A0A075B727_HUMAN Loading...

Platelet endothelial cell adhesion molecule

AlphaFold DB , UniProt , Accession A0A075B727, Species HUMAN (Homo sapiens, Human), Gene PECAM1, Length 230 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.5	Very low	47.3	Very low	245 Å²	245	148 Å²	148	100%	1.207	76%	0.759	S	S	*	*				0	148.2	0	-88.2	167.6	160	0	0	108.2
2	Q	36	Very low	48.1	Very low	193 Å²	193	152.2 Å²	152.2	90%	0.902	76%	0.758	S	S	*	*			trans	85.1	141.7	-178.2	-81.1	179.2	-21.4	0	0	117.4
3	P	44	Very low	48.9	Very low	111 Å²	111	148.8 Å²	148.8	72%	0.721	74%	0.743	S	S	*	*				-126.1	141.4	-95.5	25.4	-5.4	0	0	0	113.8	W5	P3-W5 VanDerWaalsContact C-N 3.33Å; P3-W5 PolarHBondContact O-N 3.33Å; P3-W5 VanDerWaalsContact O-N 3.1Å
4	R	44.2	Very low	49.8	Very low	250 Å²	250	140.8 Å²	140.8	94%	0.943	72%	0.717	S	S	*	*			trans	-73.1	84.7	158.6	-85.7	178.4	149.6	-168.1	-5	108.6
5	W	50.2	Low	50.7	Low	248 Å²	248	136.7 Å²	136.7	94%	0.939	70%	0.701	S	S	*	*			trans	-154.1	86.9	165.4	-97.3	5.4	0	0	0	108.7	P3	P3-W5 VanDerWaalsContact C-N 3.33Å; P3-W5 PolarHBondContact O-N 3.33Å; P3-W5 VanDerWaalsContact O-N 3.1Å
6	A	47.2	Very low	51.3	Low	77 Å²	77	134.8 Å²	134.8	64%	0.636	69%	0.692	S	S	*	*	S	Bend	trans	-153.6	-8.3	170.8	0	0	0	0	0	114.9
7	Q	48.7	Very low	51.8	Low	168 Å²	168	132.7 Å²	132.7	79%	0.785	68%	0.682	S	S	*	*	S	Bend	trans	-103.5	-21.8	-175.6	-75.3	179.1	-23.1	0	0	114.6	T10	Q7-T10 PolarHBondContact O-OG1 2.94Å
8	G	47	Very low	52.3	Low	44 Å²	44	130.2 Å²	130.2	45%	0.454	67%	0.674	S	S	.	*	H	α-helix	trans	-77	-33.5	175	0	0	0	0	0	113.1	W12	G8-W12 PolarHBondContact O-N 3.27Å
9	A	52.5	Low	52.6	Low	61 Å²	61	129.4 Å²	129.4	50%	0.504	67%	0.671	S	S	.	*	H	α-helix	trans	-69.4	-41.4	-174.9	0	0	0	0	0	112.7	W12 L13	A9-W12 PolarHBondContact O-N 3.27Å; A9-L13 WeakPolarHBondContact O-CB 3.36Å; A9-L13 WeakPolarHBondContact O-CD1 3.42Å; A9-L13 PolarHBondContact O-N 2.98Å
10	T	53.4	Low	52.9	Low	96 Å²	96	128.6 Å²	128.6	59%	0.589	67%	0.666	S	S	*	*	H	α-helix	trans	-67.3	-36.5	179.5	45.2	0	0	0	0	112.6	Q7 G14	Q7-T10 PolarHBondContact O-OG1 2.94Å; T10-G14 PolarHBondContact O-N 2.93Å
11	M	55.2	Low	53.1	Low	135 Å²	135	128.5 Å²	128.5	67%	0.665	67%	0.667	S	S	*	*	H	α-helix	trans	-68.5	-38.2	177.5	-140.8	-162.3	-54.7	0	0	111.5	V15	M11-V15 WeakPolarHBondContact O-CG2 3.42Å; M11-V15 PolarHBondContact O-N 3.45Å
12	W	56.7	Low	53.7	Low	198 Å²	198	121.7 Å²	121.7	75%	0.75	64%	0.642	S	S	*	*	H	α-helix	trans	-75.4	-35.6	178.6	-73.6	41.8	0	0	0	112.2	G8 A9 V15 L16	G8-W12 PolarHBondContact O-N 3.27Å; A9-W12 PolarHBondContact O-N 3.27Å; W12-V15 PolarHBondContact O-N 2.83Å; W12-L16 WeakPolarHBondContact O-CB 3.12Å; W12-L16 PolarHBondContact O-N 2.88Å
13	L	58.8	Low	54.6	Low	108 Å²	108	116.8 Å²	116.8	57%	0.565	63%	0.629	S	S	*	*	H	α-helix	trans	-64	-39.8	172.3	-95.2	142.9	0	0	0	112.1	A9 L16 L17	A9-L13 WeakPolarHBondContact O-CB 3.36Å; A9-L13 WeakPolarHBondContact O-CD1 3.42Å; A9-L13 PolarHBondContact O-N 2.98Å; L13-L16 PolarHBondContact O-N 3.03Å; L13-L17 PolarHBondContact O-N 3.29Å
14	G	61.3	Low	55.1	Low	37 Å²	37	116.1 Å²	116.1	38%	0.381	63%	0.627	S	S	.	*	H	α-helix	trans	-63.6	-43.3	174.3	0	0	0	0	0	112.6	T10 L17 T18	T10-G14 PolarHBondContact O-N 2.93Å; G14-L17 PolarHBondContact O-N 2.79Å; G14-T18 WeakPolarHBondContact O-CG2 3.45Å; G14-T18 PolarHBondContact O-N 2.83Å; G14-T18 PolarHBondContact O-OG1 2.9Å
15	V	62.5	Low	55.4	Low	79 Å²	79	112 Å²	112	48%	0.479	62%	0.623	S	S	.	*	H	α-helix	trans	-66.6	-41.5	176.8	173.2	0	0	0	0	111.6	M11 W12 L17 T18 L19	M11-V15 WeakPolarHBondContact O-CG2 3.42Å; M11-V15 PolarHBondContact O-N 3.45Å; W12-V15 PolarHBondContact O-N 2.83Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.46Å; V15-T18 WeakPolarHBondContact CA-OG1 3.37Å; V15-T18 PolarHBondContact O-N 2.82Å; V15-T18 PolarHBondContact O-OG1 2.67Å; V15-L19 HydrophobicContact CG1-CD1 3.85Å; V15-L19 WeakPolarHBondContact O-CG 3.28Å; V15-L19 PolarHBondContact O-N 2.83Å
16	L	60.5	Low	55.7	Low	106 Å²	106	108.8 Å²	108.8	56%	0.555	62%	0.618	S	S	*	*	H	α-helix	trans	-61.6	-41.8	174.3	-117.1	99.3	0	0	0	111.7	W12 L13 L19 L20	W12-L16 WeakPolarHBondContact O-CB 3.12Å; W12-L16 PolarHBondContact O-N 2.88Å; L13-L16 PolarHBondContact O-N 3.03Å; L16-L19 PolarHBondContact O-N 3.4Å; L16-L20 WeakPolarHBondContact O-CB 3.48Å; L16-L20 WeakPolarHBondContact O-CD1 3.28Å; L16-L20 WeakPolarHBondContact O-CG 3.42Å; L16-L20 PolarHBondContact O-N 2.63Å
17	L	60.3	Low	55.9	Low	100 Å²	100	108 Å²	108	52%	0.524	62%	0.618	S	S	.	*	H	α-helix	trans	-62.2	-43.7	175.1	-113.3	83.6	0	0	0	111.3	L13 G14 V15 L19 L20 L21	L13-L17 PolarHBondContact O-N 3.29Å; G14-L17 PolarHBondContact O-N 2.79Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.46Å; L17-L19 VanDerWaalsContact C-N 3.34Å; L17-L19 PolarHBondContact O-N 2.64Å; L17-L20 PolarHBondContact O-N 2.95Å; L17-L21 WeakPolarHBondContact O-CD1 3.23Å; L17-L21 PolarHBondContact O-N 3.14Å
18	T	60.5	Low	56.3	Low	87 Å²	87	107.9 Å²	107.9	53%	0.534	62%	0.617	S	S	.	*	H	α-helix	trans	-66	-34.8	177.7	53.2	0	0	0	0	113.1	G14 V15 L21 C22	G14-T18 WeakPolarHBondContact O-CG2 3.45Å; G14-T18 PolarHBondContact O-N 2.83Å; G14-T18 PolarHBondContact O-OG1 2.9Å; V15-T18 WeakPolarHBondContact CA-OG1 3.37Å; V15-T18 PolarHBondContact O-N 2.82Å; V15-T18 PolarHBondContact O-OG1 2.67Å; T18-L21 PolarHBondContact O-N 2.84Å; T18-C22 PolarHBondContact O-N 2.94Å; T18-C22 VanDerWaalsContact O-N 3.11Å
19	L	59	Low	57.2	Low	116 Å²	116	114.4 Å²	114.4	61%	0.607	64%	0.636	S	S	*	*	H	α-helix	trans	-70.2	-36.6	174.4	-77.6	159	0	0	0	112	V15 L16 L17 C22 S23	V15-L19 HydrophobicContact CG1-CD1 3.85Å; V15-L19 WeakPolarHBondContact O-CG 3.28Å; V15-L19 PolarHBondContact O-N 2.83Å; L16-L19 PolarHBondContact O-N 3.4Å; L17-L19 VanDerWaalsContact C-N 3.34Å; L17-L19 PolarHBondContact O-N 2.64Å; L19-C22 PolarHBondContact O-N 2.99Å; L19-S23 PolarHBondContact O-N 2.94Å
20	L	58.3	Low	58.4	Low	112 Å²	112	115.4 Å²	115.4	59%	0.586	63%	0.633	S	S	*	*	H	α-helix	trans	-68.5	-32.6	173.6	-82.1	156.8	0	0	0	112.9	L16 L17 S23	L16-L20 WeakPolarHBondContact O-CB 3.48Å; L16-L20 WeakPolarHBondContact O-CD1 3.28Å; L16-L20 WeakPolarHBondContact O-CG 3.42Å; L16-L20 PolarHBondContact O-N 2.63Å; L17-L20 PolarHBondContact O-N 2.95Å; L20-S23 PolarHBondContact O-OG 2.85Å
21	L	56.4	Low	59.9	Low	128 Å²	128	113.6 Å²	113.6	67%	0.67	62%	0.624	S	S	*	*	H	α-helix	trans	-78.9	-18.9	173.7	-86.5	95.6	0	0	0	113.4	L17 T18	L17-L21 WeakPolarHBondContact O-CD1 3.23Å; L17-L21 PolarHBondContact O-N 3.14Å; T18-L21 PolarHBondContact O-N 2.84Å
22	C	55.8	Low	61.5	Low	101 Å²	101	108.4 Å²	108.4	68%	0.682	60%	0.598	S	S	*	*	H	α-helix	trans	-89.1	-12.1	176.4	-87.6	0	0	0	0	114.2	T18 L19 S24	T18-C22 PolarHBondContact O-N 2.94Å; T18-C22 VanDerWaalsContact O-N 3.11Å; L19-C22 PolarHBondContact O-N 2.99Å; C22-S24 PolarHBondContact O-N 2.73Å
23	S	55	Low	63.1	Low	91 Å²	91	102.2 Å²	102.2	64%	0.636	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-2.4	-178.1	36.7	0	0	0	0	115.4	L19 L20	L19-S23 PolarHBondContact O-N 2.94Å; L20-S23 PolarHBondContact O-OG 2.85Å
24	S	54.7	Low	64.9	Low	96 Å²	96	98 Å²	98	67%	0.671	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	13.1	-177.9	69.6	0	0	0	0	115	C22 E26	C22-S24 PolarHBondContact O-N 2.73Å; S24-E26 PolarHBondContact O-N 2.66Å; S24-E26 VanDerWaalsContact O-N 3.09Å
25	L	50.6	Low	66.5	Low	164 Å²	164	99.2 Å²	99.2	86%	0.859	56%	0.557	S	S	*	*			trans	-83.8	68.3	165.3	-130.9	81.5	0	0	0	108.6	G27	L25-G27 VanDerWaalsContact C-N 3.34Å; L25-G27 PolarHBondContact O-N 2.56Å
26	E	54.7	Low	68.2	Low	180 Å²	180	97.4 Å²	97.4	84%	0.841	55%	0.548	S	S	*	.			trans	-60.9	104.1	160.6	-80.1	174.8	155	0	0	106.2	S24 Q28	S24-E26 PolarHBondContact O-N 2.66Å; S24-E26 VanDerWaalsContact O-N 3.09Å; E26-Q28 PolarHBondContact O-N 2.65Å
27	G	52.1	Low	69.9	Low	62 Å²	62	92.9 Å²	92.9	64%	0.639	53%	0.525	S	S	*	.			trans	-56.1	113.7	170.9	0	0	0	0	0	107.3	L25 E29	L25-G27 VanDerWaalsContact C-N 3.34Å; L25-G27 PolarHBondContact O-N 2.56Å; G27-E29 VanDerWaalsContact C-N 3.32Å; G27-E29 PolarHBondContact O-N 3.04Å
28	Q	57.2	Low	71.7	Confident	164 Å²	164	91.8 Å²	91.8	77%	0.766	52%	0.52	S	S	*	.			trans	-64.9	96.9	176.5	-174.9	162.7	-4.3	0	0	107.8	E26 N30	E26-Q28 PolarHBondContact O-N 2.65Å; Q28-N30 PolarHBondContact O-N 3.5Å; Q28-N30 VanDerWaalsContact O-N 3.16Å
29	E	67	Low	73.5	Confident	182 Å²	182	88 Å²	88	85%	0.85	50%	0.496	S	S	*	.			trans	-64.3	117.2	175.7	-76.3	-167.8	163.5	0	0	108.4	G27 S31	G27-E29 VanDerWaalsContact C-N 3.32Å; G27-E29 PolarHBondContact O-N 3.04Å; E29-S31 PolarHBondContact O-N 2.85Å; E29-S31 VanDerWaalsContact O-N 3.13Å
30	N	76.9	Confident	75.4	Confident	82 Å²	82	87.8 Å²	87.8	44%	0.439	49%	0.49	S	S	.	.			trans	-64.5	115.8	174.5	-74.1	-39.5	0	0	0	109	Q28 F32 S65	Q28-N30 PolarHBondContact O-N 3.5Å; Q28-N30 VanDerWaalsContact O-N 3.16Å; N30-F32 HydrophobicContact CB-CE2 3.76Å; N30-F32 HydrophobicContact CB-CZ 4.18Å; N30-F32 WeakPolarHBondContact O-CD2 3.34Å; N30-F32 WeakPolarHBondContact O-CE2 3.21Å; N30-S65 PolarHBondContact ND2-OG 2.8Å; N30-S65 WeakPolarHBondContact OD1-CA 3.32Å
31	S	84.5	Confident	77.3	Confident	57 Å²	57	82.7 Å²	82.7	40%	0.399	46%	0.464	S	S	.	.			trans	-87.1	146	175.3	71.9	0	0	0	0	110.6	E29 T63 T64	E29-S31 PolarHBondContact O-N 2.85Å; E29-S31 VanDerWaalsContact O-N 3.13Å; S31-T63 VanDerWaalsContact O-CA 3.27Å; S31-T63 WeakPolarHBondContact O-CA 3.31Å; S31-T63 PolarHBondContact O-OG1 2.83Å; S31-T64 PolarHBondContact N-OG1 2.88Å; S31-T64 PolarHBondContact O-N 2.77Å; S31-T64 VanDerWaalsContact O-N 3.09Å; S31-T64 WeakPolarHBondContact OG-CG2 3.38Å; S31-T64 PolarHBondContact OG-OG1 2.77Å
32	F	88.3	Confident	79.3	Confident	27 Å²	27	79.6 Å²	79.6	12%	0.118	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.2	175.1	-61.6	-95.4	0	0	0	108.4	N30 S62 T63 P69 V113 N114 K116	N30-F32 HydrophobicContact CB-CE2 3.76Å; N30-F32 HydrophobicContact CB-CZ 4.18Å; N30-F32 WeakPolarHBondContact O-CD2 3.34Å; N30-F32 WeakPolarHBondContact O-CE2 3.21Å; F32-S62 CarbonylContact C-O 3.58Å; F32-S62 WeakPolarHBondContact CA-O 3.3Å; F32-T63 VanDerWaalsContact CD1-CB 3.49Å; F32-T63 HydrophobicContact CD1-CG2 4.46Å; F32-T63 WeakPolarHBondContact CD1-OG1 3.15Å; F32-T63 HydrophobicContact CE1-CG2 4.25Å; F32-T63 WeakPolarHBondContact CE1-OG1 3.42Å; F32-T63 WeakPolarHBondContact CZ-OG1 3.39Å; F32-P69 HydrophobicContact CD1-CB 3.93Å; F32-P69 HydrophobicContact CD1-CG 4.01Å; F32-P69 HydrophobicContact CE1-CB 3.69Å; F32-P69 HydrophobicContact CE1-CG 3.96Å; F32-V113 HydrophobicContact CB-CG1 4.39Å; F32-V113 HydrophobicContact CD1-CG1 4.16Å; F32-V113 HydrophobicContact CG-CG1 4.45Å; F32-N114 VanDerWaalsContact CD1-ND2 3.34Å; F32-N114 WeakPolarHBondContact CD1-ND2 3.19Å; F32-N114 HydrophobicContact CD2-CB 4.03Å; F32-N114 WeakPolarHBondContact CD2-ND2 3.44Å; F32-N114 WeakPolarHBondContact CE1-ND2 3.47Å; F32-N114 WeakPolarHBondContact CE2-ND2 3.35Å; F32-N114 HydrophobicContact CG-CB 4.29Å; F32-N114 VanDerWaalsContact CG-ND2 3.27Å; F32-N114 WeakPolarHBondContact CG-ND2 3.49Å; F32-N114 WeakPolarHBondContact CZ-ND2 3.46Å; F32-K116 VanDerWaalsContact O-CD 3.24Å; F32-K116 WeakPolarHBondContact O-CD 3.5Å; F32-K116 VanDerWaalsContact O-CE 3.28Å; F32-K116 WeakPolarHBondContact O-CE 3.42Å; F32-K116 PolarHBondContact O-NZ 2.79Å
33	T	91.5	Very high	81.2	Confident	67 Å²	67	79.5 Å²	79.5	41%	0.411	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.5	177.7	-61.1	0	0	0	0	109	N35 V61 S62	T33-N35 PolarHBondContact O-N 2.81Å; T33-V61 WeakPolarHBondContact O-CA 3.48Å; T33-S62 PolarHBondContact N-O 2.65Å; T33-S62 PolarHBondContact O-N 2.95Å
34	I	95.7	Very high	83.3	Confident	19 Å²	19	79.5 Å²	79.5	10%	0.097	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	100.7	173.2	-50.5	173.7	0	0	0	107.5	V37 D60 V61 V111 V113 K116 K118	I34-V37 HydrophobicContact CG2-CG2 3.56Å; I34-D60 CarbonylContact C-O 3.57Å; I34-V61 HydrophobicContact CG1-CG2 4.4Å; I34-V61 HydrophobicContact CG2-CG2 4.45Å; I34-V111 WeakPolarHBondContact CD1-O 3.35Å; I34-V113 HydrophobicContact CD1-CB 4.39Å; I34-K116 HydrophobicContact CD1-CB 4.34Å; I34-K116 WeakPolarHBondContact CD1-O 3.3Å; I34-K118 HydrophobicContact CB-CB 4.19Å; I34-K118 HydrophobicContact CB-CD 4.43Å; I34-K118 HydrophobicContact CD1-CB 4.25Å; I34-K118 HydrophobicContact CG2-CB 3.84Å; I34-K118 HydrophobicContact CG2-CD 4.02Å; I34-K118 HydrophobicContact CG2-CG 4.5Å
35	N	95.8	Very high	85.3	Confident	63 Å²	63	77.5 Å²	77.5	34%	0.337	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-51.6	-176.6	-64.5	-22.2	0	0	0	110.7	T33 D60 S62 K118	T33-N35 PolarHBondContact O-N 2.81Å; N35-D60 HydrophobicContact CB-CB 4.08Å; N35-D60 WeakPolarHBondContact CB-O 3.39Å; N35-D60 VanDerWaalsContact CB-OD2 3.23Å; N35-D60 WeakPolarHBondContact CB-OD2 3.41Å; N35-D60 PolarHBondContact N-O 2.93Å; N35-D60 PolarHBondContact ND2-OD2 3.4Å; N35-S62 PolarHBondContact ND2-OG 2.94Å; N35-K118 PolarHBondContact O-NZ 2.96Å
36	S	96.7	Very high	87.5	Confident	41 Å²	41	72.5 Å²	72.5	29%	0.287	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	159	175.4	75.3	0	0	0	0	111.3	D38 D60	S36-D38 PolarHBondContact OG-OD2 2.9Å; S36-D60 PolarHBondContact O-N 2.83Å
37	V	97.9	Very high	89.5	Confident	11 Å²	11	64.2 Å²	64.2	7%	0.067	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	130.1	167.2	-172.6	0	0	0	0	106.3	I34 F58 V111 K118 T120	I34-V37 HydrophobicContact CG2-CG2 3.56Å; V37-F58 CarbonylContact C-O 3.58Å; V37-F58 VanDerWaalsContact CA-O 3.27Å; V37-F58 WeakPolarHBondContact CA-O 3.38Å; V37-F58 WeakPolarHBondContact CG1-O 3.27Å; V37-V111 HydrophobicContact CG1-CB 4.33Å; V37-V111 HydrophobicContact CG1-CG2 3.5Å; V37-V111 HydrophobicContact CG2-CB 4.08Å; V37-V111 HydrophobicContact CG2-CG2 4.12Å; V37-K118 HydrophobicContact CG2-CB 3.72Å; V37-K118 HydrophobicContact CG2-CD 4.16Å; V37-K118 HydrophobicContact CG2-CG 3.87Å; V37-T120 HydrophobicContact CB-CG2 4.03Å; V37-T120 HydrophobicContact CG1-CG2 3.43Å; V37-T120 VanDerWaalsContact CG1-CG2 3.43Å
38	D	97.7	Very high	91.6	Very high	77 Å²	77	66 Å²	66	41%	0.412	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.2	-175.4	-66.2	-74.7	0	0	0	109.9	S36 F58	S36-D38 PolarHBondContact OG-OD2 2.9Å; D38-F58 PolarHBondContact N-O 2.84Å; D38-F58 PolarHBondContact O-N 3.32Å
39	M	97.9	Very high	93.5	Very high	9 Å²	9	59.6 Å²	59.6	4%	0.044	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	144	174.2	-154.8	172	176.8	0	0	110.1	W45 L55 Q56 F75 C109 T120 Y123	M39-W45 HydrophobicContact CB-CH2 4.2Å; M39-W45 HydrophobicContact CG-CH2 4.05Å; M39-W45 HydrophobicContact SD-CH2 4.41Å; M39-L55 HydrophobicContact CE-CB 3.73Å; M39-L55 HydrophobicContact CE-CD1 3.92Å; M39-L55 HydrophobicContact CE-CD2 4.13Å; M39-L55 HydrophobicContact CE-CG 4.14Å; M39-Q56 CarbonylContact C-O 3.59Å; M39-Q56 VanDerWaalsContact CA-O 3.27Å; M39-Q56 WeakPolarHBondContact CA-O 3.26Å; M39-Q56 WeakPolarHBondContact CG-O 3.34Å; M39-F75 HydrophobicContact CE-CD1 3.82Å; M39-F75 HydrophobicContact CE-CE1 4.11Å; M39-C109 HydrophobicContact SD-CB 4.32Å; M39-T120 HydrophobicContact CB-CG2 4.21Å; M39-Y123 HydrophobicContact CB-CD2 3.69Å; M39-Y123 HydrophobicContact CB-CE2 3.39Å; M39-Y123 HydrophobicContact CG-CD2 4.49Å; M39-Y123 HydrophobicContact SD-CD2 4.29Å
40	K	98.1	Very high	94.9	Very high	111 Å²	111	52.2 Å²	52.2	48%	0.483	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.2	174.5	-168.4	175.3	-177.7	179	0	109.9	L42 Q56 F58	K40-L42 HydrophobicContact CD-CD2 4.2Å; K40-L42 HydrophobicContact CG-CD2 4.45Å; K40-Q56 PolarHBondContact N-O 2.8Å; K40-Q56 PolarHBondContact O-N 2.83Å; K40-F58 HydrophobicContact CB-CE2 3.79Å
41	S	98.3	Very high	95.9	Very high	4 Å²	4	54.7 Å²	54.7	3%	0.028	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.9	164.4	61.7	0	0	0	0	110.5	D44 W45 T54	S41-D44 WeakPolarHBondContact CB-O 3.38Å; S41-D44 PolarHBondContact OG-O 2.84Å; S41-W45 WeakPolarHBondContact OG-CA 3.39Å; S41-W45 PolarHBondContact OG-N 2.86Å; S41-T54 CarbonylContact C-O 3.44Å; S41-T54 WeakPolarHBondContact CA-O 3.17Å
42	L	98.1	Very high	96.5	Very high	63 Å²	63	56 Å²	56	33%	0.33	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.6	170.9	-60.3	174.9	0	0	0	108.4	K40 T54 Q56	K40-L42 HydrophobicContact CD-CD2 4.2Å; K40-L42 HydrophobicContact CG-CD2 4.45Å; L42-T54 PolarHBondContact N-O 2.88Å; L42-T54 PolarHBondContact O-N 3.43Å; L42-Q56 HydrophobicContact CD1-CG 4.38Å; L42-Q56 VanDerWaalsContact CD1-OE1 3.3Å
