A0A087WR31_MOUSE Loading...

CD22 antigen

AlphaFold DB , UniProt , Accession A0A087WR31, Species MOUSE (Mus musculus, Mouse), Gene Cd22, Length 147 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.1	Very low	49	Very low	245 Å²	245	173.2 Å²	173.2	100%	1.207	81%	0.811	S	S	*	*				0	84.9	0	-66.7	169.9	174.8	0	0	108.8
2	R	49.8	Very low	49	Very low	244 Å²	244	171.8 Å²	171.8	92%	0.921	81%	0.812	S	S	*	*			trans	-160.4	60.2	-178.8	-144.4	179.6	-168.8	-166.9	3	111
3	V	51.5	Low	49	Very low	128 Å²	128	163.2 Å²	163.2	78%	0.776	80%	0.798	S	S	*	*			trans	-143.3	60.6	178	-166.7	0	0	0	0	110
4	H	49.4	Very low	49	Very low	179 Å²	179	163.1 Å²	163.1	83%	0.829	79%	0.794	S	S	*	*	S	Bend	trans	-146.2	3.7	169.3	-79.9	-53.2	0	0	0	115.2
5	Y	49.1	Very low	49.3	Very low	209 Å²	209	161.5 Å²	161.5	82%	0.82	80%	0.797	S	S	*	*	S	Bend	trans	-96.4	-7.2	-175.7	-126.4	-91.8	0	0	0	115.1
6	L	49.6	Very low	49.5	Very low	149 Å²	149	157.6 Å²	157.6	78%	0.78	80%	0.798	S	S	*	*	S	Bend	trans	-89.5	-10.5	-178.8	-105.7	92.4	0	0	0	114.7
7	W	47.1	Very low	49.7	Very low	226 Å²	226	155 Å²	155	86%	0.856	80%	0.798	S	S	*	*	S	Bend	trans	-90.9	-14	-179.4	-94.5	40.1	0	0	0	114.2
8	L	47.6	Very low	49.8	Very low	124 Å²	124	151.9 Å²	151.9	65%	0.649	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-13.4	177	-99.1	99	0	0	0	114.4
9	L	49.2	Very low	49.8	Very low	143 Å²	143	156.8 Å²	156.8	75%	0.749	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-10.4	-179.2	-76.1	164.1	0	0	0	113.9
10	L	49.4	Very low	49.6	Very low	130 Å²	130	159.8 Å²	159.8	68%	0.681	81%	0.808	S	S	*	*	S	Bend	trans	-88.8	-7.2	-176.7	-99.4	146.1	0	0	0	114.4
11	I	53	Low	49.8	Very low	128 Å²	128	156.3 Å²	156.3	66%	0.656	80%	0.799	S	S	*	*	S	Bend	trans	-99.2	-4.9	-178.4	13.6	175.7	0	0	0	114
12	L	49.2	Very low	50.5	Low	156 Å²	156	146.8 Å²	146.8	82%	0.817	76%	0.756	S	S	*	*	S	Bend	trans	-86.8	-7.1	175.3	-105.5	83.3	0	0	0	114.1
13	G	49	Very low	51.2	Low	61 Å²	61	140.2 Å²	140.2	63%	0.629	75%	0.754	S	S	*	*	S	Bend	trans	-90.6	3.3	-170.3	0	0	0	0	0	116.7
14	H	49.1	Very low	52.4	Low	162 Å²	162	139.4 Å²	139.4	75%	0.75	75%	0.746	S	S	*	*	S	Bend	trans	-118.5	6.1	-171.4	-64	-23.2	0	0	0	115.1
15	V	53.2	Low	54.3	Low	138 Å²	138	134.3 Å²	134.3	84%	0.836	72%	0.724	S	S	*	*	S	Bend	trans	-114.2	58.2	179	-163.4	0	0	0	0	110.3
16	A	52.5	Low	56.5	Low	99 Å²	99	125.4 Å²	125.4	82%	0.818	69%	0.689	S	S	*	*			trans	-155.6	54.6	171.5	0	0	0	0	0	112.5
17	S	52.8	Low	58.6	Low	114 Å²	114	122 Å²	122	80%	0.797	68%	0.675	S	S	*	*			trans	-147.6	25.7	161.8	56.9	0	0	0	0	113.3	R19	S17-R19 PolarHBondContact O-N 3.14Å
18	A	51.5	Low	61	Low	99 Å²	99	112.4 Å²	112.4	82%	0.818	64%	0.641	S	S	*	*			trans	-73.1	103.6	157.8	0	0	0	0	0	106.6	Y20	A18-Y20 PolarHBondContact O-N 2.78Å
19	R	50.4	Low	63.4	Low	246 Å²	246	111.9 Å²	111.9	93%	0.928	64%	0.639	S	S	*	*			trans	-55.6	116.2	168.1	-71	-176.6	179.6	176.4	0.5	106.7	S17 S21	S17-R19 PolarHBondContact O-N 3.14Å; R19-S21 VanDerWaalsContact C-N 3.25Å; R19-S21 PolarHBondContact O-N 2.82Å
20	Y	46.1	Very low	65.7	Low	215 Å²	215	106.2 Å²	106.2	84%	0.843	61%	0.608	S	S	*	*			trans	-66	91.1	172.9	-173.3	-93.8	0	0	0	107.5	A18 S22	A18-Y20 PolarHBondContact O-N 2.78Å; Y20-S22 PolarHBondContact O-N 3.45Å
21	S	53.6	Low	67.9	Low	88 Å²	88	102.4 Å²	102.4	62%	0.615	59%	0.592	S	S	*	*			trans	-74.5	104.9	167.1	145.2	0	0	0	0	105.7	R19 A23	R19-S21 VanDerWaalsContact C-N 3.25Å; R19-S21 PolarHBondContact O-N 2.82Å; S21-A23 PolarHBondContact O-N 2.86Å
22	S	58.2	Low	69.5	Low	45 Å²	45	104.2 Å²	104.2	32%	0.315	60%	0.597	S	S	.	*			trans	-55.8	141.6	170	8	0	0	0	0	108.6	Y20 N24 D25	Y20-S22 PolarHBondContact O-N 3.45Å; S22-N24 PolarHBondContact O-N 3.32Å; S22-D25 PolarHBondContact O-N 3.31Å; S22-D25 PolarHBondContact OG-OD1 3.28Å; S22-D25 PolarHBondContact OG-OD2 2.67Å
23	A	63.7	Low	71.7	Confident	106 Å²	106	99.7 Å²	99.7	88%	0.876	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-7.7	175.8	0	0	0	0	0	113.8	S21	S21-A23 PolarHBondContact O-N 2.86Å
24	N	77.6	Confident	74	Confident	111 Å²	111	97.8 Å²	97.8	59%	0.594	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	22.8	-178.4	-62.5	9.2	0	0	0	112.4	S22 P51	S22-N24 PolarHBondContact O-N 3.32Å; N24-P51 VanDerWaalsContact O-CA 3.23Å; N24-P51 WeakPolarHBondContact O-CA 3.36Å; N24-P51 WeakPolarHBondContact O-CB 3Å; N24-P51 VanDerWaalsContact O-CG 3.25Å; N24-P51 WeakPolarHBondContact O-CG 3.37Å
25	D	88.8	Confident	76.3	Confident	72 Å²	72	96.8 Å²	96.8	39%	0.385	55%	0.545	S	S	.	.	S	Bend	trans	-88.3	161.8	174.4	-71.9	-0.7	0	0	0	111.9	S22 T27	S22-D25 PolarHBondContact O-N 3.31Å; S22-D25 PolarHBondContact OG-OD1 3.28Å; S22-D25 PolarHBondContact OG-OD2 2.67Å; D25-T27 PolarHBondContact O-N 3.05Å
26	W	94.3	Very high	78.4	Confident	21 Å²	21	90.6 Å²	90.6	8%	0.08	51%	0.508	C	S	.	.			trans	-60.9	134.2	167.2	-75.5	85.7	0	0	0	109.5	Y48 K49 T50 P51 L57 M131 A133 E136 W138	W26-Y48 HydrophobicContact CZ3-CD2 4.16Å; W26-K49 WeakPolarHBondContact CA-O 3.44Å; W26-T50 HydrophobicContact CE3-CG2 4.28Å; W26-T50 HydrophobicContact CH2-CG2 3.61Å; W26-T50 HydrophobicContact CZ2-CG2 4.28Å; W26-T50 HydrophobicContact CZ3-CG2 3.62Å; W26-P51 HydrophobicContact CD2-CG 4.42Å; W26-P51 VanDerWaalsContact CE2-CD 3.48Å; W26-P51 HydrophobicContact CG-CG 3.96Å; W26-P51 VanDerWaalsContact NE1-CD 3.31Å; W26-L57 HydrophobicContact CH2-CD2 3.75Å; W26-L57 HydrophobicContact CZ3-CD2 4.05Å; W26-M131 HydrophobicContact CE3-CE 4.41Å; W26-M131 HydrophobicContact CH2-CB 4.02Å; W26-M131 HydrophobicContact CZ3-CB 3.91Å; W26-M131 HydrophobicContact CZ3-CE 4.33Å; W26-M131 HydrophobicContact CZ3-SD 4.37Å; W26-A133 HydrophobicContact CH2-CB 4.17Å; W26-A133 HydrophobicContact CZ2-CB 4.39Å; W26-E136 HydrophobicContact CZ2-CB 3.74Å; W26-W138 HydrophobicContact CB-CB 4.21Å; W26-W138 HydrophobicContact CB-CD2 3.57Å; W26-W138 HydrophobicContact CB-CE3 3.79Å; W26-W138 HydrophobicContact CB-CG 3.76Å; W26-W138 HydrophobicContact CB-CZ3 4.39Å; W26-W138 AromaticContact CD1-CE3 3.79Å; W26-W138 HydrophobicContact CD2-CB 3.39Å; W26-W138 AromaticContact CD2-CG 3.9Å; W26-W138 HydrophobicContact CD2-CG 3.9Å; W26-W138 HydrophobicContact CE3-CB 3.8Å; W26-W138 HydrophobicContact CE3-CG 4.25Å; W26-W138 HydrophobicContact CG-CB 3.56Å; W26-W138 AromaticContact CG-CD2 3.8Å; W26-W138 HydrophobicContact CG-CD2 3.8Å; W26-W138 AromaticContact CG-CE3 3.91Å; W26-W138 HydrophobicContact CG-CE3 3.91Å; W26-W138 AromaticContact CG-CG 3.67Å; W26-W138 HydrophobicContact CG-CG 3.67Å; W26-W138 HydrophobicContact CZ2-CB 4.21Å; W26-W138 HydrophobicContact CZ3-CB 4.34Å
27	T	95.1	Very high	80.6	Confident	79 Å²	79	94.8 Å²	94.8	49%	0.485	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.8	168.1	-50.7	0	0	0	0	107.9	D25 Y48 K49	D25-T27 PolarHBondContact O-N 3.05Å; T27-Y48 CarbonylContact O-C 3.49Å; T27-Y48 WeakPolarHBondContact O-CA 3.15Å; T27-K49 PolarHBondContact N-O 3.17Å; T27-K49 PolarHBondContact O-N 2.99Å
28	V	96.4	Very high	82.7	Confident	23 Å²	23	94.9 Å²	94.9	14%	0.139	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126	173.7	-160.5	0	0	0	0	108.2	C46 K47 M131 E140	V28-C46 VanDerWaalsContact CG1-SG 3.58Å; V28-K47 CarbonylContact C-O 3.58Å; V28-K47 WeakPolarHBondContact CA-O 3.2Å; V28-K47 WeakPolarHBondContact CG1-O 3.31Å; V28-M131 HydrophobicContact CG1-CE 4.16Å; V28-M131 HydrophobicContact CG2-CE 3.58Å; V28-E140 HydrophobicContact CB-CB 4.46Å; V28-E140 HydrophobicContact CB-CG 3.88Å; V28-E140 WeakPolarHBondContact CB-OE2 3.25Å; V28-E140 HydrophobicContact CG1-CB 4.4Å; V28-E140 HydrophobicContact CG1-CG 3.88Å; V28-E140 HydrophobicContact CG2-CB 4.26Å; V28-E140 HydrophobicContact CG2-CG 4.18Å; V28-E140 VanDerWaalsContact CG2-OE2 3.3Å; V28-E140 WeakPolarHBondContact CG2-OE2 3.09Å
29	D	97.8	Very high	84.7	Confident	113 Å²	113	92.3 Å²	92.3	60%	0.604	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	112.7	-178	178.3	33.1	0	0	0	109	C46 K47	D29-C46 WeakPolarHBondContact O-CA 3.48Å; D29-K47 HydrophobicContact CB-CB 4.47Å; D29-K47 PolarHBondContact N-O 2.68Å; D29-K47 PolarHBondContact O-N 2.94Å
30	H	97.3	Very high	86.9	Confident	24 Å²	24	82.2 Å²	82.2	11%	0.111	44%	0.443	C	S	.	.			trans	-157.9	163.3	176.7	67	85.5	0	0	0	110.4	Q32 P45 C46 E140 P141	H30-Q32 PolarHBondContact O-N 3.38Å; H30-P45 WeakPolarHBondContact CB-O 3.19Å; H30-C46 HydrophobicContact CB-CB 4.29Å; H30-E140 WeakPolarHBondContact NE2-CG 3.41Å; H30-E140 IonicContact NE2-OE1 2.76Å; H30-E140 PolarHBondContact NE2-OE1 3Å; H30-E140 VanDerWaalsContact NE2-OE1 3.13Å; H30-P141 PolarHBondContact CE1-O 2.88Å; H30-P141 VanDerWaalsContact CE1-O 3.25Å
31	P	96.6	Very high	89.3	Confident	50 Å²	50	75.4 Å²	75.4	33%	0.325	43%	0.426	S	S	.	.			trans	-60.6	128.3	171.1	-22.4	34.3	0	0	0	110.8	T33 L34 P45	P31-T33 PolarHBondContact O-N 3.34Å; P31-L34 HydrophobicContact CB-CD2 3.95Å; P31-L34 HydrophobicContact CB-CG 4.23Å; P31-L34 HydrophobicContact CG-CD2 4.07Å; P31-P45 WeakPolarHBondContact CD-O 3.37Å; P31-P45 HydrophobicContact CG-CG 3.92Å
32	Q	87.4	Confident	91.3	Very high	167 Å²	167	71.9 Å²	71.9	78%	0.78	40%	0.4	S	S	*	.	S	Bend	trans	-62.2	-34.8	-179.4	-68.5	-177.4	-20.1	0	0	112.5	H30 H143	H30-Q32 PolarHBondContact O-N 3.38Å; Q32-H143 WeakPolarHBondContact O-CB 3.04Å; Q32-H143 PolarHBondContact O-N 2.79Å
33	T	94.8	Very high	93.2	Very high	61 Å²	61	77.1 Å²	77.1	37%	0.374	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.2	177.7	-59.3	0	0	0	0	110	P31 F35 H143	P31-T33 PolarHBondContact O-N 3.34Å; T33-F35 HydrophobicContact CG2-CD2 4.32Å; T33-F35 HydrophobicContact CG2-CE1 4.37Å; T33-F35 HydrophobicContact CG2-CE2 3.63Å; T33-F35 HydrophobicContact CG2-CZ 3.65Å; T33-H143 CarbonylContact C-O 3.52Å; T33-H143 WeakPolarHBondContact CA-O 3.09Å; T33-H143 HydrophobicContact CG2-CB 4.44Å
