G4M158_SCHMA Loading...

Egg protein CP391S-like AlphaSync

AlphaFold DB , UniProt , Accession G4M158, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 347 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.9	Very low	58.2	Low	224 Å²	224	121.6 Å²	121.6	100%	1.103	60%	0.598	S	S	*	*				0	110.2	0	-79.6	172.6	171.2	0	0	108.7	Y3	M1-Y3 PolarHBondContact O-N 3.3Å
2	R	46.6	Very low	59.2	Low	239 Å²	239	120.2 Å²	120.2	90%	0.902	59%	0.593	S	S	*	*			trans	-79.6	99.1	165.1	-72.8	-177.5	179.3	178	-0.1	106	N4	R2-N4 PolarHBondContact O-N 3.25Å; R2-N4 VanDerWaalsContact O-N 3.07Å
3	Y	54.5	Low	60	Low	184 Å²	184	115 Å²	115	72%	0.722	57%	0.568	S	S	*	*			trans	-73.6	99	173.8	-124.5	-89.8	0	0	0	107	M1 F5	M1-Y3 PolarHBondContact O-N 3.3Å; Y3-F5 PolarHBondContact O-N 3.47Å; Y3-F5 VanDerWaalsContact O-N 3.16Å
4	N	53.4	Low	60.6	Low	145 Å²	145	117.9 Å²	117.9	78%	0.775	57%	0.571	S	S	*	*			trans	-72.9	102.4	168.3	-72.6	-19.8	0	0	0	106.3	R2 S6	R2-N4 PolarHBondContact O-N 3.25Å; R2-N4 VanDerWaalsContact O-N 3.07Å; N4-S6 PolarHBondContact O-N 3.47Å
5	F	54.2	Low	61.1	Low	70 Å²	70	115.7 Å²	115.7	31%	0.307	57%	0.568	S	S	.	*			trans	-56.8	132.9	166.1	-77	-86.1	0	0	0	108.3	Y3 Q9 L10 I13 L328	Y3-F5 PolarHBondContact O-N 3.47Å; Y3-F5 VanDerWaalsContact O-N 3.16Å; F5-Q9 HydrophobicContact CD1-CB 4.13Å; F5-L10 HydrophobicContact CB-CD1 4.21Å; F5-L10 HydrophobicContact CB-CD2 3.74Å; F5-L10 HydrophobicContact CB-CG 3.64Å; F5-L10 HydrophobicContact CD2-CD2 4.26Å; F5-L10 HydrophobicContact CG-CD2 4.06Å; F5-L10 HydrophobicContact CG-CG 4.45Å; F5-I13 HydrophobicContact CD1-CD1 4.43Å; F5-I13 HydrophobicContact CE1-CD1 4.12Å; F5-L328 HydrophobicContact CE1-CD1 3.8Å; F5-L328 HydrophobicContact CZ-CD1 3.92Å
6	S	63.4	Low	61.5	Low	54 Å²	54	113.8 Å²	113.8	38%	0.378	56%	0.559	S	S	.	*			trans	-56.4	140.7	167.4	168.3	0	0	0	0	108.6	N4 S8 Q9 L10	N4-S6 PolarHBondContact O-N 3.47Å; S6-S8 PolarHBondContact O-N 3.46Å; S6-S8 PolarHBondContact OG-N 3.31Å; S6-S8 PolarHBondContact OG-OG 3.21Å; S6-Q9 WeakPolarHBondContact O-CB 3.29Å; S6-Q9 PolarHBondContact O-N 3.48Å; S6-L10 PolarHBondContact O-N 3.29Å
7	P	67.8	Low	61.2	Low	96 Å²	96	114.8 Å²	114.8	62%	0.623	56%	0.56	S	S	*	*	H	α-helix	trans	-48.5	-35.5	176.6	-27.1	33.1	0	0	0	113.2	Q9 L10 I11	P7-Q9 PolarHBondContact O-N 3.01Å; P7-L10 PolarHBondContact O-N 3.07Å; P7-I11 WeakPolarHBondContact O-CD1 3.35Å; P7-I11 VanDerWaalsContact O-CG1 3.25Å; P7-I11 WeakPolarHBondContact O-CG1 3.38Å; P7-I11 PolarHBondContact O-N 2.99Å
8	S	65.2	Low	60.9	Low	68 Å²	68	113.3 Å²	113.3	48%	0.476	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-36.2	177.2	59.9	0	0	0	0	113.8	S6 I11 I12	S6-S8 PolarHBondContact O-N 3.46Å; S6-S8 PolarHBondContact OG-N 3.31Å; S6-S8 PolarHBondContact OG-OG 3.21Å; S8-I11 PolarHBondContact O-N 2.88Å; S8-I12 WeakPolarHBondContact O-CG1 3.34Å; S8-I12 PolarHBondContact O-N 2.84Å
9	Q	59.6	Low	60.5	Low	82 Å²	82	115.3 Å²	115.3	38%	0.383	56%	0.559	S	S	.	*	H	α-helix	trans	-74	-36.4	178.1	-69.4	178.9	-27	0	0	111.6	F5 S6 P7 I12 I13	F5-Q9 HydrophobicContact CD1-CB 4.13Å; S6-Q9 WeakPolarHBondContact O-CB 3.29Å; S6-Q9 PolarHBondContact O-N 3.48Å; P7-Q9 PolarHBondContact O-N 3.01Å; Q9-I12 PolarHBondContact O-N 3.3Å; Q9-I13 VanDerWaalsContact O-CG1 3.31Å; Q9-I13 WeakPolarHBondContact O-CG1 3.37Å; Q9-I13 PolarHBondContact O-N 3.02Å; Q9-I13 VanDerWaalsContact O-N 3.13Å
10	L	63.2	Low	60.1	Low	69 Å²	69	111.6 Å²	111.6	36%	0.361	55%	0.545	S	S	.	.	H	α-helix	trans	-61.2	-46.7	172.2	-70	172.9	0	0	0	110.2	F5 S6 P7 I12 I13 Y14	F5-L10 HydrophobicContact CB-CD1 4.21Å; F5-L10 HydrophobicContact CB-CD2 3.74Å; F5-L10 HydrophobicContact CB-CG 3.64Å; F5-L10 HydrophobicContact CD2-CD2 4.26Å; F5-L10 HydrophobicContact CG-CD2 4.06Å; F5-L10 HydrophobicContact CG-CG 4.45Å; S6-L10 PolarHBondContact O-N 3.29Å; P7-L10 PolarHBondContact O-N 3.07Å; L10-I12 PolarHBondContact O-N 3.49Å; L10-I13 PolarHBondContact O-N 3.48Å; L10-Y14 HydrophobicContact CB-CD2 4.21Å; L10-Y14 HydrophobicContact CB-CE2 4.19Å; L10-Y14 WeakPolarHBondContact O-CB 3.49Å; L10-Y14 WeakPolarHBondContact O-CD2 3.48Å; L10-Y14 PolarHBondContact O-N 3.43Å
11	I	71.1	Confident	59.6	Low	107 Å²	107	111.7 Å²	111.7	55%	0.549	55%	0.545	S	S	.	.	H	α-helix	trans	-57.5	-46.4	178.8	-67.3	162.5	0	0	0	111.3	P7 S8 I13 Y14 V15	P7-I11 WeakPolarHBondContact O-CD1 3.35Å; P7-I11 VanDerWaalsContact O-CG1 3.25Å; P7-I11 WeakPolarHBondContact O-CG1 3.38Å; P7-I11 PolarHBondContact O-N 2.99Å; S8-I11 PolarHBondContact O-N 2.88Å; I11-I13 PolarHBondContact O-N 3.35Å; I11-Y14 PolarHBondContact O-N 3.43Å; I11-V15 HydrophobicContact CG2-CG2 4.18Å; I11-V15 WeakPolarHBondContact O-CB 3.26Å; I11-V15 VanDerWaalsContact O-CG2 3.23Å; I11-V15 WeakPolarHBondContact O-CG2 3.25Å; I11-V15 PolarHBondContact O-N 2.92Å
12	I	70.2	Confident	60	Low	104 Å²	104	108.2 Å²	108.2	53%	0.533	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-44.8	179.1	-67.2	166.5	0	0	0	111.2	S8 Q9 L10 V15 I16	S8-I12 WeakPolarHBondContact O-CG1 3.34Å; S8-I12 PolarHBondContact O-N 2.84Å; Q9-I12 PolarHBondContact O-N 3.3Å; L10-I12 PolarHBondContact O-N 3.49Å; I12-V15 PolarHBondContact O-N 3.44Å; I12-I16 HydrophobicContact CG2-CD1 3.87Å; I12-I16 VanDerWaalsContact O-CG1 3.31Å; I12-I16 WeakPolarHBondContact O-CG1 3.31Å; I12-I16 PolarHBondContact O-N 3.2Å
13	I	70	Confident	60.3	Low	53 Å²	53	104.3 Å²	104.3	27%	0.272	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-47.8	177.5	-67.9	168.6	0	0	0	110	F5 Q9 L10 I11 V15 I16 F17	F5-I13 HydrophobicContact CD1-CD1 4.43Å; F5-I13 HydrophobicContact CE1-CD1 4.12Å; Q9-I13 VanDerWaalsContact O-CG1 3.31Å; Q9-I13 WeakPolarHBondContact O-CG1 3.37Å; Q9-I13 PolarHBondContact O-N 3.02Å; Q9-I13 VanDerWaalsContact O-N 3.13Å; L10-I13 PolarHBondContact O-N 3.48Å; I11-I13 PolarHBondContact O-N 3.35Å; I13-V15 PolarHBondContact O-N 2.93Å; I13-I16 PolarHBondContact O-N 3.36Å; I13-F17 HydrophobicContact CG2-CD2 3.58Å; I13-F17 HydrophobicContact CG2-CE2 3.64Å; I13-F17 VanDerWaalsContact O-CD2 3.26Å; I13-F17 WeakPolarHBondContact O-CD2 3.25Å; I13-F17 PolarHBondContact O-N 2.85Å
14	Y	68.4	Low	60	Low	155 Å²	155	103.8 Å²	103.8	61%	0.608	51%	0.511	S	S	*	.	H	α-helix	trans	-59.8	-42.6	176.4	-81.3	-68.7	0	0	0	112.2	L10 I11 F17 V18	L10-Y14 HydrophobicContact CB-CD2 4.21Å; L10-Y14 HydrophobicContact CB-CE2 4.19Å; L10-Y14 WeakPolarHBondContact O-CB 3.49Å; L10-Y14 WeakPolarHBondContact O-CD2 3.48Å; L10-Y14 PolarHBondContact O-N 3.43Å; I11-Y14 PolarHBondContact O-N 3.43Å; Y14-F17 PolarHBondContact O-N 2.87Å; Y14-V18 VanDerWaalsContact O-CB 3.25Å; Y14-V18 WeakPolarHBondContact O-CB 3.24Å; Y14-V18 WeakPolarHBondContact O-CG2 3.5Å; Y14-V18 PolarHBondContact O-N 3.19Å
15	V	68.6	Low	59.7	Low	86 Å²	86	101.1 Å²	101.1	52%	0.521	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-43.6	177.6	170.8	0	0	0	0	110.7	I11 I12 I13 W19	I11-V15 HydrophobicContact CG2-CG2 4.18Å; I11-V15 WeakPolarHBondContact O-CB 3.26Å; I11-V15 VanDerWaalsContact O-CG2 3.23Å; I11-V15 WeakPolarHBondContact O-CG2 3.25Å; I11-V15 PolarHBondContact O-N 2.92Å; I12-V15 PolarHBondContact O-N 3.44Å; I13-V15 PolarHBondContact O-N 2.93Å; V15-W19 WeakPolarHBondContact O-CB 3.45Å; V15-W19 PolarHBondContact O-N 3.35Å
16	I	67.3	Low	60.2	Low	85 Å²	85	100.9 Å²	100.9	44%	0.436	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-46.2	176.2	-67.1	165.8	0	0	0	110.6	I12 I13 S20	I12-I16 HydrophobicContact CG2-CD1 3.87Å; I12-I16 VanDerWaalsContact O-CG1 3.31Å; I12-I16 WeakPolarHBondContact O-CG1 3.31Å; I12-I16 PolarHBondContact O-N 3.2Å; I13-I16 PolarHBondContact O-N 3.36Å; I16-S20 WeakPolarHBondContact O-CB 3.33Å; I16-S20 PolarHBondContact O-N 3.45Å; I16-S20 PolarHBondContact O-OG 3.45Å
17	F	55.8	Low	60.7	Low	131 Å²	131	101.1 Å²	101.1	58%	0.575	50%	0.499	S	S	*	.	H	α-helix	trans	-66.1	-44.5	178.8	-87	-74.8	0	0	0	112.7	I13 Y14 H21	I13-F17 HydrophobicContact CG2-CD2 3.58Å; I13-F17 HydrophobicContact CG2-CE2 3.64Å; I13-F17 VanDerWaalsContact O-CD2 3.26Å; I13-F17 WeakPolarHBondContact O-CD2 3.25Å; I13-F17 PolarHBondContact O-N 2.85Å; Y14-F17 PolarHBondContact O-N 2.87Å; F17-H21 WeakPolarHBondContact O-CB 3.45Å; F17-H21 PolarHBondContact O-N 3.3Å
18	V	56.4	Low	61.5	Low	87 Å²	87	101.3 Å²	101.3	53%	0.527	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-41.8	179.3	171.5	0	0	0	0	110.8	Y14 H21 K22	Y14-V18 VanDerWaalsContact O-CB 3.25Å; Y14-V18 WeakPolarHBondContact O-CB 3.24Å; Y14-V18 WeakPolarHBondContact O-CG2 3.5Å; Y14-V18 PolarHBondContact O-N 3.19Å; V18-H21 PolarHBondContact O-N 3.02Å; V18-K22 WeakPolarHBondContact O-CB 3.19Å; V18-K22 PolarHBondContact O-N 2.84Å
19	W	53	Low	62.4	Low	151 Å²	151	98.1 Å²	98.1	57%	0.572	47%	0.473	S	S	*	.	H	α-helix	trans	-67.1	-43.9	177.9	-173.2	55.4	0	0	0	111.7	V15 K22 R23	V15-W19 WeakPolarHBondContact O-CB 3.45Å; V15-W19 PolarHBondContact O-N 3.35Å; W19-K22 PolarHBondContact O-N 3.16Å; W19-R23 PolarHBondContact O-N 2.9Å
20	S	52.1	Low	63.7	Low	41 Å²	41	95.8 Å²	95.8	29%	0.287	47%	0.465	S	S	.	.	H	α-helix	trans	-61	-46.5	172.8	-54.3	0	0	0	0	110.5	I16 K22 R23 F24	I16-S20 WeakPolarHBondContact O-CB 3.33Å; I16-S20 PolarHBondContact O-N 3.45Å; I16-S20 PolarHBondContact O-OG 3.45Å; S20-K22 PolarHBondContact O-N 3.45Å; S20-R23 PolarHBondContact O-N 2.89Å; S20-F24 WeakPolarHBondContact O-CB 3.38Å; S20-F24 WeakPolarHBondContact O-CD2 3.41Å; S20-F24 PolarHBondContact O-N 3.3Å
21	H	49.3	Very low	64.8	Low	115 Å²	115	98.6 Å²	98.6	53%	0.532	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-40.4	179.8	-172.3	-81.2	0	0	0	112.5	F17 V18 F24 N25	F17-H21 WeakPolarHBondContact O-CB 3.45Å; F17-H21 PolarHBondContact O-N 3.3Å; V18-H21 PolarHBondContact O-N 3.02Å; H21-F24 PolarHBondContact O-N 3.31Å; H21-N25 PolarHBondContact O-N 3.39Å; H21-N25 VanDerWaalsContact O-N 3.17Å
22	K	50.7	Low	65.6	Low	151 Å²	151	97.2 Å²	97.2	66%	0.657	47%	0.474	S	S	*	.	H	α-helix	trans	-60.3	-45.9	173.1	-98	-170.4	172	-173	0	111.4	V18 W19 S20 C26	V18-K22 WeakPolarHBondContact O-CB 3.19Å; V18-K22 PolarHBondContact O-N 2.84Å; W19-K22 PolarHBondContact O-N 3.16Å; S20-K22 PolarHBondContact O-N 3.45Å; K22-C26 PolarHBondContact O-N 3.22Å
23	R	52.7	Low	66.2	Low	157 Å²	157	101.8 Å²	101.8	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-65.9	-40.6	176.9	-88.5	-172	158.7	-179.8	-5.3	113.2	W19 S20	W19-R23 PolarHBondContact O-N 2.9Å; S20-R23 PolarHBondContact O-N 2.89Å
24	F	48	Very low	67	Low	173 Å²	173	102.5 Å²	102.5	76%	0.759	50%	0.499	S	S	*	.	H	α-helix	trans	-73.9	-24.2	-175.8	-88.4	-71.5	0	0	0	113.7	S20 H21	S20-F24 WeakPolarHBondContact O-CB 3.38Å; S20-F24 WeakPolarHBondContact O-CD2 3.41Å; S20-F24 PolarHBondContact O-N 3.3Å; H21-F24 PolarHBondContact O-N 3.31Å
25	N	47.6	Very low	67.9	Low	89 Å²	89	96.6 Å²	96.6	48%	0.476	48%	0.478	S	S	.	.	H	α-helix	trans	-128.4	-6.5	-167.1	-84.5	-28.2	0	0	0	118.1	H21	H21-N25 PolarHBondContact O-N 3.39Å; H21-N25 VanDerWaalsContact O-N 3.17Å
26	C	63.8	Low	68.7	Low	64 Å²	64	96.6 Å²	96.6	43%	0.432	47%	0.468	S	S	.	.			trans	-132.6	76.9	-175.7	-65.7	0	0	0	0	112.9	K22 D28	K22-C26 PolarHBondContact O-N 3.22Å; C26-D28 PolarHBondContact O-N 2.88Å
27	N	74.1	Confident	69.7	Low	59 Å²	59	99.6 Å²	99.6	32%	0.316	49%	0.485	S	S	.	.			trans	-65.1	123.4	149.6	-66.2	-49.8	0	0	0	106.8	I29 C30 I192	N27-I29 HydrophobicContact CB-CG2 3.8Å; N27-I29 PolarHBondContact O-N 3.29Å; N27-C30 WeakPolarHBondContact O-CB 3.26Å; N27-C30 PolarHBondContact O-N 2.94Å; N27-C30 PolarHBondContact O-SG 3.48Å; N27-I192 HydrophobicContact CB-CG2 4.04Å; N27-I192 WeakPolarHBondContact ND2-CG2 3.25Å
28	D	83.4	Confident	71.4	Confident	101 Å²	101	96.9 Å²	96.9	54%	0.54	47%	0.472	S	S	.	.	H	α-helix	trans	-53	-30.8	-178.6	-67.4	-35.4	0	0	0	112.8	C26 C30 N31 N32 L35 Y54	C26-D28 PolarHBondContact O-N 2.88Å; D28-C30 PolarHBondContact O-N 2.94Å; D28-C30 VanDerWaalsContact O-N 3.16Å; D28-N31 PolarHBondContact O-N 3.23Å; D28-N32 PolarHBondContact O-N 3.4Å; D28-L35 HydrophobicContact CB-CD1 3.55Å; D28-Y54 HydrophobicContact CB-CE2 4.32Å; D28-Y54 PolarHBondContact N-OH 2.78Å
29	I	84.9	Confident	73.2	Confident	0 Å²	0	96.5 Å²	96.5	0%	0	46%	0.464	C	S	.	.	H	α-helix	trans	-59	-24.2	175.1	-162.6	172.7	0	0	0	114.1	N27 N31 L35 R36 Y54 I192 H201	N27-I29 HydrophobicContact CB-CG2 3.8Å; N27-I29 PolarHBondContact O-N 3.29Å; I29-N31 VanDerWaalsContact C-N 3.32Å; I29-L35 HydrophobicContact CB-CB 4.18Å; I29-L35 HydrophobicContact CG1-CB 4Å; I29-R36 HydrophobicContact CD1-CG 3.95Å; I29-R36 HydrophobicContact CG1-CG 3.79Å; I29-Y54 HydrophobicContact CB-CD1 4.15Å; I29-Y54 HydrophobicContact CB-CE1 3.69Å; I29-Y54 HydrophobicContact CD1-CD1 3.99Å; I29-Y54 HydrophobicContact CD1-CE1 4.3Å; I29-Y54 HydrophobicContact CG2-CD1 4.48Å; I29-Y54 HydrophobicContact CG2-CE1 3.76Å; I29-Y54 PolarHBondContact N-OH 3.3Å; I29-I192 HydrophobicContact CD1-CD1 4.01Å; I29-I192 HydrophobicContact CG2-CD1 3.86Å; I29-I192 HydrophobicContact CG2-CG2 3.97Å; I29-H201 HydrophobicContact CD1-CB 3.88Å
30	C	86.9	Confident	75.1	Confident	33 Å²	33	91.2 Å²	91.2	22%	0.223	45%	0.447	C	S	.	.	H	α-helix	trans	-69.3	-33.5	176.6	-62.9	0	0	0	0	111.8	N27 D28 C194	N27-C30 WeakPolarHBondContact O-CB 3.26Å; N27-C30 PolarHBondContact O-N 2.94Å; N27-C30 PolarHBondContact O-SG 3.48Å; D28-C30 PolarHBondContact O-N 2.94Å; D28-C30 VanDerWaalsContact O-N 3.16Å; C30-C194 WeakPolarHBondContact CA-SG 3.32Å; C30-C194 HydrophobicContact CB-CB 3.62Å; C30-C194 WeakPolarHBondContact CB-SG 3.39Å; C30-C194 WeakPolarHBondContact SG-CA 3.35Å; C30-C194 WeakPolarHBondContact SG-CB 3.23Å; C30-C194 CovalentContact SG-SG 2.04Å; C30-C194 PolarHBondContact SG-SG 2.84Å
31	N	86.7	Confident	77.2	Confident	129 Å²	129	91.6 Å²	91.6	69%	0.69	45%	0.446	S	S	*	.	H	α-helix	trans	-97.7	-28.8	-179	-63.2	-41.9	0	0	0	112.2	D28 I29	D28-N31 PolarHBondContact O-N 3.23Å; I29-N31 VanDerWaalsContact C-N 3.32Å
32	N	87.1	Confident	79.4	Confident	77 Å²	77	86.1 Å²	86.1	41%	0.412	42%	0.42	S	S	.	.			trans	-114.9	100.4	-178.4	-173.3	-6.9	0	0	0	111.1	D28 A34 L35	D28-N32 PolarHBondContact O-N 3.4Å; N32-A34 PolarHBondContact O-N 3.06Å; N32-A34 WeakPolarHBondContact OD1-CB 3.31Å; N32-A34 PolarHBondContact OD1-N 3.31Å; N32-L35 HydrophobicContact CB-CD1 3.93Å; N32-L35 HydrophobicContact CB-CG 4.05Å; N32-L35 WeakPolarHBondContact O-CB 3.4Å; N32-L35 PolarHBondContact O-N 2.88Å; N32-L35 VanDerWaalsContact O-N 3.15Å
33	R	83.6	Confident	81.4	Confident	200 Å²	200	80.4 Å²	80.4	76%	0.755	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-62.2	-24.3	177.7	-67.1	-175.6	-176.9	179	1.4	113.3	L35 R36	R33-L35 PolarHBondContact O-N 3.47Å; R33-R36 WeakPolarHBondContact O-CB 3.31Å; R33-R36 WeakPolarHBondContact O-CG 3.48Å; R33-R36 PolarHBondContact O-N 3.03Å; R33-R36 VanDerWaalsContact O-N 3.12Å
34	A	86.8	Confident	83.4	Confident	69 Å²	69	76.1 Å²	76.1	57%	0.57	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-63.7	-27.6	177.9	0	0	0	0	0	112	N32 R36 N37 Y38	N32-A34 PolarHBondContact O-N 3.06Å; N32-A34 WeakPolarHBondContact OD1-CB 3.31Å; N32-A34 PolarHBondContact OD1-N 3.31Å; A34-R36 PolarHBondContact O-N 2.91Å; A34-N37 PolarHBondContact O-N 2.98Å; A34-Y38 PolarHBondContact O-N 3.29Å
35	L	86.4	Confident	85.7	Confident	30 Å²	30	71.6 Å²	71.6	16%	0.157	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-67.4	-14.6	176.8	-64.2	176.6	0	0	0	113.6	D28 I29 N32 R33 N37 Y38 Y54	D28-L35 HydrophobicContact CB-CD1 3.55Å; I29-L35 HydrophobicContact CB-CB 4.18Å; I29-L35 HydrophobicContact CG1-CB 4Å; N32-L35 HydrophobicContact CB-CD1 3.93Å; N32-L35 HydrophobicContact CB-CG 4.05Å; N32-L35 WeakPolarHBondContact O-CB 3.4Å; N32-L35 PolarHBondContact O-N 2.88Å; N32-L35 VanDerWaalsContact O-N 3.15Å; R33-L35 PolarHBondContact O-N 3.47Å; L35-N37 VanDerWaalsContact C-N 3.34Å; L35-Y38 HydrophobicContact CD2-CD2 4.49Å; L35-Y38 HydrophobicContact CD2-CG 4.36Å; L35-Y54 HydrophobicContact CB-CD2 4.14Å; L35-Y54 HydrophobicContact CD1-CD2 4.09Å; L35-Y54 HydrophobicContact CD1-CE2 3.8Å; L35-Y54 HydrophobicContact CD2-CD2 4.27Å; L35-Y54 HydrophobicContact CG-CD2 4.4Å
36	R	85.4	Confident	87.9	Confident	86 Å²	86	74 Å²	74	33%	0.325	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-68.7	-32.9	177.3	-64.2	-177.4	-175.7	-164.9	-1.1	113.5	I29 R33 A34	I29-R36 HydrophobicContact CD1-CG 3.95Å; I29-R36 HydrophobicContact CG1-CG 3.79Å; R33-R36 WeakPolarHBondContact O-CB 3.31Å; R33-R36 WeakPolarHBondContact O-CG 3.48Å; R33-R36 PolarHBondContact O-N 3.03Å; R33-R36 VanDerWaalsContact O-N 3.12Å; A34-R36 PolarHBondContact O-N 2.91Å
37	N	88.4	Confident	89.5	Confident	149 Å²	149	74 Å²	74	80%	0.797	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-114.6	16.4	179.2	-60.6	-29.8	0	0	0	110.9	A34 L35 E39	A34-N37 PolarHBondContact O-N 2.98Å; L35-N37 VanDerWaalsContact C-N 3.34Å; N37-E39 PolarHBondContact O-N 3.3Å
38	Y	91.1	Very high	90.6	Very high	73 Å²	73	72.9 Å²	72.9	29%	0.286	37%	0.369	S	S	.	.			trans	-65.4	125.3	-177.4	172.5	-91.7	0	0	0	110	A34 L35 N40 H53	A34-Y38 PolarHBondContact O-N 3.29Å; L35-Y38 HydrophobicContact CD2-CD2 4.49Å; L35-Y38 HydrophobicContact CD2-CG 4.36Å; Y38-N40 HydrophobicContact CE1-CB 4.46Å; Y38-H53 PolarHBondContact O-ND1 3.5Å
39	E	94.8	Very high	91.2	Very high	80 Å²	80	68.7 Å²	68.7	37%	0.374	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	125.8	174.3	176.4	173.3	-139.4	0	0	107.9	N37 I41 R49 L52 H53	N37-E39 PolarHBondContact O-N 3.3Å; E39-I41 HydrophobicContact CG-CG1 4.07Å; E39-R49 IonicContact OE1-CZ 2.86Å; E39-R49 IonicContact OE1-NE 3.45Å; E39-R49 IonicContact OE1-NH2 2.77Å; E39-R49 PolarHBondContact OE1-NH2 3.07Å; E39-R49 IonicContact OE2-NH2 2.67Å; E39-R49 PolarHBondContact OE2-NH2 3.43Å; E39-L52 WeakPolarHBondContact CA-O 3.43Å; E39-H53 IonicContact OE1-CE1 3.45Å; E39-H53 PolarHBondContact OE1-CE1 2.84Å; E39-H53 IonicContact OE1-NE2 3.83Å
40	N	94.1	Very high	91.8	Very high	39 Å²	39	68.7 Å²	68.7	21%	0.209	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	109.9	168.4	-171.5	-12.3	0	0	0	109.1	Y38 I42 S51 L52 K249 G250	Y38-N40 HydrophobicContact CE1-CB 4.46Å; N40-I42 PolarHBondContact O-N 3.44Å; N40-S51 CarbonylContact O-C 3.6Å; N40-S51 VanDerWaalsContact O-CA 3.23Å; N40-S51 WeakPolarHBondContact O-CA 3.44Å; N40-L52 PolarHBondContact N-O 3.19Å; N40-L52 PolarHBondContact O-N 3.45Å; N40-K249 PolarHBondContact ND2-O 2.91Å; N40-G250 WeakPolarHBondContact ND2-CA 3.4Å
41	I	95.4	Very high	92.3	Very high	50 Å²	50	67.1 Å²	67.1	26%	0.256	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	107.2	178.7	-57.5	167.6	0	0	0	108.6	E39 E44 R49 K249	E39-I41 HydrophobicContact CG-CG1 4.07Å; I41-E44 HydrophobicContact CG2-CB 3.77Å; I41-R49 HydrophobicContact CG2-CG 4.47Å; I41-K249 WeakPolarHBondContact O-CE 3.04Å; I41-K249 PolarHBondContact O-NZ 2.93Å
42	I	94.3	Very high	92.7	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-48.1	-179.8	-48.3	-56.8	0	0	0	109.6	N40 Y50 L52 K249 G250 D268	N40-I42 PolarHBondContact O-N 3.44Å; I42-Y50 HydrophobicContact CB-CD1 3.91Å; I42-Y50 HydrophobicContact CG1-CD1 3.93Å; I42-Y50 HydrophobicContact CG1-CE1 4.23Å; I42-Y50 HydrophobicContact CG2-CD1 4.45Å; I42-Y50 PolarHBondContact N-O 3.34Å; I42-L52 HydrophobicContact CD1-CD1 3.86Å; I42-L52 HydrophobicContact CD1-CG 4Å; I42-L52 HydrophobicContact CG1-CD1 4.18Å; I42-L52 HydrophobicContact CG1-CG 3.88Å; I42-K249 HydrophobicContact CG2-CB 4.36Å; I42-K249 VanDerWaalsContact O-CD 3.23Å; I42-K249 WeakPolarHBondContact O-CD 3.17Å; I42-K249 WeakPolarHBondContact O-CE 3.42Å; I42-K249 PolarHBondContact O-NZ 3.15Å; I42-G250 VanDerWaalsContact CD1-CA 3.43Å; I42-D268 WeakPolarHBondContact CG2-O 3.34Å
