-CB 4.21Å; I85-L124 HydrophobicContact CD1-CD2 4.23Å; I85-L124 PolarHBondContact N-O 3.35Å; I85-L124 PolarHBondContact O-N 2.81Å
86	N	98.4	Very high	97.4	Very high	15 Å²	15	31.6 Å²	31.6	8%	0.08	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.7	179.6	-51.8	-35.3	0	0	0	109.1	W38 S79 Q80 F121 V122 T123	W38-N86 HydrophobicContact CH2-CB 3.74Å; W38-N86 HydrophobicContact CZ2-CB 4.41Å; W38-N86 HydrophobicContact CZ3-CB 4.4Å; S79-N86 CarbonylContact C-O 3.56Å; S79-N86 WeakPolarHBondContact CA-O 3.31Å; Q80-N86 HydrophobicContact CB-CB 4.36Å; Q80-N86 PolarHBondContact N-O 2.87Å; Q80-N86 PolarHBondContact O-N 3.41Å; N86-F121 HydrophobicContact CB-CE2 4.41Å; N86-F121 HydrophobicContact CB-CZ 3.95Å; N86-V122 CarbonylContact C-O 3.55Å; N86-T123 WeakPolarHBondContact OD1-CG2 3.18Å
87	F	98.6	Very high	97.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.6	174.7	-62.3	-84.1	0	0	0	110	D47 V48 A51 K78 I85 I89 F121 V122 L124	D47-F87 HydrophobicContact CB-CE1 4.29Å; D47-F87 HydrophobicContact CB-CZ 3.94Å; V48-F87 HydrophobicContact CG2-CD1 4.27Å; V48-F87 HydrophobicContact CG2-CE1 4.25Å; A51-F87 HydrophobicContact CB-CB 4.44Å; A51-F87 HydrophobicContact CB-CD2 3.85Å; A51-F87 HydrophobicContact CB-CE2 4.24Å; A51-F87 HydrophobicContact CB-CG 4.07Å; K78-F87 CarbonylContact O-C 3.57Å; K78-F87 WeakPolarHBondContact O-CA 3.06Å; I85-F87 HydrophobicContact CB-CE2 4.23Å; I85-F87 HydrophobicContact CB-CZ 4.47Å; I85-F87 HydrophobicContact CG2-CD2 4.35Å; I85-F87 HydrophobicContact CG2-CE1 4.14Å; I85-F87 HydrophobicContact CG2-CE2 3.6Å; I85-F87 HydrophobicContact CG2-CZ 3.47Å; I85-F87 VanDerWaalsContact CG2-CZ 3.47Å; F87-I89 HydrophobicContact CB-CD1 3.88Å; F87-I89 HydrophobicContact CB-CG1 3.95Å; F87-I89 HydrophobicContact CG-CD1 4.5Å; F87-F121 WeakPolarHBondContact O-CA 3.41Å; F87-V122 HydrophobicContact CB-CB 4.41Å; F87-V122 PolarHBondContact N-O 3.42Å; F87-V122 PolarHBondContact O-N 3.31Å; F87-L124 HydrophobicContact CE2-CB 3.9Å; F87-L124 HydrophobicContact CE2-CD2 4.27Å
88	K	98.6	Very high	97	Very high	78 Å²	78	37 Å²	37	34%	0.339	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	113.3	164.1	-178.2	177.1	-69.2	-169.9	0	107.4	W38 A77 K78 Q119 F120	W38-K88 HydrophobicContact CE3-CB 4.43Å; W38-K88 HydrophobicContact CH2-CB 4.16Å; W38-K88 HydrophobicContact CZ3-CB 3.86Å; A77-K88 WeakPolarHBondContact CA-O 3.47Å; K78-K88 HydrophobicContact CB-CB 4.46Å; K78-K88 PolarHBondContact N-O 2.94Å; K78-K88 PolarHBondContact O-N 3.42Å; K88-Q119 HydrophobicContact CG-CG 4.21Å; K88-F120 WeakPolarHBondContact CA-O 3.43Å
89	I	98.8	Very high	96.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	119.7	-170	-60.3	174	0	0	0	108.2	A51 A52 V74 F87 A91 Q119 F120	A51-I89 HydrophobicContact CB-CD1 3.67Å; A52-I89 HydrophobicContact CB-CD1 4.23Å; A52-I89 HydrophobicContact CB-CG2 4.16Å; V74-I89 HydrophobicContact CG1-CG2 3.75Å; V74-I89 HydrophobicContact CG2-CG2 4.47Å; F87-I89 HydrophobicContact CB-CD1 3.88Å; F87-I89 HydrophobicContact CB-CG1 3.95Å; F87-I89 HydrophobicContact CG-CD1 4.5Å; I89-A91 HydrophobicContact CG2-CB 4.41Å; I89-Q119 CarbonylContact O-C 3.56Å; I89-Q119 WeakPolarHBondContact O-CA 3.49Å; I89-F120 PolarHBondContact N-O 2.9Å; I89-F120 PolarHBondContact O-N 3.41Å
90	D	98.6	Very high	96.3	Very high	31 Å²	31	39.5 Å²	39.5	17%	0.166	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.3	162.1	-63.2	-32	0	0	0	107.7	V74 P75 S76 C118 Q119	V74-D90 WeakPolarHBondContact CA-O 3.5Å; P75-D90 WeakPolarHBondContact CD-O 3.42Å; S76-D90 PolarHBondContact O-N 3.44Å; D90-C118 CarbonylContact C-O 3.47Å; D90-C118 WeakPolarHBondContact CA-O 3.38Å; D90-Q119 WeakPolarHBondContact OD1-CB 3.44Å; D90-Q119 WeakPolarHBondContact OD1-CG 3.46Å; D90-Q119 PolarHBondContact OD1-NE2 3.41Å
