A0AA82N848_SCHMA Loading...

Delta-like protein AlphaSync

Putative Notch ligand involved in the mediation of Notch signaling.

AlphaFold DB , UniProt , Accession A0AA82N848, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 200 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	34.9	Very low	33.2	Very low	236 Å²	236	153.5 Å²	153.5	100%	1.163	81%	0.813	S	S	*	*				0	139.8	0	-76.9	170.1	171.2	0	0	108.3
2	T	33	Very low	33.5	Very low	139 Å²	139	154.7 Å²	154.7	85%	0.853	81%	0.806	S	S	*	*			trans	61	92.2	172.2	52.5	0	0	0	0	117.3
3	S	30.8	Very low	33.5	Very low	102 Å²	102	155.2 Å²	155.2	71%	0.713	81%	0.809	S	S	*	*				76.9	96.4	77.5	-168.9	0	0	0	0	113.4
4	G	34.3	Very low	33.8	Very low	81 Å²	81	152.6 Å²	152.6	84%	0.835	79%	0.794	S	S	*	*			trans	-116.2	102.3	159.4	0	0	0	0	0	108.3	N6	G4-N6 PolarHBondContact O-N 2.87Å
5	R	35.1	Very low	34.9	Very low	206 Å²	206	147.6 Å²	147.6	78%	0.777	78%	0.775	S	S	*	*			trans	-75.8	114.2	176.3	-71.2	-175.1	-134.5	-171.6	4.1	109.1	F7	R5-F7 HydrophobicContact CB-CD2 4.14Å; R5-F7 HydrophobicContact CB-CE2 4.42Å; R5-F7 PolarHBondContact O-N 2.86Å
6	N	30.9	Very low	36.6	Very low	174 Å²	174	143.2 Å²	143.2	93%	0.93	75%	0.746	S	S	*	*			trans	-60.6	114.9	162.4	-97.1	-23	0	0	0	109.2	G4	G4-N6 PolarHBondContact O-N 2.87Å
7	F	30.5	Very low	38.6	Very low	156 Å²	156	144.3 Å²	144.3	68%	0.684	75%	0.746	S	S	*	*			trans	-117.2	132	173.3	-107.9	-88.5	0	0	0	108.1	R5	R5-F7 HydrophobicContact CB-CD2 4.14Å; R5-F7 HydrophobicContact CB-CE2 4.42Å; R5-F7 PolarHBondContact O-N 2.86Å
8	R	30.7	Very low	40.7	Very low	219 Å²	219	138.6 Å²	138.6	83%	0.826	72%	0.719	S	S	*	*			trans	85.5	86.2	159.8	-55	170.3	-168.6	-119.8	2.7	116.5
9	D	32.7	Very low	43.2	Very low	119 Å²	119	134.5 Å²	134.5	64%	0.636	71%	0.708	S	S	*	*			trans	-119	83.2	143.7	-154.4	-4.4	0	0	0	106.9
10	C	35.8	Very low	45.4	Very low	107 Å²	107	130 Å²	130	72%	0.723	69%	0.686	S	S	*	*			trans	-110.6	10.6	170.5	-77.7	0	0	0	0	111.4
11	D	36.4	Very low	47.6	Very low	150 Å²	150	128 Å²	128	80%	0.802	67%	0.674	S	S	*	*			trans	-100.4	16.6	-167.8	-72.9	-30	0	0	0	114.1
12	K	37	Very low	50.3	Low	167 Å²	167	119 Å²	119	73%	0.726	63%	0.631	S	S	*	*	S	Bend	trans	-119	1.8	-171.7	-73.5	-171.9	179.3	170.6	0	118.3
13	L	33.1	Very low	53.2	Low	162 Å²	162	116.4 Å²	116.4	85%	0.848	61%	0.609	S	S	*	*	S	Bend	trans	-152.8	68.5	178.1	-85.4	162.3	0	0	0	112.2
14	I	38.2	Very low	56.2	Low	118 Å²	118	112.7 Å²	112.7	61%	0.605	59%	0.585	S	S	*	*			trans	-138.8	80.2	161.9	-44.2	173.9	0	0	0	109.3	Q17	I14-Q17 HydrophobicContact CG2-CB 4.22Å; I14-Q17 HydrophobicContact CG2-CG 4.11Å
15	P	50.2	Low	59	Low	78 Å²	78	113 Å²	113	51%	0.506	56%	0.561	S	S	.	*			trans	-77.1	136.4	162.9	36.8	-30.2	0	0	0	106.8
16	Y	61.5	Low	61.8	Low	77 Å²	77	107.1 Å²	107.1	30%	0.302	55%	0.546	S	S	.	.			trans	93.7	4.8	158.3	-39.8	-65.1	0	0	0	121.4	T18 L44 N88 D89	Y16-T18 PolarHBondContact O-N 2.82Å; Y16-L44 HydrophobicContact CD2-CD1 4.47Å; Y16-L44 HydrophobicContact CG-CD1 4.15Å; Y16-N88 VanDerWaalsContact CE1-C 3.47Å; Y16-N88 HydrophobicContact CE1-CB 3.96Å; Y16-N88 WeakPolarHBondContact CE1-O 3.23Å; Y16-D89 HydrophobicContact CE1-CB 3.65Å
17	Q	70.7	Confident	64.9	Low	162 Å²	162	104.8 Å²	104.8	76%	0.757	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	109.8	169.2	-75.5	-170.4	-3.6	0	0	110.9	I14	I14-Q17 HydrophobicContact CG2-CB 4.22Å; I14-Q17 HydrophobicContact CG2-CG 4.11Å
18	T	77	Confident	67.9	Low	41 Å²	41	101.2 Å²	101.2	25%	0.252	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	145.1	174.2	61.2	0	0	0	0	110.3	Y16 R42 G43 L45 L79	Y16-T18 PolarHBondContact O-N 2.82Å; T18-R42 WeakPolarHBondContact O-CA 3.48Å; T18-G43 PolarHBondContact N-O 3.25Å; T18-G43 PolarHBondContact O-N 3.14Å; T18-G43 PolarHBondContact OG1-O 2.83Å; T18-L45 HydrophobicContact CG2-CB 4.45Å; T18-L45 WeakPolarHBondContact OG1-CD1 3.46Å; T18-L45 WeakPolarHBondContact OG1-CG 3.49Å; T18-L79 HydrophobicContact CG2-CD1 4.45Å
19	A	87.5	Confident	70.9	Confident	62 Å²	62	94.3 Å²	94.3	51%	0.512	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.5	171	0	0	0	0	0	108.7	H41 R42	A19-H41 CarbonylContact C-O 3.55Å; A19-H41 WeakPolarHBondContact CA-O 3.46Å; A19-R42 HydrophobicContact CB-CG 4.19Å
20	V	87.4	Confident	73.7	Confident	43 Å²	43	100.7 Å²	100.7	26%	0.261	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	124	173.1	-179.6	0	0	0	0	107.9	I40 H41 I75 I77	V20-I40 WeakPolarHBondContact O-CA 3.43Å; V20-H41 PolarHBondContact N-O 3.49Å; V20-H41 PolarHBondContact O-N 3.37Å; V20-I75 HydrophobicContact CG1-CD1 4.37Å; V20-I77 HydrophobicContact CB-CD1 4.38Å; V20-I77 HydrophobicContact CG1-CD1 4.26Å; V20-I77 HydrophobicContact CG2-CD1 3.97Å
21	I	91.7	Very high	76.4	Confident	88 Å²	88	103 Å²	103	45%	0.451	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.4	177.5	-58.9	166.3	0	0	0	107.3	E23 R38 I40	I21-E23 HydrophobicContact CG2-CG 4.1Å; I21-R38 HydrophobicContact CG2-CG 4.17Å; I21-I40 HydrophobicContact CG1-CG1 4.34Å; I21-I40 HydrophobicContact CG1-CG2 4.39Å
22	L	92	Very high	79.1	Confident	47 Å²	47	100.4 Å²	100.4	25%	0.246	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.3	176.2	-174.7	118.3	0	0	0	108.8	R38 A39 Y73 I75	L22-R38 WeakPolarHBondContact O-CA 3.17Å; L22-A39 HydrophobicContact CB-CB 4.22Å; L22-A39 HydrophobicContact CD2-CB 4.27Å; L22-A39 PolarHBondContact N-O 3.39Å; L22-A39 PolarHBondContact O-N 3.01Å; L22-Y73 HydrophobicContact CD2-CD1 3.37Å; L22-Y73 HydrophobicContact CD2-CD2 3.81Å; L22-Y73 HydrophobicContact CD2-CE1 3.7Å; L22-Y73 HydrophobicContact CD2-CE2 4.09Å; L22-Y73 HydrophobicContact CD2-CG 3.43Å; L22-Y73 VanDerWaalsContact CD2-CG 3.43Å; L22-I75 HydrophobicContact CD1-CG2 3.95Å
23	E	94.2	Very high	82	Confident	85 Å²	85	98.3 Å²	98.3	40%	0.397	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.8	-179.6	-68.9	177.8	162.4	0	0	109.6	I21 Y25 L35 R38	I21-E23 HydrophobicContact CG2-CG 4.1Å; E23-Y25 HydrophobicContact CB-CD2 4.21Å; E23-Y25 HydrophobicContact CB-CE2 3.55Å; E23-Y25 PolarHBondContact OE2-OH 3.3Å; E23-L35 HydrophobicContact CB-CD1 3.96Å; E23-L35 HydrophobicContact CG-CD1 4.24Å; E23-R38 HydrophobicContact CG-CB 4.42Å; E23-R38 HydrophobicContact CG-CG 3.97Å; E23-R38 IonicContact OE1-NE 3.13Å; E23-R38 PolarHBondContact OE1-NE 2.86Å
24	A	93.1	Very high	84.9	Confident	25 Å²	25	97.1 Å²	97.1	21%	0.207	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124.6	175.8	0	0	0	0	0	109.2	I36 D37 Y73	A24-I36 PolarHBondContact O-N 3.07Å; A24-D37 PolarHBondContact N-O 2.8Å; A24-D37 PolarHBondContact O-N 2.97Å; A24-Y73 HydrophobicContact CB-CE1 4.31Å; A24-Y73 WeakPolarHBondContact CB-OH 3.28Å
25	Y	94.3	Very high	87.6	Confident	86 Å²	86	95.8 Å²	95.8	34%	0.337	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.7	-178.3	-70.5	-86.4	0	0	0	111.5	E23 K33 Y34 L35	E23-Y25 HydrophobicContact CB-CD2 4.21Å; E23-Y25 HydrophobicContact CB-CE2 3.55Å; E23-Y25 PolarHBondContact OE2-OH 3.3Å; Y25-K33 HydrophobicContact CD1-CB 4.28Å; Y25-K33 HydrophobicContact CD1-CD 3.75Å; Y25-K33 HydrophobicContact CD1-CG 3.96Å; Y25-K33 HydrophobicContact CE1-CD 4.07Å; Y25-K33 HydrophobicContact CE1-CG 4.39Å; Y25-K33 HydrophobicContact CG-CD 4.06Å; Y25-Y34 CarbonylContact C-O 3.44Å; Y25-Y34 VanDerWaalsContact CA-O 3.28Å; Y25-Y34 WeakPolarHBondContact CA-O 3.4Å; Y25-L35 HydrophobicContact CD1-CB 4.22Å; Y25-L35 HydrophobicContact CD1-CD1 4.24Å; Y25-L35 HydrophobicContact CE1-CB 3.96Å; Y25-L35 HydrophobicContact CE1-CD1 3.84Å; Y25-L35 HydrophobicContact CE2-CD1 4.28Å
26	D	94.1	Very high	89.7	Confident	84 Å²	84	96.8 Å²	96.8	45%	0.449	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	131.8	161.6	-171.1	15.3	0	0	0	109.1	K33 Y34 I36	D26-K33 CarbonylContact O-C 3.49Å; D26-K33 WeakPolarHBondContact O-CA 3.49Å; D26-Y34 PolarHBondContact N-O 2.84Å; D26-Y34 PolarHBondContact O-N 3.41Å; D26-I36 HydrophobicContact CB-CD1 3.83Å; D26-I36 HydrophobicContact CB-CG1 3.86Å
27	L	95	Very high	91.3	Very high	124 Å²	124	93.8 Å²	93.8	65%	0.649	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	108.5	-178.3	-60.6	-178.5	0	0	0	109.4	K33	L27-K33 HydrophobicContact CD2-CB 3.59Å; L27-K33 HydrophobicContact CD2-CD 4.45Å
28	V	94.4	Very high	92.4	Very high	82 Å²	82	92 Å²	92	50%	0.497	45%	0.451	S	S	.	.	S	Bend	trans	-85.1	-40	-179.9	176.6	0	0	0	0	111.3	E32 Y34	V28-E32 HydrophobicContact CB-CB 4.4Å; V28-E32 PolarHBondContact N-O 3.16Å; V28-Y34 HydrophobicContact CB-CE2 4.28Å; V28-Y34 HydrophobicContact CG2-CD2 3.62Å; V28-Y34 HydrophobicContact CG2-CE2 3.5Å; V28-Y34 VanDerWaalsContact CG2-CE2 3.5Å
29	N	92.6	Very high	93.2	Very high	74 Å²	74	90 Å²	90	40%	0.396	44%	0.44	S	S	.	.	S	Bend	trans	-151.9	-174.3	169.5	60	57.4	0	0	0	109.5	N31 E32	N29-N31 PolarHBondContact O-N 2.51Å; N29-N31 VanDerWaalsContact O-N 3.14Å; N29-N31 WeakPolarHBondContact OD1-CA 3.4Å; N29-N31 PolarHBondContact OD1-N 2.83Å; N29-E32 PolarHBondContact N-O 2.96Å; N29-E32 PolarHBondContact ND2-OE2 3.4Å; N29-E32 PolarHBondContact O-N 3.42Å; N29-E32 WeakPolarHBondContact OD1-CB 3.38Å; N29-E32 PolarHBondContact OD1-N 2.94Å
30	R	90.7	Very high	93.3	Very high	252 Å²	252	90.3 Å²	90.3	95%	0.951	43%	0.432	S	S	*	.	S	Bend	trans	-61.6	-22	-178.3	-69.6	-175.4	-179.3	177.1	0.8	114
31	N	93.4	Very high	93.4	Very high	156 Å²	156	90.4 Å²	90.4	83%	0.834	43%	0.429	S	S	*	.	S	Bend	trans	-111.3	-18.1	-174.2	-60.9	-22.3	0	0	0	112.9	N29	N29-N31 PolarHBondContact O-N 2.51Å; N29-N31 VanDerWaalsContact O-N 3.14Å; N29-N31 WeakPolarHBondContact OD1-CA 3.4Å; N29-N31 PolarHBondContact OD1-N 2.83Å
32	E	94.1	Very high	93.3	Very high	96 Å²	96	95.4 Å²	95.4	45%	0.449	44%	0.442	S	S	.	.			trans	-117	123.1	-175.2	-66.5	177.9	167.1	0	0	111.2	V28 N29	V28-E32 HydrophobicContact CB-CB 4.4Å; V28-E32 PolarHBondContact N-O 3.16Å; N29-E32 PolarHBondContact N-O 2.96Å; N29-E32 PolarHBondContact ND2-OE2 3.4Å; N29-E32 PolarHBondContact O-N 3.42Å; N29-E32 WeakPolarHBondContact OD1-CB 3.38Å; N29-E32 PolarHBondContact OD1-N 2.94Å
33	K	96.1	Very high	92.9	Very high	122 Å²	122	94.1 Å²	94.1	53%	0.53	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143.4	174.9	65.6	177.5	-176.1	167.3	0	111.1	Y25 D26 L27	Y25-K33 HydrophobicContact CD1-CB 4.28Å; Y25-K33 HydrophobicContact CD1-CD 3.75Å; Y25-K33 HydrophobicContact CD1-CG 3.96Å; Y25-K33 HydrophobicContact CE1-CD 4.07Å; Y25-K33 HydrophobicContact CE1-CG 4.39Å; Y25-K33 HydrophobicContact CG-CD 4.06Å; D26-K33 CarbonylContact O-C 3.49Å; D26-K33 WeakPolarHBondContact O-CA 3.49Å; L27-K33 HydrophobicContact CD2-CB 3.59Å; L27-K33 HydrophobicContact CD2-CD 4.45Å
34	Y	95.1	Very high	92.2	Very high	138 Å²	138	94.9 Å²	94.9	54%	0.541	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.3	176.6	-63.3	-84.3	0	0	0	109.9	Y25 D26 V28 I36	Y25-Y34 CarbonylContact C-O 3.44Å; Y25-Y34 VanDerWaalsContact CA-O 3.28Å; Y25-Y34 WeakPolarHBondContact CA-O 3.4Å; D26-Y34 PolarHBondContact N-O 2.84Å; D26-Y34 PolarHBondContact O-N 3.41Å; V28-Y34 HydrophobicContact CB-CE2 4.28Å; V28-Y34 HydrophobicContact CG2-CD2 3.62Å; V28-Y34 HydrophobicContact CG2-CE2 3.5Å; V28-Y34 VanDerWaalsContact CG2-CE2 3.5Å; Y34-I36 PolarHBondContact O-N 3.42Å
