A0A087Y2Y2_POEFO Loading...

Single-stranded DNA binding protein 1

AlphaFold DB , UniProt , Accession A0A087Y2Y2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 147 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	42.7	Very low	245 Å²	245	169.7 Å²	169.7	100%	1.207	86%	0.864	S	S	*	*				0	90.3	0	-71.2	179.6	173.7	0	0	108.3
2	L	36.7	Very low	42.5	Very low	179 Å²	179	169.8 Å²	169.8	94%	0.937	86%	0.858	S	S	*	*			trans	-102.1	122.8	-175.4	-81.7	148.5	0	0	0	108.8	S4	L2-S4 PolarHBondContact O-N 3.04Å
3	R	37.9	Very low	43	Very low	251 Å²	251	168.3 Å²	168.3	95%	0.947	85%	0.853	S	S	*	*			trans	-73.1	112.9	-178.7	-68	-178.7	171.6	-151.1	-2.2	109.3
4	S	40.4	Very low	43.3	Very low	125 Å²	125	164.3 Å²	164.3	87%	0.874	84%	0.841	S	S	*	*			trans	-74.8	128.9	173.4	-173.2	0	0	0	0	110	L2	L2-S4 PolarHBondContact O-N 3.04Å
5	A	43.2	Very low	43.7	Very low	87 Å²	87	166.7 Å²	166.7	72%	0.719	84%	0.835	S	S	*	*			trans	-74.1	139.4	-172.7	0	0	0	0	0	112.4	V7	A5-V7 PolarHBondContact O-N 2.9Å
6	S	43	Very low	43.7	Very low	111 Å²	111	166.3 Å²	166.3	78%	0.776	83%	0.829	S	S	*	*			trans	-36.2	120.6	172.2	-50.1	0	0	0	0	114.7	Q8	S6-Q8 PolarHBondContact O-N 3.32Å
7	V	42.9	Very low	43.9	Very low	129 Å²	129	169.8 Å²	169.8	78%	0.782	83%	0.831	S	S	*	*			trans	-67.4	94.3	168	-177	0	0	0	0	108.4	A5 I9	A5-V7 PolarHBondContact O-N 2.9Å; V7-I9 HydrophobicContact CG1-CD1 4.47Å; V7-I9 HydrophobicContact CG1-CG1 3.78Å; V7-I9 PolarHBondContact O-N 2.79Å; V7-I9 VanDerWaalsContact O-N 3.1Å
8	Q	44.4	Very low	44.3	Very low	175 Å²	175	163.7 Å²	163.7	82%	0.818	81%	0.808	S	S	*	*			trans	-72.8	94.2	166.1	-78.7	178.2	-29.8	0	0	108.5	S6 F10	S6-Q8 PolarHBondContact O-N 3.32Å; Q8-F10 VanDerWaalsContact C-N 3.25Å; Q8-F10 PolarHBondContact O-N 3.3Å
9	I	49.2	Very low	44.9	Very low	148 Å²	148	161.7 Å²	161.7	76%	0.759	81%	0.806	S	S	*	*			trans	-72.2	87.2	168.4	-57.9	177.6	0	0	0	107.4	V7 R11	V7-I9 HydrophobicContact CG1-CD1 4.47Å; V7-I9 HydrophobicContact CG1-CG1 3.78Å; V7-I9 PolarHBondContact O-N 2.79Å; V7-I9 VanDerWaalsContact O-N 3.1Å; I9-R11 PolarHBondContact O-N 3.47Å; I9-R11 VanDerWaalsContact O-N 3.1Å
10	F	44.3	Very low	45.3	Very low	185 Å²	185	159.8 Å²	159.8	81%	0.811	80%	0.798	S	S	*	*			trans	-71.8	98.7	169.6	-138.5	-94.9	0	0	0	107.4	Q8 Q12	Q8-F10 VanDerWaalsContact C-N 3.25Å; Q8-F10 PolarHBondContact O-N 3.3Å; F10-Q12 VanDerWaalsContact C-N 3.3Å; F10-Q12 PolarHBondContact O-N 3.05Å
11	R	47.5	Very low	46	Very low	232 Å²	232	157.2 Å²	157.2	88%	0.875	80%	0.802	S	S	*	*			trans	-63.8	96.4	167.2	-104.7	-175.1	173.9	-167.4	-1.1	107.8	I9 L13	I9-R11 PolarHBondContact O-N 3.47Å; I9-R11 VanDerWaalsContact O-N 3.1Å; R11-L13 VanDerWaalsContact C-N 3.34Å; R11-L13 PolarHBondContact O-N 3.31Å
12	Q	40.1	Very low	46.8	Very low	170 Å²	170	152.9 Å²	152.9	79%	0.794	78%	0.784	S	S	*	*			trans	-60.4	94.7	170.3	-169.6	174.1	-4.2	0	0	108.4	F10 V14	F10-Q12 VanDerWaalsContact C-N 3.3Å; F10-Q12 PolarHBondContact O-N 3.05Å; Q12-V14 VanDerWaalsContact C-N 3.34Å; Q12-V14 PolarHBondContact O-N 2.85Å
13	L	49.4	Very low	48	Very low	151 Å²	151	149.3 Å²	149.3	79%	0.791	77%	0.765	S	S	*	*			trans	-66.1	100.1	164	-112.2	150.1	0	0	0	106.1	R11 R15	R11-L13 VanDerWaalsContact C-N 3.34Å; R11-L13 PolarHBondContact O-N 3.31Å; L13-R15 PolarHBondContact O-N 3.04Å
14	V	47.9	Very low	49.4	Very low	112 Å²	112	145.4 Å²	145.4	68%	0.679	76%	0.761	S	S	*	*			trans	-62.8	85.2	168.6	179.3	0	0	0	0	107	Q12 H16	Q12-V14 VanDerWaalsContact C-N 3.34Å; Q12-V14 PolarHBondContact O-N 2.85Å; V14-H16 PolarHBondContact O-N 3.23Å
15	R	48.7	Very low	51	Low	201 Å²	201	146 Å²	146	76%	0.758	75%	0.754	S	S	*	*			trans	-76.5	100.2	157.2	-75.2	-174	175.2	-176.1	-3.1	105.2	L13 R17	L13-R15 PolarHBondContact O-N 3.04Å; R15-R17 VanDerWaalsContact C-N 3.31Å; R15-R17 PolarHBondContact O-N 3.4Å
16	H	43.3	Very low	53	Low	160 Å²	160	150.2 Å²	150.2	74%	0.741	76%	0.759	S	S	*	*			trans	-57.9	97.4	169.5	-154.5	-70.9	0	0	0	107.7	V14 S18	V14-H16 PolarHBondContact O-N 3.23Å; H16-S18 VanDerWaalsContact C-N 3.35Å; H16-S18 PolarHBondContact O-N 3.21Å
17	R	47.8	Very low	55.2	Low	226 Å²	226	156.5 Å²	156.5	85%	0.853	77%	0.766	S	S	*	*			trans	-83.6	86.3	165.2	-88.2	-170.9	175.2	-171.9	-0.4	106.4	R15 T19	R15-R17 VanDerWaalsContact C-N 3.31Å; R15-R17 PolarHBondContact O-N 3.4Å; R17-T19 PolarHBondContact O-N 3.06Å
18	S	50.2	Low	57.6	Low	60 Å²	60	155.6 Å²	155.6	42%	0.42	77%	0.765	S	S	.	*			trans	-68.5	110.3	160.1	35.2	0	0	0	0	107.2	H16 D20	H16-S18 VanDerWaalsContact C-N 3.35Å; H16-S18 PolarHBondContact O-N 3.21Å; S18-D20 VanDerWaalsContact C-N 3.31Å; S18-D20 PolarHBondContact O-N 3.21Å
19	T	55.5	Low	60.1	Low	126 Å²	126	154.9 Å²	154.9	77%	0.773	77%	0.765	S	S	*	*			trans	-96.4	65	176.3	-41.3	0	0	0	0	107	R17	R17-T19 PolarHBondContact O-N 3.06Å
20	D	54	Low	62.3	Low	122 Å²	122	152 Å²	152	65%	0.652	75%	0.752	S	S	*	*			trans	-130.3	111	177.1	-72.9	-48.1	0	0	0	109.5	S18 N22	S18-D20 VanDerWaalsContact C-N 3.31Å; S18-D20 PolarHBondContact O-N 3.21Å; D20-N22 PolarHBondContact O-N 2.8Å
21	A	59.8	Low	64.8	Low	106 Å²	106	151 Å²	151	88%	0.876	74%	0.742	S	S	*	*	S	Bend	trans	-75.6	34.8	-172.7	0	0	0	0	0	114.1
22	N	56.9	Low	67.2	Low	155 Å²	155	141.2 Å²	141.2	83%	0.829	71%	0.708	S	S	*	*			trans	-155.6	56.2	169	-99.4	-31.2	0	0	0	110.5	D20 I24	D20-N22 PolarHBondContact O-N 2.8Å; N22-I24 PolarHBondContact O-N 3.41Å
23	L	61.1	Low	69.9	Low	103 Å²	103	138.5 Å²	138.5	54%	0.539	70%	0.696	S	S	.	*			trans	-73.4	95.6	166.6	-72.5	159	0	0	0	107.9	L25	L23-L25 HydrophobicContact CB-CG 4.21Å; L23-L25 PolarHBondContact O-N 3.45Å
24	I	67.1	Low	72.2	Confident	169 Å²	169	132.5 Å²	132.5	87%	0.867	66%	0.664	S	S	*	*			trans	-61.3	88.9	148.4	-61.2	175.9	0	0	0	104.4	N22 E26	N22-I24 PolarHBondContact O-N 3.41Å; I24-E26 PolarHBondContact O-N 2.93Å
25	L	75.3	Confident	74.6	Confident	139 Å²	139	131.2 Å²	131.2	73%	0.728	65%	0.653	S	S	*	*			trans	-57.1	124.9	176.7	-82.2	155	0	0	0	107.3	L23 R27	L23-L25 HydrophobicContact CB-CG 4.21Å; L23-L25 PolarHBondContact O-N 3.45Å; L25-R27 PolarHBondContact O-N 3.17Å
26	E	85.6	Confident	76.9	Confident	175 Å²	175	122 Å²	122	82%	0.818	62%	0.621	S	S	*	*			trans	-53	131.4	173.9	-175.3	-174.5	171	0	0	109.3	I24 S28	I24-E26 PolarHBondContact O-N 2.93Å; E26-S28 PolarHBondContact O-N 2.8Å
27	R	88.6	Confident	79.4	Confident	242 Å²	242	121 Å²	121	91%	0.913	61%	0.61	S	S	*	*			trans	-76.4	109.4	175.7	-71	-169.9	169.6	125.4	-0.9	108.9	L25	L25-R27 PolarHBondContact O-N 3.17Å
28	S	93.8	Very high	81.7	Confident	110 Å²	110	110.4 Å²	110.4	77%	0.769	57%	0.571	S	S	*	*			trans	-98.8	161.2	172.1	60.2	0	0	0	0	111.8	E26	E26-S28 PolarHBondContact O-N 2.8Å
29	I	95.4	Very high	83.9	Confident	161 Å²	161	108.5 Å²	108.5	83%	0.826	56%	0.561	S	S	*	*			trans	-114.1	122.4	178.2	-60.1	174.9	0	0	0	108.9	R31	I29-R31 HydrophobicContact CG2-CB 4.26Å
30	N	96.3	Very high	85.8	Confident	88 Å²	88	107.6 Å²	107.6	47%	0.471	55%	0.548	S	S	.	.			trans	-125.5	103.4	167.2	176.7	-6.5	0	0	0	107.5	L113	N30-L113 PolarHBondContact ND2-O 3.27Å; N30-L113 PolarHBondContact OD1-N 2.99Å
31	R	96.8	Very high	87.7	Confident	163 Å²	163	106 Å²	106	62%	0.615	54%	0.539	S	S	*	.			trans	-134.5	132.1	-178.8	-173.1	174.7	-176.3	166.6	2.2	109.6	I29 E110 G111	I29-R31 HydrophobicContact CG2-CB 4.26Å; R31-E110 IonicContact CZ-OE1 3.84Å; R31-E110 IonicContact NE-OE1 3.99Å; R31-E110 IonicContact NH2-OE1 2.86Å; R31-E110 PolarHBondContact NH2-OE1 3.07Å; R31-G111 CarbonylContact C-O 3.56Å; R31-G111 WeakPolarHBondContact CA-O 3.32Å