91	A	98.4	Very high	95.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.1	-176.8	0	0	0	0	0	110.6	L71 S73 I89 L93 K117 C118 F120	L71-A91 HydrophobicContact CD1-CB 3.78Å; S73-A91 WeakPolarHBondContact O-CA 3.24Å; I89-A91 HydrophobicContact CG2-CB 4.41Å; A91-L93 HydrophobicContact CB-CD1 3.74Å; A91-K117 WeakPolarHBondContact O-CA 3.27Å; A91-C118 PolarHBondContact N-O 3.41Å; A91-C118 PolarHBondContact O-N 3.29Å; A91-F120 HydrophobicContact CB-CD2 4.03Å; A91-F120 HydrophobicContact CB-CE2 3.82Å
92	I	98.1	Very high	95.1	Very high	22 Å²	22	45 Å²	45	11%	0.113	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.9	167.5	-54	-58.7	0	0	0	107.7	V72 S73 P75 Q115 K117	V72-I92 HydrophobicContact CB-CB 4.46Å; V72-I92 HydrophobicContact CB-CG2 4.27Å; V72-I92 WeakPolarHBondContact CB-O 3.09Å; V72-I92 PolarHBondContact N-O 3.39Å; S73-I92 PolarHBondContact N-O 3.45Å; S73-I92 PolarHBondContact O-N 2.82Å; S73-I92 WeakPolarHBondContact OG-CG1 3.4Å; P75-I92 HydrophobicContact CG-CD1 4.21Å; P75-I92 HydrophobicContact CG-CG1 3.72Å; I92-Q115 HydrophobicContact CG2-CB 4.27Å; I92-K117 HydrophobicContact CD1-CB 3.74Å; I92-K117 HydrophobicContact CD1-CD 4.12Å; I92-K117 HydrophobicContact CD1-CG 3.74Å
93	L	97.6	Very high	94.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.2	176.7	-79.9	60.9	0	0	0	108.4	V56 Y59 F69 K70 L71 A91 Q115 V116 C118 F120	V56-L93 HydrophobicContact CG1-CD2 4.41Å; V56-L93 HydrophobicContact CG2-CD1 3.89Å; V56-L93 HydrophobicContact CG2-CD2 4.04Å; V56-L93 HydrophobicContact CG2-CG 3.89Å; Y59-L93 HydrophobicContact CD1-CD2 3.66Å; Y59-L93 HydrophobicContact CD2-CD2 4.43Å; Y59-L93 HydrophobicContact CE1-CD2 3.96Å; Y59-L93 HydrophobicContact CG-CD2 3.92Å; F69-L93 HydrophobicContact CB-CB 4.27Å; F69-L93 HydrophobicContact CB-CD2 4.14Å; F69-L93 HydrophobicContact CD1-CB 4.12Å; K70-L93 CarbonylContact O-C 3.53Å; K70-L93 VanDerWaalsContact O-CA 3.29Å; K70-L93 WeakPolarHBondContact O-CA 3.07Å; L71-L93 HydrophobicContact CD1-CD1 4.37Å; A91-L93 HydrophobicContact CB-CD1 3.74Å; L93-Q115 CarbonylContact O-C 3.59Å; L93-Q115 VanDerWaalsContact O-CA 3.22Å; L93-Q115 WeakPolarHBondContact O-CA 3.38Å; L93-V116 HydrophobicContact CB-CG2 3.7Å; L93-V116 HydrophobicContact CD2-CG2 4.44Å; L93-V116 PolarHBondContact N-O 2.64Å; L93-V116 PolarHBondContact O-N 2.97Å; L93-C118 HydrophobicContact CD1-CB 4.41Å; L93-F120 HydrophobicContact CD1-CE2 3.95Å; L93-F120 HydrophobicContact CD1-CZ 4.2Å; L93-F120 HydrophobicContact CD2-CZ 4.17Å
94	G	96.7	Very high	93.3	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.5	172	0	0	0	0	0	110.3	F69 K70	F69-G94 CarbonylContact C-O 3.55Å; F69-G94 VanDerWaalsContact CA-O 3.3Å; F69-G94 WeakPolarHBondContact CA-O 3.26Å; K70-G94 PolarHBondContact N-O 3.37Å; K70-G94 PolarHBondContact O-N 3.06Å
95	R	95.8	Very high	92.5	Very high	38 Å²	38	49.6 Å²	49.6	14%	0.143	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	142.2	168	-171.4	-172.9	-70.4	-100.4	-2.4	107.9	D65 E67 F69 D112 E114	D65-R95 IonicContact OD1-NH1 2.74Å; D65-R95 IonicContact OD1-NH2 3.1Å; E67-R95 HydrophobicContact CB-CG 4.06Å; E67-R95 IonicContact OE2-NH1 2.74Å; E67-R95 PolarHBondContact OE2-NH1 3.3Å; F69-R95 HydrophobicContact CD1-CB 4.25Å; F69-R95 HydrophobicContact CE1-CB 3.79Å; F69-R95 HydrophobicContact CE1-CG 4.42Å; F69-R95 HydrophobicContact CE2-CG 4.49Å; F69-R95 HydrophobicContact CZ-CB 4.04Å; F69-R95 HydrophobicContact CZ-CG 4.17Å; R95-D112 HydrophobicContact CB-CB 4.42Å; R95-D112 PolarHBondContact O-N 2.79Å; R95-E114 HydrophobicContact CB-CB 4.13Å; R95-E114 IonicContact CZ-OE2 3.89Å; R95-E114 PolarHBondContact N-O 3.39Å; R95-E114 IonicContact NE-OE2 3.83Å; R95-E114 PolarHBondContact NE-OE2 2.81Å; R95-E114 IonicContact NH2-OE1 2.64Å; R95-E114 IonicContact NH2-OE2 3.23Å; R95-E114 PolarHBondContact NH2-OE2 2.95Å
96	T	95.8	Very high	91.8	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	168.3	174.6	72.9	0	0	0	0	110.7	E67 L68 K70 C98 C109 D110 L111	E67-T96 WeakPolarHBondContact CB-O 3.44Å; L68-T96 VanDerWaalsContact O-CB 3.32Å; L68-T96 WeakPolarHBondContact O-CB 3.33Å; L68-T96 WeakPolarHBondContact O-CG2 3.41Å; L68-T96 PolarHBondContact O-N 3.5Å; L68-T96 PolarHBondContact O-OG1 3.01Å; K70-T96 HydrophobicContact CB-CG2 3.79Å; T96-C98 VanDerWaalsContact C-N 3.28Å; T96-C98 PolarHBondContact OG1-N 3.45Å; T96-C109 HydrophobicContact CG2-CB 4.02Å; T96-D110 CarbonylContact C-O 3.53Å; T96-D110 WeakPolarHBondContact CA-O 3.34Å; T96-D110 WeakPolarHBondContact CB-O 3.46Å; T96-L111 HydrophobicContact CG2-CD2 4.27Å