35	L	94.5	Very high	91.4	Very high	90 Å²	90	94.2 Å²	94.2	47%	0.471	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	117.1	175.1	-178	70.8	0	0	0	108.7	E23 Y25 D37 R38	E23-L35 HydrophobicContact CB-CD1 3.96Å; E23-L35 HydrophobicContact CG-CD1 4.24Å; Y25-L35 HydrophobicContact CD1-CB 4.22Å; Y25-L35 HydrophobicContact CD1-CD1 4.24Å; Y25-L35 HydrophobicContact CE1-CB 3.96Å; Y25-L35 HydrophobicContact CE1-CD1 3.84Å; Y25-L35 HydrophobicContact CE2-CD1 4.28Å; L35-D37 WeakPolarHBondContact CD1-O 3.45Å; L35-R38 HydrophobicContact CD2-CB 4.42Å
36	I	93.9	Very high	90.5	Very high	98 Å²	98	98.4 Å²	98.4	50%	0.503	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-48.7	174.9	-62.6	166.2	0	0	0	109.1	A24 D26 Y34	A24-I36 PolarHBondContact O-N 3.07Å; D26-I36 HydrophobicContact CB-CD1 3.83Å; D26-I36 HydrophobicContact CB-CG1 3.86Å; Y34-I36 PolarHBondContact O-N 3.42Å
37	D	94.9	Very high	89.8	Confident	14 Å²	14	95.3 Å²	95.3	8%	0.075	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	156.5	-174	-166.2	16.8	0	0	0	111.4	A24 L35 T68 S71 Y73	A24-D37 PolarHBondContact N-O 2.8Å; A24-D37 PolarHBondContact O-N 2.97Å; L35-D37 WeakPolarHBondContact CD1-O 3.45Å; D37-T68 VanDerWaalsContact OD2-CB 3.27Å; D37-T68 WeakPolarHBondContact OD2-CB 3.5Å; D37-T68 WeakPolarHBondContact OD2-CG2 3.21Å; D37-T68 PolarHBondContact OD2-OG1 3.46Å; D37-S71 WeakPolarHBondContact OD2-CB 3.48Å; D37-Y73 WeakPolarHBondContact CB-OH 3.41Å; D37-Y73 WeakPolarHBondContact OD2-CE2 3.27Å; D37-Y73 PolarHBondContact OD2-OH 2.04Å
38	R	94.8	Very high	88.9	Confident	124 Å²	124	91.4 Å²	91.4	47%	0.468	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	114.5	178	-179.8	176.3	-176.8	-154.2	1.4	109.7	I21 L22 E23 L35	I21-R38 HydrophobicContact CG2-CG 4.17Å; L22-R38 WeakPolarHBondContact O-CA 3.17Å; E23-R38 HydrophobicContact CG-CB 4.42Å; E23-R38 HydrophobicContact CG-CG 3.97Å; E23-R38 IonicContact OE1-NE 3.13Å; E23-R38 PolarHBondContact OE1-NE 2.86Å; L35-R38 HydrophobicContact CD2-CB 4.42Å
39	A	92.5	Very high	87.9	Confident	1 Å²	1	90.3 Å²	90.3	1%	0.008	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	138.1	176.9	0	0	0	0	0	110.5	L22 I66 T68 Y73	L22-A39 HydrophobicContact CB-CB 4.22Å; L22-A39 HydrophobicContact CD2-CB 4.27Å; L22-A39 PolarHBondContact N-O 3.39Å; L22-A39 PolarHBondContact O-N 3.01Å; A39-I66 HydrophobicContact CB-CB 4.22Å; A39-I66 HydrophobicContact CB-CD1 4.35Å; A39-I66 HydrophobicContact CB-CG2 3.67Å; A39-T68 HydrophobicContact CB-CG2 3.82Å; A39-Y73 HydrophobicContact CB-CD2 3.72Å; A39-Y73 HydrophobicContact CB-CE2 3.98Å
40	I	91.5	Very high	86.6	Confident	68 Å²	68	88.3 Å²	88.3	35%	0.349	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	119.4	177.1	-53.9	178.3	0	0	0	108.6	V20 I21 R42	V20-I40 WeakPolarHBondContact O-CA 3.43Å; I21-I40 HydrophobicContact CG1-CG1 4.34Å; I21-I40 HydrophobicContact CG1-CG2 4.39Å; I40-R42 HydrophobicContact CG2-CG 4.26Å
41	H	88.6	Confident	85	Confident	45 Å²	45	79.8 Å²	79.8	21%	0.208	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.2	169.7	179.8	70.4	0	0	0	109.9	A19 V20 V64 I66	A19-H41 CarbonylContact C-O 3.55Å; A19-H41 WeakPolarHBondContact CA-O 3.46Å; V20-H41 PolarHBondContact N-O 3.49Å; V20-H41 PolarHBondContact O-N 3.37Å; H41-V64 HydrophobicContact CB-CG1 4.31Å; H41-V64 VanDerWaalsContact CE1-CG1 3.41Å; H41-V64 WeakPolarHBondContact CE1-CG1 3.44Å; H41-V64 VanDerWaalsContact ND1-CG1 3.28Å; H41-V64 WeakPolarHBondContact ND1-CG1 3.41Å; H41-I66 HydrophobicContact CB-CD1 3.67Å; H41-I66 HydrophobicContact CB-CG1 4.02Å
42	R	89.2	Confident	83.1	Confident	192 Å²	192	79.3 Å²	79.3	73%	0.725	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.6	172.1	-65.5	-176.2	179	112.9	-1.2	108.6	T18 A19 I40	T18-R42 WeakPolarHBondContact O-CA 3.48Å; A19-R42 HydrophobicContact CB-CG 4.19Å; I40-R42 HydrophobicContact CG2-CG 4.26Å
43	G	84.2	Confident	81.1	Confident	20 Å²	20	80.4 Å²	80.4	21%	0.206	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	165	-175.1	0	0	0	0	0	113.4	T18	T18-G43 PolarHBondContact N-O 3.25Å; T18-G43 PolarHBondContact O-N 3.14Å; T18-G43 PolarHBondContact OG1-O 2.83Å
44	L	79.1	Confident	79.1	Confident	102 Å²	102	78.6 Å²	78.6	53%	0.534	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	113.4	168.9	-174.9	76.9	0	0	0	108	Y16	Y16-L44 HydrophobicContact CD2-CD1 4.47Å; Y16-L44 HydrophobicContact CG-CD1 4.15Å
45	L	76.7	Confident	77.1	Confident	11 Å²	11	77.3 Å²	77.3	6%	0.058	39%	0.39	C	S	.	.			trans	-108.1	131.9	170.8	-66.4	177	0	0	0	108.5	T18 I77 L79	T18-L45 HydrophobicContact CG2-CB 4.45Å; T18-L45 WeakPolarHBondContact OG1-CD1 3.46Å; T18-L45 WeakPolarHBondContact OG1-CG 3.49Å; L45-I77 HydrophobicContact CD1-CG2 3.79Å; L45-L79 HydrophobicContact CB-CD1 3.39Å; L45-L79 HydrophobicContact CB-CG 3.96Å; L45-L79 HydrophobicContact CD1-CD1 4.22Å; L45-L79 HydrophobicContact CD1-CG 4.2Å; L45-L79 HydrophobicContact CG-CD1 4.47Å
46	R	74.4	Confident	75	Confident	173 Å²	173	80.4 Å²	80.4	65%	0.653	41%	0.407	S	S	*	.			trans	-104	129.9	174.6	-68.6	-176.9	-179	162.4	0.8	109.1
47	P	79.6	Confident	73.3	Confident	19 Å²	19	80.4 Å²	80.4	12%	0.123	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	142.9	175.9	30.5	-33.2	0	0	0	110.5	L79 N88 C90	P47-L79 CarbonylContact C-O 3.47Å; P47-L79 VanDerWaalsContact CA-O 3.32Å; P47-L79 WeakPolarHBondContact CA-O 3.46Å; P47-L79 HydrophobicContact CB-CB 3.99Å; P47-N88 WeakPolarHBondContact CD-O 3.28Å; P47-N88 WeakPolarHBondContact CG-O 3.41Å; P47-C90 WeakPolarHBondContact CB-SG 3.46Å; P47-C90 WeakPolarHBondContact CG-SG 3.42Å
48	L	76.2	Confident	71.7	Confident	43 Å²	43	81.3 Å²	81.3	23%	0.225	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	133.3	167.1	-67.1	162.8	0	0	0	108.8	S50 S58 D60 Q78 L79 T80 C81	L48-S50 PolarHBondContact O-N 2.84Å; L48-S58 WeakPolarHBondContact CD1-OG 3.34Å; L48-D60 HydrophobicContact CD1-CB 3.77Å; L48-D60 HydrophobicContact CD2-CB 3.83Å; L48-D60 HydrophobicContact CG-CB 4.41Å; L48-Q78 HydrophobicContact CD1-CG 3.49Å; L48-Q78 VanDerWaalsContact CD1-CG 3.49Å; L48-Q78 HydrophobicContact CG-CG 4.47Å; L48-L79 PolarHBondContact N-O 3.33Å; L48-T80 WeakPolarHBondContact O-CA 3.32Å; L48-C81 PolarHBondContact O-N 3.45Å
49	I	73.2	Confident	70.2	Confident	59 Å²	59	81 Å²	81	30%	0.303	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-68.7	128.1	174.4	-56.5	176	0	0	0	107.3	S51 Y86 A107	I49-S51 PolarHBondContact O-N 2.81Å; I49-Y86 HydrophobicContact CG2-CD1 3.44Å; I49-Y86 VanDerWaalsContact CG2-CD1 3.44Å; I49-Y86 HydrophobicContact CG2-CE1 3.8Å; I49-Y86 HydrophobicContact CG2-CG 4.42Å; I49-A107 VanDerWaalsContact CD1-O 3.31Å; I49-A107 WeakPolarHBondContact CD1-O 3.2Å
50	S	65.6	Low	69.1	Low	32 Å²	32	85.5 Å²	85.5	22%	0.224	45%	0.45	C	S	.	.			trans	-72.5	71.7	176.4	-172	0	0	0	0	109.8	L48 T52 C81	L48-S50 PolarHBondContact O-N 2.84Å; S50-T52 PolarHBondContact O-N 2.86Å; S50-C81 WeakPolarHBondContact CB-O 3.07Å
51	S	57	Low	68.6	Low	72 Å²	72	88.8 Å²	88.8	50%	0.503	46%	0.459	S	S	.	.			trans	-87.2	89.7	170.5	76	0	0	0	0	108.3	I49 K53	I49-S51 PolarHBondContact O-N 2.81Å; S51-K53 PolarHBondContact O-N 2.86Å
52	T	54.4	Low	68.1	Low	147 Å²	147	90.5 Å²	90.5	90%	0.902	47%	0.469	S	S	*	.	S	Bend	trans	52.4	-3.6	160.8	56.6	0	0	0	0	119.3	S50	S50-T52 PolarHBondContact O-N 2.86Å
53	K	52.3	Low	68	Low	119 Å²	119	88 Å²	88	52%	0.517	47%	0.465	S	S	.	.	S	Bend	trans	-94.6	126.4	-179.9	-148	179.9	-173.8	-155.6	0	108.1	S51 L55 L57	S51-K53 PolarHBondContact O-N 2.86Å; K53-L55 PolarHBondContact O-N 2.82Å; K53-L57 HydrophobicContact CD-CB 4.12Å; K53-L57 HydrophobicContact CG-CB 4.06Å; K53-L57 PolarHBondContact NZ-O 2.99Å
54	P	53.6	Low	68.2	Low	84 Å²	84	87.8 Å²	87.8	55%	0.545	46%	0.461	S	S	.	.			trans	-57.2	140.4	177.8	21.5	-31	0	0	0	110	N56 L57	P54-N56 PolarHBondContact O-N 2.88Å; P54-L57 PolarHBondContact O-N 2.74Å
55	L	52.8	Low	68.7	Low	111 Å²	111	87.1 Å²	87.1	58%	0.581	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-46.2	-32	-175.9	-148.2	76.5	0	0	0	113.2	K53 L57 S58 T80	K53-L55 PolarHBondContact O-N 2.82Å; L55-L57 PolarHBondContact O-N 2.78Å; L55-S58 PolarHBondContact O-N 3.05Å; L55-T80 HydrophobicContact CD1-CG2 3.72Å
56	N	51	Low	69.4	Low	155 Å²	155	87.3 Å²	87.3	83%	0.829	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-70.5	-5.9	-179.6	-62.8	-18	0	0	0	115.1	P54	P54-N56 PolarHBondContact O-N 2.88Å
57	L	57.7	Low	70.2	Confident	98 Å²	98	83.9 Å²	83.9	51%	0.513	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-117.1	12.1	-179.4	-109.9	83.6	0	0	0	113.6	K53 P54 L55	K53-L57 HydrophobicContact CD-CB 4.12Å; K53-L57 HydrophobicContact CG-CB 4.06Å; K53-L57 PolarHBondContact NZ-O 2.99Å; P54-L57 PolarHBondContact O-N 2.74Å; L55-L57 PolarHBondContact O-N 2.78Å
58	S	61.6	Low	70.7	Confident	32 Å²	32	84.9 Å²	84.9	22%	0.224	47%	0.47	C	S	.	.			trans	-80.5	120	175	-173	0	0	0	0	110.5	L48 L55 W61 Q78	L48-S58 WeakPolarHBondContact CD1-OG 3.34Å; L55-S58 PolarHBondContact O-N 3.05Å; S58-W61 VanDerWaalsContact O-CD1 3.29Å; S58-W61 PolarHBondContact O-NE1 3.06Å; S58-Q78 VanDerWaalsContact CB-OE1 3.31Å; S58-Q78 VanDerWaalsContact OG-CD 3.31Å; S58-Q78 PolarHBondContact OG-NE2 2.98Å; S58-Q78 PolarHBondContact OG-OE1 3.27Å; S58-Q78 VanDerWaalsContact OG-OE1 3.1Å
59	T	62.5	Low	71.4	Confident	119 Å²	119	90.2 Å²	90.2	73%	0.73	49%	0.494	S	S	*	.			trans	-93.3	-7.8	-179.5	46.2	0	0	0	0	113.4	W61	T59-W61 PolarHBondContact O-N 2.89Å
60	D	70.3	Confident	72.2	Confident	95 Å²	95	95 Å²	95	51%	0.508	51%	0.509	S	S	.	.			trans	-90.4	51.4	-169.1	-63.8	-10.1	0	0	0	111.5	L48 Q78	L48-D60 HydrophobicContact CD1-CB 3.77Å; L48-D60 HydrophobicContact CD2-CB 3.83Å; L48-D60 HydrophobicContact CG-CB 4.41Å; D60-Q78 PolarHBondContact O-NE2 3.37Å
61	W	79.7	Confident	73.5	Confident	137 Å²	137	95.6 Å²	95.6	52%	0.519	51%	0.513	S	S	.	.			trans	-78.7	132.2	175.7	-72	86.9	0	0	0	110.2	S58 T59 Q63 C76 Q78	S58-W61 VanDerWaalsContact O-CD1 3.29Å; S58-W61 PolarHBondContact O-NE1 3.06Å; T59-W61 PolarHBondContact O-N 2.89Å; W61-Q63 PolarHBondContact O-N 3.42Å; W61-C76 HydrophobicContact CB-CB 4.28Å; W61-C76 HydrophobicContact CD2-CB 4.47Å; W61-C76 HydrophobicContact CE3-CB 3.95Å; W61-Q78 HydrophobicContact CD2-CB 3.9Å; W61-Q78 HydrophobicContact CE3-CB 3.56Å; W61-Q78 HydrophobicContact CH2-CB 4.19Å; W61-Q78 HydrophobicContact CZ2-CB 4.48Å; W61-Q78 HydrophobicContact CZ3-CB 3.73Å
62	N	80	Confident	75.1	Confident	80 Å²	80	94.9 Å²	94.9	43%	0.428	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	110	172.9	-64.1	-85.4	0	0	0	108.5	C76 I77	N62-C76 WeakPolarHBondContact O-CA 3.05Å; N62-I77 WeakPolarHBondContact CB-O 3.31Å; N62-I77 PolarHBondContact N-O 3.1Å; N62-I77 PolarHBondContact O-N 3.15Å
63	Q	86.8	Confident	77	Confident	139 Å²	139	89.9 Å²	89.9	65%	0.65	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.7	173.7	-171.7	175.8	-38	0	0	109.7	W61 T74 I75	W61-Q63 PolarHBondContact O-N 3.42Å; Q63-T74 HydrophobicContact CG-CG2 3.73Å; Q63-I75 WeakPolarHBondContact CA-O 3.29Å
64	V	86.8	Confident	78.9	Confident	17 Å²	17	88.3 Å²	88.3	10%	0.103	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.8	-177.2	178.2	0	0	0	0	108.8	H41 I66 T74 I75 I77	H41-V64 HydrophobicContact CB-CG1 4.31Å; H41-V64 VanDerWaalsContact CE1-CG1 3.41Å; H41-V64 WeakPolarHBondContact CE1-CG1 3.44Å; H41-V64 VanDerWaalsContact ND1-CG1 3.28Å; H41-V64 WeakPolarHBondContact ND1-CG1 3.41Å; V64-I66 HydrophobicContact CG1-CG1 3.91Å; V64-T74 WeakPolarHBondContact O-CA 3.47Å; V64-I75 HydrophobicContact CB-CG1 4.16Å; V64-I75 PolarHBondContact N-O 2.89Å; V64-I75 PolarHBondContact O-N 2.78Å; V64-I77 HydrophobicContact CG2-CD1 4.47Å