43	I	94.2	Very high	93.1	Very high	30 Å²	30	57.8 Å²	57.8	15%	0.154	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.5	179.8	-48.6	174.5	0	0	0	108.4	Y48 R49 Y50 D268 V271	I43-Y48 HydrophobicContact CG2-CD1 4.4Å; I43-R49 CarbonylContact O-C 3.58Å; I43-R49 VanDerWaalsContact O-CA 3.28Å; I43-R49 WeakPolarHBondContact O-CA 3.34Å; I43-Y50 PolarHBondContact N-O 3.39Å; I43-Y50 PolarHBondContact O-N 2.97Å; I43-D268 VanDerWaalsContact CD1-O 3.29Å; I43-D268 WeakPolarHBondContact CD1-O 3.47Å; I43-V271 HydrophobicContact CD1-CB 4.11Å; I43-V271 HydrophobicContact CD1-CG2 3.22Å; I43-V271 HydrophobicContact CG1-CB 3.99Å; I43-V271 HydrophobicContact CG1-CG1 4.44Å; I43-V271 HydrophobicContact CG1-CG2 3.56Å
44	E	95.1	Very high	93.5	Very high	67 Å²	67	49.8 Å²	49.8	31%	0.313	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	129.5	168.4	-175.8	163.7	-178.7	0	0	109.8	I41 Y48 R49 K208 W209	I41-E44 HydrophobicContact CG2-CB 3.77Å; E44-Y48 CarbonylContact C-O 3.56Å; E44-Y48 WeakPolarHBondContact CA-O 3.45Å; E44-R49 HydrophobicContact CB-CG 4.35Å; E44-R49 VanDerWaalsContact CD-NH1 3.34Å; E44-R49 HydrophobicContact CG-CB 4.3Å; E44-R49 HydrophobicContact CG-CG 4.3Å; E44-R49 IonicContact OE1-NH1 3.9Å; E44-R49 PolarHBondContact OE1-NH1 3.23Å; E44-R49 IonicContact OE2-CZ 3.28Å; E44-R49 IonicContact OE2-NE 2.65Å; E44-R49 IonicContact OE2-NH1 3.67Å; E44-R49 PolarHBondContact OE2-NH1 3.13Å; E44-K208 VanDerWaalsContact OE1-CE 3.24Å; E44-K208 WeakPolarHBondContact OE1-CE 3.25Å; E44-K208 IonicContact OE1-NZ 2.66Å; E44-K208 PolarHBondContact OE1-NZ 2.88Å; E44-W209 HydrophobicContact CG-CZ2 4.09Å
45	N	94.9	Very high	93.6	Very high	79 Å²	79	48.3 Å²	48.3	42%	0.422	24%	0.237	S	C	.	.			trans	-139.8	-169.4	167.9	67.1	39	0	0	0	108.8	T47 Y48 W209	N45-T47 VanDerWaalsContact C-N 3.27Å; N45-T47 PolarHBondContact O-N 3.41Å; N45-T47 PolarHBondContact OD1-N 3.46Å; N45-T47 PolarHBondContact OD1-OG1 3.4Å; N45-Y48 PolarHBondContact N-O 3.43Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.16Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.23Å; N45-Y48 PolarHBondContact OD1-N 3.27Å; N45-Y48 PolarHBondContact OD1-O 2.92Å; N45-W209 WeakPolarHBondContact O-CH2 3.29Å; N45-W209 WeakPolarHBondContact O-CZ2 3.38Å
46	D	94.9	Very high	94.1	Very high	139 Å²	139	47 Å²	47	74%	0.743	23%	0.23	S	C	*	.	S	Bend	trans	-70.3	-18.1	-174.5	-65	-27.4	0	0	0	115.2	R62	D46-R62 VanDerWaalsContact O-CD 3.26Å; D46-R62 WeakPolarHBondContact O-CD 3.22Å; D46-R62 PolarHBondContact O-NH1 3.31Å; D46-R62 VanDerWaalsContact O-NH1 3.1Å
47	T	96.5	Very high	94.6	Very high	63 Å²	63	43 Å²	43	39%	0.387	22%	0.216	S	C	.	.	S	Bend	trans	-122.9	-11.5	-174.9	61.1	0	0	0	0	113.8	N45 R61 R62	N45-T47 VanDerWaalsContact C-N 3.27Å; N45-T47 PolarHBondContact O-N 3.41Å; N45-T47 PolarHBondContact OD1-N 3.46Å; N45-T47 PolarHBondContact OD1-OG1 3.4Å; T47-R61 CarbonylContact O-C 3.57Å; T47-R61 WeakPolarHBondContact O-CA 3.01Å; T47-R62 PolarHBondContact O-N 3.07Å
48	Y	97	Very high	95	Very high	37 Å²	37	36 Å²	36	15%	0.145	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.9	-171.5	-164.3	-92.4	0	0	0	111.6	I43 E44 N45 R59 I60 R61 D268	I43-Y48 HydrophobicContact CG2-CD1 4.4Å; E44-Y48 CarbonylContact C-O 3.56Å; E44-Y48 WeakPolarHBondContact CA-O 3.45Å; N45-Y48 PolarHBondContact N-O 3.43Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.16Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.23Å; N45-Y48 PolarHBondContact OD1-N 3.27Å; N45-Y48 PolarHBondContact OD1-O 2.92Å; Y48-R59 HydrophobicContact CE2-CG 4.1Å; Y48-R59 WeakPolarHBondContact OH-CD 3.03Å; Y48-R59 WeakPolarHBondContact OH-CG 3.31Å; Y48-R59 PolarHBondContact OH-NE 2.96Å; Y48-R59 VanDerWaalsContact OH-NE 3.12Å; Y48-I60 CarbonylContact C-O 3.45Å; Y48-I60 WeakPolarHBondContact CA-O 3.42Å; Y48-R61 HydrophobicContact CD2-CG 3.71Å; Y48-R61 HydrophobicContact CE2-CG 3.57Å; Y48-D268 VanDerWaalsContact CE1-OD1 3.25Å; Y48-D268 WeakPolarHBondContact CE1-OD1 3.14Å; Y48-D268 PolarHBondContact OH-OD1 2.89Å; Y48-D268 PolarHBondContact OH-OD2 3.19Å
49	R	97.5	Very high	95.3	Very high	13 Å²	13	32.6 Å²	32.6	5%	0.049	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	134.4	169.1	176	175.8	171.5	145.4	-12.3	110.2	E39 I41 I43 E44 R59 I60 W209	E39-R49 IonicContact OE1-CZ 2.86Å; E39-R49 IonicContact OE1-NE 3.45Å; E39-R49 IonicContact OE1-NH2 2.77Å; E39-R49 PolarHBondContact OE1-NH2 3.07Å; E39-R49 IonicContact OE2-NH2 2.67Å; E39-R49 PolarHBondContact OE2-NH2 3.43Å; I41-R49 HydrophobicContact CG2-CG 4.47Å; I43-R49 CarbonylContact O-C 3.58Å; I43-R49 VanDerWaalsContact O-CA 3.28Å; I43-R49 WeakPolarHBondContact O-CA 3.34Å; E44-R49 HydrophobicContact CB-CG 4.35Å; E44-R49 VanDerWaalsContact CD-NH1 3.34Å; E44-R49 HydrophobicContact CG-CB 4.3Å; E44-R49 HydrophobicContact CG-CG 4.3Å; E44-R49 IonicContact OE1-NH1 3.9Å; E44-R49 PolarHBondContact OE1-NH1 3.23Å; E44-R49 IonicContact OE2-CZ 3.28Å; E44-R49 IonicContact OE2-NE 2.65Å; E44-R49 IonicContact OE2-NH1 3.67Å; E44-R49 PolarHBondContact OE2-NH1 3.13Å; R49-R59 CarbonylContact O-C 3.6Å; R49-R59 WeakPolarHBondContact O-CA 3.05Å; R49-I60 HydrophobicContact CB-CB 4.19Å; R49-I60 HydrophobicContact CB-CG1 4.48Å; R49-I60 PolarHBondContact N-O 3.26Å; R49-I60 PolarHBondContact O-N 3.45Å; R49-W209 HydrophobicContact CB-CH2 4.08Å; R49-W209 HydrophobicContact CB-CZ2 3.63Å
50	Y	97.3	Very high	95.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.3	170.7	-176.2	-113.6	0	0	0	109.8	I42 I43 L52 S57 M58 R59 D268	I42-Y50 HydrophobicContact CB-CD1 3.91Å; I42-Y50 HydrophobicContact CG1-CD1 3.93Å; I42-Y50 HydrophobicContact CG1-CE1 4.23Å; I42-Y50 HydrophobicContact CG2-CD1 4.45Å; I42-Y50 PolarHBondContact N-O 3.34Å; I43-Y50 PolarHBondContact N-O 3.39Å; I43-Y50 PolarHBondContact O-N 2.97Å; Y50-L52 HydrophobicContact CE1-CD2 3.91Å; Y50-S57 WeakPolarHBondContact OH-CB 3.21Å; Y50-M58 WeakPolarHBondContact CA-O 3.13Å; Y50-R59 HydrophobicContact CD2-CB 3.99Å; Y50-R59 HydrophobicContact CD2-CG 4.36Å; Y50-D268 HydrophobicContact CD1-CB 3.56Å; Y50-D268 HydrophobicContact CD2-CB 4.47Å; Y50-D268 HydrophobicContact CE1-CB 3.72Å; Y50-D268 HydrophobicContact CG-CB 3.96Å
51	S	97	Very high	95.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.2	179.6	55.2	0	0	0	0	112	N40 H53 S57 M58	N40-S51 CarbonylContact O-C 3.6Å; N40-S51 VanDerWaalsContact O-CA 3.23Å; N40-S51 WeakPolarHBondContact O-CA 3.44Å; S51-H53 PolarHBondContact OG-NE2 3.34Å; S51-S57 CarbonylContact O-C 3.57Å; S51-S57 VanDerWaalsContact O-CA 3.3Å; S51-S57 WeakPolarHBondContact O-CA 3.38Å; S51-M58 PolarHBondContact N-O 2.95Å; S51-M58 PolarHBondContact O-N 3.27Å; S51-M58 WeakPolarHBondContact OG-CE 3.49Å
52	L	95.6	Very high	95.8	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.1	172.2	-58.1	-179.3	0	0	0	109.1	E39 N40 I42 Y50 I221 C247 K252 I254	E39-L52 WeakPolarHBondContact CA-O 3.43Å; N40-L52 PolarHBondContact N-O 3.19Å; N40-L52 PolarHBondContact O-N 3.45Å; I42-L52 HydrophobicContact CD1-CD1 3.86Å; I42-L52 HydrophobicContact CD1-CG 4Å; I42-L52 HydrophobicContact CG1-CD1 4.18Å; I42-L52 HydrophobicContact CG1-CG 3.88Å; Y50-L52 HydrophobicContact CE1-CD2 3.91Å; L52-I221 HydrophobicContact CB-CD1 4.48Å; L52-I221 HydrophobicContact CD2-CD1 4.04Å; L52-C247 HydrophobicContact CD1-CB 4.44Å; L52-K252 HydrophobicContact CD1-CB 4.28Å; L52-K252 HydrophobicContact CD1-CD 4.42Å; L52-I254 HydrophobicContact CD2-CG2 4.47Å
53	H	95	Very high	95.9	Very high	9 Å²	9	36.8 Å²	36.8	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	-175.2	170.9	-57.3	-88.6	0	0	0	109.1	Y38 E39 S51 Y56 I203	Y38-H53 PolarHBondContact O-ND1 3.5Å; E39-H53 IonicContact OE1-CE1 3.45Å; E39-H53 PolarHBondContact OE1-CE1 2.84Å; E39-H53 IonicContact OE1-NE2 3.83Å; S51-H53 PolarHBondContact OG-NE2 3.34Å; H53-Y56 CarbonylContact C-O 3.6Å; H53-Y56 WeakPolarHBondContact CA-O 3.28Å; H53-Y56 VanDerWaalsContact CB-O 3.29Å; H53-Y56 WeakPolarHBondContact CB-O 3.13Å; H53-Y56 PolarHBondContact N-O 3.26Å; H53-I203 HydrophobicContact CB-CD1 3.76Å; H53-I203 HydrophobicContact CB-CG1 4.21Å
54	Y	91.2	Very high	96.1	Very high	33 Å²	33	38.2 Å²	38.2	13%	0.129	19%	0.186	C	C	.	.	S	Bend	trans	-56.4	-58.8	-175.9	-178.7	-120.8	0	0	0	112.4	D28 I29 L35 I192 H201 K252	D28-Y54 HydrophobicContact CB-CE2 4.32Å; D28-Y54 PolarHBondContact N-OH 2.78Å; I29-Y54 HydrophobicContact CB-CD1 4.15Å; I29-Y54 HydrophobicContact CB-CE1 3.69Å; I29-Y54 HydrophobicContact CD1-CD1 3.99Å; I29-Y54 HydrophobicContact CD1-CE1 4.3Å; I29-Y54 HydrophobicContact CG2-CD1 4.48Å; I29-Y54 HydrophobicContact CG2-CE1 3.76Å; I29-Y54 PolarHBondContact N-OH 3.3Å; L35-Y54 HydrophobicContact CB-CD2 4.14Å; L35-Y54 HydrophobicContact CD1-CD2 4.09Å; L35-Y54 HydrophobicContact CD1-CE2 3.8Å; L35-Y54 HydrophobicContact CD2-CD2 4.27Å; L35-Y54 HydrophobicContact CG-CD2 4.4Å; Y54-I192 HydrophobicContact CE1-CD1 4.45Å; Y54-H201 WeakPolarHBondContact CB-NE2 3.45Å; Y54-K252 PolarHBondContact O-NZ 2.81Å
55	N	90.4	Very high	96.1	Very high	37 Å²	37	40 Å²	40	20%	0.198	21%	0.206	C	C	.	.	S	Bend	trans	-108.3	-6	-176.3	-73.2	-16.1	0	0	0	114.6	S220 I221	N55-S220 WeakPolarHBondContact O-CA 3.49Å; N55-I221 PolarHBondContact O-N 3.24Å
56	Y	95.7	Very high	96.2	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	150.1	-172.1	-77.2	-97.2	0	0	0	110.8	H53 Y92 I188 I203 F218 E219 I221	H53-Y56 CarbonylContact C-O 3.6Å; H53-Y56 WeakPolarHBondContact CA-O 3.28Å; H53-Y56 VanDerWaalsContact CB-O 3.29Å; H53-Y56 WeakPolarHBondContact CB-O 3.13Å; H53-Y56 PolarHBondContact N-O 3.26Å; Y56-Y92 HydrophobicContact CD2-CD2 4.49Å; Y56-Y92 HydrophobicContact CD2-CE1 4.37Å; Y56-Y92 HydrophobicContact CD2-CE2 4.13Å; Y56-Y92 HydrophobicContact CE2-CD1 4.14Å; Y56-Y92 AromaticContact CE2-CD2 3.48Å; Y56-Y92 HydrophobicContact CE2-CD2 3.48Å; Y56-Y92 VanDerWaalsContact CE2-CD2 3.48Å; Y56-Y92 HydrophobicContact CE2-CE1 4.12Å; Y56-Y92 AromaticContact CE2-CE2 3.5Å; Y56-Y92 HydrophobicContact CE2-CE2 3.5Å; Y56-Y92 AromaticContact CE2-CG 3.83Å; Y56-Y92 HydrophobicContact CE2-CG 3.83Å; Y56-Y92 AromaticContact CE2-CZ 3.83Å; Y56-Y92 AromaticContact CZ-CD2 3.98Å; Y56-Y92 PolarHBondContact OH-N 3.01Å; Y56-I188 HydrophobicContact CD1-CD1 3.96Å; Y56-I188 HydrophobicContact CD2-CD1 4.15Å; Y56-I188 HydrophobicContact CE1-CD1 4.12Å; Y56-I188 HydrophobicContact CE2-CD1 4.31Å; Y56-I188 HydrophobicContact CG-CD1 4Å; Y56-I203 HydrophobicContact CD2-CD1 4.1Å; Y56-I203 HydrophobicContact CG-CD1 4.09Å; Y56-F218 HydrophobicContact CD1-CB 3.95Å; Y56-F218 HydrophobicContact CE1-CB 4.49Å; Y56-E219 CarbonylContact C-O 3.55Å; Y56-E219 WeakPolarHBondContact CA-O 3.15Å; Y56-E219 WeakPolarHBondContact CD1-O 3.19Å; Y56-I221 VanDerWaalsContact C-CD1 3.45Å; Y56-I221 WeakPolarHBondContact O-CD1 3.4Å
57	S	95.8	Very high	96.2	Very high	4 Å²	4	34.7 Å²	34.7	3%	0.028	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	150.5	156.8	63	0	0	0	0	109.5	Y50 S51 F218 E219	Y50-S57 WeakPolarHBondContact OH-CB 3.21Å; S51-S57 CarbonylContact O-C 3.57Å; S51-S57 VanDerWaalsContact O-CA 3.3Å; S51-S57 WeakPolarHBondContact O-CA 3.38Å; S57-F218 WeakPolarHBondContact O-CA 3.44Å; S57-E219 PolarHBondContact N-O 2.98Å; S57-E219 PolarHBondContact O-N 2.82Å
58	M	98	Very high	96.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.1	174.1	179.8	179.6	60.6	0	0	108.6	Y50 S51 I60 V205 V216 E217 F218	Y50-M58 WeakPolarHBondContact CA-O 3.13Å; S51-M58 PolarHBondContact N-O 2.95Å; S51-M58 PolarHBondContact O-N 3.27Å; S51-M58 WeakPolarHBondContact OG-CE 3.49Å; M58-I60 HydrophobicContact CE-CD1 4.03Å; M58-I60 HydrophobicContact CG-CG1 4.16Å; M58-I60 HydrophobicContact SD-CD1 4.13Å; M58-I60 HydrophobicContact SD-CG1 4.33Å; M58-V205 HydrophobicContact SD-CG2 4.34Å; M58-V216 HydrophobicContact CG-CG1 3.85Å; M58-V216 HydrophobicContact SD-CG1 4.1Å; M58-E217 WeakPolarHBondContact CA-O 3.44Å; M58-F218 HydrophobicContact CB-CD1 4.03Å; M58-F218 HydrophobicContact CB-CE1 3.99Å; M58-F218 HydrophobicContact CG-CD1 4.09Å; M58-F218 HydrophobicContact CG-CE1 3.7Å; M58-F218 HydrophobicContact CG-CZ 4.21Å; M58-F218 HydrophobicContact SD-CE1 3.61Å; M58-F218 HydrophobicContact SD-CZ 3.88Å
59	R	97.5	Very high	96	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.011	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.6	173.6	-172.1	-179.5	-66.2	104.4	1.2	109.5	Y48 R49 Y50 R61 V216 E217 D268	Y48-R59 HydrophobicContact CE2-CG 4.1Å; Y48-R59 WeakPolarHBondContact OH-CD 3.03Å; Y48-R59 WeakPolarHBondContact OH-CG 3.31Å; Y48-R59 PolarHBondContact OH-NE 2.96Å; Y48-R59 VanDerWaalsContact OH-NE 3.12Å; R49-R59 CarbonylContact O-C 3.6Å; R49-R59 WeakPolarHBondContact O-CA 3.05Å; Y50-R59 HydrophobicContact CD2-CB 3.99Å; Y50-R59 HydrophobicContact CD2-CG 4.36Å; R59-R61 HydrophobicContact CG-CG 4.27Å; R59-V216 CarbonylContact O-C 3.6Å; R59-V216 VanDerWaalsContact O-CA 3.32Å; R59-V216 WeakPolarHBondContact O-CA 3.43Å; R59-E217 HydrophobicContact CB-CB 4.49Å; R59-E217 PolarHBondContact N-O 2.03Å; R59-E217 PolarHBondContact O-N 2.85Å; R59-D268 IonicContact CZ-OD2 3.18Å; R59-D268 IonicContact NE-OD2 3.55Å; R59-D268 PolarHBondContact NE-OD2 3Å; R59-D268 IonicContact NH2-OD2 3.71Å; R59-D268 PolarHBondContact NH2-OD2 2.82Å
60	I	98.4	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.1	177.3	-50.1	-176.7	0	0	0	108.4	Y48 R49 M58 V205 W209 T214 L215 V216	Y48-I60 CarbonylContact C-O 3.45Å; Y48-I60 WeakPolarHBondContact CA-O 3.42Å; R49-I60 HydrophobicContact CB-CB 4.19Å; R49-I60 HydrophobicContact CB-CG1 4.48Å; R49-I60 PolarHBondContact N-O 3.26Å; R49-I60 PolarHBondContact O-N 3.45Å; M58-I60 HydrophobicContact CE-CD1 4.03Å; M58-I60 HydrophobicContact CG-CG1 4.16Å; M58-I60 HydrophobicContact SD-CD1 4.13Å; M58-I60 HydrophobicContact SD-CG1 4.33Å; I60-V205 HydrophobicContact CD1-CG1 4.26Å; I60-W209 HydrophobicContact CB-CD2 4.39Å; I60-W209 HydrophobicContact CB-CE3 4.23Å; I60-W209 HydrophobicContact CD1-CB 3.9Å; I60-W209 HydrophobicContact CD1-CD2 4.12Å; I60-W209 HydrophobicContact CD1-CG 3.7Å; I60-W209 HydrophobicContact CG2-CB 4.07Å; I60-W209 HydrophobicContact CG2-CD2 3.75Å; I60-W209 HydrophobicContact CG2-CE3 3.35Å; I60-W209 HydrophobicContact CG2-CG 4.08Å; I60-W209 HydrophobicContact CG2-CZ3 3.98Å; I60-T214 HydrophobicContact CG2-CG2 3.44Å; I60-T214 VanDerWaalsContact CG2-CG2 3.44Å; I60-L215 CarbonylContact C-O 3.57Å; I60-L215 WeakPolarHBondContact CA-O 3.02Å; I60-V216 HydrophobicContact CG1-CG1 4.2Å; I60-V216 HydrophobicContact CG1-CG2 4.16Å; I60-V216 HydrophobicContact CG2-CG2 4.17Å
61	R	97.9	Very high	95.6	Very high	60 Å²	60	44.3 Å²	44.3	23%	0.226	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.6	179	-63.6	-175.4	-76.5	154.8	-10.4	109.9	T47 Y48 R59 Q64 T214 L215 E217	T47-R61 CarbonylContact O-C 3.57Å; T47-R61 WeakPolarHBondContact O-CA 3.01Å; Y48-R61 HydrophobicContact CD2-CG 3.71Å; Y48-R61 HydrophobicContact CE2-CG 3.57Å; R59-R61 HydrophobicContact CG-CG 4.27Å; R61-Q64 HydrophobicContact CB-CG 3.69Å; R61-Q64 WeakPolarHBondContact O-CG 3.23Å; R61-T214 CarbonylContact O-C 3.37Å; R61-T214 WeakPolarHBondContact O-CA 3.44Å; R61-L215 PolarHBondContact N-O 3.2Å; R61-L215 VanDerWaalsContact NH2-CD2 3.34Å; R61-L215 PolarHBondContact O-N 2.84Å; R61-E217 IonicContact CZ-OE2 3.47Å; R61-E217 IonicContact NE-OE2 3.43Å; R61-E217 PolarHBondContact NE-OE2 2.82Å; R61-E217 VanDerWaalsContact NH2-CD 3.34Å; R61-E217 IonicContact NH2-OE1 3.49Å; R61-E217 PolarHBondContact NH2-OE1 2.77Å; R61-E217 IonicContact NH2-OE2 2.71Å; R61-E217 PolarHBondContact NH2-OE2 3.45Å
62	R	97.5	Very high	95.6	Very high	74 Å²	74	48.2 Å²	48.2	28%	0.279	25%	0.247	S	C	.	.	S	Bend	trans	-92.4	169.9	172.6	-68.8	-175.6	67.9	-151.1	-4.5	111.7	D46 T47 Q64 W209 G213 T214	D46-R62 VanDerWaalsContact O-CD 3.26Å; D46-R62 WeakPolarHBondContact O-CD 3.22Å; D46-R62 PolarHBondContact O-NH1 3.31Å; D46-R62 VanDerWaalsContact O-NH1 3.1Å; T47-R62 PolarHBondContact O-N 3.07Å; R62-Q64 PolarHBondContact O-N 3Å; R62-Q64 PolarHBondContact O-NE2 3.37Å; R62-W209 HydrophobicContact CG-CE3 3.98Å; R62-W209 HydrophobicContact CG-CZ3 3.75Å; R62-G213 CarbonylContact C-O 3.53Å; R62-T214 HydrophobicContact CG-CG2 4.19Å
63	N	96.8	Very high	95.6	Very high	122 Å²	122	49 Å²	49	65%	0.652	25%	0.251	S	S	*	.	S	Bend	trans	56.6	35.4	-179.7	-50.2	-28.7	0	0	0	112.1	G213	N63-G213 PolarHBondContact N-O 2.91Å
64	Q	97.6	Very high	95.5	Very high	60 Å²	60	56 Å²	56	28%	0.28	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-95	142.1	176.4	-56.5	-57.7	-71.7	0	0	109.3	R61 R62 Y171 G213 L215	R61-Q64 HydrophobicContact CB-CG 3.69Å; R61-Q64 WeakPolarHBondContact O-CG 3.23Å; R62-Q64 PolarHBondContact O-N 3Å; R62-Q64 PolarHBondContact O-NE2 3.37Å; Q64-Y171 HydrophobicContact CB-CE2 4.48Å; Q64-Y171 WeakPolarHBondContact O-CE2 3.39Å; Q64-Y171 PolarHBondContact O-OH 2.84Å; Q64-G213 PolarHBondContact N-O 2.64Å; Q64-G213 WeakPolarHBondContact O-CA 3.48Å; Q64-L215 HydrophobicContact CB-CB 4.02Å; Q64-L215 HydrophobicContact CG-CB 3.87Å
65	S	96.7	Very high	95.4	Very high	105 Å²	105	57 Å²	57	73%	0.734	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-74.8	160.3	168.3	-57	0	0	0	0	110.8
66	Q	96.2	Very high	95.4	Very high	47 Å²	47	58.8 Å²	58.8	22%	0.22	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-55.5	122.3	174.8	-172	177.7	-48	0	0	110.3	V68 S70 I159 Y171	Q66-V68 WeakPolarHBondContact CG-O 3.47Å; Q66-V68 PolarHBondContact NE2-O 3.17Å; Q66-V68 PolarHBondContact O-N 3.3Å; Q66-V68 VanDerWaalsContact O-N 3.16Å; Q66-S70 PolarHBondContact NE2-OG 3.11Å; Q66-I159 HydrophobicContact CG-CD1 3.76Å; Q66-Y171 VanDerWaalsContact CA-CZ 3.46Å; Q66-Y171 HydrophobicContact CB-CD1 4.3Å; Q66-Y171 HydrophobicContact CB-CE1 3.64Å; Q66-Y171 HydrophobicContact CG-CD1 4.04Å; Q66-Y171 HydrophobicContact CG-CE1 3.83Å; Q66-Y171 PolarHBondContact N-OH 3.37Å
67	P	94.3	Very high	95.1	Very high	60 Å²	60	59.1 Å²	59.1	39%	0.39	31%	0.314	S	S	.	.	S	Bend	trans	-69.9	-16.4	-170.4	25.7	-35.5	0	0	0	113.8	L161 Y171 L215	P67-L161 HydrophobicContact CB-CD1 4.36Å; P67-L161 HydrophobicContact CG-CD1 3.73Å; P67-Y171 HydrophobicContact CG-CG 4.35Å; P67-L215 HydrophobicContact CG-CD1 4.28Å
68	V	95.2	Very high	94.7	Very high	7 Å²	7	67 Å²	67	4%	0.042	35%	0.35	C	S	.	.	S	Bend	trans	-136.2	126.7	-174.4	-176.7	0	0	0	0	108.8	Q66 S70 R72 F73 L138 L161	Q66-V68 WeakPolarHBondContact CG-O 3.47Å; Q66-V68 PolarHBondContact NE2-O 3.17Å; Q66-V68 PolarHBondContact O-N 3.3Å; Q66-V68 VanDerWaalsContact O-N 3.16Å; V68-S70 PolarHBondContact O-N 2.64Å; V68-R72 HydrophobicContact CG1-CB 4.01Å; V68-R72 HydrophobicContact CG1-CG 4.45Å; V68-F73 HydrophobicContact CB-CE2 3.85Å; V68-F73 HydrophobicContact CB-CZ 4.12Å; V68-F73 HydrophobicContact CG1-CD2 4.47Å; V68-F73 HydrophobicContact CG1-CE2 3.69Å; V68-F73 HydrophobicContact CG1-CZ 4.09Å; V68-L138 HydrophobicContact CB-CD2 4.38Å; V68-L138 HydrophobicContact CG1-CD2 4.08Å; V68-L138 HydrophobicContact CG2-CD2 3.36Å; V68-L161 HydrophobicContact CG2-CD1 3.48Å; V68-L161 VanDerWaalsContact CG2-CD1 3.48Å; V68-L161 HydrophobicContact CG2-CD2 4.1Å; V68-L161 HydrophobicContact CG2-CG 4.45Å
69	P	94.6	Very high	94.3	Very high	71 Å²	71	72.7 Å²	72.7	46%	0.461	38%	0.381	S	S	.	.			trans	-57.7	134.1	178.3	-25.9	34.5	0	0	0	112.6	K71 R72	P69-K71 HydrophobicContact CB-CG 4.07Å; P69-K71 PolarHBondContact O-N 2.8Å; P69-R72 WeakPolarHBondContact O-CB 3.43Å; P69-R72 PolarHBondContact O-N 3.22Å
70	S	92.7	Very high	94	Very high	60 Å²	60	76.8 Å²	76.8	42%	0.42	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-52.8	-32.7	-177.9	-65.3	0	0	0	0	113.9	Q66 V68 R72 F73	Q66-S70 PolarHBondContact NE2-OG 3.11Å; V68-S70 PolarHBondContact O-N 2.64Å; S70-R72 PolarHBondContact O-N 3.46Å; S70-R72 VanDerWaalsContact O-N 3.16Å; S70-F73 PolarHBondContact O-N 2.81Å; S70-F73 VanDerWaalsContact O-N 3.08Å