97	K	94.2	Very high	91.2	Very high	136 Å²	136	57.3 Å²	57.3	59%	0.591	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	-6.7	171.1	-60.6	179.5	-173.2	168	0	113.7	D110	K97-D110 HydrophobicContact CD-CB 4.22Å; K97-D110 PolarHBondContact N-O 2.8Å
98	C	93.2	Very high	90.6	Very high	11 Å²	11	61.1 Å²	61.1	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	137.7	-178.3	-73.7	0	0	0	0	111.5	E67 L68 T96 C109	E67-C98 CarbonylContact C-O 3.57Å; E67-C98 VanDerWaalsContact CA-O 3.24Å; E67-C98 WeakPolarHBondContact CA-O 3.49Å; L68-C98 HydrophobicContact CD1-CB 4.23Å; L68-C98 PolarHBondContact N-O 3.4Å; T96-C98 VanDerWaalsContact C-N 3.28Å; T96-C98 PolarHBondContact OG1-N 3.45Å; C98-C109 HydrophobicContact CB-CB 3.78Å; C98-C109 WeakPolarHBondContact CB-SG 3.03Å; C98-C109 VanDerWaalsContact SG-CA 3.56Å; C98-C109 WeakPolarHBondContact SG-CB 3.44Å; C98-C109 CovalentContact SG-SG 2.02Å; C98-C109 PolarHBondContact SG-SG 2.89Å
99	L	92.6	Very high	90.3	Very high	58 Å²	58	57.7 Å²	57.7	30%	0.304	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	147.2	172.2	-58.1	178.5	0	0	0	110.8	K66 E67 T101 Q102	K66-L99 HydrophobicContact CB-CD2 4.16Å; K66-L99 WeakPolarHBondContact O-CA 3.32Å; E67-L99 HydrophobicContact CG-CD2 4.23Å; L99-T101 PolarHBondContact O-N 3.42Å; L99-T101 VanDerWaalsContact O-N 3.09Å; L99-Q102 HydrophobicContact CB-CG 4.1Å; L99-Q102 PolarHBondContact O-N 2.98Å; L99-Q102 VanDerWaalsContact O-N 3.15Å
100	K	89.8	Confident	90	Very high	63 Å²	63	62.8 Å²	62.8	27%	0.274	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-54.5	-29.3	175.2	-73.3	175.2	-177.4	174	0	113.7	N60 S63 D65 K66 L68	N60-K100 WeakPolarHBondContact O-CE 3.15Å; N60-K100 PolarHBondContact O-NZ 3.28Å; S63-K100 PolarHBondContact O-NZ 3.01Å; D65-K100 WeakPolarHBondContact O-CD 3.35Å; D65-K100 WeakPolarHBondContact O-CE 3.32Å; D65-K100 PolarHBondContact O-NZ 2.86Å; K66-K100 PolarHBondContact O-N 3.23Å; L68-K100 HydrophobicContact CD2-CB 4.48Å; L68-K100 HydrophobicContact CD2-CG 3.56Å; L68-K100 HydrophobicContact CG-CG 3.95Å
101	T	86.3	Confident	89.8	Confident	115 Å²	115	65.1 Å²	65.1	71%	0.706	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-79.8	-14.8	-176.4	54	0	0	0	0	114.5	L99 N103	L99-T101 PolarHBondContact O-N 3.42Å; L99-T101 VanDerWaalsContact O-N 3.09Å; T101-N103 VanDerWaalsContact C-N 3.28Å; T101-N103 PolarHBondContact O-N 2.99Å
102	Q	81.3	Confident	89.5	Confident	93 Å²	93	68.7 Å²	68.7	44%	0.435	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-81	-4.4	-170.6	-69.6	172.6	-2.3	0	0	113.7	L99 L104	L99-Q102 HydrophobicContact CB-CG 4.1Å; L99-Q102 PolarHBondContact O-N 2.98Å; L99-Q102 VanDerWaalsContact O-N 3.15Å; Q102-L104 HydrophobicContact CB-CD1 3.77Å; Q102-L104 HydrophobicContact CB-CG 3.8Å; Q102-L104 PolarHBondContact O-N 3.18Å; Q102-L104 VanDerWaalsContact O-N 3.12Å; Q102-L104 VanDerWaalsContact OE1-CD1 3.3Å
103	N	73.3	Confident	89.1	Confident	157 Å²	157	77 Å²	77	84%	0.84	39%	0.39	S	S	*	.			trans	47.8	37.1	-177.8	-66.5	-44.3	0	0	0	113.5	T101	T101-N103 VanDerWaalsContact C-N 3.28Å; T101-N103 PolarHBondContact O-N 2.99Å
104	L	78.1	Confident	88.9	Confident	84 Å²	84	79.4 Å²	79.4	44%	0.44	40%	0.401	S	S	.	.			trans	-89.4	153.8	-179.8	-65.4	172.1	0	0	0	111.5	Q102 I106	Q102-L104 HydrophobicContact CB-CD1 3.77Å; Q102-L104 HydrophobicContact CB-CG 3.8Å; Q102-L104 PolarHBondContact O-N 3.18Å; Q102-L104 VanDerWaalsContact O-N 3.12Å; Q102-L104 VanDerWaalsContact OE1-CD1 3.3Å; L104-I106 PolarHBondContact O-N 3.41Å