65	T	91.1	Very high	80.5	Confident	88 Å²	88	86 Å²	86	54%	0.54	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.4	170.8	-52.7	0	0	0	0	109.4	Y73	T65-Y73 CarbonylContact C-O 3.51Å; T65-Y73 VanDerWaalsContact CA-O 3.28Å; T65-Y73 WeakPolarHBondContact CA-O 3.28Å
66	I	90.6	Very high	82.1	Confident	15 Å²	15	84.1 Å²	84.1	8%	0.077	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.2	180	-43.3	168.8	0	0	0	108	A39 H41 V64 G72 Y73 I75	A39-I66 HydrophobicContact CB-CB 4.22Å; A39-I66 HydrophobicContact CB-CD1 4.35Å; A39-I66 HydrophobicContact CB-CG2 3.67Å; H41-I66 HydrophobicContact CB-CD1 3.67Å; H41-I66 HydrophobicContact CB-CG1 4.02Å; V64-I66 HydrophobicContact CG1-CG1 3.91Å; I66-G72 WeakPolarHBondContact O-CA 3.39Å; I66-Y73 PolarHBondContact N-O 2.8Å; I66-Y73 PolarHBondContact O-N 3.02Å; I66-I75 HydrophobicContact CD1-CD1 3.87Å; I66-I75 HydrophobicContact CD1-CG1 4.48Å
67	S	90.9	Very high	83.7	Confident	100 Å²	100	78 Å²	78	70%	0.699	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	129.2	175.4	-57.8	0	0	0	0	110.1
68	T	91.2	Very high	84.8	Confident	41 Å²	41	74.7 Å²	74.7	25%	0.252	41%	0.41	S	S	.	.			trans	-104.8	-174.1	169.8	74.2	0	0	0	0	109.5	D37 A39 Y70 S71 Y73	D37-T68 VanDerWaalsContact OD2-CB 3.27Å; D37-T68 WeakPolarHBondContact OD2-CB 3.5Å; D37-T68 WeakPolarHBondContact OD2-CG2 3.21Å; D37-T68 PolarHBondContact OD2-OG1 3.46Å; A39-T68 HydrophobicContact CB-CG2 3.82Å; T68-Y70 PolarHBondContact O-N 2.92Å; T68-Y70 PolarHBondContact OG1-N 2.98Å; T68-Y70 VanDerWaalsContact OG1-N 3.07Å; T68-S71 PolarHBondContact N-O 3.45Å; T68-S71 PolarHBondContact OG1-N 2.92Å; T68-S71 PolarHBondContact OG1-O 2.82Å; T68-Y73 HydrophobicContact CG2-CE2 4.21Å
69	Q	90.8	Very high	85.7	Confident	154 Å²	154	76.2 Å²	76.2	72%	0.72	42%	0.415	S	S	*	.	S	Bend	trans	-69.4	-16.9	171.2	63	-177	-11.8	0	0	113.6
70	Y	89.4	Confident	86.6	Confident	159 Å²	159	72.9 Å²	72.9	62%	0.624	40%	0.395	S	S	*	.	S	Bend	trans	-121.2	-23	-173	-55.9	-52.4	0	0	0	114.1	T68	T68-Y70 PolarHBondContact O-N 2.92Å; T68-Y70 PolarHBondContact OG1-N 2.98Å; T68-Y70 VanDerWaalsContact OG1-N 3.07Å
71	S	92.2	Very high	87.4	Confident	45 Å²	45	68.7 Å²	68.7	32%	0.315	37%	0.372	S	S	.	.			trans	-153.1	158.1	-170.4	-70.9	0	0	0	0	112.4	D37 T68 Y73	D37-S71 WeakPolarHBondContact OD2-CB 3.48Å; T68-S71 PolarHBondContact N-O 3.45Å; T68-S71 PolarHBondContact OG1-N 2.92Å; T68-S71 PolarHBondContact OG1-O 2.82Å; S71-Y73 WeakPolarHBondContact CB-OH 3.46Å
72	G	92.5	Very high	87.7	Confident	57 Å²	57	69.2 Å²	69.2	59%	0.588	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.9	171.2	0	0	0	0	0	109.9	I66	I66-G72 WeakPolarHBondContact O-CA 3.39Å
73	Y	92.6	Very high	88	Confident	42 Å²	42	71.3 Å²	71.3	17%	0.165	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.8	-179	-58.7	-79.2	0	0	0	110.1	L22 A24 D37 A39 T65 I66 T68 S71	L22-Y73 HydrophobicContact CD2-CD1 3.37Å; L22-Y73 HydrophobicContact CD2-CD2 3.81Å; L22-Y73 HydrophobicContact CD2-CE1 3.7Å; L22-Y73 HydrophobicContact CD2-CE2 4.09Å; L22-Y73 HydrophobicContact CD2-CG 3.43Å; L22-Y73 VanDerWaalsContact CD2-CG 3.43Å; A24-Y73 HydrophobicContact CB-CE1 4.31Å; A24-Y73 WeakPolarHBondContact CB-OH 3.28Å; D37-Y73 WeakPolarHBondContact CB-OH 3.41Å; D37-Y73 WeakPolarHBondContact OD2-CE2 3.27Å; D37-Y73 PolarHBondContact OD2-OH 2.04Å; A39-Y73 HydrophobicContact CB-CD2 3.72Å; A39-Y73 HydrophobicContact CB-CE2 3.98Å; T65-Y73 CarbonylContact C-O 3.51Å; T65-Y73 VanDerWaalsContact CA-O 3.28Å; T65-Y73 WeakPolarHBondContact CA-O 3.28Å; I66-Y73 PolarHBondContact N-O 2.8Å; I66-Y73 PolarHBondContact O-N 3.02Å; T68-Y73 HydrophobicContact CG2-CE2 4.21Å; S71-Y73 WeakPolarHBondContact CB-OH 3.46Å
74	T	92	Very high	88.1	Confident	86 Å²	86	67 Å²	67	53%	0.528	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	120	170.6	-57.2	0	0	0	0	108.4	Q63 V64	Q63-T74 HydrophobicContact CG-CG2 3.73Å; V64-T74 WeakPolarHBondContact O-CA 3.47Å
75	I	88.5	Confident	88.3	Confident	35 Å²	35	68.8 Å²	68.8	18%	0.179	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149	179.5	61.6	179.2	0	0	0	110.6	V20 L22 Q63 V64 I66 I77	V20-I75 HydrophobicContact CG1-CD1 4.37Å; L22-I75 HydrophobicContact CD1-CG2 3.95Å; Q63-I75 WeakPolarHBondContact CA-O 3.29Å; V64-I75 HydrophobicContact CB-CG1 4.16Å; V64-I75 PolarHBondContact N-O 2.89Å; V64-I75 PolarHBondContact O-N 2.78Å; I66-I75 HydrophobicContact CD1-CD1 3.87Å; I66-I75 HydrophobicContact CD1-CG1 4.48Å; I75-I77 HydrophobicContact CD1-CD1 3.45Å; I75-I77 VanDerWaalsContact CD1-CD1 3.45Å; I75-I77 HydrophobicContact CD1-CG1 3.96Å; I75-I77 HydrophobicContact CG1-CD1 3.91Å; I75-I77 HydrophobicContact CG1-CG1 4.12Å
76	C	86.2	Confident	88.2	Confident	72 Å²	72	65.7 Å²	65.7	49%	0.486	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.6	171.5	-65.7	0	0	0	0	108.5	W61 N62	W61-C76 HydrophobicContact CB-CB 4.28Å; W61-C76 HydrophobicContact CD2-CB 4.47Å; W61-C76 HydrophobicContact CE3-CB 3.95Å; N62-C76 WeakPolarHBondContact O-CA 3.05Å
77	I	84	Confident	87.9	Confident	28 Å²	28	66.1 Å²	66.1	14%	0.144	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	138.4	-178.8	-56.3	159.4	0	0	0	109.5	V20 L45 N62 V64 I75	V20-I77 HydrophobicContact CB-CD1 4.38Å; V20-I77 HydrophobicContact CG1-CD1 4.26Å; V20-I77 HydrophobicContact CG2-CD1 3.97Å; L45-I77 HydrophobicContact CD1-CG2 3.79Å; N62-I77 WeakPolarHBondContact CB-O 3.31Å; N62-I77 PolarHBondContact N-O 3.1Å; N62-I77 PolarHBondContact O-N 3.15Å; V64-I77 HydrophobicContact CG2-CD1 4.47Å; I75-I77 HydrophobicContact CD1-CD1 3.45Å; I75-I77 VanDerWaalsContact CD1-CD1 3.45Å; I75-I77 HydrophobicContact CD1-CG1 3.96Å; I75-I77 HydrophobicContact CG1-CD1 3.91Å; I75-I77 HydrophobicContact CG1-CG1 4.12Å
78	Q	81	Confident	87.5	Confident	27 Å²	27	66.2 Å²	66.2	13%	0.126	36%	0.359	C	S	.	.			trans	-140.5	133.1	174.9	-179.2	171.8	89.3	0	0	109	L48 S58 D60 W61	L48-Q78 HydrophobicContact CD1-CG 3.49Å; L48-Q78 VanDerWaalsContact CD1-CG 3.49Å; L48-Q78 HydrophobicContact CG-CG 4.47Å; S58-Q78 VanDerWaalsContact CB-OE1 3.31Å; S58-Q78 VanDerWaalsContact OG-CD 3.31Å; S58-Q78 PolarHBondContact OG-NE2 2.98Å; S58-Q78 PolarHBondContact OG-OE1 3.27Å; S58-Q78 VanDerWaalsContact OG-OE1 3.1Å; D60-Q78 PolarHBondContact O-NE2 3.37Å; W61-Q78 HydrophobicContact CD2-CB 3.9Å; W61-Q78 HydrophobicContact CE3-CB 3.56Å; W61-Q78 HydrophobicContact CH2-CB 4.19Å; W61-Q78 HydrophobicContact CZ2-CB 4.48Å; W61-Q78 HydrophobicContact CZ3-CB 3.73Å
79	L	81.4	Confident	87.2	Confident	65 Å²	65	67.8 Å²	67.8	34%	0.34	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.8	166.8	-65.9	-178.5	0	0	0	107.9	T18 L45 P47 L48	T18-L79 HydrophobicContact CG2-CD1 4.45Å; L45-L79 HydrophobicContact CB-CD1 3.39Å; L45-L79 HydrophobicContact CB-CG 3.96Å; L45-L79 HydrophobicContact CD1-CD1 4.22Å; L45-L79 HydrophobicContact CD1-CG 4.2Å; L45-L79 HydrophobicContact CG-CD1 4.47Å; P47-L79 CarbonylContact C-O 3.47Å; P47-L79 VanDerWaalsContact CA-O 3.32Å; P47-L79 WeakPolarHBondContact CA-O 3.46Å; P47-L79 HydrophobicContact CB-CB 3.99Å; L48-L79 PolarHBondContact N-O 3.33Å
80	T	81.2	Confident	87.1	Confident	49 Å²	49	61.8 Å²	61.8	30%	0.301	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	133.6	176.4	-51.9	0	0	0	0	108.2	L48 L55	L48-T80 WeakPolarHBondContact O-CA 3.32Å; L55-T80 HydrophobicContact CD1-CG2 3.72Å
81	C	85.9	Confident	87.1	Confident	6 Å²	6	59 Å²	59	4%	0.041	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-66	150.8	174.4	-62.6	0	0	0	0	110.8	L48 S50 H85 C90	L48-C81 PolarHBondContact O-N 3.45Å; S50-C81 WeakPolarHBondContact CB-O 3.07Å; C81-H85 HydrophobicContact CB-CB 4Å; C81-H85 VanDerWaalsContact CB-O 3.29Å; C81-H85 WeakPolarHBondContact CB-O 3.5Å; C81-C90 WeakPolarHBondContact CA-SG 3.4Å; C81-C90 HydrophobicContact CB-CB 3.73Å; C81-C90 WeakPolarHBondContact CB-SG 3.44Å; C81-C90 VanDerWaalsContact SG-CA 3.56Å; C81-C90 WeakPolarHBondContact SG-CB 3.33Å; C81-C90 CovalentContact SG-SG 2.04Å; C81-C90 PolarHBondContact SG-SG 2.78Å
82	E	86.9	Confident	87.1	Confident	148 Å²	148	60.4 Å²	60.4	69%	0.692	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-61.9	165.2	168.5	-66.2	-175.6	-178	0	0	111.2	N84 H85	E82-N84 PolarHBondContact O-N 2.88Å; E82-H85 WeakPolarHBondContact O-CB 3.27Å; E82-H85 PolarHBondContact O-N 3.1Å; E82-H85 VanDerWaalsContact O-N 3.09Å
83	L	86.4	Confident	87.1	Confident	125 Å²	125	61.2 Å²	61.2	65%	0.654	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	135	177.6	-175.6	67	0	0	0	110	H85	L83-H85 PolarHBondContact O-CD2 2.97Å; L83-H85 PolarHBondContact O-N 2.84Å
84	N	88.3	Confident	87.1	Confident	48 Å²	48	59.2 Å²	59.2	26%	0.257	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	6.2	-177.4	-52.1	-42.6	0	0	0	115.8	E82 Y86 V93 C94 Q95	E82-N84 PolarHBondContact O-N 2.88Å; N84-Y86 VanDerWaalsContact C-CE2 3.44Å; N84-Y86 VanDerWaalsContact O-CD2 3.23Å; N84-Y86 WeakPolarHBondContact O-CD2 3.12Å; N84-Y86 VanDerWaalsContact O-CE2 3.24Å; N84-Y86 WeakPolarHBondContact O-CE2 3.14Å; N84-V93 WeakPolarHBondContact O-CA 3.15Å; N84-C94 WeakPolarHBondContact CB-O 2.96Å; N84-C94 PolarHBondContact O-N 3.19Å; N84-Q95 HydrophobicContact CB-CB 4.39Å
85	H	90.6	Very high	87	Confident	54 Å²	54	60.1 Å²	60.1	25%	0.25	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	138.9	173.7	-75.5	-116.3	0	0	0	111.3	C81 E82 L83 C90 K92	C81-H85 HydrophobicContact CB-CB 4Å; C81-H85 VanDerWaalsContact CB-O 3.29Å; C81-H85 WeakPolarHBondContact CB-O 3.5Å; E82-H85 WeakPolarHBondContact O-CB 3.27Å; E82-H85 PolarHBondContact O-N 3.1Å; E82-H85 VanDerWaalsContact O-N 3.09Å; L83-H85 PolarHBondContact O-CD2 2.97Å; L83-H85 PolarHBondContact O-N 2.84Å; H85-C90 HydrophobicContact CB-CB 4.21Å; H85-C90 PolarHBondContact ND1-O 3.42Å; H85-K92 CarbonylContact C-O 3.54Å; H85-K92 WeakPolarHBondContact CA-O 3.23Å
86	Y	89.1	Confident	87	Confident	23 Å²	23	61.7 Å²	61.7	9%	0.09	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	171.4	-170.2	-59.9	-95.7	0	0	0	111.1	I49 N84 C90 T91 K92 C94 N106 G109	I49-Y86 HydrophobicContact CG2-CD1 3.44Å; I49-Y86 VanDerWaalsContact CG2-CD1 3.44Å; I49-Y86 HydrophobicContact CG2-CE1 3.8Å; I49-Y86 HydrophobicContact CG2-CG 4.42Å; N84-Y86 VanDerWaalsContact C-CE2 3.44Å; N84-Y86 VanDerWaalsContact O-CD2 3.23Å; N84-Y86 WeakPolarHBondContact O-CD2 3.12Å; N84-Y86 VanDerWaalsContact O-CE2 3.24Å; N84-Y86 WeakPolarHBondContact O-CE2 3.14Å; Y86-C90 CarbonylContact O-C 3.51Å; Y86-C90 VanDerWaalsContact O-CA 3.27Å; Y86-C90 WeakPolarHBondContact O-CA 3.42Å; Y86-T91 PolarHBondContact O-N 3.33Å; Y86-K92 PolarHBondContact N-O 2.78Å; Y86-K92 WeakPolarHBondContact O-CB 3.33Å; Y86-K92 PolarHBondContact O-N 3.09Å; Y86-C94 HydrophobicContact CD2-CB 4.01Å; Y86-C94 HydrophobicContact CE2-CB 3.68Å; Y86-N106 WeakPolarHBondContact CE1-O 3.24Å; Y86-G109 VanDerWaalsContact CD1-CA 3.44Å; Y86-G109 VanDerWaalsContact CD2-CA 3.45Å
87	G	85.3	Confident	87	Confident	25 Å²	25	62.2 Å²	62.2	26%	0.258	33%	0.334	S	S	.	.	S	Bend	trans	86.9	172.9	-178.2	0	0	0	0	0	112.6	D89 C90	G87-D89 PolarHBondContact O-N 2.91Å; G87-C90 PolarHBondContact O-N 3.37Å
88	N	82.9	Confident	86.5	Confident	101 Å²	101	69.8 Å²	69.8	54%	0.54	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.5	-175.7	-67.7	-25	0	0	0	113.2	Y16 P47	Y16-N88 VanDerWaalsContact CE1-C 3.47Å; Y16-N88 HydrophobicContact CE1-CB 3.96Å; Y16-N88 WeakPolarHBondContact CE1-O 3.23Å; P47-N88 WeakPolarHBondContact CD-O 3.28Å; P47-N88 WeakPolarHBondContact CG-O 3.41Å