32	V	97.7	Very high	89.5	Confident	27 Å²	27	101.4 Å²	101.4	16%	0.164	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.4	175.5	177.5	0	0	0	0	108.1	L34 E110 G111 L113 I131	V32-L34 HydrophobicContact CG1-CD1 4.3Å; V32-L34 HydrophobicContact CG1-CD2 4.25Å; V32-L34 HydrophobicContact CG1-CG 3.85Å; V32-E110 WeakPolarHBondContact O-CA 3.41Å; V32-G111 PolarHBondContact N-O 2.94Å; V32-G111 PolarHBondContact O-N 2.87Å; V32-L113 HydrophobicContact CG2-CB 3.96Å; V32-I131 HydrophobicContact CB-CG2 4.36Å; V32-I131 HydrophobicContact CG1-CD1 3.94Å; V32-I131 HydrophobicContact CG1-CG1 4.36Å; V32-I131 HydrophobicContact CG1-CG2 4.24Å
33	Q	97.7	Very high	91.3	Very high	113 Å²	113	98.2 Å²	98.2	53%	0.528	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.6	171.4	-66.7	-178.7	-30.7	0	0	108	V109 E110	Q33-V109 WeakPolarHBondContact CA-O 3.29Å; Q33-E110 HydrophobicContact CG-CG 4.13Å; Q33-E110 PolarHBondContact NE2-OE1 2.81Å
34	L	97.5	Very high	93	Very high	24 Å²	24	96.3 Å²	96.3	13%	0.126	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.5	179	-62.7	-179.6	0	0	0	110.4	V32 L58 T60 H84 L108 V109 I131	V32-L34 HydrophobicContact CG1-CD1 4.3Å; V32-L34 HydrophobicContact CG1-CD2 4.25Å; V32-L34 HydrophobicContact CG1-CG 3.85Å; L34-L58 HydrophobicContact CB-CD2 3.59Å; L34-L58 HydrophobicContact CD1-CD2 4.02Å; L34-L58 HydrophobicContact CG-CD2 4.49Å; L34-T60 HydrophobicContact CD2-CG2 4.33Å; L34-H84 HydrophobicContact CD1-CB 3.83Å; L34-L108 CarbonylContact O-C 3.6Å; L34-L108 VanDerWaalsContact O-CA 3.29Å; L34-L108 WeakPolarHBondContact O-CA 3.48Å; L34-V109 PolarHBondContact N-O 3.02Å; L34-V109 PolarHBondContact O-N 2.78Å; L34-I131 HydrophobicContact CD1-CD1 3.25Å; L34-I131 HydrophobicContact CG-CD1 4.28Å
35	L	97.4	Very high	94.1	Very high	86 Å²	86	95.4 Å²	95.4	45%	0.45	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.4	168.4	-171.5	155.9	0	0	0	107.8	L108 L139	L35-L108 HydrophobicContact CB-CD1 3.99Å; L35-L108 HydrophobicContact CD1-CD1 4.46Å; L35-L139 HydrophobicContact CD1-CD1 3.64Å; L35-L139 HydrophobicContact CG-CD1 3.89Å
36	G	96.5	Very high	94.9	Very high	8 Å²	8	96 Å²	96	8%	0.082	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	-170.6	-171.8	0	0	0	0	0	113.3	A59 R106 I107	G36-A59 WeakPolarHBondContact CA-O 3.29Å; G36-R106 WeakPolarHBondContact O-CA 3.2Å; G36-I107 PolarHBondContact N-O 3.42Å; G36-I107 VanDerWaalsContact N-O 3.1Å; G36-I107 PolarHBondContact O-N 2.88Å; G36-I107 VanDerWaalsContact O-N 3.09Å
37	R	96.4	Very high	94.9	Very high	137 Å²	137	90.5 Å²	90.5	52%	0.517	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.5	174.9	-69.8	-172.9	178.5	-82	2.8	110.9	A59 G104 S105	R37-A59 PolarHBondContact N-O 3.25Å; R37-A59 PolarHBondContact O-N 2.85Å; R37-G104 PolarHBondContact NH1-O 3.13Å; R37-S105 WeakPolarHBondContact CA-O 3.34Å
38	V	97	Very high	94.6	Very high	4 Å²	4	88.2 Å²	88.2	2%	0.024	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.7	-179.8	174	0	0	0	0	109.8	Q40 F56 S57 L58 V101 K102 G104 S105 I107	V38-Q40 WeakPolarHBondContact CG1-O 3.46Å; V38-F56 HydrophobicContact CG2-CD2 4.28Å; V38-S57 CarbonylContact C-O 3.59Å; V38-S57 WeakPolarHBondContact CA-O 3.37Å; V38-L58 HydrophobicContact CG2-CD1 4.09Å; V38-V101 HydrophobicContact CB-CG1 4.18Å; V38-V101 HydrophobicContact CG1-CG1 3.81Å; V38-V101 HydrophobicContact CG2-CG1 3.58Å; V38-K102 WeakPolarHBondContact CB-O 3.48Å; V38-K102 WeakPolarHBondContact CG1-O 3.41Å; V38-G104 PolarHBondContact O-N 3.02Å; V38-S105 WeakPolarHBondContact CG2-O 3.5Å; V38-S105 PolarHBondContact N-O 2.74Å; V38-I107 HydrophobicContact CG2-CD1 3.54Å; V38-I107 HydrophobicContact CG2-CG1 3.94Å
39	G	95.4	Very high	94.1	Very high	20 Å²	20	87.3 Å²	87.3	21%	0.206	45%	0.446	C	S	.	.			trans	-81.8	-35.2	-176.2	0	0	0	0	0	114.8	S57 W83 K103	G39-S57 PolarHBondContact N-O 2.96Å; G39-W83 VanDerWaalsContact CA-CZ3 3.48Å; G39-K103 WeakPolarHBondContact O-CG 3.03Å
40	Q	94.7	Very high	93.5	Very high	108 Å²	108	88.8 Å²	88.8	51%	0.505	44%	0.442	S	S	.	.	S	Bend	trans	-144.6	156.7	-176.6	67.8	-172.2	-21.2	0	0	110	V38	V38-Q40 WeakPolarHBondContact CG1-O 3.46Å
41	D	95.3	Very high	93.2	Very high	87 Å²	87	90.6 Å²	90.6	47%	0.465	45%	0.451	S	S	.	.			trans	-58.9	145.2	176.5	-66.8	-41.2	0	0	0	111.4	K102 K103	D41-K102 WeakPolarHBondContact OD1-CA 3.21Å; D41-K103 PolarHBondContact OD1-N 3.39Å
42	P	96.6	Very high	93.1	Very high	11 Å²	11	83.9 Å²	83.9	7%	0.071	43%	0.429	C	S	.	.			trans	-65.7	137.2	-178.4	29.1	-36.8	0	0	0	111.2	T54 I55 F56 Y98 V101	P42-T54 HydrophobicContact CB-CG2 3.68Å; P42-I55 WeakPolarHBondContact CA-O 3.33Å; P42-F56 HydrophobicContact CB-CB 4.24Å; P42-F56 HydrophobicContact CB-CD1 4.43Å; P42-Y98 HydrophobicContact CG-CD2 4.39Å; P42-V101 WeakPolarHBondContact CD-O 3.4Å; P42-V101 HydrophobicContact CG-CB 4.11Å; P42-V101 HydrophobicContact CG-CG1 4.48Å; P42-V101 VanDerWaalsContact CG-O 3.24Å; P42-V101 WeakPolarHBondContact CG-O 3.36Å
43	V	96.1	Very high	92.9	Very high	87 Å²	87	83.3 Å²	83.3	53%	0.527	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.8	176.3	-178.9	0	0	0	0	108.9	I55	V43-I55 PolarHBondContact N-O 2.94Å; V43-I55 PolarHBondContact O-N 2.92Å
44	M	95	Very high	92.9	Very high	64 Å²	64	78 Å²	78	32%	0.315	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.8	170.2	-171.6	175.7	-73.8	0	0	109.2	P52 Y98	M44-P52 HydrophobicContact CG-CB 4.37Å; M44-P52 HydrophobicContact SD-CB 4.45Å; M44-Y98 HydrophobicContact CB-CD2 3.83Å; M44-Y98 HydrophobicContact CB-CE2 3.91Å; M44-Y98 HydrophobicContact CB-CG 4.29Å; M44-Y98 HydrophobicContact CE-CD1 3.95Å; M44-Y98 HydrophobicContact CE-CG 3.86Å
45	R	92.2	Very high	92.8	Very high	150 Å²	150	78 Å²	78	57%	0.566	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	121.1	176	-175.2	176	176.9	160	-1	109.2	V47 P52 V53 I55	R45-V47 HydrophobicContact CG-CG2 4.17Å; R45-P52 WeakPolarHBondContact O-CA 3.41Å; R45-V53 HydrophobicContact CB-CG1 4.09Å; R45-V53 PolarHBondContact N-O 2.87Å; R45-V53 WeakPolarHBondContact O-CG1 3.19Å; R45-V53 PolarHBondContact O-N 3.14Å; R45-I55 HydrophobicContact CB-CD1 4.17Å
46	Q	90.3	Very high	92.8	Very high	150 Å²	150	74 Å²	74	70%	0.701	38%	0.379	S	S	*	.			trans	-107.5	124.5	168.7	-170.5	169.9	-17.7	0	0	108.2	P52	Q46-P52 HydrophobicContact CB-CB 4.18Å; Q46-P52 HydrophobicContact CG-CB 4.28Å
47	V	85.9	Confident	92.8	Very high	61 Å²	61	74.6 Å²	74.6	37%	0.37	38%	0.382	S	S	.	.			trans	-108	136.6	173.1	-179.7	0	0	0	0	106.7	R45 G49 R50	R45-V47 HydrophobicContact CG-CG2 4.17Å; V47-G49 PolarHBondContact O-N 2.74Å; V47-R50 HydrophobicContact CB-CB 4.31Å; V47-R50 PolarHBondContact O-N 2.86Å
48	E	82.9	Confident	92.9	Very high	193 Å²	193	68.1 Å²	68.1	90%	0.902	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	129.8	178.2	-65.9	179.1	179.2	0	0	110.9	R50	E48-R50 VanDerWaalsContact C-N 3.26Å; E48-R50 PolarHBondContact O-N 2.92Å
49	G	83.4	Confident	92.9	Very high	91 Å²	91	68.5 Å²	68.5	94%	0.938	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	3.2	-177.3	0	0	0	0	0	116	V47	V47-G49 PolarHBondContact O-N 2.74Å
50	R	83.4	Confident	93	Very high	193 Å²	193	69.2 Å²	69.2	73%	0.728	36%	0.362	S	S	*	.	S	Bend	trans	-121.5	150.4	175.2	-63.1	-171.7	-179.7	-164	0.2	112	V47 E48	V47-R50 HydrophobicContact CB-CB 4.31Å; V47-R50 PolarHBondContact O-N 2.86Å; E48-R50 VanDerWaalsContact C-N 3.26Å; E48-R50 PolarHBondContact O-N 2.92Å