105	D	81.8	Confident	88.9	Confident	100 Å²	100	82.9 Å²	82.9	54%	0.535	42%	0.417	S	S	.	.			trans	-68.1	114.3	169.1	-178.6	0.1	0	0	0	109.7	K107 S108	D105-K107 PolarHBondContact O-N 2.91Å; D105-K107 WeakPolarHBondContact OD1-CB 3.42Å; D105-K107 WeakPolarHBondContact OD1-CG 3.42Å; D105-K107 PolarHBondContact OD1-N 2.73Å; D105-S108 PolarHBondContact O-N 3.38Å; D105-S108 PolarHBondContact O-OG 3.5Å
106	I	82.8	Confident	89	Confident	56 Å²	56	81.5 Å²	81.5	29%	0.287	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-50.8	-29.2	177.9	-67.1	168.8	0	0	0	112	L68 K70 L104 S108 C109	L68-I106 HydrophobicContact CD1-CD1 4.42Å; L68-I106 HydrophobicContact CD1-CG1 3.89Å; L68-I106 HydrophobicContact CD2-CD1 4.42Å; K70-I106 HydrophobicContact CB-CG2 4.12Å; K70-I106 HydrophobicContact CG-CG2 4.25Å; L104-I106 PolarHBondContact O-N 3.41Å; I106-S108 VanDerWaalsContact C-N 3.29Å; I106-S108 PolarHBondContact O-N 2.92Å; I106-C109 WeakPolarHBondContact O-CB 3.34Å; I106-C109 PolarHBondContact O-N 3Å
107	K	84.5	Confident	89.1	Confident	160 Å²	160	86.2 Å²	86.2	70%	0.696	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-63.6	-36	178.8	-66.5	179.6	-179	177.3	0	112.6	K70 D105 C109	K70-K107 PolarHBondContact NZ-O 2.96Å; D105-K107 PolarHBondContact O-N 2.91Å; D105-K107 WeakPolarHBondContact OD1-CB 3.42Å; D105-K107 WeakPolarHBondContact OD1-CG 3.42Å; D105-K107 PolarHBondContact OD1-N 2.73Å; K107-C109 VanDerWaalsContact C-N 3.31Å
108	S	87.3	Confident	89.3	Confident	80 Å²	80	79.8 Å²	79.8	56%	0.559	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-79.9	-10.1	178.8	68.3	0	0	0	0	114	D105 I106 D110	D105-S108 PolarHBondContact O-N 3.38Å; D105-S108 PolarHBondContact O-OG 3.5Å; I106-S108 VanDerWaalsContact C-N 3.29Å; I106-S108 PolarHBondContact O-N 2.92Å; S108-D110 PolarHBondContact O-N 3.15Å
109	C	90.8	Very high	89.6	Confident	5 Å²	5	83.1 Å²	83.1	3%	0.034	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-74.9	124.7	-178.4	-66.2	0	0	0	0	111.7	T96 C98 I106 K107	T96-C109 HydrophobicContact CG2-CB 4.02Å; C98-C109 HydrophobicContact CB-CB 3.78Å; C98-C109 WeakPolarHBondContact CB-SG 3.03Å; C98-C109 VanDerWaalsContact SG-CA 3.56Å; C98-C109 WeakPolarHBondContact SG-CB 3.44Å; C98-C109 CovalentContact SG-SG 2.02Å; C98-C109 PolarHBondContact SG-SG 2.89Å; I106-C109 WeakPolarHBondContact O-CB 3.34Å; I106-C109 PolarHBondContact O-N 3Å; K107-C109 VanDerWaalsContact C-N 3.31Å
110	D	93.8	Very high	89.9	Confident	108 Å²	108	80.4 Å²	80.4	58%	0.578	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-64.6	137.2	173.4	-72.3	-27	0	0	0	110.9	T96 K97 S108	T96-D110 CarbonylContact C-O 3.53Å; T96-D110 WeakPolarHBondContact CA-O 3.34Å; T96-D110 WeakPolarHBondContact CB-O 3.46Å; K97-D110 HydrophobicContact CD-CB 4.22Å; K97-D110 PolarHBondContact N-O 2.8Å; S108-D110 PolarHBondContact O-N 3.15Å
111	L	94.7	Very high	90.3	Very high	80 Å²	80	79.8 Å²	79.8	42%	0.419	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	144.6	171.5	-67	174	0	0	0	110.5	K70 V72 T96	K70-L111 HydrophobicContact CB-CD2 4.09Å; K70-L111 HydrophobicContact CD-CD2 4.38Å; V72-L111 HydrophobicContact CG2-CD1 4.09Å; V72-L111 HydrophobicContact CG2-CD2 4.24Å; T96-L111 HydrophobicContact CG2-CD2 4.27Å
112	D	92	Very high	90.9	Very high	74 Å²	74	74.3 Å²	74.3	40%	0.396	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-179.8	163.5	-167.5	14.9	0	0	0	109.8	R95	R95-D112 HydrophobicContact CB-CB 4.42Å; R95-D112 PolarHBondContact O-N 2.79Å
113	K	88.8	Confident	91.7	Very high	197 Å²	197	70.8 Å²	70.8	86%	0.857	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	-25.9	-175.9	-62.1	-178.3	-178.5	179.5	0	113.7
114	E	94.4	Very high	92.9	Very high	51 Å²	51	63.8 Å²	63.8	24%	0.238	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.2	-175.2	-169.7	174.1	-171.3	0	0	111.6	R95 K140	R95-E114 HydrophobicContact CB-CB 4.13Å; R95-E114 IonicContact CZ-OE2 3.89Å; R95-E114 PolarHBondContact N-O 3.39Å; R95-E114 IonicContact NE-OE2 3.83Å; R95-E114 PolarHBondContact NE-OE2 2.81Å; R95-E114 IonicContact NH2-OE1 2.64Å; R95-E114 IonicContact NH2-OE2 3.23Å; R95-E114 PolarHBondContact NH2-OE2 2.95Å; E114-K140 VanDerWaalsContact OE1-CE 3.28Å; E114-K140 WeakPolarHBondContact OE1-CE 3.45Å; E114-K140 IonicContact OE1-NZ 2.91Å; E114-K140 PolarHBondContact OE1-NZ 2.74Å