89	D	84.1	Confident	86.2	Confident	75 Å²	75	76 Å²	76	40%	0.401	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	3.7	179.7	57.2	-4	0	0	0	112.6	Y16 G87 T91	Y16-D89 HydrophobicContact CE1-CB 3.65Å; G87-D89 PolarHBondContact O-N 2.91Å; D89-T91 HydrophobicContact CB-CG2 3.93Å; D89-T91 PolarHBondContact O-N 3.48Å; D89-T91 VanDerWaalsContact O-N 3.1Å; D89-T91 PolarHBondContact OD1-N 2.76Å; D89-T91 VanDerWaalsContact OD1-N 3.15Å; D89-T91 PolarHBondContact OD1-OG1 3.22Å; D89-T91 WeakPolarHBondContact OD2-CG2 3.42Å; D89-T91 PolarHBondContact OD2-OG1 3.5Å
90	C	88	Confident	86.1	Confident	28 Å²	28	83.2 Å²	83.2	19%	0.189	43%	0.425	C	S	.	.	S	Bend	trans	55.2	20.7	-173.6	-51.2	0	0	0	0	114.2	P47 C81 H85 Y86 G87	P47-C90 WeakPolarHBondContact CB-SG 3.46Å; P47-C90 WeakPolarHBondContact CG-SG 3.42Å; C81-C90 WeakPolarHBondContact CA-SG 3.4Å; C81-C90 HydrophobicContact CB-CB 3.73Å; C81-C90 WeakPolarHBondContact CB-SG 3.44Å; C81-C90 VanDerWaalsContact SG-CA 3.56Å; C81-C90 WeakPolarHBondContact SG-CB 3.33Å; C81-C90 CovalentContact SG-SG 2.04Å; C81-C90 PolarHBondContact SG-SG 2.78Å; H85-C90 HydrophobicContact CB-CB 4.21Å; H85-C90 PolarHBondContact ND1-O 3.42Å; Y86-C90 CarbonylContact O-C 3.51Å; Y86-C90 VanDerWaalsContact O-CA 3.27Å; Y86-C90 WeakPolarHBondContact O-CA 3.42Å; G87-C90 PolarHBondContact O-N 3.37Å
91	T	90.8	Very high	86.2	Confident	99 Å²	99	82.2 Å²	82.2	61%	0.607	42%	0.42	S	S	*	.			trans	-84.6	-20.9	-177.9	62.5	0	0	0	0	112.9	Y86 D89 V93	Y86-T91 PolarHBondContact O-N 3.33Å; D89-T91 HydrophobicContact CB-CG2 3.93Å; D89-T91 PolarHBondContact O-N 3.48Å; D89-T91 VanDerWaalsContact O-N 3.1Å; D89-T91 PolarHBondContact OD1-N 2.76Å; D89-T91 VanDerWaalsContact OD1-N 3.15Å; D89-T91 PolarHBondContact OD1-OG1 3.22Å; D89-T91 WeakPolarHBondContact OD2-CG2 3.42Å; D89-T91 PolarHBondContact OD2-OG1 3.5Å; T91-V93 PolarHBondContact O-N 3.26Å
92	K	91.5	Very high	86.5	Confident	75 Å²	75	85.1 Å²	85.1	33%	0.326	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	119.7	-178.9	-174.2	-177.5	-177.2	-170.3	0	110.3	H85 Y86 N108 G109 D110	H85-K92 CarbonylContact C-O 3.54Å; H85-K92 WeakPolarHBondContact CA-O 3.23Å; Y86-K92 PolarHBondContact N-O 2.78Å; Y86-K92 WeakPolarHBondContact O-CB 3.33Å; Y86-K92 PolarHBondContact O-N 3.09Å; K92-N108 PolarHBondContact NZ-O 2.84Å; K92-G109 WeakPolarHBondContact CE-O 3.05Å; K92-D110 VanDerWaalsContact NZ-CG 3.34Å; K92-D110 IonicContact NZ-OD1 2.76Å; K92-D110 PolarHBondContact NZ-OD1 3.01Å; K92-D110 IonicContact NZ-OD2 2.58Å
93	V	91.9	Very high	86.8	Confident	74 Å²	74	78.7 Å²	78.7	45%	0.448	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.7	-179.4	-174.7	0	0	0	0	110.4	N84 T91 Q95	N84-V93 WeakPolarHBondContact O-CA 3.15Å; T91-V93 PolarHBondContact O-N 3.26Å; V93-Q95 HydrophobicContact CG1-CB 4.46Å
94	C	92.6	Very high	87.1	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.007	40%	0.399	C	S	.	.			trans	-131.2	99.4	170	-169.5	0	0	0	0	109.4	N84 Y86 C105 G109	N84-C94 WeakPolarHBondContact CB-O 2.96Å; N84-C94 PolarHBondContact O-N 3.19Å; Y86-C94 HydrophobicContact CD2-CB 4.01Å; Y86-C94 HydrophobicContact CE2-CB 3.68Å; C94-C105 HydrophobicContact CB-CB 3.75Å; C94-C105 WeakPolarHBondContact CB-SG 3.33Å; C94-C105 PolarHBondContact O-SG 2.81Å; C94-C105 VanDerWaalsContact SG-CA 3.58Å; C94-C105 WeakPolarHBondContact SG-CB 3.18Å; C94-C105 CovalentContact SG-SG 2.02Å; C94-C105 PolarHBondContact SG-SG 3.47Å; C94-G109 VanDerWaalsContact CB-O 3.3Å; C94-G109 WeakPolarHBondContact CB-O 3.25Å
95	Q	90.3	Very high	87.3	Confident	105 Å²	105	78.7 Å²	78.7	49%	0.491	40%	0.397	S	S	.	.			trans	-113.1	123.8	-176.9	-177.5	175.7	-17.2	0	0	110.1	N84 V93	N84-Q95 HydrophobicContact CB-CB 4.39Å; V93-Q95 HydrophobicContact CG1-CB 4.46Å
96	V	88.4	Confident	87.2	Confident	67 Å²	67	78.1 Å²	78.1	41%	0.406	40%	0.396	S	S	.	.			trans	-88.9	126.8	173.3	-178.5	0	0	0	0	107.8	T101 F103	V96-T101 VanDerWaalsContact CG1-OG1 3.23Å; V96-T101 WeakPolarHBondContact CG1-OG1 3.02Å; V96-F103 HydrophobicContact CG2-CE2 4.44Å
97	N	86.7	Confident	87.1	Confident	83 Å²	83	80.2 Å²	80.2	44%	0.444	42%	0.418	S	S	.	.			trans	-101.1	111.6	170.2	-67.7	-39.3	0	0	0	106.9	N99 R100 T101	N97-N99 PolarHBondContact O-N 3.16Å; N97-R100 HydrophobicContact CB-CB 4.47Å; N97-R100 PolarHBondContact O-N 3.02Å; N97-T101 HydrophobicContact CB-CG2 4.07Å; N97-T101 PolarHBondContact N-OG1 2.93Å; N97-T101 PolarHBondContact O-N 3.3Å; N97-T101 PolarHBondContact O-OG1 2.64Å
98	E	73.9	Confident	87.3	Confident	187 Å²	187	83.7 Å²	83.7	87%	0.874	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.2	-28.3	-165.2	-65.8	-176.3	160.8	0	0	115.5
99	N	74	Confident	87.6	Confident	158 Å²	158	79 Å²	79	85%	0.845	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	6.5	-175.7	-67.6	-19.8	0	0	0	115.7	N97	N97-N99 PolarHBondContact O-N 3.16Å
100	R	79.2	Confident	88	Confident	216 Å²	216	78.8 Å²	78.8	82%	0.815	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.3	-30.1	-173.1	-66.5	-173.6	-179.7	177.2	0.7	115	N97	N97-R100 HydrophobicContact CB-CB 4.47Å; N97-R100 PolarHBondContact O-N 3.02Å
101	T	82.7	Confident	88.3	Confident	29 Å²	29	80.4 Å²	80.4	18%	0.178	41%	0.409	C	S	.	.			trans	-86.6	126.2	-174.3	47.4	0	0	0	0	110.3	V96 N97 F103	V96-T101 VanDerWaalsContact CG1-OG1 3.23Å; V96-T101 WeakPolarHBondContact CG1-OG1 3.02Å; N97-T101 HydrophobicContact CB-CG2 4.07Å; N97-T101 PolarHBondContact N-OG1 2.93Å; N97-T101 PolarHBondContact O-N 3.3Å; N97-T101 PolarHBondContact O-OG1 2.64Å; T101-F103 HydrophobicContact CG2-CD1 4.3Å; T101-F103 HydrophobicContact CG2-CE1 3.51Å; T101-F103 HydrophobicContact CG2-CZ 3.64Å; T101-F103 PolarHBondContact O-N 2.02Å
102	K	92	Very high	88.5	Confident	67 Å²	67	80.3 Å²	80.3	29%	0.291	40%	0.404	S	S	.	.			trans	-93	38.4	176.2	-57	131	170.3	-171	0	111.3	E114 W117	K102-E114 WeakPolarHBondContact O-CB 3.03Å; K102-E114 WeakPolarHBondContact O-CG 3.27Å; K102-E114 PolarHBondContact O-N 3.46Å; K102-W117 HydrophobicContact CB-CB 4.24Å; K102-W117 HydrophobicContact CB-CD2 4.02Å; K102-W117 HydrophobicContact CB-CG 3.71Å; K102-W117 HydrophobicContact CD-CD2 3.49Å; K102-W117 VanDerWaalsContact CD-CD2 3.49Å; K102-W117 HydrophobicContact CD-CE3 3.63Å; K102-W117 HydrophobicContact CD-CG 4.11Å; K102-W117 HydrophobicContact CD-CH2 4.01Å; K102-W117 HydrophobicContact CD-CZ2 3.8Å; K102-W117 HydrophobicContact CD-CZ3 3.91Å; K102-W117 HydrophobicContact CG-CD2 3.9Å; K102-W117 HydrophobicContact CG-CG 4.1Å; K102-W117 HydrophobicContact CG-CZ2 4.22Å
103	F	93.9	Very high	88.7	Confident	13 Å²	13	78.6 Å²	78.6	6%	0.057	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	158.6	-176.5	66.7	-98.6	0	0	0	111.6	V96 T101 K111 I112 C122	V96-F103 HydrophobicContact CG2-CE2 4.44Å; T101-F103 HydrophobicContact CG2-CD1 4.3Å; T101-F103 HydrophobicContact CG2-CE1 3.51Å; T101-F103 HydrophobicContact CG2-CZ 3.64Å; T101-F103 PolarHBondContact O-N 2.02Å; F103-K111 HydrophobicContact CB-CB 4.24Å; F103-K111 HydrophobicContact CD1-CD 4.18Å; F103-K111 HydrophobicContact CD2-CB 3.88Å; F103-K111 HydrophobicContact CD2-CD 4.08Å; F103-K111 HydrophobicContact CD2-CG 3.63Å; F103-K111 HydrophobicContact CE1-CD 3.97Å; F103-K111 HydrophobicContact CE2-CB 4.45Å; F103-K111 HydrophobicContact CE2-CD 3.9Å; F103-K111 HydrophobicContact CE2-CG 3.69Å; F103-K111 HydrophobicContact CG-CB 4.04Å; F103-K111 HydrophobicContact CG-CD 4.24Å; F103-K111 HydrophobicContact CG-CG 4.1Å; F103-K111 HydrophobicContact CZ-CD 3.85Å; F103-K111 HydrophobicContact CZ-CG 4.18Å; F103-I112 CarbonylContact C-O 3.58Å; F103-I112 WeakPolarHBondContact CA-O 2.99Å; F103-I112 WeakPolarHBondContact CB-O 3.42Å; F103-C122 HydrophobicContact CB-CB 3.84Å; F103-C122 VanDerWaalsContact CB-SG 3.56Å; F103-C122 HydrophobicContact CD1-CB 4.06Å; F103-C122 HydrophobicContact CG-CB 4.39Å
104	K	92.9	Very high	88.8	Confident	141 Å²	141	78.9 Å²	78.9	61%	0.613	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	152.6	170.1	-61.5	-177.8	-177.5	178.7	0	109.5	I112	K104-I112 PolarHBondContact N-O 2.58Å; K104-I112 PolarHBondContact O-N 2.76Å
105	C	91.8	Very high	88.9	Confident	31 Å²	31	85 Å²	85	21%	0.209	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	130	176.3	-57.6	0	0	0	0	110	C94 D110	C94-C105 HydrophobicContact CB-CB 3.75Å; C94-C105 WeakPolarHBondContact CB-SG 3.33Å; C94-C105 PolarHBondContact O-SG 2.81Å; C94-C105 VanDerWaalsContact SG-CA 3.58Å; C94-C105 WeakPolarHBondContact SG-CB 3.18Å; C94-C105 CovalentContact SG-SG 2.02Å; C94-C105 PolarHBondContact SG-SG 3.47Å; C105-D110 WeakPolarHBondContact CA-O 3.3Å
106	N	89.9	Confident	89.2	Confident	43 Å²	43	81.1 Å²	81.1	23%	0.23	43%	0.425	C	S	.	.			trans	-79	-179.7	171.7	79.2	2.8	0	0	0	111.3	Y86 N108 G109 D110 I112	Y86-N106 WeakPolarHBondContact CE1-O 3.24Å; N106-N108 PolarHBondContact O-N 2.87Å; N106-N108 VanDerWaalsContact O-N 3.16Å; N106-N108 WeakPolarHBondContact OD1-CA 3.48Å; N106-N108 WeakPolarHBondContact OD1-CB 3.36Å; N106-N108 PolarHBondContact OD1-N 3.16Å; N106-G109 PolarHBondContact O-N 2.59Å; N106-G109 PolarHBondContact OD1-N 3.34Å; N106-D110 PolarHBondContact N-O 3.31Å; N106-D110 WeakPolarHBondContact ND2-CB 3.31Å; N106-D110 PolarHBondContact ND2-OD2 2.98Å; N106-D110 PolarHBondContact OD1-N 2.77Å; N106-D110 PolarHBondContact OD1-OD2 3.03Å; N106-I112 HydrophobicContact CB-CD1 3.55Å; N106-I112 HydrophobicContact CB-CG1 4.04Å
107	A	86.3	Confident	89.6	Confident	66 Å²	66	80 Å²	80	55%	0.545	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.9	178.9	0	0	0	0	0	114.3	I49	I49-A107 VanDerWaalsContact CD1-O 3.31Å; I49-A107 WeakPolarHBondContact CD1-O 3.2Å
108	N	88.8	Confident	90	Very high	98 Å²	98	77.7 Å²	77.7	52%	0.524	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	3.4	177.5	-59.6	-29	0	0	0	112.6	K92 N106 D110	K92-N108 PolarHBondContact NZ-O 2.84Å; N106-N108 PolarHBondContact O-N 2.87Å; N106-N108 VanDerWaalsContact O-N 3.16Å; N106-N108 WeakPolarHBondContact OD1-CA 3.48Å; N106-N108 WeakPolarHBondContact OD1-CB 3.36Å; N106-N108 PolarHBondContact OD1-N 3.16Å; N108-D110 VanDerWaalsContact C-N 3.31Å; N108-D110 PolarHBondContact O-N 2.87Å
109	G	90.5	Very high	90.9	Very high	3 Å²	3	70.9 Å²	70.9	3%	0.031	38%	0.383	C	S	.	.	S	Bend	trans	73.5	15.2	-174.7	0	0	0	0	0	114.6	Y86 K92 C94 N106	Y86-G109 VanDerWaalsContact CD1-CA 3.44Å; Y86-G109 VanDerWaalsContact CD2-CA 3.45Å; K92-G109 WeakPolarHBondContact CE-O 3.05Å; C94-G109 VanDerWaalsContact CB-O 3.3Å; C94-G109 WeakPolarHBondContact CB-O 3.25Å; N106-G109 PolarHBondContact O-N 2.59Å; N106-G109 PolarHBondContact OD1-N 3.34Å
110	D	92.2	Very high	91.8	Very high	70 Å²	70	70.5 Å²	70.5	37%	0.374	38%	0.38	S	S	.	.			trans	-75	143.7	169.1	-50.2	-61.7	0	0	0	110.2	K92 C105 N106 N108 I112	K92-D110 VanDerWaalsContact NZ-CG 3.34Å; K92-D110 IonicContact NZ-OD1 2.76Å; K92-D110 PolarHBondContact NZ-OD1 3.01Å; K92-D110 IonicContact NZ-OD2 2.58Å; C105-D110 WeakPolarHBondContact CA-O 3.3Å; N106-D110 PolarHBondContact N-O 3.31Å; N106-D110 WeakPolarHBondContact ND2-CB 3.31Å; N106-D110 PolarHBondContact ND2-OD2 2.98Å; N106-D110 PolarHBondContact OD1-N 2.77Å; N106-D110 PolarHBondContact OD1-OD2 3.03Å; N108-D110 VanDerWaalsContact C-N 3.31Å; N108-D110 PolarHBondContact O-N 2.87Å; D110-I112 PolarHBondContact O-N 2.03Å