34	L	97.2	Very high	94.8	Very high	20 Å²	20	72.1 Å²	72.1	11%	0.105	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.4	179.5	-72.1	160.1	0	0	0	109.6	P31 I42 I44 I142 H143 L144 N145	P31-L34 HydrophobicContact CB-CD2 3.95Å; P31-L34 HydrophobicContact CB-CG 4.23Å; P31-L34 HydrophobicContact CG-CD2 4.07Å; L34-I42 HydrophobicContact CB-CD1 3.79Å; L34-I42 HydrophobicContact CD1-CD1 4.39Å; L34-I42 HydrophobicContact CD2-CD1 4.29Å; L34-I42 HydrophobicContact CG-CD1 4.39Å; L34-I44 HydrophobicContact CD1-CB 4.19Å; L34-I44 HydrophobicContact CD1-CD1 4.32Å; L34-I44 HydrophobicContact CD1-CG1 3.86Å; L34-I44 HydrophobicContact CD1-CG2 3.77Å; L34-I142 HydrophobicContact CD1-CG2 3.87Å; L34-H143 PolarHBondContact N-O 2.81Å; L34-L144 HydrophobicContact CB-CD1 3.89Å; L34-N145 PolarHBondContact O-N 3.3Å
35	F	97.4	Very high	95.7	Very high	142 Å²	142	69.9 Å²	69.9	62%	0.623	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.3	177.1	-60.8	-91.7	0	0	0	109.3	T33 N145	T33-F35 HydrophobicContact CG2-CD2 4.32Å; T33-F35 HydrophobicContact CG2-CE1 4.37Å; T33-F35 HydrophobicContact CG2-CE2 3.63Å; T33-F35 HydrophobicContact CG2-CZ 3.65Å; F35-N145 CarbonylContact C-O 3.55Å; F35-N145 VanDerWaalsContact CA-O 3.29Å; F35-N145 WeakPolarHBondContact CA-O 3.04Å; F35-N145 HydrophobicContact CD1-CB 3.75Å; F35-N145 HydrophobicContact CE1-CB 3.93Å
36	A	97.2	Very high	96.1	Very high	7 Å²	7	66.6 Å²	66.6	6%	0.058	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	170	173.4	0	0	0	0	0	111.1	I42 I119 N145 V146 S147	A36-I42 HydrophobicContact CB-CB 4.31Å; A36-I42 HydrophobicContact CB-CD1 4.09Å; A36-I119 HydrophobicContact CB-CD1 3.66Å; A36-I119 HydrophobicContact CB-CG2 4.03Å; A36-N145 PolarHBondContact N-O 3.05Å; A36-V146 VanDerWaalsContact O-CA 3.3Å; A36-V146 WeakPolarHBondContact O-CA 3.45Å; A36-S147 PolarHBondContact O-N 3.36Å
37	W	97.6	Very high	96.3	Very high	188 Å²	188	72 Å²	72	71%	0.712	37%	0.37	S	S	*	.			trans	-108.6	144	172.1	-59.3	-85.7	0	0	0	109.8	G39 A40 I119 S147	W37-G39 PolarHBondContact O-N 2.85Å; W37-A40 WeakPolarHBondContact O-CB 3.44Å; W37-A40 PolarHBondContact O-N 2.84Å; W37-I119 WeakPolarHBondContact O-CG2 3.13Å; W37-S147 CarbonylContact C-O 3.55Å; W37-S147 VanDerWaalsContact CA-O 3.25Å; W37-S147 WeakPolarHBondContact CA-O 3.42Å
38	E	96.9	Very high	96.3	Very high	116 Å²	116	68.5 Å²	68.5	54%	0.542	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	138.2	176.5	179.7	155.1	-123.3	0	0	111.7	A40 A121 V146 S147	E38-A40 PolarHBondContact O-N 3.33Å; E38-A121 PolarHBondContact OE1-N 3.07Å; E38-V146 HydrophobicContact CB-CG1 4.35Å; E38-S147 PolarHBondContact N-O 2.84Å
39	G	95.1	Very high	96.3	Very high	45 Å²	45	74.7 Å²	74.7	46%	0.464	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	-16.6	-175.5	0	0	0	0	0	114.7	W37 I119	W37-G39 PolarHBondContact O-N 2.85Å; G39-I119 PolarHBondContact N-O 2.86Å
40	A	96.8	Very high	96.1	Very high	34 Å²	34	70.5 Å²	70.5	28%	0.281	35%	0.351	S	S	.	.			trans	-70.3	179.4	179.7	0	0	0	0	0	113.1	W37 E38 H117 P118 I119	W37-A40 WeakPolarHBondContact O-CB 3.44Å; W37-A40 PolarHBondContact O-N 2.84Å; E38-A40 PolarHBondContact O-N 3.33Å; A40-H117 PolarHBondContact O-ND1 2.92Å; A40-P118 WeakPolarHBondContact O-CA 3.47Å; A40-I119 HydrophobicContact CB-CG2 4.15Å; A40-I119 WeakPolarHBondContact O-CG2 3.27Å; A40-I119 PolarHBondContact O-N 3.18Å
41	C	95.6	Very high	95.9	Very high	72 Å²	72	70.2 Å²	70.2	49%	0.486	35%	0.352	S	S	.	.			trans	-110	126.8	168.8	179.1	0	0	0	0	108.1	H117	C41-H117 HydrophobicContact CB-CB 4.12Å
42	I	96.4	Very high	95.6	Very high	14 Å²	14	70.7 Å²	70.7	7%	0.072	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.4	170.2	-164.4	174.6	0	0	0	110.3	L34 A36 K115 I116 I119 L144	L34-I42 HydrophobicContact CB-CD1 3.79Å; L34-I42 HydrophobicContact CD1-CD1 4.39Å; L34-I42 HydrophobicContact CD2-CD1 4.29Å; L34-I42 HydrophobicContact CG-CD1 4.39Å; A36-I42 HydrophobicContact CB-CB 4.31Å; A36-I42 HydrophobicContact CB-CD1 4.09Å; I42-K115 CarbonylContact O-C 3.48Å; I42-K115 VanDerWaalsContact O-CA 3.31Å; I42-K115 WeakPolarHBondContact O-CA 3.33Å; I42-I116 HydrophobicContact CG2-CB 3.85Å; I42-I116 HydrophobicContact CG2-CD1 4.46Å; I42-I116 HydrophobicContact CG2-CG1 4.25Å; I42-I116 PolarHBondContact N-O 3.14Å; I42-I116 PolarHBondContact O-N 3.4Å; I42-I119 HydrophobicContact CB-CD1 4.06Å; I42-I119 HydrophobicContact CG2-CD1 3.41Å; I42-I119 VanDerWaalsContact CG2-CD1 3.41Å; I42-L144 HydrophobicContact CD1-CD1 3.65Å
43	R	96.8	Very high	95.4	Very high	155 Å²	155	68.3 Å²	68.3	59%	0.585	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	126.2	167.1	-174.1	179.3	-175	-171.7	1	108.2	P45 L105 T113 L114	R43-P45 WeakPolarHBondContact O-CD 3.23Å; R43-L105 HydrophobicContact CG-CD1 4.31Å; R43-T113 HydrophobicContact CG-CG2 3.82Å; R43-L114 CarbonylContact C-O 3.56Å; R43-L114 WeakPolarHBondContact CA-O 3.44Å
44	I	97.2	Very high	95	Very high	1 Å²	1	75.5 Å²	75.5	1%	0.005	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	94.1	178.6	-53.9	-176.4	0	0	0	107	L34 C46 T113 L114 I116 L127 I142	L34-I44 HydrophobicContact CD1-CB 4.19Å; L34-I44 HydrophobicContact CD1-CD1 4.32Å; L34-I44 HydrophobicContact CD1-CG1 3.86Å; L34-I44 HydrophobicContact CD1-CG2 3.77Å; I44-C46 PolarHBondContact O-N 3.47Å; I44-T113 WeakPolarHBondContact O-CA 3.19Å; I44-T113 WeakPolarHBondContact O-CG2 3.46Å; I44-L114 HydrophobicContact CB-CB 4.36Å; I44-L114 PolarHBondContact N-O 2.8Å; I44-L114 PolarHBondContact O-N 3.49Å; I44-L114 VanDerWaalsContact O-N 3.17Å; I44-I116 HydrophobicContact CD1-CD1 4.1Å; I44-L127 HydrophobicContact CD1-CD1 4.25Å; I44-I142 HydrophobicContact CG2-CD1 4.07Å; I44-I142 HydrophobicContact CG2-CG2 4.47Å
45	P	97.7	Very high	94.6	Very high	63 Å²	63	75.7 Å²	75.7	41%	0.409	38%	0.381	S	S	.	.			trans	-66.4	131.9	177.9	28.7	-33.5	0	0	0	109.3	H30 P31 R43	H30-P45 WeakPolarHBondContact CB-O 3.19Å; P31-P45 WeakPolarHBondContact CD-O 3.37Å; P31-P45 HydrophobicContact CG-CG 3.92Å; R43-P45 WeakPolarHBondContact O-CD 3.23Å
46	C	97.6	Very high	94.4	Very high	4 Å²	4	76.9 Å²	76.9	3%	0.027	38%	0.382	C	S	.	.			trans	-152.4	130.9	-175.1	-177.7	0	0	0	0	110.5	V28 D29 H30 I44 N111 C112 T113	V28-C46 VanDerWaalsContact CG1-SG 3.58Å; D29-C46 WeakPolarHBondContact O-CA 3.48Å; H30-C46 HydrophobicContact CB-CB 4.29Å; I44-C46 PolarHBondContact O-N 3.47Å; C46-N111 PolarHBondContact O-OD1 2.87Å; C46-C112 HydrophobicContact CB-CB 3.83Å; C46-C112 WeakPolarHBondContact CB-SG 3.29Å; C46-C112 PolarHBondContact O-N 3.32Å; C46-C112 PolarHBondContact O-SG 2.76Å; C46-C112 WeakPolarHBondContact SG-CB 3.3Å; C46-C112 CovalentContact SG-SG 2.03Å; C46-C112 PolarHBondContact SG-SG 2.84Å; C46-T113 PolarHBondContact N-OG1 2.88Å; C46-T113 PolarHBondContact O-OG1 2.77Å
47	K	97.8	Very high	94.2	Very high	133 Å²	133	76.6 Å²	76.6	58%	0.578	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.3	167.7	-69.4	-175.8	179	179.4	0	110.1	V28 D29 D110 C112	V28-K47 CarbonylContact C-O 3.58Å; V28-K47 WeakPolarHBondContact CA-O 3.2Å; V28-K47 WeakPolarHBondContact CG1-O 3.31Å; D29-K47 HydrophobicContact CB-CB 4.47Å; D29-K47 PolarHBondContact N-O 2.68Å; D29-K47 PolarHBondContact O-N 2.94Å; K47-D110 CarbonylContact C-O 3.59Å; K47-D110 VanDerWaalsContact CA-O 3.25Å; K47-D110 WeakPolarHBondContact CA-O 3.46Å; K47-C112 VanDerWaalsContact C-SG 3.53Å; K47-C112 PolarHBondContact N-SG 3.22Å
48	Y	95.8	Very high	94	Very high	7 Å²	7	69.2 Å²	69.2	3%	0.027	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.8	177.6	74.1	-86.5	0	0	0	113	W26 T27 T50 L57 R108 I109 D110 C112 M131	W26-Y48 HydrophobicContact CZ3-CD2 4.16Å; T27-Y48 CarbonylContact O-C 3.49Å; T27-Y48 WeakPolarHBondContact O-CA 3.15Å; Y48-T50 HydrophobicContact CD2-CG2 3.96Å; Y48-T50 HydrophobicContact CE2-CG2 3.73Å; Y48-L57 HydrophobicContact CD1-CD1 4.13Å; Y48-L57 HydrophobicContact CD2-CD1 4.39Å; Y48-L57 HydrophobicContact CE1-CD1 3.39Å; Y48-L57 HydrophobicContact CE1-CG 4.21Å; Y48-L57 HydrophobicContact CE2-CD1 3.74Å; Y48-L57 HydrophobicContact CE2-CD2 4.18Å; Y48-L57 HydrophobicContact CE2-CG 3.7Å; Y48-L57 VanDerWaalsContact CZ-CG 3.47Å; Y48-L57 VanDerWaalsContact OH-CD1 3.25Å; Y48-L57 WeakPolarHBondContact OH-CD1 3.25Å; Y48-L57 VanDerWaalsContact OH-CG 3.23Å; Y48-L57 WeakPolarHBondContact OH-CG 3.38Å; Y48-R108 PolarHBondContact OH-O 2.93Å; Y48-R108 VanDerWaalsContact OH-O 3.08Å; Y48-I109 WeakPolarHBondContact CE2-O 3.31Å; Y48-I109 VanDerWaalsContact CZ-C 3.45Å; Y48-I109 WeakPolarHBondContact OH-CA 3.31Å; Y48-I109 PolarHBondContact OH-N 2.99Å; Y48-I109 PolarHBondContact OH-O 3.18Å; Y48-D110 VanDerWaalsContact CD1-C 3.49Å; Y48-D110 VanDerWaalsContact CE1-C 3.43Å; Y48-D110 PolarHBondContact N-O 2.75Å; Y48-D110 PolarHBondContact OH-N 3.07Å; Y48-C112 HydrophobicContact CD1-CB 3.78Å; Y48-C112 HydrophobicContact CE1-CB 4.39Å; Y48-M131 HydrophobicContact CD1-SD 4.27Å; Y48-M131 HydrophobicContact CG-SD 4.11Å
49	K	95.3	Very high	93.7	Very high	152 Å²	152	66 Å²	66	66%	0.661	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	135.6	165.6	-65.6	-178.7	179.5	176.1	0	108.9	W26 T27	W26-K49 WeakPolarHBondContact CA-O 3.44Å; T27-K49 PolarHBondContact N-O 3.17Å; T27-K49 PolarHBondContact O-N 2.99Å
50	T	93.6	Very high	93.6	Very high	25 Å²	25	63.9 Å²	63.9	15%	0.153	32%	0.318	C	S	.	.			trans	-90.6	150.3	177	61.7	0	0	0	0	110.9	W26 Y48 L52 A133	W26-T50 HydrophobicContact CE3-CG2 4.28Å; W26-T50 HydrophobicContact CH2-CG2 3.61Å; W26-T50 HydrophobicContact CZ2-CG2 4.28Å; W26-T50 HydrophobicContact CZ3-CG2 3.62Å; Y48-T50 HydrophobicContact CD2-CG2 3.96Å; Y48-T50 HydrophobicContact CE2-CG2 3.73Å; T50-L52 PolarHBondContact O-N 2.88Å; T50-L52 PolarHBondContact OG1-O 2.91Å; T50-A133 HydrophobicContact CG2-CB 4.07Å