115	Q	96.7	Very high	93.9	Very high	73 Å²	73	61.4 Å²	61.4	34%	0.341	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.6	174.1	-63.2	-174.7	12.2	0	0	111.1	I92 L93 V141	I92-Q115 HydrophobicContact CG2-CB 4.27Å; L93-Q115 CarbonylContact O-C 3.59Å; L93-Q115 VanDerWaalsContact O-CA 3.22Å; L93-Q115 WeakPolarHBondContact O-CA 3.38Å; Q115-V141 HydrophobicContact CB-CB 4.24Å; Q115-V141 HydrophobicContact CB-CG2 4.1Å; Q115-V141 PolarHBondContact O-N 3.37Å
116	V	97.1	Very high	94.5	Very high	10 Å²	10	60.2 Å²	60.2	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.5	172.3	-59.1	0	0	0	0	109.4	F69 L93 N139 K140	F69-V116 HydrophobicContact CD1-CG2 4.04Å; F69-V116 HydrophobicContact CE1-CG1 4.13Å; F69-V116 HydrophobicContact CE1-CG2 3.98Å; L93-V116 HydrophobicContact CB-CG2 3.7Å; L93-V116 HydrophobicContact CD2-CG2 4.44Å; L93-V116 PolarHBondContact N-O 2.64Å; L93-V116 PolarHBondContact O-N 2.97Å; V116-N139 CarbonylContact C-O 3.55Å; V116-N139 WeakPolarHBondContact CA-O 3.29Å; V116-K140 HydrophobicContact CG1-CG 4.42Å
117	K	98.2	Very high	95.2	Very high	100 Å²	100	65.2 Å²	65.2	44%	0.435	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.8	170.9	179.7	173.2	-178.6	-179.9	0	108.5	A91 I92 C138 N139 V141	A91-K117 WeakPolarHBondContact O-CA 3.27Å; I92-K117 HydrophobicContact CD1-CB 3.74Å; I92-K117 HydrophobicContact CD1-CD 4.12Å; I92-K117 HydrophobicContact CD1-CG 3.74Å; K117-C138 CarbonylContact O-C 3.58Å; K117-C138 VanDerWaalsContact O-CA 3.3Å; K117-C138 WeakPolarHBondContact O-CA 3.32Å; K117-N139 PolarHBondContact N-O 3.01Å; K117-N139 PolarHBondContact O-N 2.85Å; K117-V141 HydrophobicContact CB-CG2 4Å
118	C	98.5	Very high	95.8	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.007	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.6	178.8	-65.6	0	0	0	0	111	D90 A91 L93 F120 T137 C138	D90-C118 CarbonylContact C-O 3.47Å; D90-C118 WeakPolarHBondContact CA-O 3.38Å; A91-C118 PolarHBondContact N-O 3.41Å; A91-C118 PolarHBondContact O-N 3.29Å; L93-C118 HydrophobicContact CD1-CB 4.41Å; C118-F120 HydrophobicContact CB-CD1 4.41Å; C118-F120 HydrophobicContact CB-CD2 4.31Å; C118-F120 HydrophobicContact CB-CE1 3.8Å; C118-F120 HydrophobicContact CB-CE2 3.7Å; C118-F120 HydrophobicContact CB-CZ 3.41Å; C118-F120 VanDerWaalsContact CB-CZ 3.41Å; C118-T137 CarbonylContact C-O 3.59Å; C118-T137 VanDerWaalsContact CA-O 3.24Å; C118-T137 WeakPolarHBondContact CA-O 3.4Å; C118-C138 HydrophobicContact CB-CB 4.15Å; C118-C138 WeakPolarHBondContact CB-SG 3.38Å; C118-C138 WeakPolarHBondContact SG-CB 3.4Å; C118-C138 CovalentContact SG-SG 2.04Å; C118-C138 PolarHBondContact SG-SG 3.4Å
119	Q	98.6	Very high	96.2	Very high	81 Å²	81	62.3 Å²	62.3	38%	0.379	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125	159.3	-177.5	167.7	103.5	0	0	108.4	K88 I89 D90 K136 T137	K88-Q119 HydrophobicContact CG-CG 4.21Å; I89-Q119 CarbonylContact O-C 3.56Å; I89-Q119 WeakPolarHBondContact O-CA 3.49Å; D90-Q119 WeakPolarHBondContact OD1-CB 3.44Å; D90-Q119 WeakPolarHBondContact OD1-CG 3.46Å; D90-Q119 PolarHBondContact OD1-NE2 3.41Å; Q119-K136 WeakPolarHBondContact O-CA 3.13Å; Q119-T137 PolarHBondContact N-O 3.46Å; Q119-T137 PolarHBondContact O-N 2.96Å
120	F	98.8	Very high	96.6	Very high	1 Å²	1	68.9 Å²	68.9	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	141.4	178	-60.6	-58.5	0	0	0	110.9	A55 V56 Y59 K88 I89 A91 L93 C118 V122 L133 K136	A55-F120 HydrophobicContact CB-CB 3.93Å; A55-F120 HydrophobicContact CB-CD1 4Å; A55-F120 HydrophobicContact CB-CD2 3.59Å; A55-F120 HydrophobicContact CB-CE1 4.38Å; A55-F120 HydrophobicContact CB-CE2 4Å; A55-F120 HydrophobicContact CB-CG 3.58Å; A55-F120 HydrophobicContact CB-CZ 4.38Å; V56-F120 HydrophobicContact CG2-CE2 4.39Å; Y59-F120 HydrophobicContact CD2-CE1 4.43Å; K88-F120 WeakPolarHBondContact CA-O 3.43Å; I89-F120 PolarHBondContact N-O 