51	N	88.9	Confident	93	Very high	126 Å²	126	68.5 Å²	68.5	67%	0.674	36%	0.362	S	S	*	.			trans	-58.6	138.4	172.1	-70.3	-28.9	0	0	0	110.3
52	P	93.9	Very high	92.9	Very high	22 Å²	22	69.9 Å²	69.9	14%	0.143	37%	0.365	C	S	.	.			trans	-63	146.8	176.3	19.7	-25.8	0	0	0	110.6	M44 R45 Q46 R94	M44-P52 HydrophobicContact CG-CB 4.37Å; M44-P52 HydrophobicContact SD-CB 4.45Å; R45-P52 WeakPolarHBondContact O-CA 3.41Å; Q46-P52 HydrophobicContact CB-CB 4.18Å; Q46-P52 HydrophobicContact CG-CB 4.28Å; P52-R94 VanDerWaalsContact CD-NH1 3.3Å; P52-R94 WeakPolarHBondContact O-CD 3.45Å; P52-R94 PolarHBondContact O-NH1 3.39Å
53	V	94.9	Very high	92.6	Very high	15 Å²	15	75.2 Å²	75.2	9%	0.091	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.9	-177.6	61.7	0	0	0	0	109.8	R45 I55 V88 F89	R45-V53 HydrophobicContact CB-CG1 4.09Å; R45-V53 PolarHBondContact N-O 2.87Å; R45-V53 WeakPolarHBondContact O-CG1 3.19Å; R45-V53 PolarHBondContact O-N 3.14Å; V53-I55 HydrophobicContact CG1-CD1 3.91Å; V53-I55 HydrophobicContact CG1-CG1 4.18Å; V53-I55 HydrophobicContact CG2-CG1 4.06Å; V53-V88 WeakPolarHBondContact CG2-O 3.04Å; V53-F89 HydrophobicContact CB-CD1 3.9Å; V53-F89 HydrophobicContact CB-CE1 3.7Å; V53-F89 HydrophobicContact CB-CZ 4.32Å; V53-F89 HydrophobicContact CG1-CE1 4.38Å; V53-F89 HydrophobicContact CG2-CD1 3.76Å; V53-F89 HydrophobicContact CG2-CD2 4.25Å; V53-F89 HydrophobicContact CG2-CE1 3.53Å; V53-F89 HydrophobicContact CG2-CE2 4.04Å; V53-F89 HydrophobicContact CG2-CG 4.13Å; V53-F89 HydrophobicContact CG2-CZ 3.69Å
54	T	96.8	Very high	92.2	Very high	0 Å²	0	77.4 Å²	77.4	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.4	171.7	-59.8	0	0	0	0	109.1	P42 V88 R94 A97	P42-T54 HydrophobicContact CB-CG2 3.68Å; T54-V88 PolarHBondContact N-O 3.33Å; T54-V88 VanDerWaalsContact N-O 3.13Å; T54-V88 PolarHBondContact O-N 3.3Å; T54-R94 PolarHBondContact OG1-O 3.09Å; T54-A97 HydrophobicContact CG2-CB 4.02Å
55	I	96.3	Very high	91.6	Very high	26 Å²	26	84.7 Å²	84.7	13%	0.133	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.3	-175.4	-58.5	157.2	0	0	0	109.7	P42 V43 R45 V53 R85 V86	P42-I55 WeakPolarHBondContact CA-O 3.33Å; V43-I55 PolarHBondContact N-O 2.94Å; V43-I55 PolarHBondContact O-N 2.92Å; R45-I55 HydrophobicContact CB-CD1 4.17Å; V53-I55 HydrophobicContact CG1-CD1 3.91Å; V53-I55 HydrophobicContact CG1-CG1 4.18Å; V53-I55 HydrophobicContact CG2-CG1 4.06Å; I55-R85 VanDerWaalsContact CD1-NH2 3.35Å; I55-R85 HydrophobicContact CG2-CG 4.27Å; I55-V86 WeakPolarHBondContact CA-O 3.32Å
56	F	97	Very high	90.4	Very high	2 Å²	2	79.7 Å²	79.7	1%	0.009	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	167	172.9	58	-92.5	0	0	0	111.5	V38 P42 V86 V88 A97 I107 V109 I136	V38-F56 HydrophobicContact CG2-CD2 4.28Å; P42-F56 HydrophobicContact CB-CB 4.24Å; P42-F56 HydrophobicContact CB-CD1 4.43Å; F56-V86 HydrophobicContact CD2-CB 4.05Å; F56-V86 HydrophobicContact CD2-CG2 4.39Å; F56-V86 HydrophobicContact CE1-CB 4.24Å; F56-V86 HydrophobicContact CE1-CG1 3.99Å; F56-V86 HydrophobicContact CE2-CB 3.61Å; F56-V86 HydrophobicContact CE2-CG1 3.9Å; F56-V86 HydrophobicContact CE2-CG2 3.84Å; F56-V86 HydrophobicContact CZ-CB 3.74Å; F56-V86 HydrophobicContact CZ-CG1 3.5Å; F56-V86 VanDerWaalsContact CZ-CG1 3.5Å; F56-V86 HydrophobicContact CZ-CG2 4.32Å; F56-V86 PolarHBondContact N-O 3.3Å; F56-V86 VanDerWaalsContact N-O 3.1Å; F56-V86 PolarHBondContact O-N 2.8Å; F56-V88 HydrophobicContact CE1-CG2 3.76Å; F56-A97 HydrophobicContact CE1-CB 4.42Å; F56-I107 HydrophobicContact CD2-CD1 4.49Å; F56-I107 HydrophobicContact CE2-CD1 3.61Å; F56-I107 HydrophobicContact CZ-CD1 3.87Å; F56-V109 HydrophobicContact CE2-CG2 4.35Å; F56-V109 HydrophobicContact CZ-CG2 4.28Å; F56-I136 HydrophobicContact CE1-CD1 4.2Å; F56-I136 HydrophobicContact CZ-CD1 4.07Å
57	S	97.3	Very high	89.2	Confident	20 Å²	20	75.8 Å²	75.8	14%	0.14	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	140.6	174.2	62.2	0	0	0	0	111.4	V38 G39 H84	V38-S57 CarbonylContact C-O 3.59Å; V38-S57 WeakPolarHBondContact CA-O 3.37Å; G39-S57 PolarHBondContact N-O 2.96Å; S57-H84 CarbonylContact C-O 3.6Å; S57-H84 VanDerWaalsContact CA-O 3.3Å; S57-H84 WeakPolarHBondContact CA-O 3.45Å
58	L	97.5	Very high	88	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.3	177.2	-168.7	78.6	0	0	0	109.9	L34 V38 H84 V86 I107 V109	L34-L58 HydrophobicContact CB-CD2 3.59Å; L34-L58 HydrophobicContact CD1-CD2 4.02Å; L34-L58 HydrophobicContact CG-CD2 4.49Å; V38-L58 HydrophobicContact CG2-CD1 4.09Å; L58-H84 HydrophobicContact CB-CB 4.42Å; L58-H84 PolarHBondContact N-O 2.98Å; L58-H84 PolarHBondContact O-N 3.29Å; L58-H84 PolarHBondContact O-ND1 2.8Å; L58-V86 HydrophobicContact CB-CG2 4.23Å; L58-I107 HydrophobicContact CD1-CD1 3.98Å; L58-I107 HydrophobicContact CD1-CG1 3.61Å; L58-V109 HydrophobicContact CD2-CG2 4.22Å
59	A	97.7	Very high	86.6	Confident	13 Å²	13	75.5 Å²	75.5	11%	0.107	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	131.8	172.8	0	0	0	0	0	110.6	G36 R37 T81 T82 W83	G36-A59 WeakPolarHBondContact CA-O 3.29Å; R37-A59 PolarHBondContact N-O 3.25Å; R37-A59 PolarHBondContact O-N 2.85Å; A59-T81 HydrophobicContact CB-CG2 4Å; A59-T82 WeakPolarHBondContact CA-O 3.38Å; A59-W83 HydrophobicContact CB-CD2 4.34Å; A59-W83 HydrophobicContact CB-CE3 3.89Å; A59-W83 HydrophobicContact CB-CH2 3.88Å; A59-W83 HydrophobicContact CB-CZ2 4.31Å; A59-W83 HydrophobicContact CB-CZ3 3.62Å
60	T	97	Very high	85.2	Confident	34 Å²	34	80.1 Å²	80.1	21%	0.209	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.3	161.7	67.3	0	0	0	0	109.2	L34 T81 T82 H84	L34-T60 HydrophobicContact CD2-CG2 4.33Å; T60-T81 CarbonylContact O-C 3.58Å; T60-T81 WeakPolarHBondContact O-CA 3.35Å; T60-T82 PolarHBondContact N-O 2.87Å; T60-T82 PolarHBondContact O-N 3.02Å; T60-H84 PolarHBondContact OG1-CE1 3.45Å
61	N	95.1	Very high	84	Confident	94 Å²	94	77.3 Å²	77.3	50%	0.503	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.2	-178.6	-60.8	-31.2	0	0	0	109.1	K80 T81	N61-K80 WeakPolarHBondContact CA-O 3.39Å; N61-T81 WeakPolarHBondContact OD1-CG2 3.49Å; N61-T81 PolarHBondContact OD1-OG1 2.91Å; N61-T81 VanDerWaalsContact OD1-OG1 3.12Å
62	E	93.1	Very high	82.3	Confident	116 Å²	116	76.5 Å²	76.5	54%	0.542	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.1	172.2	-173.4	177.1	-176.9	0	0	107.9	Q79 K80	E62-Q79 CarbonylContact O-C 3.5Å; E62-Q79 WeakPolarHBondContact O-CA 3.21Å; E62-K80 PolarHBondContact N-O 2.83Å; E62-K80 PolarHBondContact O-N 3.45Å
63	M	89.8	Confident	80.5	Confident	123 Å²	123	80.9 Å²	80.9	61%	0.606	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.6	179.4	-66.7	172.9	175.6	0	0	108.8	V77 S78 Q79	M63-V77 HydrophobicContact CB-CG1 4.43Å; M63-S78 WeakPolarHBondContact CA-O 3.42Å; M63-Q79 HydrophobicContact CE-CG 4.36Å; M63-Q79 HydrophobicContact CG-CB 4.29Å; M63-Q79 HydrophobicContact CG-CG 4.1Å
64	W	87.3	Confident	78.6	Confident	132 Å²	132	86.6 Å²	86.6	50%	0.5	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	148.9	177.2	58.8	-91.5	0	0	0	109.9	S66 S78	W64-S66 WeakPolarHBondContact CH2-OG 3.46Å; W64-S66 VanDerWaalsContact CZ3-CA 3.46Å; W64-S66 VanDerWaalsContact CZ3-CB 3.45Å; W64-S66 WeakPolarHBondContact CZ3-OG 3.48Å; W64-S78 WeakPolarHBondContact CZ2-OG 3.12Å; W64-S78 PolarHBondContact N-O 2.86Å; W64-S78 PolarHBondContact O-N 2.78Å