43	P	97.4	Very high	97	Very high	100 Å²	100	54.7 Å²	54.7	65%	0.649	29%	0.293	S	S	*	.	S	Bend	cis	-78.5	-31.5	7	30.7	-35	0	0	0	114.8	V47	P43-V47 HydrophobicContact CG-CG2 4.49Å
44	D	97.8	Very high	97.3	Very high	90 Å²	90	53.1 Å²	53.1	48%	0.481	28%	0.283	S	S	.	.			trans	-156.6	173.9	-177.7	-160.8	-1.2	0	0	0	110.2	S41 T46 V47	S41-D44 WeakPolarHBondContact CB-O 3.38Å; S41-D44 PolarHBondContact OG-O 2.84Å; D44-T46 VanDerWaalsContact C-N 3.29Å; D44-V47 WeakPolarHBondContact O-CG2 3.07Å
45	W	97.2	Very high	97.5	Very high	54 Å²	54	52.2 Å²	52.2	21%	0.205	28%	0.279	C	S	.	.	S	Bend	trans	-74.1	-22.1	176	-66	105.3	0	0	0	112.6	M39 S41 L55 Y123 V125 L126	M39-W45 HydrophobicContact CB-CH2 4.2Å; M39-W45 HydrophobicContact CG-CH2 4.05Å; M39-W45 HydrophobicContact SD-CH2 4.41Å; S41-W45 WeakPolarHBondContact OG-CA 3.39Å; S41-W45 PolarHBondContact OG-N 2.86Å; W45-L55 HydrophobicContact CZ3-CD2 4.22Å; W45-Y123 HydrophobicContact CD2-CD1 4.31Å; W45-Y123 AromaticContact CE2-CD1 3.57Å; W45-Y123 HydrophobicContact CE3-CG 4.49Å; W45-Y123 AromaticContact CH2-CD1 3.58Å; W45-Y123 HydrophobicContact CH2-CD1 3.58Å; W45-Y123 AromaticContact CH2-CD2 3.99Å; W45-Y123 HydrophobicContact CH2-CD2 3.99Å; W45-Y123 HydrophobicContact CH2-CE1 4.35Å; W45-Y123 AromaticContact CH2-CG 3.34Å; W45-Y123 HydrophobicContact CH2-CG 3.34Å; W45-Y123 AromaticContact CZ2-CD1 3.14Å; W45-Y123 HydrophobicContact CZ2-CD1 3.14Å; W45-Y123 HydrophobicContact CZ2-CD2 4.3Å; W45-Y123 AromaticContact CZ2-CE1 3.7Å; W45-Y123 HydrophobicContact CZ2-CE1 3.7Å; W45-Y123 AromaticContact CZ2-CG 3.49Å; W45-Y123 HydrophobicContact CZ2-CG 3.49Å; W45-Y123 VanDerWaalsContact CZ2-CG 3.49Å; W45-Y123 HydrophobicContact CZ3-CD1 4.3Å; W45-Y123 AromaticContact CZ3-CG 3.9Å; W45-Y123 HydrophobicContact CZ3-CG 3.9Å; W45-V125 HydrophobicContact CE3-CG2 3.72Å; W45-V125 HydrophobicContact CZ3-CG2 3.93Å; W45-V125 WeakPolarHBondContact O-CA 3.5Å; W45-L126 PolarHBondContact O-N 2.82Å
46	T	96.8	Very high	97.6	Very high	60 Å²	60	51.1 Å²	51.1	37%	0.368	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.2	170.2	-56.3	0	0	0	0	109.7	D44 L126 E128	D44-T46 VanDerWaalsContact C-N 3.29Å; T46-L126 CarbonylContact C-O 3.52Å; T46-L126 VanDerWaalsContact CA-O 3.28Å; T46-L126 WeakPolarHBondContact CA-O 3.28Å; T46-L126 HydrophobicContact CG2-CB 4.43Å; T46-L126 HydrophobicContact CG2-CD2 4.21Å; T46-L126 HydrophobicContact CG2-CG 4.37Å; T46-E128 HydrophobicContact CG2-CG 3.81Å
47	V	96.8	Very high	97.7	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.03	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.3	-173.6	-174.6	0	0	0	0	110.8	P43 D44 K51 L53 V99 L126 V127 E128	P43-V47 HydrophobicContact CG-CG2 4.49Å; D44-V47 WeakPolarHBondContact O-CG2 3.07Å; V47-K51 HydrophobicContact CG1-CB 3.82Å; V47-L53 HydrophobicContact CG2-CD1 4.13Å; V47-V99 HydrophobicContact CB-CG1 4.27Å; V47-V99 HydrophobicContact CG1-CG1 3.81Å; V47-L126 PolarHBondContact N-O 2.84Å; V47-V127 CarbonylContact O-C 3.56Å; V47-V127 VanDerWaalsContact O-CA 3.25Å; V47-V127 WeakPolarHBondContact O-CA 3.32Å; V47-E128 PolarHBondContact O-N 2.81Å
48	Q	96.3	Very high	97.6	Very high	100 Å²	100	51.8 Å²	51.8	47%	0.467	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	142.3	175	-64.2	-62.1	-50	0	0	111.3	K51 E128	Q48-K51 HydrophobicContact CB-CG 4.12Å; Q48-K51 VanDerWaalsContact O-CB 3.3Å; Q48-K51 WeakPolarHBondContact O-CB 3.27Å; Q48-K51 WeakPolarHBondContact O-CG 3.47Å; Q48-K51 PolarHBondContact O-N 2.76Å; Q48-K51 VanDerWaalsContact O-N 3.15Å; Q48-E128 PolarHBondContact NE2-OE2 2.88Å
49	N	96.3	Very high	97.6	Very high	30 Å²	30	48.6 Å²	48.6	16%	0.16	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	138.9	178.1	-163.9	-67	0	0	0	112.4	K51 R100 V127 E128 G129 E157	N49-K51 PolarHBondContact O-N 3.45Å; N49-R100 WeakPolarHBondContact OD1-CD 3.33Å; N49-R100 PolarHBondContact OD1-NH1 2.94Å; N49-V127 HydrophobicContact CB-CG1 4.18Å; N49-E128 WeakPolarHBondContact CB-O 3.25Å; N49-E128 PolarHBondContact N-O 2.97Å; N49-G129 VanDerWaalsContact CB-O 3.26Å; N49-G129 WeakPolarHBondContact CB-O 3.28Å; N49-G129 PolarHBondContact ND2-O 3.13Å; N49-E157 PolarHBondContact ND2-OE1 2.86Å
50	G	96.4	Very high	97.5	Very high	26 Å²	26	52 Å²	52	27%	0.268	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	0.5	-179.3	0	0	0	0	0	114.6	V99	G50-V99 PolarHBondContact N-O 3.1Å
51	K	97.7	Very high	97.3	Very high	134 Å²	134	48 Å²	48	58%	0.583	26%	0.256	S	S	*	.	S	Bend	trans	-84.8	161.2	169.2	-61.8	-60.9	-175.7	-176	0	111.2	V47 Q48 N49 E98 V99	V47-K51 HydrophobicContact CG1-CB 3.82Å; Q48-K51 HydrophobicContact CB-CG 4.12Å; Q48-K51 VanDerWaalsContact O-CB 3.3Å; Q48-K51 WeakPolarHBondContact O-CB 3.27Å; Q48-K51 WeakPolarHBondContact O-CG 3.47Å; Q48-K51 PolarHBondContact O-N 2.76Å; Q48-K51 VanDerWaalsContact O-N 3.15Å; N49-K51 PolarHBondContact O-N 3.45Å; K51-E98 CarbonylContact O-C 3.58Å; K51-E98 WeakPolarHBondContact O-CA 3.24Å; K51-V99 WeakPolarHBondContact O-CB 3.46Å; K51-V99 VanDerWaalsContact O-CG1 3.3Å; K51-V99 WeakPolarHBondContact O-CG1 3.46Å; K51-V99 PolarHBondContact O-N 2.73Å
52	N	98.2	Very high	96.9	Very high	85 Å²	85	50.5 Å²	50.5	46%	0.455	27%	0.273	S	S	.	.			trans	-83	141.2	177.3	-60.6	-13.8	0	0	0	110.2	F95 E98	N52-F95 HydrophobicContact CB-CE2 3.69Å; N52-F95 HydrophobicContact CB-CZ 3.83Å; N52-E98 PolarHBondContact OD1-N 2.85Å
53	L	98.3	Very high	96.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.9	176.4	169.3	63	0	0	0	109.1	V47 L55 I96 V99 V125	V47-L53 HydrophobicContact CG2-CD1 4.13Å; L53-L55 HydrophobicContact CD1-CD2 4.21Å; L53-L55 HydrophobicContact CD2-CD2 4.35Å; L53-L55 HydrophobicContact CG-CD2 4.34Å; L53-I96 HydrophobicContact CB-CB 4.33Å; L53-I96 HydrophobicContact CD2-CD1 4.04Å; L53-I96 HydrophobicContact CG-CD1 4.48Å; L53-I96 PolarHBondContact N-O 2.83Å; L53-I96 PolarHBondContact O-N 3.43Å; L53-V99 HydrophobicContact CB-CB 4.28Å; L53-V99 HydrophobicContact CB-CG2 4.31Å; L53-V99 HydrophobicContact CD2-CG2 4.04Å; L53-V125 HydrophobicContact CD2-CG1 3.78Å
54	T	98.6	Very high	96.1	Very high	33 Å²	33	48.4 Å²	48.4	20%	0.202	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.2	170.3	-52.5	0	0	0	0	109.6	S41 L42 Q56 Y94	S41-T54 CarbonylContact C-O 3.44Å; S41-T54 WeakPolarHBondContact CA-O 3.17Å; L42-T54 PolarHBondContact N-O 2.88Å; L42-T54 PolarHBondContact O-N 3.43Å; T54-Q56 HydrophobicContact CG2-CG 4.01Å; T54-Y94 WeakPolarHBondContact CA-O 3.34Å
55	L	98.6	Very high	95.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.9	171.6	-62	177.6	0	0	0	108.7	M39 W45 L53 F75 F82 S93 Y94 I96 Y107 V125	M39-L55 HydrophobicContact CE-CB 3.73Å; M39-L55 HydrophobicContact CE-CD1 3.92Å; M39-L55 HydrophobicContact CE-CD2 4.13Å; M39-L55 HydrophobicContact CE-CG 4.14Å; W45-L55 HydrophobicContact CZ3-CD2 4.22Å; L53-L55 HydrophobicContact CD1-CD2 4.21Å; L53-L55 HydrophobicContact CD2-CD2 4.35Å; L53-L55 HydrophobicContact CG-CD2 4.34Å; L55-F75 HydrophobicContact CB-CE1 4.48Å; L55-F82 HydrophobicContact CD1-CZ 4.28Å; L55-S93 CarbonylContact O-C 3.54Å; L55-S93 WeakPolarHBondContact O-CA 3.41Å; L55-Y94 PolarHBondContact N-O 2.89Å; L55-Y94 PolarHBondContact O-N 2.01Å; L55-I96 HydrophobicContact CD1-CD1 4.24Å; L55-Y107 HydrophobicContact CD1-CD1 3.42Å; L55-Y107 VanDerWaalsContact CD1-CD1 3.42Å; L55-Y107 HydrophobicContact CD1-CE1 3.45Å; L55-Y107 VanDerWaalsContact CD1-CE1 3.45Å; L55-Y107 HydrophobicContact CD1-CG 4.16Å; L55-V125 HydrophobicContact CD2-CG2 4.2Å
56	Q	98.4	Very high	94.7	Very high	41 Å²	41	51.8 Å²	51.8	19%	0.192	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.4	-179.2	-53.8	-164.7	-68.2	0	0	109.6	M39 K40 L42 T54 F58 E92 S93	M39-Q56 CarbonylContact C-O 3.59Å; M39-Q56 VanDerWaalsContact CA-O 3.27Å; M39-Q56 WeakPolarHBondContact CA-O 3.26Å; M39-Q56 WeakPolarHBondContact CG-O 3.34Å; K40-Q56 PolarHBondContact N-O 2.8Å; K40-Q56 PolarHBondContact O-N 2.83Å; L42-Q56 HydrophobicContact CD1-CG 4.38Å; L42-Q56 VanDerWaalsContact CD1-OE1 3.3Å; T54-Q56 HydrophobicContact CG2-CG 4.01Å; Q56-F58 HydrophobicContact CB-CD2 4.32Å; Q56-F58 HydrophobicContact CB-CE2 3.39Å; Q56-F58 HydrophobicContact CB-CZ 3.58Å; Q56-F58 HydrophobicContact CG-CZ 4.36Å; Q56-E92 WeakPolarHBondContact CA-O 3.23Å; Q56-S93 WeakPolarHBondContact CG-OG 3.42Å; Q56-S93 PolarHBondContact NE2-OG 2.97Å
57	C	98.3	Very high	94.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.2	174.5	-178	0	0	0	0	109.1	F75 T91 E92 C109	C57-F75 HydrophobicContact CB-CE1 3.78Å; C57-F75 HydrophobicContact CB-CE2 4.28Å; C57-F75 HydrophobicContact CB-CZ 3.5Å; C57-F75 VanDerWaalsContact CB-CZ 3.5Å; C57-T91 VanDerWaalsContact O-CA 3.25Å; C57-T91 WeakPolarHBondContact O-CA 3.44Å; C57-E92 PolarHBondContact N-O 2.81Å; C57-E92 PolarHBondContact O-N 2.88Å; C57-C109 HydrophobicContact CB-CB 3.72Å; C57-C109 WeakPolarHBondContact CB-SG 3.4Å; C57-C109 WeakPolarHBondContact SG-CB 3.31Å; C57-C109 CovalentContact SG-SG 2.03Å; C57-C109 PolarHBondContact SG-SG 3.04Å
58	F	97.1	Very high	93.4	Very high	66 Å²	66	61.2 Å²	61.2	29%	0.289	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.9	-177.4	-54	-99	0	0	0	109.1	V37 D38 K40 Q56 T91	V37-F58 CarbonylContact C-O 3.58Å; V37-F58 VanDerWaalsContact CA-O 3.27Å; V37-F58 WeakPolarHBondContact CA-O 3.38Å; V37-F58 WeakPolarHBondContact CG1-O 3.27Å; D38-F58 PolarHBondContact N-O 2.84Å; D38-F58 PolarHBondContact O-N 3.32Å; K40-F58 HydrophobicContact CB-CE2 3.79Å; Q56-F58 HydrophobicContact CB-CD2 4.32Å; Q56-F58 HydrophobicContact CB-CE2 3.39Å; Q56-F58 HydrophobicContact CB-CZ 3.58Å; Q56-F58 HydrophobicContact CG-CZ 4.36Å; F58-T91 HydrophobicContact CD1-CG2 3.44Å; F58-T91 VanDerWaalsContact CD1-CG2 3.44Å; F58-T91 WeakPolarHBondContact CD1-OG1 3.21Å; F58-T91 HydrophobicContact CE1-CG2 3.36Å; F58-T91 HydrophobicContact CG-CG2 4.13Å; F58-T91 HydrophobicContact CZ-CG2 4.02Å
59	A	96.7	Very high	93.1	Very high	9 Å²	9	57.2 Å²	57.2	7%	0.074	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.4	171.4	0	0	0	0	0	110	V61 S90 V111	A59-V61 HydrophobicContact CB-CG2 3.96Å; A59-S90 PolarHBondContact N-O 3.21Å; A59-S90 WeakPolarHBondContact O-CB 3.27Å; A59-V111 HydrophobicContact CB-CB 4.36Å; A59-V111 HydrophobicContact CB-CG1 3.88Å; A59-V111 HydrophobicContact CB-CG2 4.19Å
60	D	95.6	Very high	92.9	Very high	80 Å²	80	61.2 Å²	61.2	43%	0.428	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	114.9	163	-179.9	25.5	0	0	0	108.6	I34 N35 S36	I34-D60 CarbonylContact C-O 3.57Å; N35-D60 HydrophobicContact CB-CB 4.08Å; N35-D60 WeakPolarHBondContact CB-O 3.39Å; N35-D60 VanDerWaalsContact CB-OD2 3.23Å; N35-D60 WeakPolarHBondContact CB-OD2 3.41Å; N35-D60 PolarHBondContact N-O 2.93Å; N35-D60 PolarHBondContact ND2-OD2 3.4Å; S36-D60 PolarHBondContact O-N 2.83Å
61	V	93.8	Very high	92.9	Very high	28 Å²	28	60.4 Å²	60.4	17%	0.17	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.5	-174.7	-177.6	0	0	0	0	109.5	T33 I34 A59 P69 V113	T33-V61 WeakPolarHBondContact O-CA 3.48Å; I34-V61 HydrophobicContact CG1-CG2 4.4Å; I34-V61 HydrophobicContact CG2-CG2 4.45Å; A59-V61 HydrophobicContact CB-CG2 3.96Å; V61-P69 HydrophobicContact CG1-CG 4.24Å; V61-V113 HydrophobicContact CG1-CG1 4.41Å; V61-V113 HydrophobicContact CG2-CG2 4.31Å
62	S	91.8	Very high	92.9	Very high	56 Å²	56	57 Å²	57	39%	0.392	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.8	170.9	-68.4	0	0	0	0	110.3	F32 T33 N35	F32-S62 CarbonylContact C-O 3.58Å; F32-S62 WeakPolarHBondContact CA-O 3.3Å; T33-S62 PolarHBondContact N-O 2.65Å; T33-S62 PolarHBondContact O-N 2.95Å; N35-S62 PolarHBondContact ND2-OG 2.94Å
63	T	89.6	Confident	92.9	Very high	51 Å²	51	52.9 Å²	52.9	31%	0.313	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	145.7	175.5	-175.7	0	0	0	0	111.8	S31 F32 S65	S31-T63 VanDerWaalsContact O-CA 3.27Å; S31-T63 WeakPolarHBondContact O-CA 3.31Å; S31-T63 PolarHBondContact O-OG1 2.83Å; F32-T63 VanDerWaalsContact CD1-CB 3.49Å; F32-T63 HydrophobicContact CD1-CG2 4.46Å; F32-T63 WeakPolarHBondContact CD1-OG1 3.15Å; F32-T63 HydrophobicContact CE1-CG2 4.25Å; F32-T63 WeakPolarHBondContact CE1-OG1 3.42Å; F32-T63 WeakPolarHBondContact CZ-OG1 3.39Å; T63-S65 VanDerWaalsContact C-N 3.28Å; T63-S65 VanDerWaalsContact OG1-CB 3.23Å; T63-S65 WeakPolarHBondContact OG1-CB 3.01Å; T63-S65 PolarHBondContact OG1-N 2.89Å
64	T	87.6	Confident	92.9	Very high	69 Å²	69	53.6 Å²	53.6	42%	0.423	28%	0.28	S	S	.	.	S	Bend	trans	-85.4	-4.3	168.1	59.2	0	0	0	0	112.5	S31	S31-T64 PolarHBondContact N-OG1 2.88Å; S31-T64 PolarHBondContact O-N 2.77Å; S31-T64 VanDerWaalsContact O-N 3.09Å; S31-T64 WeakPolarHBondContact OG-CG2 3.38Å; S31-T64 PolarHBondContact OG-OG1 2.77Å
65	S	83.3	Confident	92.9	Very high	16 Å²	16	52 Å²	52	11%	0.112	27%	0.27	C	S	.	.			trans	-77	143.5	177.3	-171.9	0	0	0	0	111.8	N30 T63 V67	N30-S65 PolarHBondContact ND2-OG 2.8Å; N30-S65 WeakPolarHBondContact OD1-CA 3.32Å; T63-S65 VanDerWaalsContact C-N 3.28Å; T63-S65 VanDerWaalsContact OG1-CB 3.23Å; T63-S65 WeakPolarHBondContact OG1-CB 3.01Å; T63-S65 PolarHBondContact OG1-N 2.89Å; S65-V67 PolarHBondContact O-N 3.24Å; S65-V67 PolarHBondContact OG-N 3.47Å; S65-V67 PolarHBondContact OG-O 2.77Å
66	H	82.3	Confident	92.9	Very high	198 Å²	198	54.5 Å²	54.5	92%	0.917	28%	0.28	S	S	*	.	S	Bend	trans	-75.3	-11.3	166.6	-59.9	-62.2	0	0	0	113
67	V	83.9	Confident	92.9	Very high	104 Å²	104	54.7 Å²	54.7	63%	0.63	28%	0.28	S	S	*	.	S	Bend	trans	-97.8	125.4	179.4	-175	0	0	0	0	109.2	S65	S65-V67 PolarHBondContact O-N 3.24Å; S65-V67 PolarHBondContact OG-N 3.47Å; S65-V67 PolarHBondContact OG-O 2.77Å
68	K	83.9	Confident	92.8	Very high	160 Å²	160	58.2 Å²	58.2	70%	0.696	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-60.3	129.7	173.3	-67.8	-173.8	178.8	-176	0	109.3	M88	K68-M88 HydrophobicContact CB-CE 4.02Å; K68-M88 WeakPolarHBondContact O-CE 3.02Å
69	P	88.6	Confident	92.8	Very high	15 Å²	15	60.4 Å²	60.4	10%	0.097	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-69.5	152.8	176.7	25.9	-30.4	0	0	0	111.2	F32 V61 H71 V113	F32-P69 HydrophobicContact CD1-CB 3.93Å; F32-P69 HydrophobicContact CD1-CG 4.01Å; F32-P69 HydrophobicContact CE1-CB 3.69Å; F32-P69 HydrophobicContact CE1-CG 3.96Å; V61-P69 HydrophobicContact CG1-CG 4.24Å; P69-H71 PolarHBondContact O-CE1 3.46Å; P69-H71 VanDerWaalsContact O-CE1 3.25Å; P69-H71 PolarHBondContact O-ND1 3.16Å; P69-V113 HydrophobicContact CB-CG1 3.56Å; P69-V113 HydrophobicContact CG-CG1 4.05Å
70	Q	93.4	Very high	92.9	Very high	115 Å²	115	64.8 Å²	64.8	54%	0.537	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-78.3	138.1	160.2	-172.9	176.6	-64.3	0	0	108.6	M88	Q70-M88 HydrophobicContact CB-SD 3.91Å; Q70-M88 HydrophobicContact CG-SD 4.31Å
71	H	95.3	Very high	93	Very high	8 Å²	8	64.7 Å²	64.7	4%	0.037	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131	177.3	-51.4	78.8	0	0	0	108	P69 M73 S86 S87 K89 V111 V113	P69-H71 PolarHBondContact O-CE1 3.46Å; P69-H71 VanDerWaalsContact O-CE1 3.25Å; P69-H71 PolarHBondContact O-ND1 3.16Å; H71-M73 HydrophobicContact CB-CE 3.3Å; H71-M73 HydrophobicContact CB-SD 3.44Å; H71-M73 WeakPolarHBondContact CB-SD 3.41Å; H71-S86 CarbonylContact O-C 3.56Å; H71-S86 VanDerWaalsContact O-CA 3.26Å; H71-S86 WeakPolarHBondContact O-CA 3.34Å; H71-S87 PolarHBondContact N-O 3.46Å; H71-S87 PolarHBondContact ND1-O 2.76Å; H71-S87 PolarHBondContact O-N 2.85Å; H71-K89 PolarHBondContact ND1-O 3.27Å; H71-V111 HydrophobicContact CB-CG1 4.43Å; H71-V113 HydrophobicContact CB-CG2 4.27Å; H71-V113 VanDerWaalsContact CD2-CG2 3.45Å; H71-V113 WeakPolarHBondContact CD2-CG2 3.38Å
72	Q	97.6	Very high	93.2	Very high	62 Å²	62	66.4 Å²	66.4	29%	0.29	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.6	167.7	-179.3	179	9.9	0	0	108.6	L74 N84 I85 V111 I112	Q72-L74 HydrophobicContact CG-CD2 4.1Å; Q72-N84 PolarHBondContact NE2-ND2 3.18Å; Q72-N84 PolarHBondContact NE2-OD1 2.85Å; Q72-N84 VanDerWaalsContact NE2-OD1 3.12Å; Q72-I85 CarbonylContact C-O 3.57Å; Q72-I85 WeakPolarHBondContact CA-O 3.35Å; Q72-V111 CarbonylContact O-C 3.53Å; Q72-V111 WeakPolarHBondContact O-CA 3.39Å; Q72-I112 HydrophobicContact CB-CB 4.26Å; Q72-I112 PolarHBondContact N-O 2.68Å; Q72-I112 PolarHBondContact O-N 2.99Å