2.9Å; I89-F120 PolarHBondContact O-N 3.41Å; A91-F120 HydrophobicContact CB-CD2 4.03Å; A91-F120 HydrophobicContact CB-CE2 3.82Å; L93-F120 HydrophobicContact CD1-CE2 3.95Å; L93-F120 HydrophobicContact CD1-CZ 4.2Å; L93-F120 HydrophobicContact CD2-CZ 4.17Å; C118-F120 HydrophobicContact CB-CD1 4.41Å; C118-F120 HydrophobicContact CB-CD2 4.31Å; C118-F120 HydrophobicContact CB-CE1 3.8Å; C118-F120 HydrophobicContact CB-CE2 3.7Å; C118-F120 HydrophobicContact CB-CZ 3.41Å; C118-F120 VanDerWaalsContact CB-CZ 3.41Å; F120-V122 HydrophobicContact CB-CG2 4.2Å; F120-L133 HydrophobicContact CB-CD1 4.17Å; F120-L133 HydrophobicContact CD1-CD1 4Å; F120-L133 HydrophobicContact CG-CD1 4.43Å; F120-K136 HydrophobicContact CD1-CB 3.64Å; F120-K136 HydrophobicContact CE1-CB 3.77Å
121	F	98.7	Very high	96.8	Very high	50 Å²	50	65.2 Å²	65.2	22%	0.219	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	109.3	165.8	-169.9	-85.8	0	0	0	109.7	W38 N86 F87 T123 N134 T135	W38-F121 HydrophobicContact CH2-CD2 4.22Å; W38-F121 AromaticContact CH2-CE2 3.51Å; W38-F121 HydrophobicContact CH2-CE2 3.51Å; W38-F121 HydrophobicContact CH2-CZ 4.27Å; W38-F121 AromaticContact CZ2-CE2 3.63Å; W38-F121 HydrophobicContact CZ2-CE2 3.63Å; W38-F121 HydrophobicContact CZ2-CZ 4.37Å; N86-F121 HydrophobicContact CB-CE2 4.41Å; N86-F121 HydrophobicContact CB-CZ 3.95Å; F87-F121 WeakPolarHBondContact O-CA 3.41Å; F121-T123 HydrophobicContact CE1-CG2 3.99Å; F121-N134 HydrophobicContact CD1-CB 3.77Å; F121-N134 WeakPolarHBondContact CD1-ND2 3.4Å; F121-N134 HydrophobicContact CE1-CB 4.4Å; F121-N134 PolarHBondContact O-N 3.17Å; F121-T135 WeakPolarHBondContact CB-OG1 3.39Å; F121-T135 PolarHBondContact N-O 2.96Å; F121-T135 PolarHBondContact O-N 2.91Å
122	V	98.8	Very high	97	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.1	-175.5	-174.9	0	0	0	0	109.2	A51 Y54 A55 N86 F87 F120 H131 E132 L133	A51-V122 HydrophobicContact CB-CB 4.36Å; A51-V122 HydrophobicContact CB-CG1 4.14Å; Y54-V122 HydrophobicContact CD1-CG1 4.16Å; A55-V122 HydrophobicContact CB-CG2 3.83Å; N86-V122 CarbonylContact C-O 3.55Å; F87-V122 HydrophobicContact CB-CB 4.41Å; F87-V122 PolarHBondContact N-O 3.42Å; F87-V122 PolarHBondContact O-N 3.31Å; F120-V122 HydrophobicContact CB-CG2 4.2Å; V122-H131 HydrophobicContact CG1-CB 4.18Å; V122-E132 CarbonylContact C-O 3.49Å; V122-E132 VanDerWaalsContact CA-O 3.3Å; V122-E132 WeakPolarHBondContact CA-O 3.45Å; V122-E132 WeakPolarHBondContact CG1-O 3.35Å; V122-L133 HydrophobicContact CG2-CD1 4Å
123	T	98.5	Very high	97.3	Very high	19 Å²	19	64.8 Å²	64.8	12%	0.117	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.3	171.7	40.9	0	0	0	0	109.3	I85 N86 F121 H131 E132 N134	I85-T123 CarbonylContact O-C 3.48Å; N86-T123 WeakPolarHBondContact OD1-CG2 3.18Å; F121-T123 HydrophobicContact CE1-CG2 3.99Å; T123-H131 CarbonylContact O-C 3.52Å; T123-H131 WeakPolarHBondContact O-CA 3.49Å; T123-E132 PolarHBondContact N-O 3.47Å; T123-E132 PolarHBondContact O-N 2.63Å; T123-E132 PolarHBondContact OG1-O 2.99Å; T123-N134 WeakPolarHBondContact CG2-ND2 3.35Å; T123-N134 PolarHBondContact N-ND2 3.12Å; T123-N134 PolarHBondContact OG1-ND2 3.19Å
124	L	98.6	Very high	97.7	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.052	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.6	169.8	167.5	60.3	0	0	0	108.7	I85 F87 P126 K130	I85-L124 HydrophobicContact CB-CB 4.21Å; I85-L124 HydrophobicContact CD1-CD2 4.23Å; I85-L124 PolarHBondContact N-O 3.35Å; I85-L124 PolarHBondContact O-N 2.81Å; F87-L124 HydrophobicContact CE2-CB 3.9Å; F87-L124 HydrophobicContact CE2-CD2 4.27Å; L124-P126 VanDerWaalsContact O-CD 3.32Å; L124-P126 WeakPolarHBondContact O-CD 3.3Å; L124-K130 WeakPolarHBondContact CA-O 3.23Å