51	P	92.8	Very high	93.4	Very high	19 Å²	19	63.8 Å²	63.8	12%	0.123	31%	0.312	C	S	.	.	S	Bend	trans	-51.4	-34.5	167.4	-33.4	39.1	0	0	0	114.3	N24 W26 P53 E136	N24-P51 VanDerWaalsContact O-CA 3.23Å; N24-P51 WeakPolarHBondContact O-CA 3.36Å; N24-P51 WeakPolarHBondContact O-CB 3Å; N24-P51 VanDerWaalsContact O-CG 3.25Å; N24-P51 WeakPolarHBondContact O-CG 3.37Å; W26-P51 HydrophobicContact CD2-CG 4.42Å; W26-P51 VanDerWaalsContact CE2-CD 3.48Å; W26-P51 HydrophobicContact CG-CG 3.96Å; W26-P51 VanDerWaalsContact NE1-CD 3.31Å; P51-P53 WeakPolarHBondContact O-CD 3.44Å; P51-E136 HydrophobicContact CB-CG 4Å; P51-E136 HydrophobicContact CG-CG 4.11Å
52	L	90.1	Very high	93.4	Very high	59 Å²	59	60.3 Å²	60.3	31%	0.309	29%	0.289	S	S	.	.	S	Bend	trans	-85	117.7	-176.9	-62.8	176.2	0	0	0	109.9	T50 K54 A55 A133 E136	T50-L52 PolarHBondContact O-N 2.88Å; T50-L52 PolarHBondContact OG1-O 2.91Å; L52-K54 PolarHBondContact O-N 2.96Å; L52-A55 HydrophobicContact CB-CB 3.52Å; L52-A55 HydrophobicContact CD1-CB 4.34Å; L52-A55 WeakPolarHBondContact O-CB 3.37Å; L52-A55 PolarHBondContact O-N 3.23Å; L52-A133 WeakPolarHBondContact CD1-O 3.29Å; L52-E136 HydrophobicContact CD1-CB 4.34Å; L52-E136 HydrophobicContact CD1-CG 3.78Å; L52-E136 HydrophobicContact CD2-CG 4.25Å; L52-E136 HydrophobicContact CG-CG 3.64Å
53	P	85.1	Confident	93.3	Very high	117 Å²	117	60.5 Å²	60.5	76%	0.76	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	132.5	178.4	-24.1	34.2	0	0	0	111.5	P51 A55	P51-P53 WeakPolarHBondContact O-CD 3.44Å; P53-A55 PolarHBondContact O-N 2.68Å; P53-A55 VanDerWaalsContact O-N 3.08Å
54	K	85.9	Confident	93.1	Very high	212 Å²	212	53.6 Å²	53.6	92%	0.922	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	12	178.3	-51.2	177.6	-179.1	177.2	0	115	L52	L52-K54 PolarHBondContact O-N 2.96Å
55	A	89.3	Confident	92.7	Very high	25 Å²	25	58.1 Å²	58.1	21%	0.207	29%	0.288	C	S	.	.			trans	-68	151.4	175	0	0	0	0	0	111	L52 P53 A133	L52-A55 HydrophobicContact CB-CB 3.52Å; L52-A55 HydrophobicContact CD1-CB 4.34Å; L52-A55 WeakPolarHBondContact O-CB 3.37Å; L52-A55 PolarHBondContact O-N 3.23Å; P53-A55 PolarHBondContact O-N 2.68Å; P53-A55 VanDerWaalsContact O-N 3.08Å; A55-A133 HydrophobicContact CB-CB 4.26Å
56	R	92.3	Very high	92.6	Very high	167 Å²	167	57.8 Å²	57.8	63%	0.63	28%	0.279	S	S	*	.			trans	-111	150.1	173.4	-67.3	-175.7	-179.5	170.2	-0.3	109.5	D58 R108	R56-D58 PolarHBondContact O-N 3.23Å; R56-R108 CarbonylContact C-O 3.57Å; R56-R108 WeakPolarHBondContact CA-O 3.09Å; R56-R108 HydrophobicContact CB-CB 4.41Å; R56-R108 VanDerWaalsContact CB-O 3.26Å; R56-R108 WeakPolarHBondContact CB-O 3.37Å
57	L	92.8	Very high	92.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.309	C	S	.	.			trans	-66.2	125	175.4	-74.6	175.9	0	0	0	111	W26 Y48 I60 R108 M131 A133	W26-L57 HydrophobicContact CH2-CD2 3.75Å; W26-L57 HydrophobicContact CZ3-CD2 4.05Å; Y48-L57 HydrophobicContact CD1-CD1 4.13Å; Y48-L57 HydrophobicContact CD2-CD1 4.39Å; Y48-L57 HydrophobicContact CE1-CD1 3.39Å; Y48-L57 HydrophobicContact CE1-CG 4.21Å; Y48-L57 HydrophobicContact CE2-CD1 3.74Å; Y48-L57 HydrophobicContact CE2-CD2 4.18Å; Y48-L57 HydrophobicContact CE2-CG 3.7Å; Y48-L57 VanDerWaalsContact CZ-CG 3.47Å; Y48-L57 VanDerWaalsContact OH-CD1 3.25Å; Y48-L57 WeakPolarHBondContact OH-CD1 3.25Å; Y48-L57 VanDerWaalsContact OH-CG 3.23Å; Y48-L57 WeakPolarHBondContact OH-CG 3.38Å; L57-I60 HydrophobicContact CB-CD1 4.44Å; L57-I60 HydrophobicContact CB-CG1 4.3Å; L57-I60 HydrophobicContact CD1-CD1 3.61Å; L57-I60 HydrophobicContact CD1-CG1 3.76Å; L57-R108 HydrophobicContact CB-CB 4.3Å; L57-R108 HydrophobicContact CB-CG 4.45Å; L57-R108 PolarHBondContact N-O 3.19Å; L57-R108 WeakPolarHBondContact O-CD 3.48Å; L57-R108 PolarHBondContact O-NH1 2.86Å; L57-M131 HydrophobicContact CD1-CG 4.17Å; L57-M131 HydrophobicContact CD1-SD 4.04Å; L57-M131 HydrophobicContact CD2-CB 3.77Å; L57-M131 HydrophobicContact CD2-CG 4.26Å; L57-A133 HydrophobicContact CD2-CB 4.3Å
58	D	92.6	Very high	92.4	Very high	34 Å²	34	62.7 Å²	62.7	18%	0.182	30%	0.302	C	S	.	.	S	Bend	trans	-80.6	-43.1	171.5	-62.6	-48.4	0	0	0	110.5	R56 T84 K85 R108 T132 G134	R56-D58 PolarHBondContact O-N 3.23Å; D58-T84 CarbonylContact O-C 3.48Å; D58-K85 HydrophobicContact CB-CD 4.39Å; D58-K85 VanDerWaalsContact O-CB 3.24Å; D58-K85 WeakPolarHBondContact O-CB 3.24Å; D58-K85 PolarHBondContact O-N 3.17Å; D58-K85 WeakPolarHBondContact OD1-CD 2.94Å; D58-K85 IonicContact OD1-NZ 2.8Å; D58-K85 PolarHBondContact OD1-NZ 3.05Å; D58-R108 PolarHBondContact O-NH1 3.49Å; D58-T132 PolarHBondContact N-O 3.01Å; D58-G134 PolarHBondContact OD2-N 3.34Å
59	N	91.4	Very high	92.4	Very high	48 Å²	48	64.9 Å²	64.9	26%	0.257	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	147.9	179.6	-47.1	-71	0	0	0	112.1	L61 A83 T84 T132	N59-L61 HydrophobicContact CB-CD1 3.94Å; N59-A83 CarbonylContact C-O 3.6Å; N59-A83 VanDerWaalsContact CA-O 3.28Å; N59-A83 WeakPolarHBondContact CA-O 3.43Å; N59-T84 WeakPolarHBondContact OD1-CA 3.47Å; N59-T84 WeakPolarHBondContact OD1-CB 3.21Å; N59-T84 VanDerWaalsContact OD1-CG2 3.25Å; N59-T84 WeakPolarHBondContact OD1-CG2 3.47Å; N59-T132 VanDerWaalsContact CB-OG1 3.31Å; N59-T132 WeakPolarHBondContact CB-OG1 3.25Å; N59-T132 PolarHBondContact N-O 2.8Å; N59-T132 PolarHBondContact N-OG1 2.89Å; N59-T132 PolarHBondContact ND2-OG1 2.89Å; N59-T132 PolarHBondContact O-N 2.92Å
60	I	92.8	Very high	92.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119.8	174	-57.3	179.3	0	0	0	107.8	L57 N82 A83 F104 L129 R130	L57-I60 HydrophobicContact CB-CD1 4.44Å; L57-I60 HydrophobicContact CB-CG1 4.3Å; L57-I60 HydrophobicContact CD1-CD1 3.61Å; L57-I60 HydrophobicContact CD1-CG1 3.76Å; I60-N82 CarbonylContact O-C 3.49Å; I60-N82 WeakPolarHBondContact O-CA 3.37Å; I60-A83 PolarHBondContact N-O 3.13Å; I60-A83 PolarHBondContact O-N 3.43Å; I60-F104 HydrophobicContact CD1-CD2 4.18Å; I60-F104 HydrophobicContact CD1-CE1 3.88Å; I60-F104 HydrophobicContact CD1-CE2 3.41Å; I60-F104 VanDerWaalsContact CD1-CE2 3.41Å; I60-F104 HydrophobicContact CD1-CZ 3.23Å; I60-L129 HydrophobicContact CG2-CD1 3.72Å; I60-R130 WeakPolarHBondContact CA-O 3.4Å
61	L	93.6	Very high	92.5	Very high	32 Å²	32	68.6 Å²	68.6	17%	0.168	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.7	175.5	-69.9	77.2	0	0	0	109.5	N59 F63 Y81 N82 R130	N59-L61 HydrophobicContact CB-CD1 3.94Å; L61-F63 HydrophobicContact CB-CD2 4.33Å; L61-F63 HydrophobicContact CB-CE2 3.9Å; L61-F63 HydrophobicContact CD2-CE2 3.97Å; L61-F63 HydrophobicContact CD2-CZ 3.98Å; L61-Y81 CarbonylContact C-O 3.54Å; L61-Y81 VanDerWaalsContact CA-O 3.24Å; L61-Y81 WeakPolarHBondContact CA-O 3.33Å; L61-N82 HydrophobicContact CG-CB 4.21Å; L61-R130 HydrophobicContact CB-CB 4.14Å; L61-R130 PolarHBondContact N-O 3.04Å; L61-R130 PolarHBondContact O-N 2.95Å
62	L	94.5	Very high	92.6	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.3	168.2	-173.3	68.1	0	0	0	108.5	L80 Y81 V102 L114 I116 L127	L62-L80 HydrophobicContact CB-CB 4.39Å; L62-L80 HydrophobicContact CD2-CB 4.1Å; L62-L80 HydrophobicContact CD2-CD1 4.14Å; L62-L80 HydrophobicContact CG-CB 4.31Å; L62-L80 HydrophobicContact CG-CD1 4.5Å; L62-L80 PolarHBondContact O-N 3.31Å; L62-Y81 PolarHBondContact N-O 3.08Å; L62-Y81 PolarHBondContact O-N 3.25Å; L62-V102 HydrophobicContact CD2-CG1 4Å; L62-V102 HydrophobicContact CD2-CG2 4.31Å; L62-L114 HydrophobicContact CB-CD1 4.47Å; L62-L114 HydrophobicContact CD1-CD1 3.99Å; L62-L114 HydrophobicContact CD2-CD1 4.24Å; L62-L114 HydrophobicContact CG-CD1 4.47Å; L62-I116 HydrophobicContact CD2-CD1 4.27Å; L62-L127 HydrophobicContact CD1-CB 4.09Å; L62-L127 HydrophobicContact CD1-CD1 4.47Å
63	F	94.6	Very high	92.8	Very high	17 Å²	17	75.4 Å²	75.4	8%	0.075	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	153.9	171.2	-71.1	-91.1	0	0	0	111.3	L61 Y66 T78 V79 L127 G128 R130 M139	L61-F63 HydrophobicContact CB-CD2 4.33Å; L61-F63 HydrophobicContact CB-CE2 3.9Å; L61-F63 HydrophobicContact CD2-CE2 3.97Å; L61-F63 HydrophobicContact CD2-CZ 3.98Å; F63-Y66 HydrophobicContact CB-CD1 4.45Å; F63-Y66 HydrophobicContact CB-CG 4.39Å; F63-T78 CarbonylContact C-O 3.52Å; F63-T78 WeakPolarHBondContact CA-O 3.39Å; F63-V79 HydrophobicContact CD1-CG2 4.03Å; F63-V79 HydrophobicContact CE1-CG2 3.6Å; F63-V79 HydrophobicContact CZ-CG2 4.15Å; F63-L127 CarbonylContact O-C 3.52Å; F63-L127 VanDerWaalsContact O-CA 3.25Å; F63-L127 WeakPolarHBondContact O-CA 3.45Å; F63-G128 PolarHBondContact N-O 3.13Å; F63-G128 PolarHBondContact O-N 3.13Å; F63-R130 HydrophobicContact CD2-CB 4.03Å; F63-R130 HydrophobicContact CE2-CB 3.84Å; F63-R130 HydrophobicContact CE2-CG 4.19Å; F63-M139 HydrophobicContact CD2-CE 3.97Å; F63-M139 HydrophobicContact CE2-CE 4.3Å
64	Q	92.5	Very high	93.2	Very high	10 Å²	10	76.7 Å²	76.7	5%	0.047	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.6	162	-179.6	179	43.6	0	0	109.6	Y66 T78 L80 N122 D123 L127	Q64-Y66 VanDerWaalsContact C-N 3.32Å; Q64-Y66 PolarHBondContact O-N 2.84Å; Q64-T78 PolarHBondContact N-O 3.45Å; Q64-T78 PolarHBondContact O-N 3.32Å; Q64-T78 VanDerWaalsContact O-N 3.13Å; Q64-L80 HydrophobicContact CB-CD1 3.85Å; Q64-L80 HydrophobicContact CB-CD2 4.28Å; Q64-L80 HydrophobicContact CB-CG 3.94Å; Q64-N122 PolarHBondContact NE2-O 2.94Å; Q64-D123 VanDerWaalsContact NE2-CA 3.34Å; Q64-D123 PolarHBondContact NE2-O 3.39Å; Q64-L127 HydrophobicContact CB-CD2 4.06Å; Q64-L127 HydrophobicContact CG-CD2 4.2Å
65	N	89.8	Confident	93.6	Very high	96 Å²	96	68.9 Å²	68.9	51%	0.513	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.5	52.4	177.7	-60.7	-30.3	0	0	0	111.2	N126	N65-N126 PolarHBondContact N-O 3.13Å; N65-N126 VanDerWaalsContact N-O 3.13Å