71	K	94.4	Very high	93.8	Very high	176 Å²	176	81.1 Å²	81.1	77%	0.765	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-62.1	-17.9	176.7	67.8	179.2	-179.7	-178.1	0	115.5	P69	P69-K71 HydrophobicContact CB-CG 4.07Å; P69-K71 PolarHBondContact O-N 2.8Å
72	R	96	Very high	93.6	Very high	82 Å²	82	80 Å²	80	31%	0.309	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-77.4	-24.8	175.5	-74.3	-174.7	70.1	163.4	4.9	111.9	V68 P69 S70 V133 D135 E137	V68-R72 HydrophobicContact CG1-CB 4.01Å; V68-R72 HydrophobicContact CG1-CG 4.45Å; P69-R72 WeakPolarHBondContact O-CB 3.43Å; P69-R72 PolarHBondContact O-N 3.22Å; S70-R72 PolarHBondContact O-N 3.46Å; S70-R72 VanDerWaalsContact O-N 3.16Å; R72-V133 HydrophobicContact CB-CG2 4.14Å; R72-D135 IonicContact CZ-OD2 3.68Å; R72-D135 IonicContact NE-OD2 2.67Å; R72-D135 IonicContact NH2-OD1 3.94Å; R72-D135 PolarHBondContact NH2-OD1 3.18Å; R72-D135 IonicContact NH2-OD2 3.21Å; R72-D135 PolarHBondContact NH2-OD2 3.32Å; R72-E137 IonicContact CZ-OE2 3.53Å; R72-E137 IonicContact NH1-OE2 3.35Å; R72-E137 IonicContact NH2-OE2 2.73Å; R72-E137 PolarHBondContact NH2-OE2 3.19Å
73	F	96.3	Very high	93.6	Very high	16 Å²	16	76.9 Å²	76.9	7%	0.07	42%	0.415	C	S	.	.			trans	-79.2	122.5	175.4	-62.6	-90.4	0	0	0	109.1	V68 S70 P131 V132 V133 K142 I159 L161	V68-F73 HydrophobicContact CB-CE2 3.85Å; V68-F73 HydrophobicContact CB-CZ 4.12Å; V68-F73 HydrophobicContact CG1-CD2 4.47Å; V68-F73 HydrophobicContact CG1-CE2 3.69Å; V68-F73 HydrophobicContact CG1-CZ 4.09Å; S70-F73 PolarHBondContact O-N 2.81Å; S70-F73 VanDerWaalsContact O-N 3.08Å; F73-P131 HydrophobicContact CB-CB 3.93Å; F73-P131 HydrophobicContact CB-CG 4.06Å; F73-V132 CarbonylContact C-O 3.48Å; F73-V132 WeakPolarHBondContact CA-O 3.41Å; F73-V133 HydrophobicContact CD1-CB 3.97Å; F73-V133 HydrophobicContact CD1-CG1 3.97Å; F73-V133 HydrophobicContact CE1-CB 4.07Å; F73-V133 HydrophobicContact CE1-CG1 3.56Å; F73-V133 HydrophobicContact CG-CB 4.47Å; F73-V133 HydrophobicContact CZ-CG1 4.1Å; F73-K142 HydrophobicContact CD1-CB 3.67Å; F73-K142 HydrophobicContact CD2-CB 4.47Å; F73-K142 HydrophobicContact CE1-CB 3.78Å; F73-K142 HydrophobicContact CG-CB 4.04Å; F73-K142 HydrophobicContact CZ-CB 4.23Å; F73-I159 HydrophobicContact CE1-CG2 4.03Å; F73-I159 HydrophobicContact CZ-CD1 4.39Å; F73-I159 HydrophobicContact CZ-CG2 3.65Å; F73-L161 HydrophobicContact CE1-CD2 4.29Å; F73-L161 HydrophobicContact CZ-CD2 4.02Å
74	K	92.6	Very high	93.6	Very high	156 Å²	156	78.3 Å²	78.3	68%	0.678	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	149.6	-175	-63	-176.4	-179.7	-176.9	0	109.8	V132	K74-V132 PolarHBondContact N-O 3.48Å; K74-V132 VanDerWaalsContact O-CG2 3.29Å; K74-V132 WeakPolarHBondContact O-CG2 3.07Å; K74-V132 PolarHBondContact O-N 3.39Å
75	G	89.6	Confident	93.5	Very high	55 Å²	55	76.4 Å²	76.4	57%	0.567	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	71.7	115.5	177.8	0	0	0	0	0	111.3	P131 V132	G75-P131 VanDerWaalsContact O-CA 3.28Å; G75-P131 WeakPolarHBondContact O-CA 3.33Å; G75-V132 PolarHBondContact O-N 2.91Å
76	N	90.3	Very high	93.5	Very high	75 Å²	75	79.1 Å²	79.1	40%	0.401	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	135.6	178.2	-165.3	25.1	0	0	0	110.2	E78 S130	N76-E78 PolarHBondContact O-N 2.83Å; N76-S130 WeakPolarHBondContact OD1-CA 3.19Å; N76-S130 PolarHBondContact OD1-N 3.17Å
77	V	88.2	Confident	93.5	Very high	8 Å²	8	78.1 Å²	78.1	5%	0.048	40%	0.395	C	S	.	.			trans	-78.5	103.9	171.9	177.3	0	0	0	0	107.9	N79 Y81 F101 P103 S130 V132	V77-N79 WeakPolarHBondContact CG1-O 3.43Å; V77-Y81 HydrophobicContact CG2-CD1 4.25Å; V77-Y81 HydrophobicContact CG2-CG 4.2Å; V77-F101 HydrophobicContact CG1-CB 4.43Å; V77-F101 WeakPolarHBondContact CG1-O 3.3Å; V77-F101 HydrophobicContact CG2-CB 4.3Å; V77-P103 HydrophobicContact CG1-CB 4.07Å; V77-P103 VanDerWaalsContact O-CB 3.3Å; V77-P103 WeakPolarHBondContact O-CB 3.32Å; V77-S130 WeakPolarHBondContact CG2-O 3.38Å; V77-S130 PolarHBondContact N-O 2.9Å; V77-S130 VanDerWaalsContact N-O 3.09Å; V77-V132 HydrophobicContact CG2-CG1 3.46Å; V77-V132 VanDerWaalsContact CG2-CG1 3.46Å
78	E	87.4	Confident	93.5	Very high	169 Å²	169	79.1 Å²	79.1	79%	0.79	40%	0.403	S	S	*	.	S	Bend	trans	-93.5	-30.3	177.3	-65.9	-180	180	0	0	112.6	N76	N76-E78 PolarHBondContact O-N 2.83Å
79	N	89.9	Confident	93.5	Very high	121 Å²	121	78.9 Å²	78.9	65%	0.647	40%	0.401	S	S	*	.	S	Bend	trans	-135.6	-178.9	174.2	-162.1	-3.9	0	0	0	108.8	V77 Y81	V77-N79 WeakPolarHBondContact CG1-O 3.43Å; N79-Y81 PolarHBondContact O-N 3.43Å
80	I	91.3	Very high	93.5	Very high	89 Å²	89	78.2 Å²	78.2	46%	0.456	40%	0.398	S	S	.	.			trans	-51.1	117.3	177.3	-55.9	176.2	0	0	0	109.7	D100	I80-D100 HydrophobicContact CG2-CB 3.98Å
81	Y	93.5	Very high	93.7	Very high	90 Å²	90	75.3 Å²	75.3	35%	0.353	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	95.9	-179.9	-178.7	-107.3	0	0	0	109.5	V77 N79 V83 F101 V132	V77-Y81 HydrophobicContact CG2-CD1 4.25Å; V77-Y81 HydrophobicContact CG2-CG 4.2Å; N79-Y81 PolarHBondContact O-N 3.43Å; Y81-V83 HydrophobicContact CD1-CG1 3.73Å; Y81-V83 HydrophobicContact CE1-CB 4.5Å; Y81-V83 HydrophobicContact CE1-CG1 3.11Å; Y81-V83 HydrophobicContact CE2-CG1 4.3Å; Y81-V83 VanDerWaalsContact CZ-CG1 3.44Å; Y81-F101 AromaticContact CD1-CD2 3.97Å; Y81-F101 HydrophobicContact CD1-CD2 3.97Å; Y81-F101 PolarHBondContact N-O 3.3Å; Y81-F101 PolarHBondContact O-N 2.84Å; Y81-V132 HydrophobicContact CD1-CG1 4.17Å; Y81-V132 HydrophobicContact CD1-CG2 4.34Å; Y81-V132 HydrophobicContact CE1-CB 4.4Å; Y81-V132 HydrophobicContact CE1-CG1 4.34Å; Y81-V132 HydrophobicContact CE1-CG2 3.79Å
82	G	95.3	Very high	93.7	Very high	38 Å²	38	68 Å²	68	39%	0.392	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	131	177.9	0	0	0	0	0	112.3	I99 D100	G82-I99 WeakPolarHBondContact CA-O 3.28Å; G82-D100 WeakPolarHBondContact CA-OD1 3.4Å
83	V	95.8	Very high	93.4	Very high	7 Å²	7	67.8 Å²	67.8	4%	0.042	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.4	179.5	-65.4	0	0	0	0	112.9	Y81 Q98 I99 F101 L139	Y81-V83 HydrophobicContact CD1-CG1 3.73Å; Y81-V83 HydrophobicContact CE1-CB 4.5Å; Y81-V83 HydrophobicContact CE1-CG1 3.11Å; Y81-V83 HydrophobicContact CE2-CG1 4.3Å; Y81-V83 VanDerWaalsContact CZ-CG1 3.44Å; V83-Q98 WeakPolarHBondContact O-CA 3.25Å; V83-I99 HydrophobicContact CG2-CB 4.15Å; V83-I99 PolarHBondContact N-O 2.86Å; V83-I99 PolarHBondContact O-N 3.03Å; V83-F101 HydrophobicContact CG2-CD2 4.23Å; V83-F101 HydrophobicContact CG2-CE2 3.71Å; V83-L139 HydrophobicContact CG2-CD1 3.87Å; V83-L139 HydrophobicContact CG2-CD2 3.91Å
84	Y	97.1	Very high	93.3	Very high	152 Å²	152	70 Å²	70	60%	0.596	38%	0.38	S	S	*	.			trans	-95.3	120.5	168.5	-58.1	-87.6	0	0	0	108.6	R86 Q97 Q98 H134	Y84-R86 PolarHBondContact O-N 2.87Å; Y84-Q97 WeakPolarHBondContact CD1-O 3.48Å; Y84-Q98 HydrophobicContact CD1-CB 4.37Å; Y84-Q98 HydrophobicContact CE1-CB 4.08Å; Y84-H134 PolarHBondContact O-CE1 3.13Å; Y84-H134 PolarHBondContact O-NE2 3.34Å
85	P	96.5	Very high	93.4	Very high	21 Å²	21	66.9 Å²	66.9	14%	0.136	37%	0.367	C	S	.	.			trans	-54.3	137.3	175.4	-26.2	35.3	0	0	0	111.7	F87 F89 V96 Q97 I99 L139	P85-F87 HydrophobicContact CB-CD2 4.4Å; P85-F87 HydrophobicContact CB-CE2 4.31Å; P85-F87 PolarHBondContact O-N 3.3Å; P85-F89 HydrophobicContact CB-CB 4.48Å; P85-V96 HydrophobicContact CG-CG1 4.39Å; P85-Q97 VanDerWaalsContact CD-O 3.3Å; P85-Q97 WeakPolarHBondContact CD-O 3.24Å; P85-I99 HydrophobicContact CG-CG1 4.14Å; P85-L139 HydrophobicContact CB-CD2 4.36Å; P85-L139 HydrophobicContact CG-CD2 3.99Å
86	R	96.2	Very high	93.8	Very high	161 Å²	161	64.5 Å²	64.5	61%	0.608	34%	0.341	S	S	*	.	S	Bend	trans	-84.4	14.2	178.7	-66.8	176.1	-176.5	-173.7	2.5	113.1	Y84 K136	Y84-R86 PolarHBondContact O-N 2.87Å; R86-K136 HydrophobicContact CB-CG 4.46Å
87	F	96.3	Very high	94.1	Very high	27 Å²	27	65 Å²	65	12%	0.118	34%	0.341	C	S	.	.	S	Bend	trans	-146	157.3	-179.2	49.6	-99.3	0	0	0	108.4	P85 F89 K136 L139 L162 P164	P85-F87 HydrophobicContact CB-CD2 4.4Å; P85-F87 HydrophobicContact CB-CE2 4.31Å; P85-F87 PolarHBondContact O-N 3.3Å; F87-F89 HydrophobicContact CD2-CB 4.03Å; F87-F89 HydrophobicContact CE2-CB 3.88Å; F87-F89 HydrophobicContact CE2-CD2 4.19Å; F87-F89 HydrophobicContact CE2-CG 4.26Å; F87-F89 PolarHBondContact O-N 3.01Å; F87-K136 WeakPolarHBondContact CD1-O 3.3Å; F87-L139 HydrophobicContact CE1-CB 4.02Å; F87-L139 HydrophobicContact CZ-CB 3.74Å; F87-L162 WeakPolarHBondContact CZ-O 3.34Å; F87-P164 HydrophobicContact CB-CB 4.12Å; F87-P164 HydrophobicContact CB-CG 4.08Å; F87-P164 HydrophobicContact CD1-CG 4.09Å; F87-P164 HydrophobicContact CD2-CB 4.02Å; F87-P164 HydrophobicContact CD2-CG 3.98Å; F87-P164 HydrophobicContact CE2-CG 4.39Å; F87-P164 HydrophobicContact CG-CB 4.11Å; F87-P164 HydrophobicContact CG-CG 3.8Å
88	S	94.1	Very high	94.6	Very high	81 Å²	81	67.2 Å²	67.2	57%	0.566	35%	0.351	S	S	*	.			trans	-66.9	122.7	172.6	-176.2	0	0	0	0	109.1
89	F	95.6	Very high	95.1	Very high	1 Å²	1	59.2 Å²	59.2	0%	0.004	31%	0.314	C	S	.	.			trans	-125.8	138.2	177.6	-177.7	-117.4	0	0	0	109.3	P85 F87 Y91 H95 V96 L162 H163 V168	P85-F89 HydrophobicContact CB-CB 4.48Å; F87-F89 HydrophobicContact CD2-CB 4.03Å; F87-F89 HydrophobicContact CE2-CB 3.88Å; F87-F89 HydrophobicContact CE2-CD2 4.19Å; F87-F89 HydrophobicContact CE2-CG 4.26Å; F87-F89 PolarHBondContact O-N 3.01Å; F89-Y91 HydrophobicContact CE1-CD2 4.39Å; F89-Y91 HydrophobicContact CZ-CD2 4.33Å; F89-H95 PolarHBondContact O-ND1 2.04Å; F89-V96 HydrophobicContact CB-CB 4.39Å; F89-V96 HydrophobicContact CD1-CB 3.67Å; F89-V96 HydrophobicContact CD1-CG1 4.04Å; F89-V96 HydrophobicContact CD1-CG2 3.46Å; F89-V96 VanDerWaalsContact CD1-CG2 3.46Å; F89-V96 HydrophobicContact CE1-CB 4.48Å; F89-V96 HydrophobicContact CE1-CG2 3.85Å; F89-V96 HydrophobicContact CG-CB 4.48Å; F89-V96 HydrophobicContact CG-CG2 4.44Å; F89-V96 PolarHBondContact O-N 3.5Å; F89-L162 HydrophobicContact CE1-CD1 4.23Å; F89-L162 HydrophobicContact CE1-CD2 4.41Å; F89-L162 HydrophobicContact CE2-CB 4.11Å; F89-L162 HydrophobicContact CZ-CB 4.11Å; F89-L162 HydrophobicContact CZ-CD1 4.46Å; F89-L162 HydrophobicContact CZ-CD2 3.94Å; F89-L162 HydrophobicContact CZ-CG 4.39Å; F89-H163 VanDerWaalsContact CD2-O 3.26Å; F89-H163 WeakPolarHBondContact CD2-O 3.33Å; F89-V168 HydrophobicContact CZ-CG2 4.07Å
90	S	94.9	Very high	95.4	Very high	57 Å²	57	54.5 Å²	54.5	40%	0.399	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.7	176.3	-62.5	0	0	0	0	109.9	K94	S90-K94 CarbonylContact C-O 3.51Å; S90-K94 WeakPolarHBondContact CA-O 3.06Å
91	Y	96.4	Very high	95.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	123.7	-179.8	-172.9	-95.9	0	0	0	109.2	F89 G93 K94 V109 I115 I117 I118 V168 V189	F89-Y91 HydrophobicContact CE1-CD2 4.39Å; F89-Y91 HydrophobicContact CZ-CD2 4.33Å; Y91-G93 PolarHBondContact O-N 3.42Å; Y91-K94 PolarHBondContact N-O 2.92Å; Y91-K94 PolarHBondContact O-N 3.33Å; Y91-V109 HydrophobicContact CD1-CB 4.33Å; Y91-V109 HydrophobicContact CD1-CG1 4.02Å; Y91-V109 HydrophobicContact CD1-CG2 4.46Å; Y91-V109 HydrophobicContact CE1-CG2 4.47Å; Y91-V109 HydrophobicContact CG-CG1 3.99Å; Y91-I115 HydrophobicContact CD1-CD1 4.46Å; Y91-I117 PolarHBondContact OH-O 3.46Å; Y91-I118 HydrophobicContact CD2-CD1 4.39Å; Y91-I118 HydrophobicContact CE2-CD1 3.83Å; Y91-I118 HydrophobicContact CE2-CG1 3.79Å; Y91-V168 HydrophobicContact CD2-CG2 4.33Å; Y91-V168 HydrophobicContact CE2-CG2 4.27Å; Y91-V189 WeakPolarHBondContact CE1-O 3.2Å; Y91-V189 PolarHBondContact OH-N 2.95Å; Y91-V189 VanDerWaalsContact OH-N 3.07Å; Y91-V189 PolarHBondContact OH-O 3.47Å
92	Y	93.9	Very high	95.5	Very high	21 Å²	21	48 Å²	48	8%	0.082	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	41.6	-174.8	-84.5	-102.6	0	0	0	113.3	Y56 K94 I188 H201	Y56-Y92 HydrophobicContact CD2-CD2 4.49Å; Y56-Y92 HydrophobicContact CD2-CE1 4.37Å; Y56-Y92 HydrophobicContact CD2-CE2 4.13Å; Y56-Y92 HydrophobicContact CE2-CD1 4.14Å; Y56-Y92 AromaticContact CE2-CD2 3.48Å; Y56-Y92 HydrophobicContact CE2-CD2 3.48Å; Y56-Y92 VanDerWaalsContact CE2-CD2 3.48Å; Y56-Y92 HydrophobicContact CE2-CE1 4.12Å; Y56-Y92 AromaticContact CE2-CE2 3.5Å; Y56-Y92 HydrophobicContact CE2-CE2 3.5Å; Y56-Y92 AromaticContact CE2-CG 3.83Å; Y56-Y92 HydrophobicContact CE2-CG 3.83Å; Y56-Y92 AromaticContact CE2-CZ 3.83Å; Y56-Y92 AromaticContact CZ-CD2 3.98Å; Y56-Y92 PolarHBondContact OH-N 3.01Å; Y92-K94 PolarHBondContact O-N 2.78Å; Y92-I188 HydrophobicContact CE2-CD1 4.19Å; Y92-I188 HydrophobicContact CE2-CG1 4.49Å; Y92-H201 HydrophobicContact CE1-CB 4.12Å; Y92-H201 AromaticContact CE1-ND1 3.38Å; Y92-H201 WeakPolarHBondContact CE1-ND1 3.27Å; Y92-H201 AromaticContact CZ-ND1 3.65Å; Y92-H201 PolarHBondContact OH-ND1 2.83Å; Y92-H201 PolarHBondContact OH-O 3.44Å
93	G	90.9	Very high	94.8	Very high	79 Å²	79	47.4 Å²	47.4	81%	0.814	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	1.5	179.1	0	0	0	0	0	115.3	Y91	Y91-G93 PolarHBondContact O-N 3.42Å
94	K	93.3	Very high	94.1	Very high	63 Å²	63	53.6 Å²	53.6	27%	0.274	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	148.9	179.7	-60.5	178.1	-175.3	169.4	0	111.4	S90 Y91 Y92 I115 T191	S90-K94 CarbonylContact C-O 3.51Å; S90-K94 WeakPolarHBondContact CA-O 3.06Å; Y91-K94 PolarHBondContact N-O 2.92Å; Y91-K94 PolarHBondContact O-N 3.33Å; Y92-K94 PolarHBondContact O-N 2.78Å; K94-I115 HydrophobicContact CB-CD1 3.73Å; K94-I115 HydrophobicContact CD-CB 3.94Å; K94-I115 HydrophobicContact CD-CD1 4.2Å; K94-I115 HydrophobicContact CD-CG2 3.58Å; K94-T191 PolarHBondContact NZ-O 3.27Å
95	H	95.7	Very high	93.3	Very high	90 Å²	90	49.3 Å²	49.3	42%	0.417	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	128.7	177.2	180	60	0	0	0	110.3	F89 E111	F89-H95 PolarHBondContact O-ND1 2.04Å; H95-E111 WeakPolarHBondContact O-CB 3.11Å; H95-E111 VanDerWaalsContact O-CG 3.32Å; H95-E111 WeakPolarHBondContact O-CG 3.48Å
96	V	97.4	Very high	93.1	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.024	26%	0.26	C	S	.	.			trans	-90.5	124.7	-179.7	179.4	0	0	0	0	109.8	P85 F89 I99 V109 I115	P85-V96 HydrophobicContact CG-CG1 4.39Å; F89-V96 HydrophobicContact CB-CB 4.39Å; F89-V96 HydrophobicContact CD1-CB 3.67Å; F89-V96 HydrophobicContact CD1-CG1 4.04Å; F89-V96 HydrophobicContact CD1-CG2 3.46Å; F89-V96 VanDerWaalsContact CD1-CG2 3.46Å; F89-V96 HydrophobicContact CE1-CB 4.48Å; F89-V96 HydrophobicContact CE1-CG2 3.85Å; F89-V96 HydrophobicContact CG-CB 4.48Å; F89-V96 HydrophobicContact CG-CG2 4.44Å; F89-V96 PolarHBondContact O-N 3.5Å; V96-I99 HydrophobicContact CG1-CD1 3.66Å; V96-I99 HydrophobicContact CG1-CG1 3.94Å; V96-V109 HydrophobicContact CB-CG1 4.37Å; V96-V109 HydrophobicContact CG1-CG1 3.87Å; V96-V109 HydrophobicContact CG2-CG1 3.55Å; V96-I115 HydrophobicContact CG2-CD1 4.2Å
97	Q	97.3	Very high	93.1	Very high	86 Å²	86	41.5 Å²	41.5	40%	0.402	23%	0.231	S	C	.	.			trans	-94	-44.5	173.1	-62.1	-175.8	19.2	0	0	110.6	Y84 P85 F110	Y84-Q97 WeakPolarHBondContact CD1-O 3.48Å; P85-Q97 VanDerWaalsContact CD-O 3.3Å; P85-Q97 WeakPolarHBondContact CD-O 3.24Å; Q97-F110 PolarHBondContact N-O 3.15Å
98	Q	97.6	Very high	93.1	Very high	55 Å²	55	42.3 Å²	42.3	26%	0.257	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	145.3	-172.7	177.8	177.5	-15.3	0	0	111.8	V83 Y84 D100 F110	V83-Q98 WeakPolarHBondContact O-CA 3.25Å; Y84-Q98 HydrophobicContact CD1-CB 4.37Å; Y84-Q98 HydrophobicContact CE1-CB 4.08Å; Q98-D100 WeakPolarHBondContact CG-OD1 3.17Å; Q98-D100 PolarHBondContact NE2-OD1 3.05Å; Q98-F110 HydrophobicContact CB-CB 4.16Å; Q98-F110 PolarHBondContact N-O 3.16Å; Q98-F110 VanDerWaalsContact N-O 3.16Å; Q98-F110 PolarHBondContact O-N 3.21Å
99	I	97.6	Very high	93.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.2	172.7	-63.7	-68.1	0	0	0	108.2	G82 V83 P85 V96 F101 V107 Y108 V109 L139 L162	G82-I99 WeakPolarHBondContact CA-O 3.28Å; V83-I99 HydrophobicContact CG2-CB 4.15Å; V83-I99 PolarHBondContact N-O 2.86Å; V83-I99 PolarHBondContact O-N 3.03Å; P85-I99 HydrophobicContact CG-CG1 4.14Å; V96-I99 HydrophobicContact CG1-CD1 3.66Å; V96-I99 HydrophobicContact CG1-CG1 3.94Å; I99-F101 HydrophobicContact CB-CE2 4.45Å; I99-F101 HydrophobicContact CG2-CD2 4.11Å; I99-F101 HydrophobicContact CG2-CE1 4.15Å; I99-F101 HydrophobicContact CG2-CE2 3.58Å; I99-F101 HydrophobicContact CG2-CZ 3.61Å; I99-V107 HydrophobicContact CG2-CG1 3.42Å; I99-V107 VanDerWaalsContact CG2-CG1 3.42Å; I99-Y108 WeakPolarHBondContact CA-O 3.47Å; I99-V109 HydrophobicContact CD1-CB 4.06Å; I99-V109 HydrophobicContact CD1-CG1 3.76Å; I99-V109 HydrophobicContact CD1-CG2 3.8Å; I99-L139 HydrophobicContact CB-CD2 4.17Å; I99-L139 HydrophobicContact CG1-CD2 3.97Å; I99-L139 HydrophobicContact CG2-CD2 4.46Å; I99-L162 HydrophobicContact CD1-CD1 3.9Å; I99-L162 HydrophobicContact CG1-CD1 3.98Å; I99-L162 HydrophobicContact CG2-CD1 4.33Å
100	D	96.6	Very high	93.4	Very high	22 Å²	22	40.6 Å²	40.6	12%	0.118	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.4	174.4	-66.7	-10	0	0	0	110.3	I80 G82 Q98 V107 Y108 F110	I80-D100 HydrophobicContact CG2-CB 3.98Å; G82-D100 WeakPolarHBondContact CA-OD1 3.4Å; Q98-D100 WeakPolarHBondContact CG-OD1 3.17Å; Q98-D100 PolarHBondContact NE2-OD1 3.05Å; D100-V107 CarbonylContact O-C 3.52Å; D100-V107 WeakPolarHBondContact O-CA 3.33Å; D100-Y108 PolarHBondContact N-O 3.36Å; D100-Y108 PolarHBondContact O-N 2.86Å; D100-F110 HydrophobicContact CB-CE2 3.98Å; D100-F110 VanDerWaalsContact OD2-CE2 3.31Å; D100-F110 WeakPolarHBondContact OD2-CE2 3.28Å
101	F	95.4	Very high	93.4	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115.6	171.5	-62.7	-81.3	0	0	0	109.4	V77 Y81 V83 I99 V107 V132 L139 V141	V77-F101 HydrophobicContact CG1-CB 4.43Å; V77-F101 WeakPolarHBondContact CG1-O 3.3Å; V77-F101 HydrophobicContact CG2-CB 4.3Å; Y81-F101 AromaticContact CD1-CD2 3.97Å; Y81-F101 HydrophobicContact CD1-CD2 3.97Å; Y81-F101 PolarHBondContact N-O 3.3Å; Y81-F101 PolarHBondContact O-N 2.84Å; V83-F101 HydrophobicContact CG2-CD2 4.23Å; V83-F101 HydrophobicContact CG2-CE2 3.71Å; I99-F101 HydrophobicContact CB-CE2 4.45Å; I99-F101 HydrophobicContact CG2-CD2 4.11Å; I99-F101 HydrophobicContact CG2-CE1 4.15Å; I99-F101 HydrophobicContact CG2-CE2 3.58Å; I99-F101 HydrophobicContact CG2-CZ 3.61Å; F101-V107 HydrophobicContact CD1-CB 4.33Å; F101-V107 HydrophobicContact CD1-CG1 3.91Å; F101-V107 HydrophobicContact CD1-CG2 3.53Å; F101-V107 HydrophobicContact CE1-CB 4.49Å; F101-V107 HydrophobicContact CE1-CG1 3.8Å; F101-V107 HydrophobicContact CE1-CG2 3.85Å; F101-V107 HydrophobicContact CZ-CG1 4.44Å; F101-V132 HydrophobicContact CD2-CG1 4.45Å; F101-V132 HydrophobicContact CG-CG1 4.48Å; F101-L139 HydrophobicContact CE2-CD1 3.82Å; F101-L139 HydrophobicContact CE2-CD2 4.42Å; F101-L139 HydrophobicContact CE2-CG 4.19Å; F101-L139 HydrophobicContact CZ-CD1 3.95Å; F101-L139 HydrophobicContact CZ-CD2 4.37Å; F101-L139 HydrophobicContact CZ-CG 3.93Å; F101-V141 HydrophobicContact CD1-CB 3.6Å; F101-V141 HydrophobicContact CD1-CG1 3.56Å; F101-V141 HydrophobicContact CD1-CG2 4.41Å; F101-V141 HydrophobicContact CE1-CB 3.81Å; F101-V141 HydrophobicContact CE1-CG1 3.74Å; F101-V141 HydrophobicContact CG-CB 4.43Å
102	H	91.7	Very high	93.1	Very high	41 Å²	41	49.7 Å²	49.7	19%	0.19	25%	0.253	C	S	.	.			trans	-84.6	140.9	167.4	-74.1	-127	0	0	0	110.1	K104 D105 N106 Y108 R143	H102-K104 PolarHBondContact O-N 2.79Å; H102-D105 HydrophobicContact CB-CB 3.77Å; H102-N106 WeakPolarHBondContact CB-O 3.45Å; H102-N106 PolarHBondContact N-O 3.38Å; H102-Y108 AromaticContact CD2-CD2 3.31Å; H102-Y108 WeakPolarHBondContact CD2-CD2 3.49Å; H102-Y108 AromaticContact CD2-CE2 3.43Å; H102-Y108 VanDerWaalsContact CD2-CE2 3.43Å; H102-Y108 WeakPolarHBondContact CD2-CE2 3.45Å; H102-Y108 AromaticContact CE1-CE2 3.74Å; H102-Y108 AromaticContact CG-CE2 3.78Å; H102-Y108 AromaticContact ND1-CE2 3.96Å; H102-Y108 AromaticContact NE2-CD2 3.38Å; H102-Y108 WeakPolarHBondContact NE2-CD2 3.38Å; H102-Y108 AromaticContact NE2-CE2 3.41Å; H102-Y108 WeakPolarHBondContact NE2-CE2 3.45Å; H102-R143 PolarHBondContact O-NH2 3.37Å