111	K	93.9	Very high	92.4	Very high	63 Å²	63	64.9 Å²	64.9	27%	0.274	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.9	173.6	-62.1	177.4	-177.9	161.7	0	109.2	F103 E121	F103-K111 HydrophobicContact CB-CB 4.24Å; F103-K111 HydrophobicContact CD1-CD 4.18Å; F103-K111 HydrophobicContact CD2-CB 3.88Å; F103-K111 HydrophobicContact CD2-CD 4.08Å; F103-K111 HydrophobicContact CD2-CG 3.63Å; F103-K111 HydrophobicContact CE1-CD 3.97Å; F103-K111 HydrophobicContact CE2-CB 4.45Å; F103-K111 HydrophobicContact CE2-CD 3.9Å; F103-K111 HydrophobicContact CE2-CG 3.69Å; F103-K111 HydrophobicContact CG-CB 4.04Å; F103-K111 HydrophobicContact CG-CD 4.24Å; F103-K111 HydrophobicContact CG-CG 4.1Å; F103-K111 HydrophobicContact CZ-CD 3.85Å; F103-K111 HydrophobicContact CZ-CG 4.18Å; K111-E121 IonicContact NZ-OE1 3.4Å; K111-E121 PolarHBondContact NZ-OE1 3.25Å; K111-E121 IonicContact NZ-OE2 2.81Å; K111-E121 PolarHBondContact NZ-OE2 3.43Å
112	I	95.2	Very high	93	Very high	96 Å²	96	63.6 Å²	63.6	49%	0.492	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	108.9	168	-60.7	177.3	0	0	0	106.7	F103 K104 N106 D110	F103-I112 CarbonylContact C-O 3.58Å; F103-I112 WeakPolarHBondContact CA-O 2.99Å; F103-I112 WeakPolarHBondContact CB-O 3.42Å; K104-I112 PolarHBondContact N-O 2.58Å; K104-I112 PolarHBondContact O-N 2.76Å; N106-I112 HydrophobicContact CB-CD1 3.55Å; N106-I112 HydrophobicContact CB-CG1 4.04Å; D110-I112 PolarHBondContact O-N 2.03Å
113	C	95.8	Very high	93	Very high	39 Å²	39	65.6 Å²	65.6	26%	0.264	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	144.5	179	-52.1	0	0	0	0	111.4	W117 C122	C113-W117 HydrophobicContact CB-CB 4.2Å; C113-W117 VanDerWaalsContact CB-O 3.28Å; C113-W117 WeakPolarHBondContact CB-O 3.45Å; C113-C122 WeakPolarHBondContact CA-SG 3.45Å; C113-C122 HydrophobicContact CB-CB 3.64Å; C113-C122 WeakPolarHBondContact CB-SG 3.46Å; C113-C122 PolarHBondContact N-SG 3.33Å; C113-C122 VanDerWaalsContact SG-CA 3.51Å; C113-C122 WeakPolarHBondContact SG-CB 3.49Å; C113-C122 CovalentContact SG-SG 2.03Å; C113-C122 PolarHBondContact SG-SG 2.81Å
114	E	94.5	Very high	93.1	Very high	80 Å²	80	71.7 Å²	71.7	37%	0.374	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.3	155.6	169.4	-72	-176.1	160.3	0	0	110.9	K102 G116 W117	K102-E114 WeakPolarHBondContact O-CB 3.03Å; K102-E114 WeakPolarHBondContact O-CG 3.27Å; K102-E114 PolarHBondContact O-N 3.46Å; E114-G116 PolarHBondContact O-N 3.44Å; E114-W117 PolarHBondContact O-N 3.17Å
115	P	95.1	Very high	93.2	Very high	131 Å²	131	65.4 Å²	65.4	85%	0.851	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	129.8	177.6	-26.9	35.3	0	0	0	111.9
116	G	96	Very high	93.4	Very high	22 Å²	22	68 Å²	68	23%	0.227	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-3.1	-177.9	0	0	0	0	0	115.2	E114 I126 P141	E114-G116 PolarHBondContact O-N 3.44Å; G116-I126 WeakPolarHBondContact O-CB 3.32Å; G116-I126 WeakPolarHBondContact O-CG1 3.42Å; G116-I126 PolarHBondContact O-N 2.98Å; G116-P141 WeakPolarHBondContact O-CB 3.42Å; G116-P141 VanDerWaalsContact O-CG 3.26Å; G116-P141 WeakPolarHBondContact O-CG 3.32Å
117	W	96.6	Very high	93.8	Very high	44 Å²	44	67.9 Å²	67.9	17%	0.167	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	151.6	175.9	-63.2	95.5	0	0	0	111.9	K102 C113 E114 D123 K124 A125 P141	K102-W117 HydrophobicContact CB-CB 4.24Å; K102-W117 HydrophobicContact CB-CD2 4.02Å; K102-W117 HydrophobicContact CB-CG 3.71Å; K102-W117 HydrophobicContact CD-CD2 3.49Å; K102-W117 VanDerWaalsContact CD-CD2 3.49Å; K102-W117 HydrophobicContact CD-CE3 3.63Å; K102-W117 HydrophobicContact CD-CG 4.11Å; K102-W117 HydrophobicContact CD-CH2 4.01Å; K102-W117 HydrophobicContact CD-CZ2 3.8Å; K102-W117 HydrophobicContact CD-CZ3 3.91Å; K102-W117 HydrophobicContact CG-CD2 3.9Å; K102-W117 HydrophobicContact CG-CG 4.1Å; K102-W117 HydrophobicContact CG-CZ2 4.22Å; C113-W117 HydrophobicContact CB-CB 4.2Å; C113-W117 VanDerWaalsContact CB-O 3.28Å; C113-W117 WeakPolarHBondContact CB-O 3.45Å; E114-W117 PolarHBondContact O-N 3.17Å; W117-D123 WeakPolarHBondContact CZ3-O 3.28Å; W117-K124 CarbonylContact C-O 3.55Å; W117-A125 HydrophobicContact CE3-CB 4.27Å; W117-A125 HydrophobicContact CH2-CB 4.2Å; W117-A125 HydrophobicContact CZ3-CB 3.82Å; W117-P141 HydrophobicContact CD2-CG 4.22Å; W117-P141 HydrophobicContact CZ2-CG 3.89Å
118	S	95.1	Very high	94.2	Very high	35 Å²	35	68.1 Å²	68.1	25%	0.245	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	176.3	-174.9	68.2	0	0	0	0	111.5	C122 D123 K124	S118-C122 CarbonylContact O-C 3.59Å; S118-C122 VanDerWaalsContact O-CA 3.27Å; S118-C122 WeakPolarHBondContact O-CA 3.4Å; S118-D123 PolarHBondContact O-N 3Å; S118-K124 PolarHBondContact N-O 3.08Å; S118-K124 WeakPolarHBondContact O-CB 3.46Å; S118-K124 PolarHBondContact O-N 3.05Å; S118-K124 PolarHBondContact OG-O 3.26Å
119	G	93.7	Very high	94.6	Very high	43 Å²	43	71.1 Å²	71.1	44%	0.443	39%	0.389	S	S	.	.	S	Bend	trans	93.4	166.4	-175.5	0	0	0	0	0	112.2	E121 C122	G119-E121 PolarHBondContact O-N 2.94Å; G119-C122 PolarHBondContact O-N 2.92Å
120	I	92.5	Very high	94.8	Very high	150 Å²	150	73.5 Å²	73.5	77%	0.769	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-35.2	-178.2	-62.6	170	0	0	0	110.8
121	E	91.9	Very high	95	Very high	99 Å²	99	71.2 Å²	71.2	46%	0.463	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	3.7	-179.6	-64.6	-60.5	121.8	0	0	113.2	K111 G119 D123	K111-E121 IonicContact NZ-OE1 3.4Å; K111-E121 PolarHBondContact NZ-OE1 3.25Å; K111-E121 IonicContact NZ-OE2 2.81Å; K111-E121 PolarHBondContact NZ-OE2 3.43Å; G119-E121 PolarHBondContact O-N 2.94Å; E121-D123 HydrophobicContact CB-CB 4.39Å; E121-D123 PolarHBondContact O-N 2.77Å
122	C	94.7	Very high	95.1	Very high	2 Å²	2	69.3 Å²	69.3	1%	0.014	40%	0.397	C	S	.	.	S	Bend	trans	53.5	34.6	-175.3	-55.4	0	0	0	0	113.6	F103 C113 S118 G119	F103-C122 HydrophobicContact CB-CB 3.84Å; F103-C122 VanDerWaalsContact CB-SG 3.56Å; F103-C122 HydrophobicContact CD1-CB 4.06Å; F103-C122 HydrophobicContact CG-CB 4.39Å; C113-C122 WeakPolarHBondContact CA-SG 3.45Å; C113-C122 HydrophobicContact CB-CB 3.64Å; C113-C122 WeakPolarHBondContact CB-SG 3.46Å; C113-C122 PolarHBondContact N-SG 3.33Å; C113-C122 VanDerWaalsContact SG-CA 3.51Å; C113-C122 WeakPolarHBondContact SG-CB 3.49Å; C113-C122 CovalentContact SG-SG 2.03Å; C113-C122 PolarHBondContact SG-SG 2.81Å; S118-C122 CarbonylContact O-C 3.59Å; S118-C122 VanDerWaalsContact O-CA 3.27Å; S118-C122 WeakPolarHBondContact O-CA 3.4Å; G119-C122 PolarHBondContact O-N 2.92Å
123	D	92.2	Very high	95	Very high	108 Å²	108	71 Å²	71	58%	0.578	41%	0.414	S	S	*	.			trans	-99.9	-15.3	-176	60.6	-20.7	0	0	0	113.2	W117 S118 E121	W117-D123 WeakPolarHBondContact CZ3-O 3.28Å; S118-D123 PolarHBondContact O-N 3Å; E121-D123 HydrophobicContact CB-CB 4.39Å; E121-D123 PolarHBondContact O-N 2.77Å
124	K	94.5	Very high	94.9	Very high	142 Å²	142	75.3 Å²	75.3	62%	0.617	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.8	179.9	-174.8	-179.9	-179.4	-179.4	0	111.7	W117 S118	W117-K124 CarbonylContact C-O 3.55Å; S118-K124 PolarHBondContact N-O 3.08Å; S118-K124 WeakPolarHBondContact O-CB 3.46Å; S118-K124 PolarHBondContact O-N 3.05Å; S118-K124 PolarHBondContact OG-O 3.26Å
125	A	96	Very high	94.9	Very high	9 Å²	9	72.8 Å²	72.8	7%	0.074	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	143.6	172.6	0	0	0	0	0	111.3	W117 P141	W117-A125 HydrophobicContact CE3-CB 4.27Å; W117-A125 HydrophobicContact CH2-CB 4.2Å; W117-A125 HydrophobicContact CZ3-CB 3.82Å; A125-P141 HydrophobicContact CB-CG 4.36Å
126	I	96.8	Very high	95	Very high	84 Å²	84	66.9 Å²	66.9	43%	0.431	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-90.8	117.5	171.6	-59.2	173.9	0	0	0	107.5	G116 P141 G142	G116-I126 WeakPolarHBondContact O-CB 3.32Å; G116-I126 WeakPolarHBondContact O-CG1 3.42Å; G116-I126 PolarHBondContact O-N 2.98Å; I126-P141 CarbonylContact O-C 3.3Å; I126-P141 VanDerWaalsContact O-CA 3.3Å; I126-P141 WeakPolarHBondContact O-CA 3.43Å; I126-G142 PolarHBondContact O-N 3.19Å
127	C	97.1	Very high	95	Very high	41 Å²	41	70.1 Å²	70.1	28%	0.277	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-71.3	170.2	-176.4	-50.4	0	0	0	0	112	C131 C138 E143	C127-C131 HydrophobicContact CB-CB 3.83Å; C127-C138 WeakPolarHBondContact CA-SG 3.45Å; C127-C138 HydrophobicContact CB-CB 3.7Å; C127-C138 WeakPolarHBondContact CB-SG 3.06Å; C127-C138 PolarHBondContact N-SG 3.45Å; C127-C138 WeakPolarHBondContact SG-CB 3.04Å; C127-C138 PolarHBondContact SG-N 2.87Å; C127-C138 CovalentContact SG-SG 2.04Å; C127-C138 PolarHBondContact SG-SG 3.49Å; C127-E143 WeakPolarHBondContact CA-O 3.02Å; C127-E143 WeakPolarHBondContact CB-O 3.15Å
128	N	95.9	Very high	95	Very high	72 Å²	72	69 Å²	69	39%	0.385	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-54.4	148.5	176.5	-158.7	4.6	0	0	0	111.7	G130 C131 G142 E143 C144	N128-G130 PolarHBondContact O-N 3.48Å; N128-C131 HydrophobicContact CB-CB 4.48Å; N128-C131 WeakPolarHBondContact O-CB 3.26Å; N128-C131 PolarHBondContact O-N 2.72Å; N128-G142 VanDerWaalsContact CB-O 3.32Å; N128-G142 WeakPolarHBondContact CB-O 3.3Å; N128-E143 PolarHBondContact N-O 2.8Å; N128-C144 HydrophobicContact CB-CB 4.33Å
129	I	95.6	Very high	94.9	Very high	160 Å²	160	71.8 Å²	71.8	82%	0.821	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	125.9	177	-60.3	174.5	0	0	0	108.3	L154	I129-L154 WeakPolarHBondContact O-CD2 3.34Å
130	G	95.2	Very high	95	Very high	54 Å²	54	77.8 Å²	77.8	56%	0.557	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	-5.5	-175.6	0	0	0	0	0	114.4	N128 P132	N128-G130 PolarHBondContact O-N 3.48Å; G130-P132 VanDerWaalsContact O-CD 3.3Å; G130-P132 WeakPolarHBondContact O-CD 3.4Å
131	C	96.8	Very high	95.1	Very high	22 Å²	22	73 Å²	73	15%	0.149	41%	0.412	C	S	.	.			trans	-63.9	118.9	173.9	-167.8	0	0	0	0	110.2	C127 N128 C144	C127-C131 HydrophobicContact CB-CB 3.83Å; N128-C131 HydrophobicContact CB-CB 4.48Å; N128-C131 WeakPolarHBondContact O-CB 3.26Å; N128-C131 PolarHBondContact O-N 2.72Å; C131-C144 VanDerWaalsContact CA-SG 3.56Å; C131-C144 HydrophobicContact CB-CB 3.78Å; C131-C144 WeakPolarHBondContact CB-SG 3.29Å; C131-C144 VanDerWaalsContact SG-CA 3.55Å; C131-C144 WeakPolarHBondContact SG-CB 3.03Å; C131-C144 CovalentContact SG-SG 2.04Å; C131-C144 PolarHBondContact SG-SG 2.04Å
132	P	94.9	Very high	95.3	Very high	22 Å²	22	70.3 Å²	70.3	14%	0.143	41%	0.411	C	S	.	.			trans	-76	131.6	-170.3	25.5	-31.5	0	0	0	110.5	G130 V134 H135 G136 L154 C155	G130-P132 VanDerWaalsContact O-CD 3.3Å; G130-P132 WeakPolarHBondContact O-CD 3.4Å; P132-V134 PolarHBondContact O-N 3.29Å; P132-V134 VanDerWaalsContact O-N 3.1Å; P132-H135 WeakPolarHBondContact CB-CE1 3.39Å; P132-H135 WeakPolarHBondContact CG-CE1 3.16Å; P132-H135 WeakPolarHBondContact CG-ND1 3.3Å; P132-H135 PolarHBondContact O-N 3.42Å; P132-G136 VanDerWaalsContact O-CA 3.29Å; P132-G136 WeakPolarHBondContact O-CA 3.05Å; P132-G136 PolarHBondContact O-N 2.04Å; P132-L154 WeakPolarHBondContact CD-O 3.37Å; P132-L154 VanDerWaalsContact CG-O 3.23Å; P132-L154 WeakPolarHBondContact CG-O 3.38Å; P132-C155 HydrophobicContact CG-CB 4.24Å
133	P	93.5	Very high	95.4	Very high	131 Å²	131	73.3 Å²	73.3	85%	0.851	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-13.4	-173.7	28.2	-35.9	0	0	0	114