66	Y	93.8	Very high	93.7	Very high	56 Å²	56	70.9 Å²	70.9	22%	0.22	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	148.3	-174	70.7	-86.8	0	0	0	112.3	F63 Q64 F75 T76 M139	F63-Y66 HydrophobicContact CB-CD1 4.45Å; F63-Y66 HydrophobicContact CB-CG 4.39Å; Q64-Y66 VanDerWaalsContact C-N 3.32Å; Q64-Y66 PolarHBondContact O-N 2.84Å; Y66-F75 AromaticContact CD2-CD1 3.7Å; Y66-F75 HydrophobicContact CD2-CD1 3.7Å; Y66-F75 AromaticContact CD2-CE1 3.89Å; Y66-F75 HydrophobicContact CD2-CE1 3.89Å; Y66-F75 HydrophobicContact CE2-CD1 4.27Å; Y66-F75 AromaticContact CE2-CE1 3.99Å; Y66-F75 HydrophobicContact CE2-CE1 3.99Å; Y66-T76 CarbonylContact C-O 3.58Å; Y66-T76 WeakPolarHBondContact CA-O 3.3Å; Y66-T76 WeakPolarHBondContact CB-O 3.42Å; Y66-M139 HydrophobicContact CD2-CE 3.95Å; Y66-M139 HydrophobicContact CD2-CG 4.28Å; Y66-M139 HydrophobicContact CD2-SD 4.3Å; Y66-M139 HydrophobicContact CE2-CE 4.28Å; Y66-M139 HydrophobicContact CE2-CG 3.66Å; Y66-M139 HydrophobicContact CE2-SD 4.15Å; Y66-M139 HydrophobicContact CG-CE 4.3Å
67	E	95.6	Very high	93.6	Very high	143 Å²	143	64.8 Å²	64.8	67%	0.668	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.5	174.4	-66.1	-171.4	177.3	0	0	110.9	F75 T76	E67-F75 CarbonylContact O-C 3.5Å; E67-F75 VanDerWaalsContact O-CA 3.31Å; E67-F75 WeakPolarHBondContact O-CA 3.46Å; E67-T76 PolarHBondContact N-O 2.91Å; E67-T76 PolarHBondContact O-N 2.79Å; E67-T76 PolarHBondContact O-OG1 3.06Å
68	F	95.6	Very high	93.5	Very high	98 Å²	98	68.6 Å²	68.6	43%	0.43	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	110.6	174.2	-175	-105.4	0	0	0	110.6	K70 K73 F75	F68-K70 HydrophobicContact CD1-CG 4.15Å; F68-K70 HydrophobicContact CE1-CG 4.34Å; F68-K70 PolarHBondContact O-N 3.21Å; F68-K73 HydrophobicContact CE1-CD 4.4Å; F68-K73 HydrophobicContact CZ-CB 4.29Å; F68-K73 HydrophobicContact CZ-CD 4.08Å; F68-F75 HydrophobicContact CB-CD1 3.99Å; F68-F75 HydrophobicContact CB-CE1 3.7Å; F68-F75 HydrophobicContact CB-CZ 4.39Å; F68-F75 HydrophobicContact CD2-CD1 4.06Å; F68-F75 HydrophobicContact CD2-CD2 4.24Å; F68-F75 AromaticContact CD2-CE1 3.8Å; F68-F75 HydrophobicContact CD2-CE1 3.8Å; F68-F75 AromaticContact CD2-CE2 3.96Å; F68-F75 HydrophobicContact CD2-CE2 3.96Å; F68-F75 HydrophobicContact CD2-CG 4.3Å; F68-F75 AromaticContact CD2-CZ 3.75Å; F68-F75 HydrophobicContact CD2-CZ 3.75Å; F68-F75 HydrophobicContact CE2-CE2 4.45Å; F68-F75 HydrophobicContact CG-CE1 4.19Å; F68-F75 HydrophobicContact CG-CZ 4.44Å
69	D	95.8	Very high	93.4	Very high	53 Å²	53	70.5 Å²	70.5	28%	0.283	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	112.7	171.9	177.2	-9.5	0	0	0	109.6	A71 T72 K73 K74 T76	D69-A71 VanDerWaalsContact C-N 3.32Å; D69-A71 PolarHBondContact O-N 2.73Å; D69-A71 WeakPolarHBondContact OD1-CA 2.99Å; D69-A71 WeakPolarHBondContact OD1-CB 3.25Å; D69-A71 PolarHBondContact OD1-N 2.8Å; D69-T72 WeakPolarHBondContact CB-OG1 3.11Å; D69-T72 PolarHBondContact OD1-N 2.84Å; D69-T72 VanDerWaalsContact OD1-N 3.14Å; D69-T72 WeakPolarHBondContact OD2-CB 3.48Å; D69-T72 WeakPolarHBondContact OD2-CG2 3.48Å; D69-T72 PolarHBondContact OD2-OG1 2.82Å; D69-K73 WeakPolarHBondContact O-CA 3.31Å; D69-K73 PolarHBondContact O-N 2.83Å; D69-K74 WeakPolarHBondContact CB-O 3.32Å; D69-K74 PolarHBondContact N-O 2.89Å; D69-K74 PolarHBondContact O-N 2.95Å; D69-T76 HydrophobicContact CB-CG2 4.41Å
70	K	95.4	Very high	93.4	Very high	162 Å²	162	69.8 Å²	69.8	70%	0.704	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.9	-178.9	-67.4	179.9	-178	175	0	113.5	F68 K73	F68-K70 HydrophobicContact CD1-CG 4.15Å; F68-K70 HydrophobicContact CE1-CG 4.34Å; F68-K70 PolarHBondContact O-N 3.21Å; K70-K73 VanDerWaalsContact O-CD 3.31Å; K70-K73 WeakPolarHBondContact O-CD 3.36Å; K70-K73 WeakPolarHBondContact O-CE 3.28Å; K70-K73 PolarHBondContact O-NZ 3.34Å
71	A	96.1	Very high	93.2	Very high	92 Å²	92	70.3 Å²	70.3	76%	0.76	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-50.2	179.8	0	0	0	0	0	110.3	D69	D69-A71 VanDerWaalsContact C-N 3.32Å; D69-A71 PolarHBondContact O-N 2.73Å; D69-A71 WeakPolarHBondContact OD1-CA 2.99Å; D69-A71 WeakPolarHBondContact OD1-CB 3.25Å; D69-A71 PolarHBondContact OD1-N 2.8Å
72	T	95.4	Very high	93	Very high	74 Å²	74	71.7 Å²	71.7	45%	0.454	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-11.4	-179.8	64.4	0	0	0	0	113.6	D69 K74	D69-T72 WeakPolarHBondContact CB-OG1 3.11Å; D69-T72 PolarHBondContact OD1-N 2.84Å; D69-T72 VanDerWaalsContact OD1-N 3.14Å; D69-T72 WeakPolarHBondContact OD2-CB 3.48Å; D69-T72 WeakPolarHBondContact OD2-CG2 3.48Å; D69-T72 PolarHBondContact OD2-OG1 2.82Å; T72-K74 PolarHBondContact O-N 3.34Å
73	K	93.4	Very high	92.5	Very high	147 Å²	147	71.7 Å²	71.7	64%	0.639	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	33	-173.2	-53.9	-61.1	-175.8	-160.1	0	112.4	F68 D69 K70	F68-K73 HydrophobicContact CE1-CD 4.4Å; F68-K73 HydrophobicContact CZ-CB 4.29Å; F68-K73 HydrophobicContact CZ-CD 4.08Å; D69-K73 WeakPolarHBondContact O-CA 3.31Å; D69-K73 PolarHBondContact O-N 2.83Å; K70-K73 VanDerWaalsContact O-CD 3.31Å; K70-K73 WeakPolarHBondContact O-CD 3.36Å; K70-K73 WeakPolarHBondContact O-CE 3.28Å; K70-K73 PolarHBondContact O-NZ 3.34Å
74	K	93.1	Very high	92	Very high	144 Å²	144	72.6 Å²	72.6	63%	0.626	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	155	-178.2	-69	177.7	-176.1	-179.2	0	110.9	D69 T72	D69-K74 WeakPolarHBondContact CB-O 3.32Å; D69-K74 PolarHBondContact N-O 2.89Å; D69-K74 PolarHBondContact O-N 2.95Å; T72-K74 PolarHBondContact O-N 3.34Å
75	F	94.4	Very high	91.1	Very high	49 Å²	49	78 Å²	78	22%	0.215	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137.7	167.4	-71	-78.7	0	0	0	109.7	Y66 E67 F68 M139	Y66-F75 AromaticContact CD2-CD1 3.7Å; Y66-F75 HydrophobicContact CD2-CD1 3.7Å; Y66-F75 AromaticContact CD2-CE1 3.89Å; Y66-F75 HydrophobicContact CD2-CE1 3.89Å; Y66-F75 HydrophobicContact CE2-CD1 4.27Å; Y66-F75 AromaticContact CE2-CE1 3.99Å; Y66-F75 HydrophobicContact CE2-CE1 3.99Å; E67-F75 CarbonylContact O-C 3.5Å; E67-F75 VanDerWaalsContact O-CA 3.31Å; E67-F75 WeakPolarHBondContact O-CA 3.46Å; F68-F75 HydrophobicContact CB-CD1 3.99Å; F68-F75 HydrophobicContact CB-CE1 3.7Å; F68-F75 HydrophobicContact CB-CZ 4.39Å; F68-F75 HydrophobicContact CD2-CD1 4.06Å; F68-F75 HydrophobicContact CD2-CD2 4.24Å; F68-F75 AromaticContact CD2-CE1 3.8Å; F68-F75 HydrophobicContact CD2-CE1 3.8Å; F68-F75 AromaticContact CD2-CE2 3.96Å; F68-F75 HydrophobicContact CD2-CE2 3.96Å; F68-F75 HydrophobicContact CD2-CG 4.3Å; F68-F75 AromaticContact CD2-CZ 3.75Å; F68-F75 HydrophobicContact CD2-CZ 3.75Å; F68-F75 HydrophobicContact CE2-CE2 4.45Å; F68-F75 HydrophobicContact CG-CE1 4.19Å; F68-F75 HydrophobicContact CG-CZ 4.44Å; F75-M139 HydrophobicContact CB-CE 3.85Å; F75-M139 HydrophobicContact CD1-CE 3.56Å; F75-M139 HydrophobicContact CD2-CE 3.51Å; F75-M139 HydrophobicContact CE1-CB 4.4Å; F75-M139 HydrophobicContact CE1-CE 3.87Å; F75-M139 HydrophobicContact CE1-CG 4.07Å; F75-M139 HydrophobicContact CE2-CB 3.95Å; F75-M139 HydrophobicContact CE2-CE 3.85Å; F75-M139 HydrophobicContact CE2-CG 4.36Å; F75-M139 HydrophobicContact CG-CE 3.34Å; F75-M139 HydrophobicContact CZ-CB 3.72Å; F75-M139 HydrophobicContact CZ-CE 4.01Å; F75-M139 HydrophobicContact CZ-CG 3.9Å
76	T	92.4	Very high	89.8	Confident	66 Å²	66	79.2 Å²	79.2	41%	0.405	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	160.7	171.7	63.7	0	0	0	0	108.9	Y66 E67 D69	Y66-T76 CarbonylContact C-O 3.58Å; Y66-T76 WeakPolarHBondContact CA-O 3.3Å; Y66-T76 WeakPolarHBondContact CB-O 3.42Å; E67-T76 PolarHBondContact N-O 2.91Å; E67-T76 PolarHBondContact O-N 2.79Å; E67-T76 PolarHBondContact O-OG1 3.06Å; D69-T76 HydrophobicContact CB-CG2 4.41Å
77	G	90.3	Very high	88	Confident	39 Å²	39	78.3 Å²	78.3	40%	0.402	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	142.9	176.7	-177.6	0	0	0	0	0	111.7	V79	G77-V79 PolarHBondContact O-N 2.79Å
78	T	90.5	Very high	85.6	Confident	80 Å²	80	80.9 Å²	80.9	49%	0.491	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	122.8	177.4	-57.9	0	0	0	0	109.4	F63 Q64 L80	F63-T78 CarbonylContact C-O 3.52Å; F63-T78 WeakPolarHBondContact CA-O 3.39Å; Q64-T78 PolarHBondContact N-O 3.45Å; Q64-T78 PolarHBondContact O-N 3.32Å; Q64-T78 VanDerWaalsContact O-N 3.13Å; T78-L80 HydrophobicContact CG2-CD2 4.06Å; T78-L80 PolarHBondContact O-N 2.98Å
79	V	90.8	Very high	83.3	Confident	74 Å²	74	79.9 Å²	79.9	45%	0.448	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.3	175.5	-179.4	0	0	0	0	108.8	F63 G77 Y81 N82	F63-V79 HydrophobicContact CD1-CG2 4.03Å; F63-V79 HydrophobicContact CE1-CG2 3.6Å; F63-V79 HydrophobicContact CZ-CG2 4.15Å; G77-V79 PolarHBondContact O-N 2.79Å; V79-Y81 WeakPolarHBondContact CG1-O 3.47Å; V79-N82 HydrophobicContact CG1-CB 4.11Å
80	L	90.2	Very high	81.2	Confident	33 Å²	33	82.1 Å²	82.1	17%	0.173	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-26.7	176.6	-60.5	-173.2	0	0	0	112.7	L62 Q64 T78 V102 L127	L62-L80 HydrophobicContact CB-CB 4.39Å; L62-L80 HydrophobicContact CD2-CB 4.1Å; L62-L80 HydrophobicContact CD2-CD1 4.14Å; L62-L80 HydrophobicContact CG-CB 4.31Å; L62-L80 HydrophobicContact CG-CD1 4.5Å; L62-L80 PolarHBondContact O-N 3.31Å; Q64-L80 HydrophobicContact CB-CD1 3.85Å; Q64-L80 HydrophobicContact CB-CD2 4.28Å; Q64-L80 HydrophobicContact CB-CG 3.94Å; T78-L80 HydrophobicContact CG2-CD2 4.06Å; T78-L80 PolarHBondContact O-N 2.98Å; L80-V102 HydrophobicContact CB-CG2 4.07Å; L80-L127 HydrophobicContact CD1-CD2 3.94Å