103	P	80.6	Confident	93.1	Very high	26 Å²	26	52.4 Å²	52.4	17%	0.169	28%	0.275	C	S	.	.	S	Bend	trans	-62.4	-42.1	-175.1	23	-34	0	0	0	112.5	V77 N127 S130	V77-P103 HydrophobicContact CG1-CB 4.07Å; V77-P103 VanDerWaalsContact O-CB 3.3Å; V77-P103 WeakPolarHBondContact O-CB 3.32Å; P103-N127 PolarHBondContact O-OD1 3.32Å; P103-S130 PolarHBondContact O-OG 3.01Å
104	K	81.3	Confident	93.3	Very high	138 Å²	138	52.5 Å²	52.5	60%	0.6	25%	0.254	S	S	*	.	S	Bend	trans	-117.3	8.5	-173	-58.2	-170.1	175.6	-171	0	113.8	H102 N127	H102-K104 PolarHBondContact O-N 2.79Å; K104-N127 HydrophobicContact CG-CB 4.37Å
105	D	80.2	Confident	93.5	Very high	61 Å²	61	49.6 Å²	49.6	33%	0.326	24%	0.242	S	C	.	.	S	Bend	trans	-142.2	-156.9	-166.5	-159	-8.1	0	0	0	110.5	H102 R143	H102-D105 HydrophobicContact CB-CB 3.77Å; D105-R143 PolarHBondContact O-NH1 2.79Å; D105-R143 PolarHBondContact O-NH2 3.05Å
106	N	92.8	Very high	93.5	Very high	18 Å²	18	45.3 Å²	45.3	10%	0.096	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-70.2	169.4	-173.8	-55.4	-50.2	0	0	0	113.8	H102 Y108 I117 I119	H102-N106 WeakPolarHBondContact CB-O 3.45Å; H102-N106 PolarHBondContact N-O 3.38Å; N106-Y108 HydrophobicContact CB-CD2 4.48Å; N106-Y108 HydrophobicContact CB-CE2 3.99Å; N106-I117 HydrophobicContact CB-CG2 3.4Å; N106-I119 HydrophobicContact CB-CG1 4.47Å; N106-I119 WeakPolarHBondContact OD1-CD1 3.44Å; N106-I119 VanDerWaalsContact OD1-CG1 3.22Å; N106-I119 WeakPolarHBondContact OD1-CG1 3.41Å; N106-I119 WeakPolarHBondContact OD1-CG2 3.33Å
107	V	95.9	Very high	93.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122	164.8	179.9	0	0	0	0	107.4	I99 D100 F101 I117 I118 V141	I99-V107 HydrophobicContact CG2-CG1 3.42Å; I99-V107 VanDerWaalsContact CG2-CG1 3.42Å; D100-V107 CarbonylContact O-C 3.52Å; D100-V107 WeakPolarHBondContact O-CA 3.33Å; F101-V107 HydrophobicContact CD1-CB 4.33Å; F101-V107 HydrophobicContact CD1-CG1 3.91Å; F101-V107 HydrophobicContact CD1-CG2 3.53Å; F101-V107 HydrophobicContact CE1-CB 4.49Å; F101-V107 HydrophobicContact CE1-CG1 3.8Å; F101-V107 HydrophobicContact CE1-CG2 3.85Å; F101-V107 HydrophobicContact CZ-CG1 4.44Å; V107-I117 CarbonylContact O-C 3.57Å; V107-I117 WeakPolarHBondContact O-CA 3.47Å; V107-I118 HydrophobicContact CB-CB 4.12Å; V107-I118 PolarHBondContact N-O 3.47Å; V107-I118 PolarHBondContact O-N 3.16Å; V107-V141 HydrophobicContact CG2-CG1 4.15Å
108	Y	96.9	Very high	93.6	Very high	45 Å²	45	42.7 Å²	42.7	18%	0.176	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.3	-179.1	-64.6	-95.9	0	0	0	109.9	I99 D100 H102 N106 F110 I117	I99-Y108 WeakPolarHBondContact CA-O 3.47Å; D100-Y108 PolarHBondContact N-O 3.36Å; D100-Y108 PolarHBondContact O-N 2.86Å; H102-Y108 AromaticContact CD2-CD2 3.31Å; H102-Y108 WeakPolarHBondContact CD2-CD2 3.49Å; H102-Y108 AromaticContact CD2-CE2 3.43Å; H102-Y108 VanDerWaalsContact CD2-CE2 3.43Å; H102-Y108 WeakPolarHBondContact CD2-CE2 3.45Å; H102-Y108 AromaticContact CE1-CE2 3.74Å; H102-Y108 AromaticContact CG-CE2 3.78Å; H102-Y108 AromaticContact ND1-CE2 3.96Å; H102-Y108 AromaticContact NE2-CD2 3.38Å; H102-Y108 WeakPolarHBondContact NE2-CD2 3.38Å; H102-Y108 AromaticContact NE2-CE2 3.41Å; H102-Y108 WeakPolarHBondContact NE2-CE2 3.45Å; N106-Y108 HydrophobicContact CB-CD2 4.48Å; N106-Y108 HydrophobicContact CB-CE2 3.99Å; Y108-F110 VanDerWaalsContact CB-CE2 3.4Å; Y108-I117 HydrophobicContact CD1-CD1 4.46Å; Y108-I117 HydrophobicContact CD1-CG1 4.12Å; Y108-I117 HydrophobicContact CE1-CD1 4.13Å; Y108-I117 HydrophobicContact CE1-CG1 4.26Å
109	V	97.2	Very high	93.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.3	-173.6	-173.6	0	0	0	0	109.4	Y91 V96 I99 I115 G116 I118	Y91-V109 HydrophobicContact CD1-CB 4.33Å; Y91-V109 HydrophobicContact CD1-CG1 4.02Å; Y91-V109 HydrophobicContact CD1-CG2 4.46Å; Y91-V109 HydrophobicContact CE1-CG2 4.47Å; Y91-V109 HydrophobicContact CG-CG1 3.99Å; V96-V109 HydrophobicContact CB-CG1 4.37Å; V96-V109 HydrophobicContact CG1-CG1 3.87Å; V96-V109 HydrophobicContact CG2-CG1 3.55Å; I99-V109 HydrophobicContact CD1-CB 4.06Å; I99-V109 HydrophobicContact CD1-CG1 3.76Å; I99-V109 HydrophobicContact CD1-CG2 3.8Å; V109-I115 HydrophobicContact CB-CG1 4.27Å; V109-I115 HydrophobicContact CG1-CD1 4Å; V109-I115 HydrophobicContact CG1-CG1 3.88Å; V109-I115 WeakPolarHBondContact O-CG1 3.41Å; V109-I115 PolarHBondContact O-N 3.29Å; V109-G116 PolarHBondContact N-O 3.12Å; V109-G116 PolarHBondContact O-N 2.98Å; V109-I118 HydrophobicContact CG2-CD1 3.94Å; V109-I118 HydrophobicContact CG2-CG1 4.07Å
110	F	97.2	Very high	93.5	Very high	45 Å²	45	40.9 Å²	40.9	20%	0.197	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.9	-174	-59.2	-95	0	0	0	112.5	Q97 Q98 D100 Y108 S113 Q114	Q97-F110 PolarHBondContact N-O 3.15Å; Q98-F110 HydrophobicContact CB-CB 4.16Å; Q98-F110 PolarHBondContact N-O 3.16Å; Q98-F110 VanDerWaalsContact N-O 3.16Å; Q98-F110 PolarHBondContact O-N 3.21Å; D100-F110 HydrophobicContact CB-CE2 3.98Å; D100-F110 VanDerWaalsContact OD2-CE2 3.31Å; D100-F110 WeakPolarHBondContact OD2-CE2 3.28Å; Y108-F110 VanDerWaalsContact CB-CE2 3.4Å; F110-S113 WeakPolarHBondContact CA-O 3.12Å; F110-Q114 HydrophobicContact CD1-CB 3.9Å; F110-Q114 HydrophobicContact CE1-CB 3.65Å; F110-Q114 HydrophobicContact CE1-CG 4.14Å; F110-Q114 HydrophobicContact CZ-CB 4.43Å; F110-Q114 HydrophobicContact CZ-CG 4.46Å
111	E	94.6	Very high	93.3	Very high	69 Å²	69	41.9 Å²	41.9	32%	0.322	21%	0.205	S	C	.	.	S	Bend	trans	-96.6	-107.3	156.7	-177.2	177.6	-137.6	0	0	106.7	H95 S113 I115	H95-E111 WeakPolarHBondContact O-CB 3.11Å; H95-E111 VanDerWaalsContact O-CG 3.32Å; H95-E111 WeakPolarHBondContact O-CG 3.48Å; E111-S113 PolarHBondContact N-O 2.88Å; E111-I115 HydrophobicContact CB-CD1 4.42Å; E111-I115 HydrophobicContact CB-CG2 3.89Å
112	E	91.9	Very high	93.2	Very high	179 Å²	179	42 Å²	42	84%	0.836	21%	0.205	S	C	*	.	S	Bend	trans	-84.6	-27.7	165.3	-63.9	-178.6	173.1	0	0	112
113	S	93.6	Very high	93.2	Very high	79 Å²	79	44.9 Å²	44.9	55%	0.552	22%	0.217	S	C	*	.	S	Bend	trans	-129.4	172	173.2	69.9	0	0	0	0	109.4	F110 E111 I115	F110-S113 WeakPolarHBondContact CA-O 3.12Å; E111-S113 PolarHBondContact N-O 2.88Å; S113-I115 WeakPolarHBondContact O-CG2 3.43Å; S113-I115 PolarHBondContact O-N 3.04Å
114	Q	95.4	Very high	93.6	Very high	80 Å²	80	49.6 Å²	49.6	37%	0.374	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	126.7	172.1	-169.8	-176.6	-35.3	0	0	109.8	F110 I117	F110-Q114 HydrophobicContact CD1-CB 3.9Å; F110-Q114 HydrophobicContact CE1-CB 3.65Å; F110-Q114 HydrophobicContact CE1-CG 4.14Å; F110-Q114 HydrophobicContact CZ-CB 4.43Å; F110-Q114 HydrophobicContact CZ-CG 4.46Å; Q114-I117 VanDerWaalsContact NE2-CG1 3.29Å
115	I	96	Very high	94	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-10	179.2	59.7	163.1	0	0	0	112.7	Y91 K94 V96 V109 E111 S113 T191	Y91-I115 HydrophobicContact CD1-CD1 4.46Å; K94-I115 HydrophobicContact CB-CD1 3.73Å; K94-I115 HydrophobicContact CD-CB 3.94Å; K94-I115 HydrophobicContact CD-CD1 4.2Å; K94-I115 HydrophobicContact CD-CG2 3.58Å; V96-I115 HydrophobicContact CG2-CD1 4.2Å; V109-I115 HydrophobicContact CB-CG1 4.27Å; V109-I115 HydrophobicContact CG1-CD1 4Å; V109-I115 HydrophobicContact CG1-CG1 3.88Å; V109-I115 WeakPolarHBondContact O-CG1 3.41Å; V109-I115 PolarHBondContact O-N 3.29Å; E111-I115 HydrophobicContact CB-CD1 4.42Å; E111-I115 HydrophobicContact CB-CG2 3.89Å; S113-I115 WeakPolarHBondContact O-CG2 3.43Å; S113-I115 PolarHBondContact O-N 3.04Å; I115-T191 PolarHBondContact O-N 3.24Å
116	G	97	Very high	94.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	175.4	-179.8	0	0	0	0	0	114.8	V109 V189	V109-G116 PolarHBondContact N-O 3.12Å; V109-G116 PolarHBondContact O-N 2.98Å; G116-V189 CarbonylContact C-O 3.52Å; G116-V189 WeakPolarHBondContact CA-O 3.3Å
117	I	97.6	Very high	94.2	Very high	36 Å²	36	49.5 Å²	49.5	19%	0.185	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	132.5	-178.1	-51.3	178.3	0	0	0	108	Y91 N106 V107 Y108 Q114 I119 V189	Y91-I117 PolarHBondContact OH-O 3.46Å; N106-I117 HydrophobicContact CB-CG2 3.4Å; V107-I117 CarbonylContact O-C 3.57Å; V107-I117 WeakPolarHBondContact O-CA 3.47Å; Y108-I117 HydrophobicContact CD1-CD1 4.46Å; Y108-I117 HydrophobicContact CD1-CG1 4.12Å; Y108-I117 HydrophobicContact CE1-CD1 4.13Å; Y108-I117 HydrophobicContact CE1-CG1 4.26Å; Q114-I117 VanDerWaalsContact NE2-CG1 3.29Å; I117-I119 HydrophobicContact CG2-CD1 4.05Å; I117-I119 HydrophobicContact CG2-CG1 3.77Å; I117-V189 HydrophobicContact CB-CB 4.4Å; I117-V189 PolarHBondContact N-O 3.37Å; I117-V189 PolarHBondContact O-N 2.83Å
118	I	98.2	Very high	93.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120	171.9	-59.6	171.7	0	0	0	107.5	Y91 V107 V109 T160 L162 V168 F170 I188	Y91-I118 HydrophobicContact CD2-CD1 4.39Å; Y91-I118 HydrophobicContact CE2-CD1 3.83Å; Y91-I118 HydrophobicContact CE2-CG1 3.79Å; V107-I118 HydrophobicContact CB-CB 4.12Å; V107-I118 PolarHBondContact N-O 3.47Å; V107-I118 PolarHBondContact O-N 3.16Å; V109-I118 HydrophobicContact CG2-CD1 3.94Å; V109-I118 HydrophobicContact CG2-CG1 4.07Å; I118-T160 HydrophobicContact CG2-CG2 3.77Å; I118-L162 HydrophobicContact CD1-CD2 3.57Å; I118-V168 HydrophobicContact CD1-CG1 4.2Å; I118-V168 HydrophobicContact CD1-CG2 4.31Å; I118-V168 HydrophobicContact CG2-CG1 4.35Å; I118-F170 HydrophobicContact CG2-CE1 3.48Å; I118-F170 VanDerWaalsContact CG2-CE1 3.48Å; I118-F170 HydrophobicContact CG2-CZ 3.67Å; I118-I188 HydrophobicContact CG1-CG2 4.36Å; I118-I188 HydrophobicContact CG2-CG2 4.34Å
119	I	97.2	Very high	93.6	Very high	15 Å²	15	55.2 Å²	55.2	8%	0.077	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.6	-173.5	-51.7	-152.2	0	0	0	107.6	N106 I117 Y121 E185 S186 K187	N106-I119 HydrophobicContact CB-CG1 4.47Å; N106-I119 WeakPolarHBondContact OD1-CD1 3.44Å; N106-I119 VanDerWaalsContact OD1-CG1 3.22Å; N106-I119 WeakPolarHBondContact OD1-CG1 3.41Å; N106-I119 WeakPolarHBondContact OD1-CG2 3.33Å; I117-I119 HydrophobicContact CG2-CD1 4.05Å; I117-I119 HydrophobicContact CG2-CG1 3.77Å; I119-Y121 HydrophobicContact CG2-CD1 3.52Å; I119-Y121 HydrophobicContact CG2-CE1 3.4Å; I119-E185 HydrophobicContact CG2-CB 4.44Å; I119-E185 HydrophobicContact CG2-CG 3.91Å; I119-S186 CarbonylContact O-C 3.59Å; I119-S186 WeakPolarHBondContact O-CA 3.31Å; I119-K187 HydrophobicContact CB-CG 3.76Å; I119-K187 HydrophobicContact CD1-CG 4.27Å; I119-K187 HydrophobicContact CG1-CG 4.01Å; I119-K187 HydrophobicContact CG2-CG 4.4Å; I119-K187 PolarHBondContact N-O 2.92Å; I119-K187 PolarHBondContact O-N 2.88Å
120	N	96.5	Very high	93.5	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.011	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	86.7	177.7	-171.6	10	0	0	0	108.8	R143 M158 I159 T160 F170 Y172 E185 S186	N120-R143 PolarHBondContact O-NH1 2.92Å; N120-M158 WeakPolarHBondContact OD1-CE 3.39Å; N120-I159 PolarHBondContact ND2-O 2.8Å; N120-I159 VanDerWaalsContact ND2-O 3.11Å; N120-T160 VanDerWaalsContact CB-OG1 3.32Å; N120-T160 WeakPolarHBondContact CB-OG1 3.44Å; N120-T160 PolarHBondContact ND2-OG1 2.89Å; N120-F170 HydrophobicContact CB-CD1 4.21Å; N120-F170 HydrophobicContact CB-CE1 4.11Å; N120-F170 HydrophobicContact CB-CZ 4.39Å; N120-F170 WeakPolarHBondContact ND2-CD1 3.23Å; N120-Y172 WeakPolarHBondContact OD1-CE1 3.41Å; N120-E185 WeakPolarHBondContact CA-O 3.2Å; N120-S186 PolarHBondContact OD1-OG 3.02Å; N120-S186 VanDerWaalsContact OD1-OG 3.04Å
121	Y	92.5	Very high	93.5	Very high	43 Å²	43	54 Å²	54	17%	0.169	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	166.2	-175.7	77.7	-77.6	0	0	0	112.6	I119 K123 M158 E185	I119-Y121 HydrophobicContact CG2-CD1 3.52Å; I119-Y121 HydrophobicContact CG2-CE1 3.4Å; Y121-K123 HydrophobicContact CE2-CB 3.9Å; Y121-K123 HydrophobicContact CE2-CG 4.49Å; Y121-M158 VanDerWaalsContact C-SD 3.53Å; Y121-E185 HydrophobicContact CD1-CB 4.5Å; Y121-E185 HydrophobicContact CE1-CB 4.01Å; Y121-E185 HydrophobicContact CE1-CG 4.38Å; Y121-E185 WeakPolarHBondContact CE1-OE2 3.09Å; Y121-E185 PolarHBondContact N-O 3.32Å; Y121-E185 PolarHBondContact O-N 3.21Å; Y121-E185 VanDerWaalsContact O-N 3.17Å; Y121-E185 PolarHBondContact OH-OE2 3.18Å
122	M	92.7	Very high	93.5	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.015	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.9	173.3	-56.4	-175	60.5	0	0	110.2	Y125 F145 I147 A156 M158 I175 I179 K183 L184	M122-Y125 HydrophobicContact CB-CD2 3.73Å; M122-Y125 HydrophobicContact CB-CG 4.27Å; M122-Y125 HydrophobicContact CE-CD2 4.01Å; M122-Y125 HydrophobicContact CE-CE2 4.09Å; M122-Y125 HydrophobicContact CE-CG 4.48Å; M122-F145 HydrophobicContact CB-CD1 4.02Å; M122-F145 HydrophobicContact CB-CD2 4.32Å; M122-F145 HydrophobicContact CB-CE1 4.21Å; M122-F145 HydrophobicContact CB-CG 4.07Å; M122-F145 HydrophobicContact CB-CZ 4.46Å; M122-F145 HydrophobicContact CG-CD1 4.44Å; M122-F145 HydrophobicContact CG-CD2 3.85Å; M122-F145 HydrophobicContact CG-CE2 4.08Å; M122-F145 HydrophobicContact CG-CG 4.06Å; M122-F145 HydrophobicContact CG-CZ 4.47Å; M122-F145 HydrophobicContact SD-CB 3.97Å; M122-F145 HydrophobicContact SD-CD2 3.85Å; M122-F145 HydrophobicContact SD-CG 3.98Å; M122-I147 HydrophobicContact CE-CD1 3.33Å; M122-I147 HydrophobicContact SD-CD1 3.93Å; M122-A156 HydrophobicContact CE-CB 4.43Å; M122-A156 HydrophobicContact SD-CB 3.64Å; M122-M158 HydrophobicContact CG-CG 4.45Å; M122-M158 HydrophobicContact CG-SD 3.51Å; M122-M158 VanDerWaalsContact CG-SD 3.51Å; M122-M158 HydrophobicContact SD-SD 4.46Å; M122-I175 HydrophobicContact SD-CD1 4.41Å; M122-I179 HydrophobicContact CE-CD1 3.39Å; M122-I179 HydrophobicContact CE-CG2 4.36Å; M122-K183 CarbonylContact C-O 3.59Å; M122-K183 WeakPolarHBondContact CA-O 3.38Å; M122-L184 HydrophobicContact CE-CD2 3.63Å; M122-L184 HydrophobicContact CG-CD2 3.98Å; M122-L184 HydrophobicContact SD-CD2 4.24Å
123	K	91.5	Very high	93.7	Very high	102 Å²	102	42.9 Å²	42.9	44%	0.443	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	138.1	-178.1	-176.4	174	-178.4	177.1	0	111.3	Y121 Y125 K183	Y121-K123 HydrophobicContact CE2-CB 3.9Å; Y121-K123 HydrophobicContact CE2-CG 4.49Å; K123-Y125 WeakPolarHBondContact O-CD2 3.43Å; K123-Y125 PolarHBondContact O-N 3.47Å; K123-K183 PolarHBondContact N-O 2.87Å
124	N	89.2	Confident	93.9	Very high	124 Å²	124	41.1 Å²	41.1	66%	0.663	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	15.1	-177.9	-56	-4.4	0	0	0	115	K183	N124-K183 PolarHBondContact ND2-NZ 3.01Å
125	Y	90.1	Very high	93.8	Very high	72 Å²	72	39 Å²	39	28%	0.282	19%	0.191	S	C	.	.	S	Bend	trans	-111.3	142.3	172.7	-66.2	-80.6	0	0	0	110.1	M122 K123 N127 I147 I179 K183	M122-Y125 HydrophobicContact CB-CD2 3.73Å; M122-Y125 HydrophobicContact CB-CG 4.27Å; M122-Y125 HydrophobicContact CE-CD2 4.01Å; M122-Y125 HydrophobicContact CE-CE2 4.09Å; M122-Y125 HydrophobicContact CE-CG 4.48Å; K123-Y125 WeakPolarHBondContact O-CD2 3.43Å; K123-Y125 PolarHBondContact O-N 3.47Å; Y125-N127 PolarHBondContact O-N 3.03Å; Y125-I147 HydrophobicContact CD1-CB 4.43Å; Y125-I147 HydrophobicContact CD1-CD1 4.4Å; Y125-I147 HydrophobicContact CD1-CG1 3.88Å; Y125-I147 HydrophobicContact CD1-CG2 4.28Å; Y125-I147 HydrophobicContact CE1-CB 4.39Å; Y125-I147 HydrophobicContact CE1-CD1 4.47Å; Y125-I147 HydrophobicContact CE1-CG1 4.17Å; Y125-I147 HydrophobicContact CE1-CG2 3.75Å; Y125-I179 HydrophobicContact CE2-CG2 4.42Å; Y125-K183 HydrophobicContact CE2-CB 4Å; Y125-K183 HydrophobicContact CE2-CG 4.28Å
126	E	86.7	Confident	93.7	Very high	126 Å²	126	47 Å²	47	59%	0.589	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	123.6	177.8	-177.1	164.8	-158.8	0	0	110.2	F145 L146	E126-F145 WeakPolarHBondContact O-CA 3.31Å; E126-L146 PolarHBondContact O-N 3.4Å
127	N	89.4	Confident	93.6	Very high	17 Å²	17	53.1 Å²	53.1	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	120.9	166.4	-179.4	-82.3	0	0	0	109	P103 K104 Y125 E129 S130 R143 N144 F145	P103-N127 PolarHBondContact O-OD1 3.32Å; K104-N127 HydrophobicContact CG-CB 4.37Å; Y125-N127 PolarHBondContact O-N 3.03Å; N127-E129 PolarHBondContact OD1-O 3.03Å; N127-S130 PolarHBondContact ND2-OG 2.79Å; N127-S130 VanDerWaalsContact ND2-OG 3.14Å; N127-S130 PolarHBondContact OD1-OG 2.88Å; N127-R143 WeakPolarHBondContact ND2-CB 3.45Å; N127-N144 CarbonylContact C-O 3.52Å; N127-N144 WeakPolarHBondContact CA-O 3.41Å; N127-F145 HydrophobicContact CB-CD1 4.26Å; N127-F145 HydrophobicContact CB-CE1 4.05Å
128	T	89.5	Confident	93.5	Very high	62 Å²	62	51.8 Å²	51.8	38%	0.38	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-43.6	-179.9	53	0	0	0	0	111.9	N144 L146	T128-N144 PolarHBondContact N-O 3.47Å; T128-N144 WeakPolarHBondContact OG1-CB 3.34Å; T128-N144 PolarHBondContact OG1-O 3.22Å; T128-L146 HydrophobicContact CG2-CB 3.79Å
129	E	92.3	Very high	93.5	Very high	103 Å²	103	51.8 Å²	51.8	48%	0.481	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	142.3	-178.3	-60.2	-178.5	162.7	0	0	110.9	N127 R143 N144	N127-E129 PolarHBondContact OD1-O 3.03Å; E129-R143 WeakPolarHBondContact O-CA 3.43Å; E129-N144 HydrophobicContact CB-CB 4.34Å; E129-N144 PolarHBondContact O-N 3.15Å; E129-N144 PolarHBondContact OE2-ND2 3.33Å; E129-N144 VanDerWaalsContact OE2-ND2 3.15Å
130	S	95	Very high	93.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.243	C	C	.	.			trans	-132.7	60.4	177	-72.4	0	0	0	0	112.2	N76 V77 P103 N127 K142	N76-S130 WeakPolarHBondContact OD1-CA 3.19Å; N76-S130 PolarHBondContact OD1-N 3.17Å; V77-S130 WeakPolarHBondContact CG2-O 3.38Å; V77-S130 PolarHBondContact N-O 2.9Å; V77-S130 VanDerWaalsContact N-O 3.09Å; P103-S130 PolarHBondContact O-OG 3.01Å; N127-S130 PolarHBondContact ND2-OG 2.79Å; N127-S130 VanDerWaalsContact ND2-OG 3.14Å; N127-S130 PolarHBondContact OD1-OG 2.88Å; S130-K142 CarbonylContact C-O 3.59Å; S130-K142 WeakPolarHBondContact CA-O 3.43Å
131	P	95.6	Very high	93.5	Very high	20 Å²	20	51 Å²	51	13%	0.13	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	147.3	179.8	30.9	-38.7	0	0	0	112.8	F73 G75 K142	F73-P131 HydrophobicContact CB-CB 3.93Å; F73-P131 HydrophobicContact CB-CG 4.06Å; G75-P131 VanDerWaalsContact O-CA 3.28Å; G75-P131 WeakPolarHBondContact O-CA 3.33Å; P131-K142 WeakPolarHBondContact CD-O 3.29Å; P131-K142 HydrophobicContact CG-CB 4.22Å; P131-K142 HydrophobicContact CG-CG 4.39Å; P131-K142 PolarHBondContact O-N 3.4Å
132	V	96.2	Very high	93.6	Very high	12 Å²	12	50.4 Å²	50.4	7%	0.073	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	152.5	-175.1	-68.3	0	0	0	0	113.3	F73 K74 G75 V77 Y81 F101 G140 V141	F73-V132 CarbonylContact C-O 3.48Å; F73-V132 WeakPolarHBondContact CA-O 3.41Å; K74-V132 PolarHBondContact N-O 3.48Å; K74-V132 VanDerWaalsContact O-CG2 3.29Å; K74-V132 WeakPolarHBondContact O-CG2 3.07Å; K74-V132 PolarHBondContact O-N 3.39Å; G75-V132 PolarHBondContact O-N 2.91Å; V77-V132 HydrophobicContact CG2-CG1 3.46Å; V77-V132 VanDerWaalsContact CG2-CG1 3.46Å; Y81-V132 HydrophobicContact CD1-CG1 4.17Å; Y81-V132 HydrophobicContact CD1-CG2 4.34Å; Y81-V132 HydrophobicContact CE1-CB 4.4Å; Y81-V132 HydrophobicContact CE1-CG1 4.34Å; Y81-V132 HydrophobicContact CE1-CG2 3.79Å; F101-V132 HydrophobicContact CD2-CG1 4.45Å; F101-V132 HydrophobicContact CG-CG1 4.48Å; V132-G140 CarbonylContact C-O 3.55Å; V132-G140 VanDerWaalsContact CA-O 3.28Å; V132-G140 WeakPolarHBondContact CA-O 3.29Å; V132-V141 HydrophobicContact CG1-CB 4.22Å; V132-V141 HydrophobicContact CG1-CG2 4.16Å