134	V	94.7	Very high	95.6	Very high	131 Å²	131	69.2 Å²	69.2	79%	0.794	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-36.9	-176	-179	0	0	0	0	111.8	P132	P132-V134 PolarHBondContact O-N 3.29Å; P132-V134 VanDerWaalsContact O-N 3.1Å
135	H	94.2	Very high	95.7	Very high	27 Å²	27	65.9 Å²	65.9	13%	0.125	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	9.8	-172.9	48.8	79.8	0	0	0	113.7	P132 C146 A147 W150 C155	P132-H135 WeakPolarHBondContact CB-CE1 3.39Å; P132-H135 WeakPolarHBondContact CG-CE1 3.16Å; P132-H135 WeakPolarHBondContact CG-ND1 3.3Å; P132-H135 PolarHBondContact O-N 3.42Å; H135-C146 CarbonylContact O-C 3.49Å; H135-C146 WeakPolarHBondContact O-CA 3.48Å; H135-A147 HydrophobicContact CB-CB 4.04Å; H135-A147 PolarHBondContact O-N 2.82Å; H135-W150 HydrophobicContact CB-CB 4.34Å; H135-W150 VanDerWaalsContact CB-CD1 3.41Å; H135-W150 HydrophobicContact CB-CD2 3.92Å; H135-W150 HydrophobicContact CB-CG 3.64Å; H135-W150 AromaticContact CD2-CD2 3.93Å; H135-W150 AromaticContact CD2-CE2 3.68Å; H135-W150 AromaticContact CD2-CZ2 3.74Å; H135-W150 AromaticContact CE1-CE3 3.76Å; H135-W150 AromaticContact CE1-CZ3 3.95Å; H135-W150 AromaticContact CG-CD2 3.61Å; H135-W150 AromaticContact CG-CE2 3.69Å; H135-W150 AromaticContact CG-CG 3.82Å; H135-W150 AromaticContact CG-NE1 3.9Å; H135-W150 AromaticContact ND1-CD2 3.74Å; H135-W150 AromaticContact ND1-CE3 3.85Å; H135-W150 AromaticContact ND1-CG 3.97Å; H135-W150 AromaticContact NE2-CH2 3.94Å; H135-W150 AromaticContact NE2-CZ3 3.89Å; H135-C155 PolarHBondContact CE1-O 2.96Å; H135-C155 PolarHBondContact ND1-O 3Å
136	G	96.2	Very high	95.8	Very high	7 Å²	7	67.9 Å²	67.9	7%	0.072	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.7	171	0	0	0	0	0	110.9	P132 D145	P132-G136 VanDerWaalsContact O-CA 3.29Å; P132-G136 WeakPolarHBondContact O-CA 3.05Å; P132-G136 PolarHBondContact O-N 2.04Å; G136-D145 WeakPolarHBondContact CA-O 3.15Å
137	T	96.5	Very high	95.8	Very high	89 Å²	89	66 Å²	66	55%	0.546	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	173.4	173.2	63.2	0	0	0	0	109.9	C144 D145	T137-C144 CarbonylContact O-C 3.43Å; T137-C144 WeakPolarHBondContact O-CA 3.41Å; T137-D145 PolarHBondContact N-O 3.19Å; T137-D145 PolarHBondContact O-N 2.79Å; T137-D145 PolarHBondContact OG1-O 3.39Å
138	C	96.5	Very high	95.7	Very high	22 Å²	22	70.3 Å²	70.3	15%	0.149	43%	0.428	C	S	.	.			trans	-153.9	133	174.3	57	0	0	0	0	110.7	C127 E143	C127-C138 WeakPolarHBondContact CA-SG 3.45Å; C127-C138 HydrophobicContact CB-CB 3.7Å; C127-C138 WeakPolarHBondContact CB-SG 3.06Å; C127-C138 PolarHBondContact N-SG 3.45Å; C127-C138 WeakPolarHBondContact SG-CB 3.04Å; C127-C138 PolarHBondContact SG-N 2.87Å; C127-C138 CovalentContact SG-SG 2.04Å; C127-C138 PolarHBondContact SG-SG 3.49Å; C138-E143 HydrophobicContact CB-CB 4.08Å; C138-E143 WeakPolarHBondContact CB-O 3.48Å
139	S	93.8	Very high	95.7	Very high	93 Å²	93	67 Å²	67	65%	0.65	41%	0.411	S	S	*	.	S	Bend	trans	-89.8	-27.6	172.4	-63.3	0	0	0	0	111.8
140	R	94.3	Very high	95.8	Very high	168 Å²	168	62.9 Å²	62.9	63%	0.634	39%	0.385	S	S	*	.	S	Bend	trans	-123	154.7	174.5	-51.9	178.8	175.6	160.1	-2.3	111.5	G142 E143	R140-G142 PolarHBondContact O-N 2.91Å; R140-E143 HydrophobicContact CB-CG 4.25Å; R140-E143 WeakPolarHBondContact CB-OE2 3.47Å; R140-E143 WeakPolarHBondContact CD-OE1 3.46Å; R140-E143 PolarHBondContact N-OE2 3.31Å; R140-E143 VanDerWaalsContact N-OE2 3.08Å; R140-E143 PolarHBondContact O-N 2.91Å
141	P	96	Very high	95.8	Very high	51 Å²	51	64.5 Å²	64.5	33%	0.331	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	136.1	179.8	-23.3	33.8	0	0	0	112.3	G116 W117 A125 I126 E143	G116-P141 WeakPolarHBondContact O-CB 3.42Å; G116-P141 VanDerWaalsContact O-CG 3.26Å; G116-P141 WeakPolarHBondContact O-CG 3.32Å; W117-P141 HydrophobicContact CD2-CG 4.22Å; W117-P141 HydrophobicContact CZ2-CG 3.89Å; A125-P141 HydrophobicContact CB-CG 4.36Å; I126-P141 CarbonylContact O-C 3.3Å; I126-P141 VanDerWaalsContact O-CA 3.3Å; I126-P141 WeakPolarHBondContact O-CA 3.43Å; P141-E143 VanDerWaalsContact C-N 3.3Å; P141-E143 PolarHBondContact O-N 3Å
142	G	95.5	Very high	95.7	Very high	42 Å²	42	64.8 Å²	64.8	43%	0.433	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	0.4	178.7	0	0	0	0	0	115.7	I126 N128 R140	I126-G142 PolarHBondContact O-N 3.19Å; N128-G142 VanDerWaalsContact CB-O 3.32Å; N128-G142 WeakPolarHBondContact CB-O 3.3Å; R140-G142 PolarHBondContact O-N 2.91Å
143	E	96.1	Very high	95.6	Very high	65 Å²	65	68.6 Å²	68.6	30%	0.304	41%	0.41	S	S	.	.			trans	-83.1	165.3	171.2	-69.1	174.7	170.6	0	0	111.6	C127 N128 C138 R140 P141	C127-E143 WeakPolarHBondContact CA-O 3.02Å; C127-E143 WeakPolarHBondContact CB-O 3.15Å; N128-E143 PolarHBondContact N-O 2.8Å; C138-E143 HydrophobicContact CB-CB 4.08Å; C138-E143 WeakPolarHBondContact CB-O 3.48Å; R140-E143 HydrophobicContact CB-CG 4.25Å; R140-E143 WeakPolarHBondContact CB-OE2 3.47Å; R140-E143 WeakPolarHBondContact CD-OE1 3.46Å; R140-E143 PolarHBondContact N-OE2 3.31Å; R140-E143 VanDerWaalsContact N-OE2 3.08Å; R140-E143 PolarHBondContact O-N 2.91Å; P141-E143 VanDerWaalsContact C-N 3.3Å; P141-E143 PolarHBondContact O-N 3Å
144	C	97.6	Very high	95.6	Very high	22 Å²	22	64.8 Å²	64.8	15%	0.149	38%	0.382	C	S	.	.			trans	-148.4	93.2	170.1	-166.7	0	0	0	0	109.2	N128 C131 T137 C155	N128-C144 HydrophobicContact CB-CB 4.33Å; C131-C144 VanDerWaalsContact CA-SG 3.56Å; C131-C144 HydrophobicContact CB-CB 3.78Å; C131-C144 WeakPolarHBondContact CB-SG 3.29Å; C131-C144 VanDerWaalsContact SG-CA 3.55Å; C131-C144 WeakPolarHBondContact SG-CB 3.03Å; C131-C144 CovalentContact SG-SG 2.04Å; C131-C144 PolarHBondContact SG-SG 2.04Å; T137-C144 CarbonylContact O-C 3.43Å; T137-C144 WeakPolarHBondContact O-CA 3.41Å; C144-C155 PolarHBondContact O-SG 3.5Å; C144-C155 PolarHBondContact SG-SG 3.24Å
145	D	96.9	Very high	95.7	Very high	71 Å²	71	58.5 Å²	58.5	38%	0.38	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.3	178.5	-60.3	-46.6	0	0	0	109.7	G136 T137	G136-D145 WeakPolarHBondContact CA-O 3.15Å; T137-D145 PolarHBondContact N-O 3.19Å; T137-D145 PolarHBondContact O-N 2.79Å; T137-D145 PolarHBondContact OG1-O 3.39Å
146	C	97.2	Very high	95.6	Very high	52 Å²	52	61.8 Å²	61.8	35%	0.351	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	137.6	-173.3	-50.3	0	0	0	0	112.4	H135 W150 C155	H135-C146 CarbonylContact O-C 3.49Å; H135-C146 WeakPolarHBondContact O-CA 3.48Å; C146-W150 HydrophobicContact CB-CB 4.18Å; C146-W150 VanDerWaalsContact CB-O 3.3Å; C146-W150 WeakPolarHBondContact CB-O 3.32Å; C146-C155 WeakPolarHBondContact CA-SG 3.16Å; C146-C155 HydrophobicContact CB-CB 3.67Å; C146-C155 WeakPolarHBondContact CB-SG 3.01Å; C146-C155 PolarHBondContact N-SG 2.04Å; C146-C155 WeakPolarHBondContact SG-CA 3.38Å; C146-C155 WeakPolarHBondContact SG-CB 2.78Å; C146-C155 CovalentContact SG-SG 2.04Å; C146-C155 PolarHBondContact SG-SG 2.75Å
147	A	96.7	Very high	95.6	Very high	44 Å²	44	66.1 Å²	66.1	36%	0.364	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-64.2	153.9	167.4	0	0	0	0	0	110.4	H135 G149 W150	H135-A147 HydrophobicContact CB-CB 4.04Å; H135-A147 PolarHBondContact O-N 2.82Å; A147-G149 PolarHBondContact O-N 3.47Å; A147-W150 PolarHBondContact O-N 3.1Å
148	T	96.1	Very high	95.5	Very high	132 Å²	132	62.9 Å²	62.9	81%	0.81	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	125	178.4	-56.6	0	0	0	0	111.4	F174	T148-F174 HydrophobicContact CG2-CE2 4.04Å; T148-F174 HydrophobicContact CG2-CZ 4.09Å
149	G	96.1	Very high	95.5	Very high	2 Å²	2	64.3 Å²	64.3	2%	0.021	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	-2.1	-178.4	0	0	0	0	0	115.1	A147 I159 P173	A147-G149 PolarHBondContact O-N 3.47Å; G149-I159 PolarHBondContact O-N 2.67Å; G149-P173 WeakPolarHBondContact O-CB 3.25Å
150	W	97	Very high	95.6	Very high	73 Å²	73	64 Å²	64	28%	0.277	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	150.8	175	-62.7	88.2	0	0	0	111.1	H135 C146 A147 C155 E157 C158 P173	H135-W150 HydrophobicContact CB-CB 4.34Å; H135-W150 VanDerWaalsContact CB-CD1 3.41Å; H135-W150 HydrophobicContact CB-CD2 3.92Å; H135-W150 HydrophobicContact CB-CG 3.64Å; H135-W150 AromaticContact CD2-CD2 3.93Å; H135-W150 AromaticContact CD2-CE2 3.68Å; H135-W150 AromaticContact CD2-CZ2 3.74Å; H135-W150 AromaticContact CE1-CE3 3.76Å; H135-W150 AromaticContact CE1-CZ3 3.95Å; H135-W150 AromaticContact CG-CD2 3.61Å; H135-W150 AromaticContact CG-CE2 3.69Å; H135-W150 AromaticContact CG-CG 3.82Å; H135-W150 AromaticContact CG-NE1 3.9Å; H135-W150 AromaticContact ND1-CD2 3.74Å; H135-W150 AromaticContact ND1-CE3 3.85Å; H135-W150 AromaticContact ND1-CG 3.97Å; H135-W150 AromaticContact NE2-CH2 3.94Å; H135-W150 AromaticContact NE2-CZ3 3.89Å; C146-W150 HydrophobicContact CB-CB 4.18Å; C146-W150 VanDerWaalsContact CB-O 3.3Å; C146-W150 WeakPolarHBondContact CB-O 3.32Å; A147-W150 PolarHBondContact O-N 3.1Å; W150-C155 HydrophobicContact CB-CB 4.48Å; W150-C155 VanDerWaalsContact CE3-O 3.25Å; W150-E157 CarbonylContact C-O 3.43Å; W150-E157 VanDerWaalsContact CA-O 3.32Å; W150-E157 WeakPolarHBondContact CA-O 3.23Å; W150-C158 HydrophobicContact CZ3-CB 4.45Å; W150-P173 HydrophobicContact CD2-CG 4.41Å; W150-P173 HydrophobicContact CZ2-CG 4.07Å
151	Q	95	Very high	95.6	Very high	88 Å²	88	61.7 Å²	61.7	41%	0.411	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	-177.6	-177.7	69	176.6	8.6	0	0	110.9	C155 D156 E157 I159	Q151-C155 CarbonylContact O-C 3.54Å; Q151-C155 VanDerWaalsContact O-C 3.3Å; Q151-C155 WeakPolarHBondContact O-CA 3.3Å; Q151-D156 PolarHBondContact O-N 3.23Å; Q151-E157 HydrophobicContact CG-CB 3.78Å; Q151-E157 PolarHBondContact N-O 3.15Å; Q151-E157 WeakPolarHBondContact O-CB 3.45Å; Q151-E157 PolarHBondContact O-N 3.19Å; Q151-I159 HydrophobicContact CB-CD1 4.2Å; Q151-I159 HydrophobicContact CB-CG1 3.81Å; Q151-I159 HydrophobicContact CG-CG1 3.85Å
152	G	94.2	Very high	95.5	Very high	28 Å²	28	63.6 Å²	63.6	29%	0.289	36%	0.358	S	S	.	.	S	Bend	trans	89.6	165.5	-175.8	0	0	0	0	0	112.1	L154 C155	G152-L154 PolarHBondContact O-N 3.46Å; G152-C155 PolarHBondContact O-N 2.76Å; G152-C155 VanDerWaalsContact O-N 3.15Å
153	P	93.2	Very high	95.3	Very high	103 Å²	103	64.1 Å²	64.1	67%	0.669	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.3	-175.7	27.2	-35.2	0	0	0	113.8
154	L	94.6	Very high	95.2	Very high	50 Å²	50	61.9 Å²	61.9	26%	0.262	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	13.3	176.6	-59.9	178.6	0	0	0	111.7	I129 P132 G152 D156	I129-L154 WeakPolarHBondContact O-CD2 3.34Å; P132-L154 WeakPolarHBondContact CD-O 3.37Å; P132-L154 VanDerWaalsContact CG-O 3.23Å; P132-L154 WeakPolarHBondContact CG-O 3.38Å; G152-L154 PolarHBondContact O-N 3.46Å; L154-D156 PolarHBondContact O-N 2.83Å
155	C	96.1	Very high	94.9	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	56.1	18.4	-179.3	-53.2	0	0	0	0	114.7	P132 H135 C144 C146 W150 Q151 G152	P132-C155 HydrophobicContact CG-CB 4.24Å; H135-C155 PolarHBondContact CE1-O 2.96Å; H135-C155 PolarHBondContact ND1-O 3Å; C144-C155 PolarHBondContact O-SG 3.5Å; C144-C155 PolarHBondContact SG-SG 3.24Å; C146-C155 WeakPolarHBondContact CA-SG 3.16Å; C146-C155 HydrophobicContact CB-CB 3.67Å; C146-C155 WeakPolarHBondContact CB-SG 3.01Å; C146-C155 PolarHBondContact N-SG 2.04Å; C146-C155 WeakPolarHBondContact SG-CA 3.38Å; C146-C155 WeakPolarHBondContact SG-CB 2.78Å; C146-C155 CovalentContact SG-SG 2.04Å; C146-C155 PolarHBondContact SG-SG 2.75Å; W150-C155 HydrophobicContact CB-CB 4.48Å; W150-C155 VanDerWaalsContact CE3-O 3.25Å; Q151-C155 CarbonylContact O-C 3.54Å; Q151-C155 VanDerWaalsContact O-C 3.3Å; Q151-C155 WeakPolarHBondContact O-CA 3.3Å; G152-C155 PolarHBondContact O-N 2.76Å; G152-C155 VanDerWaalsContact O-N 3.15Å