125	N	98.1	Very high	97.9	Very high	34 Å²	34	60.4 Å²	60.4	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	110.5	170.1	-175.5	-17.3	0	0	0	110.1	M84 H127 N128 D129 K130	M84-N125 HydrophobicContact CE-CB 4.21Å; M84-N125 VanDerWaalsContact SD-CA 3.53Å; M84-N125 HydrophobicContact SD-CB 3.57Å; M84-N125 VanDerWaalsContact SD-CB 3.57Å; N125-H127 PolarHBondContact O-N 2.87Å; N125-H127 VanDerWaalsContact O-N 3.17Å; N125-H127 WeakPolarHBondContact OD1-CB 3.32Å; N125-H127 PolarHBondContact OD1-N 3.3Å; N125-H127 PolarHBondContact OD1-ND1 2.79Å; N125-N128 WeakPolarHBondContact CB-OD1 3.4Å; N125-N128 PolarHBondContact O-N 2.8Å; N125-D129 WeakPolarHBondContact O-CA 3.43Å; N125-D129 PolarHBondContact O-N 2.9Å; N125-K130 PolarHBondContact N-O 3.14Å
126	P	96	Very high	98	Very high	75 Å²	75	60.7 Å²	60.7	49%	0.487	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.5	-175.8	28.9	-35.6	0	0	0	113.5	L124	L124-P126 VanDerWaalsContact O-CD 3.32Å; L124-P126 WeakPolarHBondContact O-CD 3.3Å
127	H	96.4	Very high	98	Very high	161 Å²	161	64.4 Å²	64.4	75%	0.745	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-27.2	-178.4	-57.2	86.9	0	0	0	113	N125	N125-H127 PolarHBondContact O-N 2.87Å; N125-H127 VanDerWaalsContact O-N 3.17Å; N125-H127 WeakPolarHBondContact OD1-CB 3.32Å; N125-H127 PolarHBondContact OD1-N 3.3Å; N125-H127 PolarHBondContact OD1-ND1 2.79Å
128	N	97.3	Very high	98	Very high	82 Å²	82	61.6 Å²	61.6	44%	0.439	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	9.9	-175.8	64.5	16.5	0	0	0	113.9	N125 K130	N125-N128 WeakPolarHBondContact CB-OD1 3.4Å; N125-N128 PolarHBondContact O-N 2.8Å; N128-K130 HydrophobicContact CB-CG 4.5Å; N128-K130 PolarHBondContact O-N 3.03Å; N128-K130 VanDerWaalsContact O-N 3.12Å; N128-K130 VanDerWaalsContact OD1-CB 3.29Å; N128-K130 WeakPolarHBondContact OD1-CB 3.2Å; N128-K130 WeakPolarHBondContact OD1-CG 3.32Å; N128-K130 PolarHBondContact OD1-N 2.89Å
129	D	96.6	Very high	97.8	Very high	96 Å²	96	66.9 Å²	66.9	51%	0.513	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	24.3	178.9	-156.5	36.6	0	0	0	114.3	R50 N125	R50-D129 IonicContact NH1-OD1 3.86Å; R50-D129 IonicContact NH1-OD2 2.82Å; N125-D129 WeakPolarHBondContact O-CA 3.43Å; N125-D129 PolarHBondContact O-N 2.9Å
130	K	98.1	Very high	97.6	Very high	143 Å²	143	70.1 Å²	70.1	62%	0.622	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	132	179	-68.3	-173	178	-176.1	0	111.5	L124 N125 N128	L124-K130 WeakPolarHBondContact CA-O 3.23Å; N125-K130 PolarHBondContact N-O 3.14Å; N128-K130 HydrophobicContact CB-CG 4.5Å; N128-K130 PolarHBondContact O-N 3.03Å; N128-K130 VanDerWaalsContact O-N 3.12Å; N128-K130 VanDerWaalsContact OD1-CB 3.29Å; N128-K130 WeakPolarHBondContact OD1-CB 3.2Å; N128-K130 WeakPolarHBondContact OD1-CG 3.32Å; N128-K130 PolarHBondContact OD1-N 2.89Å
131	H	98.6	Very high	97	Very high	31 Å²	31	73.5 Å²	73.5	14%	0.144	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	150.7	170.4	-65.1	78.3	0	0	0	110.9	Y54 V122 T123	Y54-H131 HydrophobicContact CD1-CB 3.56Å; Y54-H131 HydrophobicContact CD2-CB 3.85Å; Y54-H131 HydrophobicContact CE1-CB 3.79Å; Y54-H131 HydrophobicContact CE2-CB 4.04Å; Y54-H131 HydrophobicContact CG-CB 3.59Å; Y54-H131 VanDerWaalsContact CZ-O 3.23Å; Y54-H131 PolarHBondContact OH-O 2.92Å; V122-H131 HydrophobicContact CG1-CB 4.18Å; T123-H131 CarbonylContact O-C 3.52Å; T123-H131 WeakPolarHBondContact O-CA 3.49Å
132	E	98.4	Very high	95.4	Very high	117 Å²	117	80.7 Å²	80.7	55%	0.547	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	134.8	172	175.5	174.5	-164.7	0	0	110	V122 T123 N134	V122-E132 CarbonylContact C-O 3.49Å; V122-E132 VanDerWaalsContact CA-O 3.3Å; V122-E132 WeakPolarHBondContact CA-O 3.45Å; V122-E132 WeakPolarHBondContact CG1-O 3.35Å; T123-E132 PolarHBondContact N-O 3.47Å; T123-E132 PolarHBondContact O-N 2.63Å; T123-E132 PolarHBondContact OG1-O 2.99Å; E132-N134 PolarHBondContact O-ND2 2.99Å