73	M	98.1	Very high	93.5	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.2	-179.8	-66.2	72.6	164.7	0	0	109.7	H71 F75 N84 I85 K89 E92 T110 V111	H71-M73 HydrophobicContact CB-CE 3.3Å; H71-M73 HydrophobicContact CB-SD 3.44Å; H71-M73 WeakPolarHBondContact CB-SD 3.41Å; M73-F75 HydrophobicContact CB-CE2 3.94Å; M73-N84 WeakPolarHBondContact O-CA 3.43Å; M73-I85 HydrophobicContact CB-CG2 3.9Å; M73-I85 PolarHBondContact N-O 3.18Å; M73-I85 PolarHBondContact O-N 2.76Å; M73-K89 VanDerWaalsContact CE-O 3.32Å; M73-K89 WeakPolarHBondContact CE-O 3.36Å; M73-E92 HydrophobicContact CE-CG 4.18Å; M73-E92 HydrophobicContact CG-CB 4.33Å; M73-E92 HydrophobicContact SD-CG 4.11Å; M73-T110 WeakPolarHBondContact CA-O 3.27Å; M73-V111 HydrophobicContact CG-CG2 4.07Å
74	L	98.5	Very high	93.9	Very high	15 Å²	15	68.5 Å²	68.5	8%	0.079	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.8	180	-54.3	-179.2	0	0	0	108.7	Q72 Y76 L81 N84 C109 T110 I112	Q72-L74 HydrophobicContact CG-CD2 4.1Å; L74-Y76 HydrophobicContact CB-CD2 4.43Å; L74-Y76 HydrophobicContact CB-CE2 3.56Å; L74-Y76 WeakPolarHBondContact CD1-OH 3.47Å; L74-L81 HydrophobicContact CB-CD1 3.81Å; L74-L81 HydrophobicContact CD2-CD1 4.2Å; L74-N84 HydrophobicContact CD2-CB 3.75Å; L74-N84 WeakPolarHBondContact CD2-OD1 3.29Å; L74-C109 CarbonylContact O-C 3.56Å; L74-C109 VanDerWaalsContact O-CA 3.28Å; L74-C109 WeakPolarHBondContact O-CA 3.49Å; L74-T110 PolarHBondContact N-O 3.24Å; L74-T110 PolarHBondContact O-N 2.93Å; L74-I112 HydrophobicContact CD1-CD1 3.8Å
75	F	98.7	Very high	94.4	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129	177.9	-65.2	-112.8	0	0	0	110	M39 L55 C57 M73 L81 F82 Y83 I85	M39-F75 HydrophobicContact CE-CD1 3.82Å; M39-F75 HydrophobicContact CE-CE1 4.11Å; L55-F75 HydrophobicContact CB-CE1 4.48Å; C57-F75 HydrophobicContact CB-CE1 3.78Å; C57-F75 HydrophobicContact CB-CE2 4.28Å; C57-F75 HydrophobicContact CB-CZ 3.5Å; C57-F75 VanDerWaalsContact CB-CZ 3.5Å; M73-F75 HydrophobicContact CB-CE2 3.94Å; F75-L81 WeakPolarHBondContact O-CD1 3.48Å; F75-F82 HydrophobicContact CB-CD1 4.38Å; F75-F82 HydrophobicContact CB-CE1 3.69Å; F75-F82 HydrophobicContact CB-CE2 4.04Å; F75-F82 HydrophobicContact CB-CZ 3.49Å; F75-F82 VanDerWaalsContact CB-CZ 3.49Å; F75-F82 HydrophobicContact CD1-CZ 4.42Å; F75-F82 HydrophobicContact CG-CZ 4.34Å; F75-F82 VanDerWaalsContact O-CD1 3.31Å; F75-F82 WeakPolarHBondContact O-CD1 3.49Å; F75-F82 PolarHBondContact O-N 3.49Å; F75-Y83 AromaticContact CD2-CD1 3.59Å; F75-Y83 HydrophobicContact CD2-CD1 3.59Å; F75-Y83 HydrophobicContact CD2-CE1 4.43Å; F75-Y83 HydrophobicContact CD2-CG 4.45Å; F75-Y83 AromaticContact CE2-CD1 3.84Å; F75-Y83 HydrophobicContact CE2-CD1 3.84Å; F75-Y83 HydrophobicContact CE2-CE1 4.25Å; F75-Y83 HydrophobicContact CG-CD1 4.24Å; F75-Y83 PolarHBondContact N-O 2.78Å; F75-Y83 PolarHBondContact O-N 2.88Å; F75-I85 HydrophobicContact CE2-CG2 4.41Å
76	Y	98.7	Very high	95	Very high	51 Å²	51	69.3 Å²	69.3	20%	0.2	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.7	-179.4	-61.4	-95.6	0	0	0	110.3	L74 V80 L81 F82 Y107 K108	L74-Y76 HydrophobicContact CB-CD2 4.43Å; L74-Y76 HydrophobicContact CB-CE2 3.56Å; L74-Y76 WeakPolarHBondContact CD1-OH 3.47Å; Y76-V80 VanDerWaalsContact CA-O 3.29Å; Y76-V80 WeakPolarHBondContact CA-O 3.34Å; Y76-L81 HydrophobicContact CD1-CB 3.94Å; Y76-L81 HydrophobicContact CD1-CD1 4.48Å; Y76-L81 HydrophobicContact CE1-CB 3.66Å; Y76-L81 HydrophobicContact CE1-CD1 4.1Å; Y76-L81 HydrophobicContact CE1-CG 4.43Å; Y76-L81 HydrophobicContact CE2-CD1 4.34Å; Y76-F82 VanDerWaalsContact C-CE1 3.49Å; Y76-Y107 WeakPolarHBondContact O-CA 3.35Å; Y76-K108 HydrophobicContact CD2-CG 4.27Å; Y76-K108 HydrophobicContact CG-CG 4.37Å; Y76-K108 PolarHBondContact N-O 3.42Å; Y76-K108 PolarHBondContact O-N 2.93Å; Y76-K108 VanDerWaalsContact O-N 3.13Å
77	K	97.9	Very high	95.6	Very high	45 Å²	45	61 Å²	61	20%	0.196	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.7	169.1	179	-171.3	-172.1	-71.8	0	106.8	D79 V80 F82 Y102 D103 S104 T106 Y107	K77-D79 PolarHBondContact O-N 2.87Å; K77-V80 PolarHBondContact N-O 2.65Å; K77-V80 WeakPolarHBondContact O-CB 3.42Å; K77-V80 PolarHBondContact O-N 2.8Å; K77-F82 HydrophobicContact CB-CD1 3.63Å; K77-F82 HydrophobicContact CB-CE1 3.87Å; K77-Y102 WeakPolarHBondContact CE-O 3.5Å; K77-Y102 PolarHBondContact NZ-O 3.08Å; K77-D103 VanDerWaalsContact CE-O 3.28Å; K77-D103 WeakPolarHBondContact CE-O 3.3Å; K77-S104 VanDerWaalsContact CE-O 3.27Å; K77-S104 WeakPolarHBondContact CE-O 3.47Å; K77-S104 PolarHBondContact NZ-O 2.96Å; K77-T106 CarbonylContact C-O 3.52Å; K77-T106 WeakPolarHBondContact CA-O 3.46Å; K77-Y107 HydrophobicContact CB-CD1 4.15Å; K77-Y107 HydrophobicContact CB-CE1 3.78Å; K77-Y107 HydrophobicContact CD-CE1 4.22Å; K77-Y107 HydrophobicContact CD-CE2 4.39Å; K77-Y107 WeakPolarHBondContact CD-OH 3.32Å; K77-Y107 WeakPolarHBondContact CE-OH 3.21Å; K77-Y107 HydrophobicContact CG-CE1 3.93Å; K77-Y107 HydrophobicContact CG-CE2 4.04Å
78	D	96.4	Very high	96.1	Very high	75 Å²	75	60.8 Å²	60.8	40%	0.401	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	46.8	-178.8	-49.4	-45.4	0	0	0	111	V80 G105 T106	D78-V80 PolarHBondContact O-N 2.8Å; D78-V80 VanDerWaalsContact O-N 3.08Å; D78-G105 VanDerWaalsContact OD1-CA 3.32Å; D78-G105 WeakPolarHBondContact OD1-CA 3.41Å; D78-T106 PolarHBondContact N-O 2.95Å; D78-T106 PolarHBondContact OD1-N 2.89Å
79	D	97.5	Very high	96.6	Very high	112 Å²	112	59.8 Å²	59.8	60%	0.599	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	4.3	-175.2	-61.9	-46.2	0	0	0	116.9	K77 K108	K77-D79 PolarHBondContact O-N 2.87Å; D79-K108 VanDerWaalsContact OD1-CE 3.31Å; D79-K108 WeakPolarHBondContact OD1-CE 3.43Å; D79-K108 IonicContact OD1-NZ 2.65Å; D79-K108 PolarHBondContact OD1-NZ 2.63Å
80	V	98.2	Very high	96.9	Very high	100 Å²	100	61.7 Å²	61.7	61%	0.606	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.6	175.8	-176.8	0	0	0	0	110.3	Y76 K77 D78 F82	Y76-V80 VanDerWaalsContact CA-O 3.29Å; Y76-V80 WeakPolarHBondContact CA-O 3.34Å; K77-V80 PolarHBondContact N-O 2.65Å; K77-V80 WeakPolarHBondContact O-CB 3.42Å; K77-V80 PolarHBondContact O-N 2.8Å; D78-V80 PolarHBondContact O-N 2.8Å; D78-V80 VanDerWaalsContact O-N 3.08Å; V80-F82 PolarHBondContact O-N 3.09Å
81	L	98.3	Very high	97	Very high	78 Å²	78	58.1 Å²	58.1	41%	0.408	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	117.7	173.2	179.2	65.2	0	0	0	109.6	L74 F75 Y76 Y83	L74-L81 HydrophobicContact CB-CD1 3.81Å; L74-L81 HydrophobicContact CD2-CD1 4.2Å; F75-L81 WeakPolarHBondContact O-CD1 3.48Å; Y76-L81 HydrophobicContact CD1-CB 3.94Å; Y76-L81 HydrophobicContact CD1-CD1 4.48Å; Y76-L81 HydrophobicContact CE1-CB 3.66Å; Y76-L81 HydrophobicContact CE1-CD1 4.1Å; Y76-L81 HydrophobicContact CE1-CG 4.43Å; Y76-L81 HydrophobicContact CE2-CD1 4.34Å; L81-Y83 WeakPolarHBondContact CD1-O 3.15Å
82	F	97.9	Very high	97.2	Very high	65 Å²	65	59.1 Å²	59.1	29%	0.285	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-17.9	178.2	73.3	-94.2	0	0	0	113.4	L55 F75 Y76 K77 V80 Y94 Y107	L55-F82 HydrophobicContact CD1-CZ 4.28Å; F75-F82 HydrophobicContact CB-CD1 4.38Å; F75-F82 HydrophobicContact CB-CE1 3.69Å; F75-F82 HydrophobicContact CB-CE2 4.04Å; F75-F82 HydrophobicContact CB-CZ 3.49Å; F75-F82 VanDerWaalsContact CB-CZ 3.49Å; F75-F82 HydrophobicContact CD1-CZ 4.42Å; F75-F82 HydrophobicContact CG-CZ 4.34Å; F75-F82 VanDerWaalsContact O-CD1 3.31Å; F75-F82 WeakPolarHBondContact O-CD1 3.49Å; F75-F82 PolarHBondContact O-N 3.49Å; Y76-F82 VanDerWaalsContact C-CE1 3.49Å; K77-F82 HydrophobicContact CB-CD1 3.63Å; K77-F82 HydrophobicContact CB-CE1 3.87Å; V80-F82 PolarHBondContact O-N 3.09Å; F82-Y94 HydrophobicContact CD2-CD1 4.47Å; F82-Y94 HydrophobicContact CD2-CE1 4.04Å; F82-Y94 HydrophobicContact CD2-CE2 4.3Å; F82-Y94 AromaticContact CD2-CZ 3.97Å; F82-Y94 AromaticContact CE2-CD1 3.52Å; F82-Y94 HydrophobicContact CE2-CD1 3.52Å; F82-Y94 HydrophobicContact CE2-CD2 4.1Å; F82-Y94 AromaticContact CE2-CE1 3.49Å; F82-Y94 HydrophobicContact CE2-CE1 3.49Å; F82-Y94 VanDerWaalsContact CE2-CE1 3.49Å; F82-Y94 HydrophobicContact CE2-CE2 4.1Å; F82-Y94 AromaticContact CE2-CG 3.81Å; F82-Y94 HydrophobicContact CE2-CG 3.81Å; F82-Y94 AromaticContact CE2-CZ 3.81Å; F82-Y94 HydrophobicContact CZ-CD1 4.24Å; F82-Y94 HydrophobicContact CZ-CE1 4.46Å; F82-Y107 AromaticContact CE1-CD1 3.75Å; F82-Y107 HydrophobicContact CE1-CD1 3.75Å; F82-Y107 AromaticContact CE1-CE1 3.67Å; F82-Y107 HydrophobicContact CE1-CE1 3.67Å; F82-Y107 HydrophobicContact CZ-CD1 4.03Å; F82-Y107 AromaticContact CZ-CE1 3.82Å; F82-Y107 HydrophobicContact CZ-CE1 3.82Å
83	Y	98.3	Very high	97.2	Very high	67 Å²	67	58.4 Å²	58.4	26%	0.263	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	131.8	177.9	-173.9	-120	0	0	0	111.5	F75 L81 I85 Y94	F75-Y83 AromaticContact CD2-CD1 3.59Å; F75-Y83 HydrophobicContact CD2-CD1 3.59Å; F75-Y83 HydrophobicContact CD2-CE1 4.43Å; F75-Y83 HydrophobicContact CD2-CG 4.45Å; F75-Y83 AromaticContact CE2-CD1 3.84Å; F75-Y83 HydrophobicContact CE2-CD1 3.84Å; F75-Y83 HydrophobicContact CE2-CE1 4.25Å; F75-Y83 HydrophobicContact CG-CD1 4.24Å; F75-Y83 PolarHBondContact N-O 2.78Å; F75-Y83 PolarHBondContact O-N 2.88Å; L81-Y83 WeakPolarHBondContact CD1-O 3.15Å; Y83-I85 HydrophobicContact CD1-CG2 4.34Å; Y83-I85 HydrophobicContact CE1-CB 3.91Å; Y83-I85 HydrophobicContact CE1-CG2 3.72Å; Y83-Y94 AromaticContact CD1-CD2 3.69Å; Y83-Y94 HydrophobicContact CD1-CD2 3.69Å; Y83-Y94 HydrophobicContact CD1-CG 4.31Å; Y83-Y94 AromaticContact CD2-CD2 3.81Å; Y83-Y94 HydrophobicContact CD2-CD2 3.81Å; Y83-Y94 AromaticContact CD2-CE2 3.95Å; Y83-Y94 HydrophobicContact CD2-CE2 3.95Å; Y83-Y94 HydrophobicContact CE1-CD2 4.1Å; Y83-Y94 HydrophobicContact CE2-CD2 4.21Å; Y83-Y94 AromaticContact CG-CD2 3.54Å; Y83-Y94 HydrophobicContact CG-CD2 3.54Å; Y83-Y94 AromaticContact CG-CE2 3.99Å; Y83-Y94 HydrophobicContact CG-CE2 3.99Å; Y83-Y94 HydrophobicContact CG-CG 4.45Å
84	N	98.1	Very high	97.2	Very high	83 Å²	83	62 Å²	62	44%	0.444	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	120.3	-180	174.2	4.9	0	0	0	108.1	Q72 M73 L74	Q72-N84 PolarHBondContact NE2-ND2 3.18Å; Q72-N84 PolarHBondContact NE2-OD1 2.85Å; Q72-N84 VanDerWaalsContact NE2-OD1 3.12Å; M73-N84 WeakPolarHBondContact O-CA 3.43Å; L74-N84 HydrophobicContact CD2-CB 3.75Å; L74-N84 WeakPolarHBondContact CD2-OD1 3.29Å
85	I	97.7	Very high	97.2	Very high	47 Å²	47	66.4 Å²	66.4	24%	0.241	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.6	-177.3	-173.4	63.9	0	0	0	110.1	Q72 M73 F75 Y83 E92	Q72-I85 CarbonylContact C-O 3.57Å; Q72-I85 WeakPolarHBondContact CA-O 3.35Å; M73-I85 HydrophobicContact CB-CG2 3.9Å; M73-I85 PolarHBondContact N-O 3.18Å; M73-I85 PolarHBondContact O-N 2.76Å; F75-I85 HydrophobicContact CE2-CG2 4.41Å; Y83-I85 HydrophobicContact CD1-CG2 4.34Å; Y83-I85 HydrophobicContact CE1-CB 3.91Å; Y83-I85 HydrophobicContact CE1-CG2 3.72Å; I85-E92 HydrophobicContact CG2-CB 3.96Å; I85-E92 HydrophobicContact CG2-CG 3.94Å
86	S	96.8	Very high	97.1	Very high	56 Å²	56	67 Å²	67	39%	0.392	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.5	170.9	-70.8	0	0	0	0	110	H71	H71-S86 CarbonylContact O-C 3.56Å; H71-S86 VanDerWaalsContact O-CA 3.26Å; H71-S86 WeakPolarHBondContact O-CA 3.34Å
87	S	94.6	Very high	97.1	Very high	22 Å²	22	68.4 Å²	68.4	15%	0.154	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	153.8	-173.7	-176.1	0	0	0	0	112.3	H71 K89 E92	H71-S87 PolarHBondContact N-O 3.46Å; H71-S87 PolarHBondContact ND1-O 2.76Å; H71-S87 PolarHBondContact O-N 2.85Å; S87-K89 PolarHBondContact OG-N 2.9Å; S87-K89 VanDerWaalsContact OG-N 3.14Å; S87-E92 WeakPolarHBondContact CB-OE1 3.3Å; S87-E92 PolarHBondContact OG-OE1 2.92Å
88	M	93.7	Very high	97	Very high	101 Å²	101	71.6 Å²	71.6	50%	0.498	38%	0.375	S	S	.	.	S	Bend	trans	-78.7	-11.5	170.8	-59.8	-56.2	-64.5	0	0	112.3	K68 Q70	K68-M88 HydrophobicContact CB-CE 4.02Å; K68-M88 WeakPolarHBondContact O-CE 3.02Å; Q70-M88 HydrophobicContact CB-SD 3.91Å; Q70-M88 HydrophobicContact CG-SD 4.31Å
89	K	94.3	Very high	97	Very high	138 Å²	138	68 Å²	68	60%	0.6	36%	0.355	S	S	*	.	S	Bend	trans	-78.9	146.2	174.9	-60.2	176.9	-174.3	170.4	0	109.1	H71 M73 S87 T91	H71-K89 PolarHBondContact ND1-O 3.27Å; M73-K89 VanDerWaalsContact CE-O 3.32Å; M73-K89 WeakPolarHBondContact CE-O 3.36Å; S87-K89 PolarHBondContact OG-N 2.9Å; S87-K89 VanDerWaalsContact OG-N 3.14Å; K89-T91 WeakPolarHBondContact CB-O 3.35Å; K89-T91 PolarHBondContact O-N 3.39Å
90	S	94.3	Very high	97	Very high	55 Å²	55	64.1 Å²	64.1	39%	0.385	33%	0.332	S	S	.	.	S	Bend	trans	-83	2.3	171.4	59.2	0	0	0	0	112.9	A59	A59-S90 PolarHBondContact N-O 3.21Å; A59-S90 WeakPolarHBondContact O-CB 3.27Å
91	T	96.9	Very high	96.8	Very high	40 Å²	40	59.5 Å²	59.5	25%	0.245	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.1	177.7	-57.4	0	0	0	0	110	C57 F58 K89	C57-T91 VanDerWaalsContact O-CA 3.25Å; C57-T91 WeakPolarHBondContact O-CA 3.44Å; F58-T91 HydrophobicContact CD1-CG2 3.44Å; F58-T91 VanDerWaalsContact CD1-CG2 3.44Å; F58-T91 WeakPolarHBondContact CD1-OG1 3.21Å; F58-T91 HydrophobicContact CE1-CG2 3.36Å; F58-T91 HydrophobicContact CG-CG2 4.13Å; F58-T91 HydrophobicContact CZ-CG2 4.02Å; K89-T91 WeakPolarHBondContact CB-O 3.35Å; K89-T91 PolarHBondContact O-N 3.39Å
92	E	97.9	Very high	96.6	Very high	30 Å²	30	59.8 Å²	59.8	14%	0.14	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	156.3	172	-75.6	-58.1	153.5	0	0	111	Q56 C57 M73 I85 S87	Q56-E92 WeakPolarHBondContact CA-O 3.23Å; C57-E92 PolarHBondContact N-O 2.81Å; C57-E92 PolarHBondContact O-N 2.88Å; M73-E92 HydrophobicContact CE-CG 4.18Å; M73-E92 HydrophobicContact CG-CB 4.33Å; M73-E92 HydrophobicContact SD-CG 4.11Å; I85-E92 HydrophobicContact CG2-CB 3.96Å; I85-E92 HydrophobicContact CG2-CG 3.94Å; S87-E92 WeakPolarHBondContact CB-OE1 3.3Å; S87-E92 PolarHBondContact OG-OE1 2.92Å
93	S	97.9	Very high	96.5	Very high	46 Å²	46	58 Å²	58	32%	0.322	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.3	-174.8	-59.4	0	0	0	0	111.6	L55 Q56	L55-S93 CarbonylContact O-C 3.54Å; L55-S93 WeakPolarHBondContact O-CA 3.41Å; Q56-S93 WeakPolarHBondContact CG-OG 3.42Å; Q56-S93 PolarHBondContact NE2-OG 2.97Å
94	Y	98.4	Very high	96.4	Very high	75 Å²	75	55.1 Å²	55.1	29%	0.294	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.9	172.2	-175.1	-99.6	0	0	0	109.5	T54 L55 F82 Y83 I96	T54-Y94 WeakPolarHBondContact CA-O 3.34Å; L55-Y94 PolarHBondContact N-O 2.89Å; L55-Y94 PolarHBondContact O-N 2.01Å; F82-Y94 HydrophobicContact CD2-CD1 4.47Å; F82-Y94 HydrophobicContact CD2-CE1 4.04Å; F82-Y94 HydrophobicContact CD2-CE2 4.3Å; F82-Y94 AromaticContact CD2-CZ 3.97Å; F82-Y94 AromaticContact CE2-CD1 3.52Å; F82-Y94 HydrophobicContact CE2-CD1 3.52Å; F82-Y94 HydrophobicContact CE2-CD2 4.1Å; F82-Y94 AromaticContact CE2-CE1 3.49Å; F82-Y94 HydrophobicContact CE2-CE1 3.49Å; F82-Y94 VanDerWaalsContact CE2-CE1 3.49Å; F82-Y94 HydrophobicContact CE2-CE2 4.1Å; F82-Y94 AromaticContact CE2-CG 3.81Å; F82-Y94 HydrophobicContact CE2-CG 3.81Å; F82-Y94 AromaticContact CE2-CZ 3.81Å; F82-Y94 HydrophobicContact CZ-CD1 4.24Å; F82-Y94 HydrophobicContact CZ-CE1 4.46Å; Y83-Y94 AromaticContact CD1-CD2 3.69Å; Y83-Y94 HydrophobicContact CD1-CD2 3.69Å; Y83-Y94 HydrophobicContact CD1-CG 4.31Å; Y83-Y94 AromaticContact CD2-CD2 3.81Å; Y83-Y94 HydrophobicContact CD2-CD2 3.81Å; Y83-Y94 AromaticContact CD2-CE2 3.95Å; Y83-Y94 HydrophobicContact CD2-CE2 3.95Å; Y83-Y94 HydrophobicContact CE1-CD2 4.1Å; Y83-Y94 HydrophobicContact CE2-CD2 4.21Å; Y83-Y94 AromaticContact CG-CD2 3.54Å; Y83-Y94 HydrophobicContact CG-CD2 3.54Å; Y83-Y94 AromaticContact CG-CE2 3.99Å; Y83-Y94 HydrophobicContact CG-CE2 3.99Å; Y83-Y94 HydrophobicContact CG-CG 4.45Å; Y94-I96 HydrophobicContact CD1-CD1 4.17Å; Y94-I96 HydrophobicContact CD1-CG1 3.7Å; Y94-I96 HydrophobicContact CE1-CD1 4.05Å; Y94-I96 HydrophobicContact CE1-CG1 3.45Å; Y94-I96 VanDerWaalsContact CE1-CG1 3.45Å
95	F	98.3	Very high	96.3	Very high	108 Å²	108	51.5 Å²	51.5	47%	0.474	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.4	-175.9	179.8	-110.5	0	0	0	110.6	N52 P97	N52-F95 HydrophobicContact CB-CE2 3.69Å; N52-F95 HydrophobicContact CB-CZ 3.83Å; F95-P97 HydrophobicContact CE1-CB 3.83Å; F95-P97 HydrophobicContact CE1-CG 4.41Å; F95-P97 HydrophobicContact CZ-CB 4.39Å