81	Y	90.2	Very high	78.9	Confident	11 Å²	11	81 Å²	81	4%	0.043	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	145.4	178.4	-175.4	-103.9	0	0	0	110.6	L61 L62 V79 A83 V102 F104 L114	L61-Y81 CarbonylContact C-O 3.54Å; L61-Y81 VanDerWaalsContact CA-O 3.24Å; L61-Y81 WeakPolarHBondContact CA-O 3.33Å; L62-Y81 PolarHBondContact N-O 3.08Å; L62-Y81 PolarHBondContact O-N 3.25Å; V79-Y81 WeakPolarHBondContact CG1-O 3.47Å; Y81-A83 HydrophobicContact CE1-CB 3.51Å; Y81-A83 WeakPolarHBondContact OH-CB 3.25Å; Y81-V102 HydrophobicContact CD2-CB 4.27Å; Y81-V102 HydrophobicContact CD2-CG1 4.2Å; Y81-V102 HydrophobicContact CG-CB 4.47Å; Y81-V102 HydrophobicContact CG-CG1 4.08Å; Y81-F104 HydrophobicContact CE1-CB 3.73Å; Y81-F104 HydrophobicContact CE1-CG 4.41Å; Y81-F104 HydrophobicContact CE2-CB 4.4Å; Y81-F104 WeakPolarHBondContact OH-CB 3.13Å; Y81-L114 HydrophobicContact CD1-CD2 4.24Å
82	N	88.8	Confident	76.6	Confident	61 Å²	61	78.1 Å²	78.1	33%	0.326	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	123.8	174.1	-177.5	10.7	0	0	0	108.5	I60 L61 V79 L96	I60-N82 CarbonylContact O-C 3.49Å; I60-N82 WeakPolarHBondContact O-CA 3.37Å; L61-N82 HydrophobicContact CG-CB 4.21Å; V79-N82 HydrophobicContact CG1-CB 4.11Å; N82-L96 VanDerWaalsContact O-CD1 3.27Å; N82-L96 WeakPolarHBondContact O-CD1 3.4Å
83	A	83.8	Confident	74.6	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.008	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.2	172.3	0	0	0	0	0	110.2	N59 I60 Y81	N59-A83 CarbonylContact C-O 3.6Å; N59-A83 VanDerWaalsContact CA-O 3.28Å; N59-A83 WeakPolarHBondContact CA-O 3.43Å; I60-A83 PolarHBondContact N-O 3.13Å; I60-A83 PolarHBondContact O-N 3.43Å; Y81-A83 HydrophobicContact CE1-CB 3.51Å; Y81-A83 WeakPolarHBondContact OH-CB 3.25Å
84	T	83.8	Confident	72.5	Confident	36 Å²	36	74.4 Å²	74.4	22%	0.221	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148.6	-177.7	68.5	0	0	0	0	111.1	D58 N59 T86 E87 R108	D58-T84 CarbonylContact O-C 3.48Å; N59-T84 WeakPolarHBondContact OD1-CA 3.47Å; N59-T84 WeakPolarHBondContact OD1-CB 3.21Å; N59-T84 VanDerWaalsContact OD1-CG2 3.25Å; N59-T84 WeakPolarHBondContact OD1-CG2 3.47Å; T84-T86 PolarHBondContact O-N 2.69Å; T84-E87 PolarHBondContact N-OE1 2.79Å; T84-E87 WeakPolarHBondContact O-CB 3.24Å; T84-E87 PolarHBondContact O-N 3.43Å; T84-E87 PolarHBondContact OG1-OE1 2.79Å; T84-E87 VanDerWaalsContact OG1-OE1 3.05Å; T84-R108 VanDerWaalsContact C-NH2 3.25Å; T84-R108 PolarHBondContact O-NH2 2.81Å
85	K	73.7	Confident	70.2	Confident	122 Å²	122	74 Å²	74	53%	0.53	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.1	-177.5	174.7	-180	179.9	-173	0	113.1	D58 E87	D58-K85 HydrophobicContact CB-CD 4.39Å; D58-K85 VanDerWaalsContact O-CB 3.24Å; D58-K85 WeakPolarHBondContact O-CB 3.24Å; D58-K85 PolarHBondContact O-N 3.17Å; D58-K85 WeakPolarHBondContact OD1-CD 2.94Å; D58-K85 IonicContact OD1-NZ 2.8Å; D58-K85 PolarHBondContact OD1-NZ 3.05Å; K85-E87 VanDerWaalsContact C-N 3.3Å
86	T	62.2	Low	68.1	Low	122 Å²	122	75.4 Å²	75.4	75%	0.748	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-4	-178.7	-29.1	0	0	0	0	112.6	T84 K88	T84-T86 PolarHBondContact O-N 2.69Å; T86-K88 PolarHBondContact O-N 3.49Å
87	E	57.3	Low	66.1	Low	38 Å²	38	73.8 Å²	73.8	18%	0.178	39%	0.392	C	S	.	.			trans	-69.4	71.1	163.2	-69.8	165.2	-130.7	0	0	108.5	T84 K85 D89 S92 E93	T84-E87 PolarHBondContact N-OE1 2.79Å; T84-E87 WeakPolarHBondContact O-CB 3.24Å; T84-E87 PolarHBondContact O-N 3.43Å; T84-E87 PolarHBondContact OG1-OE1 2.79Å; T84-E87 VanDerWaalsContact OG1-OE1 3.05Å; K85-E87 VanDerWaalsContact C-N 3.3Å; E87-D89 PolarHBondContact O-N 3.36Å; E87-S92 WeakPolarHBondContact CB-OG 3.26Å; E87-S92 VanDerWaalsContact CG-OG 3.31Å; E87-S92 WeakPolarHBondContact CG-OG 3.36Å; E87-E93 WeakPolarHBondContact OE2-CA 3.3Å; E87-E93 PolarHBondContact OE2-N 2.84Å
88	K	44.2	Very low	64.1	Low	196 Å²	196	79.3 Å²	79.3	85%	0.852	41%	0.405	S	S	*	.			trans	-72.4	5.1	161.1	-79.8	-173.3	176.1	-178.5	0	111.7	T86 P90	T86-K88 PolarHBondContact O-N 3.49Å; K88-P90 WeakPolarHBondContact O-CD 3.23Å
89	D	47.1	Very low	62.4	Low	77 Å²	77	81.8 Å²	81.8	41%	0.412	41%	0.411	S	S	.	.			trans	-106.5	102.8	175	-171.9	2.6	0	0	0	108.4	E87 E91 S92	E87-D89 PolarHBondContact O-N 3.36Å; D89-E91 PolarHBondContact O-N 2.9Å; D89-E91 WeakPolarHBondContact OD1-CB 3.44Å; D89-E91 PolarHBondContact OD1-N 2.87Å; D89-S92 PolarHBondContact O-N 2.85Å; D89-S92 PolarHBondContact O-OG 2.93Å
90	P	53.2	Low	61.7	Low	100 Å²	100	79.7 Å²	79.7	65%	0.649	40%	0.404	S	S	*	.	H	α-helix	trans	-50.2	-26.7	171.4	-22.3	32.4	0	0	0	111.6	K88 L94	K88-P90 WeakPolarHBondContact O-CD 3.23Å; P90-L94 WeakPolarHBondContact O-CB 3.29Å; P90-L94 PolarHBondContact O-N 2.89Å
91	E	46.6	Very low	61.7	Low	138 Å²	138	80.5 Å²	80.5	65%	0.645	41%	0.405	S	S	*	.	H	α-helix	trans	-70.3	-29.7	179.7	-149.8	167.1	-151.7	0	0	112.5	D89 L94 Y95	D89-E91 PolarHBondContact O-N 2.9Å; D89-E91 WeakPolarHBondContact OD1-CB 3.44Å; D89-E91 PolarHBondContact OD1-N 2.87Å; E91-L94 CarbonylContact O-C 3.55Å; E91-Y95 WeakPolarHBondContact O-CA 3.11Å; E91-Y95 WeakPolarHBondContact O-CB 3.25Å; E91-Y95 PolarHBondContact O-N 2.99Å
92	S	48.4	Very low	61.8	Low	32 Å²	32	80.2 Å²	80.2	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-80.1	-42.4	178.8	63.9	0	0	0	0	113.9	E87 D89 L94 Y95 L96	E87-S92 WeakPolarHBondContact CB-OG 3.26Å; E87-S92 VanDerWaalsContact CG-OG 3.31Å; E87-S92 WeakPolarHBondContact CG-OG 3.36Å; D89-S92 PolarHBondContact O-N 2.85Å; D89-S92 PolarHBondContact O-OG 2.93Å; S92-L94 PolarHBondContact O-N 3Å; S92-Y95 PolarHBondContact O-N 2.8Å; S92-Y95 VanDerWaalsContact O-N 3.13Å; S92-L96 PolarHBondContact O-N 3.13Å
93	E	51.9	Low	61.9	Low	69 Å²	69	78.8 Å²	78.8	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-64.4	-34.1	170.2	-158.8	173.1	-150.1	0	0	109.7	E87 S97	E87-E93 WeakPolarHBondContact OE2-CA 3.3Å; E87-E93 PolarHBondContact OE2-N 2.84Å; E93-S97 VanDerWaalsContact O-CB 3.27Å; E93-S97 WeakPolarHBondContact O-CB 3.4Å; E93-S97 PolarHBondContact O-N 3.04Å; E93-S97 PolarHBondContact O-OG 2.96Å
94	L	49	Very low	62.2	Low	74 Å²	74	80.1 Å²	80.1	39%	0.387	40%	0.403	S	S	.	.	H	α-helix	trans	-74.4	-31.1	171.3	-168.7	65.1	0	0	0	113.1	P90 E91 S92 S97 K98	P90-L94 WeakPolarHBondContact O-CB 3.29Å; P90-L94 PolarHBondContact O-N 2.89Å; E91-L94 CarbonylContact O-C 3.55Å; S92-L94 PolarHBondContact O-N 3Å; L94-S97 VanDerWaalsContact CA-OG 3.24Å; L94-S97 WeakPolarHBondContact CA-OG 3.07Å; L94-S97 PolarHBondContact O-OG 2.73Å; L94-K98 HydrophobicContact CD1-CD 4.15Å; L94-K98 HydrophobicContact CD1-CG 4.1Å; L94-K98 HydrophobicContact CD2-CD 4.29Å; L94-K98 HydrophobicContact CG-CD 3.71Å; L94-K98 HydrophobicContact CG-CG 4.07Å; L94-K98 WeakPolarHBondContact O-CA 3.37Å; L94-K98 WeakPolarHBondContact O-CB 3.11Å; L94-K98 WeakPolarHBondContact O-CG 3.5Å; L94-K98 PolarHBondContact O-N 2.89Å
95	Y	44.7	Very low	62.6	Low	136 Å²	136	81.7 Å²	81.7	53%	0.533	41%	0.41	S	S	.	.	H	α-helix	trans	-74.7	-45	-179.8	-166.1	-97.6	0	0	0	111	E91 S92 S97 K98 Q99	E91-Y95 WeakPolarHBondContact O-CA 3.11Å; E91-Y95 WeakPolarHBondContact O-CB 3.25Å; E91-Y95 PolarHBondContact O-N 2.99Å; S92-Y95 PolarHBondContact O-N 2.8Å; S92-Y95 VanDerWaalsContact O-N 3.13Å; Y95-S97 VanDerWaalsContact C-N 3.3Å; Y95-S97 PolarHBondContact O-N 2.87Å; Y95-K98 PolarHBondContact O-N 2.03Å; Y95-Q99 VanDerWaalsContact CE1-CD 3.46Å; Y95-Q99 WeakPolarHBondContact O-CB 3.2Å; Y95-Q99 PolarHBondContact O-N 3.48Å; Y95-Q99 PolarHBondContact OH-NE2 3.48Å
96	L	51	Low	63.5	Low	79 Å²	79	76.9 Å²	76.9	41%	0.414	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-32.9	173.8	-68.9	172.5	0	0	0	112	N82 S92 G100	N82-L96 VanDerWaalsContact O-CD1 3.27Å; N82-L96 WeakPolarHBondContact O-CD1 3.4Å; S92-L96 PolarHBondContact O-N 3.13Å; L96-G100 VanDerWaalsContact O-CA 3.27Å; L96-G100 WeakPolarHBondContact O-CA 3.33Å; L96-G100 PolarHBondContact O-N 2.91Å
97	S	51.7	Low	64.9	Low	32 Å²	32	73.7 Å²	73.7	22%	0.224	37%	0.374	C	S	.	.	H	α-helix	trans	-84.4	-20.8	174.4	62	0	0	0	0	115.1	E93 L94 Y95	E93-S97 VanDerWaalsContact O-CB 3.27Å; E93-S97 WeakPolarHBondContact O-CB 3.4Å; E93-S97 PolarHBondContact O-N 3.04Å; E93-S97 PolarHBondContact O-OG 2.96Å; L94-S97 VanDerWaalsContact CA-OG 3.24Å; L94-S97 WeakPolarHBondContact CA-OG 3.07Å; L94-S97 PolarHBondContact O-OG 2.73Å; Y95-S97 VanDerWaalsContact C-N 3.3Å; Y95-S97 PolarHBondContact O-N 2.87Å
98	K	47.3	Very low	66.6	Low	154 Å²	154	74.2 Å²	74.2	67%	0.67	37%	0.374	S	S	*	.	H	α-helix	trans	-85.3	-27.2	173.6	-80.7	178.4	176.4	169.3	0	113.1	L94 Y95	L94-K98 HydrophobicContact CD1-CD 4.15Å; L94-K98 HydrophobicContact CD1-CG 4.1Å; L94-K98 HydrophobicContact CD2-CD 4.29Å; L94-K98 HydrophobicContact CG-CD 3.71Å; L94-K98 HydrophobicContact CG-CG 4.07Å; L94-K98 WeakPolarHBondContact O-CA 3.37Å; L94-K98 WeakPolarHBondContact O-CB 3.11Å; L94-K98 WeakPolarHBondContact O-CG 3.5Å; L94-K98 PolarHBondContact O-N 2.89Å; Y95-K98 PolarHBondContact O-N 2.03Å
99	Q	54.8	Low	68.9	Low	133 Å²	133	69.8 Å²	69.8	62%	0.621	36%	0.358	S	S	*	.	H	α-helix	trans	-98.3	-24.5	174.3	-72.2	179.3	-11.5	0	0	113.1	Y95	Y95-Q99 VanDerWaalsContact CE1-CD 3.46Å; Y95-Q99 WeakPolarHBondContact O-CB 3.2Å; Y95-Q99 PolarHBondContact O-N 3.48Å; Y95-Q99 PolarHBondContact OH-NE2 3.48Å
100	G	76.4	Confident	71.2	Confident	30 Å²	30	69.8 Å²	69.8	31%	0.309	36%	0.359	S	S	.	.	S	Bend	trans	-90.6	145.7	178.9	0	0	0	0	0	113.3	L96 V102	L96-G100 VanDerWaalsContact O-CA 3.27Å; L96-G100 WeakPolarHBondContact O-CA 3.33Å; L96-G100 PolarHBondContact O-N 2.91Å; G100-V102 PolarHBondContact O-N 2.82Å