133	V	96.2	Very high	93.7	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.9	165.7	60.3	0	0	0	0	107.7	R72 F73 L138 L139 G140 L161	R72-V133 HydrophobicContact CB-CG2 4.14Å; F73-V133 HydrophobicContact CD1-CB 3.97Å; F73-V133 HydrophobicContact CD1-CG1 3.97Å; F73-V133 HydrophobicContact CE1-CB 4.07Å; F73-V133 HydrophobicContact CE1-CG1 3.56Å; F73-V133 HydrophobicContact CG-CB 4.47Å; F73-V133 HydrophobicContact CZ-CG1 4.1Å; V133-L138 HydrophobicContact CG1-CD2 4.03Å; V133-L138 HydrophobicContact CG1-CG 4.33Å; V133-L139 CarbonylContact O-C 3.44Å; V133-L139 VanDerWaalsContact O-CA 3.27Å; V133-L139 WeakPolarHBondContact O-CA 3.37Å; V133-L139 WeakPolarHBondContact O-CD1 3.34Å; V133-G140 PolarHBondContact N-O 3.25Å; V133-G140 PolarHBondContact O-N 2.9Å; V133-L161 HydrophobicContact CG1-CD2 4.21Å
134	H	96.2	Very high	93.9	Very high	42 Å²	42	46.1 Å²	46.1	19%	0.194	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	99.3	179.9	178.3	-149.9	0	0	0	110.6	Y84 L139	Y84-H134 PolarHBondContact O-CE1 3.13Å; Y84-H134 PolarHBondContact O-NE2 3.34Å; H134-L139 HydrophobicContact CB-CD1 3.9Å
135	D	94.3	Very high	94.1	Very high	37 Å²	37	40.5 Å²	40.5	20%	0.198	19%	0.193	C	C	.	.	S	Bend	trans	-144.4	-167.5	176.9	59.6	58.8	0	0	0	111.2	R72 E137 L138	R72-D135 IonicContact CZ-OD2 3.68Å; R72-D135 IonicContact NE-OD2 2.67Å; R72-D135 IonicContact NH2-OD1 3.94Å; R72-D135 PolarHBondContact NH2-OD1 3.18Å; R72-D135 IonicContact NH2-OD2 3.21Å; R72-D135 PolarHBondContact NH2-OD2 3.32Å; D135-E137 VanDerWaalsContact C-N 3.28Å; D135-E137 PolarHBondContact O-N 2.82Å; D135-E137 WeakPolarHBondContact OD1-CA 3.11Å; D135-E137 WeakPolarHBondContact OD1-CB 3.41Å; D135-E137 PolarHBondContact OD1-N 3.36Å; D135-L138 PolarHBondContact N-O 2.96Å; D135-L138 PolarHBondContact OD1-N 3.45Å
136	K	94.7	Very high	94.2	Very high	168 Å²	168	39.6 Å²	39.6	73%	0.73	19%	0.193	S	C	*	.	S	Bend	trans	-75.4	-17.6	-175.9	-66	-176.3	179.2	-178.7	0	113.2	R86 F87	R86-K136 HydrophobicContact CB-CG 4.46Å; F87-K136 WeakPolarHBondContact CD1-O 3.3Å
137	E	94.3	Very high	94.5	Very high	129 Å²	129	33.8 Å²	33.8	60%	0.603	17%	0.165	S	C	*	.	S	Bend	trans	-104.3	-24.7	-176	-59.4	175.8	164.3	0	0	111.8	R72 D135 P164	R72-E137 IonicContact CZ-OE2 3.53Å; R72-E137 IonicContact NH1-OE2 3.35Å; R72-E137 IonicContact NH2-OE2 2.73Å; R72-E137 PolarHBondContact NH2-OE2 3.19Å; D135-E137 VanDerWaalsContact C-N 3.28Å; D135-E137 PolarHBondContact O-N 2.82Å; D135-E137 WeakPolarHBondContact OD1-CA 3.11Å; D135-E137 WeakPolarHBondContact OD1-CB 3.41Å; D135-E137 PolarHBondContact OD1-N 3.36Å; E137-P164 WeakPolarHBondContact O-CD 3.37Å
138	L	95.9	Very high	94.5	Very high	8 Å²	8	38.5 Å²	38.5	4%	0.042	19%	0.191	C	C	.	.			trans	-154.9	143.6	-170.2	-157.3	68.6	0	0	0	113.1	V68 V133 D135 L161 H163	V68-L138 HydrophobicContact CB-CD2 4.38Å; V68-L138 HydrophobicContact CG1-CD2 4.08Å; V68-L138 HydrophobicContact CG2-CD2 3.36Å; V133-L138 HydrophobicContact CG1-CD2 4.03Å; V133-L138 HydrophobicContact CG1-CG 4.33Å; D135-L138 PolarHBondContact N-O 2.96Å; D135-L138 PolarHBondContact OD1-N 3.45Å; L138-L161 HydrophobicContact CD1-CB 4.23Å; L138-L161 HydrophobicContact CD2-CD1 4.38Å; L138-L161 HydrophobicContact CD2-CD2 3.77Å; L138-L161 HydrophobicContact CG-CD2 4.22Å; L138-H163 VanDerWaalsContact CD1-CE1 3.44Å; L138-H163 WeakPolarHBondContact CD1-CE1 3.24Å; L138-H163 WeakPolarHBondContact CD1-ND1 3.26Å
139	L	97.5	Very high	94.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.1	166.4	175.3	60.7	0	0	0	108.9	V83 P85 F87 I99 F101 V133 H134 L161 L162	V83-L139 HydrophobicContact CG2-CD1 3.87Å; V83-L139 HydrophobicContact CG2-CD2 3.91Å; P85-L139 HydrophobicContact CB-CD2 4.36Å; P85-L139 HydrophobicContact CG-CD2 3.99Å; F87-L139 HydrophobicContact CE1-CB 4.02Å; F87-L139 HydrophobicContact CZ-CB 3.74Å; I99-L139 HydrophobicContact CB-CD2 4.17Å; I99-L139 HydrophobicContact CG1-CD2 3.97Å; I99-L139 HydrophobicContact CG2-CD2 4.46Å; F101-L139 HydrophobicContact CE2-CD1 3.82Å; F101-L139 HydrophobicContact CE2-CD2 4.42Å; F101-L139 HydrophobicContact CE2-CG 4.19Å; F101-L139 HydrophobicContact CZ-CD1 3.95Å; F101-L139 HydrophobicContact CZ-CD2 4.37Å; F101-L139 HydrophobicContact CZ-CG 3.93Å; V133-L139 CarbonylContact O-C 3.44Å; V133-L139 VanDerWaalsContact O-CA 3.27Å; V133-L139 WeakPolarHBondContact O-CA 3.37Å; V133-L139 WeakPolarHBondContact O-CD1 3.34Å; H134-L139 HydrophobicContact CB-CD1 3.9Å; L139-L161 CarbonylContact O-C 3.55Å; L139-L162 HydrophobicContact CB-CB 4.31Å; L139-L162 HydrophobicContact CD2-CD1 4.06Å; L139-L162 HydrophobicContact CG-CD1 4.28Å; L139-L162 PolarHBondContact N-O 3.28Å; L139-L162 VanDerWaalsContact N-O 3.11Å; L139-L162 PolarHBondContact O-N 2.84Å
140	G	96.7	Very high	94	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	171.6	179.4	0	0	0	0	0	114.8	V132 V133 T160	V132-G140 CarbonylContact C-O 3.55Å; V132-G140 VanDerWaalsContact CA-O 3.28Å; V132-G140 WeakPolarHBondContact CA-O 3.29Å; V133-G140 PolarHBondContact N-O 3.25Å; V133-G140 PolarHBondContact O-N 2.9Å; G140-T160 CarbonylContact C-O 3.6Å; G140-T160 WeakPolarHBondContact CA-O 3.32Å
141	V	96	Very high	93.5	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.3	176.5	64.1	0	0	0	0	109.2	F101 V107 V132 R143 I159 T160	F101-V141 HydrophobicContact CD1-CB 3.6Å; F101-V141 HydrophobicContact CD1-CG1 3.56Å; F101-V141 HydrophobicContact CD1-CG2 4.41Å; F101-V141 HydrophobicContact CE1-CB 3.81Å; F101-V141 HydrophobicContact CE1-CG1 3.74Å; F101-V141 HydrophobicContact CG-CB 4.43Å; V107-V141 HydrophobicContact CG2-CG1 4.15Å; V132-V141 HydrophobicContact CG1-CB 4.22Å; V132-V141 HydrophobicContact CG1-CG2 4.16Å; V141-R143 HydrophobicContact CG2-CG 4.22Å; V141-I159 WeakPolarHBondContact O-CA 3.46Å; V141-T160 PolarHBondContact N-O 3.28Å; V141-T160 PolarHBondContact O-N 3.07Å
142	K	95.6	Very high	93.1	Very high	30 Å²	30	49.9 Å²	49.9	13%	0.13	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.9	168	164.1	175.2	169	170.8	0	107.2	F73 S130 P131 N144 T157 I159	F73-K142 HydrophobicContact CD1-CB 3.67Å; F73-K142 HydrophobicContact CD2-CB 4.47Å; F73-K142 HydrophobicContact CE1-CB 3.78Å; F73-K142 HydrophobicContact CG-CB 4.04Å; F73-K142 HydrophobicContact CZ-CB 4.23Å; S130-K142 CarbonylContact C-O 3.59Å; S130-K142 WeakPolarHBondContact CA-O 3.43Å; P131-K142 WeakPolarHBondContact CD-O 3.29Å; P131-K142 HydrophobicContact CG-CB 4.22Å; P131-K142 HydrophobicContact CG-CG 4.39Å; P131-K142 PolarHBondContact O-N 3.4Å; K142-N144 WeakPolarHBondContact CE-OD1 3.44Å; K142-T157 HydrophobicContact CD-CG2 3.98Å; K142-T157 HydrophobicContact CG-CG2 3.74Å; K142-I159 HydrophobicContact CB-CD1 4.49Å; K142-I159 HydrophobicContact CB-CG1 4.1Å; K142-I159 HydrophobicContact CB-CG2 4.5Å; K142-I159 HydrophobicContact CD-CD1 4.39Å; K142-I159 HydrophobicContact CG-CD1 4.41Å; K142-I159 HydrophobicContact CG-CG1 4.09Å
143	R	95	Very high	92.9	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.1	178.4	-68.7	-164.6	174.3	108.9	0.8	110.6	H102 D105 N120 N127 E129 V141 F145 T157 M158	H102-R143 PolarHBondContact O-NH2 3.37Å; D105-R143 PolarHBondContact O-NH1 2.79Å; D105-R143 PolarHBondContact O-NH2 3.05Å; N120-R143 PolarHBondContact O-NH1 2.92Å; N127-R143 WeakPolarHBondContact ND2-CB 3.45Å; E129-R143 WeakPolarHBondContact O-CA 3.43Å; V141-R143 HydrophobicContact CG2-CG 4.22Å; R143-F145 HydrophobicContact CB-CE2 3.65Å; R143-F145 HydrophobicContact CB-CZ 3.89Å; R143-T157 CarbonylContact O-C 3.47Å; R143-T157 VanDerWaalsContact O-CA 3.3Å; R143-T157 WeakPolarHBondContact O-CA 3.29Å; R143-M158 PolarHBondContact N-O 2.75Å; R143-M158 PolarHBondContact O-N 2.87Å
144	N	94.7	Very high	92.7	Very high	13 Å²	13	57.7 Å²	57.7	7%	0.07	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.2	175.3	-64.2	-19.5	0	0	0	109.3	N127 T128 E129 K142 T155 A156 T157	N127-N144 CarbonylContact C-O 3.52Å; N127-N144 WeakPolarHBondContact CA-O 3.41Å; T128-N144 PolarHBondContact N-O 3.47Å; T128-N144 WeakPolarHBondContact OG1-CB 3.34Å; T128-N144 PolarHBondContact OG1-O 3.22Å; E129-N144 HydrophobicContact CB-CB 4.34Å; E129-N144 PolarHBondContact O-N 3.15Å; E129-N144 PolarHBondContact OE2-ND2 3.33Å; E129-N144 VanDerWaalsContact OE2-ND2 3.15Å; K142-N144 WeakPolarHBondContact CE-OD1 3.44Å; N144-T155 HydrophobicContact CB-CG2 3.8Å; N144-A156 CarbonylContact C-O 3.56Å; N144-A156 WeakPolarHBondContact CA-O 3.44Å; N144-T157 PolarHBondContact OD1-OG1 3.4Å
145	F	94.1	Very high	92.6	Very high	6 Å²	6	58.5 Å²	58.5	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.5	178	-59.2	-87.9	0	0	0	109.2	M122 E126 N127 R143 T155 A156 M158	M122-F145 HydrophobicContact CB-CD1 4.02Å; M122-F145 HydrophobicContact CB-CD2 4.32Å; M122-F145 HydrophobicContact CB-CE1 4.21Å; M122-F145 HydrophobicContact CB-CG 4.07Å; M122-F145 HydrophobicContact CB-CZ 4.46Å; M122-F145 HydrophobicContact CG-CD1 4.44Å; M122-F145 HydrophobicContact CG-CD2 3.85Å; M122-F145 HydrophobicContact CG-CE2 4.08Å; M122-F145 HydrophobicContact CG-CG 4.06Å; M122-F145 HydrophobicContact CG-CZ 4.47Å; M122-F145 HydrophobicContact SD-CB 3.97Å; M122-F145 HydrophobicContact SD-CD2 3.85Å; M122-F145 HydrophobicContact SD-CG 3.98Å; E126-F145 WeakPolarHBondContact O-CA 3.31Å; N127-F145 HydrophobicContact CB-CD1 4.26Å; N127-F145 HydrophobicContact CB-CE1 4.05Å; R143-F145 HydrophobicContact CB-CE2 3.65Å; R143-F145 HydrophobicContact CB-CZ 3.89Å; F145-T155 CarbonylContact O-C 3.49Å; F145-T155 WeakPolarHBondContact O-CA 2.97Å; F145-A156 HydrophobicContact CB-CB 4.45Å; F145-A156 PolarHBondContact N-O 3.08Å; F145-A156 PolarHBondContact O-N 2.93Å; F145-M158 HydrophobicContact CD2-CG 4.34Å; F145-M158 HydrophobicContact CE2-CB 4.15Å; F145-M158 HydrophobicContact CE2-CG 3.93Å; F145-M158 HydrophobicContact CE2-SD 3.89Å
146	L	93.2	Very high	92.7	Very high	54 Å²	54	56.8 Å²	56.8	28%	0.283	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	129.8	175.1	-171.8	65	0	0	0	109.8	E126 T128 E153	E126-L146 PolarHBondContact O-N 3.4Å; T128-L146 HydrophobicContact CG2-CB 3.79Å; L146-E153 HydrophobicContact CD1-CB 4.05Å; L146-E153 HydrophobicContact CD1-CG 4.28Å
147	I	92.1	Very high	92.7	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126	-174	-49.5	-174	0	0	0	108.8	M122 Y125 I149 V154 A156 P176 I179	M122-I147 HydrophobicContact CE-CD1 3.33Å; M122-I147 HydrophobicContact SD-CD1 3.93Å; Y125-I147 HydrophobicContact CD1-CB 4.43Å; Y125-I147 HydrophobicContact CD1-CD1 4.4Å; Y125-I147 HydrophobicContact CD1-CG1 3.88Å; Y125-I147 HydrophobicContact CD1-CG2 4.28Å; Y125-I147 HydrophobicContact CE1-CB 4.39Å; Y125-I147 HydrophobicContact CE1-CD1 4.47Å; Y125-I147 HydrophobicContact CE1-CG1 4.17Å; Y125-I147 HydrophobicContact CE1-CG2 3.75Å; I147-I149 HydrophobicContact CG2-CD1 4.02Å; I147-I149 HydrophobicContact CG2-CG1 3.83Å; I147-V154 PolarHBondContact N-O 2.88Å; I147-V154 PolarHBondContact O-N 2.8Å; I147-A156 HydrophobicContact CD1-CB 3.51Å; I147-A156 HydrophobicContact CG1-CB 4.34Å; I147-P176 HydrophobicContact CD1-CG 4.17Å; I147-I179 HydrophobicContact CD1-CD1 3.49Å; I147-I179 VanDerWaalsContact CD1-CD1 3.49Å; I147-I179 HydrophobicContact CG2-CD1 4.27Å
148	N	89.2	Confident	92.8	Very high	116 Å²	116	43.1 Å²	43.1	62%	0.62	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.7	176.4	-61.9	-10.9	0	0	0	109.1	E153	N148-E153 WeakPolarHBondContact OD1-CG 3.32Å
149	I	84.7	Confident	92.9	Very high	39 Å²	39	42.8 Å²	42.8	20%	0.2	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	120.8	177.4	-58.8	-179.7	0	0	0	108.1	I147 D151 S152 P176	I147-I149 HydrophobicContact CG2-CD1 4.02Å; I147-I149 HydrophobicContact CG2-CG1 3.83Å; I149-D151 VanDerWaalsContact C-N 3.28Å; I149-D151 PolarHBondContact O-N 2.99Å; I149-S152 PolarHBondContact N-O 2.86Å; I149-S152 WeakPolarHBondContact O-CA 3.02Å; I149-S152 WeakPolarHBondContact O-CB 3.27Å; I149-S152 PolarHBondContact O-N 3.07Å; I149-P176 HydrophobicContact CD1-CB 3.13Å; I149-P176 HydrophobicContact CD1-CG 3.36Å
150	N	86.8	Confident	92.9	Very high	141 Å²	141	42.8 Å²	42.8	75%	0.754	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	50.7	177.9	-57.8	-23.6	0	0	0	112.4	S152	N150-S152 PolarHBondContact O-N 3.24Å
151	D	83.8	Confident	93	Very high	173 Å²	173	42.9 Å²	42.9	93%	0.925	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	12.8	-177.7	-52.4	-45.3	0	0	0	115.6	I149	I149-D151 VanDerWaalsContact C-N 3.28Å; I149-D151 PolarHBondContact O-N 2.99Å
152	S	89.1	Confident	93	Very high	72 Å²	72	42.9 Å²	42.9	50%	0.503	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.8	173.3	-58.8	0	0	0	0	110.9	I149 N150	I149-S152 PolarHBondContact N-O 2.86Å; I149-S152 WeakPolarHBondContact O-CA 3.02Å; I149-S152 WeakPolarHBondContact O-CB 3.27Å; I149-S152 PolarHBondContact O-N 3.07Å; N150-S152 PolarHBondContact O-N 3.24Å
153	E	90	Very high	93.1	Very high	142 Å²	142	43.1 Å²	43.1	66%	0.664	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.5	174	-76.3	-175.4	146.8	0	0	110.5	L146 N148	L146-E153 HydrophobicContact CD1-CB 4.05Å; L146-E153 HydrophobicContact CD1-CG 4.28Å; N148-E153 WeakPolarHBondContact OD1-CG 3.32Å
154	V	93	Very high	93	Very high	36 Å²	36	45.9 Å²	45.9	22%	0.218	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134.1	177.3	-176.5	0	0	0	0	108.6	I147 N174 P176	I147-V154 PolarHBondContact N-O 2.88Å; I147-V154 PolarHBondContact O-N 2.8Å; V154-N174 WeakPolarHBondContact CG1-ND2 3.33Å; V154-P176 HydrophobicContact CG1-CG 4.2Å
155	T	94.7	Very high	92.8	Very high	59 Å²	59	48.7 Å²	48.7	36%	0.362	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110	174.3	-59.5	0	0	0	0	110.2	N144 F145 N174	N144-T155 HydrophobicContact CB-CG2 3.8Å; F145-T155 CarbonylContact O-C 3.49Å; F145-T155 WeakPolarHBondContact O-CA 2.97Å; T155-N174 PolarHBondContact O-ND2 3.3Å
156	A	95.6	Very high	92.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	142.3	170.9	0	0	0	0	0	110.3	M122 N144 F145 I147 N174 I175	M122-A156 HydrophobicContact CE-CB 4.43Å; M122-A156 HydrophobicContact SD-CB 3.64Å; N144-A156 CarbonylContact C-O 3.56Å; N144-A156 WeakPolarHBondContact CA-O 3.44Å; F145-A156 HydrophobicContact CB-CB 4.45Å; F145-A156 PolarHBondContact N-O 3.08Å; F145-A156 PolarHBondContact O-N 2.93Å; I147-A156 HydrophobicContact CD1-CB 3.51Å; I147-A156 HydrophobicContact CG1-CB 4.34Å; A156-N174 WeakPolarHBondContact CA-O 3.15Å; A156-I175 HydrophobicContact CB-CD1 3.91Å
157	T	95.8	Very high	92.8	Very high	10 Å²	10	47.5 Å²	47.5	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.9	179.3	-59.6	0	0	0	0	110.9	K142 R143 N144 I159 Y172 D173	K142-T157 HydrophobicContact CD-CG2 3.98Å; K142-T157 HydrophobicContact CG-CG2 3.74Å; R143-T157 CarbonylContact O-C 3.47Å; R143-T157 VanDerWaalsContact O-CA 3.3Å; R143-T157 WeakPolarHBondContact O-CA 3.29Å; N144-T157 PolarHBondContact OD1-OG1 3.4Å; T157-I159 HydrophobicContact CG2-CD1 4.27Å; T157-I159 HydrophobicContact CG2-CG1 3.83Å; T157-Y172 WeakPolarHBondContact O-CA 3.22Å; T157-D173 PolarHBondContact N-O 3.42Å; T157-D173 PolarHBondContact O-N 2.02Å
158	M	96.3	Very high	93.1	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125.4	169.4	-55	-177.4	96	0	0	109.8	N120 Y121 M122 R143 F145 Y172 I175 S186 I210	N120-M158 WeakPolarHBondContact OD1-CE 3.39Å; Y121-M158 VanDerWaalsContact C-SD 3.53Å; M122-M158 HydrophobicContact CG-CG 4.45Å; M122-M158 HydrophobicContact CG-SD 3.51Å; M122-M158 VanDerWaalsContact CG-SD 3.51Å; M122-M158 HydrophobicContact SD-SD 4.46Å; R143-M158 PolarHBondContact N-O 2.75Å; R143-M158 PolarHBondContact O-N 2.87Å; F145-M158 HydrophobicContact CD2-CG 4.34Å; F145-M158 HydrophobicContact CE2-CB 4.15Å; F145-M158 HydrophobicContact CE2-CG 3.93Å; F145-M158 HydrophobicContact CE2-SD 3.89Å; M158-Y172 HydrophobicContact CB-CD1 4.33Å; M158-Y172 HydrophobicContact CE-CD1 3.62Å; M158-Y172 HydrophobicContact CE-CE1 3.57Å; M158-Y172 HydrophobicContact CG-CD1 4.13Å; M158-I175 HydrophobicContact CG-CD1 4.29Å; M158-S186 WeakPolarHBondContact CE-OG 3.32Å; M158-I210 HydrophobicContact CE-CG2 3.79Å
159	I	97	Very high	93.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.4	-177.4	-50.2	-175.9	0	0	0	109.2	Q66 F73 N120 V141 K142 T157 L161 F170 Y171	Q66-I159 HydrophobicContact CG-CD1 3.76Å; F73-I159 HydrophobicContact CE1-CG2 4.03Å; F73-I159 HydrophobicContact CZ-CD1 4.39Å; F73-I159 HydrophobicContact CZ-CG2 3.65Å; N120-I159 PolarHBondContact ND2-O 2.8Å; N120-I159 VanDerWaalsContact ND2-O 3.11Å; V141-I159 WeakPolarHBondContact O-CA 3.46Å; K142-I159 HydrophobicContact CB-CD1 4.49Å; K142-I159 HydrophobicContact CB-CG1 4.1Å; K142-I159 HydrophobicContact CB-CG2 4.5Å; K142-I159 HydrophobicContact CD-CD1 4.39Å; K142-I159 HydrophobicContact CG-CD1 4.41Å; K142-I159 HydrophobicContact CG-CG1 4.09Å; T157-I159 HydrophobicContact CG2-CD1 4.27Å; T157-I159 HydrophobicContact CG2-CG1 3.83Å; I159-L161 HydrophobicContact CG2-CD1 4.46Å; I159-L161 HydrophobicContact CG2-CD2 3.76Å; I159-L161 HydrophobicContact CG2-CG 3.89Å; I159-F170 CarbonylContact O-C 3.55Å; I159-F170 VanDerWaalsContact O-CA 3.26Å; I159-F170 WeakPolarHBondContact O-CA 3.46Å; I159-Y171 HydrophobicContact CD1-CD1 3.97Å; I159-Y171 HydrophobicContact CG1-CD1 4.37Å; I159-Y171 PolarHBondContact N-O 2.84Å; I159-Y171 PolarHBondContact O-N 3Å
160	T	97.7	Very high	94.2	Very high	1 Å²	1	40 Å²	40	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.2	170.2	-60.9	0	0	0	0	109.6	I118 N120 G140 V141 S169 F170	I118-T160 HydrophobicContact CG2-CG2 3.77Å; N120-T160 VanDerWaalsContact CB-OG1 3.32Å; N120-T160 WeakPolarHBondContact CB-OG1 3.44Å; N120-T160 PolarHBondContact ND2-OG1 2.89Å; G140-T160 CarbonylContact C-O 3.6Å; G140-T160 WeakPolarHBondContact CA-O 3.32Å; V141-T160 PolarHBondContact N-O 3.28Å; V141-T160 PolarHBondContact O-N 3.07Å; T160-S169 WeakPolarHBondContact CA-O 3.46Å; T160-F170 HydrophobicContact CG2-CD1 4.18Å; T160-F170 HydrophobicContact CG2-CE1 3.9Å
161	L	97.8	Very high	94.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.1	-179.1	-59.3	177.1	0	0	0	111.1	P67 V68 F73 V133 L138 L139 I159 V168 S169	P67-L161 HydrophobicContact CB-CD1 4.36Å; P67-L161 HydrophobicContact CG-CD1 3.73Å; V68-L161 HydrophobicContact CG2-CD1 3.48Å; V68-L161 VanDerWaalsContact CG2-CD1 3.48Å; V68-L161 HydrophobicContact CG2-CD2 4.1Å; V68-L161 HydrophobicContact CG2-CG 4.45Å; F73-L161 HydrophobicContact CE1-CD2 4.29Å; F73-L161 HydrophobicContact CZ-CD2 4.02Å; V133-L161 HydrophobicContact CG1-CD2 4.21Å; L138-L161 HydrophobicContact CD1-CB 4.23Å; L138-L161 HydrophobicContact CD2-CD1 4.38Å; L138-L161 HydrophobicContact CD2-CD2 3.77Å; L138-L161 HydrophobicContact CG-CD2 4.22Å; L139-L161 CarbonylContact O-C 3.55Å; I159-L161 HydrophobicContact CG2-CD1 4.46Å; I159-L161 HydrophobicContact CG2-CD2 3.76Å; I159-L161 HydrophobicContact CG2-CG 3.89Å; L161-V168 CarbonylContact O-C 3.48Å; L161-V168 WeakPolarHBondContact O-CA 3.07Å; L161-S169 PolarHBondContact N-O 2.83Å; L161-S169 PolarHBondContact O-N 2.97Å
162	L	98	Very high	95.4	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127	176.9	-49.6	179.2	0	0	0	108	F87 F89 I99 I118 L139 V168	F87-L162 WeakPolarHBondContact CZ-O 3.34Å; F89-L162 HydrophobicContact CE1-CD1 4.23Å; F89-L162 HydrophobicContact CE1-CD2 4.41Å; F89-L162 HydrophobicContact CE2-CB 4.11Å; F89-L162 HydrophobicContact CZ-CB 4.11Å; F89-L162 HydrophobicContact CZ-CD1 4.46Å; F89-L162 HydrophobicContact CZ-CD2 3.94Å; F89-L162 HydrophobicContact CZ-CG 4.39Å; I99-L162 HydrophobicContact CD1-CD1 3.9Å; I99-L162 HydrophobicContact CG1-CD1 3.98Å; I99-L162 HydrophobicContact CG2-CD1 4.33Å; I118-L162 HydrophobicContact CD1-CD2 3.57Å; L139-L162 HydrophobicContact CB-CB 4.31Å; L139-L162 HydrophobicContact CD2-CD1 4.06Å; L139-L162 HydrophobicContact CG-CD1 4.28Å; L139-L162 PolarHBondContact N-O 3.28Å; L139-L162 VanDerWaalsContact N-O 3.11Å; L139-L162 PolarHBondContact O-N 2.84Å; L162-V168 HydrophobicContact CD2-CB 4.39Å; L162-V168 HydrophobicContact CD2-CG1 4.01Å; L162-V168 HydrophobicContact CD2-CG2 3.85Å