156	D	93.3	Very high	94.7	Very high	95 Å²	95	66.2 Å²	66.2	51%	0.508	37%	0.371	S	S	.	.			trans	-89.7	-2.8	-175.3	58.5	-27.5	0	0	0	113.6	Q151 L154	Q151-D156 PolarHBondContact O-N 3.23Å; L154-D156 PolarHBondContact O-N 2.83Å
157	E	94.3	Very high	94.4	Very high	99 Å²	99	63.8 Å²	63.8	46%	0.463	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.5	175.6	-61.2	175.9	-160.4	0	0	110.5	W150 Q151	W150-E157 CarbonylContact C-O 3.43Å; W150-E157 VanDerWaalsContact CA-O 3.32Å; W150-E157 WeakPolarHBondContact CA-O 3.23Å; Q151-E157 HydrophobicContact CG-CB 3.78Å; Q151-E157 PolarHBondContact N-O 3.15Å; Q151-E157 WeakPolarHBondContact O-CB 3.45Å; Q151-E157 PolarHBondContact O-N 3.19Å
158	C	96	Very high	94.3	Very high	20 Å²	20	63.8 Å²	63.8	14%	0.135	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	147.3	170.6	55.8	0	0	0	0	110.9	W150 C169	W150-C158 HydrophobicContact CZ3-CB 4.45Å; C158-C169 HydrophobicContact CB-CB 3.88Å; C158-C169 WeakPolarHBondContact CB-SG 3.25Å; C158-C169 PolarHBondContact O-SG 3.12Å; C158-C169 VanDerWaalsContact SG-CA 3.54Å; C158-C169 WeakPolarHBondContact SG-CB 3.47Å; C158-C169 PolarHBondContact SG-O 2.87Å; C158-C169 CovalentContact SG-SG 2.03Å; C158-C169 PolarHBondContact SG-SG 3.12Å
159	I	96.4	Very high	94.2	Very high	52 Å²	52	57.8 Å²	57.8	27%	0.267	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-85.3	126.3	170.1	-60.6	174.6	0	0	0	108	G149 Q151 F174	G149-I159 PolarHBondContact O-N 2.67Å; Q151-I159 HydrophobicContact CB-CD1 4.2Å; Q151-I159 HydrophobicContact CB-CG1 3.81Å; Q151-I159 HydrophobicContact CG-CG1 3.85Å; I159-F174 HydrophobicContact CB-CD1 4.47Å; I159-F174 HydrophobicContact CB-CE1 4.12Å; I159-F174 HydrophobicContact CG2-CD1 4.2Å; I159-F174 HydrophobicContact CG2-CE1 3.85Å; I159-F174 WeakPolarHBondContact O-CA 3.3Å; I159-F174 PolarHBondContact O-N 2.81Å
160	K	95.3	Very high	93.7	Very high	87 Å²	87	64 Å²	64	38%	0.378	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-69.6	162.2	176.3	-50.1	-175.4	-154.3	-177.2	0	111.7	C164 G167 C169 T175	K160-C164 HydrophobicContact CB-CB 3.83Å; K160-C164 HydrophobicContact CD-CB 4.07Å; K160-G167 VanDerWaalsContact CD-O 3.3Å; K160-G167 WeakPolarHBondContact CD-O 3.05Å; K160-G167 VanDerWaalsContact CE-O 3.25Å; K160-G167 WeakPolarHBondContact CE-O 3.05Å; K160-G167 PolarHBondContact NZ-O 3.04Å; K160-C169 HydrophobicContact CG-CB 4.37Å; K160-T175 WeakPolarHBondContact CA-O 2.94Å
161	Y	93.5	Very high	93.2	Very high	119 Å²	119	66 Å²	66	47%	0.467	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-56.7	137.8	169	-164.3	-96	0	0	0	110.6	G163 C164 F174 T175 F186	Y161-G163 PolarHBondContact O-N 2.69Å; Y161-C164 WeakPolarHBondContact O-CB 3.1Å; Y161-C164 PolarHBondContact O-N 3.07Å; Y161-F174 WeakPolarHBondContact CD2-O 3.37Å; Y161-T175 PolarHBondContact N-O 3.28Å; Y161-F186 HydrophobicContact CD1-CD1 4.16Å; Y161-F186 AromaticContact CD1-CE1 3.69Å; Y161-F186 HydrophobicContact CD1-CE1 3.69Å; Y161-F186 HydrophobicContact CE1-CD1 4.48Å; Y161-F186 AromaticContact CE1-CE1 3.59Å; Y161-F186 HydrophobicContact CE1-CE1 3.59Å; Y161-F186 HydrophobicContact CE1-CZ 4.27Å
162	P	94.2	Very high	93.1	Very high	91 Å²	91	63.8 Å²	63.8	59%	0.591	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	129.6	178.5	-27.6	35.5	0	0	0	112.2	F186	P162-F186 WeakPolarHBondContact O-CD1 3.37Å; P162-F186 VanDerWaalsContact O-CE1 3.32Å; P162-F186 WeakPolarHBondContact O-CE1 3.41Å
163	G	92.2	Very high	93.1	Very high	54 Å²	54	64.2 Å²	64.2	56%	0.557	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-3.2	-176.4	0	0	0	0	0	115.2	Y161 E165	Y161-G163 PolarHBondContact O-N 2.69Å; G163-E165 PolarHBondContact O-N 3Å
164	C	92.6	Very high	93.2	Very high	17 Å²	17	63.6 Å²	63.6	12%	0.115	34%	0.344	C	S	.	.			trans	-66.4	101.2	176.1	-172.8	0	0	0	0	111.7	K160 Y161 G167 C176 F186	K160-C164 HydrophobicContact CB-CB 3.83Å; K160-C164 HydrophobicContact CD-CB 4.07Å; Y161-C164 WeakPolarHBondContact O-CB 3.1Å; Y161-C164 PolarHBondContact O-N 3.07Å; C164-G167 VanDerWaalsContact SG-CA 3.57Å; C164-C176 HydrophobicContact CB-CB 3.67Å; C164-C176 WeakPolarHBondContact CB-SG 3.37Å; C164-C176 VanDerWaalsContact SG-CA 3.58Å; C164-C176 WeakPolarHBondContact SG-CB 3.49Å; C164-C176 CovalentContact SG-SG 2.03Å; C164-C176 PolarHBondContact SG-SG 3.3Å; C164-F186 WeakPolarHBondContact CA-O 3.22Å
165	E	92	Very high	93.1	Very high	122 Å²	122	62.7 Å²	62.7	57%	0.57	34%	0.341	S	S	*	.	S	Bend	trans	-80.2	-65.2	-177.4	-61.3	-167.2	165.9	0	0	110.6	G163 F186	G163-E165 PolarHBondContact O-N 3Å; E165-F186 PolarHBondContact N-O 3.23Å
166	H	92	Very high	93	Very high	62 Å²	62	64 Å²	64	29%	0.287	35%	0.349	S	S	.	.	S	Bend	trans	-110.8	47.6	-173.5	-53.5	88.2	0	0	0	113.1	L179 W182 S187	H166-L179 WeakPolarHBondContact O-CB 3.31Å; H166-L179 VanDerWaalsContact O-CG 3.31Å; H166-L179 WeakPolarHBondContact O-CG 3.29Å; H166-L179 PolarHBondContact O-N 3.22Å; H166-W182 HydrophobicContact CB-CB 4.05Å; H166-W182 HydrophobicContact CB-CD2 3.38Å; H166-W182 HydrophobicContact CB-CE3 3.87Å; H166-W182 HydrophobicContact CB-CG 3.45Å; H166-W182 VanDerWaalsContact CB-CG 3.45Å; H166-W182 HydrophobicContact CB-CZ2 4.35Å; H166-W182 AromaticContact CD2-CE2 3.53Å; H166-W182 AromaticContact CD2-CH2 3.88Å; H166-W182 AromaticContact CD2-CZ2 3.41Å; H166-W182 VanDerWaalsContact CD2-CZ2 3.41Å; H166-W182 WeakPolarHBondContact CD2-CZ2 3.32Å; H166-W182 AromaticContact CD2-NE1 3.94Å; H166-W182 AromaticContact CE1-CH2 3.22Å; H166-W182 WeakPolarHBondContact CE1-CH2 3.12Å; H166-W182 AromaticContact CE1-CZ2 3.61Å; H166-W182 AromaticContact CE1-CZ3 3.52Å; H166-W182 AromaticContact CG-CD2 3.45Å; H166-W182 VanDerWaalsContact CG-CD2 3.45Å; H166-W182 AromaticContact CG-CE2 3.37Å; H166-W182 AromaticContact CG-CE3 3.67Å; H166-W182 AromaticContact CG-CH2 3.79Å; H166-W182 AromaticContact CG-CZ2 3.56Å; H166-W182 AromaticContact CG-CZ3 3.84Å; H166-W182 AromaticContact CG-NE1 3.9Å; H166-W182 AromaticContact ND1-CD2 3.72Å; H166-W182 AromaticContact ND1-CE2 3.82Å; H166-W182 AromaticContact ND1-CE3 3.41Å; H166-W182 AromaticContact ND1-CH2 3.37Å; H166-W182 WeakPolarHBondContact ND1-CH2 3.45Å; H166-W182 AromaticContact ND1-CZ2 3.67Å; H166-W182 AromaticContact ND1-CZ3 3.23Å; H166-W182 WeakPolarHBondContact ND1-CZ3 3.46Å; H166-W182 AromaticContact NE2-CH2 3.55Å; H166-W182 AromaticContact NE2-CZ2 3.46Å; H166-W182 WeakPolarHBondContact NE2-CZ2 3Å; H166-S187 WeakPolarHBondContact CB-O 3.3Å; H166-S187 PolarHBondContact N-O 3.24Å; H166-S187 PolarHBondContact ND1-O 3.47Å; H166-S187 VanDerWaalsContact ND1-O 3.07Å; H166-S187 VanDerWaalsContact O-CB 3.31Å; H166-S187 WeakPolarHBondContact O-CB 3.39Å
167	G	92.2	Very high	92.9	Very high	2 Å²	2	65.8 Å²	65.8	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	174.1	176.4	0	0	0	0	0	114.8	K160 C164 R177	K160-G167 VanDerWaalsContact CD-O 3.3Å; K160-G167 WeakPolarHBondContact CD-O 3.05Å; K160-G167 VanDerWaalsContact CE-O 3.25Å; K160-G167 WeakPolarHBondContact CE-O 3.05Å; K160-G167 PolarHBondContact NZ-O 3.04Å; C164-G167 VanDerWaalsContact SG-CA 3.57Å; G167-R177 CarbonylContact C-O 3.51Å; G167-R177 WeakPolarHBondContact CA-O 3.49Å
168	T	93.5	Very high	92.7	Very high	43 Å²	43	63.8 Å²	63.8	26%	0.264	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	170.3	177.9	69.5	0	0	0	0	111.7	C176 R177 L179	T168-C176 CarbonylContact O-C 3.39Å; T168-C176 WeakPolarHBondContact O-CA 3.3Å; T168-R177 PolarHBondContact N-O 3.37Å; T168-R177 PolarHBondContact O-N 2.03Å; T168-L179 HydrophobicContact CG2-CD2 3.77Å
169	C	94.3	Very high	92.4	Very high	6 Å²	6	66.4 Å²	66.4	4%	0.041	36%	0.358	C	S	.	.			trans	-128.4	22.7	180	51.6	0	0	0	0	113.7	C158 K160 D171 A172 T175	C158-C169 HydrophobicContact CB-CB 3.88Å; C158-C169 WeakPolarHBondContact CB-SG 3.25Å; C158-C169 PolarHBondContact O-SG 3.12Å; C158-C169 VanDerWaalsContact SG-CA 3.54Å; C158-C169 WeakPolarHBondContact SG-CB 3.47Å; C158-C169 PolarHBondContact SG-O 2.87Å; C158-C169 CovalentContact SG-SG 2.03Å; C158-C169 PolarHBondContact SG-SG 3.12Å; K160-C169 HydrophobicContact CG-CB 4.37Å; C169-D171 PolarHBondContact O-N 2.78Å; C169-A172 CarbonylContact O-C 3.59Å; C169-A172 PolarHBondContact O-N 2.96Å; C169-T175 VanDerWaalsContact CA-OG1 3.25Å; C169-T175 WeakPolarHBondContact CA-OG1 3.04Å
170	N	86.2	Confident	92	Very high	133 Å²	133	69 Å²	69	71%	0.711	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.9	-165.5	-61.7	-4.8	0	0	0	114.8
171	D	86.5	Confident	91.6	Very high	114 Å²	114	70.3 Å²	70.3	61%	0.61	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-34.6	-179.6	-49.7	-36.1	0	0	0	112.8	C169 R177	C169-D171 PolarHBondContact O-N 2.78Å; D171-R177 IonicContact OD2-CZ 3.95Å; D171-R177 IonicContact OD2-NE 3.41Å; D171-R177 PolarHBondContact OD2-NE 2.84Å; D171-R177 IonicContact OD2-NH2 2.59Å; D171-R177 PolarHBondContact OD2-NH2 2.03Å; D171-R177 VanDerWaalsContact OD2-NH2 3.13Å
172	A	91.7	Very high	91.3	Very high	42 Å²	42	68 Å²	68	35%	0.347	38%	0.38	S	S	.	.	S	Bend	trans	-168.2	149.2	-175.6	0	0	0	0	0	111.7	C169 T175	C169-A172 CarbonylContact O-C 3.59Å; C169-A172 PolarHBondContact O-N 2.96Å; A172-T175 HydrophobicContact CB-CG2 4Å; A172-T175 WeakPolarHBondContact O-CB 3.36Å; A172-T175 WeakPolarHBondContact O-CG2 3Å; A172-T175 PolarHBondContact O-OG1 3.13Å
173	P	95	Very high	90.7	Very high	37 Å²	37	64 Å²	64	24%	0.24	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	150.3	169.7	-29.4	37.2	0	0	0	114.2	G149 W150 T175	G149-P173 WeakPolarHBondContact O-CB 3.25Å; W150-P173 HydrophobicContact CD2-CG 4.41Å; W150-P173 HydrophobicContact CZ2-CG 4.07Å; P173-T175 PolarHBondContact O-N 2.96Å
174	F	95.1	Very high	90.2	Very high	91 Å²	91	62.8 Å²	62.8	40%	0.399	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	32.5	179.7	-50.9	-65.2	0	0	0	114	T148 I159 Y161	T148-F174 HydrophobicContact CG2-CE2 4.04Å; T148-F174 HydrophobicContact CG2-CZ 4.09Å; I159-F174 HydrophobicContact CB-CD1 4.47Å; I159-F174 HydrophobicContact CB-CE1 4.12Å; I159-F174 HydrophobicContact CG2-CD1 4.2Å; I159-F174 HydrophobicContact CG2-CE1 3.85Å; I159-F174 WeakPolarHBondContact O-CA 3.3Å; I159-F174 PolarHBondContact O-N 2.81Å; Y161-F174 WeakPolarHBondContact CD2-O 3.37Å
175	T	93.4	Very high	89.7	Confident	30 Å²	30	67 Å²	67	18%	0.184	37%	0.371	C	S	.	.			trans	-105	163.1	169.1	62.1	0	0	0	0	111	K160 Y161 C169 A172 P173	K160-T175 WeakPolarHBondContact CA-O 2.94Å; Y161-T175 PolarHBondContact N-O 3.28Å; C169-T175 VanDerWaalsContact CA-OG1 3.25Å; C169-T175 WeakPolarHBondContact CA-OG1 3.04Å; A172-T175 HydrophobicContact CB-CG2 4Å; A172-T175 WeakPolarHBondContact O-CB 3.36Å; A172-T175 WeakPolarHBondContact O-CG2 3Å; A172-T175 PolarHBondContact O-OG1 3.13Å; P173-T175 PolarHBondContact O-N 2.96Å
176	C	93.3	Very high	89.4	Confident	27 Å²	27	65 Å²	65	18%	0.182	36%	0.361	C	S	.	.			trans	-138.4	94.1	173.9	-171.6	0	0	0	0	108.9	C164 T168 S187	C164-C176 HydrophobicContact CB-CB 3.67Å; C164-C176 WeakPolarHBondContact CB-SG 3.37Å; C164-C176 VanDerWaalsContact SG-CA 3.58Å; C164-C176 WeakPolarHBondContact SG-CB 3.49Å; C164-C176 CovalentContact SG-SG 2.03Å; C164-C176 PolarHBondContact SG-SG 3.3Å; T168-C176 CarbonylContact O-C 3.39Å; T168-C176 WeakPolarHBondContact O-CA 3.3Å; C176-S187 PolarHBondContact SG-OG 2.83Å