96	I	98.1	Very high	96.3	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	103.3	174.5	-58.2	166.6	0	0	0	107.3	L53 L55 Y94 V99	L53-I96 HydrophobicContact CB-CB 4.33Å; L53-I96 HydrophobicContact CD2-CD1 4.04Å; L53-I96 HydrophobicContact CG-CD1 4.48Å; L53-I96 PolarHBondContact N-O 2.83Å; L53-I96 PolarHBondContact O-N 3.43Å; L55-I96 HydrophobicContact CD1-CD1 4.24Å; Y94-I96 HydrophobicContact CD1-CD1 4.17Å; Y94-I96 HydrophobicContact CD1-CG1 3.7Å; Y94-I96 HydrophobicContact CE1-CD1 4.05Å; Y94-I96 HydrophobicContact CE1-CG1 3.45Å; Y94-I96 VanDerWaalsContact CE1-CG1 3.45Å; I96-V99 HydrophobicContact CG2-CB 4.3Å; I96-V99 HydrophobicContact CG2-CG2 4.14Å
97	P	97.3	Very high	96.3	Very high	81 Å²	81	48.8 Å²	48.8	53%	0.526	25%	0.249	S	C	.	.	S	Bend	trans	-70	142.3	172	29.4	-32.3	0	0	0	109.9	F95 V99	F95-P97 HydrophobicContact CE1-CB 3.83Å; F95-P97 HydrophobicContact CE1-CG 4.41Å; F95-P97 HydrophobicContact CZ-CB 4.39Å; P97-V99 PolarHBondContact O-N 2.92Å
98	E	96.6	Very high	96.5	Very high	112 Å²	112	49.9 Å²	49.9	52%	0.523	25%	0.25	S	S	.	.	S	Bend	trans	44.6	63.6	174.1	-60	-174.1	-170.6	0	0	114.7	K51 N52 R100	K51-E98 CarbonylContact O-C 3.58Å; K51-E98 WeakPolarHBondContact O-CA 3.24Å; N52-E98 PolarHBondContact OD1-N 2.85Å; E98-R100 WeakPolarHBondContact O-CG 3.5Å; E98-R100 PolarHBondContact O-NE 2.8Å; E98-R100 VanDerWaalsContact O-NE 3.1Å; E98-R100 IonicContact OE2-CZ 2.66Å; E98-R100 IonicContact OE2-NH2 3.8Å; E98-R100 PolarHBondContact OE2-NH2 3.41Å
99	V	97	Very high	96.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.			trans	-55.9	138.3	-175.7	78.8	0	0	0	0	112.3	V47 G50 K51 L53 I96 P97 D103 V127	V47-V99 HydrophobicContact CB-CG1 4.27Å; V47-V99 HydrophobicContact CG1-CG1 3.81Å; G50-V99 PolarHBondContact N-O 3.1Å; K51-V99 WeakPolarHBondContact O-CB 3.46Å; K51-V99 VanDerWaalsContact O-CG1 3.3Å; K51-V99 WeakPolarHBondContact O-CG1 3.46Å; K51-V99 PolarHBondContact O-N 2.73Å; L53-V99 HydrophobicContact CB-CB 4.28Å; L53-V99 HydrophobicContact CB-CG2 4.31Å; L53-V99 HydrophobicContact CD2-CG2 4.04Å; I96-V99 HydrophobicContact CG2-CB 4.3Å; I96-V99 HydrophobicContact CG2-CG2 4.14Å; P97-V99 PolarHBondContact O-N 2.92Å; V99-D103 HydrophobicContact CG2-CB 3.57Å; V99-V127 HydrophobicContact CB-CG2 4.44Å; V99-V127 HydrophobicContact CG1-CG1 3.97Å; V99-V127 HydrophobicContact CG1-CG2 4.04Å; V99-V127 HydrophobicContact CG2-CG2 3.58Å
100	R	96.3	Very high	97	Very high	30 Å²	30	38.9 Å²	38.9	11%	0.113	20%	0.201	C	C	.	.			trans	-119.6	169.1	-177.8	-57.4	-56.6	171.2	174.4	4.4	111.7	N49 E98 Y102 D103 V127 E157	N49-R100 WeakPolarHBondContact OD1-CD 3.33Å; N49-R100 PolarHBondContact OD1-NH1 2.94Å; E98-R100 WeakPolarHBondContact O-CG 3.5Å; E98-R100 PolarHBondContact O-NE 2.8Å; E98-R100 VanDerWaalsContact O-NE 3.1Å; E98-R100 IonicContact OE2-CZ 2.66Å; E98-R100 IonicContact OE2-NH2 3.8Å; E98-R100 PolarHBondContact OE2-NH2 3.41Å; R100-Y102 HydrophobicContact CB-CD1 3.67Å; R100-Y102 HydrophobicContact CB-CD2 4.4Å; R100-Y102 HydrophobicContact CB-CE1 3.29Å; R100-Y102 HydrophobicContact CB-CE2 4.05Å; R100-Y102 HydrophobicContact CB-CG 4.22Å; R100-Y102 VanDerWaalsContact CB-CZ 3.48Å; R100-Y102 HydrophobicContact CG-CD1 4.48Å; R100-Y102 HydrophobicContact CG-CE1 3.64Å; R100-Y102 HydrophobicContact CG-CE2 4.49Å; R100-Y102 WeakPolarHBondContact CG-OH 3.39Å; R100-Y102 PolarHBondContact O-N 3.16Å; R100-D103 PolarHBondContact N-OD2 2.83Å; R100-D103 WeakPolarHBondContact O-CB 3.35Å; R100-D103 PolarHBondContact O-N 2.91Å; R100-V127 WeakPolarHBondContact O-CG2 3.37Å; R100-E157 WeakPolarHBondContact CB-OE1 3.49Å
101	I	95.1	Very high	97.1	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.015	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-60.6	-34.7	-176.6	-69.4	163.7	0	0	0	111.5	D103 S104 G129 V130 E157 I210 Q217	I101-D103 PolarHBondContact O-N 3.27Å; I101-S104 WeakPolarHBondContact O-CB 3.42Å; I101-S104 PolarHBondContact O-N 2.81Å; I101-S104 PolarHBondContact O-OG 2.86Å; I101-G129 WeakPolarHBondContact CD1-O 3.45Å; I101-V130 HydrophobicContact CD1-CB 4.26Å; I101-V130 HydrophobicContact CD1-CG2 3.63Å; I101-E157 PolarHBondContact N-OE1 2.82Å; I101-E157 PolarHBondContact N-OE2 2.96Å; I101-I210 HydrophobicContact CB-CG2 4.42Å; I101-I210 HydrophobicContact CD1-CB 4.19Å; I101-I210 HydrophobicContact CD1-CD1 3.97Å; I101-I210 HydrophobicContact CD1-CG2 4.49Å; I101-I210 HydrophobicContact CG2-CB 4.47Å; I101-I210 HydrophobicContact CG2-CG2 3.72Å; I101-Q217 HydrophobicContact CD1-CB 3.96Å; I101-Q217 HydrophobicContact CD1-CG 4.36Å
102	Y	93.8	Very high	97.2	Very high	84 Å²	84	36.2 Å²	36.2	33%	0.329	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-66.9	-15	176.2	62.3	-107.6	0	0	0	114.5	K77 R100 S104 K158	K77-Y102 WeakPolarHBondContact CE-O 3.5Å; K77-Y102 PolarHBondContact NZ-O 3.08Å; R100-Y102 HydrophobicContact CB-CD1 3.67Å; R100-Y102 HydrophobicContact CB-CD2 4.4Å; R100-Y102 HydrophobicContact CB-CE1 3.29Å; R100-Y102 HydrophobicContact CB-CE2 4.05Å; R100-Y102 HydrophobicContact CB-CG 4.22Å; R100-Y102 VanDerWaalsContact CB-CZ 3.48Å; R100-Y102 HydrophobicContact CG-CD1 4.48Å; R100-Y102 HydrophobicContact CG-CE1 3.64Å; R100-Y102 HydrophobicContact CG-CE2 4.49Å; R100-Y102 WeakPolarHBondContact CG-OH 3.39Å; R100-Y102 PolarHBondContact O-N 3.16Å; Y102-S104 VanDerWaalsContact C-N 3.31Å; Y102-K158 HydrophobicContact CD1-CB 3.92Å; Y102-K158 HydrophobicContact CD1-CD 3.68Å; Y102-K158 HydrophobicContact CD1-CG 3.62Å; Y102-K158 HydrophobicContact CD2-CD 4.25Å; Y102-K158 HydrophobicContact CE1-CD 3.92Å; Y102-K158 HydrophobicContact CE1-CG 3.81Å; Y102-K158 HydrophobicContact CG-CB 4.5Å; Y102-K158 HydrophobicContact CG-CD 3.85Å; Y102-K158 HydrophobicContact CG-CG 4.28Å
103	D	95.9	Very high	97	Very high	28 Å²	28	34.9 Å²	34.9	15%	0.15	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-82	-12.8	173	-61.2	-48.1	0	0	0	112	K77 V99 R100 I101 Y107	K77-D103 VanDerWaalsContact CE-O 3.28Å; K77-D103 WeakPolarHBondContact CE-O 3.3Å; V99-D103 HydrophobicContact CG2-CB 3.57Å; R100-D103 PolarHBondContact N-OD2 2.83Å; R100-D103 WeakPolarHBondContact O-CB 3.35Å; R100-D103 PolarHBondContact O-N 2.91Å; I101-D103 PolarHBondContact O-N 3.27Å; D103-Y107 WeakPolarHBondContact O-CE2 3.49Å; D103-Y107 PolarHBondContact O-OH 2.99Å
104	S	95.7	Very high	96.6	Very high	6 Å²	6	37 Å²	37	4%	0.042	18%	0.182	C	C	.	.			trans	-60.6	146.3	169	-54.5	0	0	0	0	110.2	K77 I101 Y102 V125 V127	K77-S104 VanDerWaalsContact CE-O 3.27Å; K77-S104 WeakPolarHBondContact CE-O 3.47Å; K77-S104 PolarHBondContact NZ-O 2.96Å; I101-S104 WeakPolarHBondContact O-CB 3.42Å; I101-S104 PolarHBondContact O-N 2.81Å; I101-S104 PolarHBondContact O-OG 2.86Å; Y102-S104 VanDerWaalsContact C-N 3.31Å; S104-V125 WeakPolarHBondContact CA-O 3.45Å; S104-V125 WeakPolarHBondContact CB-O 3.47Å; S104-V127 WeakPolarHBondContact OG-CB 3.36Å; S104-V127 WeakPolarHBondContact OG-CG2 3.46Å; S104-V127 PolarHBondContact OG-N 3.44Å
105	G	95.6	Very high	96.1	Very high	7 Å²	7	41.3 Å²	41.3	7%	0.072	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.5	-178.1	-178	0	0	0	0	0	112.2	D78 Y107 Q124 V125	D78-G105 VanDerWaalsContact OD1-CA 3.32Å; D78-G105 WeakPolarHBondContact OD1-CA 3.41Å; G105-Y107 WeakPolarHBondContact O-CD2 3.45Å; G105-Q124 VanDerWaalsContact C-NE2 3.31Å; G105-Q124 PolarHBondContact O-NE2 3.08Å; G105-Q124 VanDerWaalsContact O-NE2 3.1Å; G105-V125 PolarHBondContact N-O 3.12Å; G105-V125 VanDerWaalsContact N-O 3.15Å; G105-V125 PolarHBondContact O-N 3.1Å
106	T	97.3	Very high	95.8	Very high	41 Å²	41	41.2 Å²	41.2	25%	0.252	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.8	177.5	-53.9	0	0	0	0	109.3	K77 D78 E122 Q124	K77-T106 CarbonylContact C-O 3.52Å; K77-T106 WeakPolarHBondContact CA-O 3.46Å; D78-T106 PolarHBondContact N-O 2.95Å; D78-T106 PolarHBondContact OD1-N 2.89Å; T106-E122 HydrophobicContact CG2-CB 3.66Å; T106-E122 HydrophobicContact CG2-CG 3.86Å; T106-Q124 PolarHBondContact OG1-OE1 3.25Å; T106-Q124 VanDerWaalsContact OG1-OE1 3.08Å
107	Y	98.3	Very high	95.8	Very high	5 Å²	5	47.1 Å²	47.1	2%	0.02	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	142.1	-176.7	-73.5	-96.8	0	0	0	111.4	L55 Y76 K77 F82 D103 G105 Y123 V125	L55-Y107 HydrophobicContact CD1-CD1 3.42Å; L55-Y107 VanDerWaalsContact CD1-CD1 3.42Å; L55-Y107 HydrophobicContact CD1-CE1 3.45Å; L55-Y107 VanDerWaalsContact CD1-CE1 3.45Å; L55-Y107 HydrophobicContact CD1-CG 4.16Å; Y76-Y107 WeakPolarHBondContact O-CA 3.35Å; K77-Y107 HydrophobicContact CB-CD1 4.15Å; K77-Y107 HydrophobicContact CB-CE1 3.78Å; K77-Y107 HydrophobicContact CD-CE1 4.22Å; K77-Y107 HydrophobicContact CD-CE2 4.39Å; K77-Y107 WeakPolarHBondContact CD-OH 3.32Å; K77-Y107 WeakPolarHBondContact CE-OH 3.21Å; K77-Y107 HydrophobicContact CG-CE1 3.93Å; K77-Y107 HydrophobicContact CG-CE2 4.04Å; F82-Y107 AromaticContact CE1-CD1 3.75Å; F82-Y107 HydrophobicContact CE1-CD1 3.75Å; F82-Y107 AromaticContact CE1-CE1 3.67Å; F82-Y107 HydrophobicContact CE1-CE1 3.67Å; F82-Y107 HydrophobicContact CZ-CD1 4.03Å; F82-Y107 AromaticContact CZ-CE1 3.82Å; F82-Y107 HydrophobicContact CZ-CE1 3.82Å; D103-Y107 WeakPolarHBondContact O-CE2 3.49Å; D103-Y107 PolarHBondContact O-OH 2.99Å; G105-Y107 WeakPolarHBondContact O-CD2 3.45Å; Y107-Y123 PolarHBondContact N-O 2.59Å; Y107-Y123 PolarHBondContact O-N 2.82Å; Y107-V125 HydrophobicContact CD2-CB 3.77Å; Y107-V125 HydrophobicContact CD2-CG2 3.4Å; Y107-V125 HydrophobicContact CE2-CB 3.66Å; Y107-V125 HydrophobicContact CE2-CG1 4.39Å; Y107-V125 HydrophobicContact CE2-CG2 3.65Å; Y107-V125 HydrophobicContact CG-CG2 4.16Å
108	K	98.6	Very high	95.8	Very high	44 Å²	44	47.2 Å²	47.2	19%	0.191	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	157.9	170.1	64.6	-171	-173.8	-163.5	0	111.3	Y76 D79 T119 E122	Y76-K108 HydrophobicContact CD2-CG 4.27Å; Y76-K108 HydrophobicContact CG-CG 4.37Å; Y76-K108 PolarHBondContact N-O 3.42Å; Y76-K108 PolarHBondContact O-N 2.93Å; Y76-K108 VanDerWaalsContact O-N 3.13Å; D79-K108 VanDerWaalsContact OD1-CE 3.31Å; D79-K108 WeakPolarHBondContact OD1-CE 3.43Å; D79-K108 IonicContact OD1-NZ 2.65Å; D79-K108 PolarHBondContact OD1-NZ 2.63Å; K108-T119 HydrophobicContact CB-CG2 4.41Å; K108-T119 HydrophobicContact CD-CG2 4.13Å; K108-T119 HydrophobicContact CG-CG2 4.39Å; K108-E122 HydrophobicContact CD-CG 4.4Å
109	C	98.5	Very high	95.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.2	176.5	179.3	0	0	0	0	110.6	M39 C57 L74 T119 T120	M39-C109 HydrophobicContact SD-CB 4.32Å; C57-C109 HydrophobicContact CB-CB 3.72Å; C57-C109 WeakPolarHBondContact CB-SG 3.4Å; C57-C109 WeakPolarHBondContact SG-CB 3.31Å; C57-C109 CovalentContact SG-SG 2.03Å; C57-C109 PolarHBondContact SG-SG 3.04Å; L74-C109 CarbonylContact O-C 3.56Å; L74-C109 VanDerWaalsContact O-CA 3.28Å; L74-C109 WeakPolarHBondContact O-CA 3.49Å; C109-T119 CarbonylContact O-C 3.57Å; C109-T119 WeakPolarHBondContact O-CA 3.47Å; C109-T120 HydrophobicContact CB-CG2 3.94Å; C109-T120 PolarHBondContact N-OG1 3.15Å; C109-T120 WeakPolarHBondContact O-CG2 3.29Å; C109-T120 PolarHBondContact O-N 3.33Å; C109-T120 PolarHBondContact O-OG1 2.88Å
110	T	98.5	Very high	96	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.055	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.2	169.7	-57.4	0	0	0	0	109.2	M73 L74 I112 E117 K118 T119	M73-T110 WeakPolarHBondContact CA-O 3.27Å; L74-T110 PolarHBondContact N-O 3.24Å; L74-T110 PolarHBondContact O-N 2.93Å; T110-I112 HydrophobicContact CG2-CG1 4.24Å; T110-E117 HydrophobicContact CG2-CB 4.22Å; T110-K118 WeakPolarHBondContact CA-O 3.37Å; T110-T119 WeakPolarHBondContact CG2-OG1 3.31Å; T110-T119 WeakPolarHBondContact OG1-CG2 3.28Å; T110-T119 PolarHBondContact OG1-OG1 3.03Å
111	V	98.2	Very high	96	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.3	176.1	-177.4	0	0	0	0	109.2	I34 V37 A59 H71 Q72 M73 V113 E117 K118	I34-V111 WeakPolarHBondContact CD1-O 3.35Å; V37-V111 HydrophobicContact CG1-CB 4.33Å; V37-V111 HydrophobicContact CG1-CG2 3.5Å; V37-V111 HydrophobicContact CG2-CB 4.08Å; V37-V111 HydrophobicContact CG2-CG2 4.12Å; A59-V111 HydrophobicContact CB-CB 4.36Å; A59-V111 HydrophobicContact CB-CG1 3.88Å; A59-V111 HydrophobicContact CB-CG2 4.19Å; H71-V111 HydrophobicContact CB-CG1 4.43Å; Q72-V111 CarbonylContact O-C 3.53Å; Q72-V111 WeakPolarHBondContact O-CA 3.39Å; M73-V111 HydrophobicContact CG-CG2 4.07Å; V111-V113 HydrophobicContact CG1-CG2 4.19Å; V111-E117 VanDerWaalsContact O-CA 3.25Å; V111-E117 WeakPolarHBondContact O-CA 3.5Å; V111-K118 PolarHBondContact N-O 2.93Å; V111-K118 PolarHBondContact O-N 3.2Å
112	I	97.3	Very high	96.1	Very high	38 Å²	38	52.9 Å²	52.9	20%	0.195	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.7	178.7	-49.3	176.8	0	0	0	108.7	Q72 L74 T110 K116 E117	Q72-I112 HydrophobicContact CB-CB 4.26Å; Q72-I112 PolarHBondContact N-O 2.68Å; Q72-I112 PolarHBondContact O-N 2.99Å; L74-I112 HydrophobicContact CD1-CD1 3.8Å; T110-I112 HydrophobicContact CG2-CG1 4.24Å; I112-K116 CarbonylContact C-O 3.56Å; I112-K116 VanDerWaalsContact CA-O 3.29Å; I112-K116 WeakPolarHBondContact CA-O 3.26Å; I112-E117 HydrophobicContact CG1-CB 3.95Å
113	V	94.8	Very high	96.3	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	120.4	175.5	177.1	0	0	0	0	108.4	F32 I34 V61 P69 H71 V111 N115 K116	F32-V113 HydrophobicContact CB-CG1 4.39Å; F32-V113 HydrophobicContact CD1-CG1 4.16Å; F32-V113 HydrophobicContact CG-CG1 4.45Å; I34-V113 HydrophobicContact CD1-CB 4.39Å; V61-V113 HydrophobicContact CG1-CG1 4.41Å; V61-V113 HydrophobicContact CG2-CG2 4.31Å; P69-V113 HydrophobicContact CB-CG1 3.56Å; P69-V113 HydrophobicContact CG-CG1 4.05Å; H71-V113 HydrophobicContact CB-CG2 4.27Å; H71-V113 VanDerWaalsContact CD2-CG2 3.45Å; H71-V113 WeakPolarHBondContact CD2-CG2 3.38Å; V111-V113 HydrophobicContact CG1-CG2 4.19Å; V113-N115 VanDerWaalsContact C-N 3.34Å; V113-N115 PolarHBondContact O-N 3.18Å; V113-K116 PolarHBondContact N-O 2.81Å; V113-K116 WeakPolarHBondContact O-CB 3.41Å; V113-K116 PolarHBondContact O-N 2.84Å
114	N	89.3	Confident	96.3	Very high	90 Å²	90	54.4 Å²	54.4	48%	0.481	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	54.4	176.4	-67.7	-35.2	0	0	0	113.3	F32 K116	F32-N114 VanDerWaalsContact CD1-ND2 3.34Å; F32-N114 WeakPolarHBondContact CD1-ND2 3.19Å; F32-N114 HydrophobicContact CD2-CB 4.03Å; F32-N114 WeakPolarHBondContact CD2-ND2 3.44Å; F32-N114 WeakPolarHBondContact CE1-ND2 3.47Å; F32-N114 WeakPolarHBondContact CE2-ND2 3.35Å; F32-N114 HydrophobicContact CG-CB 4.29Å; F32-N114 VanDerWaalsContact CG-ND2 3.27Å; F32-N114 WeakPolarHBondContact CG-ND2 3.49Å; F32-N114 WeakPolarHBondContact CZ-ND2 3.46Å; N114-K116 PolarHBondContact O-N 2.81Å; N114-K116 VanDerWaalsContact O-N 3.11Å
115	N	87.6	Confident	96.4	Very high	167 Å²	167	54.1 Å²	54.1	89%	0.893	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	7.9	-179.6	-55.3	-21.6	0	0	0	115.9	V113	V113-N115 VanDerWaalsContact C-N 3.34Å; V113-N115 PolarHBondContact O-N 3.18Å
116	K	93.2	Very high	96.4	Very high	105 Å²	105	55 Å²	55	46%	0.457	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	141.2	167	-62.5	-173.7	-179	-173	0	109	F32 I34 I112 V113 N114	F32-K116 VanDerWaalsContact O-CD 3.24Å; F32-K116 WeakPolarHBondContact O-CD 3.5Å; F32-K116 VanDerWaalsContact O-CE 3.28Å; F32-K116 WeakPolarHBondContact O-CE 3.42Å; F32-K116 PolarHBondContact O-NZ 2.79Å; I34-K116 HydrophobicContact CD1-CB 4.34Å; I34-K116 WeakPolarHBondContact CD1-O 3.3Å; I112-K116 CarbonylContact C-O 3.56Å; I112-K116 VanDerWaalsContact CA-O 3.29Å; I112-K116 WeakPolarHBondContact CA-O 3.26Å; V113-K116 PolarHBondContact N-O 2.81Å; V113-K116 WeakPolarHBondContact O-CB 3.41Å; V113-K116 PolarHBondContact O-N 2.84Å; N114-K116 PolarHBondContact O-N 2.81Å; N114-K116 VanDerWaalsContact O-N 3.11Å
117	E	96.6	Very high	96.3	Very high	137 Å²	137	53.1 Å²	53.1	64%	0.64	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	150.6	177.2	67.9	179.5	-160.9	0	0	111.8	T110 V111 I112	T110-E117 HydrophobicContact CG2-CB 4.22Å; V111-E117 VanDerWaalsContact O-CA 3.25Å; V111-E117 WeakPolarHBondContact O-CA 3.5Å; I112-E117 HydrophobicContact CG1-CB 3.95Å