65	R	82.1	Confident	76.9	Confident	218 Å²	218	89 Å²	89	82%	0.823	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	124	176.9	-68.2	-172.1	175.5	101.3	-0.6	108.7	G67 V77	R65-G67 PolarHBondContact O-N 2.98Å; R65-V77 HydrophobicContact CG-CG2 4.4Å
66	S	68.4	Low	75.7	Confident	45 Å²	45	93.8 Å²	93.8	32%	0.315	54%	0.543	S	S	.	.			trans	-81.6	111.9	170.6	-45.4	0	0	0	0	108.6	W64 D76 S78	W64-S66 WeakPolarHBondContact CH2-OG 3.46Å; W64-S66 VanDerWaalsContact CZ3-CA 3.46Å; W64-S66 VanDerWaalsContact CZ3-CB 3.45Å; W64-S66 WeakPolarHBondContact CZ3-OG 3.48Å; S66-D76 PolarHBondContact N-O 3.4Å; S66-D76 VanDerWaalsContact N-O 3.13Å; S66-S78 PolarHBondContact OG-OG 2.82Å
67	G	64.6	Low	74.9	Confident	68 Å²	68	98 Å²	98	70%	0.701	57%	0.569	S	S	*	*			trans	-179.5	90.3	174.9	0	0	0	0	0	111.9	R65 G69	R65-G67 PolarHBondContact O-N 2.98Å; G67-G69 PolarHBondContact O-N 3.39Å
68	D	61.4	Low	74.4	Confident	178 Å²	178	98.8 Å²	98.8	95%	0.952	58%	0.575	S	S	*	*			trans	-79.4	106.8	163	-78.2	-28.6	0	0	0	108
69	G	53.4	Low	74	Confident	69 Å²	69	103.8 Å²	103.8	71%	0.711	60%	0.598	S	S	*	*	S	Bend	trans	83.4	135.2	163.4	0	0	0	0	0	116.3	G67	G67-G69 PolarHBondContact O-N 3.39Å
70	E	53	Low	73.8	Confident	189 Å²	189	109.2 Å²	109.2	88%	0.883	62%	0.619	S	S	*	*	S	Bend	trans	10.7	120.7	160	-68.4	176.7	156.3	0	0	119
71	T	59.4	Low	73.8	Confident	134 Å²	134	110.5 Å²	110.5	82%	0.822	63%	0.627	S	S	*	*			trans	73.6	79.1	158	-35.6	0	0	0	0	115.1
72	S	51.9	Low	73.9	Confident	108 Å²	108	108.5 Å²	108.5	76%	0.755	62%	0.618	S	S	*	*			trans	-145.7	111.3	154.1	-76.8	0	0	0	0	110.6	T74	S72-T74 PolarHBondContact O-N 3.03Å
73	S	55.9	Low	74	Confident	115 Å²	115	110.3 Å²	110.3	80%	0.804	62%	0.62	S	S	*	*	S	Bend	trans	-49.5	124.2	164.3	42.2	0	0	0	0	110.5
74	T	56	Low	74.4	Confident	134 Å²	134	106.4 Å²	106.4	82%	0.822	60%	0.601	S	S	*	*	S	Bend	trans	70.4	71.6	176.7	-43.4	0	0	0	0	113.3	S72 D76	S72-T74 PolarHBondContact O-N 3.03Å; T74-D76 PolarHBondContact O-N 2.88Å
75	G	60.7	Low	74.8	Confident	52 Å²	52	105 Å²	105	54%	0.536	60%	0.595	S	S	.	*			trans	-63.8	124.9	177.4	0	0	0	0	0	113	V77	G75-V77 PolarHBondContact O-N 2.85Å
76	D	71.3	Confident	75.5	Confident	125 Å²	125	94.6 Å²	94.6	67%	0.668	56%	0.556	S	S	*	*			trans	-64.2	112.4	175.2	-72.6	-34.6	0	0	0	110.3	S66 T74	S66-D76 PolarHBondContact N-O 3.4Å; S66-D76 VanDerWaalsContact N-O 3.13Å; T74-D76 PolarHBondContact O-N 2.88Å
77	V	79.6	Confident	76.9	Confident	91 Å²	91	92.6 Å²	92.6	55%	0.552	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	113.6	171.5	-177.8	0	0	0	0	108.2	M63 R65 G75	M63-V77 HydrophobicContact CB-CG1 4.43Å; R65-V77 HydrophobicContact CG-CG2 4.4Å; G75-V77 PolarHBondContact O-N 2.85Å
78	S	86.6	Confident	78.4	Confident	37 Å²	37	89.3 Å²	89.3	26%	0.259	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	142	176.7	-65.7	0	0	0	0	110.9	M63 W64 S66	M63-S78 WeakPolarHBondContact CA-O 3.42Å; W64-S78 WeakPolarHBondContact CZ2-OG 3.12Å; W64-S78 PolarHBondContact N-O 2.86Å; W64-S78 PolarHBondContact O-N 2.78Å; S66-S78 PolarHBondContact OG-OG 2.82Å
79	Q	90.6	Very high	80	Confident	105 Å²	105	85.2 Å²	85.2	49%	0.491	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.7	177.6	-177.7	-178.2	-26.4	0	0	111.3	E62 M63	E62-Q79 CarbonylContact O-C 3.5Å; E62-Q79 WeakPolarHBondContact O-CA 3.21Å; M63-Q79 HydrophobicContact CE-CG 4.36Å; M63-Q79 HydrophobicContact CG-CB 4.29Å; M63-Q79 HydrophobicContact CG-CG 4.1Å
80	K	93.4	Very high	82	Confident	127 Å²	127	87.6 Å²	87.6	55%	0.552	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	128.8	171.8	-175.8	178	177.3	-176.7	0	110.2	N61 E62	N61-K80 WeakPolarHBondContact CA-O 3.39Å; E62-K80 PolarHBondContact N-O 2.83Å; E62-K80 PolarHBondContact O-N 3.45Å
81	T	95.4	Very high	83.8	Confident	60 Å²	60	82.3 Å²	82.3	37%	0.368	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.6	176	-54.7	0	0	0	0	109.8	A59 T60 N61 W83	A59-T81 HydrophobicContact CB-CG2 4Å; T60-T81 CarbonylContact O-C 3.58Å; T60-T81 WeakPolarHBondContact O-CA 3.35Å; N61-T81 WeakPolarHBondContact OD1-CG2 3.49Å; N61-T81 PolarHBondContact OD1-OG1 2.91Å; N61-T81 VanDerWaalsContact OD1-OG1 3.12Å; T81-W83 HydrophobicContact CG2-CZ2 4.49Å
82	T	97.2	Very high	85.4	Confident	52 Å²	52	78.2 Å²	78.2	32%	0.319	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.8	176.6	-57.4	0	0	0	0	110.1	A59 T60 H84	A59-T82 WeakPolarHBondContact CA-O 3.38Å; T60-T82 PolarHBondContact N-O 2.87Å; T60-T82 PolarHBondContact O-N 3.02Å; T82-H84 VanDerWaalsContact CG2-CE1 3.43Å; T82-H84 WeakPolarHBondContact CG2-CE1 3.35Å; T82-H84 PolarHBondContact O-CE1 3Å; T82-H84 PolarHBondContact O-ND1 2.79Å
83	W	96.8	Very high	87.5	Confident	154 Å²	154	74.2 Å²	74.2	58%	0.583	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	120.1	-179.9	-69.6	99.7	0	0	0	111.1	G39 A59 T81	G39-W83 VanDerWaalsContact CA-CZ3 3.48Å; A59-W83 HydrophobicContact CB-CD2 4.34Å; A59-W83 HydrophobicContact CB-CE3 3.89Å; A59-W83 HydrophobicContact CB-CH2 3.88Å; A59-W83 HydrophobicContact CB-CZ2 4.31Å; A59-W83 HydrophobicContact CB-CZ3 3.62Å; T81-W83 HydrophobicContact CG2-CZ2 4.49Å
84	H	97.1	Very high	89.4	Confident	42 Å²	42	70.4 Å²	70.4	19%	0.194	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.6	-180	-54.9	78.4	0	0	0	109.9	L34 S57 L58 T60 T82 I131	L34-H84 HydrophobicContact CD1-CB 3.83Å; S57-H84 CarbonylContact C-O 3.6Å; S57-H84 VanDerWaalsContact CA-O 3.3Å; S57-H84 WeakPolarHBondContact CA-O 3.45Å; L58-H84 HydrophobicContact CB-CB 4.42Å; L58-H84 PolarHBondContact N-O 2.98Å; L58-H84 PolarHBondContact O-N 3.29Å; L58-H84 PolarHBondContact O-ND1 2.8Å; T60-H84 PolarHBondContact OG1-CE1 3.45Å; T82-H84 VanDerWaalsContact CG2-CE1 3.43Å; T82-H84 WeakPolarHBondContact CG2-CE1 3.35Å; T82-H84 PolarHBondContact O-CE1 3Å; T82-H84 PolarHBondContact O-ND1 2.79Å; H84-I131 HydrophobicContact CB-CD1 3.92Å
85	R	96.3	Very high	91.2	Very high	101 Å²	101	67.1 Å²	67.1	38%	0.381	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	119.4	171.2	-174.2	177.8	-177	-80.3	-1.3	109.3	I55 S87 T130 I131	I55-R85 VanDerWaalsContact CD1-NH2 3.35Å; I55-R85 HydrophobicContact CG2-CG 4.27Å; R85-S87 PolarHBondContact NH1-OG 2.95Å; R85-T130 PolarHBondContact NH1-OG1 2.82Å; R85-T130 VanDerWaalsContact NH1-OG1 3.15Å; R85-T130 PolarHBondContact O-OG1 3.01Å; R85-I131 PolarHBondContact O-N 2.84Å
86	V	97.1	Very high	92.8	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.7	178.8	-175.5	0	0	0	0	109.3	I55 F56 L58 V109 I131 A133	I55-V86 WeakPolarHBondContact CA-O 3.32Å; F56-V86 HydrophobicContact CD2-CB 4.05Å; F56-V86 HydrophobicContact CD2-CG2 4.39Å; F56-V86 HydrophobicContact CE1-CB 4.24Å; F56-V86 HydrophobicContact CE1-CG1 3.99Å; F56-V86 HydrophobicContact CE2-CB 3.61Å; F56-V86 HydrophobicContact CE2-CG1 3.9Å; F56-V86 HydrophobicContact CE2-CG2 3.84Å; F56-V86 HydrophobicContact CZ-CB 3.74Å; F56-V86 HydrophobicContact CZ-CG1 3.5Å; F56-V86 VanDerWaalsContact CZ-CG1 3.5Å; F56-V86 HydrophobicContact CZ-CG2 4.32Å; F56-V86 PolarHBondContact N-O 3.3Å; F56-V86 VanDerWaalsContact N-O 3.1Å; F56-V86 PolarHBondContact O-N 2.8Å; L58-V86 HydrophobicContact CB-CG2 4.23Å; V86-V109 HydrophobicContact CG1-CG1 3.98Å; V86-V109 HydrophobicContact CG2-CG1 4.47Å; V86-I131 CarbonylContact C-O 3.58Å; V86-I131 WeakPolarHBondContact CA-O 3.43Å; V86-A133 HydrophobicContact CG1-CB 3.75Å