101	R	89.9	Confident	73.3	Confident	50 Å²	50	67 Å²	67	19%	0.189	34%	0.338	C	S	.	.	S	Bend	trans	-71	-10.5	171.6	-61.9	179.2	-62.5	106.9	-2.2	112.4	I116 H117 P118 D123	R101-I116 HydrophobicContact CB-CG2 4.47Å; R101-I116 CarbonylContact O-C 3.41Å; R101-I116 VanDerWaalsContact O-CA 3.29Å; R101-I116 WeakPolarHBondContact O-CA 3.25Å; R101-H117 WeakPolarHBondContact CA-O 3.15Å; R101-H117 WeakPolarHBondContact CB-O 3.19Å; R101-H117 PolarHBondContact O-N 3.15Å; R101-P118 WeakPolarHBondContact CD-O 3.14Å; R101-P118 PolarHBondContact NH1-O 2.82Å; R101-D123 IonicContact CZ-OD1 3.64Å; R101-D123 IonicContact CZ-OD2 3.13Å; R101-D123 IonicContact NH1-OD1 3.6Å; R101-D123 PolarHBondContact NH1-OD1 2.68Å; R101-D123 IonicContact NH1-OD2 3.5Å; R101-D123 PolarHBondContact NH1-OD2 2.97Å; R101-D123 IonicContact NH2-OD1 2.68Å; R101-D123 PolarHBondContact NH2-OD1 3.18Å; R101-D123 IonicContact NH2-OD2 3.32Å
102	V	91.6	Very high	75.6	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.8	-175.7	-170.8	0	0	0	0	110.7	L62 L80 Y81 G100 L114 K115 I116	L62-V102 HydrophobicContact CD2-CG1 4Å; L62-V102 HydrophobicContact CD2-CG2 4.31Å; L80-V102 HydrophobicContact CB-CG2 4.07Å; Y81-V102 HydrophobicContact CD2-CB 4.27Å; Y81-V102 HydrophobicContact CD2-CG1 4.2Å; Y81-V102 HydrophobicContact CG-CB 4.47Å; Y81-V102 HydrophobicContact CG-CG1 4.08Å; G100-V102 PolarHBondContact O-N 2.82Å; V102-L114 HydrophobicContact CG1-CD2 4.01Å; V102-K115 CarbonylContact C-O 3.53Å; V102-K115 VanDerWaalsContact CA-O 3.25Å; V102-K115 WeakPolarHBondContact CA-O 3.27Å; V102-I116 HydrophobicContact CG1-CG1 4.39Å; V102-I116 HydrophobicContact CG2-CG1 4.15Å; V102-I116 HydrophobicContact CG2-CG2 4.37Å
103	T	90.9	Very high	77.9	Confident	32 Å²	32	59.3 Å²	59.3	20%	0.196	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.1	175.7	-43	0	0	0	0	110.1	L105 L114 K115	T103-L105 HydrophobicContact CG2-CD2 3.92Å; T103-L114 CarbonylContact O-C 3.59Å; T103-L114 WeakPolarHBondContact O-CA 3.49Å; T103-K115 PolarHBondContact N-O 3.17Å; T103-K115 PolarHBondContact O-N 3.44Å; T103-K115 VanDerWaalsContact OG1-CE 3.24Å; T103-K115 WeakPolarHBondContact OG1-CE 3.31Å
104	F	90.7	Very high	80	Confident	28 Å²	28	56 Å²	56	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	119.7	166.9	-175.7	-119.8	0	0	0	110.5	I60 Y81 G106 N107 N111 L114	I60-F104 HydrophobicContact CD1-CD2 4.18Å; I60-F104 HydrophobicContact CD1-CE1 3.88Å; I60-F104 HydrophobicContact CD1-CE2 3.41Å; I60-F104 VanDerWaalsContact CD1-CE2 3.41Å; I60-F104 HydrophobicContact CD1-CZ 3.23Å; Y81-F104 HydrophobicContact CE1-CB 3.73Å; Y81-F104 HydrophobicContact CE1-CG 4.41Å; Y81-F104 HydrophobicContact CE2-CB 4.4Å; Y81-F104 WeakPolarHBondContact OH-CB 3.13Å; F104-G106 VanDerWaalsContact CE1-C 3.42Å; F104-G106 VanDerWaalsContact CZ-C 3.42Å; F104-N107 VanDerWaalsContact CZ-N 3.34Å; F104-N107 WeakPolarHBondContact CZ-O 3.43Å; F104-N111 WeakPolarHBondContact CZ-O 3.47Å; F104-L114 HydrophobicContact CB-CD2 4.25Å; F104-L114 HydrophobicContact CD2-CD2 3.98Å
105	L	92.7	Very high	82.2	Confident	69 Å²	69	55.7 Å²	55.7	36%	0.361	28%	0.28	S	S	.	.			trans	-106.9	-0.7	177.7	-57.4	-176	0	0	0	112.2	R43 T103 T113 K115	R43-L105 HydrophobicContact CG-CD1 4.31Å; T103-L105 HydrophobicContact CG2-CD2 3.92Å; L105-T113 HydrophobicContact CB-CG2 4.06Å; L105-T113 HydrophobicContact CD1-CG2 4.41Å; L105-T113 PolarHBondContact N-O 3.35Å; L105-K115 HydrophobicContact CD1-CB 3.76Å; L105-K115 HydrophobicContact CG-CB 4.06Å
106	G	92.5	Very high	84.6	Confident	21 Å²	21	49.3 Å²	49.3	22%	0.216	25%	0.254	C	S	.	.	S	Bend	trans	-84.7	-155.7	-178	0	0	0	0	0	113.2	F104 N111 T113	F104-G106 VanDerWaalsContact CE1-C 3.42Å; F104-G106 VanDerWaalsContact CZ-C 3.42Å; G106-N111 CarbonylContact C-O 3.54Å; G106-N111 WeakPolarHBondContact CA-O 3.48Å; G106-N111 WeakPolarHBondContact CA-OD1 3.33Å; G106-T113 PolarHBondContact N-O 3.4Å; G106-T113 VanDerWaalsContact N-O 3.14Å
107	N	91.7	Very high	86.6	Confident	55 Å²	55	50.3 Å²	50.3	29%	0.294	26%	0.257	S	S	.	.			trans	-143.5	171.6	175.6	67.1	42.8	0	0	0	109.5	F104 I109 D110 N111	F104-N107 VanDerWaalsContact CZ-N 3.34Å; F104-N107 WeakPolarHBondContact CZ-O 3.43Å; N107-I109 PolarHBondContact O-N 2.73Å; N107-I109 WeakPolarHBondContact OD1-CA 3.46Å; N107-I109 WeakPolarHBondContact OD1-CB 3.27Å; N107-I109 PolarHBondContact OD1-N 3.32Å; N107-D110 PolarHBondContact ND2-OD1 3.08Å; N107-D110 PolarHBondContact OD1-N 3.4Å; N107-D110 PolarHBondContact OD1-OD1 3.34Å; N107-N111 PolarHBondContact N-O 3.19Å; N107-N111 PolarHBondContact OD1-N 3.33Å
108	R	92.1	Very high	88.7	Confident	49 Å²	49	51.3 Å²	51.3	19%	0.185	26%	0.263	C	S	.	.	S	Bend	trans	-88.6	18.9	179	-62.6	176.7	179.5	-92.7	-0.8	113.4	Y48 R56 L57 D58 T84	Y48-R108 PolarHBondContact OH-O 2.93Å; Y48-R108 VanDerWaalsContact OH-O 3.08Å; R56-R108 CarbonylContact C-O 3.57Å; R56-R108 WeakPolarHBondContact CA-O 3.09Å; R56-R108 HydrophobicContact CB-CB 4.41Å; R56-R108 VanDerWaalsContact CB-O 3.26Å; R56-R108 WeakPolarHBondContact CB-O 3.37Å; L57-R108 HydrophobicContact CB-CB 4.3Å; L57-R108 HydrophobicContact CB-CG 4.45Å; L57-R108 PolarHBondContact N-O 3.19Å; L57-R108 WeakPolarHBondContact O-CD 3.48Å; L57-R108 PolarHBondContact O-NH1 2.86Å; D58-R108 PolarHBondContact O-NH1 3.49Å; T84-R108 VanDerWaalsContact C-NH2 3.25Å; T84-R108 PolarHBondContact O-NH2 2.81Å
109	I	93.6	Very high	90.9	Very high	103 Å²	103	44 Å²	44	53%	0.528	23%	0.231	S	C	.	.	S	Bend	trans	-110	-57.6	-177.3	-53.1	178.4	0	0	0	110.9	Y48 N107	Y48-I109 WeakPolarHBondContact CE2-O 3.31Å; Y48-I109 VanDerWaalsContact CZ-C 3.45Å; Y48-I109 WeakPolarHBondContact OH-CA 3.31Å; Y48-I109 PolarHBondContact OH-N 2.99Å; Y48-I109 PolarHBondContact OH-O 3.18Å; N107-I109 PolarHBondContact O-N 2.73Å; N107-I109 WeakPolarHBondContact OD1-CA 3.46Å; N107-I109 WeakPolarHBondContact OD1-CB 3.27Å; N107-I109 PolarHBondContact OD1-N 3.32Å
110	D	94.8	Very high	92.8	Very high	78 Å²	78	43.7 Å²	43.7	42%	0.417	22%	0.224	S	C	.	.	S	Bend	trans	-154	-3.3	-169.1	66.3	-9.7	0	0	0	115.1	K47 Y48 N107	K47-D110 CarbonylContact C-O 3.59Å; K47-D110 VanDerWaalsContact CA-O 3.25Å; K47-D110 WeakPolarHBondContact CA-O 3.46Å; Y48-D110 VanDerWaalsContact CD1-C 3.49Å; Y48-D110 VanDerWaalsContact CE1-C 3.43Å; Y48-D110 PolarHBondContact N-O 2.75Å; Y48-D110 PolarHBondContact OH-N 3.07Å; N107-D110 PolarHBondContact ND2-OD1 3.08Å; N107-D110 PolarHBondContact OD1-N 3.4Å; N107-D110 PolarHBondContact OD1-OD1 3.34Å
111	N	96.1	Very high	93.7	Very high	40 Å²	40	44.2 Å²	44.2	21%	0.214	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-120.5	118.7	-173.2	-174.3	-21.3	0	0	0	110.4	C46 F104 G106 N107 T113	C46-N111 PolarHBondContact O-OD1 2.87Å; F104-N111 WeakPolarHBondContact CZ-O 3.47Å; G106-N111 CarbonylContact C-O 3.54Å; G106-N111 WeakPolarHBondContact CA-O 3.48Å; G106-N111 WeakPolarHBondContact CA-OD1 3.33Å; N107-N111 PolarHBondContact N-O 3.19Å; N107-N111 PolarHBondContact OD1-N 3.33Å; N111-T113 WeakPolarHBondContact OD1-CB 3.43Å; N111-T113 PolarHBondContact OD1-N 2.85Å; N111-T113 PolarHBondContact OD1-OG1 2.99Å
112	C	95.9	Very high	93.8	Very high	1 Å²	1	48 Å²	48	1%	0.007	25%	0.249	C	C	.	.			trans	-108.2	18.8	-178.8	38.9	0	0	0	0	113.2	C46 K47 Y48 L114 L129 M131	C46-C112 HydrophobicContact CB-CB 3.83Å; C46-C112 WeakPolarHBondContact CB-SG 3.29Å; C46-C112 PolarHBondContact O-N 3.32Å; C46-C112 PolarHBondContact O-SG 2.76Å; C46-C112 WeakPolarHBondContact SG-CB 3.3Å; C46-C112 CovalentContact SG-SG 2.03Å; C46-C112 PolarHBondContact SG-SG 2.84Å; K47-C112 VanDerWaalsContact C-SG 3.53Å; K47-C112 PolarHBondContact N-SG 3.22Å; Y48-C112 HydrophobicContact CD1-CB 3.78Å; Y48-C112 HydrophobicContact CE1-CB 4.39Å; C112-L114 PolarHBondContact O-N 2.95Å; C112-L129 HydrophobicContact CB-CD2 3.85Å; C112-M131 HydrophobicContact CB-SD 4.22Å
113	T	97	Very high	93.9	Very high	8 Å²	8	47.9 Å²	47.9	5%	0.049	25%	0.248	C	C	.	.			trans	-60.8	132.1	-173.1	-61.8	0	0	0	0	112.1	R43 I44 C46 L105 G106 N111	R43-T113 HydrophobicContact CG-CG2 3.82Å; I44-T113 WeakPolarHBondContact O-CA 3.19Å; I44-T113 WeakPolarHBondContact O-CG2 3.46Å; C46-T113 PolarHBondContact N-OG1 2.88Å; C46-T113 PolarHBondContact O-OG1 2.77Å; L105-T113 HydrophobicContact CB-CG2 4.06Å; L105-T113 HydrophobicContact CD1-CG2 4.41Å; L105-T113 PolarHBondContact N-O 3.35Å; G106-T113 PolarHBondContact N-O 3.4Å; G106-T113 VanDerWaalsContact N-O 3.14Å; N111-T113 WeakPolarHBondContact OD1-CB 3.43Å; N111-T113 PolarHBondContact OD1-N 2.85Å; N111-T113 PolarHBondContact OD1-OG1 2.99Å
114	L	95.2	Very high	94.1	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	157.2	177.2	-70.4	161.9	0	0	0	110.8	R43 I44 L62 Y81 V102 T103 F104 C112 L129	R43-L114 CarbonylContact C-O 3.56Å; R43-L114 WeakPolarHBondContact CA-O 3.44Å; I44-L114 HydrophobicContact CB-CB 4.36Å; I44-L114 PolarHBondContact N-O 2.8Å; I44-L114 PolarHBondContact O-N 3.49Å; I44-L114 VanDerWaalsContact O-N 3.17Å; L62-L114 HydrophobicContact CB-CD1 4.47Å; L62-L114 HydrophobicContact CD1-CD1 3.99Å; L62-L114 HydrophobicContact CD2-CD1 4.24Å; L62-L114 HydrophobicContact CG-CD1 4.47Å; Y81-L114 HydrophobicContact CD1-CD2 4.24Å; V102-L114 HydrophobicContact CG1-CD2 4.01Å; T103-L114 CarbonylContact O-C 3.59Å; T103-L114 WeakPolarHBondContact O-CA 3.49Å; F104-L114 HydrophobicContact CB-CD2 4.25Å; F104-L114 HydrophobicContact CD2-CD2 3.98Å; C112-L114 PolarHBondContact O-N 2.95Å; L114-L129 HydrophobicContact CD1-CD1 3.84Å
115	K	95.1	Very high	94.2	Very high	67 Å²	67	47.7 Å²	47.7	29%	0.291	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.6	169.6	179.1	-174.1	64	171.1	0	108.8	I42 V102 T103 L105	I42-K115 CarbonylContact O-C 3.48Å; I42-K115 VanDerWaalsContact O-CA 3.31Å; I42-K115 WeakPolarHBondContact O-CA 3.33Å; V102-K115 CarbonylContact C-O 3.53Å; V102-K115 VanDerWaalsContact CA-O 3.25Å; V102-K115 WeakPolarHBondContact CA-O 3.27Å; T103-K115 PolarHBondContact N-O 3.17Å; T103-K115 PolarHBondContact O-N 3.44Å; T103-K115 VanDerWaalsContact OG1-CE 3.24Å; T103-K115 WeakPolarHBondContact OG1-CE 3.31Å; L105-K115 HydrophobicContact CD1-CB 3.76Å; L105-K115 HydrophobicContact CG-CB 4.06Å