163	H	95.8	Very high	95.8	Very high	35 Å²	35	24.8 Å²	24.8	16%	0.162	13%	0.133	C	C	.	.			trans	-111.4	152.3	-173.7	-61.7	-93.1	0	0	0	111.7	F89 L138 N165 G166 K167 S169	F89-H163 VanDerWaalsContact CD2-O 3.26Å; F89-H163 WeakPolarHBondContact CD2-O 3.33Å; L138-H163 VanDerWaalsContact CD1-CE1 3.44Å; L138-H163 WeakPolarHBondContact CD1-CE1 3.24Å; L138-H163 WeakPolarHBondContact CD1-ND1 3.26Å; H163-N165 VanDerWaalsContact CB-OD1 3.29Å; H163-N165 WeakPolarHBondContact CB-OD1 3.36Å; H163-N165 PolarHBondContact O-N 3.08Å; H163-G166 PolarHBondContact O-N 3.22Å; H163-K167 HydrophobicContact CB-CB 4.1Å; H163-K167 PolarHBondContact CD2-O 2.92Å; H163-K167 PolarHBondContact N-O 3.24Å; H163-S169 PolarHBondContact CD2-OG 3.45Å; H163-S169 PolarHBondContact NE2-OG 2.73Å
164	P	93.6	Very high	96.1	Very high	60 Å²	60	21.6 Å²	21.6	39%	0.39	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-24.9	178.5	-28.1	33.7	0	0	0	115.6	F87 E137 G166	F87-P164 HydrophobicContact CB-CB 4.12Å; F87-P164 HydrophobicContact CB-CG 4.08Å; F87-P164 HydrophobicContact CD1-CG 4.09Å; F87-P164 HydrophobicContact CD2-CB 4.02Å; F87-P164 HydrophobicContact CD2-CG 3.98Å; F87-P164 HydrophobicContact CE2-CG 4.39Å; F87-P164 HydrophobicContact CG-CB 4.11Å; F87-P164 HydrophobicContact CG-CG 3.8Å; E137-P164 WeakPolarHBondContact O-CD 3.37Å; P164-G166 VanDerWaalsContact C-N 3.25Å; P164-G166 PolarHBondContact O-N 2.02Å
165	N	89.8	Confident	96.2	Very high	71 Å²	71	20.3 Å²	20.3	38%	0.38	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	9.5	177.8	67.1	-6.4	0	0	0	113.9	H163 K167 N258	H163-N165 VanDerWaalsContact CB-OD1 3.29Å; H163-N165 WeakPolarHBondContact CB-OD1 3.36Å; H163-N165 PolarHBondContact O-N 3.08Å; N165-K167 VanDerWaalsContact C-N 3.27Å; N165-K167 PolarHBondContact O-N 3.42Å; N165-K167 WeakPolarHBondContact OD1-CB 3.43Å; N165-K167 PolarHBondContact OD1-N 3.36Å; N165-K167 VanDerWaalsContact OD1-N 3.1Å; N165-N258 PolarHBondContact ND2-ND2 2.64Å
166	G	92.7	Very high	96.2	Very high	5 Å²	5	18.5 Å²	18.5	5%	0.052	10%	0.102	C	C	.	.	S	Bend	trans	83.1	-2.5	-177.6	0	0	0	0	0	114.4	H163 P164	H163-G166 PolarHBondContact O-N 3.22Å; P164-G166 VanDerWaalsContact C-N 3.25Å; P164-G166 PolarHBondContact O-N 2.02Å
167	K	95.3	Very high	96	Very high	30 Å²	30	24.7 Å²	24.7	13%	0.13	14%	0.14	C	C	.	.			trans	-67.3	138.3	176.7	-175.2	176.1	68.7	171.7	0	110.7	H163 N165 E217 F218	H163-K167 HydrophobicContact CB-CB 4.1Å; H163-K167 PolarHBondContact CD2-O 2.92Å; H163-K167 PolarHBondContact N-O 3.24Å; N165-K167 VanDerWaalsContact C-N 3.27Å; N165-K167 PolarHBondContact O-N 3.42Å; N165-K167 WeakPolarHBondContact OD1-CB 3.43Å; N165-K167 PolarHBondContact OD1-N 3.36Å; N165-K167 VanDerWaalsContact OD1-N 3.1Å; K167-E217 HydrophobicContact CD-CB 4.15Å; K167-E217 HydrophobicContact CD-CG 4.23Å; K167-E217 IonicContact NZ-OE1 3.19Å; K167-E217 PolarHBondContact NZ-OE1 2.81Å; K167-F218 WeakPolarHBondContact CA-O 3.4Å; K167-F218 WeakPolarHBondContact CG-O 3.38Å
168	V	98	Very high	95.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.8	169.9	-179.1	0	0	0	0	108.2	F89 Y91 I118 L161 L162 F170 I188 F218	F89-V168 HydrophobicContact CZ-CG2 4.07Å; Y91-V168 HydrophobicContact CD2-CG2 4.33Å; Y91-V168 HydrophobicContact CE2-CG2 4.27Å; I118-V168 HydrophobicContact CD1-CG1 4.2Å; I118-V168 HydrophobicContact CD1-CG2 4.31Å; I118-V168 HydrophobicContact CG2-CG1 4.35Å; L161-V168 CarbonylContact O-C 3.48Å; L161-V168 WeakPolarHBondContact O-CA 3.07Å; L162-V168 HydrophobicContact CD2-CB 4.39Å; L162-V168 HydrophobicContact CD2-CG1 4.01Å; L162-V168 HydrophobicContact CD2-CG2 3.85Å; V168-F170 HydrophobicContact CG1-CE1 3.94Å; V168-F170 HydrophobicContact CG1-CZ 4.47Å; V168-I188 HydrophobicContact CB-CG2 4.44Å; V168-I188 HydrophobicContact CG1-CG2 3.99Å; V168-F218 HydrophobicContact CB-CB 4.36Å; V168-F218 HydrophobicContact CB-CD2 4.45Å; V168-F218 PolarHBondContact N-O 3.03Å; V168-F218 PolarHBondContact O-N 2.91Å
169	S	98.2	Very high	95.4	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.014	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.9	-179.2	-44.1	0	0	0	0	111.4	T160 L161 H163 V216	T160-S169 WeakPolarHBondContact CA-O 3.46Å; L161-S169 PolarHBondContact N-O 2.83Å; L161-S169 PolarHBondContact O-N 2.97Å; H163-S169 PolarHBondContact CD2-OG 3.45Å; H163-S169 PolarHBondContact NE2-OG 2.73Å; S169-V216 CarbonylContact C-O 3.58Å; S169-V216 WeakPolarHBondContact CA-O 3.2Å
170	F	98.7	Very high	95.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.5	167	-55	-31.8	0	0	0	110.1	I118 N120 I159 T160 V168 Y172 I188 V205 L215 V216 F218	I118-F170 HydrophobicContact CG2-CE1 3.48Å; I118-F170 VanDerWaalsContact CG2-CE1 3.48Å; I118-F170 HydrophobicContact CG2-CZ 3.67Å; N120-F170 HydrophobicContact CB-CD1 4.21Å; N120-F170 HydrophobicContact CB-CE1 4.11Å; N120-F170 HydrophobicContact CB-CZ 4.39Å; N120-F170 WeakPolarHBondContact ND2-CD1 3.23Å; I159-F170 CarbonylContact O-C 3.55Å; I159-F170 VanDerWaalsContact O-CA 3.26Å; I159-F170 WeakPolarHBondContact O-CA 3.46Å; T160-F170 HydrophobicContact CG2-CD1 4.18Å; T160-F170 HydrophobicContact CG2-CE1 3.9Å; V168-F170 HydrophobicContact CG1-CE1 3.94Å; V168-F170 HydrophobicContact CG1-CZ 4.47Å; F170-Y172 HydrophobicContact CB-CE1 3.89Å; F170-Y172 WeakPolarHBondContact CB-OH 3.2Å; F170-I188 HydrophobicContact CE2-CG2 4.4Å; F170-I188 HydrophobicContact CZ-CG2 3.79Å; F170-V205 HydrophobicContact CD2-CG2 3.93Å; F170-V205 HydrophobicContact CE2-CG2 4.21Å; F170-L215 CarbonylContact O-C 3.47Å; F170-L215 WeakPolarHBondContact O-CA 3.44Å; F170-V216 HydrophobicContact CB-CB 4.21Å; F170-V216 PolarHBondContact N-O 3Å; F170-V216 PolarHBondContact O-N 2.78Å; F170-F218 AromaticContact CD2-CE2 3.72Å; F170-F218 HydrophobicContact CD2-CE2 3.72Å; F170-F218 HydrophobicContact CD2-CZ 4.47Å; F170-F218 HydrophobicContact CE2-CD2 4.46Å; F170-F218 AromaticContact CE2-CE2 3.49Å; F170-F218 HydrophobicContact CE2-CE2 3.49Å; F170-F218 VanDerWaalsContact CE2-CE2 3.49Å; F170-F218 HydrophobicContact CE2-CZ 4.13Å; F170-F218 HydrophobicContact CZ-CE2 4.12Å
171	Y	98.5	Very high	94.9	Very high	9 Å²	9	37.1 Å²	37.1	4%	0.035	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.9	172.1	177.2	-98.9	0	0	0	109.8	Q64 Q66 P67 I159 D173 T214 L215	Q64-Y171 HydrophobicContact CB-CE2 4.48Å; Q64-Y171 WeakPolarHBondContact O-CE2 3.39Å; Q64-Y171 PolarHBondContact O-OH 2.84Å; Q66-Y171 VanDerWaalsContact CA-CZ 3.46Å; Q66-Y171 HydrophobicContact CB-CD1 4.3Å; Q66-Y171 HydrophobicContact CB-CE1 3.64Å; Q66-Y171 HydrophobicContact CG-CD1 4.04Å; Q66-Y171 HydrophobicContact CG-CE1 3.83Å; Q66-Y171 PolarHBondContact N-OH 3.37Å; P67-Y171 HydrophobicContact CG-CG 4.35Å; I159-Y171 HydrophobicContact CD1-CD1 3.97Å; I159-Y171 HydrophobicContact CG1-CD1 4.37Å; I159-Y171 PolarHBondContact N-O 2.84Å; I159-Y171 PolarHBondContact O-N 3Å; Y171-D173 HydrophobicContact CD1-CB 4.48Å; Y171-D173 HydrophobicContact CE1-CB 3.74Å; Y171-T214 WeakPolarHBondContact CA-O 3.44Å; Y171-T214 WeakPolarHBondContact CD2-O 3.38Å; Y171-L215 HydrophobicContact CD2-CB 4.35Å
172	Y	98.3	Very high	94.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.5	-180	-39.1	-62.4	0	0	0	110.2	N120 T157 M158 F170 S186 I210 S212 G213 T214 V216	N120-Y172 WeakPolarHBondContact OD1-CE1 3.41Å; T157-Y172 WeakPolarHBondContact O-CA 3.22Å; M158-Y172 HydrophobicContact CB-CD1 4.33Å; M158-Y172 HydrophobicContact CE-CD1 3.62Å; M158-Y172 HydrophobicContact CE-CE1 3.57Å; M158-Y172 HydrophobicContact CG-CD1 4.13Å; F170-Y172 HydrophobicContact CB-CE1 3.89Å; F170-Y172 WeakPolarHBondContact CB-OH 3.2Å; Y172-S186 WeakPolarHBondContact CE1-OG 3.22Å; Y172-S186 WeakPolarHBondContact OH-CB 3.43Å; Y172-S186 PolarHBondContact OH-OG 3.2Å; Y172-I210 HydrophobicContact CD1-CG2 3.98Å; Y172-I210 HydrophobicContact CD2-CB 4.31Å; Y172-I210 HydrophobicContact CD2-CG2 3.91Å; Y172-I210 HydrophobicContact CE1-CG2 4.04Å; Y172-I210 HydrophobicContact CE2-CB 4.14Å; Y172-I210 HydrophobicContact CE2-CG1 4.02Å; Y172-I210 HydrophobicContact CE2-CG2 3.98Å; Y172-I210 HydrophobicContact CG-CG2 3.92Å; Y172-S212 CarbonylContact O-C 3.53Å; Y172-G213 PolarHBondContact O-N 2.92Å; Y172-T214 PolarHBondContact N-O 2.87Å; Y172-T214 VanDerWaalsContact N-O 3.08Å; Y172-V216 HydrophobicContact CE2-CG2 3.88Å
173	D	97	Very high	94.5	Very high	56 Å²	56	43.5 Å²	43.5	30%	0.299	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.2	178.9	-158.6	15.9	0	0	0	110.9	T157 Y171 I175	T157-D173 PolarHBondContact N-O 3.42Å; T157-D173 PolarHBondContact O-N 2.02Å; Y171-D173 HydrophobicContact CD1-CB 4.48Å; Y171-D173 HydrophobicContact CE1-CB 3.74Å; D173-I175 PolarHBondContact O-N 3.38Å; D173-I175 VanDerWaalsContact O-N 3.07Å
174	N	95.7	Very high	94.5	Very high	76 Å²	76	42.6 Å²	42.6	41%	0.406	25%	0.246	S	C	.	.	S	Bend	trans	47.4	37.5	178.8	-160.8	35.1	0	0	0	114.1	V154 T155 A156 P176 S212	V154-N174 WeakPolarHBondContact CG1-ND2 3.33Å; T155-N174 PolarHBondContact O-ND2 3.3Å; A156-N174 WeakPolarHBondContact CA-O 3.15Å; N174-P176 VanDerWaalsContact O-CD 3.23Å; N174-P176 WeakPolarHBondContact O-CD 3.37Å; N174-S212 WeakPolarHBondContact CA-OG 3.32Å; N174-S212 PolarHBondContact N-OG 2.94Å
175	I	95.5	Very high	94.6	Very high	9 Å²	9	42.4 Å²	42.4	5%	0.046	24%	0.24	C	C	.	.			trans	-75.1	115.7	171.1	-51.5	-53.9	0	0	0	108.4	M122 A156 M158 D173 L184 S212	M122-I175 HydrophobicContact SD-CD1 4.41Å; A156-I175 HydrophobicContact CB-CD1 3.91Å; M158-I175 HydrophobicContact CG-CD1 4.29Å; D173-I175 PolarHBondContact O-N 3.38Å; D173-I175 VanDerWaalsContact O-N 3.07Å; I175-L184 HydrophobicContact CG2-CD1 4.19Å; I175-L184 HydrophobicContact CG2-CD2 4.26Å; I175-S212 PolarHBondContact N-OG 3.36Å; I175-S212 PolarHBondContact O-OG 2.83Å; I175-S212 VanDerWaalsContact O-OG 3.11Å
176	P	94	Very high	95	Very high	21 Å²	21	39.2 Å²	39.2	14%	0.136	22%	0.223	C	C	.	.			trans	-63.7	144.9	177.6	-21.3	32.7	0	0	0	112.8	I147 I149 V154 N174 D178 I179	I147-P176 HydrophobicContact CD1-CG 4.17Å; I149-P176 HydrophobicContact CD1-CB 3.13Å; I149-P176 HydrophobicContact CD1-CG 3.36Å; V154-P176 HydrophobicContact CG1-CG 4.2Å; N174-P176 VanDerWaalsContact O-CD 3.23Å; N174-P176 WeakPolarHBondContact O-CD 3.37Å; P176-D178 VanDerWaalsContact C-N 3.31Å; P176-D178 PolarHBondContact O-N 2.67Å; P176-I179 HydrophobicContact CB-CD1 4.02Å; P176-I179 HydrophobicContact CB-CG1 4.09Å; P176-I179 HydrophobicContact CG-CD1 3.87Å; P176-I179 HydrophobicContact CG-CG1 4.46Å
177	T	91.9	Very high	95.2	Very high	130 Å²	130	41.6 Å²	41.6	80%	0.798	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-24.6	-174.9	48.7	0	0	0	0	114.1	I179	T177-I179 VanDerWaalsContact C-N 3.3Å; T177-I179 PolarHBondContact O-N 3.26Å
178	D	88.9	Confident	95.3	Very high	126 Å²	126	40.2 Å²	40.2	67%	0.674	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	4.7	-169.9	-55.2	-13.1	0	0	0	112.4	P176	P176-D178 VanDerWaalsContact C-N 3.31Å; P176-D178 PolarHBondContact O-N 2.67Å
179	I	90.4	Very high	95.3	Very high	21 Å²	21	41 Å²	41	11%	0.108	23%	0.231	C	C	.	.	S	Bend	trans	-76.4	130	177.6	-64.1	-177.6	0	0	0	109.6	M122 Y125 I147 P176 T177 G181 K183 L184	M122-I179 HydrophobicContact CE-CD1 3.39Å; M122-I179 HydrophobicContact CE-CG2 4.36Å; Y125-I179 HydrophobicContact CE2-CG2 4.42Å; I147-I179 HydrophobicContact CD1-CD1 3.49Å; I147-I179 VanDerWaalsContact CD1-CD1 3.49Å; I147-I179 HydrophobicContact CG2-CD1 4.27Å; P176-I179 HydrophobicContact CB-CD1 4.02Å; P176-I179 HydrophobicContact CB-CG1 4.09Å; P176-I179 HydrophobicContact CG-CD1 3.87Å; P176-I179 HydrophobicContact CG-CG1 4.46Å; T177-I179 VanDerWaalsContact C-N 3.3Å; T177-I179 PolarHBondContact O-N 3.26Å; I179-G181 PolarHBondContact O-N 3.21Å; I179-K183 HydrophobicContact CG2-CB 4.11Å; I179-L184 HydrophobicContact CG2-CD1 4.4Å; I179-L184 HydrophobicContact CG2-CD2 4.15Å; I179-L184 HydrophobicContact CG2-CG 4.09Å
180	D	92.1	Very high	95.2	Very high	98 Å²	98	40.9 Å²	40.9	52%	0.524	23%	0.23	S	C	.	.			trans	-57.9	124.1	170.7	174.9	11.9	0	0	0	110.3	S182 K183	D180-S182 VanDerWaalsContact CG-OG 3.24Å; D180-S182 PolarHBondContact O-N 3.43Å; D180-S182 PolarHBondContact OD1-N 2.84Å; D180-S182 WeakPolarHBondContact OD2-CB 3.3Å; D180-S182 PolarHBondContact OD2-OG 2.88Å; D180-K183 HydrophobicContact CB-CG 4.3Å; D180-K183 WeakPolarHBondContact O-CB 3.11Å; D180-K183 PolarHBondContact O-N 3.07Å
181	G	93	Very high	95	Very high	27 Å²	27	41.9 Å²	41.9	28%	0.278	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-55.9	-22.9	178.1	0	0	0	0	0	113.8	I179 K183 L184	I179-G181 PolarHBondContact O-N 3.21Å; G181-K183 PolarHBondContact O-N 2.86Å; G181-L184 PolarHBondContact O-N 3.25Å; G181-L184 VanDerWaalsContact O-N 3.13Å
182	S	93.8	Very high	94.7	Very high	80 Å²	80	42 Å²	42	56%	0.559	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-65.1	-17.4	173.6	85.9	0	0	0	0	113.9	D180	D180-S182 VanDerWaalsContact CG-OG 3.24Å; D180-S182 PolarHBondContact O-N 3.43Å; D180-S182 PolarHBondContact OD1-N 2.84Å; D180-S182 WeakPolarHBondContact OD2-CB 3.3Å; D180-S182 PolarHBondContact OD2-OG 2.88Å
183	K	94.3	Very high	94.2	Very high	57 Å²	57	51.1 Å²	51.1	25%	0.248	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-88.8	-14.2	175.8	-54.9	-59.2	-174.7	-173.8	0	113.2	M122 K123 N124 Y125 I179 D180 G181	M122-K183 CarbonylContact C-O 3.59Å; M122-K183 WeakPolarHBondContact CA-O 3.38Å; K123-K183 PolarHBondContact N-O 2.87Å; N124-K183 PolarHBondContact ND2-NZ 3.01Å; Y125-K183 HydrophobicContact CE2-CB 4Å; Y125-K183 HydrophobicContact CE2-CG 4.28Å; I179-K183 HydrophobicContact CG2-CB 4.11Å; D180-K183 HydrophobicContact CB-CG 4.3Å; D180-K183 WeakPolarHBondContact O-CB 3.11Å; D180-K183 PolarHBondContact O-N 3.07Å; G181-K183 PolarHBondContact O-N 2.86Å
184	L	95.3	Very high	93.8	Very high	17 Å²	17	49.4 Å²	49.4	9%	0.089	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.2	-177.2	-61.3	176.2	0	0	0	109.1	M122 I175 I179 G181 I210	M122-L184 HydrophobicContact CE-CD2 3.63Å; M122-L184 HydrophobicContact CG-CD2 3.98Å; M122-L184 HydrophobicContact SD-CD2 4.24Å; I175-L184 HydrophobicContact CG2-CD1 4.19Å; I175-L184 HydrophobicContact CG2-CD2 4.26Å; I179-L184 HydrophobicContact CG2-CD1 4.4Å; I179-L184 HydrophobicContact CG2-CD2 4.15Å; I179-L184 HydrophobicContact CG2-CG 4.09Å; G181-L184 PolarHBondContact O-N 3.25Å; G181-L184 VanDerWaalsContact O-N 3.13Å; L184-I210 HydrophobicContact CB-CB 4.21Å; L184-I210 HydrophobicContact CB-CD1 3.88Å; L184-I210 HydrophobicContact CB-CG2 4.06Å; L184-I210 HydrophobicContact CD1-CB 4.11Å; L184-I210 HydrophobicContact CD1-CG2 4.08Å; L184-I210 HydrophobicContact CD2-CG2 4.29Å; L184-I210 HydrophobicContact CG-CG2 4.38Å
185	E	95.1	Very high	93.1	Very high	56 Å²	56	49.8 Å²	49.8	26%	0.262	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.9	-179.6	-165.3	172.8	-171.7	0	0	111.2	I119 N120 Y121 K187	I119-E185 HydrophobicContact CG2-CB 4.44Å; I119-E185 HydrophobicContact CG2-CG 3.91Å; N120-E185 WeakPolarHBondContact CA-O 3.2Å; Y121-E185 HydrophobicContact CD1-CB 4.5Å; Y121-E185 HydrophobicContact CE1-CB 4.01Å; Y121-E185 HydrophobicContact CE1-CG 4.38Å; Y121-E185 WeakPolarHBondContact CE1-OE2 3.09Å; Y121-E185 PolarHBondContact N-O 3.32Å; Y121-E185 PolarHBondContact O-N 3.21Å; Y121-E185 VanDerWaalsContact O-N 3.17Å; Y121-E185 PolarHBondContact OH-OE2 3.18Å; E185-K187 WeakPolarHBondContact OE1-CE 3.24Å; E185-K187 IonicContact OE1-NZ 2.67Å; E185-K187 PolarHBondContact OE1-NZ 3.41Å
186	S	97.8	Very high	92.6	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	121.3	172.6	-55.9	0	0	0	0	109.8	I119 N120 M158 Y172 V205	I119-S186 CarbonylContact O-C 3.59Å; I119-S186 WeakPolarHBondContact O-CA 3.31Å; N120-S186 PolarHBondContact OD1-OG 3.02Å; N120-S186 VanDerWaalsContact OD1-OG 3.04Å; M158-S186 WeakPolarHBondContact CE-OG 3.32Å; Y172-S186 WeakPolarHBondContact CE1-OG 3.22Å; Y172-S186 WeakPolarHBondContact OH-CB 3.43Å; Y172-S186 PolarHBondContact OH-OG 3.2Å; S186-V205 PolarHBondContact O-N 3.28Å
187	K	97.4	Very high	92.3	Very high	56 Å²	56	55.9 Å²	55.9	24%	0.243	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	152.6	179.4	64.1	-177.5	178.1	-157.3	0	112.1	I119 E185 V189 I203 P204	I119-K187 HydrophobicContact CB-CG 3.76Å; I119-K187 HydrophobicContact CD1-CG 4.27Å; I119-K187 HydrophobicContact CG1-CG 4.01Å; I119-K187 HydrophobicContact CG2-CG 4.4Å; I119-K187 PolarHBondContact N-O 2.92Å; I119-K187 PolarHBondContact O-N 2.88Å; E185-K187 WeakPolarHBondContact OE1-CE 3.24Å; E185-K187 IonicContact OE1-NZ 2.67Å; E185-K187 PolarHBondContact OE1-NZ 3.41Å; K187-V189 HydrophobicContact CD-CG2 4.09Å; K187-V189 HydrophobicContact CG-CG2 4.09Å; K187-I203 VanDerWaalsContact CA-O 3.24Å; K187-I203 WeakPolarHBondContact CA-O 3.27Å; K187-I203 WeakPolarHBondContact CB-O 3.49Å; K187-P204 HydrophobicContact CB-CB 4.26Å
188	I	98	Very high	92.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.5	166.7	60.5	165.1	0	0	0	109.6	Y56 Y92 I118 V168 F170 G202 I203 F218	Y56-I188 HydrophobicContact CD1-CD1 3.96Å; Y56-I188 HydrophobicContact CD2-CD1 4.15Å; Y56-I188 HydrophobicContact CE1-CD1 4.12Å; Y56-I188 HydrophobicContact CE2-CD1 4.31Å; Y56-I188 HydrophobicContact CG-CD1 4Å; Y92-I188 HydrophobicContact CE2-CD1 4.19Å; Y92-I188 HydrophobicContact CE2-CG1 4.49Å; I118-I188 HydrophobicContact CG1-CG2 4.36Å; I118-I188 HydrophobicContact CG2-CG2 4.34Å; V168-I188 HydrophobicContact CB-CG2 4.44Å; V168-I188 HydrophobicContact CG1-CG2 3.99Å; F170-I188 HydrophobicContact CE2-CG2 4.4Å; F170-I188 HydrophobicContact CZ-CG2 3.79Å; I188-G202 CarbonylContact O-C 3.59Å; I188-G202 VanDerWaalsContact O-CA 3.29Å; I188-G202 WeakPolarHBondContact O-CA 3.5Å; I188-I203 HydrophobicContact CD1-CD1 4.11Å; I188-I203 HydrophobicContact CG1-CB 3.97Å; I188-I203 HydrophobicContact CG1-CD1 4.25Å; I188-I203 HydrophobicContact CG1-CG1 4.36Å; I188-I203 PolarHBondContact N-O 3.45Å; I188-I203 PolarHBondContact O-N 3.28Å; I188-F218 HydrophobicContact CD1-CB 3.68Å; I188-F218 HydrophobicContact CD1-CD1 3.59Å; I188-F218 HydrophobicContact CD1-CD2 4.27Å; I188-F218 HydrophobicContact CD1-CE1 4.27Å; I188-F218 HydrophobicContact CD1-CG 3.58Å; I188-F218 HydrophobicContact CG1-CD1 3.87Å; I188-F218 HydrophobicContact CG1-CD2 4.43Å; I188-F218 HydrophobicContact CG1-CE1 4.03Å; I188-F218 HydrophobicContact CG1-CG 4.07Å; I188-F218 HydrophobicContact CG1-CZ 4.37Å; I188-F218 HydrophobicContact CG2-CD2 3.96Å; I188-F218 HydrophobicContact CG2-CE2 4.08Å; I188-F218 HydrophobicContact CG2-CG 4.35Å
189	V	97.7	Very high	92.3	Very high	17 Å²	17	49.4 Å²	49.4	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.6	-178.5	-173.7	0	0	0	0	110	Y91 G116 I117 K187 D200 H201	Y91-V189 WeakPolarHBondContact CE1-O 3.2Å; Y91-V189 PolarHBondContact OH-N 2.95Å; Y91-V189 VanDerWaalsContact OH-N 3.07Å; Y91-V189 PolarHBondContact OH-O 3.47Å; G116-V189 CarbonylContact C-O 3.52Å; G116-V189 WeakPolarHBondContact CA-O 3.3Å; I117-V189 HydrophobicContact CB-CB 4.4Å; I117-V189 PolarHBondContact N-O 3.37Å; I117-V189 PolarHBondContact O-N 2.83Å; K187-V189 HydrophobicContact CD-CG2 4.09Å; K187-V189 HydrophobicContact CG-CG2 4.09Å; V189-D200 HydrophobicContact CG1-CB 3.88Å; V189-H201 CarbonylContact C-O 3.46Å; V189-H201 WeakPolarHBondContact CA-O 3.48Å