87	S	96.3	Very high	93.9	Very high	3 Å²	3	61.2 Å²	61.2	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.9	175.5	-60	0	0	0	0	109.6	R85 T130 I131 I132 A133	R85-S87 PolarHBondContact NH1-OG 2.95Å; S87-T130 PolarHBondContact OG-OG1 2.78Å; S87-I131 PolarHBondContact N-O 2.83Å; S87-I132 WeakPolarHBondContact O-CA 3.29Å; S87-A133 PolarHBondContact O-N 3.1Å
88	V	96.9	Very high	94.7	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	112	-179.6	-165.8	0	0	0	0	109.2	V53 T54 F56 L93 R94 A97 A133 I136	V53-V88 WeakPolarHBondContact CG2-O 3.04Å; T54-V88 PolarHBondContact N-O 3.33Å; T54-V88 VanDerWaalsContact N-O 3.13Å; T54-V88 PolarHBondContact O-N 3.3Å; F56-V88 HydrophobicContact CE1-CG2 3.76Å; V88-L93 HydrophobicContact CG1-CB 3.83Å; V88-L93 HydrophobicContact CG1-CD2 3.86Å; V88-L93 HydrophobicContact CG1-CG 3.68Å; V88-R94 HydrophobicContact CB-CB 4.12Å; V88-R94 HydrophobicContact CG1-CB 3.94Å; V88-R94 WeakPolarHBondContact O-CB 3.37Å; V88-A97 HydrophobicContact CG2-CB 4.1Å; V88-A133 HydrophobicContact CG2-CB 4.18Å; V88-I136 HydrophobicContact CG2-CD1 3.99Å
89	F	94.9	Very high	95	Very high	92 Å²	92	65.5 Å²	65.5	40%	0.404	32%	0.319	S	S	.	.			trans	-101.7	-26.3	-179.7	-68.3	-83.1	0	0	0	113.2	V53 P91 I132	V53-F89 HydrophobicContact CB-CD1 3.9Å; V53-F89 HydrophobicContact CB-CE1 3.7Å; V53-F89 HydrophobicContact CB-CZ 4.32Å; V53-F89 HydrophobicContact CG1-CE1 4.38Å; V53-F89 HydrophobicContact CG2-CD1 3.76Å; V53-F89 HydrophobicContact CG2-CD2 4.25Å; V53-F89 HydrophobicContact CG2-CE1 3.53Å; V53-F89 HydrophobicContact CG2-CE2 4.04Å; V53-F89 HydrophobicContact CG2-CG 4.13Å; V53-F89 HydrophobicContact CG2-CZ 3.69Å; F89-P91 WeakPolarHBondContact O-CD 3.47Å; F89-I132 HydrophobicContact CD2-CG1 4.33Å; F89-I132 HydrophobicContact CD2-CG2 4.01Å; F89-I132 HydrophobicContact CE2-CD1 4.28Å; F89-I132 HydrophobicContact CE2-CG1 4.08Å
90	K	94.7	Very high	95.1	Very high	118 Å²	118	67.4 Å²	67.4	51%	0.513	32%	0.323	S	S	.	.	S	Bend	trans	-60.5	121	-177.6	-178.7	173.1	179.4	177.5	0	109.6	G92 L93 R94	K90-G92 PolarHBondContact O-N 3.28Å; K90-L93 HydrophobicContact CB-CB 4.01Å; K90-L93 HydrophobicContact CD-CB 4.23Å; K90-L93 HydrophobicContact CG-CB 4.18Å; K90-L93 PolarHBondContact O-N 3.02Å; K90-R94 PolarHBondContact O-N 2.77Å
91	P	91.7	Very high	95.1	Very high	78 Å²	78	61.3 Å²	61.3	51%	0.506	30%	0.297	S	S	.	.	H	α-helix	trans	-53.6	-49.6	-168.5	-30.4	35.5	0	0	0	114.9	F89 L93 R94	F89-P91 WeakPolarHBondContact O-CD 3.47Å; P91-L93 PolarHBondContact O-N 3Å; P91-R94 WeakPolarHBondContact O-CG 3.29Å
92	G	93.4	Very high	95	Very high	49 Å²	49	63.3 Å²	63.3	51%	0.505	30%	0.3	S	S	.	.	H	α-helix	trans	-67.8	-36.4	178.1	0	0	0	0	0	113.4	K90 V96	K90-G92 PolarHBondContact O-N 3.28Å; G92-V96 VanDerWaalsContact O-CG2 3.29Å; G92-V96 WeakPolarHBondContact O-CG2 3.34Å; G92-V96 PolarHBondContact O-N 2.84Å
93	L	95.2	Very high	94.9	Very high	24 Å²	24	67.9 Å²	67.9	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-76	-33.3	-176.6	-169.3	63.9	0	0	0	112.3	V88 K90 P91 D95 A97 D134 I136	V88-L93 HydrophobicContact CG1-CB 3.83Å; V88-L93 HydrophobicContact CG1-CD2 3.86Å; V88-L93 HydrophobicContact CG1-CG 3.68Å; K90-L93 HydrophobicContact CB-CB 4.01Å; K90-L93 HydrophobicContact CD-CB 4.23Å; K90-L93 HydrophobicContact CG-CB 4.18Å; K90-L93 PolarHBondContact O-N 3.02Å; P91-L93 PolarHBondContact O-N 3Å; L93-D95 VanDerWaalsContact C-N 3.34Å; L93-A97 WeakPolarHBondContact O-CB 3.42Å; L93-A97 PolarHBondContact O-N 3.09Å; L93-D134 WeakPolarHBondContact CD2-O 3.43Å; L93-I136 HydrophobicContact CD1-CB 4.11Å; L93-I136 HydrophobicContact CD1-CD1 4.32Å; L93-I136 HydrophobicContact CD1-CG1 4.23Å; L93-I136 HydrophobicContact CD2-CD1 4.36Å; L93-I136 HydrophobicContact CD2-CG1 4.19Å; L93-I136 HydrophobicContact CG-CD1 4.2Å; L93-I136 HydrophobicContact CG-CG1 4.38Å
94	R	95.6	Very high	94.8	Very high	34 Å²	34	62.1 Å²	62.1	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-67.8	-37.3	-179.6	83.7	-172	166.9	-160.3	-7.4	111.3	P52 T54 V88 K90 P91 A97 Y98	P52-R94 VanDerWaalsContact CD-NH1 3.3Å; P52-R94 WeakPolarHBondContact O-CD 3.45Å; P52-R94 PolarHBondContact O-NH1 3.39Å; T54-R94 PolarHBondContact OG1-O 3.09Å; V88-R94 HydrophobicContact CB-CB 4.12Å; V88-R94 HydrophobicContact CG1-CB 3.94Å; V88-R94 WeakPolarHBondContact O-CB 3.37Å; K90-R94 PolarHBondContact O-N 2.77Å; P91-R94 WeakPolarHBondContact O-CG 3.29Å; R94-A97 PolarHBondContact O-N 3.27Å; R94-Y98 WeakPolarHBondContact O-CB 3.41Å; R94-Y98 PolarHBondContact O-N 2.75Å
95	D	94.3	Very high	94.6	Very high	65 Å²	65	60.7 Å²	60.7	35%	0.348	30%	0.299	S	S	.	.	H	α-helix	trans	-71.6	-46	-179.6	-59.7	-17.7	0	0	0	109	L93 A97 Y98 H99	L93-D95 VanDerWaalsContact C-N 3.34Å; D95-A97 VanDerWaalsContact C-N 3.33Å; D95-A97 PolarHBondContact O-N 2.96Å; D95-Y98 PolarHBondContact O-N 2.96Å; D95-H99 PolarHBondContact O-CD2 3.1Å; D95-H99 PolarHBondContact O-N 3.06Å
96	V	94.8	Very high	94.6	Very high	54 Å²	54	61.5 Å²	61.5	33%	0.327	30%	0.302	S	S	.	.	H	α-helix	trans	-57.6	-46	171.6	171	0	0	0	0	111.1	G92 Y98 H99 Y100 F138	G92-V96 VanDerWaalsContact O-CG2 3.29Å; G92-V96 WeakPolarHBondContact O-CG2 3.34Å; G92-V96 PolarHBondContact O-N 2.84Å; V96-Y98 VanDerWaalsContact C-N 3.31Å; V96-Y98 PolarHBondContact O-N 3.13Å; V96-H99 PolarHBondContact O-N 3.31Å; V96-Y100 HydrophobicContact CB-CD2 4.36Å; V96-Y100 HydrophobicContact CG1-CD2 3.86Å; V96-Y100 WeakPolarHBondContact O-CB 3.06Å; V96-Y100 WeakPolarHBondContact O-CD2 3.24Å; V96-Y100 PolarHBondContact O-N 2.94Å; V96-F138 HydrophobicContact CG1-CE2 3.75Å; V96-F138 HydrophobicContact CG1-CZ 3.87Å
97	A	94.9	Very high	94.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-43.2	177.7	0	0	0	0	0	111.1	T54 F56 V88 L93 R94 D95 V101 I136	T54-A97 HydrophobicContact CG2-CB 4.02Å; F56-A97 HydrophobicContact CE1-CB 4.42Å; V88-A97 HydrophobicContact CG2-CB 4.1Å; L93-A97 WeakPolarHBondContact O-CB 3.42Å; L93-A97 PolarHBondContact O-N 3.09Å; R94-A97 PolarHBondContact O-N 3.27Å; D95-A97 VanDerWaalsContact C-N 3.33Å; D95-A97 PolarHBondContact O-N 2.96Å; A97-V101 HydrophobicContact CB-CG2 4.19Å; A97-V101 WeakPolarHBondContact O-CB 3.43Å; A97-V101 VanDerWaalsContact O-CG2 3.29Å; A97-V101 WeakPolarHBondContact O-CG2 3.47Å; A97-V101 PolarHBondContact O-N 2.85Å; A97-I136 HydrophobicContact CB-CD1 4.1Å
98	Y	95.3	Very high	94.6	Very high	98 Å²	98	63.6 Å²	63.6	38%	0.384	31%	0.313	S	S	.	.	H	α-helix	trans	-66.5	-40.1	-179.2	-178.1	-112.7	0	0	0	113	P42 M44 R94 D95 V96	P42-Y98 HydrophobicContact CG-CD2 4.39Å; M44-Y98 HydrophobicContact CB-CD2 3.83Å; M44-Y98 HydrophobicContact CB-CE2 3.91Å; M44-Y98 HydrophobicContact CB-CG 4.29Å; M44-Y98 HydrophobicContact CE-CD1 3.95Å; M44-Y98 HydrophobicContact CE-CG 3.86Å; R94-Y98 WeakPolarHBondContact O-CB 3.41Å; R94-Y98 PolarHBondContact O-N 2.75Å; D95-Y98 PolarHBondContact O-N 2.96Å; V96-Y98 VanDerWaalsContact C-N 3.31Å; V96-Y98 PolarHBondContact O-N 3.13Å
99	H	93	Very high	94.6	Very high	119 Å²	119	63.7 Å²	63.7	55%	0.551	31%	0.313	S	S	*	.	H	α-helix	trans	-78.3	-43.9	-178.2	-70.6	-62.2	0	0	0	113.2	D95 V96 K102	D95-H99 PolarHBondContact O-CD2 3.1Å; D95-H99 PolarHBondContact O-N 3.06Å; V96-H99 PolarHBondContact O-N 3.31Å; H99-K102 WeakPolarHBondContact O-CE 3.5Å; H99-K102 PolarHBondContact O-NZ 2.85Å
100	Y	92.4	Very high	94.8	Very high	145 Å²	145	61 Å²	61	57%	0.569	30%	0.302	S	S	*	.	H	α-helix	trans	-100.6	-25.1	-168.8	-65.1	-84	0	0	0	114.3	V96 K102	V96-Y100 HydrophobicContact CB-CD2 4.36Å; V96-Y100 HydrophobicContact CG1-CD2 3.86Å; V96-Y100 WeakPolarHBondContact O-CB 3.06Å; V96-Y100 WeakPolarHBondContact O-CD2 3.24Å; V96-Y100 PolarHBondContact O-N 2.94Å; Y100-K102 PolarHBondContact O-N 3.1Å