116	I	94.7	Very high	94.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.7	171	-48.6	-179.8	0	0	0	108.2	I42 I44 L62 R101 V102 L127	I42-I116 HydrophobicContact CG2-CB 3.85Å; I42-I116 HydrophobicContact CG2-CD1 4.46Å; I42-I116 HydrophobicContact CG2-CG1 4.25Å; I42-I116 PolarHBondContact N-O 3.14Å; I42-I116 PolarHBondContact O-N 3.4Å; I44-I116 HydrophobicContact CD1-CD1 4.1Å; L62-I116 HydrophobicContact CD2-CD1 4.27Å; R101-I116 HydrophobicContact CB-CG2 4.47Å; R101-I116 CarbonylContact O-C 3.41Å; R101-I116 VanDerWaalsContact O-CA 3.29Å; R101-I116 WeakPolarHBondContact O-CA 3.25Å; V102-I116 HydrophobicContact CG1-CG1 4.39Å; V102-I116 HydrophobicContact CG2-CG1 4.15Å; V102-I116 HydrophobicContact CG2-CG2 4.37Å; I116-L127 HydrophobicContact CD1-CD1 4.28Å
117	H	94.2	Very high	94.5	Very high	100 Å²	100	47.7 Å²	47.7	46%	0.463	25%	0.251	S	S	.	.	S	Bend	trans	-152.8	128.9	179.3	-176.5	56.9	0	0	0	112.9	A40 C41 R101	A40-H117 PolarHBondContact O-ND1 2.92Å; C41-H117 HydrophobicContact CB-CB 4.12Å; R101-H117 WeakPolarHBondContact CA-O 3.15Å; R101-H117 WeakPolarHBondContact CB-O 3.19Å; R101-H117 PolarHBondContact O-N 3.15Å
118	P	94.8	Very high	94.7	Very high	53 Å²	53	45.1 Å²	45.1	34%	0.344	24%	0.237	S	C	.	.	S	Bend	cis	-67.5	146.8	-15.8	29.8	-34.6	0	0	0	110.7	A40 R101	A40-P118 WeakPolarHBondContact O-CA 3.47Å; R101-P118 WeakPolarHBondContact CD-O 3.14Å; R101-P118 PolarHBondContact NH1-O 2.82Å
119	I	94.9	Very high	95	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.			trans	-77.9	146.7	166	-165.4	157.3	0	0	0	109.9	A36 W37 G39 A40 I42 D123 L144 V146	A36-I119 HydrophobicContact CB-CD1 3.66Å; A36-I119 HydrophobicContact CB-CG2 4.03Å; W37-I119 WeakPolarHBondContact O-CG2 3.13Å; G39-I119 PolarHBondContact N-O 2.86Å; A40-I119 HydrophobicContact CB-CG2 4.15Å; A40-I119 WeakPolarHBondContact O-CG2 3.27Å; A40-I119 PolarHBondContact O-N 3.18Å; I42-I119 HydrophobicContact CB-CD1 4.06Å; I42-I119 HydrophobicContact CG2-CD1 3.41Å; I42-I119 VanDerWaalsContact CG2-CD1 3.41Å; I119-D123 WeakPolarHBondContact CA-OD2 3.45Å; I119-D123 HydrophobicContact CG1-CB 4.07Å; I119-L144 HydrophobicContact CD1-CD1 3.94Å; I119-L144 HydrophobicContact CD1-CD2 3.67Å; I119-L144 HydrophobicContact CD1-CG 4.23Å; I119-V146 HydrophobicContact CD1-CG2 3.69Å; I119-V146 HydrophobicContact CG1-CG1 4.18Å; I119-V146 HydrophobicContact CG1-CG2 3.75Å; I119-V146 HydrophobicContact CG2-CG1 4.28Å
120	R	94.8	Very high	95.1	Very high	127 Å²	127	40.1 Å²	40.1	48%	0.479	21%	0.212	S	C	.	.			trans	-122.2	154.5	-177.3	-63.4	177.8	177.3	170.2	-2.5	110.1	N122 D123	R120-N122 PolarHBondContact O-N 3.17Å; R120-D123 PolarHBondContact N-OD2 2.97Å; R120-D123 VanDerWaalsContact O-CB 3.27Å; R120-D123 WeakPolarHBondContact O-CB 3.48Å; R120-D123 PolarHBondContact O-N 3.47Å
121	A	94.8	Very high	95.2	Very high	41 Å²	41	36.4 Å²	36.4	34%	0.339	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-54.9	-38.7	176.5	0	0	0	0	0	111.8	E38 D123 S124	E38-A121 PolarHBondContact OE1-N 3.07Å; A121-D123 PolarHBondContact O-N 3.36Å; A121-S124 VanDerWaalsContact O-CB 3.3Å; A121-S124 WeakPolarHBondContact O-CB 3.41Å; A121-S124 PolarHBondContact O-N 2.94Å; A121-S124 VanDerWaalsContact O-N 3.13Å; A121-S124 PolarHBondContact O-OG 2.95Å
122	N	92	Very high	95.1	Very high	129 Å²	129	35.3 Å²	35.3	69%	0.69	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-71.2	-4.3	176.1	-168.5	59.6	0	0	0	114.3	Q64 R120	Q64-N122 PolarHBondContact NE2-O 2.94Å; R120-N122 PolarHBondContact O-N 3.17Å
123	D	93.1	Very high	95	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.011	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-78.2	-11.9	169.4	-63	-34.3	0	0	0	111.8	Q64 R101 I119 R120 A121 L144 V146	Q64-D123 VanDerWaalsContact NE2-CA 3.34Å; Q64-D123 PolarHBondContact NE2-O 3.39Å; R101-D123 IonicContact CZ-OD1 3.64Å; R101-D123 IonicContact CZ-OD2 3.13Å; R101-D123 IonicContact NH1-OD1 3.6Å; R101-D123 PolarHBondContact NH1-OD1 2.68Å; R101-D123 IonicContact NH1-OD2 3.5Å; R101-D123 PolarHBondContact NH1-OD2 2.97Å; R101-D123 IonicContact NH2-OD1 2.68Å; R101-D123 PolarHBondContact NH2-OD1 3.18Å; R101-D123 IonicContact NH2-OD2 3.32Å; I119-D123 WeakPolarHBondContact CA-OD2 3.45Å; I119-D123 HydrophobicContact CG1-CB 4.07Å; R120-D123 PolarHBondContact N-OD2 2.97Å; R120-D123 VanDerWaalsContact O-CB 3.27Å; R120-D123 WeakPolarHBondContact O-CB 3.48Å; R120-D123 PolarHBondContact O-N 3.47Å; A121-D123 PolarHBondContact O-N 3.36Å; D123-L144 HydrophobicContact CB-CD2 4.15Å; D123-V146 HydrophobicContact CB-CG2 4.44Å
124	S	95.3	Very high	94.8	Very high	35 Å²	35	37.2 Å²	37.2	25%	0.245	21%	0.208	C	C	.	.			trans	-58.3	147.2	176.1	-58.3	0	0	0	0	112.2	A121 L144 V146	A121-S124 VanDerWaalsContact O-CB 3.3Å; A121-S124 WeakPolarHBondContact O-CB 3.41Å; A121-S124 PolarHBondContact O-N 2.94Å; A121-S124 VanDerWaalsContact O-N 3.13Å; A121-S124 PolarHBondContact O-OG 2.95Å; S124-L144 CarbonylContact C-O 3.49Å; S124-L144 VanDerWaalsContact CA-O 3.29Å; S124-L144 WeakPolarHBondContact CA-O 3.24Å; S124-V146 WeakPolarHBondContact OG-CA 2.93Å; S124-V146 VanDerWaalsContact OG-CB 3.31Å; S124-V146 WeakPolarHBondContact OG-CB 3.42Å; S124-V146 PolarHBondContact OG-N 3.32Å; S124-V146 PolarHBondContact OG-O 2.76Å
125	G	94.1	Very high	94.6	Very high	21 Å²	21	42.1 Å²	42.1	22%	0.216	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	124	-154	176.7	0	0	0	0	0	112.9	L144	G125-L144 PolarHBondContact N-O 3.44Å; G125-L144 PolarHBondContact O-N 3.19Å
126	N	94.7	Very high	94.6	Very high	90 Å²	90	42 Å²	42	48%	0.481	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	113	-179.2	-65.4	-27.5	0	0	0	109.9	N65 H143	N65-N126 PolarHBondContact N-O 3.13Å; N65-N126 VanDerWaalsContact N-O 3.13Å; N126-H143 PolarHBondContact OD1-ND1 2.84Å
127	L	95.9	Very high	94.6	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	146.9	166.7	-56.9	-179.6	0	0	0	109.5	I44 L62 F63 Q64 L80 I116 I142 L144	I44-L127 HydrophobicContact CD1-CD1 4.25Å; L62-L127 HydrophobicContact CD1-CB 4.09Å; L62-L127 HydrophobicContact CD1-CD1 4.47Å; F63-L127 CarbonylContact O-C 3.52Å; F63-L127 VanDerWaalsContact O-CA 3.25Å; F63-L127 WeakPolarHBondContact O-CA 3.45Å; Q64-L127 HydrophobicContact CB-CD2 4.06Å; Q64-L127 HydrophobicContact CG-CD2 4.2Å; L80-L127 HydrophobicContact CD1-CD2 3.94Å; I116-L127 HydrophobicContact CD1-CD1 4.28Å; L127-I142 HydrophobicContact CB-CB 4.22Å; L127-I142 PolarHBondContact N-O 3.24Å; L127-I142 PolarHBondContact O-N 3Å; L127-L144 HydrophobicContact CD1-CB 4.19Å; L127-L144 HydrophobicContact CD1-CD2 3.86Å; L127-L144 HydrophobicContact CG-CB 4.43Å
128	G	96.7	Very high	94.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	109.3	176.5	0	0	0	0	0	110.6	F63 R130	F63-G128 PolarHBondContact N-O 3.13Å; F63-G128 PolarHBondContact O-N 3.13Å; G128-R130 PolarHBondContact O-N 2.72Å
129	L	96.8	Very high	94.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	101	173	179.9	66.2	0	0	0	109.4	I60 C112 L114 M131 E140 I142	I60-L129 HydrophobicContact CG2-CD1 3.72Å; C112-L129 HydrophobicContact CB-CD2 3.85Å; L114-L129 HydrophobicContact CD1-CD1 3.84Å; L129-M131 HydrophobicContact CD2-CE 4.18Å; L129-M131 HydrophobicContact CD2-SD 4.12Å; L129-M131 HydrophobicContact CG-CE 4.45Å; L129-M131 HydrophobicContact CG-CG 4.18Å; L129-M131 HydrophobicContact CG-SD 4.4Å; L129-E140 HydrophobicContact CB-CB 4.25Å; L129-E140 PolarHBondContact N-O 3.43Å; L129-E140 PolarHBondContact O-N 3Å; L129-I142 HydrophobicContact CB-CD1 4.07Å
130	R	96.9	Very high	94.9	Very high	47 Å²	47	48.8 Å²	48.8	18%	0.177	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.9	-179.9	178	51.4	160.8	-174.4	-1.6	110.2	I60 L61 F63 G128 W138 M139	I60-R130 WeakPolarHBondContact CA-O 3.4Å; L61-R130 HydrophobicContact CB-CB 4.14Å; L61-R130 PolarHBondContact N-O 3.04Å; L61-R130 PolarHBondContact O-N 2.95Å; F63-R130 HydrophobicContact CD2-CB 4.03Å; F63-R130 HydrophobicContact CE2-CB 3.84Å; F63-R130 HydrophobicContact CE2-CG 4.19Å; G128-R130 PolarHBondContact O-N 2.72Å; R130-W138 WeakPolarHBondContact CA-O 3.31Å; R130-W138 WeakPolarHBondContact CD-O 3.24Å; R130-W138 PolarHBondContact NH1-O 2.8Å; R130-W138 VanDerWaalsContact NH1-O 3.07Å; R130-M139 HydrophobicContact CB-CE 3.82Å; R130-M139 HydrophobicContact CB-SD 3.99Å; R130-M139 HydrophobicContact CG-CE 4.27Å
131	M	96	Very high	95	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.1	-179.2	-70.9	179.8	-69.8	0	0	111	W26 V28 Y48 L57 C112 L129 R137 W138 E140	W26-M131 HydrophobicContact CE3-CE 4.41Å; W26-M131 HydrophobicContact CH2-CB 4.02Å; W26-M131 HydrophobicContact CZ3-CB 3.91Å; W26-M131 HydrophobicContact CZ3-CE 4.33Å; W26-M131 HydrophobicContact CZ3-SD 4.37Å; V28-M131 HydrophobicContact CG1-CE 4.16Å; V28-M131 HydrophobicContact CG2-CE 3.58Å; Y48-M131 HydrophobicContact CD1-SD 4.27Å; Y48-M131 HydrophobicContact CG-SD 4.11Å; L57-M131 HydrophobicContact CD1-CG 4.17Å; L57-M131 HydrophobicContact CD1-SD 4.04Å; L57-M131 HydrophobicContact CD2-CB 3.77Å; L57-M131 HydrophobicContact CD2-CG 4.26Å; C112-M131 HydrophobicContact CB-SD 4.22Å; L129-M131 HydrophobicContact CD2-CE 4.18Å; L129-M131 HydrophobicContact CD2-SD 4.12Å; L129-M131 HydrophobicContact CG-CE 4.45Å; L129-M131 HydrophobicContact CG-CG 4.18Å; L129-M131 HydrophobicContact CG-SD 4.4Å; M131-R137 WeakPolarHBondContact O-CA 3.47Å; M131-W138 PolarHBondContact N-O 3.46Å; M131-W138 PolarHBondContact O-N 2.81Å; M131-E140 HydrophobicContact CE-CB 4.44Å