190	G	96.4	Very high	92.4	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142.3	173.7	0	0	0	0	0	112.2	D200 H201	G190-D200 WeakPolarHBondContact O-CA 3.03Å; G190-H201 PolarHBondContact N-O 2.96Å; G190-H201 PolarHBondContact O-N 3.1Å
191	T	94.3	Very high	92.6	Very high	21 Å²	21	48.4 Å²	48.4	13%	0.129	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.2	177.6	-57.9	0	0	0	0	110.7	K94 I115 N198 D200	K94-T191 PolarHBondContact NZ-O 3.27Å; I115-T191 PolarHBondContact O-N 3.24Å; T191-N198 HydrophobicContact CG2-CB 3.66Å; T191-D200 PolarHBondContact OG1-OD1 2.92Å
192	I	91.6	Very high	92.7	Very high	11 Å²	11	48.5 Å²	48.5	6%	0.056	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.5	-175.8	-58.6	176.9	0	0	0	109.5	N27 I29 Y54 V199 H201	N27-I192 HydrophobicContact CB-CG2 4.04Å; N27-I192 WeakPolarHBondContact ND2-CG2 3.25Å; I29-I192 HydrophobicContact CD1-CD1 4.01Å; I29-I192 HydrophobicContact CG2-CD1 3.86Å; I29-I192 HydrophobicContact CG2-CG2 3.97Å; Y54-I192 HydrophobicContact CE1-CD1 4.45Å; I192-V199 WeakPolarHBondContact CB-O 3.23Å; I192-V199 PolarHBondContact N-O 3.04Å; I192-V199 PolarHBondContact O-N 2.97Å; I192-H201 HydrophobicContact CD1-CB 3.86Å
193	R	88.6	Confident	92.9	Very high	191 Å²	191	44.7 Å²	44.7	72%	0.721	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.8	179.6	-171	173.8	-177.1	152.4	1.8	110.4
194	C	89	Confident	93	Very high	20 Å²	20	45.7 Å²	45.7	14%	0.135	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	95.9	-179	-65.6	0	0	0	0	110.7	C30 G196 V197 V199	C30-C194 WeakPolarHBondContact CA-SG 3.32Å; C30-C194 HydrophobicContact CB-CB 3.62Å; C30-C194 WeakPolarHBondContact CB-SG 3.39Å; C30-C194 WeakPolarHBondContact SG-CA 3.35Å; C30-C194 WeakPolarHBondContact SG-CB 3.23Å; C30-C194 CovalentContact SG-SG 2.04Å; C30-C194 PolarHBondContact SG-SG 2.84Å; C194-G196 PolarHBondContact O-N 2.93Å; C194-V197 PolarHBondContact N-O 3.4Å; C194-V197 PolarHBondContact O-N 3.04Å; C194-V199 HydrophobicContact CB-CG2 4.12Å
195	G	81.1	Confident	93.2	Very high	84 Å²	84	45.2 Å²	45.2	87%	0.866	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	12.6	172	0	0	0	0	0	116.5
196	G	83.8	Confident	93.3	Very high	58 Å²	58	44.1 Å²	44.1	60%	0.598	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.8	-16.2	-175.3	0	0	0	0	0	114.5	C194	C194-G196 PolarHBondContact O-N 2.93Å
197	V	88.3	Confident	93.2	Very high	101 Å²	101	45.8 Å²	45.8	61%	0.612	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	141	174.3	-179.4	0	0	0	0	109.6	C194	C194-V197 PolarHBondContact N-O 3.4Å; C194-V197 PolarHBondContact O-N 3.04Å
198	N	90	Very high	93.1	Very high	109 Å²	109	48.9 Å²	48.9	58%	0.583	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	132.6	170.7	-74.7	-19.6	0	0	0	109.8	T191	T191-N198 HydrophobicContact CG2-CB 3.66Å
199	V	91.1	Very high	93.1	Very high	10 Å²	10	49.5 Å²	49.5	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.1	178	174.7	0	0	0	0	108.2	I192 C194	I192-V199 WeakPolarHBondContact CB-O 3.23Å; I192-V199 PolarHBondContact N-O 3.04Å; I192-V199 PolarHBondContact O-N 2.97Å; C194-V199 HydrophobicContact CB-CG2 4.12Å
200	D	92.9	Very high	93.1	Very high	96 Å²	96	48.8 Å²	48.8	51%	0.513	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.6	174	-63.6	-32.7	0	0	0	110.6	V189 G190 T191	V189-D200 HydrophobicContact CG1-CB 3.88Å; G190-D200 WeakPolarHBondContact O-CA 3.03Å; T191-D200 PolarHBondContact OG1-OD1 2.92Å
201	H	94.8	Very high	93.1	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	115.4	171.3	173.1	-87.7	0	0	0	108.3	I29 Y54 Y92 V189 G190 I192 I203	I29-H201 HydrophobicContact CD1-CB 3.88Å; Y54-H201 WeakPolarHBondContact CB-NE2 3.45Å; Y92-H201 HydrophobicContact CE1-CB 4.12Å; Y92-H201 AromaticContact CE1-ND1 3.38Å; Y92-H201 WeakPolarHBondContact CE1-ND1 3.27Å; Y92-H201 AromaticContact CZ-ND1 3.65Å; Y92-H201 PolarHBondContact OH-ND1 2.83Å; Y92-H201 PolarHBondContact OH-O 3.44Å; V189-H201 CarbonylContact C-O 3.46Å; V189-H201 WeakPolarHBondContact CA-O 3.48Å; G190-H201 PolarHBondContact N-O 2.96Å; G190-H201 PolarHBondContact O-N 3.1Å; I192-H201 HydrophobicContact CD1-CB 3.86Å; H201-I203 VanDerWaalsContact CE1-CG1 3.44Å; H201-I203 WeakPolarHBondContact CE1-CG1 3.11Å
202	G	95.9	Very high	93.2	Very high	29 Å²	29	54.6 Å²	54.6	30%	0.299	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.7	-178.4	0	0	0	0	0	111.7	I188	I188-G202 CarbonylContact O-C 3.59Å; I188-G202 VanDerWaalsContact O-CA 3.29Å; I188-G202 WeakPolarHBondContact O-CA 3.5Å
203	I	97.6	Very high	93.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	100	174.3	-52.1	174.4	0	0	0	108.2	H53 Y56 K187 I188 H201 F218	H53-I203 HydrophobicContact CB-CD1 3.76Å; H53-I203 HydrophobicContact CB-CG1 4.21Å; Y56-I203 HydrophobicContact CD2-CD1 4.1Å; Y56-I203 HydrophobicContact CG-CD1 4.09Å; K187-I203 VanDerWaalsContact CA-O 3.24Å; K187-I203 WeakPolarHBondContact CA-O 3.27Å; K187-I203 WeakPolarHBondContact CB-O 3.49Å; I188-I203 HydrophobicContact CD1-CD1 4.11Å; I188-I203 HydrophobicContact CG1-CB 3.97Å; I188-I203 HydrophobicContact CG1-CD1 4.25Å; I188-I203 HydrophobicContact CG1-CG1 4.36Å; I188-I203 PolarHBondContact N-O 3.45Å; I188-I203 PolarHBondContact O-N 3.28Å; H201-I203 VanDerWaalsContact CE1-CG1 3.44Å; H201-I203 WeakPolarHBondContact CE1-CG1 3.11Å; I203-F218 HydrophobicContact CB-CE1 4.09Å; I203-F218 HydrophobicContact CG2-CD1 4.27Å; I203-F218 HydrophobicContact CG2-CE1 3.66Å
204	P	97.3	Very high	94	Very high	78 Å²	78	45.5 Å²	45.5	51%	0.506	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	139.6	178.7	32.5	-33.4	0	0	0	112.1	K187 P206	K187-P204 HydrophobicContact CB-CB 4.26Å; P204-P206 WeakPolarHBondContact O-CD 3.33Å
205	V	98.1	Very high	94.5	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-73.8	124	162.1	-176.4	0	0	0	0	107.3	M58 I60 F170 S186 A207 W209 I210 V216 F218	M58-V205 HydrophobicContact SD-CG2 4.34Å; I60-V205 HydrophobicContact CD1-CG1 4.26Å; F170-V205 HydrophobicContact CD2-CG2 3.93Å; F170-V205 HydrophobicContact CE2-CG2 4.21Å; S186-V205 PolarHBondContact O-N 3.28Å; V205-A207 PolarHBondContact O-N 3.24Å; V205-W209 HydrophobicContact CG1-CB 4.23Å; V205-I210 HydrophobicContact CB-CD1 4.49Å; V205-I210 HydrophobicContact CB-CG1 4.4Å; V205-I210 HydrophobicContact CG1-CG1 3.92Å; V205-V216 HydrophobicContact CG1-CG2 3.89Å; V205-V216 HydrophobicContact CG2-CB 4.43Å; V205-V216 HydrophobicContact CG2-CG1 3.86Å; V205-V216 HydrophobicContact CG2-CG2 4.18Å; V205-F218 HydrophobicContact CG2-CE2 4.25Å; V205-F218 HydrophobicContact CG2-CZ 3.73Å
206	P	97.1	Very high	95.3	Very high	33 Å²	33	41.1 Å²	41.1	21%	0.214	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-61.9	130.2	177.6	-17.2	27.6	0	0	0	110.1	P204 K208 W209	P204-P206 WeakPolarHBondContact O-CD 3.33Å; P206-K208 HydrophobicContact CB-CG 4.34Å; P206-K208 PolarHBondContact O-N 2.79Å; P206-W209 WeakPolarHBondContact O-CB 3.3Å; P206-W209 PolarHBondContact O-N 3.27Å
207	A	96.3	Very high	96	Very high	37 Å²	37	39 Å²	39	31%	0.306	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-53.4	-31.6	-172.5	0	0	0	0	0	113.9	V205 W209 I210	V205-A207 PolarHBondContact O-N 3.24Å; A207-W209 PolarHBondContact O-N 2.86Å; A207-W209 VanDerWaalsContact O-N 3.07Å; A207-I210 PolarHBondContact O-N 3.03Å
208	K	95.6	Very high	96.5	Very high	122 Å²	122	34.2 Å²	34.2	53%	0.53	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-58.7	-20.9	175.8	72.2	176.5	-171.9	172.1	0	114.5	E44 P206 K211	E44-K208 VanDerWaalsContact OE1-CE 3.24Å; E44-K208 WeakPolarHBondContact OE1-CE 3.25Å; E44-K208 IonicContact OE1-NZ 2.66Å; E44-K208 PolarHBondContact OE1-NZ 2.88Å; P206-K208 HydrophobicContact CB-CG 4.34Å; P206-K208 PolarHBondContact O-N 2.79Å; K208-K211 WeakPolarHBondContact O-CD 3.02Å; K208-K211 WeakPolarHBondContact O-CE 3.28Å
209	W	97.5	Very high	96.7	Very high	12 Å²	12	29.8 Å²	29.8	5%	0.045	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-95.5	-9.9	177.8	-72	106	0	0	0	113.2	E44 N45 R49 I60 R62 V205 P206 A207 K211 T214	E44-W209 HydrophobicContact CG-CZ2 4.09Å; N45-W209 WeakPolarHBondContact O-CH2 3.29Å; N45-W209 WeakPolarHBondContact O-CZ2 3.38Å; R49-W209 HydrophobicContact CB-CH2 4.08Å; R49-W209 HydrophobicContact CB-CZ2 3.63Å; I60-W209 HydrophobicContact CB-CD2 4.39Å; I60-W209 HydrophobicContact CB-CE3 4.23Å; I60-W209 HydrophobicContact CD1-CB 3.9Å; I60-W209 HydrophobicContact CD1-CD2 4.12Å; I60-W209 HydrophobicContact CD1-CG 3.7Å; I60-W209 HydrophobicContact CG2-CB 4.07Å; I60-W209 HydrophobicContact CG2-CD2 3.75Å; I60-W209 HydrophobicContact CG2-CE3 3.35Å; I60-W209 HydrophobicContact CG2-CG 4.08Å; I60-W209 HydrophobicContact CG2-CZ3 3.98Å; R62-W209 HydrophobicContact CG-CE3 3.98Å; R62-W209 HydrophobicContact CG-CZ3 3.75Å; V205-W209 HydrophobicContact CG1-CB 4.23Å; P206-W209 WeakPolarHBondContact O-CB 3.3Å; P206-W209 PolarHBondContact O-N 3.27Å; A207-W209 PolarHBondContact O-N 2.86Å; A207-W209 VanDerWaalsContact O-N 3.07Å; W209-K211 VanDerWaalsContact C-N 3.26Å; W209-K211 PolarHBondContact O-N 2.76Å; W209-T214 WeakPolarHBondContact O-CB 3.1Å; W209-T214 VanDerWaalsContact O-CG2 3.28Å; W209-T214 WeakPolarHBondContact O-CG2 3.41Å; W209-T214 PolarHBondContact O-OG1 3.42Å
210	I	97.6	Very high	96.9	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	19%	0.189	C	C	.	.			trans	-81.7	78.4	177.2	-53.7	176.3	0	0	0	108.2	M158 Y172 L184 V205 A207	M158-I210 HydrophobicContact CE-CG2 3.79Å; Y172-I210 HydrophobicContact CD1-CG2 3.98Å; Y172-I210 HydrophobicContact CD2-CB 4.31Å; Y172-I210 HydrophobicContact CD2-CG2 3.91Å; Y172-I210 HydrophobicContact CE1-CG2 4.04Å; Y172-I210 HydrophobicContact CE2-CB 4.14Å; Y172-I210 HydrophobicContact CE2-CG1 4.02Å; Y172-I210 HydrophobicContact CE2-CG2 3.98Å; Y172-I210 HydrophobicContact CG-CG2 3.92Å; L184-I210 HydrophobicContact CB-CB 4.21Å; L184-I210 HydrophobicContact CB-CD1 3.88Å; L184-I210 HydrophobicContact CB-CG2 4.06Å; L184-I210 HydrophobicContact CD1-CB 4.11Å; L184-I210 HydrophobicContact CD1-CG2 4.08Å; L184-I210 HydrophobicContact CD2-CG2 4.29Å; L184-I210 HydrophobicContact CG-CG2 4.38Å; V205-I210 HydrophobicContact CB-CD1 4.49Å; V205-I210 HydrophobicContact CB-CG1 4.4Å; V205-I210 HydrophobicContact CG1-CG1 3.92Å; A207-I210 PolarHBondContact O-N 3.03Å
211	K	96.7	Very high	96.8	Very high	96 Å²	96	28.5 Å²	28.5	42%	0.417	17%	0.169	S	C	.	.			trans	-134.2	155.5	-176.8	-67	-179.3	175.1	175.6	0	110.8	K208 W209 G213 T214	K208-K211 WeakPolarHBondContact O-CD 3.02Å; K208-K211 WeakPolarHBondContact O-CE 3.28Å; W209-K211 VanDerWaalsContact C-N 3.26Å; W209-K211 PolarHBondContact O-N 2.76Å; K211-G213 PolarHBondContact O-N 3.02Å; K211-T214 WeakPolarHBondContact O-CB 3.16Å; K211-T214 PolarHBondContact O-N 3.47Å; K211-T214 VanDerWaalsContact O-N 3.15Å; K211-T214 PolarHBondContact O-OG1 2.84Å
212	S	97.4	Very high	96.6	Very high	48 Å²	48	29.2 Å²	29.2	34%	0.336	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48	135.7	174.7	-53.5	0	0	0	0	112.8	Y172 N174 I175 T214	Y172-S212 CarbonylContact O-C 3.53Å; N174-S212 WeakPolarHBondContact CA-OG 3.32Å; N174-S212 PolarHBondContact N-OG 2.94Å; I175-S212 PolarHBondContact N-OG 3.36Å; I175-S212 PolarHBondContact O-OG 2.83Å; I175-S212 VanDerWaalsContact O-OG 3.11Å; S212-T214 VanDerWaalsContact C-N 3.31Å
213	G	97.8	Very high	96.1	Very high	11 Å²	11	34.2 Å²	34.2	11%	0.113	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	23	-179.5	0	0	0	0	0	113.8	R62 N63 Q64 Y172 K211	R62-G213 CarbonylContact C-O 3.53Å; N63-G213 PolarHBondContact N-O 2.91Å; Q64-G213 PolarHBondContact N-O 2.64Å; Q64-G213 WeakPolarHBondContact O-CA 3.48Å; Y172-G213 PolarHBondContact O-N 2.92Å; K211-G213 PolarHBondContact O-N 3.02Å
214	T	98.5	Very high	95.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.3	176.6	-48.8	0	0	0	0	111.1	I60 R61 R62 Y171 Y172 W209 K211 S212	I60-T214 HydrophobicContact CG2-CG2 3.44Å; I60-T214 VanDerWaalsContact CG2-CG2 3.44Å; R61-T214 CarbonylContact O-C 3.37Å; R61-T214 WeakPolarHBondContact O-CA 3.44Å; R62-T214 HydrophobicContact CG-CG2 4.19Å; Y171-T214 WeakPolarHBondContact CA-O 3.44Å; Y171-T214 WeakPolarHBondContact CD2-O 3.38Å; Y172-T214 PolarHBondContact N-O 2.87Å; Y172-T214 VanDerWaalsContact N-O 3.08Å; W209-T214 WeakPolarHBondContact O-CB 3.1Å; W209-T214 VanDerWaalsContact O-CG2 3.28Å; W209-T214 WeakPolarHBondContact O-CG2 3.41Å; W209-T214 PolarHBondContact O-OG1 3.42Å; K211-T214 WeakPolarHBondContact O-CB 3.16Å; K211-T214 PolarHBondContact O-N 3.47Å; K211-T214 VanDerWaalsContact O-N 3.15Å; K211-T214 PolarHBondContact O-OG1 2.84Å; S212-T214 VanDerWaalsContact C-N 3.31Å
215	L	98.6	Very high	95.5	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.058	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.1	172.9	179.6	63.5	0	0	0	109.1	I60 R61 Q64 P67 F170 Y171 E217	I60-L215 CarbonylContact C-O 3.57Å; I60-L215 WeakPolarHBondContact CA-O 3.02Å; R61-L215 PolarHBondContact N-O 3.2Å; R61-L215 VanDerWaalsContact NH2-CD2 3.34Å; R61-L215 PolarHBondContact O-N 2.84Å; Q64-L215 HydrophobicContact CB-CB 4.02Å; Q64-L215 HydrophobicContact CG-CB 3.87Å; P67-L215 HydrophobicContact CG-CD1 4.28Å; F170-L215 CarbonylContact O-C 3.47Å; F170-L215 WeakPolarHBondContact O-CA 3.44Å; Y171-L215 HydrophobicContact CD2-CB 4.35Å; L215-E217 HydrophobicContact CD1-CG 4.43Å; L215-E217 HydrophobicContact CD2-CG 4.39Å; L215-E217 HydrophobicContact CG-CG 4.1Å
216	V	98.7	Very high	95	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134	172.5	-176.1	0	0	0	0	108.4	M58 R59 I60 S169 F170 Y172 V205 F218	M58-V216 HydrophobicContact CG-CG1 3.85Å; M58-V216 HydrophobicContact SD-CG1 4.1Å; R59-V216 CarbonylContact O-C 3.6Å; R59-V216 VanDerWaalsContact O-CA 3.32Å; R59-V216 WeakPolarHBondContact O-CA 3.43Å; I60-V216 HydrophobicContact CG1-CG1 4.2Å; I60-V216 HydrophobicContact CG1-CG2 4.16Å; I60-V216 HydrophobicContact CG2-CG2 4.17Å; S169-V216 CarbonylContact C-O 3.58Å; S169-V216 WeakPolarHBondContact CA-O 3.2Å; F170-V216 HydrophobicContact CB-CB 4.21Å; F170-V216 PolarHBondContact N-O 3Å; F170-V216 PolarHBondContact O-N 2.78Å; Y172-V216 HydrophobicContact CE2-CG2 3.88Å; V205-V216 HydrophobicContact CG1-CG2 3.89Å; V205-V216 HydrophobicContact CG2-CB 4.43Å; V205-V216 HydrophobicContact CG2-CG1 3.86Å; V205-V216 HydrophobicContact CG2-CG2 4.18Å; V216-F218 HydrophobicContact CG1-CD2 4.3Å; V216-F218 HydrophobicContact CG1-CE2 3.66Å; V216-F218 HydrophobicContact CG1-CZ 3.83Å
217	E	98.1	Very high	94.6	Very high	14 Å²	14	40.6 Å²	40.6	7%	0.065	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122.3	179.8	-67.2	176.4	115.2	0	0	109.8	M58 R59 R61 K167 L215	M58-E217 WeakPolarHBondContact CA-O 3.44Å; R59-E217 HydrophobicContact CB-CB 4.49Å; R59-E217 PolarHBondContact N-O 2.03Å; R59-E217 PolarHBondContact O-N 2.85Å; R61-E217 IonicContact CZ-OE2 3.47Å; R61-E217 IonicContact NE-OE2 3.43Å; R61-E217 PolarHBondContact NE-OE2 2.82Å; R61-E217 VanDerWaalsContact NH2-CD 3.34Å; R61-E217 IonicContact NH2-OE1 3.49Å; R61-E217 PolarHBondContact NH2-OE1 2.77Å; R61-E217 IonicContact NH2-OE2 2.71Å; R61-E217 PolarHBondContact NH2-OE2 3.45Å; K167-E217 HydrophobicContact CD-CB 4.15Å; K167-E217 HydrophobicContact CD-CG 4.23Å; K167-E217 IonicContact NZ-OE1 3.19Å; K167-E217 PolarHBondContact NZ-OE1 2.81Å; L215-E217 HydrophobicContact CD1-CG 4.43Å; L215-E217 HydrophobicContact CD2-CG 4.39Å; L215-E217 HydrophobicContact CG-CG 4.1Å
218	F	98	Very high	94.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	124.3	171.7	-59.3	-86.1	0	0	0	109.6	Y56 S57 M58 K167 V168 F170 I188 I203 V205 V216	Y56-F218 HydrophobicContact CD1-CB 3.95Å; Y56-F218 HydrophobicContact CE1-CB 4.49Å; S57-F218 WeakPolarHBondContact O-CA 3.44Å; M58-F218 HydrophobicContact CB-CD1 4.03Å; M58-F218 HydrophobicContact CB-CE1 3.99Å; M58-F218 HydrophobicContact CG-CD1 4.09Å; M58-F218 HydrophobicContact CG-CE1 3.7Å; M58-F218 HydrophobicContact CG-CZ 4.21Å; M58-F218 HydrophobicContact SD-CE1 3.61Å; M58-F218 HydrophobicContact SD-CZ 3.88Å; K167-F218 WeakPolarHBondContact CA-O 3.4Å; K167-F218 WeakPolarHBondContact CG-O 3.38Å; V168-F218 HydrophobicContact CB-CB 4.36Å; V168-F218 HydrophobicContact CB-CD2 4.45Å; V168-F218 PolarHBondContact N-O 3.03Å; V168-F218 PolarHBondContact O-N 2.91Å; F170-F218 AromaticContact CD2-CE2 3.72Å; F170-F218 HydrophobicContact CD2-CE2 3.72Å; F170-F218 HydrophobicContact CD2-CZ 4.47Å; F170-F218 HydrophobicContact CE2-CD2 4.46Å; F170-F218 AromaticContact CE2-CE2 3.49Å; F170-F218 HydrophobicContact CE2-CE2 3.49Å; F170-F218 VanDerWaalsContact CE2-CE2 3.49Å; F170-F218 HydrophobicContact CE2-CZ 4.13Å; F170-F218 HydrophobicContact CZ-CE2 4.12Å; I188-F218 HydrophobicContact CD1-CB 3.68Å; I188-F218 HydrophobicContact CD1-CD1 3.59Å; I188-F218 HydrophobicContact CD1-CD2 4.27Å; I188-F218 HydrophobicContact CD1-CE1 4.27Å; I188-F218 HydrophobicContact CD1-CG 3.58Å; I188-F218 HydrophobicContact CG1-CD1 3.87Å; I188-F218 HydrophobicContact CG1-CD2 4.43Å; I188-F218 HydrophobicContact CG1-CE1 4.03Å; I188-F218 HydrophobicContact CG1-CG 4.07Å; I188-F218 HydrophobicContact CG1-CZ 4.37Å; I188-F218 HydrophobicContact CG2-CD2 3.96Å; I188-F218 HydrophobicContact CG2-CE2 4.08Å; I188-F218 HydrophobicContact CG2-CG 4.35Å; I203-F218 HydrophobicContact CB-CE1 4.09Å; I203-F218 HydrophobicContact CG2-CD1 4.27Å; I203-F218 HydrophobicContact CG2-CE1 3.66Å; V205-F218 HydrophobicContact CG2-CE2 4.25Å; V205-F218 HydrophobicContact CG2-CZ 3.73Å; V216-F218 HydrophobicContact CG1-CD2 4.3Å; V216-F218 HydrophobicContact CG1-CE2 3.66Å; V216-F218 HydrophobicContact CG1-CZ 3.83Å
219	E	95.9	Very high	94.2	Very high	17 Å²	17	42.6 Å²	42.6	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.2	177.9	-166.4	179.8	166.4	0	0	110	Y56 S57 I221 K265	Y56-E219 CarbonylContact C-O 3.55Å; Y56-E219 WeakPolarHBondContact CA-O 3.15Å; Y56-E219 WeakPolarHBondContact CD1-O 3.19Å; S57-E219 PolarHBondContact N-O 2.98Å; S57-E219 PolarHBondContact O-N 2.82Å; E219-I221 PolarHBondContact O-N 3.47Å; E219-K265 WeakPolarHBondContact OE1-CE 3.44Å; E219-K265 IonicContact OE1-NZ 2.64Å; E219-K265 PolarHBondContact OE1-NZ 2.99Å; E219-K265 WeakPolarHBondContact OE2-CE 3.08Å; E219-K265 IonicContact OE2-NZ 3.47Å; E219-K265 PolarHBondContact OE2-NZ 2.77Å
220	S	93.9	Very high	93.9	Very high	59 Å²	59	44.3 Å²	44.3	41%	0.413	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.8	-179.9	56.3	0	0	0	0	111	N55	N55-S220 WeakPolarHBondContact O-CA 3.49Å
221	I	92.1	Very high	93.6	Very high	20 Å²	20	46.4 Å²	46.4	10%	0.103	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-85.4	117.6	170.4	-62.5	171	0	0	0	107.4	L52 N55 Y56 E219 S226 I254	L52-I221 HydrophobicContact CB-CD1 4.48Å; L52-I221 HydrophobicContact CD2-CD1 4.04Å; N55-I221 PolarHBondContact O-N 3.24Å; Y56-I221 VanDerWaalsContact C-CD1 3.45Å; Y56-I221 WeakPolarHBondContact O-CD1 3.4Å; E219-I221 PolarHBondContact O-N 3.47Å; I221-S226 WeakPolarHBondContact CG2-OG 3.37Å; I221-I254 HydrophobicContact CG2-CG2 4.15Å
222	G	89.2	Confident	93.4	Very high	16 Å²	16	46.6 Å²	46.6	17%	0.165	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-73.1	155.3	178.4	0	0	0	0	0	113.5	S226 E255	G222-S226 PolarHBondContact O-OG 3.5Å; G222-E255 VanDerWaalsContact CA-CD 3.41Å; G222-E255 WeakPolarHBondContact CA-OE1 3.43Å
223	E	86.6	Confident	93.2	Very high	134 Å²	134	46.3 Å²	46.3	63%	0.626	25%	0.247	S	C	*	.	H	α-helix	trans	-83.7	-21	-172.5	-62.9	179.3	175.9	0	0	113.5	S226 E255	E223-S226 PolarHBondContact O-N 3.34Å; E223-E255 PolarHBondContact N-OE1 3.02Å
224	I	88.7	Confident	93	Very high	83 Å²	83	45.8 Å²	45.8	43%	0.426	24%	0.241	S	C	.	.	H	α-helix	trans	-68.8	-48.8	-172.1	-58.9	172.5	0	0	0	110.1	Q227 Y228 T242 E255	I224-Q227 VanDerWaalsContact O-CG 3.24Å; I224-Q227 WeakPolarHBondContact O-CG 3.39Å; I224-Q227 PolarHBondContact O-NE2 3.28Å; I224-Y228 WeakPolarHBondContact O-CE2 3.49Å; I224-T242 HydrophobicContact CB-CG2 4.32Å; I224-T242 HydrophobicContact CG2-CG2 4.1Å; I224-E255 VanDerWaalsContact CB-OE1 3.27Å; I224-E255 WeakPolarHBondContact CB-OE1 3.39Å; I224-E255 PolarHBondContact N-OE1 3.15Å