101	V	93.9	Very high	94.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.28	C	S	.	.			trans	-74.4	128.8	174.1	179.4	0	0	0	0	108.7	V38 P42 A97 F138	V38-V101 HydrophobicContact CB-CG1 4.18Å; V38-V101 HydrophobicContact CG1-CG1 3.81Å; V38-V101 HydrophobicContact CG2-CG1 3.58Å; P42-V101 WeakPolarHBondContact CD-O 3.4Å; P42-V101 HydrophobicContact CG-CB 4.11Å; P42-V101 HydrophobicContact CG-CG1 4.48Å; P42-V101 VanDerWaalsContact CG-O 3.24Å; P42-V101 WeakPolarHBondContact CG-O 3.36Å; A97-V101 HydrophobicContact CB-CG2 4.19Å; A97-V101 WeakPolarHBondContact O-CB 3.43Å; A97-V101 VanDerWaalsContact O-CG2 3.29Å; A97-V101 WeakPolarHBondContact O-CG2 3.47Å; A97-V101 PolarHBondContact O-N 2.85Å; V101-F138 HydrophobicContact CG2-CE1 3.58Å; V101-F138 HydrophobicContact CG2-CZ 4.02Å
102	K	94	Very high	95.2	Very high	102 Å²	102	56.2 Å²	56.2	44%	0.443	28%	0.275	S	S	.	.			trans	-129.2	161.5	173.8	-60	-63.9	174	-166.8	0	110	V38 D41 H99 Y100 G104 S105	V38-K102 WeakPolarHBondContact CB-O 3.48Å; V38-K102 WeakPolarHBondContact CG1-O 3.41Å; D41-K102 WeakPolarHBondContact OD1-CA 3.21Å; H99-K102 WeakPolarHBondContact O-CE 3.5Å; H99-K102 PolarHBondContact O-NZ 2.85Å; Y100-K102 PolarHBondContact O-N 3.1Å; K102-G104 PolarHBondContact O-N 3.33Å; K102-S105 PolarHBondContact N-OG 2.89Å; K102-S105 VanDerWaalsContact N-OG 3.13Å; K102-S105 WeakPolarHBondContact O-CB 3.46Å; K102-S105 PolarHBondContact O-N 3.15Å; K102-S105 PolarHBondContact O-OG 2.81Å
103	K	94.9	Very high	95.3	Very high	147 Å²	147	56.1 Å²	56.1	64%	0.639	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	131.2	169.4	179.3	175.6	179.2	-174.5	0	110.3	G39 D41 S105	G39-K103 WeakPolarHBondContact O-CG 3.03Å; D41-K103 PolarHBondContact OD1-N 3.39Å; K103-S105 VanDerWaalsContact C-N 3.28Å; K103-S105 PolarHBondContact O-N 2.82Å
104	G	93.6	Very high	95.4	Very high	34 Å²	34	58.2 Å²	58.2	35%	0.351	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-12	-179.9	0	0	0	0	0	115.2	R37 V38 K102 R106	R37-G104 PolarHBondContact NH1-O 3.13Å; V38-G104 PolarHBondContact O-N 3.02Å; K102-G104 PolarHBondContact O-N 3.33Å; G104-R106 PolarHBondContact O-N 2.92Å
105	S	93.7	Very high	95.3	Very high	12 Å²	12	62.8 Å²	62.8	8%	0.084	29%	0.292	C	S	.	.			trans	-55.3	127.5	175.6	-63.7	0	0	0	0	110.3	R37 V38 K102 K103	R37-S105 WeakPolarHBondContact CA-O 3.34Å; V38-S105 WeakPolarHBondContact CG2-O 3.5Å; V38-S105 PolarHBondContact N-O 2.74Å; K102-S105 PolarHBondContact N-OG 2.89Å; K102-S105 VanDerWaalsContact N-OG 3.13Å; K102-S105 WeakPolarHBondContact O-CB 3.46Å; K102-S105 PolarHBondContact O-N 3.15Å; K102-S105 PolarHBondContact O-OG 2.81Å; K103-S105 VanDerWaalsContact C-N 3.28Å; K103-S105 PolarHBondContact O-N 2.82Å
106	R	95.4	Very high	94.9	Very high	117 Å²	117	60.8 Å²	60.8	44%	0.442	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	118.4	169	-165.1	176.8	-169.1	177	0.9	109	G36 G104 L139 S140	G36-R106 WeakPolarHBondContact O-CA 3.2Å; G104-R106 PolarHBondContact O-N 2.92Å; R106-L139 HydrophobicContact CB-CB 4.47Å; R106-L139 HydrophobicContact CG-CB 4.31Å; R106-L139 HydrophobicContact CG-CD1 4.46Å; R106-L139 PolarHBondContact O-N 2.9Å; R106-S140 WeakPolarHBondContact CA-OG 2.81Å; R106-S140 WeakPolarHBondContact CB-OG 3.04Å; R106-S140 PolarHBondContact N-OG 3.49Å; R106-S140 PolarHBondContact O-N 3.13Å; R106-S140 PolarHBondContact O-OG 3.02Å; R106-S140 VanDerWaalsContact O-OG 3.09Å
107	I	96.6	Very high	94.5	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.9	-177.2	62.5	175	0	0	0	110.6	G36 V38 F56 L58 V109 I136 V137 F138	G36-I107 PolarHBondContact N-O 3.42Å; G36-I107 VanDerWaalsContact N-O 3.1Å; G36-I107 PolarHBondContact O-N 2.88Å; G36-I107 VanDerWaalsContact O-N 3.09Å; V38-I107 HydrophobicContact CG2-CD1 3.54Å; V38-I107 HydrophobicContact CG2-CG1 3.94Å; F56-I107 HydrophobicContact CD2-CD1 4.49Å; F56-I107 HydrophobicContact CE2-CD1 3.61Å; F56-I107 HydrophobicContact CZ-CD1 3.87Å; L58-I107 HydrophobicContact CD1-CD1 3.98Å; L58-I107 HydrophobicContact CD1-CG1 3.61Å; I107-V109 HydrophobicContact CD1-CG2 3.73Å; I107-V109 HydrophobicContact CG1-CG2 4.04Å; I107-I136 HydrophobicContact CB-CG2 4.24Å; I107-I136 HydrophobicContact CD1-CG2 4.3Å; I107-I136 HydrophobicContact CG2-CG2 4.5Å; I107-V137 WeakPolarHBondContact CA-O 3.48Å; I107-F138 HydrophobicContact CG2-CD1 3.89Å; I107-F138 HydrophobicContact CG2-CE1 4.34Å
108	L	97.4	Very high	93.9	Very high	48 Å²	48	70.3 Å²	70.3	25%	0.251	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.1	162.8	178.4	78.9	0	0	0	107.8	L34 L35 I136 V137 L139	L34-L108 CarbonylContact O-C 3.6Å; L34-L108 VanDerWaalsContact O-CA 3.29Å; L34-L108 WeakPolarHBondContact O-CA 3.48Å; L35-L108 HydrophobicContact CB-CD1 3.99Å; L35-L108 HydrophobicContact CD1-CD1 4.46Å; L108-I136 CarbonylContact O-C 3.58Å; L108-I136 WeakPolarHBondContact O-CA 3.36Å; L108-V137 HydrophobicContact CB-CB 4.13Å; L108-V137 HydrophobicContact CD2-CB 4.4Å; L108-V137 HydrophobicContact CD2-CG2 4.21Å; L108-V137 PolarHBondContact N-O 3.19Å; L108-V137 PolarHBondContact O-N 3.36Å; L108-L139 HydrophobicContact CB-CD1 4.25Å
109	V	97.3	Very high	93.4	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.4	177.1	175.2	0	0	0	0	107.9	Q33 L34 F56 L58 V86 I107 A133 I136	Q33-V109 WeakPolarHBondContact CA-O 3.29Å; L34-V109 PolarHBondContact N-O 3.02Å; L34-V109 PolarHBondContact O-N 2.78Å; F56-V109 HydrophobicContact CE2-CG2 4.35Å; F56-V109 HydrophobicContact CZ-CG2 4.28Å; L58-V109 HydrophobicContact CD2-CG2 4.22Å; V86-V109 HydrophobicContact CG1-CG1 3.98Å; V86-V109 HydrophobicContact CG2-CG1 4.47Å; I107-V109 HydrophobicContact CD1-CG2 3.73Å; I107-V109 HydrophobicContact CG1-CG2 4.04Å; V109-A133 HydrophobicContact CG1-CB 3.75Å; V109-I136 HydrophobicContact CG2-CG1 4.38Å
110	E	98.1	Very high	92.8	Very high	35 Å²	35	66.7 Å²	66.7	16%	0.164	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.5	167.9	-48.4	-173.4	104.5	0	0	110.2	R31 V32 Q33 A133 D134 N135	R31-E110 IonicContact CZ-OE1 3.84Å; R31-E110 IonicContact NE-OE1 3.99Å; R31-E110 IonicContact NH2-OE1 2.86Å; R31-E110 PolarHBondContact NH2-OE1 3.07Å; V32-E110 WeakPolarHBondContact O-CA 3.41Å; Q33-E110 HydrophobicContact CG-CG 4.13Å; Q33-E110 PolarHBondContact NE2-OE1 2.81Å; E110-A133 WeakPolarHBondContact O-CA 3.47Å; E110-D134 PolarHBondContact O-N 2.81Å; E110-N135 HydrophobicContact CB-CB 4.2Å; E110-N135 PolarHBondContact N-O 3.45Å; E110-N135 PolarHBondContact O-N 2.97Å; E110-N135 VanDerWaalsContact O-N 3.14Å; E110-N135 PolarHBondContact OE2-ND2 2.99Å
111	G	97.4	Very high	92.4	Very high	6 Å²	6	69 Å²	69	6%	0.062	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-149.1	-179.2	0	0	0	0	0	112.3	R31 V32 I132	R31-G111 CarbonylContact C-O 3.56Å; R31-G111 WeakPolarHBondContact CA-O 3.32Å; V32-G111 PolarHBondContact N-O 2.94Å; V32-G111 PolarHBondContact O-N 2.87Å; G111-I132 CarbonylContact C-O 3.56Å; G111-I132 WeakPolarHBondContact CA-O 3.46Å
112	K	97.1	Very high	92.1	Very high	90 Å²	90	75.2 Å²	75.2	39%	0.391	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.6	-179.6	62.4	-172.8	177.4	-173.4	0	111.2	I131 I132	K112-I131 CarbonylContact O-C 3.55Å; K112-I131 WeakPolarHBondContact O-CA 3.38Å; K112-I132 HydrophobicContact CG-CB 3.97Å; K112-I132 PolarHBondContact N-O 2.84Å; K112-I132 PolarHBondContact O-N 3.12Å