118	K	98.1	Very high	96.1	Very high	84 Å²	84	56.1 Å²	56.1	37%	0.365	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.4	169.9	-172.3	167.3	-175	166.9	0	109	I34 N35 V37 T110 V111	I34-K118 HydrophobicContact CB-CB 4.19Å; I34-K118 HydrophobicContact CB-CD 4.43Å; I34-K118 HydrophobicContact CD1-CB 4.25Å; I34-K118 HydrophobicContact CG2-CB 3.84Å; I34-K118 HydrophobicContact CG2-CD 4.02Å; I34-K118 HydrophobicContact CG2-CG 4.5Å; N35-K118 PolarHBondContact O-NZ 2.96Å; V37-K118 HydrophobicContact CG2-CB 3.72Å; V37-K118 HydrophobicContact CG2-CD 4.16Å; V37-K118 HydrophobicContact CG2-CG 3.87Å; T110-K118 WeakPolarHBondContact CA-O 3.37Å; V111-K118 PolarHBondContact N-O 2.93Å; V111-K118 PolarHBondContact O-N 3.2Å
119	T	98.3	Very high	95.9	Very high	62 Å²	62	55.3 Å²	55.3	38%	0.38	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.4	-179.5	-57	0	0	0	0	109.5	K108 C109 T110	K108-T119 HydrophobicContact CB-CG2 4.41Å; K108-T119 HydrophobicContact CD-CG2 4.13Å; K108-T119 HydrophobicContact CG-CG2 4.39Å; C109-T119 CarbonylContact O-C 3.57Å; C109-T119 WeakPolarHBondContact O-CA 3.47Å; T110-T119 WeakPolarHBondContact CG2-OG1 3.31Å; T110-T119 WeakPolarHBondContact OG1-CG2 3.28Å; T110-T119 PolarHBondContact OG1-OG1 3.03Å
120	T	98.5	Very high	95.7	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.08	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-66	170.1	174	62.5	0	0	0	0	111.7	V37 M39 C109	V37-T120 HydrophobicContact CB-CG2 4.03Å; V37-T120 HydrophobicContact CG1-CG2 3.43Å; V37-T120 VanDerWaalsContact CG1-CG2 3.43Å; M39-T120 HydrophobicContact CB-CG2 4.21Å; C109-T120 HydrophobicContact CB-CG2 3.94Å; C109-T120 PolarHBondContact N-OG1 3.15Å; C109-T120 WeakPolarHBondContact O-CG2 3.29Å; C109-T120 PolarHBondContact O-N 3.33Å; C109-T120 PolarHBondContact O-OG1 2.88Å
121	A	97.3	Very high	95.6	Very high	66 Å²	66	56.5 Å²	56.5	55%	0.545	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-60.7	166.7	156.7	0	0	0	0	0	111	Y123	A121-Y123 HydrophobicContact CB-CE2 4.39Å; A121-Y123 WeakPolarHBondContact O-CD2 3.41Å; A121-Y123 VanDerWaalsContact O-CE2 3.27Å; A121-Y123 WeakPolarHBondContact O-CE2 3.45Å
122	E	97.4	Very high	95.5	Very high	123 Å²	123	59.9 Å²	59.9	58%	0.575	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-81.7	134.9	171.8	-73.2	178.5	179.9	0	0	110.5	T106 K108	T106-E122 HydrophobicContact CG2-CB 3.66Å; T106-E122 HydrophobicContact CG2-CG 3.86Å; K108-E122 HydrophobicContact CD-CG 4.4Å
123	Y	97.6	Very high	95.5	Very high	50 Å²	50	58.2 Å²	58.2	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.1	178.4	-62.4	-93.1	0	0	0	110.5	M39 W45 Y107 A121	M39-Y123 HydrophobicContact CB-CD2 3.69Å; M39-Y123 HydrophobicContact CB-CE2 3.39Å; M39-Y123 HydrophobicContact CG-CD2 4.49Å; M39-Y123 HydrophobicContact SD-CD2 4.29Å; W45-Y123 HydrophobicContact CD2-CD1 4.31Å; W45-Y123 AromaticContact CE2-CD1 3.57Å; W45-Y123 HydrophobicContact CE3-CG 4.49Å; W45-Y123 AromaticContact CH2-CD1 3.58Å; W45-Y123 HydrophobicContact CH2-CD1 3.58Å; W45-Y123 AromaticContact CH2-CD2 3.99Å; W45-Y123 HydrophobicContact CH2-CD2 3.99Å; W45-Y123 HydrophobicContact CH2-CE1 4.35Å; W45-Y123 AromaticContact CH2-CG 3.34Å; W45-Y123 HydrophobicContact CH2-CG 3.34Å; W45-Y123 AromaticContact CZ2-CD1 3.14Å; W45-Y123 HydrophobicContact CZ2-CD1 3.14Å; W45-Y123 HydrophobicContact CZ2-CD2 4.3Å; W45-Y123 AromaticContact CZ2-CE1 3.7Å; W45-Y123 HydrophobicContact CZ2-CE1 3.7Å; W45-Y123 AromaticContact CZ2-CG 3.49Å; W45-Y123 HydrophobicContact CZ2-CG 3.49Å; W45-Y123 VanDerWaalsContact CZ2-CG 3.49Å; W45-Y123 HydrophobicContact CZ3-CD1 4.3Å; W45-Y123 AromaticContact CZ3-CG 3.9Å; W45-Y123 HydrophobicContact CZ3-CG 3.9Å; Y107-Y123 PolarHBondContact N-O 2.59Å; Y107-Y123 PolarHBondContact O-N 2.82Å; A121-Y123 HydrophobicContact CB-CE2 4.39Å; A121-Y123 WeakPolarHBondContact O-CD2 3.41Å; A121-Y123 VanDerWaalsContact O-CE2 3.27Å; A121-Y123 WeakPolarHBondContact O-CE2 3.45Å
124	Q	96.5	Very high	95.7	Very high	94 Å²	94	64.8 Å²	64.8	44%	0.439	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	117.1	178.5	-171	63	45.7	0	0	110.1	G105 T106	G105-Q124 VanDerWaalsContact C-NE2 3.31Å; G105-Q124 PolarHBondContact O-NE2 3.08Å; G105-Q124 VanDerWaalsContact O-NE2 3.1Å; T106-Q124 PolarHBondContact OG1-OE1 3.25Å; T106-Q124 VanDerWaalsContact OG1-OE1 3.08Å
125	V	96.7	Very high	96.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.4	165.8	174.9	0	0	0	0	108.5	W45 L53 L55 S104 G105 Y107 V127	W45-V125 HydrophobicContact CE3-CG2 3.72Å; W45-V125 HydrophobicContact CZ3-CG2 3.93Å; W45-V125 WeakPolarHBondContact O-CA 3.5Å; L53-V125 HydrophobicContact CD2-CG1 3.78Å; L55-V125 HydrophobicContact CD2-CG2 4.2Å; S104-V125 WeakPolarHBondContact CA-O 3.45Å; S104-V125 WeakPolarHBondContact CB-O 3.47Å; G105-V125 PolarHBondContact N-O 3.12Å; G105-V125 VanDerWaalsContact N-O 3.15Å; G105-V125 PolarHBondContact O-N 3.1Å; Y107-V125 HydrophobicContact CD2-CB 3.77Å; Y107-V125 HydrophobicContact CD2-CG2 3.4Å; Y107-V125 HydrophobicContact CE2-CB 3.66Å; Y107-V125 HydrophobicContact CE2-CG1 4.39Å; Y107-V125 HydrophobicContact CE2-CG2 3.65Å; Y107-V125 HydrophobicContact CG-CG2 4.16Å; V125-V127 HydrophobicContact CG1-CG2 4.37Å
126	L	95.5	Very high	96.6	Very high	25 Å²	25	57.2 Å²	57.2	13%	0.131	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.7	175	177.6	62.7	0	0	0	110	W45 T46 V47 E128 H215	W45-L126 PolarHBondContact O-N 2.82Å; T46-L126 CarbonylContact C-O 3.52Å; T46-L126 VanDerWaalsContact CA-O 3.28Å; T46-L126 WeakPolarHBondContact CA-O 3.28Å; T46-L126 HydrophobicContact CG2-CB 4.43Å; T46-L126 HydrophobicContact CG2-CD2 4.21Å; T46-L126 HydrophobicContact CG2-CG 4.37Å; V47-L126 PolarHBondContact N-O 2.84Å; L126-E128 HydrophobicContact CD2-CG 4.25Å; L126-E128 HydrophobicContact CG-CG 4.17Å; L126-H215 HydrophobicContact CD1-CB 4.09Å
127	V	95.5	Very high	96.8	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.6	173.6	-177	0	0	0	0	109.5	V47 N49 V99 R100 S104 V125	V47-V127 CarbonylContact O-C 3.56Å; V47-V127 VanDerWaalsContact O-CA 3.25Å; V47-V127 WeakPolarHBondContact O-CA 3.32Å; N49-V127 HydrophobicContact CB-CG1 4.18Å; V99-V127 HydrophobicContact CB-CG2 4.44Å; V99-V127 HydrophobicContact CG1-CG1 3.97Å; V99-V127 HydrophobicContact CG1-CG2 4.04Å; V99-V127 HydrophobicContact CG2-CG2 3.58Å; R100-V127 WeakPolarHBondContact O-CG2 3.37Å; S104-V127 WeakPolarHBondContact OG-CB 3.36Å; S104-V127 WeakPolarHBondContact OG-CG2 3.46Å; S104-V127 PolarHBondContact OG-N 3.44Å; V125-V127 HydrophobicContact CG1-CG2 4.37Å
128	E	94.2	Very high	96.9	Very high	69 Å²	69	51.5 Å²	51.5	32%	0.322	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	147.7	-176.3	-66.6	-172.6	150.7	0	0	112.2	T46 V47 Q48 N49 L126	T46-E128 HydrophobicContact CG2-CG 3.81Å; V47-E128 PolarHBondContact O-N 2.81Å; Q48-E128 PolarHBondContact NE2-OE2 2.88Å; N49-E128 WeakPolarHBondContact CB-O 3.25Å; N49-E128 PolarHBondContact N-O 2.97Å; L126-E128 HydrophobicContact CD2-CG 4.25Å; L126-E128 HydrophobicContact CG-CG 4.17Å
129	G	93.8	Very high	96.8	Very high	26 Å²	26	51 Å²	51	27%	0.268	28%	0.275	S	S	.	.			trans	87.2	135.3	179.2	0	0	0	0	0	113.2	N49 I101	N49-G129 VanDerWaalsContact CB-O 3.26Å; N49-G129 WeakPolarHBondContact CB-O 3.28Å; N49-G129 PolarHBondContact ND2-O 3.13Å; I101-G129 WeakPolarHBondContact CD1-O 3.45Å
130	V	95.4	Very high	96.6	Very high	13 Å²	13	54.2 Å²	54.2	8%	0.079	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-102.8	132.2	169.8	-173.6	0	0	0	0	107.7	I101 V154 A208 I210 Q217	I101-V130 HydrophobicContact CD1-CB 4.26Å; I101-V130 HydrophobicContact CD1-CG2 3.63Å; V130-V154 HydrophobicContact CG1-CG1 4.31Å; V130-A208 HydrophobicContact CG1-CB 4.34Å; V130-I210 HydrophobicContact CG1-CD1 4Å; V130-I210 HydrophobicContact CG1-CG1 4.37Å; V130-I210 HydrophobicContact CG2-CG1 4.46Å; V130-Q217 VanDerWaalsContact CG2-C 3.45Å; V130-Q217 HydrophobicContact CG2-CB 3.6Å; V130-Q217 WeakPolarHBondContact CG2-O 3.26Å
131	P	95.7	Very high	96.5	Very high	22 Å²	22	60 Å²	60	14%	0.143	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-54	146.2	173.1	-24.8	34.2	0	0	0	112.1	V154 E156 E157	P131-V154 HydrophobicContact CB-CG1 4.08Å; P131-V154 HydrophobicContact CG-CG1 4.26Å; P131-E156 HydrophobicContact CG-CB 4.3Å; P131-E157 HydrophobicContact CG-CG 4.31Å
132	S	95.9	Very high	96.4	Very high	70 Å²	70	57.1 Å²	57.1	49%	0.49	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-60.4	128.7	176.2	-63.3	0	0	0	0	110.4
133	P	97.7	Very high	96.3	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.019	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-68.9	147.3	-177.3	25.3	-32.5	0	0	0	111.5	C152 S153 V154 C206 S219 E220 T222	P133-C152 VanDerWaalsContact CB-SG 3.55Å; P133-S153 CarbonylContact C-O 3.48Å; P133-S153 WeakPolarHBondContact CA-O 3.49Å; P133-V154 HydrophobicContact CB-CG2 4.05Å; P133-C206 HydrophobicContact CG-CB 4.38Å; P133-S219 WeakPolarHBondContact CD-OG 3.36Å; P133-E220 WeakPolarHBondContact CD-O 3.22Å; P133-T222 VanDerWaalsContact O-CB 3.24Å; P133-T222 WeakPolarHBondContact O-CB 3.38Å; P133-T222 WeakPolarHBondContact O-CG2 3.44Å; P133-T222 PolarHBondContact O-OG1 2.78Å
134	R	98.1	Very high	96.1	Very high	141 Å²	141	58.8 Å²	58.8	53%	0.532	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.5	171.9	-55.1	-175.5	-169.2	-177.3	3.7	109.4	C152 S153 P155 E156	R134-C152 WeakPolarHBondContact O-CA 3.27Å; R134-S153 PolarHBondContact N-O 2.93Å; R134-S153 PolarHBondContact O-N 2.59Å; R134-S153 PolarHBondContact O-OG 3.01Å; R134-P155 HydrophobicContact CG-CG 4.4Å; R134-E156 IonicContact CZ-OE1 3.98Å; R134-E156 IonicContact NE-OE1 2.59Å; R134-E156 IonicContact NH2-OE1 2.82Å; R134-E156 PolarHBondContact NH2-OE1 2.86Å
135	V	98.3	Very high	96	Very high	22 Å²	22	57.7 Å²	57.7	13%	0.133	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.7	179.8	-168.5	0	0	0	0	109.5	V150 N151 C206 T222	V135-V150 HydrophobicContact CG1-CG1 3.78Å; V135-N151 CarbonylContact C-O 3.6Å; V135-N151 WeakPolarHBondContact CA-O 3.34Å; V135-C206 HydrophobicContact CG2-CB 3.48Å; V135-C206 VanDerWaalsContact CG2-CB 3.48Å; V135-T222 HydrophobicContact CG2-CG2 4.2Å
136	T	98.1	Very high	95.9	Very high	76 Å²	76	58.5 Å²	58.5	47%	0.466	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.4	178.3	53.5	0	0	0	0	110.1	N151	T136-N151 PolarHBondContact N-O 3.15Å; T136-N151 PolarHBondContact O-N 2.83Å; T136-N151 WeakPolarHBondContact OG1-CB 3.48Å; T136-N151 PolarHBondContact OG1-O 2.93Å
137	L	98.1	Very high	96	Very high	41 Å²	41	61 Å²	61	22%	0.215	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148	-175.9	-54.3	177.6	0	0	0	109.4	K139 V148 V150 F204 V227	L137-K139 VanDerWaalsContact C-N 3.3Å; L137-V148 HydrophobicContact CD2-CG1 4.3Å; L137-V150 HydrophobicContact CD2-CB 4.22Å; L137-V150 HydrophobicContact CD2-CG1 3.97Å; L137-V150 HydrophobicContact CD2-CG2 3.82Å; L137-F204 HydrophobicContact CD1-CD2 4.23Å; L137-F204 HydrophobicContact CD2-CD2 3.58Å; L137-F204 HydrophobicContact CD2-CE2 4.13Å; L137-F204 HydrophobicContact CD2-CG 4.3Å; L137-V227 HydrophobicContact CD1-CG2 3.4Å
138	D	97.9	Very high	96.1	Very high	80 Å²	80	60.9 Å²	60.9	43%	0.428	33%	0.332	S	S	.	.	S	Bend	trans	-72.1	-24.9	174.6	67.1	-32.6	0	0	0	113.2	R149	D138-R149 HydrophobicContact CB-CB 4.03Å; D138-R149 PolarHBondContact N-O 2.9Å; D138-R149 VanDerWaalsContact N-O 3.14Å; D138-R149 PolarHBondContact OD1-N 2.85Å
139	K	95.9	Very high	96.3	Very high	75 Å²	75	63.1 Å²	63.1	33%	0.326	34%	0.338	S	S	.	.			trans	-148.2	156.3	-179	70.1	-164.6	81.8	-176.4	0	112.3	L137 E141 A142 I147 V148	L137-K139 VanDerWaalsContact C-N 3.3Å; K139-E141 VanDerWaalsContact CD-O 3.23Å; K139-E141 WeakPolarHBondContact CD-O 3.41Å; K139-E141 VanDerWaalsContact CG-O 3.28Å; K139-E141 WeakPolarHBondContact CG-O 3.35Å; K139-A142 HydrophobicContact CD-CB 4.02Å; K139-I147 WeakPolarHBondContact CE-O 3.25Å; K139-I147 PolarHBondContact NZ-O 2.85Å; K139-V148 HydrophobicContact CD-CG2 4.36Å; K139-V148 HydrophobicContact CG-CG2 4.37Å
140	K	95.4	Very high	96.5	Very high	129 Å²	129	61.9 Å²	61.9	56%	0.561	33%	0.325	S	S	*	.	S	Bend	trans	-103.1	-11.8	173	-54.8	-166	-172.4	-156	0	113.3	E225 V227 T228	K140-E225 WeakPolarHBondContact CE-OE2 3.23Å; K140-E225 IonicContact NZ-OE1 3.13Å; K140-E225 IonicContact NZ-OE2 2.8Å; K140-E225 PolarHBondContact NZ-OE2 3Å; K140-V227 VanDerWaalsContact O-CA 3.27Å; K140-V227 WeakPolarHBondContact O-CA 3.49Å; K140-T228 PolarHBondContact O-N 3.09Å
141	E	95.9	Very high	96.7	Very high	134 Å²	134	63.5 Å²	63.5	63%	0.626	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.2	176.7	-59	-176.9	-174	0	0	108.3	K139 T228	K139-E141 VanDerWaalsContact CD-O 3.23Å; K139-E141 WeakPolarHBondContact CD-O 3.41Å; K139-E141 VanDerWaalsContact CG-O 3.28Å; K139-E141 WeakPolarHBondContact CG-O 3.35Å; E141-T228 WeakPolarHBondContact CA-O 3.27Å
142	A	94.8	Very high	96.8	Very high	6 Å²	6	62.4 Å²	62.4	5%	0.05	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	147.7	-179.3	0	0	0	0	0	110.6	K139 V148 V195 V227 T228 V229 T230	K139-A142 HydrophobicContact CD-CB 4.02Å; A142-V148 HydrophobicContact CB-CG2 3.84Å; A142-V195 HydrophobicContact CB-CG2 3.87Å; A142-V227 HydrophobicContact CB-CG1 3.92Å; A142-T228 PolarHBondContact N-O 2.85Å; A142-V229 CarbonylContact O-C 3.55Å; A142-V229 WeakPolarHBondContact O-CA 3.3Å; A142-T230 PolarHBondContact O-N 2.9Å
143	I	94.7	Very high	96.9	Very high	110 Å²	110	60 Å²	60	56%	0.564	31%	0.309	S	S	*	.			trans	-91.9	152.9	175.4	60	173.1	0	0	0	110.9	G145 G146 T230	I143-G145 PolarHBondContact O-N 2.91Å; I143-G146 WeakPolarHBondContact O-CA 3.44Å; I143-G146 PolarHBondContact O-N 2.79Å; I143-T230 WeakPolarHBondContact CA-O 3.2Å
144	Q	94.4	Very high	96.9	Very high	98 Å²	98	59.9 Å²	59.9	46%	0.458	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	135.5	169.4	178.3	178.1	-24.5	0	0	111.7	G146 E197 T230	Q144-G146 PolarHBondContact O-N 2.93Å; Q144-E197 VanDerWaalsContact CD-CA 3.5Å; Q144-E197 HydrophobicContact CG-CB 4.26Å; Q144-E197 PolarHBondContact NE2-OE1 3.04Å; Q144-T230 PolarHBondContact N-O 2.91Å
145	G	93.4	Very high	96.9	Very high	70 Å²	70	55.6 Å²	55.6	72%	0.722	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-3.3	-175.3	0	0	0	0	0	114.3	I143 V195	I143-G145 PolarHBondContact O-N 2.91Å; G145-V195 WeakPolarHBondContact CA-O 2.98Å; G145-V195 PolarHBondContact N-O 3.39Å
146	G	95.8	Very high	96.7	Very high	18 Å²	18	57 Å²	57	19%	0.186	30%	0.304	C	S	.	.			trans	-76.5	-174.4	173.6	0	0	0	0	0	113.4	I143 Q144 P194 V195	I143-G146 WeakPolarHBondContact O-CA 3.44Å; I143-G146 PolarHBondContact O-N 2.79Å; Q144-G146 PolarHBondContact O-N 2.93Å; G146-P194 CarbonylContact O-C 3.52Å; G146-P194 WeakPolarHBondContact O-CA 3.37Å; G146-V195 PolarHBondContact O-N 2.93Å
147	I	97.3	Very high	96.7	Very high	76 Å²	76	53.6 Å²	53.6	39%	0.39	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142	179.4	-65.1	172.9	0	0	0	109	K139 R149 E192 F193	K139-I147 WeakPolarHBondContact CE-O 3.25Å; K139-I147 PolarHBondContact NZ-O 2.85Å; I147-R149 HydrophobicContact CG2-CG 4.5Å; I147-E192 HydrophobicContact CG2-CB 3.71Å; I147-E192 HydrophobicContact CG2-CG 4.4Å; I147-F193 CarbonylContact C-O 3.58Å; I147-F193 WeakPolarHBondContact CA-O 3.5Å
148	V	97.9	Very high	96.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.2	167.6	-179.5	0	0	0	0	108.8	L137 K139 A142 V150 F193 V195 F204 V227	L137-V148 HydrophobicContact CD2-CG1 4.3Å; K139-V148 HydrophobicContact CD-CG2 4.36Å; K139-V148 HydrophobicContact CG-CG2 4.37Å; A142-V148 HydrophobicContact CB-CG2 3.84Å; V148-V150 HydrophobicContact CG1-CG2 4.37Å; V148-F193 PolarHBondContact N-O 3.1Å; V148-F193 PolarHBondContact O-N 2.79Å; V148-V195 HydrophobicContact CG2-CG2 3.99Å; V148-F204 HydrophobicContact CB-CE2 4.27Å; V148-F204 HydrophobicContact CB-CZ 3.99Å; V148-F204 HydrophobicContact CG1-CE2 3.74Å; V148-F204 HydrophobicContact CG1-CZ 3.95Å; V148-F204 HydrophobicContact CG2-CZ 4.46Å; V148-V227 HydrophobicContact CG2-CG1 4.21Å
149	R	98.4	Very high	96.3	Very high	116 Å²	116	55.2 Å²	55.2	44%	0.438	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.4	177	-54.2	178.9	78.7	-154.5	-4.3	108.6	D138 I147 I190 E192	D138-R149 HydrophobicContact CB-CB 4.03Å; D138-R149 PolarHBondContact N-O 2.9Å; D138-R149 VanDerWaalsContact N-O 3.14Å; D138-R149 PolarHBondContact OD1-N 2.85Å; I147-R149 HydrophobicContact CG2-CG 4.5Å; R149-I190 HydrophobicContact CB-CG2 4.26Å; R149-E192 HydrophobicContact CG-CG 4.14Å; R149-E192 IonicContact CZ-OE1 2.65Å; R149-E192 IonicContact NE-OE1 2.56Å; R149-E192 PolarHBondContact NE-OE1 3.45Å; R149-E192 IonicContact NH2-OE1 3.67Å