132	T	95.1	Very high	95	Very high	17 Å²	17	44 Å²	44	10%	0.104	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	135.6	174.8	67.2	0	0	0	0	111.6	D58 N59 E136 R137	D58-T132 PolarHBondContact N-O 3.01Å; N59-T132 VanDerWaalsContact CB-OG1 3.31Å; N59-T132 WeakPolarHBondContact CB-OG1 3.25Å; N59-T132 PolarHBondContact N-O 2.8Å; N59-T132 PolarHBondContact N-OG1 2.89Å; N59-T132 PolarHBondContact ND2-OG1 2.89Å; N59-T132 PolarHBondContact O-N 2.92Å; T132-E136 WeakPolarHBondContact CA-O 3.03Å; T132-R137 HydrophobicContact CG2-CB 4.21Å; T132-R137 HydrophobicContact CG2-CG 3.89Å
133	A	93.9	Very high	95.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	108.9	173.6	0	0	0	0	0	109.8	W26 T50 L52 A55 L57 T135 E136	W26-A133 HydrophobicContact CH2-CB 4.17Å; W26-A133 HydrophobicContact CZ2-CB 4.39Å; T50-A133 HydrophobicContact CG2-CB 4.07Å; L52-A133 WeakPolarHBondContact CD1-O 3.29Å; A55-A133 HydrophobicContact CB-CB 4.26Å; L57-A133 HydrophobicContact CD2-CB 4.3Å; A133-T135 PolarHBondContact O-N 2.68Å; A133-E136 PolarHBondContact N-O 2.77Å; A133-E136 WeakPolarHBondContact O-CB 3.27Å; A133-E136 PolarHBondContact O-N 3.29Å
134	G	91.6	Very high	95.4	Very high	49 Å²	49	41.4 Å²	41.4	51%	0.505	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	-119.8	-173.6	0	0	0	0	0	111.7	D58	D58-G134 PolarHBondContact OD2-N 3.34Å
135	T	91.5	Very high	95.5	Very high	104 Å²	104	42.8 Å²	42.8	64%	0.638	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-18.3	176.2	51	0	0	0	0	113.1	A133 R137	A133-T135 PolarHBondContact O-N 2.68Å; T135-R137 PolarHBondContact O-NH1 2.69Å
136	E	94.3	Very high	95.7	Very high	64 Å²	64	42.3 Å²	42.3	30%	0.299	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139.1	-174.7	-67	-55.2	133.3	0	0	112.2	W26 P51 L52 T132 A133	W26-E136 HydrophobicContact CZ2-CB 3.74Å; P51-E136 HydrophobicContact CB-CG 4Å; P51-E136 HydrophobicContact CG-CG 4.11Å; L52-E136 HydrophobicContact CD1-CB 4.34Å; L52-E136 HydrophobicContact CD1-CG 3.78Å; L52-E136 HydrophobicContact CD2-CG 4.25Å; L52-E136 HydrophobicContact CG-CG 3.64Å; T132-E136 WeakPolarHBondContact CA-O 3.03Å; A133-E136 PolarHBondContact N-O 2.77Å; A133-E136 WeakPolarHBondContact O-CB 3.27Å; A133-E136 PolarHBondContact O-N 3.29Å
137	R	94.6	Very high	95.6	Very high	148 Å²	148	43.3 Å²	43.3	56%	0.558	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	133.6	-179.7	-49.1	-177.8	176	83.5	-3.4	110.5	M131 T132 T135	M131-R137 WeakPolarHBondContact O-CA 3.47Å; T132-R137 HydrophobicContact CG2-CB 4.21Å; T132-R137 HydrophobicContact CG2-CG 3.89Å; T135-R137 PolarHBondContact O-NH1 2.69Å
138	W	96.2	Very high	95.6	Very high	97 Å²	97	45.5 Å²	45.5	37%	0.367	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	149.5	-178.5	-171.4	-107.9	0	0	0	111.9	W26 R130 M131 E140	W26-W138 HydrophobicContact CB-CB 4.21Å; W26-W138 HydrophobicContact CB-CD2 3.57Å; W26-W138 HydrophobicContact CB-CE3 3.79Å; W26-W138 HydrophobicContact CB-CG 3.76Å; W26-W138 HydrophobicContact CB-CZ3 4.39Å; W26-W138 AromaticContact CD1-CE3 3.79Å; W26-W138 HydrophobicContact CD2-CB 3.39Å; W26-W138 AromaticContact CD2-CG 3.9Å; W26-W138 HydrophobicContact CD2-CG 3.9Å; W26-W138 HydrophobicContact CE3-CB 3.8Å; W26-W138 HydrophobicContact CE3-CG 4.25Å; W26-W138 HydrophobicContact CG-CB 3.56Å; W26-W138 AromaticContact CG-CD2 3.8Å; W26-W138 HydrophobicContact CG-CD2 3.8Å; W26-W138 AromaticContact CG-CE3 3.91Å; W26-W138 HydrophobicContact CG-CE3 3.91Å; W26-W138 AromaticContact CG-CG 3.67Å; W26-W138 HydrophobicContact CG-CG 3.67Å; W26-W138 HydrophobicContact CZ2-CB 4.21Å; W26-W138 HydrophobicContact CZ3-CB 4.34Å; R130-W138 WeakPolarHBondContact CA-O 3.31Å; R130-W138 WeakPolarHBondContact CD-O 3.24Å; R130-W138 PolarHBondContact NH1-O 2.8Å; R130-W138 VanDerWaalsContact NH1-O 3.07Å; M131-W138 PolarHBondContact N-O 3.46Å; M131-W138 PolarHBondContact O-N 2.81Å; W138-E140 PolarHBondContact NE1-OE2 2.93Å
139	M	96.7	Very high	95.5	Very high	22 Å²	22	47.8 Å²	47.8	11%	0.108	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	105	173.8	177.5	64.2	85.5	0	0	107.3	F63 Y66 F75 R130	F63-M139 HydrophobicContact CD2-CE 3.97Å; F63-M139 HydrophobicContact CE2-CE 4.3Å; Y66-M139 HydrophobicContact CD2-CE 3.95Å; Y66-M139 HydrophobicContact CD2-CG 4.28Å; Y66-M139 HydrophobicContact CD2-SD 4.3Å; Y66-M139 HydrophobicContact CE2-CE 4.28Å; Y66-M139 HydrophobicContact CE2-CG 3.66Å; Y66-M139 HydrophobicContact CE2-SD 4.15Å; Y66-M139 HydrophobicContact CG-CE 4.3Å; F75-M139 HydrophobicContact CB-CE 3.85Å; F75-M139 HydrophobicContact CD1-CE 3.56Å; F75-M139 HydrophobicContact CD2-CE 3.51Å; F75-M139 HydrophobicContact CE1-CB 4.4Å; F75-M139 HydrophobicContact CE1-CE 3.87Å; F75-M139 HydrophobicContact CE1-CG 4.07Å; F75-M139 HydrophobicContact CE2-CB 3.95Å; F75-M139 HydrophobicContact CE2-CE 3.85Å; F75-M139 HydrophobicContact CE2-CG 4.36Å; F75-M139 HydrophobicContact CG-CE 3.34Å; F75-M139 HydrophobicContact CZ-CB 3.72Å; F75-M139 HydrophobicContact CZ-CE 4.01Å; F75-M139 HydrophobicContact CZ-CG 3.9Å; R130-M139 HydrophobicContact CB-CE 3.82Å; R130-M139 HydrophobicContact CB-SD 3.99Å; R130-M139 HydrophobicContact CG-CE 4.27Å
140	E	97.1	Very high	95.5	Very high	30 Å²	30	50.4 Å²	50.4	14%	0.14	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.3	178.7	-171.8	64.6	-141.8	0	0	110.3	V28 H30 L129 M131 W138	V28-E140 HydrophobicContact CB-CB 4.46Å; V28-E140 HydrophobicContact CB-CG 3.88Å; V28-E140 WeakPolarHBondContact CB-OE2 3.25Å; V28-E140 HydrophobicContact CG1-CB 4.4Å; V28-E140 HydrophobicContact CG1-CG 3.88Å; V28-E140 HydrophobicContact CG2-CB 4.26Å; V28-E140 HydrophobicContact CG2-CG 4.18Å; V28-E140 VanDerWaalsContact CG2-OE2 3.3Å; V28-E140 WeakPolarHBondContact CG2-OE2 3.09Å; H30-E140 WeakPolarHBondContact NE2-CG 3.41Å; H30-E140 IonicContact NE2-OE1 2.76Å; H30-E140 PolarHBondContact NE2-OE1 3Å; H30-E140 VanDerWaalsContact NE2-OE1 3.13Å; L129-E140 HydrophobicContact CB-CB 4.25Å; L129-E140 PolarHBondContact N-O 3.43Å; L129-E140 PolarHBondContact O-N 3Å; M131-E140 HydrophobicContact CE-CB 4.44Å; W138-E140 PolarHBondContact NE1-OE2 2.93Å
141	P	96.9	Very high	95.4	Very high	65 Å²	65	50.6 Å²	50.6	42%	0.422	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.9	175.5	30.3	-33.1	0	0	0	111.6	H30	H30-P141 PolarHBondContact CE1-O 2.88Å; H30-P141 VanDerWaalsContact CE1-O 3.25Å
142	I	96.6	Very high	95.3	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.7	174.5	-53.4	172.5	0	0	0	108.2	L34 I44 L127 L129	L34-I142 HydrophobicContact CD1-CG2 3.87Å; I44-I142 HydrophobicContact CG2-CD1 4.07Å; I44-I142 HydrophobicContact CG2-CG2 4.47Å; L127-I142 HydrophobicContact CB-CB 4.22Å; L127-I142 PolarHBondContact N-O 3.24Å; L127-I142 PolarHBondContact O-N 3Å; L129-I142 HydrophobicContact CB-CD1 4.07Å
143	H	96.9	Very high	95.3	Very high	77 Å²	77	56.3 Å²	56.3	36%	0.356	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.7	176.8	-165.2	64.4	0	0	0	110.6	Q32 T33 L34 N126	Q32-H143 WeakPolarHBondContact O-CB 3.04Å; Q32-H143 PolarHBondContact O-N 2.79Å; T33-H143 CarbonylContact C-O 3.52Å; T33-H143 WeakPolarHBondContact CA-O 3.09Å; T33-H143 HydrophobicContact CG2-CB 4.44Å; L34-H143 PolarHBondContact N-O 2.81Å; N126-H143 PolarHBondContact OD1-ND1 2.84Å
144	L	96.6	Very high	95.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.8	-179.9	179	62	0	0	0	109.6	L34 I42 I119 D123 S124 G125 L127 V146	L34-L144 HydrophobicContact CB-CD1 3.89Å; I42-L144 HydrophobicContact CD1-CD1 3.65Å; I119-L144 HydrophobicContact CD1-CD1 3.94Å; I119-L144 HydrophobicContact CD1-CD2 3.67Å; I119-L144 HydrophobicContact CD1-CG 4.23Å; D123-L144 HydrophobicContact CB-CD2 4.15Å; S124-L144 CarbonylContact C-O 3.49Å; S124-L144 VanDerWaalsContact CA-O 3.29Å; S124-L144 WeakPolarHBondContact CA-O 3.24Å; G125-L144 PolarHBondContact N-O 3.44Å; G125-L144 PolarHBondContact O-N 3.19Å; L127-L144 HydrophobicContact CD1-CB 4.19Å; L127-L144 HydrophobicContact CD1-CD2 3.86Å; L127-L144 HydrophobicContact CG-CB 4.43Å; L144-V146 HydrophobicContact CD1-CG2 4.34Å; L144-V146 HydrophobicContact CD2-CG2 4.21Å; L144-V146 HydrophobicContact CG-CG2 3.93Å
145	N	97.4	Very high	95.7	Very high	64 Å²	64	61.2 Å²	61.2	34%	0.342	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.2	173.1	-169.9	10.7	0	0	0	109.8	L34 F35 A36	L34-N145 PolarHBondContact O-N 3.3Å; F35-N145 CarbonylContact C-O 3.55Å; F35-N145 VanDerWaalsContact CA-O 3.29Å; F35-N145 WeakPolarHBondContact CA-O 3.04Å; F35-N145 HydrophobicContact CD1-CB 3.75Å; F35-N145 HydrophobicContact CE1-CB 3.93Å; A36-N145 PolarHBondContact N-O 3.05Å
146	V	97	Very high	96.1	Very high	11 Å²	11	57.6 Å²	57.6	7%	0.067	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.9	-177.1	-167.7	0	0	0	0	109.1	A36 E38 I119 D123 S124 L144	A36-V146 VanDerWaalsContact O-CA 3.3Å; A36-V146 WeakPolarHBondContact O-CA 3.45Å; E38-V146 HydrophobicContact CB-CG1 4.35Å; I119-V146 HydrophobicContact CD1-CG2 3.69Å; I119-V146 HydrophobicContact CG1-CG1 4.18Å; I119-V146 HydrophobicContact CG1-CG2 3.75Å; I119-V146 HydrophobicContact CG2-CG1 4.28Å; D123-V146 HydrophobicContact CB-CG2 4.44Å; S124-V146 WeakPolarHBondContact OG-CA 2.93Å; S124-V146 VanDerWaalsContact OG-CB 3.31Å; S124-V146 WeakPolarHBondContact OG-CB 3.42Å; S124-V146 PolarHBondContact OG-N 3.32Å; S124-V146 PolarHBondContact OG-O 2.76Å; L144-V146 HydrophobicContact CD1-CG2 4.34Å; L144-V146 HydrophobicContact CD2-CG2 4.21Å; L144-V146 HydrophobicContact CG-CG2 3.93Å
147	S	92.9	Very high	96.3	Very high	112 Å²	112	57 Å²	57	78%	0.783	29%	0.286	S	S	*	.			trans	-110	0	179.9	-59.6	0	0	0	0	113.1	A36 W37 E38	A36-S147 PolarHBondContact O-N 3.36Å; W37-S147 CarbonylContact C-O 3.55Å; W37-S147 VanDerWaalsContact CA-O 3.25Å; W37-S147 WeakPolarHBondContact CA-O 3.42Å; E38-S147 PolarHBondContact N-O 2.84Å

Retrieved 147 of 147 residues in 67.9 ms (Link to these results)

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