113	L	97	Very high	91.7	Very high	47 Å²	47	77.9 Å²	77.9	25%	0.246	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.1	175.1	-164.7	65.1	0	0	0	110.3	N30 V32 Y115 T129 I131	N30-L113 PolarHBondContact ND2-O 3.27Å; N30-L113 PolarHBondContact OD1-N 2.99Å; V32-L113 HydrophobicContact CG2-CB 3.96Å; L113-Y115 HydrophobicContact CD2-CE1 4.32Å; L113-Y115 HydrophobicContact CD2-CE2 3.8Å; L113-Y115 WeakPolarHBondContact CD2-OH 3.18Å; L113-Y115 HydrophobicContact CG-CE2 4.17Å; L113-T129 HydrophobicContact CD1-CG2 3.58Å; L113-T129 HydrophobicContact CG-CG2 4.16Å; L113-I131 HydrophobicContact CD1-CG1 3.93Å
114	D	95.8	Very high	91.4	Very high	68 Å²	68	74 Å²	74	36%	0.364	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.2	176.2	-173.7	-97.4	0	0	0	110	G116 T129 T130 I132	D114-G116 PolarHBondContact OD1-N 3.22Å; D114-T129 WeakPolarHBondContact O-CA 3.41Å; D114-T130 HydrophobicContact CB-CG2 4.06Å; D114-T130 PolarHBondContact N-O 2.85Å; D114-T130 PolarHBondContact O-N 3.1Å; D114-T130 VanDerWaalsContact O-O 3.05Å; D114-I132 HydrophobicContact CB-CD1 3.6Å; D114-I132 HydrophobicContact CB-CG1 3.92Å
115	Y	93.9	Very high	90.9	Very high	130 Å²	130	80.6 Å²	80.6	51%	0.51	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	77.8	177	-63.6	-81.2	0	0	0	109	L113 Q127 T129	L113-Y115 HydrophobicContact CD2-CE1 4.32Å; L113-Y115 HydrophobicContact CD2-CE2 3.8Å; L113-Y115 WeakPolarHBondContact CD2-OH 3.18Å; L113-Y115 HydrophobicContact CG-CE2 4.17Å; Y115-Q127 HydrophobicContact CD1-CG 4.33Å; Y115-T129 HydrophobicContact CD1-CG2 3.79Å; Y115-T129 VanDerWaalsContact CD1-OG1 3.29Å; Y115-T129 WeakPolarHBondContact CD1-OG1 3.3Å; Y115-T129 HydrophobicContact CE1-CG2 3.63Å; Y115-T129 WeakPolarHBondContact CE1-OG1 3.44Å
116	G	86.9	Confident	90.6	Very high	23 Å²	23	86.3 Å²	86.3	24%	0.237	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	135.4	-179.9	0	0	0	0	0	111.4	D114 Q127 A128	D114-G116 PolarHBondContact OD1-N 3.22Å; G116-Q127 CarbonylContact O-C 3.55Å; G116-Q127 WeakPolarHBondContact O-CA 3.43Å; G116-A128 PolarHBondContact N-O 3.12Å; G116-A128 PolarHBondContact O-N 3.02Å
117	E	85.8	Confident	90.2	Very high	133 Å²	133	86.7 Å²	86.7	62%	0.621	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.9	168.9	-67.1	-174.3	-175.9	0	0	109.8	R125 R126	E117-R125 IonicContact OE2-NH1 3.66Å; E117-R126 WeakPolarHBondContact CA-O 3.44Å
118	Y	82.4	Confident	89.8	Confident	122 Å²	122	88.1 Å²	88.1	48%	0.478	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	149.6	169	71.4	-81	0	0	0	110.2	R126 A128	Y118-R126 HydrophobicContact CD1-CB 4.09Å; Y118-R126 HydrophobicContact CD2-CB 4.46Å; Y118-R126 HydrophobicContact CE1-CB 3.56Å; Y118-R126 HydrophobicContact CE2-CB 4Å; Y118-R126 HydrophobicContact CE2-CG 4.39Å; Y118-R126 PolarHBondContact N-O 3.33Å; Y118-R126 PolarHBondContact O-N 2.99Å; Y118-A128 HydrophobicContact CD1-CB 3.86Å; Y118-A128 HydrophobicContact CE1-CB 3.75Å
119	V	83.8	Confident	89.6	Confident	81 Å²	81	89 Å²	89	49%	0.491	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123	176.5	-177.1	0	0	0	0	107.7	R125	V119-R125 HydrophobicContact CG2-CG 4.34Å
120	D	81.6	Confident	89.5	Confident	59 Å²	59	89.4 Å²	89.4	32%	0.316	43%	0.429	S	S	.	.			trans	-75.3	168.3	175.7	-160.3	-2.2	0	0	0	110.9	N122 Q123 V124 R126	D120-N122 PolarHBondContact O-N 3.48Å; D120-Q123 PolarHBondContact O-N 3.18Å; D120-V124 PolarHBondContact N-O 2.97Å; D120-R126 HydrophobicContact CB-CG 4.34Å
121	K	83.6	Confident	89.5	Confident	195 Å²	195	88.1 Å²	88.1	85%	0.848	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-29	178.6	-65.2	-177.2	179.8	-178.5	0	112.9	Q123	K121-Q123 PolarHBondContact O-N 2.83Å
122	N	88.3	Confident	89.4	Confident	129 Å²	129	89 Å²	89	69%	0.69	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	14.7	178.4	-60	-18.4	0	0	0	113.7	D120 V124	D120-N122 PolarHBondContact O-N 3.48Å; N122-V124 HydrophobicContact CB-CG2 4.38Å; N122-V124 PolarHBondContact O-N 3.43Å; N122-V124 VanDerWaalsContact O-N 3.12Å
123	Q	84.8	Confident	89.5	Confident	158 Å²	158	84.7 Å²	84.7	74%	0.738	41%	0.408	S	S	*	.	S	Bend	trans	60.7	17	-177.2	-62.1	-65.9	-48.1	0	0	114.8	D120 K121	D120-Q123 PolarHBondContact O-N 3.18Å; K121-Q123 PolarHBondContact O-N 2.83Å
124	V	88.7	Confident	89.4	Confident	67 Å²	67	86.2 Å²	86.2	41%	0.406	42%	0.416	S	S	.	.			trans	-89.4	128.5	175.9	-179.1	0	0	0	0	109.5	D120 N122 R126	D120-V124 PolarHBondContact N-O 2.97Å; N122-V124 HydrophobicContact CB-CG2 4.38Å; N122-V124 PolarHBondContact O-N 3.43Å; N122-V124 VanDerWaalsContact O-N 3.12Å; V124-R126 PolarHBondContact O-N 2.88Å
125	R	84.3	Confident	89.5	Confident	172 Å²	172	86.1 Å²	86.1	65%	0.649	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	123.3	171.8	-64.7	-173.7	-177.3	-156.6	1.9	109.7	E117 V119	E117-R125 IonicContact OE2-NH1 3.66Å; V119-R125 HydrophobicContact CG2-CG 4.34Å
126	R	87.4	Confident	89.6	Confident	132 Å²	132	80.5 Å²	80.5	50%	0.498	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141.5	175.2	-65	-67.3	-173.5	178.2	-1.3	108.9	E117 Y118 D120 V124	E117-R126 WeakPolarHBondContact CA-O 3.44Å; Y118-R126 HydrophobicContact CD1-CB 4.09Å; Y118-R126 HydrophobicContact CD2-CB 4.46Å; Y118-R126 HydrophobicContact CE1-CB 3.56Å; Y118-R126 HydrophobicContact CE2-CB 4Å; Y118-R126 HydrophobicContact CE2-CG 4.39Å; Y118-R126 PolarHBondContact N-O 3.33Å; Y118-R126 PolarHBondContact O-N 2.99Å; D120-R126 HydrophobicContact CB-CG 4.34Å; V124-R126 PolarHBondContact O-N 2.88Å
127	Q	86.8	Confident	90	Very high	124 Å²	124	82.2 Å²	82.2	58%	0.579	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.7	172.5	-170.2	178.4	63	0	0	108.8	Y115 G116	Y115-Q127 HydrophobicContact CD1-CG 4.33Å; G116-Q127 CarbonylContact O-C 3.55Å; G116-Q127 WeakPolarHBondContact O-CA 3.43Å
128	A	87.1	Confident	90.4	Very high	31 Å²	31	79.6 Å²	79.6	26%	0.256	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	101.6	172	0	0	0	0	0	108.8	G116 Y118 T130	G116-A128 PolarHBondContact N-O 3.12Å; G116-A128 PolarHBondContact O-N 3.02Å; Y118-A128 HydrophobicContact CD1-CB 3.86Å; Y118-A128 HydrophobicContact CE1-CB 3.75Å; A128-T130 PolarHBondContact O-N 2.93Å
129	T	93.6	Very high	90.8	Very high	65 Å²	65	77.5 Å²	77.5	40%	0.399	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.5	171.5	-47.9	0	0	0	0	109.5	L113 D114 Y115	L113-T129 HydrophobicContact CD1-CG2 3.58Å; L113-T129 HydrophobicContact CG-CG2 4.16Å; D114-T129 WeakPolarHBondContact O-CA 3.41Å; Y115-T129 HydrophobicContact CD1-CG2 3.79Å; Y115-T129 VanDerWaalsContact CD1-OG1 3.29Å; Y115-T129 WeakPolarHBondContact CD1-OG1 3.3Å; Y115-T129 HydrophobicContact CE1-CG2 3.63Å; Y115-T129 WeakPolarHBondContact CE1-OG1 3.44Å
130	T	95.2	Very high	90.7	Very high	11 Å²	11	75.6 Å²	75.6	7%	0.067	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147.6	175.7	-167.3	0	0	0	0	110	R85 S87 D114 A128 I132	R85-T130 PolarHBondContact NH1-OG1 2.82Å; R85-T130 VanDerWaalsContact NH1-OG1 3.15Å; R85-T130 PolarHBondContact O-OG1 3.01Å; S87-T130 PolarHBondContact OG-OG1 2.78Å; D114-T130 HydrophobicContact CB-CG2 4.06Å; D114-T130 PolarHBondContact N-O 2.85Å; D114-T130 PolarHBondContact O-N 3.1Å; D114-T130 VanDerWaalsContact O-O 3.05Å; A128-T130 PolarHBondContact O-N 2.93Å; T130-I132 HydrophobicContact CG2-CG1 4.34Å