133	L	98.6	Very high	95.2	Very high	28 Å²	28	84.8 Å²	84.8	15%	0.147	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	108.9	176.8	177.4	66.6	0	0	0	108	Y54 A55 M58 F120 V122 T135 K136	Y54-L133 HydrophobicContact CE1-CB 4.15Å; A55-L133 HydrophobicContact CB-CD1 4.16Å; M58-L133 HydrophobicContact CB-CB 4.14Å; M58-L133 HydrophobicContact CB-CD2 3.59Å; M58-L133 HydrophobicContact CG-CB 4.2Å; F120-L133 HydrophobicContact CB-CD1 4.17Å; F120-L133 HydrophobicContact CD1-CD1 4Å; F120-L133 HydrophobicContact CG-CD1 4.43Å; V122-L133 HydrophobicContact CG2-CD1 4Å; L133-T135 WeakPolarHBondContact CD1-O 3.36Å; L133-K136 HydrophobicContact CD2-CB 4.41Å; L133-K136 HydrophobicContact CD2-CD 4.2Å
134	N	97.9	Very high	95.1	Very high	72 Å²	72	88.2 Å²	88.2	39%	0.385	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-45.5	-177.8	-52.6	-93.3	0	0	0	111.3	F121 T123 E132	F121-N134 HydrophobicContact CD1-CB 3.77Å; F121-N134 WeakPolarHBondContact CD1-ND2 3.4Å; F121-N134 HydrophobicContact CE1-CB 4.4Å; F121-N134 PolarHBondContact O-N 3.17Å; T123-N134 WeakPolarHBondContact CG2-ND2 3.35Å; T123-N134 PolarHBondContact N-ND2 3.12Å; T123-N134 PolarHBondContact OG1-ND2 3.19Å; E132-N134 PolarHBondContact O-ND2 2.99Å
135	T	98.1	Very high	94.9	Very high	84 Å²	84	92.6 Å²	92.6	52%	0.515	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.6	178.9	68.2	0	0	0	0	111.9	F121 L133	F121-T135 WeakPolarHBondContact CB-OG1 3.39Å; F121-T135 PolarHBondContact N-O 2.96Å; F121-T135 PolarHBondContact O-N 2.91Å; L133-T135 WeakPolarHBondContact CD1-O 3.36Å
136	K	97.9	Very high	94.7	Very high	80 Å²	80	96 Å²	96	35%	0.348	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	134.6	172.8	60.3	173.9	-179.4	-78.3	0	110.1	Y59 D62 Q119 F120 L133	Y59-K136 HydrophobicContact CD2-CD 4.13Å; D62-K136 IonicContact OD2-NZ 3.87Å; D62-K136 PolarHBondContact OD2-NZ 2.83Å; Q119-K136 WeakPolarHBondContact O-CA 3.13Å; F120-K136 HydrophobicContact CD1-CB 3.64Å; F120-K136 HydrophobicContact CE1-CB 3.77Å; L133-K136 HydrophobicContact CD2-CB 4.41Å; L133-K136 HydrophobicContact CD2-CD 4.2Å
137	T	97.8	Very high	94.6	Very high	88 Å²	88	97.3 Å²	97.3	54%	0.54	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	120.3	172.3	-55.2	0	0	0	0	108.4	C118 Q119	C118-T137 CarbonylContact C-O 3.59Å; C118-T137 VanDerWaalsContact CA-O 3.24Å; C118-T137 WeakPolarHBondContact CA-O 3.4Å; Q119-T137 PolarHBondContact N-O 3.46Å; Q119-T137 PolarHBondContact O-N 2.96Å
138	C	97.3	Very high	94.5	Very high	41 Å²	41	93.1 Å²	93.1	28%	0.277	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	141.5	-173.4	-61.7	0	0	0	0	111.2	Y59 K117 C118	Y59-C138 HydrophobicContact CE2-CB 4.35Å; Y59-C138 VanDerWaalsContact CE2-SG 3.54Å; K117-C138 CarbonylContact O-C 3.58Å; K117-C138 VanDerWaalsContact O-CA 3.3Å; K117-C138 WeakPolarHBondContact O-CA 3.32Å; C118-C138 HydrophobicContact CB-CB 4.15Å; C118-C138 WeakPolarHBondContact CB-SG 3.38Å; C118-C138 WeakPolarHBondContact SG-CB 3.4Å; C118-C138 CovalentContact SG-SG 2.04Å; C118-C138 PolarHBondContact SG-SG 3.4Å
139	N	95.5	Very high	94.3	Very high	112 Å²	112	93.9 Å²	93.9	60%	0.599	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	147.5	176.2	-59.5	-76.3	0	0	0	109.5	V116 K117	V116-N139 CarbonylContact C-O 3.55Å; V116-N139 WeakPolarHBondContact CA-O 3.29Å; K117-N139 PolarHBondContact N-O 3.01Å; K117-N139 PolarHBondContact O-N 2.85Å
140	K	92.8	Very high	94.1	Very high	148 Å²	148	93.7 Å²	93.7	64%	0.643	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.3	173.4	-64.9	-169.9	179.4	-145.8	0	110.1	E114 V116	E114-K140 VanDerWaalsContact OE1-CE 3.28Å; E114-K140 WeakPolarHBondContact OE1-CE 3.45Å; E114-K140 IonicContact OE1-NZ 2.91Å; E114-K140 PolarHBondContact OE1-NZ 2.74Å; V116-K140 HydrophobicContact CG1-CG 4.42Å
141	V	87.3	Confident	93.8	Very high	73 Å²	73	89.6 Å²	89.6	44%	0.442	49%	0.485	S	S	.	.			trans	-81.4	118.4	168.8	-173.4	0	0	0	0	106.3	Q115 K117	Q115-V141 HydrophobicContact CB-CB 4.24Å; Q115-V141 HydrophobicContact CB-CG2 4.1Å; Q115-V141 PolarHBondContact O-N 3.37Å; K117-V141 HydrophobicContact CB-CG2 4Å
142	T	65.1	Low	93.3	Very high	201 Å²	201	94.9 Å²	94.9	100%	1.233	52%	0.516	S	S	*	.			trans	-80.4	0	177.8	-47.5	0	0	0	0	110.2

Retrieved 142 of 142 residues in 144.6 ms (Link to these results)

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