150	V	98.6	Very high	96.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	117.3	-177.9	-172.8	0	0	0	0	108.5	V135 L137 V148 I165 I190 L191 F193 F204	V135-V150 HydrophobicContact CG1-CG1 3.78Å; L137-V150 HydrophobicContact CD2-CB 4.22Å; L137-V150 HydrophobicContact CD2-CG1 3.97Å; L137-V150 HydrophobicContact CD2-CG2 3.82Å; V148-V150 HydrophobicContact CG1-CG2 4.37Å; V150-I165 HydrophobicContact CB-CD1 4.38Å; V150-I165 HydrophobicContact CB-CG2 4.49Å; V150-I165 HydrophobicContact CG1-CD1 3.98Å; V150-I165 HydrophobicContact CG1-CG2 3.99Å; V150-I190 WeakPolarHBondContact O-CA 3.36Å; V150-L191 PolarHBondContact N-O 2.99Å; V150-L191 PolarHBondContact O-N 2.98Å; V150-F193 HydrophobicContact CB-CD2 4.26Å; V150-F193 HydrophobicContact CB-CE2 4.27Å; V150-F193 HydrophobicContact CG2-CD2 3.61Å; V150-F193 HydrophobicContact CG2-CE2 4Å; V150-F204 HydrophobicContact CG1-CB 4.06Å; V150-F204 HydrophobicContact CG1-CG 4.36Å; V150-F204 HydrophobicContact CG2-CB 4.2Å; V150-F204 HydrophobicContact CG2-CD1 3.59Å; V150-F204 HydrophobicContact CG2-CD2 3.87Å; V150-F204 HydrophobicContact CG2-CE1 3.84Å; V150-F204 HydrophobicContact CG2-CE2 4.13Å; V150-F204 HydrophobicContact CG2-CG 3.59Å; V150-F204 HydrophobicContact CG2-CZ 4.1Å
151	N	98.5	Very high	96.4	Very high	46 Å²	46	49.1 Å²	49.1	25%	0.246	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.7	171	176.9	4.7	0	0	0	109.4	V135 T136 V189 I190	V135-N151 CarbonylContact C-O 3.6Å; V135-N151 WeakPolarHBondContact CA-O 3.34Å; T136-N151 PolarHBondContact N-O 3.15Å; T136-N151 PolarHBondContact O-N 2.83Å; T136-N151 WeakPolarHBondContact OG1-CB 3.48Å; T136-N151 PolarHBondContact OG1-O 2.93Å; N151-V189 WeakPolarHBondContact CA-O 3.34Å; N151-I190 HydrophobicContact CB-CG1 4.07Å
152	C	98.4	Very high	96.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.4	172.9	-177.3	0	0	0	0	110.5	P133 R134 F163 I165 F188 V189 C206	P133-C152 VanDerWaalsContact CB-SG 3.55Å; R134-C152 WeakPolarHBondContact O-CA 3.27Å; C152-F163 HydrophobicContact CB-CD1 4.21Å; C152-I165 HydrophobicContact CB-CD1 3.63Å; C152-I165 HydrophobicContact CB-CG1 4.24Å; C152-F188 CarbonylContact O-C 3.56Å; C152-F188 WeakPolarHBondContact O-CA 3.42Å; C152-F188 VanDerWaalsContact O-CB 3.31Å; C152-F188 WeakPolarHBondContact O-CB 3.28Å; C152-V189 HydrophobicContact CB-CG2 4.4Å; C152-V189 PolarHBondContact N-O 3.5Å; C152-V189 PolarHBondContact O-N 3.16Å; C152-C206 HydrophobicContact CB-CB 3.82Å; C152-C206 WeakPolarHBondContact CB-SG 3.21Å; C152-C206 WeakPolarHBondContact SG-CB 3.29Å; C152-C206 CovalentContact SG-SG 2.01Å; C152-C206 PolarHBondContact SG-SG 3.14Å
153	S	98.3	Very high	96.7	Very high	19 Å²	19	44.3 Å²	44.3	13%	0.133	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150	-173.4	61.5	0	0	0	0	112.8	P133 R134 N187 F188	P133-S153 CarbonylContact C-O 3.48Å; P133-S153 WeakPolarHBondContact CA-O 3.49Å; R134-S153 PolarHBondContact N-O 2.93Å; R134-S153 PolarHBondContact O-N 2.59Å; R134-S153 PolarHBondContact O-OG 3.01Å; S153-N187 CarbonylContact C-O 3.55Å; S153-N187 WeakPolarHBondContact CA-O 3.41Å; S153-F188 VanDerWaalsContact CB-CB 3.46Å
154	V	97.8	Very high	96.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.			trans	-121.2	81.3	166.1	-172.2	0	0	0	0	107	V130 P131 P133 E156 E157 I161 F163 N187 A208	V130-V154 HydrophobicContact CG1-CG1 4.31Å; P131-V154 HydrophobicContact CB-CG1 4.08Å; P131-V154 HydrophobicContact CG-CG1 4.26Å; P133-V154 HydrophobicContact CB-CG2 4.05Å; V154-E156 PolarHBondContact O-N 2.88Å; V154-E157 HydrophobicContact CB-CB 4.33Å; V154-E157 HydrophobicContact CG1-CB 3.77Å; V154-E157 HydrophobicContact CG1-CG 3.76Å; V154-E157 PolarHBondContact O-N 3.27Å; V154-E157 VanDerWaalsContact O-N 3.09Å; V154-I161 HydrophobicContact CB-CD1 4.12Å; V154-F163 HydrophobicContact CG2-CE1 3.91Å; V154-F163 HydrophobicContact CG2-CZ 4.17Å; V154-N187 PolarHBondContact N-O 2.94Å; V154-A208 HydrophobicContact CG2-CB 3.44Å; V154-A208 VanDerWaalsContact CG2-CB 3.44Å
155	P	96.5	Very high	97	Very high	51 Å²	51	35 Å²	35	33%	0.331	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.8	-166.1	21.1	-29.5	0	0	0	114	R134 E157 N187	R134-P155 HydrophobicContact CG-CG 4.4Å; P155-E157 VanDerWaalsContact C-N 3.28Å; P155-E157 PolarHBondContact O-N 3.11Å; P155-N187 WeakPolarHBondContact CA-ND2 3.44Å; P155-N187 PolarHBondContact O-ND2 3.16Å
156	E	95.6	Very high	97.3	Very high	52 Å²	52	33.4 Å²	33.4	24%	0.243	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-10.7	179.9	-54.3	80	-173.8	0	0	113.2	P131 R134 V154	P131-E156 HydrophobicContact CG-CB 4.3Å; R134-E156 IonicContact CZ-OE1 3.98Å; R134-E156 IonicContact NE-OE1 2.59Å; R134-E156 IonicContact NH2-OE1 2.82Å; R134-E156 PolarHBondContact NH2-OE1 2.86Å; V154-E156 PolarHBondContact O-N 2.88Å
157	E	96.3	Very high	97.3	Very high	5 Å²	5	32.5 Å²	32.5	2%	0.023	17%	0.168	C	C	.	.	S	Bend	trans	-112.8	166	-177.9	-73.1	-65.3	165.3	0	0	112.7	N49 R100 I101 P131 V154 P155 I161 N187 I210	N49-E157 PolarHBondContact ND2-OE1 2.86Å; R100-E157 WeakPolarHBondContact CB-OE1 3.49Å; I101-E157 PolarHBondContact N-OE1 2.82Å; I101-E157 PolarHBondContact N-OE2 2.96Å; P131-E157 HydrophobicContact CG-CG 4.31Å; V154-E157 HydrophobicContact CB-CB 4.33Å; V154-E157 HydrophobicContact CG1-CB 3.77Å; V154-E157 HydrophobicContact CG1-CG 3.76Å; V154-E157 PolarHBondContact O-N 3.27Å; V154-E157 VanDerWaalsContact O-N 3.09Å; P155-E157 VanDerWaalsContact C-N 3.28Å; P155-E157 PolarHBondContact O-N 3.11Å; E157-I161 HydrophobicContact CB-CD1 3.96Å; E157-N187 VanDerWaalsContact O-CB 3.27Å; E157-N187 WeakPolarHBondContact O-CB 3.38Å; E157-I210 HydrophobicContact CB-CD1 3.72Å; E157-I210 HydrophobicContact CG-CD1 3.64Å
158	K	94.9	Very high	97.2	Very high	122 Å²	122	29.6 Å²	29.6	53%	0.53	15%	0.153	S	C	.	.			trans	-108.5	154.8	179.3	-68	178	-174.9	167.6	0	111.4	Y102 I161	Y102-K158 HydrophobicContact CD1-CB 3.92Å; Y102-K158 HydrophobicContact CD1-CD 3.68Å; Y102-K158 HydrophobicContact CD1-CG 3.62Å; Y102-K158 HydrophobicContact CD2-CD 4.25Å; Y102-K158 HydrophobicContact CE1-CD 3.92Å; Y102-K158 HydrophobicContact CE1-CG 3.81Å; Y102-K158 HydrophobicContact CG-CB 4.5Å; Y102-K158 HydrophobicContact CG-CD 3.85Å; Y102-K158 HydrophobicContact CG-CG 4.28Å; K158-I161 WeakPolarHBondContact O-CG1 3.49Å
159	A	94.6	Very high	96.9	Very high	33 Å²	33	30.2 Å²	30.2	27%	0.273	16%	0.156	S	C	.	.	S	Bend	trans	-64.4	152.6	171.9	0	0	0	0	0	111.4	R184 Q186	A159-R184 VanDerWaalsContact CB-O 3.27Å; A159-R184 WeakPolarHBondContact CB-O 3.46Å; A159-Q186 WeakPolarHBondContact CB-O 3.36Å
160	P	95.7	Very high	96.3	Very high	75 Å²	75	28.2 Å²	28.2	49%	0.487	15%	0.153	S	C	.	.			cis	-84.6	141	3.3	32.8	-34.6	0	0	0	114	S183	P160-S183 CarbonylContact C-O 3.56Å; P160-S183 WeakPolarHBondContact CA-O 3.27Å
161	I	97	Very high	95.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130	178.1	-50.2	-178.2	0	0	0	109.9	V154 E157 K158 F163 S183 N187 A208 I210	V154-I161 HydrophobicContact CB-CD1 4.12Å; E157-I161 HydrophobicContact CB-CD1 3.96Å; K158-I161 WeakPolarHBondContact O-CG1 3.49Å; I161-F163 HydrophobicContact CB-CD2 4.26Å; I161-F163 HydrophobicContact CB-CE2 3.59Å; I161-F163 HydrophobicContact CB-CZ 4Å; I161-F163 HydrophobicContact CD1-CZ 4.35Å; I161-F163 HydrophobicContact CG2-CD2 4.02Å; I161-F163 HydrophobicContact CG2-CE1 4.14Å; I161-F163 HydrophobicContact CG2-CE2 3.52Å; I161-F163 HydrophobicContact CG2-CZ 3.57Å; I161-S183 PolarHBondContact N-O 2.72Å; I161-S183 PolarHBondContact O-N 3.24Å; I161-N187 HydrophobicContact CD1-CB 4.12Å; I161-A208 HydrophobicContact CG2-CB 3.99Å; I161-I210 HydrophobicContact CB-CG1 4.42Å; I161-I210 HydrophobicContact CD1-CD1 4.11Å; I161-I210 HydrophobicContact CG1-CD1 4.1Å; I161-I210 HydrophobicContact CG1-CG1 4.07Å; I161-I210 HydrophobicContact CG2-CG1 3.97Å
162	H	97.6	Very high	94.4	Very high	40 Å²	40	37.8 Å²	37.8	19%	0.185	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.9	172.4	-174.4	77.8	0	0	0	110.5	E180 A208 R209	H162-E180 IonicContact CE1-OE2 2.99Å; H162-E180 PolarHBondContact CE1-OE2 2.03Å; H162-E180 IonicContact NE2-OE2 2.65Å; H162-E180 PolarHBondContact NE2-OE2 3.2Å; H162-A208 CarbonylContact O-C 3.55Å; H162-A208 WeakPolarHBondContact O-CA 3.01Å; H162-R209 HydrophobicContact CB-CB 4.29Å; H162-R209 PolarHBondContact N-O 2.82Å; H162-R209 PolarHBondContact O-N 2.9Å
163	F	98.3	Very high	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	139.3	179.5	-69.4	-87	0	0	0	111	C152 V154 I161 E180 K181 N187 V189 Q207 A208	C152-F163 HydrophobicContact CB-CD1 4.21Å; V154-F163 HydrophobicContact CG2-CE1 3.91Å; V154-F163 HydrophobicContact CG2-CZ 4.17Å; I161-F163 HydrophobicContact CB-CD2 4.26Å; I161-F163 HydrophobicContact CB-CE2 3.59Å; I161-F163 HydrophobicContact CB-CZ 4Å; I161-F163 HydrophobicContact CD1-CZ 4.35Å; I161-F163 HydrophobicContact CG2-CD2 4.02Å; I161-F163 HydrophobicContact CG2-CE1 4.14Å; I161-F163 HydrophobicContact CG2-CE2 3.52Å; I161-F163 HydrophobicContact CG2-CZ 3.57Å; F163-E180 CarbonylContact O-C 3.56Å; F163-E180 VanDerWaalsContact O-CA 3.26Å; F163-E180 WeakPolarHBondContact O-CA 3.27Å; F163-K181 PolarHBondContact N-O 3.2Å; F163-K181 PolarHBondContact O-N 3.41Å; F163-N187 WeakPolarHBondContact CZ-O 3.01Å; F163-V189 HydrophobicContact CB-CG1 4.31Å; F163-V189 HydrophobicContact CB-CG2 3.49Å; F163-V189 VanDerWaalsContact CB-CG2 3.49Å; F163-V189 HydrophobicContact CD1-CG2 4.23Å; F163-V189 HydrophobicContact CD2-CB 4.23Å; F163-V189 HydrophobicContact CD2-CG1 3.5Å; F163-V189 HydrophobicContact CD2-CG2 3.8Å; F163-V189 HydrophobicContact CE2-CG1 4.11Å; F163-V189 HydrophobicContact CG-CB 4.49Å; F163-V189 HydrophobicContact CG-CG1 4.16Å; F163-V189 HydrophobicContact CG-CG2 3.58Å; F163-Q207 WeakPolarHBondContact CA-O 3.49Å; F163-A208 HydrophobicContact CD1-CB 4.06Å; F163-A208 HydrophobicContact CE1-CB 3.9Å
164	T	98.4	Very high	92.7	Very high	12 Å²	12	53.6 Å²	53.6	7%	0.074	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.7	169.1	-65.1	0	0	0	0	108.3	E166 K178 E180 C206 Q207	T164-E166 HydrophobicContact CG2-CG 4.38Å; T164-K178 HydrophobicContact CG2-CD 4.3Å; T164-K178 HydrophobicContact CG2-CG 4.13Å; T164-E180 HydrophobicContact CG2-CG 4.16Å; T164-C206 CarbonylContact O-C 3.53Å; T164-C206 VanDerWaalsContact O-CA 3.3Å; T164-C206 WeakPolarHBondContact O-CA 3.36Å; T164-Q207 PolarHBondContact N-O 3.49Å; T164-Q207 PolarHBondContact O-N 3.46Å
165	I	98.5	Very high	92.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.4	175.9	-52.6	-173.2	0	0	0	109.3	V150 C152 R179 V189 L191 F193 F204 R205 C206	V150-I165 HydrophobicContact CB-CD1 4.38Å; V150-I165 HydrophobicContact CB-CG2 4.49Å; V150-I165 HydrophobicContact CG1-CD1 3.98Å; V150-I165 HydrophobicContact CG1-CG2 3.99Å; C152-I165 HydrophobicContact CB-CD1 3.63Å; C152-I165 HydrophobicContact CB-CG1 4.24Å; I165-R179 PolarHBondContact N-O 3.46Å; I165-R179 PolarHBondContact O-N 3.2Å; I165-V189 HydrophobicContact CD1-CG2 4.14Å; I165-L191 HydrophobicContact CB-CD1 4.23Å; I165-L191 HydrophobicContact CD1-CB 4.38Å; I165-L191 HydrophobicContact CD1-CD1 3.88Å; I165-L191 HydrophobicContact CD1-CG 4.25Å; I165-L191 HydrophobicContact CG1-CD1 4.05Å; I165-F193 HydrophobicContact CB-CE2 4.08Å; I165-F193 HydrophobicContact CB-CZ 3.8Å; I165-F193 HydrophobicContact CG2-CE2 3.61Å; I165-F193 HydrophobicContact CG2-CZ 3.55Å; I165-F204 HydrophobicContact CG2-CB 4.33Å; I165-R205 CarbonylContact C-O 3.54Å; I165-R205 WeakPolarHBondContact CA-O 3Å; I165-C206 HydrophobicContact CG1-CB 4.27Å
166	E	97.9	Very high	92.3	Very high	36 Å²	36	56.6 Å²	56.6	17%	0.168	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.3	-179.7	-67.8	176.9	159.9	0	0	110.1	T164 L168 V175 L177 K178 F204 R205	T164-E166 HydrophobicContact CG2-CG 4.38Å; E166-L168 HydrophobicContact CB-CD2 4.43Å; E166-V175 HydrophobicContact CB-CG1 3.83Å; E166-V175 HydrophobicContact CB-CG2 4.48Å; E166-V175 HydrophobicContact CG-CG1 3.92Å; E166-V175 HydrophobicContact CG-CG2 4.45Å; E166-L177 CarbonylContact C-O 3.52Å; E166-L177 WeakPolarHBondContact CA-O 3.34Å; E166-K178 HydrophobicContact CG-CB 4.34Å; E166-K178 HydrophobicContact CG-CG 3.96Å; E166-F204 CarbonylContact O-C 3.57Å; E166-F204 VanDerWaalsContact O-CA 3.29Å; E166-F204 WeakPolarHBondContact O-CA 3.39Å; E166-R205 HydrophobicContact CB-CB 4.36Å; E166-R205 PolarHBondContact N-O 2.81Å; E166-R205 PolarHBondContact O-N 3.26Å; E166-R205 IonicContact OE2-CZ 2.76Å; E166-R205 IonicContact OE2-NE 2.63Å; E166-R205 PolarHBondContact OE2-NE 2.78Å; E166-R205 IonicContact OE2-NH2 3.75Å; E166-R205 PolarHBondContact OE2-NH2 2.86Å
167	K	97.1	Very high	92.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.1	169.3	179.4	-175.2	176	-176.9	0	109.4	K176 L177 F193 P194 E196 D199 L202 F204	K167-K176 HydrophobicContact CD-CB 4.45Å; K167-K176 HydrophobicContact CG-CB 4.44Å; K167-K176 PolarHBondContact O-N 2.99Å; K167-L177 HydrophobicContact CB-CB 4.07Å; K167-L177 HydrophobicContact CD-CB 4.28Å; K167-L177 PolarHBondContact N-O 3.23Å; K167-F193 HydrophobicContact CB-CD1 3.73Å; K167-F193 HydrophobicContact CB-CE1 3.98Å; K167-F193 HydrophobicContact CD-CD1 4.29Å; K167-F193 HydrophobicContact CG-CD1 4.47Å; K167-P194 PolarHBondContact NZ-O 2.7Å; K167-E196 IonicContact NZ-OE1 3.46Å; K167-E196 PolarHBondContact NZ-OE1 3.48Å; K167-E196 IonicContact NZ-OE2 2.85Å; K167-E196 PolarHBondContact NZ-OE2 2.91Å; K167-D199 VanDerWaalsContact CE-OD2 3.3Å; K167-D199 WeakPolarHBondContact CE-OD2 3.33Å; K167-D199 IonicContact NZ-OD1 3.75Å; K167-D199 IonicContact NZ-OD2 2.98Å; K167-D199 PolarHBondContact NZ-OD2 2.85Å; K167-L202 HydrophobicContact CG-CD2 4.31Å; K167-F204 HydrophobicContact CB-CD1 4.14Å; K167-F204 HydrophobicContact CB-CE1 3.94Å; K167-F204 HydrophobicContact CD-CE1 4.46Å; K167-F204 HydrophobicContact CG-CD1 4.43Å; K167-F204 HydrophobicContact CG-CE1 3.85Å
168	L	94.7	Very high	92.3	Very high	15 Å²	15	61.2 Å²	61.2	8%	0.079	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	146.8	-178.9	-51.5	175.5	0	0	0	109.6	E166 V175 L202 S203 R205	E166-L168 HydrophobicContact CB-CD2 4.43Å; L168-V175 HydrophobicContact CD2-CB 4.34Å; L168-V175 HydrophobicContact CD2-CG2 3.81Å; L168-L202 CarbonylContact O-C 3.49Å; L168-L202 VanDerWaalsContact O-CA 3.3Å; L168-L202 WeakPolarHBondContact O-CA 3.08Å; L168-S203 WeakPolarHBondContact CA-O 3.2Å; L168-S203 WeakPolarHBondContact CB-O 3.39Å; L168-S203 PolarHBondContact N-O 2.96Å; L168-S203 PolarHBondContact O-N 3.06Å; L168-R205 HydrophobicContact CD1-CB 3.85Å
169	E	91.9	Very high	92.5	Very high	12 Å²	12	59.5 Å²	59.5	6%	0.056	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.8	164.7	177.5	102.2	-121.6	0	0	109.2	N171 E172 K176 D199 R200 V201	E169-N171 PolarHBondContact O-N 2.9Å; E169-E172 HydrophobicContact CB-CB 4.03Å; E169-E172 HydrophobicContact CB-CG 3.99Å; E169-E172 HydrophobicContact CG-CB 4.43Å; E169-E172 HydrophobicContact CG-CG 3.9Å; E169-E172 PolarHBondContact O-N 2.86Å; E169-E172 VanDerWaalsContact O-N 3.16Å; E169-K176 HydrophobicContact CB-CD 4.11Å; E169-K176 WeakPolarHBondContact OE2-CE 3.07Å; E169-K176 IonicContact OE2-NZ 3.85Å; E169-K176 PolarHBondContact OE2-NZ 3.25Å; E169-D199 WeakPolarHBondContact OE2-CA 3.24Å; E169-R200 WeakPolarHBondContact OE1-CA 3.23Å; E169-R200 WeakPolarHBondContact OE1-CB 3.25Å; E169-R200 PolarHBondContact OE1-N 2.93Å; E169-V201 CarbonylContact C-O 3.56Å; E169-V201 WeakPolarHBondContact CA-O 2.98Å; E169-V201 PolarHBondContact OE1-N 3.45Å
170	L	86.5	Confident	92.7	Very high	75 Å²	75	62.5 Å²	62.5	39%	0.393	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	135.5	173.9	-169.4	69.7	0	0	0	110.1	E172 V201 L226	L170-E172 PolarHBondContact O-N 2.78Å; L170-V201 HydrophobicContact CB-CB 3.79Å; L170-V201 HydrophobicContact CB-CG1 3.92Å; L170-V201 WeakPolarHBondContact CB-O 3.45Å; L170-V201 HydrophobicContact CD2-CB 4.16Å; L170-V201 HydrophobicContact CD2-CG1 3.87Å; L170-V201 HydrophobicContact CG-CG1 4.47Å; L170-V201 PolarHBondContact N-O 3.37Å; L170-L226 HydrophobicContact CD1-CD1 4.47Å; L170-L226 HydrophobicContact CD1-CD2 4.2Å; L170-L226 HydrophobicContact CD2-CD1 4.39Å