131	I	97.4	Very high	89.9	Confident	7 Å²	7	79.2 Å²	79.2	4%	0.036	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.8	169	-61.1	166.4	0	0	0	106.9	V32 L34 H84 R85 V86 S87 K112 L113	V32-I131 HydrophobicContact CB-CG2 4.36Å; V32-I131 HydrophobicContact CG1-CD1 3.94Å; V32-I131 HydrophobicContact CG1-CG1 4.36Å; V32-I131 HydrophobicContact CG1-CG2 4.24Å; L34-I131 HydrophobicContact CD1-CD1 3.25Å; L34-I131 HydrophobicContact CG-CD1 4.28Å; H84-I131 HydrophobicContact CB-CD1 3.92Å; R85-I131 PolarHBondContact O-N 2.84Å; V86-I131 CarbonylContact C-O 3.58Å; V86-I131 WeakPolarHBondContact CA-O 3.43Å; S87-I131 PolarHBondContact N-O 2.83Å; K112-I131 CarbonylContact O-C 3.55Å; K112-I131 WeakPolarHBondContact O-CA 3.38Å; L113-I131 HydrophobicContact CD1-CG1 3.93Å
132	I	96.9	Very high	88.5	Confident	24 Å²	24	75.1 Å²	75.1	12%	0.123	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	109.5	173	-62.9	178.4	0	0	0	107	S87 F89 G111 K112 D114 T130	S87-I132 WeakPolarHBondContact O-CA 3.29Å; F89-I132 HydrophobicContact CD2-CG1 4.33Å; F89-I132 HydrophobicContact CD2-CG2 4.01Å; F89-I132 HydrophobicContact CE2-CD1 4.28Å; F89-I132 HydrophobicContact CE2-CG1 4.08Å; G111-I132 CarbonylContact C-O 3.56Å; G111-I132 WeakPolarHBondContact CA-O 3.46Å; K112-I132 HydrophobicContact CG-CB 3.97Å; K112-I132 PolarHBondContact N-O 2.84Å; K112-I132 PolarHBondContact O-N 3.12Å; D114-I132 HydrophobicContact CB-CD1 3.6Å; D114-I132 HydrophobicContact CB-CG1 3.92Å; T130-I132 HydrophobicContact CG2-CG1 4.34Å
133	A	97.4	Very high	86.9	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.008	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	129.6	-178.3	0	0	0	0	0	111.4	V86 S87 V88 V109 E110 I136	V86-A133 HydrophobicContact CG1-CB 3.75Å; S87-A133 PolarHBondContact O-N 3.1Å; V88-A133 HydrophobicContact CG2-CB 4.18Å; V109-A133 HydrophobicContact CG1-CB 3.75Å; E110-A133 WeakPolarHBondContact O-CA 3.47Å; A133-I136 HydrophobicContact CB-CD1 4.45Å; A133-I136 HydrophobicContact CB-CG1 4.34Å
134	D	96.4	Very high	85.4	Confident	79 Å²	79	78.1 Å²	78.1	42%	0.422	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-24.8	175.8	-65.7	-42.1	0	0	0	111.8	L93 E110	L93-D134 WeakPolarHBondContact CD2-O 3.43Å; E110-D134 PolarHBondContact O-N 2.81Å
135	N	96.7	Very high	83.8	Confident	66 Å²	66	82.2 Å²	82.2	35%	0.353	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	142.4	178.5	-173.3	27.9	0	0	0	111.1	E110	E110-N135 HydrophobicContact CB-CB 4.2Å; E110-N135 PolarHBondContact N-O 3.45Å; E110-N135 PolarHBondContact O-N 2.97Å; E110-N135 VanDerWaalsContact O-N 3.14Å; E110-N135 PolarHBondContact OE2-ND2 2.99Å
136	I	96.1	Very high	82.1	Confident	12 Å²	12	85.1 Å²	85.1	6%	0.062	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	127.7	174.9	-60.4	173.1	0	0	0	108	F56 V88 L93 A97 I107 L108 V109 A133 F138	F56-I136 HydrophobicContact CE1-CD1 4.2Å; F56-I136 HydrophobicContact CZ-CD1 4.07Å; V88-I136 HydrophobicContact CG2-CD1 3.99Å; L93-I136 HydrophobicContact CD1-CB 4.11Å; L93-I136 HydrophobicContact CD1-CD1 4.32Å; L93-I136 HydrophobicContact CD1-CG1 4.23Å; L93-I136 HydrophobicContact CD2-CD1 4.36Å; L93-I136 HydrophobicContact CD2-CG1 4.19Å; L93-I136 HydrophobicContact CG-CD1 4.2Å; L93-I136 HydrophobicContact CG-CG1 4.38Å; A97-I136 HydrophobicContact CB-CD1 4.1Å; I107-I136 HydrophobicContact CB-CG2 4.24Å; I107-I136 HydrophobicContact CD1-CG2 4.3Å; I107-I136 HydrophobicContact CG2-CG2 4.5Å; L108-I136 CarbonylContact O-C 3.58Å; L108-I136 WeakPolarHBondContact O-CA 3.36Å; V109-I136 HydrophobicContact CG2-CG1 4.38Å; A133-I136 HydrophobicContact CB-CD1 4.45Å; A133-I136 HydrophobicContact CB-CG1 4.34Å; I136-F138 HydrophobicContact CG2-CE1 4.48Å; I136-F138 HydrophobicContact CG2-CE2 4.2Å; I136-F138 HydrophobicContact CG2-CZ 4.15Å
137	V	95.8	Very high	80	Confident	59 Å²	59	88.3 Å²	88.3	36%	0.358	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	124	172.5	-174.8	0	0	0	0	108.8	I107 L108 L139	I107-V137 WeakPolarHBondContact CA-O 3.48Å; L108-V137 HydrophobicContact CB-CB 4.13Å; L108-V137 HydrophobicContact CD2-CB 4.4Å; L108-V137 HydrophobicContact CD2-CG2 4.21Å; L108-V137 PolarHBondContact N-O 3.19Å; L108-V137 PolarHBondContact O-N 3.36Å; V137-L139 HydrophobicContact CG1-CD2 4.17Å
138	F	93.9	Very high	79.6	Confident	78 Å²	78	86.6 Å²	86.6	34%	0.342	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	121	176.2	-61.5	-90	0	0	0	109	V96 V101 I107 I136	V96-F138 HydrophobicContact CG1-CE2 3.75Å; V96-F138 HydrophobicContact CG1-CZ 3.87Å; V101-F138 HydrophobicContact CG2-CE1 3.58Å; V101-F138 HydrophobicContact CG2-CZ 4.02Å; I107-F138 HydrophobicContact CG2-CD1 3.89Å; I107-F138 HydrophobicContact CG2-CE1 4.34Å; I136-F138 HydrophobicContact CG2-CE1 4.48Å; I136-F138 HydrophobicContact CG2-CE2 4.2Å; I136-F138 HydrophobicContact CG2-CZ 4.15Å
139	L	91.1	Very high	79.2	Confident	78 Å²	78	89.5 Å²	89.5	41%	0.408	45%	0.451	S	S	.	.			trans	-107.9	1.3	-179.5	-58.6	171.4	0	0	0	112	L35 R106 L108 V137	L35-L139 HydrophobicContact CD1-CD1 3.64Å; L35-L139 HydrophobicContact CG-CD1 3.89Å; R106-L139 HydrophobicContact CB-CB 4.47Å; R106-L139 HydrophobicContact CG-CB 4.31Å; R106-L139 HydrophobicContact CG-CD1 4.46Å; R106-L139 PolarHBondContact O-N 2.9Å; L108-L139 HydrophobicContact CB-CD1 4.25Å; V137-L139 HydrophobicContact CG1-CD2 4.17Å
140	S	81.2	Confident	78.4	Confident	40 Å²	40	90.8 Å²	90.8	28%	0.28	45%	0.454	S	S	.	.	S	Bend	trans	-93	122.9	-180	-54	0	0	0	0	109.3	R106 N142	R106-S140 WeakPolarHBondContact CA-OG 2.81Å; R106-S140 WeakPolarHBondContact CB-OG 3.04Å; R106-S140 PolarHBondContact N-OG 3.49Å; R106-S140 PolarHBondContact O-N 3.13Å; R106-S140 PolarHBondContact O-OG 3.02Å; R106-S140 VanDerWaalsContact O-OG 3.09Å; S140-N142 PolarHBondContact O-N 3.44Å
141	D	65.1	Low	77.5	Confident	135 Å²	135	95.5 Å²	95.5	72%	0.722	48%	0.477	S	S	*	.			trans	-67.7	97.1	165.1	-72.2	-27.3	0	0	0	108.5	I143	D141-I143 HydrophobicContact CB-CB 4.42Å; D141-I143 HydrophobicContact CB-CD1 3.72Å; D141-I143 HydrophobicContact CB-CG1 3.88Å; D141-I143 PolarHBondContact O-N 3.42Å
142	N	55.3	Low	76.2	Confident	109 Å²	109	101.1 Å²	101.1	58%	0.583	50%	0.504	S	S	*	.			trans	-72.1	50	164.6	-98.4	-3.1	0	0	0	110.3	S140 R144	S140-N142 PolarHBondContact O-N 3.44Å; N142-R144 PolarHBondContact O-N 3.4Å
143	I	52.8	Low	74.8	Confident	122 Å²	122	106.2 Å²	106.2	63%	0.626	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-74.2	-2.7	175.9	-71	171.7	0	0	0	111.4	D141	D141-I143 HydrophobicContact CB-CB 4.42Å; D141-I143 HydrophobicContact CB-CD1 3.72Å; D141-I143 HydrophobicContact CB-CG1 3.88Å; D141-I143 PolarHBondContact O-N 3.42Å
144	R	54.7	Low	73.2	Confident	228 Å²	228	113.7 Å²	113.7	86%	0.86	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-83.4	-6	-176.9	-69.6	-174.8	174.6	172.3	-2.5	116.1	N142	N142-R144 PolarHBondContact O-N 3.4Å
145	D	54.4	Low	71.4	Confident	153 Å²	153	116.4 Å²	116.4	82%	0.818	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-105.1	21.3	178.2	-83.2	-14.3	0	0	0	113.6
146	R	48.2	Very low	69.3	Low	234 Å²	234	120.6 Å²	120.6	88%	0.883	60%	0.597	S	S	*	*			trans	-113.7	22.2	177.8	-78.6	-169.1	173.3	-170.3	-1.1	114.8
147	T	43.5	Very low	66.9	Low	199 Å²	199	130.5 Å²	130.5	100%	1.221	65%	0.646	S	S	*	*			trans	-123	0	173.3	50.8	0	0	0	0	111.1

Retrieved 147 of 147 residues in 434.5 ms (Link to these results)

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