177	R	90.9	Very high	89	Confident	134 Å²	134	62 Å²	62	51%	0.506	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	110	175.2	-60.1	-57.3	-168.2	-162.9	-1.5	108.3	G167 T168 D171 L179	G167-R177 CarbonylContact C-O 3.51Å; G167-R177 WeakPolarHBondContact CA-O 3.49Å; T168-R177 PolarHBondContact N-O 3.37Å; T168-R177 PolarHBondContact O-N 2.03Å; D171-R177 IonicContact OD2-CZ 3.95Å; D171-R177 IonicContact OD2-NE 3.41Å; D171-R177 PolarHBondContact OD2-NE 2.84Å; D171-R177 IonicContact OD2-NH2 2.59Å; D171-R177 PolarHBondContact OD2-NH2 2.03Å; D171-R177 VanDerWaalsContact OD2-NH2 3.13Å; R177-L179 PolarHBondContact O-N 3.01Å
178	C	89.5	Confident	88.6	Confident	56 Å²	56	65.6 Å²	65.6	38%	0.378	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	133.9	-177.7	-55.5	0	0	0	0	110.7	W182 S187	C178-W182 HydrophobicContact CB-CB 4.46Å; C178-W182 VanDerWaalsContact CB-O 3.3Å; C178-W182 WeakPolarHBondContact CB-O 3.23Å; C178-S187 VanDerWaalsContact CA-OG 3.3Å; C178-S187 WeakPolarHBondContact CA-OG 3.31Å; C178-S187 PolarHBondContact SG-OG 2.97Å
179	L	90.1	Very high	88	Confident	76 Å²	76	68.2 Å²	68.2	40%	0.398	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-65.1	160.4	168.8	-68.4	172.7	0	0	0	110	H166 T168 R177 N181 W182	H166-L179 WeakPolarHBondContact O-CB 3.31Å; H166-L179 VanDerWaalsContact O-CG 3.31Å; H166-L179 WeakPolarHBondContact O-CG 3.29Å; H166-L179 PolarHBondContact O-N 3.22Å; T168-L179 HydrophobicContact CG2-CD2 3.77Å; R177-L179 PolarHBondContact O-N 3.01Å; L179-N181 PolarHBondContact O-N 3.37Å; L179-W182 PolarHBondContact O-N 3.01Å
180	P	88.3	Confident	87.4	Confident	106 Å²	106	72.9 Å²	72.9	69%	0.688	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	139.1	172.5	-26.6	35.1	0	0	0	111.7	W182	P180-W182 PolarHBondContact O-N 3.24Å
181	N	87	Confident	86.6	Confident	114 Å²	114	73.8 Å²	73.8	61%	0.61	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	12.9	-176.1	-45.5	-38.6	0	0	0	115.6	L179 I190 W191	L179-N181 PolarHBondContact O-N 3.37Å; N181-I190 CarbonylContact O-C 3.58Å; N181-W191 WeakPolarHBondContact CA-O 3.34Å; N181-W191 PolarHBondContact O-N 2.74Å
182	W	87.9	Confident	85.6	Confident	72 Å²	72	73.7 Å²	73.7	27%	0.273	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	158.1	171.8	-68.2	91.4	0	0	0	111.3	H166 C178 L179 P180 Q189 I190	H166-W182 HydrophobicContact CB-CB 4.05Å; H166-W182 HydrophobicContact CB-CD2 3.38Å; H166-W182 HydrophobicContact CB-CE3 3.87Å; H166-W182 HydrophobicContact CB-CG 3.45Å; H166-W182 VanDerWaalsContact CB-CG 3.45Å; H166-W182 HydrophobicContact CB-CZ2 4.35Å; H166-W182 AromaticContact CD2-CE2 3.53Å; H166-W182 AromaticContact CD2-CH2 3.88Å; H166-W182 AromaticContact CD2-CZ2 3.41Å; H166-W182 VanDerWaalsContact CD2-CZ2 3.41Å; H166-W182 WeakPolarHBondContact CD2-CZ2 3.32Å; H166-W182 AromaticContact CD2-NE1 3.94Å; H166-W182 AromaticContact CE1-CH2 3.22Å; H166-W182 WeakPolarHBondContact CE1-CH2 3.12Å; H166-W182 AromaticContact CE1-CZ2 3.61Å; H166-W182 AromaticContact CE1-CZ3 3.52Å; H166-W182 AromaticContact CG-CD2 3.45Å; H166-W182 VanDerWaalsContact CG-CD2 3.45Å; H166-W182 AromaticContact CG-CE2 3.37Å; H166-W182 AromaticContact CG-CE3 3.67Å; H166-W182 AromaticContact CG-CH2 3.79Å; H166-W182 AromaticContact CG-CZ2 3.56Å; H166-W182 AromaticContact CG-CZ3 3.84Å; H166-W182 AromaticContact CG-NE1 3.9Å; H166-W182 AromaticContact ND1-CD2 3.72Å; H166-W182 AromaticContact ND1-CE2 3.82Å; H166-W182 AromaticContact ND1-CE3 3.41Å; H166-W182 AromaticContact ND1-CH2 3.37Å; H166-W182 WeakPolarHBondContact ND1-CH2 3.45Å; H166-W182 AromaticContact ND1-CZ2 3.67Å; H166-W182 AromaticContact ND1-CZ3 3.23Å; H166-W182 WeakPolarHBondContact ND1-CZ3 3.46Å; H166-W182 AromaticContact NE2-CH2 3.55Å; H166-W182 AromaticContact NE2-CZ2 3.46Å; H166-W182 WeakPolarHBondContact NE2-CZ2 3Å; C178-W182 HydrophobicContact CB-CB 4.46Å; C178-W182 VanDerWaalsContact CB-O 3.3Å; C178-W182 WeakPolarHBondContact CB-O 3.23Å; L179-W182 PolarHBondContact O-N 3.01Å; P180-W182 PolarHBondContact O-N 3.24Å; W182-Q189 CarbonylContact C-O 3.53Å; W182-Q189 VanDerWaalsContact CA-O 3.32Å; W182-Q189 WeakPolarHBondContact CA-O 3.49Å; W182-I190 HydrophobicContact CE3-CB 4.44Å; W182-I190 HydrophobicContact CH2-CB 4.47Å; W182-I190 HydrophobicContact CH2-CD1 4.43Å; W182-I190 HydrophobicContact CH2-CG1 4.43Å; W182-I190 HydrophobicContact CZ2-CD1 4.34Å; W182-I190 HydrophobicContact CZ2-CG1 4.39Å; W182-I190 HydrophobicContact CZ3-CB 4.24Å
183	G	80.7	Confident	83.9	Confident	7 Å²	7	77.9 Å²	77.9	7%	0.072	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	-164	178.2	0	0	0	0	0	111.8	S187 D188 Q189	G183-S187 CarbonylContact O-C 3.48Å; G183-S187 VanDerWaalsContact O-CA 3.29Å; G183-S187 WeakPolarHBondContact O-CA 3.32Å; G183-D188 PolarHBondContact O-N 3.04Å; G183-Q189 PolarHBondContact N-O 2.92Å; G183-Q189 WeakPolarHBondContact O-CB 3.37Å; G183-Q189 PolarHBondContact O-N 3.41Å
184	G	82.5	Confident	81.9	Confident	28 Å²	28	81.3 Å²	81.3	29%	0.289	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	165.6	-157.9	0	0	0	0	0	111.3	F186 S187	G184-F186 PolarHBondContact O-N 3.39Å; G184-S187 PolarHBondContact O-N 2.84Å
185	S	81.7	Confident	79.7	Confident	104 Å²	104	83.3 Å²	83.3	73%	0.727	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.3	-177.1	-60.8	0	0	0	0	113.6
186	F	85.8	Confident	77.6	Confident	81 Å²	81	89.6 Å²	89.6	36%	0.355	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	8.8	-176.7	-62.1	-76.2	0	0	0	113	Y161 P162 C164 E165 G184 D188	Y161-F186 HydrophobicContact CD1-CD1 4.16Å; Y161-F186 AromaticContact CD1-CE1 3.69Å; Y161-F186 HydrophobicContact CD1-CE1 3.69Å; Y161-F186 HydrophobicContact CE1-CD1 4.48Å; Y161-F186 AromaticContact CE1-CE1 3.59Å; Y161-F186 HydrophobicContact CE1-CE1 3.59Å; Y161-F186 HydrophobicContact CE1-CZ 4.27Å; P162-F186 WeakPolarHBondContact O-CD1 3.37Å; P162-F186 VanDerWaalsContact O-CE1 3.32Å; P162-F186 WeakPolarHBondContact O-CE1 3.41Å; C164-F186 WeakPolarHBondContact CA-O 3.22Å; E165-F186 PolarHBondContact N-O 3.23Å; G184-F186 PolarHBondContact O-N 3.39Å; F186-D188 HydrophobicContact CB-CB 4.4Å; F186-D188 PolarHBondContact O-N 3.07Å
187	S	83.3	Confident	75.5	Confident	0 Å²	0	94.9 Å²	94.9	0%	0	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	41	-173.2	-49.2	0	0	0	0	112.7	H166 C176 C178 G183 G184	H166-S187 WeakPolarHBondContact CB-O 3.3Å; H166-S187 PolarHBondContact N-O 3.24Å; H166-S187 PolarHBondContact ND1-O 3.47Å; H166-S187 VanDerWaalsContact ND1-O 3.07Å; H166-S187 VanDerWaalsContact O-CB 3.31Å; H166-S187 WeakPolarHBondContact O-CB 3.39Å; C176-S187 PolarHBondContact SG-OG 2.83Å; C178-S187 VanDerWaalsContact CA-OG 3.3Å; C178-S187 WeakPolarHBondContact CA-OG 3.31Å; C178-S187 PolarHBondContact SG-OG 2.97Å; G183-S187 CarbonylContact O-C 3.48Å; G183-S187 VanDerWaalsContact O-CA 3.29Å; G183-S187 WeakPolarHBondContact O-CA 3.32Å; G184-S187 PolarHBondContact O-N 2.84Å
188	D	84.3	Confident	72.9	Confident	77 Å²	77	95.9 Å²	95.9	41%	0.412	51%	0.513	S	S	.	.			trans	-100.8	-10.4	-177.6	59.2	-41	0	0	0	112.4	G183 F186	G183-D188 PolarHBondContact O-N 3.04Å; F186-D188 HydrophobicContact CB-CB 4.4Å; F186-D188 PolarHBondContact O-N 3.07Å
189	Q	81.2	Confident	70.7	Confident	98 Å²	98	102.9 Å²	102.9	46%	0.458	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.4	-179.2	-56.5	178.8	-16.2	0	0	110.6	W182 G183 W191	W182-Q189 CarbonylContact C-O 3.53Å; W182-Q189 VanDerWaalsContact CA-O 3.32Å; W182-Q189 WeakPolarHBondContact CA-O 3.49Å; G183-Q189 PolarHBondContact N-O 2.92Å; G183-Q189 WeakPolarHBondContact O-CB 3.37Å; G183-Q189 PolarHBondContact O-N 3.41Å; Q189-W191 PolarHBondContact O-N 3.36Å
190	I	81.6	Confident	68.4	Low	103 Å²	103	109.3 Å²	109.3	53%	0.528	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.2	119	173.5	-150.7	168.5	0	0	0	109.2	N181 W182 I192	N181-I190 CarbonylContact O-C 3.58Å; W182-I190 HydrophobicContact CE3-CB 4.44Å; W182-I190 HydrophobicContact CH2-CB 4.47Å; W182-I190 HydrophobicContact CH2-CD1 4.43Å; W182-I190 HydrophobicContact CH2-CG1 4.43Å; W182-I190 HydrophobicContact CZ2-CD1 4.34Å; W182-I190 HydrophobicContact CZ2-CG1 4.39Å; W182-I190 HydrophobicContact CZ3-CB 4.24Å; I190-I192 HydrophobicContact CD1-CD1 4.1Å; I190-I192 HydrophobicContact CD1-CG1 4.11Å; I190-I192 HydrophobicContact CG1-CD1 4.42Å; I190-I192 HydrophobicContact CG1-CG1 3.93Å; I190-I192 HydrophobicContact CG2-CD1 4.32Å; I190-I192 HydrophobicContact CG2-CG1 4.16Å; I190-I192 PolarHBondContact O-N 3.45Å
191	W	67.8	Low	67.4	Low	152 Å²	152	109.5 Å²	109.5	58%	0.576	58%	0.577	S	S	*	*			trans	-94	74.7	170.1	-68	73.4	0	0	0	107.8	N181 Q189 I193	N181-W191 WeakPolarHBondContact CA-O 3.34Å; N181-W191 PolarHBondContact O-N 2.74Å; Q189-W191 PolarHBondContact O-N 3.36Å; W191-I193 PolarHBondContact O-N 3.36Å
192	I	66.5	Low	66.4	Low	113 Å²	113	109.3 Å²	109.3	58%	0.579	58%	0.575	S	S	*	*			trans	-80.5	109.9	156.5	-46.9	174.6	0	0	0	104.1	I190 V194	I190-I192 HydrophobicContact CD1-CD1 4.1Å; I190-I192 HydrophobicContact CD1-CG1 4.11Å; I190-I192 HydrophobicContact CG1-CD1 4.42Å; I190-I192 HydrophobicContact CG1-CG1 3.93Å; I190-I192 HydrophobicContact CG2-CD1 4.32Å; I190-I192 HydrophobicContact CG2-CG1 4.16Å; I190-I192 PolarHBondContact O-N 3.45Å; I192-V194 VanDerWaalsContact C-N 3.27Å; I192-V194 PolarHBondContact O-N 2.78Å
193	I	56.9	Low	65.2	Low	130 Å²	130	111.3 Å²	111.3	67%	0.667	59%	0.592	S	S	*	*			trans	-63	105.6	156.2	-33.8	176.3	0	0	0	103.6	W191 D195	W191-I193 PolarHBondContact O-N 3.36Å; I193-D195 HydrophobicContact CB-CB 4.48Å; I193-D195 HydrophobicContact CG2-CB 3.99Å; I193-D195 VanDerWaalsContact CG2-CG 3.43Å; I193-D195 WeakPolarHBondContact CG2-OD2 3.33Å; I193-D195 PolarHBondContact O-N 2.96Å
194	V	52.3	Low	64.3	Low	109 Å²	109	117.5 Å²	117.5	66%	0.661	62%	0.623	S	S	*	*			trans	-68.4	66.9	165.7	-88.2	0	0	0	0	107.9	I192	I192-V194 VanDerWaalsContact C-N 3.27Å; I192-V194 PolarHBondContact O-N 2.78Å
195	D	48.7	Very low	63.2	Low	133 Å²	133	123.1 Å²	123.1	71%	0.711	64%	0.643	S	S	*	*			trans	-102.5	10.6	170.9	-85	-3.1	0	0	0	111.9	I193	I193-D195 HydrophobicContact CB-CB 4.48Å; I193-D195 HydrophobicContact CG2-CB 3.99Å; I193-D195 VanDerWaalsContact CG2-CG 3.43Å; I193-D195 WeakPolarHBondContact CG2-OD2 3.33Å; I193-D195 PolarHBondContact O-N 2.96Å
196	D	50.3	Low	61.9	Low	162 Å²	162	124.3 Å²	124.3	87%	0.866	64%	0.638	S	S	*	*	S	Bend	trans	-127.6	15.9	178.2	-95.6	-29.5	0	0	0	115.6
197	I	47.8	Very low	60.2	Low	137 Å²	137	127.4 Å²	127.4	70%	0.703	66%	0.658	S	S	*	*	S	Bend	trans	-134.6	39.8	179.4	-37.6	178.9	0	0	0	114
198	N	37.7	Very low	58.5	Low	155 Å²	155	137.2 Å²	137.2	83%	0.829	71%	0.709	S	S	*	*			trans	-154.1	61.8	162	-90.1	-35.9	0	0	0	112.7
199	H	43.3	Very low	56.3	Low	204 Å²	204	142.3 Å²	142.3	94%	0.944	73%	0.733	S	S	*	*			trans	-136.7	72.7	150.3	-80	-52.6	0	0	0	108.9
200	V	41.7	Very low	54	Low	211 Å²	211	146.3 Å²	146.3	100%	1.279	76%	0.758	S	S	*	*			trans	-77.5	0	147.3	176.7	0	0	0	0	107.6

Retrieved 200 of 200 residues in 176.5 ms (Link to these results)

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