171	N	77.6	Confident	92.7	Very high	158 Å²	158	63.8 Å²	63.8	85%	0.845	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-2	-176.2	-49.7	-46.8	0	0	0	115.6	E169	E169-N171 PolarHBondContact O-N 2.9Å
172	E	79.3	Confident	92.7	Very high	89 Å²	89	67.6 Å²	67.6	42%	0.416	32%	0.322	S	S	.	.			trans	-97.7	137.8	168.4	-62.4	-170.5	-179.4	0	0	110.6	E169 L170 M174	E169-E172 HydrophobicContact CB-CB 4.03Å; E169-E172 HydrophobicContact CB-CG 3.99Å; E169-E172 HydrophobicContact CG-CB 4.43Å; E169-E172 HydrophobicContact CG-CG 3.9Å; E169-E172 PolarHBondContact O-N 2.86Å; E169-E172 VanDerWaalsContact O-N 3.16Å; L170-E172 PolarHBondContact O-N 2.78Å; E172-M174 VanDerWaalsContact C-N 3.31Å
173	K	76	Confident	92.7	Very high	213 Å²	213	66 Å²	66	93%	0.926	32%	0.316	S	S	*	.			trans	-83.8	-12.7	173.8	-66.1	-176.6	-179.3	178.8	0	112.3
174	M	85.3	Confident	92.5	Very high	138 Å²	138	75.9 Å²	75.9	68%	0.68	35%	0.353	S	S	*	.	S	Bend	trans	-85.9	139.3	-173.7	-65.1	-164.2	-64.6	0	0	111.3	E172 K176	E172-M174 VanDerWaalsContact C-N 3.31Å; M174-K176 PolarHBondContact O-N 2.95Å
175	V	92.1	Very high	92.4	Very high	57 Å²	57	81.5 Å²	81.5	35%	0.345	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	116.1	169.2	178.4	0	0	0	0	107.6	E166 L168 K178	E166-V175 HydrophobicContact CB-CG1 3.83Å; E166-V175 HydrophobicContact CB-CG2 4.48Å; E166-V175 HydrophobicContact CG-CG1 3.92Å; E166-V175 HydrophobicContact CG-CG2 4.45Å; L168-V175 HydrophobicContact CD2-CB 4.34Å; L168-V175 HydrophobicContact CD2-CG2 3.81Å; V175-K178 HydrophobicContact CG1-CB 4.28Å
176	K	92.3	Very high	92.3	Very high	56 Å²	56	85.5 Å²	85.5	24%	0.243	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-42.6	179.6	-75.8	-168.9	155.8	-171.4	0	112.1	K167 E169 M174 D199	K167-K176 HydrophobicContact CD-CB 4.45Å; K167-K176 HydrophobicContact CG-CB 4.44Å; K167-K176 PolarHBondContact O-N 2.99Å; E169-K176 HydrophobicContact CB-CD 4.11Å; E169-K176 WeakPolarHBondContact OE2-CE 3.07Å; E169-K176 IonicContact OE2-NZ 3.85Å; E169-K176 PolarHBondContact OE2-NZ 3.25Å; M174-K176 PolarHBondContact O-N 2.95Å; K176-D199 WeakPolarHBondContact CD-OD1 3.41Å; K176-D199 IonicContact NZ-OD1 2.68Å; K176-D199 PolarHBondContact NZ-OD1 3.29Å
177	L	95.9	Very high	92.3	Very high	49 Å²	49	86.1 Å²	86.1	26%	0.257	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	134.6	179.8	179.8	58.9	0	0	0	110.1	E166 K167 R179 F193 P194	E166-L177 CarbonylContact C-O 3.52Å; E166-L177 WeakPolarHBondContact CA-O 3.34Å; K167-L177 HydrophobicContact CB-CB 4.07Å; K167-L177 HydrophobicContact CD-CB 4.28Å; K167-L177 PolarHBondContact N-O 3.23Å; L177-R179 HydrophobicContact CG-CG 4.33Å; L177-F193 HydrophobicContact CB-CD1 4.48Å; L177-F193 HydrophobicContact CD2-CD1 3.84Å; L177-F193 HydrophobicContact CD2-CE1 4.24Å; L177-F193 HydrophobicContact CG-CD1 4.2Å; L177-F193 HydrophobicContact CG-CE1 4.16Å; L177-P194 HydrophobicContact CD2-CG 4.43Å
178	K	97.6	Very high	92.3	Very high	106 Å²	106	88.7 Å²	88.7	46%	0.461	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.8	174.2	-175.5	-174.8	-171	-154.9	0	109.2	T164 E166 V175 E180	T164-K178 HydrophobicContact CG2-CD 4.3Å; T164-K178 HydrophobicContact CG2-CG 4.13Å; E166-K178 HydrophobicContact CG-CB 4.34Å; E166-K178 HydrophobicContact CG-CG 3.96Å; V175-K178 HydrophobicContact CG1-CB 4.28Å; K178-E180 WeakPolarHBondContact CE-OE1 3.45Å; K178-E180 IonicContact NZ-OE1 3.62Å; K178-E180 PolarHBondContact NZ-OE1 3.46Å
179	R	98.3	Very high	92.5	Very high	86 Å²	86	88 Å²	88	33%	0.325	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.1	174.3	-63.4	-102.1	-172.7	80.2	-6.5	109.1	I165 L177 L191 E192 F193	I165-R179 PolarHBondContact N-O 3.46Å; I165-R179 PolarHBondContact O-N 3.2Å; L177-R179 HydrophobicContact CG-CG 4.33Å; R179-L191 HydrophobicContact CB-CD1 3.8Å; R179-E192 PolarHBondContact NH1-O 3.33Å; R179-E192 PolarHBondContact NH2-O 3.02Å; R179-F193 HydrophobicContact CB-CE1 4.23Å; R179-F193 HydrophobicContact CB-CZ 3.82Å; R179-F193 HydrophobicContact CG-CE1 3.72Å; R179-F193 HydrophobicContact CG-CZ 3.76Å
180	E	97.9	Very high	92.8	Very high	96 Å²	96	90.6 Å²	90.6	45%	0.449	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.5	179	-60.1	-172.6	-148	0	0	109.9	H162 F163 T164 K178	H162-E180 IonicContact CE1-OE2 2.99Å; H162-E180 PolarHBondContact CE1-OE2 2.03Å; H162-E180 IonicContact NE2-OE2 2.65Å; H162-E180 PolarHBondContact NE2-OE2 3.2Å; F163-E180 CarbonylContact O-C 3.56Å; F163-E180 VanDerWaalsContact O-CA 3.26Å; F163-E180 WeakPolarHBondContact O-CA 3.27Å; T164-E180 HydrophobicContact CG2-CG 4.16Å; K178-E180 WeakPolarHBondContact CE-OE1 3.45Å; K178-E180 IonicContact NZ-OE1 3.62Å; K178-E180 PolarHBondContact NZ-OE1 3.46Å
181	K	97.6	Very high	93.4	Very high	101 Å²	101	88.1 Å²	88.1	44%	0.439	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	132.9	177.3	-174.7	171.7	178.7	-176.7	0	110.8	F163 V189 L191	F163-K181 PolarHBondContact N-O 3.2Å; F163-K181 PolarHBondContact O-N 3.41Å; K181-V189 HydrophobicContact CB-CG1 4.08Å; K181-V189 HydrophobicContact CD-CB 4.23Å; K181-V189 HydrophobicContact CD-CG1 3.94Å; K181-V189 HydrophobicContact CG-CG1 3.94Å; K181-L191 HydrophobicContact CB-CD1 4.44Å; K181-L191 HydrophobicContact CB-CD2 4.09Å; K181-L191 HydrophobicContact CD-CD2 3.74Å
182	N	96.6	Very high	94.4	Very high	80 Å²	80	85 Å²	85	43%	0.428	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	119.9	168.6	-173.7	-74.6	0	0	0	109.2
183	S	96.7	Very high	95.3	Very high	7 Å²	7	80.8 Å²	80.8	5%	0.049	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.4	171	-154.4	0	0	0	0	109	P160 I161 Q186 F188	P160-S183 CarbonylContact C-O 3.56Å; P160-S183 WeakPolarHBondContact CA-O 3.27Å; I161-S183 PolarHBondContact N-O 2.72Å; I161-S183 PolarHBondContact O-N 3.24Å; S183-Q186 VanDerWaalsContact CB-O 3.23Å; S183-Q186 WeakPolarHBondContact CB-O 3.32Å; S183-Q186 PolarHBondContact OG-O 2.85Å; S183-F188 WeakPolarHBondContact CB-O 3.25Å; S183-F188 PolarHBondContact OG-O 2.92Å
184	R	95.1	Very high	96.3	Very high	207 Å²	207	72.9 Å²	72.9	78%	0.781	35%	0.345	S	S	*	.	S	Bend	trans	-96	-31.7	-171.2	-66.5	-173.8	179.1	-165.4	-0.1	113.4	A159	A159-R184 VanDerWaalsContact CB-O 3.27Å; A159-R184 WeakPolarHBondContact CB-O 3.46Å
185	D	95.6	Very high	96.8	Very high	131 Å²	131	66.6 Å²	66.6	70%	0.701	32%	0.315	S	S	*	.	S	Bend	trans	-123.3	-16.4	-171.2	59.7	-33.3	0	0	0	112.5
186	Q	96.9	Very high	96.9	Very high	84 Å²	84	66.4 Å²	66.4	39%	0.393	31%	0.31	S	S	.	.			trans	-118	154.3	-179.1	-60.5	-175.3	-29.2	0	0	111.5	A159 S183 F188	A159-Q186 WeakPolarHBondContact CB-O 3.36Å; S183-Q186 VanDerWaalsContact CB-O 3.23Å; S183-Q186 WeakPolarHBondContact CB-O 3.32Å; S183-Q186 PolarHBondContact OG-O 2.85Å; Q186-F188 HydrophobicContact CB-CD1 4Å; Q186-F188 HydrophobicContact CB-CE1 3.96Å; Q186-F188 HydrophobicContact CG-CE1 4.16Å; Q186-F188 PolarHBondContact O-N 3.34Å
187	N	97.1	Very high	96.7	Very high	48 Å²	48	70.7 Å²	70.7	26%	0.257	33%	0.331	S	S	.	.	S	Bend	trans	-89.9	18.4	174.3	62.8	-3.4	0	0	0	112.7	S153 V154 P155 E157 I161 F163	S153-N187 CarbonylContact C-O 3.55Å; S153-N187 WeakPolarHBondContact CA-O 3.41Å; V154-N187 PolarHBondContact N-O 2.94Å; P155-N187 WeakPolarHBondContact CA-ND2 3.44Å; P155-N187 PolarHBondContact O-ND2 3.16Å; E157-N187 VanDerWaalsContact O-CB 3.27Å; E157-N187 WeakPolarHBondContact O-CB 3.38Å; I161-N187 HydrophobicContact CD1-CB 4.12Å; F163-N187 WeakPolarHBondContact CZ-O 3.01Å
188	F	98.1	Very high	96.3	Very high	54 Å²	54	74.4 Å²	74.4	24%	0.237	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	167.6	179.1	71.5	-89.6	0	0	0	111.8	C152 S153 S183 Q186 I190	C152-F188 CarbonylContact O-C 3.56Å; C152-F188 WeakPolarHBondContact O-CA 3.42Å; C152-F188 VanDerWaalsContact O-CB 3.31Å; C152-F188 WeakPolarHBondContact O-CB 3.28Å; S153-F188 VanDerWaalsContact CB-CB 3.46Å; S183-F188 WeakPolarHBondContact CB-O 3.25Å; S183-F188 PolarHBondContact OG-O 2.92Å; Q186-F188 HydrophobicContact CB-CD1 4Å; Q186-F188 HydrophobicContact CB-CE1 3.96Å; Q186-F188 HydrophobicContact CG-CE1 4.16Å; Q186-F188 PolarHBondContact O-N 3.34Å; F188-I190 HydrophobicContact CD2-CG1 4.09Å; F188-I190 HydrophobicContact CE2-CD1 4.05Å; F188-I190 HydrophobicContact CE2-CG1 4.01Å
189	V	98.4	Very high	96	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.012	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147.2	167.8	-66.5	0	0	0	0	110.3	N151 C152 F163 I165 K181 L191	N151-V189 WeakPolarHBondContact CA-O 3.34Å; C152-V189 HydrophobicContact CB-CG2 4.4Å; C152-V189 PolarHBondContact N-O 3.5Å; C152-V189 PolarHBondContact O-N 3.16Å; F163-V189 HydrophobicContact CB-CG1 4.31Å; F163-V189 HydrophobicContact CB-CG2 3.49Å; F163-V189 VanDerWaalsContact CB-CG2 3.49Å; F163-V189 HydrophobicContact CD1-CG2 4.23Å; F163-V189 HydrophobicContact CD2-CB 4.23Å; F163-V189 HydrophobicContact CD2-CG1 3.5Å; F163-V189 HydrophobicContact CD2-CG2 3.8Å; F163-V189 HydrophobicContact CE2-CG1 4.11Å; F163-V189 HydrophobicContact CG-CB 4.49Å; F163-V189 HydrophobicContact CG-CG1 4.16Å; F163-V189 HydrophobicContact CG-CG2 3.58Å; I165-V189 HydrophobicContact CD1-CG2 4.14Å; K181-V189 HydrophobicContact CB-CG1 4.08Å; K181-V189 HydrophobicContact CD-CB 4.23Å; K181-V189 HydrophobicContact CD-CG1 3.94Å; K181-V189 HydrophobicContact CG-CG1 3.94Å; V189-L191 HydrophobicContact CG2-CG 4.44Å
190	I	98.4	Very high	95.7	Very high	66 Å²	66	74.9 Å²	74.9	34%	0.338	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.9	167.9	-56.1	177.3	0	0	0	107.9	R149 V150 N151 F188	R149-I190 HydrophobicContact CB-CG2 4.26Å; V150-I190 WeakPolarHBondContact O-CA 3.36Å; N151-I190 HydrophobicContact CB-CG1 4.07Å; F188-I190 HydrophobicContact CD2-CG1 4.09Å; F188-I190 HydrophobicContact CE2-CD1 4.05Å; F188-I190 HydrophobicContact CE2-CG1 4.01Å
191	L	98.3	Very high	95.6	Very high	22 Å²	22	72 Å²	72	12%	0.115	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143	179.5	-63.2	-178.5	0	0	0	110.6	V150 I165 R179 K181 V189 F193	V150-L191 PolarHBondContact N-O 2.99Å; V150-L191 PolarHBondContact O-N 2.98Å; I165-L191 HydrophobicContact CB-CD1 4.23Å; I165-L191 HydrophobicContact CD1-CB 4.38Å; I165-L191 HydrophobicContact CD1-CD1 3.88Å; I165-L191 HydrophobicContact CD1-CG 4.25Å; I165-L191 HydrophobicContact CG1-CD1 4.05Å; R179-L191 HydrophobicContact CB-CD1 3.8Å; K181-L191 HydrophobicContact CB-CD1 4.44Å; K181-L191 HydrophobicContact CB-CD2 4.09Å; K181-L191 HydrophobicContact CD-CD2 3.74Å; V189-L191 HydrophobicContact CG2-CG 4.44Å; L191-F193 HydrophobicContact CB-CD2 4.39Å; L191-F193 HydrophobicContact CB-CE2 3.76Å
192	E	98.3	Very high	95.5	Very high	92 Å²	92	67.2 Å²	67.2	43%	0.43	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	107.8	-170.9	-60.4	-161.9	155.8	0	0	111.7	I147 R149 R179	I147-E192 HydrophobicContact CG2-CB 3.71Å; I147-E192 HydrophobicContact CG2-CG 4.4Å; R149-E192 HydrophobicContact CG-CG 4.14Å; R149-E192 IonicContact CZ-OE1 2.65Å; R149-E192 IonicContact NE-OE1 2.56Å; R149-E192 PolarHBondContact NE-OE1 3.45Å; R149-E192 IonicContact NH2-OE1 3.67Å; R179-E192 PolarHBondContact NH1-O 3.33Å; R179-E192 PolarHBondContact NH2-O 3.02Å
193	F	97.8	Very high	95.5	Very high	1 Å²	1	63.9 Å²	63.9	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.1	-176.9	-72.9	-98.8	0	0	0	110.7	I147 V148 V150 I165 K167 L177 R179 L191 F204	I147-F193 CarbonylContact C-O 3.58Å; I147-F193 WeakPolarHBondContact CA-O 3.5Å; V148-F193 PolarHBondContact N-O 3.1Å; V148-F193 PolarHBondContact O-N 2.79Å; V150-F193 HydrophobicContact CB-CD2 4.26Å; V150-F193 HydrophobicContact CB-CE2 4.27Å; V150-F193 HydrophobicContact CG2-CD2 3.61Å; V150-F193 HydrophobicContact CG2-CE2 4Å; I165-F193 HydrophobicContact CB-CE2 4.08Å; I165-F193 HydrophobicContact CB-CZ 3.8Å; I165-F193 HydrophobicContact CG2-CE2 3.61Å; I165-F193 HydrophobicContact CG2-CZ 3.55Å; K167-F193 HydrophobicContact CB-CD1 3.73Å; K167-F193 HydrophobicContact CB-CE1 3.98Å; K167-F193 HydrophobicContact CD-CD1 4.29Å; K167-F193 HydrophobicContact CG-CD1 4.47Å; L177-F193 HydrophobicContact CB-CD1 4.48Å; L177-F193 HydrophobicContact CD2-CD1 3.84Å; L177-F193 HydrophobicContact CD2-CE1 4.24Å; L177-F193 HydrophobicContact CG-CD1 4.2Å; L177-F193 HydrophobicContact CG-CE1 4.16Å; R179-F193 HydrophobicContact CB-CE1 4.23Å; R179-F193 HydrophobicContact CB-CZ 3.82Å; R179-F193 HydrophobicContact CG-CE1 3.72Å; R179-F193 HydrophobicContact CG-CZ 3.76Å; L191-F193 HydrophobicContact CB-CD2 4.39Å; L191-F193 HydrophobicContact CB-CE2 3.76Å; F193-F204 HydrophobicContact CB-CE1 3.61Å; F193-F204 HydrophobicContact CB-CZ 4.13Å; F193-F204 HydrophobicContact CD1-CD1 4.4Å; F193-F204 AromaticContact CD1-CE1 4Å; F193-F204 HydrophobicContact CD1-CE1 4Å; F193-F204 HydrophobicContact CD2-CD1 4.17Å; F193-F204 AromaticContact CD2-CE1 3.94Å; F193-F204 HydrophobicContact CD2-CE1 3.94Å; F193-F204 HydrophobicContact CE2-CD1 4.44Å; F193-F204 HydrophobicContact CG-CD1 4.14Å; F193-F204 AromaticContact CG-CE1 3.58Å; F193-F204 HydrophobicContact CG-CE1 3.58Å
194	P	97.3	Very high	95.5	Very high	48 Å²	48	63.6 Å²	63.6	31%	0.312	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	157.2	173.7	29.3	-33.4	0	0	0	110.9	G146 K167 L177	G146-P194 CarbonylContact O-C 3.52Å; G146-P194 WeakPolarHBondContact O-CA 3.37Å; K167-P194 PolarHBondContact NZ-O 2.7Å; L177-P194 HydrophobicContact CD2-CG 4.43Å
195	V	96.5	Very high	95.6	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.03	27%	0.272	C	S	.	.			trans	-107.3	117.2	173.3	-177	0	0	0	0	108.6	A142 G145 G146 V148 D199 L202 V229	A142-V195 HydrophobicContact CB-CG2 3.87Å; G145-V195 WeakPolarHBondContact CA-O 2.98Å; G145-V195 PolarHBondContact N-O 3.39Å; G146-V195 PolarHBondContact O-N 2.93Å; V148-V195 HydrophobicContact CG2-CG2 3.99Å; V195-D199 HydrophobicContact CG1-CB 4.1Å; V195-L202 HydrophobicContact CG1-CD1 4.49Å; V195-L202 HydrophobicContact CG2-CD1 4.36Å; V195-V229 HydrophobicContact CG1-CB 4.32Å; V195-V229 HydrophobicContact CG1-CG1 3.61Å; V195-V229 HydrophobicContact CG1-CG2 3.69Å
196	E	93.7	Very high	95.7	Very high	53 Å²	53	51.1 Å²	51.1	25%	0.248	24%	0.238	C	C	.	.			trans	-88.3	160.6	-179.3	-63.1	94.1	-137.9	0	0	111.8	K167 Q198 D199	K167-E196 IonicContact NZ-OE1 3.46Å; K167-E196 PolarHBondContact NZ-OE1 3.48Å; K167-E196 IonicContact NZ-OE2 2.85Å; K167-E196 PolarHBondContact NZ-OE2 2.91Å; E196-Q198 VanDerWaalsContact C-N 3.28Å; E196-Q198 PolarHBondContact O-N 3.35Å; E196-D199 PolarHBondContact N-OD2 2.96Å; E196-D199 VanDerWaalsContact O-CB 3.28Å; E196-D199 WeakPolarHBondContact O-CB 3.39Å; E196-D199 PolarHBondContact O-N 3.48Å
197	E	88.3	Confident	95.8	Very high	147 Å²	147	50 Å²	50	69%	0.687	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-34.7	-177	179.4	158.8	-146.6	0	0	114.3	Q144 D199	Q144-E197 VanDerWaalsContact CD-CA 3.5Å; Q144-E197 HydrophobicContact CG-CB 4.26Å; Q144-E197 PolarHBondContact NE2-OE1 3.04Å; E197-D199 VanDerWaalsContact C-N 3.27Å; E197-D199 PolarHBondContact O-N 3.41Å
198	Q	88	Confident	95.8	Very high	126 Å²	126	47.7 Å²	47.7	59%	0.589	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-2.2	177.8	65.3	-85.9	13	0	0	114	E196	E196-Q198 VanDerWaalsContact C-N 3.28Å; E196-Q198 PolarHBondContact O-N 3.35Å
199	D	91.7	Very high	95.8	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.032	23%	0.225	C	C	.	.			trans	-76.8	138.6	179.7	-65.5	-22.7	0	0	0	111.3	K167 E169 K176 V195 E196 E197 L202 V229	K167-D199 VanDerWaalsContact CE-OD2 3.3Å; K167-D199 WeakPolarHBondContact CE-OD2 3.33Å; K167-D199 IonicContact NZ-OD1 3.75Å; K167-D199 IonicContact NZ-OD2 2.98Å; K167-D199 PolarHBondContact NZ-OD2 2.85Å; E169-D199 WeakPolarHBondContact OE2-CA 3.24Å; K176-D199 WeakPolarHBondContact CD-OD1 3.41Å; K176-D199 IonicContact NZ-OD1 2.68Å; K176-D199 PolarHBondContact NZ-OD1 3.29Å; V195-D199 HydrophobicContact CG1-CB 4.1Å; E196-D199 PolarHBondContact N-OD2 2.96Å; E196-D199 VanDerWaalsContact O-CB 3.28Å; E196-D199 WeakPolarHBondContact O-CB 3.39Å; E196-D199 PolarHBondContact O-N 3.48Å; E197-D199 VanDerWaalsContact C-N 3.27Å; E197-D199 PolarHBondContact O-N 3.41Å; D199-L202 HydrophobicContact CB-CD1 4.24Å; D199-L202 HydrophobicContact CB-CD2 4.02Å; D199-L202 HydrophobicContact CB-CG 4.25Å; D199-V229 HydrophobicContact CB-CG2 3.86Å; D199-V229 WeakPolarHBondContact O-CB 3.43Å; D199-V229 WeakPolarHBondContact O-CG1 3.27Å
200	R	92.1	Very high	95.6	Very high	197 Å²	197	49.7 Å²	49.7	74%	0.743	23%	0.227	S	C	*	.	S	Bend	trans	-124.5	-56.3	176.8	-61	-178.7	176.8	-178.2	-1.1	112.2	E169 V229	E169-R200 WeakPolarHBondContact OE1-CA 3.23Å; E169-R200 WeakPolarHBondContact OE1-CB 3.25Å; E169-R200 PolarHBondContact OE1-N 2.93Å; R200-V229 PolarHBondContact O-N 2.91Å
201	V	95	Very high	95.1	Very high	36 Å²	36	52 Å²	52	22%	0.218	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	110.5	-178.9	-173.6	0	0	0	0	108.8	E169 L170 L226 V227 T228	E169-V201 CarbonylContact C-O 3.56Å; E169-V201 WeakPolarHBondContact CA-O 2.98Å; E169-V201 PolarHBondContact OE1-N 3.45Å; L170-V201 HydrophobicContact CB-CB 3.79Å; L170-V201 HydrophobicContact CB-CG1 3.92Å; L170-V201 WeakPolarHBondContact CB-O 3.45Å; L170-V201 HydrophobicContact CD2-CB 4.16Å; L170-V201 HydrophobicContact CD2-CG1 3.87Å; L170-V201 HydrophobicContact CG-CG1 4.47Å; L170-V201 PolarHBondContact N-O 3.37Å; V201-L226 HydrophobicContact CG1-CB 4.08Å; V201-L226 HydrophobicContact CG1-CD1 4.15Å; V201-L226 HydrophobicContact CG1-CD2 4.33Å; V201-L226 HydrophobicContact CG1-CG 4.42Å; V201-V227 CarbonylContact C-O 3.53Å; V201-V227 WeakPolarHBondContact CA-O 3.47Å; V201-T228 HydrophobicContact CG2-CG2 4.49Å
202	L	95.6	Very high	94.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	151.6	-173.9	-61.5	174.4	0	0	0	111.9	K167 L168 V195 D199 F204 L226 V227 V229	K167-L202 HydrophobicContact CG-CD2 4.31Å; L168-L202 CarbonylContact O-C 3.49Å; L168-L202 VanDerWaalsContact O-CA 3.3Å; L168-L202 WeakPolarHBondContact O-CA 3.08Å; V195-L202 HydrophobicContact CG1-CD1 4.49Å; V195-L202 HydrophobicContact CG2-CD1 4.36Å; D199-L202 HydrophobicContact CB-CD1 4.24Å; D199-L202 HydrophobicContact CB-CD2 4.02Å; D199-L202 HydrophobicContact CB-CG 4.25Å; L202-F204 HydrophobicContact CB-CE2 4.47Å; L202-L226 CarbonylContact O-C 3.55Å; L202-L226 WeakPolarHBondContact O-CA 2.97Å; L202-V227 HydrophobicContact CB-CB 4.31Å; L202-V227 PolarHBondContact N-O 3Å; L202-V227 PolarHBondContact O-N 3.11Å; L202-V229 HydrophobicContact CD1-CG2 4.12Å; L202-V229 HydrophobicContact CG-CG2 4.26Å
203	S	96.3	Very high	93.3	Very high	10 Å²	10	51.7 Å²	51.7	7%	0.07	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	147.5	167.3	-177.4	0	0	0	0	109.2	L168 S224	L168-S203 WeakPolarHBondContact CA-O 3.2Å; L168-S203 WeakPolarHBondContact CB-O 3.39Å; L168-S203 PolarHBondContact N-O 2.96Å; L168-S203 PolarHBondContact O-N 3.06Å; S203-S224 PolarHBondContact OG-O 2.94Å
204	F	97.2	Very high	92.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.9	-179.4	-59.7	-84.7	0	0	0	110.2	L137 V148 V150 I165 E166 K167 F193 L202 K223 S224 V227	L137-F204 HydrophobicContact CD1-CD2 4.23Å; L137-F204 HydrophobicContact CD2-CD2 3.58Å; L137-F204 HydrophobicContact CD2-CE2 4.13Å; L137-F204 HydrophobicContact CD2-CG 4.3Å; V148-F204 HydrophobicContact CB-CE2 4.27Å; V148-F204 HydrophobicContact CB-CZ 3.99Å; V148-F204 HydrophobicContact CG1-CE2 3.74Å; V148-F204 HydrophobicContact CG1-CZ 3.95Å; V148-F204 HydrophobicContact CG2-CZ 4.46Å; V150-F204 HydrophobicContact CG1-CB 4.06Å; V150-F204 HydrophobicContact CG1-CG 4.36Å; V150-F204 HydrophobicContact CG2-CB 4.2Å; V150-F204 HydrophobicContact CG2-CD1 3.59Å; V150-F204 HydrophobicContact CG2-CD2 3.87Å; V150-F204 HydrophobicContact CG2-CE1 3.84Å; V150-F204 HydrophobicContact CG2-CE2 4.13Å; V150-F204 HydrophobicContact CG2-CG 3.59Å; V150-F204 HydrophobicContact CG2-CZ 4.1Å; I165-F204 HydrophobicContact CG2-CB 4.33Å; E166-F204 CarbonylContact O-C 3.57Å; E166-F204 VanDerWaalsContact O-CA 3.29Å; E166-F204 WeakPolarHBondContact O-CA 3.39Å; K167-F204 HydrophobicContact CB-CD1 4.14Å; K167-F204 HydrophobicContact CB-CE1 3.94Å; K167-F204 HydrophobicContact CD-CE1 4.46Å; K167-F204 HydrophobicContact CG-CD1 4.43Å; K167-F204 HydrophobicContact CG-CE1 3.85Å; F193-F204 HydrophobicContact CB-CE1 3.61Å; F193-F204 HydrophobicContact CB-CZ 4.13Å; F193-F204 HydrophobicContact CD1-CD1 4.4Å; F193-F204 AromaticContact CD1-CE1 4Å; F193-F204 HydrophobicContact CD1-CE1 4Å; F193-F204 HydrophobicContact CD2-CD1 4.17Å; F193-F204 AromaticContact CD2-CE1 3.94Å; F193-F204 HydrophobicContact CD2-CE1 3.94Å; F193-F204 HydrophobicContact CE2-CD1 4.44Å; F193-F204 HydrophobicContact CG-CD1 4.14Å; F193-F204 AromaticContact CG-CE1 3.58Å; F193-F204 HydrophobicContact CG-CE1 3.58Å; L202-F204 HydrophobicContact CB-CE2 4.47Å; F204-K223 CarbonylContact O-C 3.52Å; F204-K223 WeakPolarHBondContact O-CA 3.12Å; F204-S224 PolarHBondContact N-OG 2.78Å; F204-S224 PolarHBondContact O-N 3.48Å; F204-V227 HydrophobicContact CE2-CG2 4.12Å
205	R	97.4	Very high	91.7	Very high	77 Å²	77	60.3 Å²	60.3	29%	0.291	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.8	176.6	179.2	167.8	63.4	-170.5	-0.1	109.7	I165 E166 L168 T222 K223	I165-R205 CarbonylContact C-O 3.54Å; I165-R205 WeakPolarHBondContact CA-O 3Å; E166-R205 HydrophobicContact CB-CB 4.36Å; E166-R205 PolarHBondContact N-O 2.81Å; E166-R205 PolarHBondContact O-N 3.26Å; E166-R205 IonicContact OE2-CZ 2.76Å; E166-R205 IonicContact OE2-NE 2.63Å; E166-R205 PolarHBondContact OE2-NE 2.78Å; E166-R205 IonicContact OE2-NH2 3.75Å; E166-R205 PolarHBondContact OE2-NH2 2.86Å; L168-R205 HydrophobicContact CD1-CB 3.85Å; R205-T222 CarbonylContact C-O 3.48Å; R205-T222 WeakPolarHBondContact CA-O 3.33Å; R205-K223 HydrophobicContact CB-CG 4.27Å; R205-K223 HydrophobicContact CG-CG 4.45Å
206	C	98.1	Very high	91.4	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	142.1	176.7	-171.8	0	0	0	0	112.2	P133 V135 C152 T164 I165 S221 T222	P133-C206 HydrophobicContact CG-CB 4.38Å; V135-C206 HydrophobicContact CG2-CB 3.48Å; V135-C206 VanDerWaalsContact CG2-CB 3.48Å; C152-C206 HydrophobicContact CB-CB 3.82Å; C152-C206 WeakPolarHBondContact CB-SG 3.21Å; C152-C206 WeakPolarHBondContact SG-CB 3.29Å; C152-C206 CovalentContact SG-SG 2.01Å; C152-C206 PolarHBondContact SG-SG 3.14Å; T164-C206 CarbonylContact O-C 3.53Å; T164-C206 VanDerWaalsContact O-CA 3.3Å; T164-C206 WeakPolarHBondContact O-CA 3.36Å; I165-C206 HydrophobicContact CG1-CB 4.27Å; C206-S221 CarbonylContact O-C 3.59Å; C206-S221 WeakPolarHBondContact O-CA 3.47Å; C206-T222 PolarHBondContact N-O 2.87Å; C206-T222 PolarHBondContact O-N 3.34Å
207	Q	98.1	Very high	91.3	Very high	60 Å²	60	64.4 Å²	64.4	28%	0.28	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.1	169.5	-175.1	171.7	56.5	0	0	109.8	F163 T164 T218 S219	F163-Q207 WeakPolarHBondContact CA-O 3.49Å; T164-Q207 PolarHBondContact N-O 3.49Å; T164-Q207 PolarHBondContact O-N 3.46Å; Q207-T218 HydrophobicContact CG-CG2 3.68Å; Q207-T218 VanDerWaalsContact NE2-CG2 3.32Å; Q207-S219 WeakPolarHBondContact CG-O 3.22Å; Q207-S219 PolarHBondContact NE2-O 3.19Å
208	A	97.9	Very high	91.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147.2	176.6	0	0	0	0	0	110.9	V130 V154 I161 H162 F163 T218 S219	V130-A208 HydrophobicContact CG1-CB 4.34Å; V154-A208 HydrophobicContact CG2-CB 3.44Å; V154-A208 VanDerWaalsContact CG2-CB 3.44Å; I161-A208 HydrophobicContact CG2-CB 3.99Å; H162-A208 CarbonylContact O-C 3.55Å; H162-A208 WeakPolarHBondContact O-CA 3.01Å; F163-A208 HydrophobicContact CD1-CB 4.06Å; F163-A208 HydrophobicContact CE1-CB 3.9Å; A208-T218 WeakPolarHBondContact O-CA 3.02Å; A208-S219 PolarHBondContact N-OG 3.35Å; A208-S219 PolarHBondContact O-N 2.92Å; A208-S219 PolarHBondContact O-OG 2.89Å
209	R	96.6	Very high	92	Very high	87 Å²	87	54 Å²	54	33%	0.328	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	131.9	177.7	178.7	-169.7	-68.4	171.1	9.5	109.6	H162 M216 Q217	H162-R209 HydrophobicContact CB-CB 4.29Å; H162-R209 PolarHBondContact N-O 2.82Å; H162-R209 PolarHBondContact O-N 2.9Å; R209-M216 WeakPolarHBondContact CD-SD 3.41Å; R209-M216 HydrophobicContact CG-CG 3.75Å; R209-M216 HydrophobicContact CG-SD 4.15Å; R209-Q217 WeakPolarHBondContact CA-O 3.41Å
210	I	95.7	Very high	92.1	Very high	10 Å²	10	60.8 Å²	60.8	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.5	-178.6	-57.6	-179.2	0	0	0	108.4	I101 V130 E157 I161 Q217	I101-I210 HydrophobicContact CB-CG2 4.42Å; I101-I210 HydrophobicContact CD1-CB 4.19Å; I101-I210 HydrophobicContact CD1-CD1 3.97Å; I101-I210 HydrophobicContact CD1-CG2 4.49Å; I101-I210 HydrophobicContact CG2-CB 4.47Å; I101-I210 HydrophobicContact CG2-CG2 3.72Å; V130-I210 HydrophobicContact CG1-CD1 4Å; V130-I210 HydrophobicContact CG1-CG1 4.37Å; V130-I210 HydrophobicContact CG2-CG1 4.46Å; E157-I210 HydrophobicContact CB-CD1 3.72Å; E157-I210 HydrophobicContact CG-CD1 3.64Å; I161-I210 HydrophobicContact CB-CG1 4.42Å; I161-I210 HydrophobicContact CD1-CD1 4.11Å; I161-I210 HydrophobicContact CG1-CD1 4.1Å; I161-I210 HydrophobicContact CG1-CG1 4.07Å; I161-I210 HydrophobicContact CG2-CG1 3.97Å; I210-Q217 PolarHBondContact N-O 3.23Å; I210-Q217 PolarHBondContact O-N 2.97Å
211	I	88.4	Confident	92.2	Very high	115 Å²	115	54 Å²	54	59%	0.59	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	121.9	176.3	-57.8	174.6	0	0	0	107.5	H215 M216	I211-H215 WeakPolarHBondContact CA-O 3.38Å; I211-M216 HydrophobicContact CG1-CG 4.38Å
212	S	80.9	Confident	92.3	Very high	32 Å²	32	54 Å²	54	22%	0.224	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	104.3	176.2	-172.8	0	0	0	0	109.2	I214 H215	S212-I214 PolarHBondContact O-N 3.13Å; S212-I214 VanDerWaalsContact O-N 3.16Å; S212-H215 PolarHBondContact N-O 3.09Å; S212-H215 PolarHBondContact O-N 2.83Å
213	G	77.7	Confident	92.3	Very high	75 Å²	75	60.2 Å²	60.2	77%	0.773	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-115.5	-169.2	0	0	0	0	0	111.2
214	I	76.8	Confident	92.2	Very high	158 Å²	158	60.3 Å²	60.3	81%	0.81	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-10.8	175.9	62.6	173	0	0	0	113.6	S212	S212-I214 PolarHBondContact O-N 3.13Å; S212-I214 VanDerWaalsContact O-N 3.16Å
215	H	84.2	Confident	92.1	Very high	72 Å²	72	65.9 Å²	65.9	33%	0.333	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131	-174	-62.3	95.3	0	0	0	110.6	L126 I211 S212	L126-H215 HydrophobicContact CD1-CB 4.09Å; I211-H215 WeakPolarHBondContact CA-O 3.38Å; S212-H215 PolarHBondContact N-O 3.09Å; S212-H215 PolarHBondContact O-N 2.83Å
216	M	89.5	Confident	92	Very high	108 Å²	108	66.2 Å²	66.2	53%	0.532	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.4	177.3	-177.1	-179	70.9	0	0	109.3	R209 I211	R209-M216 WeakPolarHBondContact CD-SD 3.41Å; R209-M216 HydrophobicContact CG-CG 3.75Å; R209-M216 HydrophobicContact CG-SD 4.15Å; I211-M216 HydrophobicContact CG1-CG 4.38Å
217	Q	91.8	Very high	91.9	Very high	36 Å²	36	66.2 Å²	66.2	17%	0.168	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.3	177.5	-63.6	-66.8	-25.4	0	0	109.1	I101 V130 R209 I210	I101-Q217 HydrophobicContact CD1-CB 3.96Å; I101-Q217 HydrophobicContact CD1-CG 4.36Å; V130-Q217 VanDerWaalsContact CG2-C 3.45Å; V130-Q217 HydrophobicContact CG2-CB 3.6Å; V130-Q217 WeakPolarHBondContact CG2-O 3.26Å; R209-Q217 WeakPolarHBondContact CA-O 3.41Å; I210-Q217 PolarHBondContact N-O 3.23Å; I210-Q217 PolarHBondContact O-N 2.97Å
218	T	94.1	Very high	91.7	Very high	53 Å²	53	66.3 Å²	66.3	33%	0.325	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.9	-179.1	-54.8	0	0	0	0	109.7	Q207 A208	Q207-T218 HydrophobicContact CG-CG2 3.68Å; Q207-T218 VanDerWaalsContact NE2-CG2 3.32Å; A208-T218 WeakPolarHBondContact O-CA 3.02Å
219	S	96.4	Very high	91.5	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.014	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-78.9	161	177	77.8	0	0	0	0	111.5	P133 Q207 A208	P133-S219 WeakPolarHBondContact CD-OG 3.36Å; Q207-S219 WeakPolarHBondContact CG-O 3.22Å; Q207-S219 PolarHBondContact NE2-O 3.19Å; A208-S219 PolarHBondContact N-OG 3.35Å; A208-S219 PolarHBondContact O-N 2.92Å; A208-S219 PolarHBondContact O-OG 2.89Å
220	E	95.3	Very high	91.1	Very high	148 Å²	148	69.7 Å²	69.7	69%	0.692	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-60.3	154	156.1	-71.7	-56.2	138.4	0	0	110.6	P133	P133-E220 WeakPolarHBondContact CD-O 3.22Å
221	S	94.3	Very high	90.9	Very high	55 Å²	55	72.7 Å²	72.7	39%	0.385	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-82.9	132.7	178	-67.4	0	0	0	0	111.1	C206	C206-S221 CarbonylContact O-C 3.59Å; C206-S221 WeakPolarHBondContact O-CA 3.47Å
222	T	96.3	Very high	91	Very high	37 Å²	37	70.5 Å²	70.5	23%	0.227	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.3	177	-58.5	0	0	0	0	110.7	P133 V135 R205 C206	P133-T222 VanDerWaalsContact O-CB 3.24Å; P133-T222 WeakPolarHBondContact O-CB 3.38Å; P133-T222 WeakPolarHBondContact O-CG2 3.44Å; P133-T222 PolarHBondContact O-OG1 2.78Å; V135-T222 HydrophobicContact CG2-CG2 4.2Å; R205-T222 CarbonylContact C-O 3.48Å; R205-T222 WeakPolarHBondContact CA-O 3.33Å; C206-T222 PolarHBondContact N-O 2.87Å; C206-T222 PolarHBondContact O-N 3.34Å
223	K	95.3	Very high	91.6	Very high	129 Å²	129	72.6 Å²	72.6	56%	0.561	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	144.2	175.2	-68	-174.7	179.4	-177	0	110.9	F204 R205	F204-K223 CarbonylContact O-C 3.52Å; F204-K223 WeakPolarHBondContact O-CA 3.12Å; R205-K223 HydrophobicContact CB-CG 4.27Å; R205-K223 HydrophobicContact CG-CG 4.45Å
224	S	95.3	Very high	92.4	Very high	12 Å²	12	72.5 Å²	72.5	8%	0.084	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-71.6	170	168.7	71.1	0	0	0	0	111.5	S203 F204	S203-S224 PolarHBondContact OG-O 2.94Å; F204-S224 PolarHBondContact N-OG 2.78Å; F204-S224 PolarHBondContact O-N 3.48Å
225	E	94.1	Very high	93.4	Very high	117 Å²	117	67.1 Å²	67.1	55%	0.547	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-57	162.3	157.5	-61.8	-175	176.4	0	0	111.5	K140	K140-E225 WeakPolarHBondContact CE-OE2 3.23Å; K140-E225 IonicContact NZ-OE1 3.13Å; K140-E225 IonicContact NZ-OE2 2.8Å; K140-E225 PolarHBondContact NZ-OE2 3Å
226	L	95.6	Very high	94	Very high	85 Å²	85	66.8 Å²	66.8	45%	0.445	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-76.9	146.9	178.4	-59.8	179.3	0	0	0	111	L170 V201 L202	L170-L226 HydrophobicContact CD1-CD1 4.47Å; L170-L226 HydrophobicContact CD1-CD2 4.2Å; L170-L226 HydrophobicContact CD2-CD1 4.39Å; V201-L226 HydrophobicContact CG1-CB 4.08Å; V201-L226 HydrophobicContact CG1-CD1 4.15Å; V201-L226 HydrophobicContact CG1-CD2 4.33Å; V201-L226 HydrophobicContact CG1-CG 4.42Å; L202-L226 CarbonylContact O-C 3.55Å; L202-L226 WeakPolarHBondContact O-CA 2.97Å
227	V	95.3	Very high	94.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	123	171.2	-177.6	0	0	0	0	109	L137 K140 A142 V148 V201 L202 F204	L137-V227 HydrophobicContact CD1-CG2 3.4Å; K140-V227 VanDerWaalsContact O-CA 3.27Å; K140-V227 WeakPolarHBondContact O-CA 3.49Å; A142-V227 HydrophobicContact CB-CG1 3.92Å; V148-V227 HydrophobicContact CG2-CG1 4.21Å; V201-V227 CarbonylContact C-O 3.53Å; V201-V227 WeakPolarHBondContact CA-O 3.47Å; L202-V227 HydrophobicContact CB-CB 4.31Å; L202-V227 PolarHBondContact N-O 3Å; L202-V227 PolarHBondContact O-N 3.11Å; F204-V227 HydrophobicContact CE2-CG2 4.12Å
228	T	95.3	Very high	94.5	Very high	61 Å²	61	66 Å²	66	37%	0.374	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138.1	174.3	45.5	0	0	0	0	111	K140 E141 A142 V201	K140-T228 PolarHBondContact O-N 3.09Å; E141-T228 WeakPolarHBondContact CA-O 3.27Å; A142-T228 PolarHBondContact N-O 2.85Å; V201-T228 HydrophobicContact CG2-CG2 4.49Å
229	V	93.4	Very high	94.6	Very high	30 Å²	30	67.1 Å²	67.1	18%	0.182	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131	178	-176.5	0	0	0	0	110.1	A142 V195 D199 R200 L202	A142-V229 CarbonylContact O-C 3.55Å; A142-V229 WeakPolarHBondContact O-CA 3.3Å; V195-V229 HydrophobicContact CG1-CB 4.32Å; V195-V229 HydrophobicContact CG1-CG1 3.61Å; V195-V229 HydrophobicContact CG1-CG2 3.69Å; D199-V229 HydrophobicContact CB-CG2 3.86Å; D199-V229 WeakPolarHBondContact O-CB 3.43Å; D199-V229 WeakPolarHBondContact O-CG1 3.27Å; R200-V229 PolarHBondContact O-N 2.91Å; L202-V229 HydrophobicContact CD1-CG2 4.12Å; L202-V229 HydrophobicContact CG-CG2 4.26Å
230	T	88	Confident	94.4	Very high	129 Å²	129	73 Å²	73	79%	0.791	39%	0.39	S	S	*	.			trans	-121	0	-179.6	54.2	0	0	0	0	113.5	A142 I143 Q144	A142-T230 PolarHBondContact O-N 2.9Å; I143-T230 WeakPolarHBondContact CA-O 3.2Å; Q144-T230 PolarHBondContact N-O 2.91Å

Retrieved 230 of 230 residues in 113.2 ms (Link to these results)

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