225	C	92.4	Very high	92.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-76.2	-30.7	177.9	-61.3	0	0	0	0	111.6	Q227 Y228 C244 C253 E255	C225-Q227 PolarHBondContact O-N 2.93Å; C225-Y228 VanDerWaalsContact O-CD2 3.28Å; C225-Y228 WeakPolarHBondContact O-CD2 3.42Å; C225-Y228 PolarHBondContact O-N 2.65Å; C225-C244 HydrophobicContact CB-CB 3.82Å; C225-C244 WeakPolarHBondContact CB-SG 3.32Å; C225-C244 WeakPolarHBondContact SG-CA 3.41Å; C225-C244 WeakPolarHBondContact SG-CB 3.36Å; C225-C244 CovalentContact SG-SG 2.02Å; C225-C244 PolarHBondContact SG-SG 3.33Å; C225-C253 CarbonylContact C-O 3.53Å; C225-C253 VanDerWaalsContact O-CB 3.25Å; C225-C253 WeakPolarHBondContact O-CB 3.4Å; C225-C253 PolarHBondContact O-SG 2.96Å; C225-C253 VanDerWaalsContact O-SG 3.4Å; C225-E255 HydrophobicContact CB-CG 3.75Å; C225-E255 WeakPolarHBondContact SG-CG 3.4Å
226	S	89.2	Confident	92.2	Very high	44 Å²	44	60 Å²	60	31%	0.308	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-15.9	-176.6	-66.6	0	0	0	0	114.4	I221 G222 E223 Y228 C253	I221-S226 WeakPolarHBondContact CG2-OG 3.37Å; G222-S226 PolarHBondContact O-OG 3.5Å; E223-S226 PolarHBondContact O-N 3.34Å; S226-Y228 VanDerWaalsContact C-N 3.33Å; S226-C253 WeakPolarHBondContact CA-O 3.43Å
227	Q	87.9	Confident	91.6	Very high	127 Å²	127	60.8 Å²	60.8	59%	0.593	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-17.5	175.9	77.5	-167.6	-24.2	0	0	113.9	I224 C225	I224-Q227 VanDerWaalsContact O-CG 3.24Å; I224-Q227 WeakPolarHBondContact O-CG 3.39Å; I224-Q227 PolarHBondContact O-NE2 3.28Å; C225-Q227 PolarHBondContact O-N 2.93Å
228	Y	91.5	Very high	91	Very high	69 Å²	69	63.3 Å²	63.3	27%	0.271	32%	0.321	S	S	.	.			trans	-89.8	124.2	-179.6	-54.4	-68.3	0	0	0	110.2	I224 C225 S226 S237 C253	I224-Y228 WeakPolarHBondContact O-CE2 3.49Å; C225-Y228 VanDerWaalsContact O-CD2 3.28Å; C225-Y228 WeakPolarHBondContact O-CD2 3.42Å; C225-Y228 PolarHBondContact O-N 2.65Å; S226-Y228 VanDerWaalsContact C-N 3.33Å; Y228-S237 VanDerWaalsContact CD2-OG 3.3Å; Y228-S237 WeakPolarHBondContact CD2-OG 3.41Å; Y228-S237 WeakPolarHBondContact CE2-OG 3.15Å; Y228-C253 WeakPolarHBondContact O-CB 3.18Å
229	N	91.2	Very high	90.4	Very high	131 Å²	131	67.2 Å²	67.2	70%	0.701	35%	0.345	S	S	*	.			trans	-109.7	6.8	-171.6	65.4	-12	0	0	0	113.8	W246	N229-W246 WeakPolarHBondContact O-CH2 3.29Å
230	T	91.8	Very high	89.7	Confident	49 Å²	49	75.3 Å²	75.3	30%	0.301	39%	0.388	S	S	.	.	S	Bend	trans	-131.1	154.3	172.4	85.8	0	0	0	0	110.6	E232 T233 C234	T230-E232 VanDerWaalsContact C-N 3.3Å; T230-E232 VanDerWaalsContact CB-OE2 3.28Å; T230-E232 WeakPolarHBondContact CB-OE2 3.16Å; T230-E232 PolarHBondContact O-N 3.26Å; T230-E232 PolarHBondContact OG1-OE2 2.86Å; T230-T233 PolarHBondContact N-OG1 3.5Å; T230-T233 PolarHBondContact O-N 2.87Å; T230-T233 PolarHBondContact O-OG1 3.38Å; T230-T233 WeakPolarHBondContact OG1-CG2 3.41Å; T230-T233 PolarHBondContact OG1-N 3.11Å; T230-T233 PolarHBondContact OG1-OG1 2.98Å; T230-C234 VanDerWaalsContact O-CB 3.27Å; T230-C234 WeakPolarHBondContact O-CB 3.23Å; T230-C234 PolarHBondContact O-N 2.9Å
231	I	91.7	Very high	89.3	Confident	45 Å²	45	81.3 Å²	81.3	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-55.8	-44.6	176.6	-172.2	179.3	0	0	0	111.7	T233 C234 Q235 W246 E248	I231-T233 PolarHBondContact O-N 2.94Å; I231-C234 PolarHBondContact O-N 3.39Å; I231-Q235 HydrophobicContact CG1-CG 4.34Å; I231-Q235 WeakPolarHBondContact O-CB 3.43Å; I231-Q235 WeakPolarHBondContact O-CG 3.33Å; I231-Q235 PolarHBondContact O-N 3.13Å; I231-W246 HydrophobicContact CB-CD2 4.1Å; I231-W246 HydrophobicContact CB-CG 3.94Å; I231-W246 HydrophobicContact CG1-CB 4.08Å; I231-W246 HydrophobicContact CG1-CG 3.84Å; I231-E248 VanDerWaalsContact CD1-OE1 3.23Å; I231-E248 WeakPolarHBondContact CD1-OE1 3.44Å
232	E	91.6	Very high	89.2	Confident	101 Å²	101	81.1 Å²	81.1	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-70.3	-35.3	-175.6	-50.1	77.3	-170.4	0	0	111.7	T230 R236	T230-E232 VanDerWaalsContact C-N 3.3Å; T230-E232 VanDerWaalsContact CB-OE2 3.28Å; T230-E232 WeakPolarHBondContact CB-OE2 3.16Å; T230-E232 PolarHBondContact O-N 3.26Å; T230-E232 PolarHBondContact OG1-OE2 2.86Å; E232-R236 VanDerWaalsContact O-CB 3.3Å; E232-R236 WeakPolarHBondContact O-CB 3.48Å; E232-R236 VanDerWaalsContact O-CG 3.24Å; E232-R236 WeakPolarHBondContact O-CG 3.41Å; E232-R236 PolarHBondContact O-N 3.13Å; E232-R236 PolarHBondContact O-NE 3.24Å
233	T	93.9	Very high	89.4	Confident	42 Å²	42	82.4 Å²	82.4	26%	0.258	41%	0.411	S	S	.	.	H	α-helix	trans	-73.8	-40.8	177.2	52.4	0	0	0	0	110.9	T230 I231 S237	T230-T233 PolarHBondContact N-OG1 3.5Å; T230-T233 PolarHBondContact O-N 2.87Å; T230-T233 PolarHBondContact O-OG1 3.38Å; T230-T233 WeakPolarHBondContact OG1-CG2 3.41Å; T230-T233 PolarHBondContact OG1-N 3.11Å; T230-T233 PolarHBondContact OG1-OG1 2.98Å; I231-T233 PolarHBondContact O-N 2.94Å; T233-S237 WeakPolarHBondContact O-CB 3.49Å; T233-S237 PolarHBondContact O-N 2.71Å; T233-S237 VanDerWaalsContact O-N 3.15Å
234	C	93.8	Very high	89.8	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-59.1	-52.8	174.7	-177.1	0	0	0	0	111.8	T230 I231 R236 S237 C244 I245 W246 C253	T230-C234 VanDerWaalsContact O-CB 3.27Å; T230-C234 WeakPolarHBondContact O-CB 3.23Å; T230-C234 PolarHBondContact O-N 2.9Å; I231-C234 PolarHBondContact O-N 3.39Å; C234-R236 PolarHBondContact O-N 3.4Å; C234-S237 PolarHBondContact O-N 3.11Å; C234-S237 PolarHBondContact O-OG 2.97Å; C234-C244 WeakPolarHBondContact O-CB 3.44Å; C234-I245 VanDerWaalsContact SG-C 3.5Å; C234-W246 HydrophobicContact CB-CB 4.36Å; C234-W246 HydrophobicContact CB-CE3 3.76Å; C234-C253 VanDerWaalsContact CA-SG 3.5Å; C234-C253 HydrophobicContact CB-CB 3.63Å; C234-C253 WeakPolarHBondContact CB-SG 3.3Å; C234-C253 WeakPolarHBondContact SG-CB 3.37Å; C234-C253 CovalentContact SG-SG 2.02Å; C234-C253 PolarHBondContact SG-SG 2.67Å
235	Q	89	Confident	90	Very high	118 Å²	118	73.3 Å²	73.3	55%	0.551	37%	0.368	S	S	*	.	H	α-helix	trans	-64.4	-40.4	-177.9	-71.5	175	-14.2	0	0	112.4	I231 S237	I231-Q235 HydrophobicContact CG1-CG 4.34Å; I231-Q235 WeakPolarHBondContact O-CB 3.43Å; I231-Q235 WeakPolarHBondContact O-CG 3.33Å; I231-Q235 PolarHBondContact O-N 3.13Å; Q235-S237 VanDerWaalsContact C-N 3.27Å; Q235-S237 PolarHBondContact O-N 3.03Å
236	R	90.3	Very high	90.1	Very high	192 Å²	192	74.7 Å²	74.7	73%	0.725	37%	0.373	S	S	*	.	H	α-helix	trans	-70.2	-19.2	178.3	-75.4	-176.8	-67.8	165.7	-3.7	114.3	E232 C234 T238	E232-R236 VanDerWaalsContact O-CB 3.3Å; E232-R236 WeakPolarHBondContact O-CB 3.48Å; E232-R236 VanDerWaalsContact O-CG 3.24Å; E232-R236 WeakPolarHBondContact O-CG 3.41Å; E232-R236 PolarHBondContact O-N 3.13Å; E232-R236 PolarHBondContact O-NE 3.24Å; C234-R236 PolarHBondContact O-N 3.4Å; R236-T238 VanDerWaalsContact C-N 3.26Å; R236-T238 PolarHBondContact O-N 3.18Å
237	S	87	Confident	90.3	Very high	16 Å²	16	72.6 Å²	72.6	11%	0.112	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-3.6	-178.4	68.9	0	0	0	0	115	Y228 T233 C234 Q235 T239 C244	Y228-S237 VanDerWaalsContact CD2-OG 3.3Å; Y228-S237 WeakPolarHBondContact CD2-OG 3.41Å; Y228-S237 WeakPolarHBondContact CE2-OG 3.15Å; T233-S237 WeakPolarHBondContact O-CB 3.49Å; T233-S237 PolarHBondContact O-N 2.71Å; T233-S237 VanDerWaalsContact O-N 3.15Å; C234-S237 PolarHBondContact O-N 3.11Å; C234-S237 PolarHBondContact O-OG 2.97Å; Q235-S237 VanDerWaalsContact C-N 3.27Å; Q235-S237 PolarHBondContact O-N 3.03Å; S237-T239 WeakPolarHBondContact O-CG2 3.28Å; S237-T239 PolarHBondContact O-N 3.02Å; S237-C244 PolarHBondContact OG-SG 2.82Å
238	T	84.7	Confident	90.5	Very high	66 Å²	66	70.7 Å²	70.7	41%	0.405	35%	0.35	S	S	.	.			trans	-62.5	126.7	176.4	-65.9	0	0	0	0	110.5	R236 T242 T243 C244	R236-T238 VanDerWaalsContact C-N 3.26Å; R236-T238 PolarHBondContact O-N 3.18Å; T238-T242 CarbonylContact C-O 3.59Å; T238-T242 WeakPolarHBondContact CA-O 3.32Å; T238-T243 HydrophobicContact CG2-CG2 4.29Å; T238-C244 PolarHBondContact OG1-N 3.42Å
239	T	85.6	Confident	90.4	Very high	82 Å²	82	71.8 Å²	71.8	50%	0.503	36%	0.356	S	S	.	.			trans	-122.5	175.2	177.9	68.9	0	0	0	0	110.4	S237 K241 T242	S237-T239 WeakPolarHBondContact O-CG2 3.28Å; S237-T239 PolarHBondContact O-N 3.02Å; T239-K241 PolarHBondContact O-N 3.46Å; T239-K241 VanDerWaalsContact O-N 3.08Å; T239-K241 PolarHBondContact OG1-N 2.89Å; T239-T242 PolarHBondContact N-O 2.81Å; T239-T242 PolarHBondContact O-N 3.28Å; T239-T242 PolarHBondContact OG1-N 2.97Å
240	L	80.7	Confident	90.2	Very high	187 Å²	187	65.8 Å²	65.8	98%	0.979	33%	0.325	S	S	*	.	S	Bend	trans	-58	-21.7	175.4	-68.4	173.9	0	0	0	114.5
241	K	85.5	Confident	90.2	Very high	185 Å²	185	70.3 Å²	70.3	80%	0.804	34%	0.343	S	S	*	.	S	Bend	trans	-110.7	-15.6	-177.5	-67.2	-174	179.2	-177.7	0	113.7	T239	T239-K241 PolarHBondContact O-N 3.46Å; T239-K241 VanDerWaalsContact O-N 3.08Å; T239-K241 PolarHBondContact OG1-N 2.89Å
242	T	90.9	Very high	90.2	Very high	17 Å²	17	70.1 Å²	70.1	10%	0.104	34%	0.34	C	S	.	.			trans	-141.5	117.9	-170.5	-54.5	0	0	0	0	109.4	I224 T238 T239 E255 N257	I224-T242 HydrophobicContact CB-CG2 4.32Å; I224-T242 HydrophobicContact CG2-CG2 4.1Å; T238-T242 CarbonylContact C-O 3.59Å; T238-T242 WeakPolarHBondContact CA-O 3.32Å; T239-T242 PolarHBondContact N-O 2.81Å; T239-T242 PolarHBondContact O-N 3.28Å; T239-T242 PolarHBondContact OG1-N 2.97Å; T242-E255 HydrophobicContact CG2-CG 4.17Å; T242-N257 VanDerWaalsContact CA-OD1 3.23Å; T242-N257 WeakPolarHBondContact CA-OD1 3.29Å
243	T	93.1	Very high	90.3	Very high	43 Å²	43	65.3 Å²	65.3	26%	0.264	32%	0.318	S	S	.	.			trans	-104.9	126.8	176.6	-55.9	0	0	0	0	108.9	T238 S256 N257	T238-T243 HydrophobicContact CG2-CG2 4.29Å; T243-S256 PolarHBondContact O-N 2.84Å; T243-N257 PolarHBondContact N-OD1 2.9Å
244	C	94.2	Very high	90.3	Very high	10 Å²	10	63.5 Å²	63.5	7%	0.068	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.9	-179.8	-61.5	0	0	0	0	111.1	C225 C234 S237 T238 I254	C225-C244 HydrophobicContact CB-CB 3.82Å; C225-C244 WeakPolarHBondContact CB-SG 3.32Å; C225-C244 WeakPolarHBondContact SG-CA 3.41Å; C225-C244 WeakPolarHBondContact SG-CB 3.36Å; C225-C244 CovalentContact SG-SG 2.02Å; C225-C244 PolarHBondContact SG-SG 3.33Å; C234-C244 WeakPolarHBondContact O-CB 3.44Å; S237-C244 PolarHBondContact OG-SG 2.82Å; T238-C244 PolarHBondContact OG1-N 3.42Å; C244-I254 WeakPolarHBondContact CA-O 3.49Å
245	I	93.4	Very high	90.3	Very high	16 Å²	16	65 Å²	65	8%	0.082	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.4	175	-62.6	175.9	0	0	0	108.5	C234 C253 I254 S256 K265 V266 C269	C234-I245 VanDerWaalsContact SG-C 3.5Å; I245-C253 CarbonylContact O-C 3.56Å; I245-C253 WeakPolarHBondContact O-CA 3.33Å; I245-I254 HydrophobicContact CB-CG1 4.31Å; I245-I254 PolarHBondContact N-O 3.16Å; I245-I254 PolarHBondContact O-N 2.86Å; I245-S256 WeakPolarHBondContact CD1-OG 3.41Å; I245-K265 HydrophobicContact CD1-CB 3.92Å; I245-V266 HydrophobicContact CD1-CB 4.34Å; I245-V266 HydrophobicContact CD1-CG2 3.42Å; I245-V266 VanDerWaalsContact CD1-CG2 3.42Å; I245-V266 HydrophobicContact CG1-CG2 4.22Å; I245-C269 HydrophobicContact CG2-CB 3.88Å
246	W	94.2	Very high	90.5	Very high	29 Å²	29	59.4 Å²	59.4	11%	0.11	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131.2	172	-175.9	-106.3	0	0	0	110.4	N229 I231 C234 E248 C253	N229-W246 WeakPolarHBondContact O-CH2 3.29Å; I231-W246 HydrophobicContact CB-CD2 4.1Å; I231-W246 HydrophobicContact CB-CG 3.94Å; I231-W246 HydrophobicContact CG1-CB 4.08Å; I231-W246 HydrophobicContact CG1-CG 3.84Å; C234-W246 HydrophobicContact CB-CB 4.36Å; C234-W246 HydrophobicContact CB-CE3 3.76Å; W246-E248 VanDerWaalsContact CD1-OE1 3.31Å; W246-E248 VanDerWaalsContact NE1-CD 3.26Å; W246-E248 PolarHBondContact NE1-OE2 2.79Å; W246-C253 HydrophobicContact CE3-CB 3.89Å; W246-C253 HydrophobicContact CZ3-CB 4.14Å
247	C	93.7	Very high	90.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	103.7	174.3	-51.2	0	0	0	0	108.9	L52 K249 G250 E251 K252 I254 C269	L52-C247 HydrophobicContact CD1-CB 4.44Å; C247-K249 PolarHBondContact O-N 3.31Å; C247-G250 CarbonylContact O-C 3.39Å; C247-G250 VanDerWaalsContact O-CA 3.32Å; C247-G250 WeakPolarHBondContact O-CA 3.26Å; C247-G250 PolarHBondContact O-N 3.49Å; C247-E251 PolarHBondContact O-N 2.96Å; C247-K252 PolarHBondContact N-O 2.87Å; C247-K252 PolarHBondContact O-N 3.04Å; C247-I254 VanDerWaalsContact SG-CD1 3.55Å; C247-C269 HydrophobicContact CB-CB 3.6Å; C247-C269 WeakPolarHBondContact CB-SG 3.45Å; C247-C269 WeakPolarHBondContact SG-CB 3.16Å; C247-C269 CovalentContact SG-SG 2.03Å; C247-C269 PolarHBondContact SG-SG 3.35Å
248	E	92	Very high	90.3	Very high	86 Å²	86	54.5 Å²	54.5	40%	0.402	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-54.4	-170	-71	-66.2	177.4	0	0	112.5	I231 W246 G250 E251 C269	I231-E248 VanDerWaalsContact CD1-OE1 3.23Å; I231-E248 WeakPolarHBondContact CD1-OE1 3.44Å; W246-E248 VanDerWaalsContact CD1-OE1 3.31Å; W246-E248 VanDerWaalsContact NE1-CD 3.26Å; W246-E248 PolarHBondContact NE1-OE2 2.79Å; E248-G250 PolarHBondContact O-N 3.34Å; E248-E251 WeakPolarHBondContact O-CG 3.46Å; E248-E251 PolarHBondContact O-N 3.02Å; E248-C269 PolarHBondContact N-O 2.91Å
249	K	90.2	Very high	90.4	Very high	92 Å²	92	56.3 Å²	56.3	40%	0.4	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23	176.9	-177.1	170.7	166.7	-161.9	0	113	N40 I41 I42 C247	N40-K249 PolarHBondContact ND2-O 2.91Å; I41-K249 WeakPolarHBondContact O-CE 3.04Å; I41-K249 PolarHBondContact O-NZ 2.93Å; I42-K249 HydrophobicContact CG2-CB 4.36Å; I42-K249 VanDerWaalsContact O-CD 3.23Å; I42-K249 WeakPolarHBondContact O-CD 3.17Å; I42-K249 WeakPolarHBondContact O-CE 3.42Å; I42-K249 PolarHBondContact O-NZ 3.15Å; C247-K249 PolarHBondContact O-N 3.31Å
250	G	87.8	Confident	90.3	Very high	6 Å²	6	59.5 Å²	59.5	6%	0.062	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.8	175	0	0	0	0	0	113.6	N40 I42 C247 E248 K252	N40-G250 WeakPolarHBondContact ND2-CA 3.4Å; I42-G250 VanDerWaalsContact CD1-CA 3.43Å; C247-G250 CarbonylContact O-C 3.39Å; C247-G250 VanDerWaalsContact O-CA 3.32Å; C247-G250 WeakPolarHBondContact O-CA 3.26Å; C247-G250 PolarHBondContact O-N 3.49Å; E248-G250 PolarHBondContact O-N 3.34Å; G250-K252 PolarHBondContact O-N 2.79Å
251	E	90.7	Very high	90.6	Very high	143 Å²	143	51.2 Å²	51.2	67%	0.668	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.7	38.7	-163.3	-62	-178.8	179.8	0	0	111.9	C247 E248	C247-E251 PolarHBondContact O-N 2.96Å; E248-E251 WeakPolarHBondContact O-CG 3.46Å; E248-E251 PolarHBondContact O-N 3.02Å
252	K	91.4	Very high	90.9	Very high	41 Å²	41	45.2 Å²	45.2	18%	0.178	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138.5	-172.4	-167.5	170.9	-176.7	178.9	0	111.2	L52 Y54 C247 G250 I254	L52-K252 HydrophobicContact CD1-CB 4.28Å; L52-K252 HydrophobicContact CD1-CD 4.42Å; Y54-K252 PolarHBondContact O-NZ 2.81Å; C247-K252 PolarHBondContact N-O 2.87Å; C247-K252 PolarHBondContact O-N 3.04Å; G250-K252 PolarHBondContact O-N 2.79Å; K252-I254 HydrophobicContact CG-CG2 4.33Å
253	C	93.8	Very high	90.9	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.9	170.4	-171.3	0	0	0	0	110.1	C225 S226 Y228 C234 I245 W246	C225-C253 CarbonylContact C-O 3.53Å; C225-C253 VanDerWaalsContact O-CB 3.25Å; C225-C253 WeakPolarHBondContact O-CB 3.4Å; C225-C253 PolarHBondContact O-SG 2.96Å; C225-C253 VanDerWaalsContact O-SG 3.4Å; S226-C253 WeakPolarHBondContact CA-O 3.43Å; Y228-C253 WeakPolarHBondContact O-CB 3.18Å; C234-C253 VanDerWaalsContact CA-SG 3.5Å; C234-C253 HydrophobicContact CB-CB 3.63Å; C234-C253 WeakPolarHBondContact CB-SG 3.3Å; C234-C253 WeakPolarHBondContact SG-CB 3.37Å; C234-C253 CovalentContact SG-SG 2.02Å; C234-C253 PolarHBondContact SG-SG 2.67Å; I245-C253 CarbonylContact O-C 3.56Å; I245-C253 WeakPolarHBondContact O-CA 3.33Å; W246-C253 HydrophobicContact CE3-CB 3.89Å; W246-C253 HydrophobicContact CZ3-CB 4.14Å
254	I	94.1	Very high	90.7	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	153.4	-178.2	66.6	170.2	0	0	0	112	L52 I221 C244 I245 C247 K252	L52-I254 HydrophobicContact CD2-CG2 4.47Å; I221-I254 HydrophobicContact CG2-CG2 4.15Å; C244-I254 WeakPolarHBondContact CA-O 3.49Å; I245-I254 HydrophobicContact CB-CG1 4.31Å; I245-I254 PolarHBondContact N-O 3.16Å; I245-I254 PolarHBondContact O-N 2.86Å; C247-I254 VanDerWaalsContact SG-CD1 3.55Å; K252-I254 HydrophobicContact CG-CG2 4.33Å
255	E	93.9	Very high	90.6	Very high	31 Å²	31	49.6 Å²	49.6	15%	0.145	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	138.8	174.3	-74.5	176.8	-147.4	0	0	112.2	G222 E223 I224 C225 T242 N257 K265	G222-E255 VanDerWaalsContact CA-CD 3.41Å; G222-E255 WeakPolarHBondContact CA-OE1 3.43Å; E223-E255 PolarHBondContact N-OE1 3.02Å; I224-E255 VanDerWaalsContact CB-OE1 3.27Å; I224-E255 WeakPolarHBondContact CB-OE1 3.39Å; I224-E255 PolarHBondContact N-OE1 3.15Å; C225-E255 HydrophobicContact CB-CG 3.75Å; C225-E255 WeakPolarHBondContact SG-CG 3.4Å; T242-E255 HydrophobicContact CG2-CG 4.17Å; E255-N257 PolarHBondContact OE2-ND2 3.35Å; E255-K265 PolarHBondContact O-NZ 3.18Å
256	S	92.4	Very high	90.5	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.014	26%	0.262	C	S	.	.			trans	-136.9	50.6	-179.2	-162	0	0	0	0	111.6	T243 I245 H262	T243-S256 PolarHBondContact O-N 2.84Å; I245-S256 WeakPolarHBondContact CD1-OG 3.41Å; S256-H262 PolarHBondContact O-ND1 3.29Å; S256-H262 WeakPolarHBondContact OG-CA 3.25Å; S256-H262 PolarHBondContact OG-ND1 3.04Å
257	N	88.3	Confident	90.4	Very high	69 Å²	69	53.7 Å²	53.7	37%	0.369	28%	0.282	S	S	.	.			trans	-77.8	-22.5	-173.7	-55.5	-28.9	0	0	0	113.4	T242 T243 E255 P259	T242-N257 VanDerWaalsContact CA-OD1 3.23Å; T242-N257 WeakPolarHBondContact CA-OD1 3.29Å; T243-N257 PolarHBondContact N-OD1 2.9Å; E255-N257 PolarHBondContact OE2-ND2 3.35Å; N257-P259 WeakPolarHBondContact O-CD 3.14Å
258	N	86	Confident	90.3	Very high	36 Å²	36	53.9 Å²	53.9	19%	0.193	28%	0.283	C	S	.	.			trans	-84.5	113	-179.6	177.1	4	0	0	0	110.2	N165 D260 T261 H262	N165-N258 PolarHBondContact ND2-ND2 2.64Å; N258-D260 VanDerWaalsContact C-N 3.27Å; N258-D260 PolarHBondContact O-N 2.96Å; N258-D260 PolarHBondContact OD1-N 3.17Å; N258-D260 VanDerWaalsContact OD1-N 3.13Å; N258-T261 WeakPolarHBondContact CB-OG1 3.44Å; N258-T261 PolarHBondContact O-N 3.42Å; N258-T261 VanDerWaalsContact O-N 3.13Å; N258-T261 PolarHBondContact O-OG1 2.76Å; N258-T261 VanDerWaalsContact O-OG1 3.11Å; N258-H262 PolarHBondContact O-N 2.81Å
259	P	85.9	Confident	90.3	Very high	103 Å²	103	49.8 Å²	49.8	67%	0.669	26%	0.264	S	S	*	.	H	α-helix	trans	-55.5	-39.3	-178	-24.6	35	0	0	0	113.3	N257 T261 H262	N257-P259 WeakPolarHBondContact O-CD 3.14Å; P259-T261 PolarHBondContact O-N 3.21Å; P259-H262 PolarHBondContact O-N 3.17Å
260	D	85.3	Confident	90.1	Very high	149 Å²	149	48.8 Å²	48.8	80%	0.797	27%	0.268	S	S	*	.	H	α-helix	trans	-64.4	-26.3	-176.4	-61.1	-24.6	0	0	0	112.9	N258	N258-D260 VanDerWaalsContact C-N 3.27Å; N258-D260 PolarHBondContact O-N 2.96Å; N258-D260 PolarHBondContact OD1-N 3.17Å; N258-D260 VanDerWaalsContact OD1-N 3.13Å
261	T	87	Confident	89.4	Confident	13 Å²	13	51.1 Å²	51.1	8%	0.08	28%	0.281	C	S	.	.	H	α-helix	trans	-107.8	-5.6	-179.2	58.4	0	0	0	0	112.9	N258 P259 L264 K265	N258-T261 WeakPolarHBondContact CB-OG1 3.44Å; N258-T261 PolarHBondContact O-N 3.42Å; N258-T261 VanDerWaalsContact O-N 3.13Å; N258-T261 PolarHBondContact O-OG1 2.76Å; N258-T261 VanDerWaalsContact O-OG1 3.11Å; P259-T261 PolarHBondContact O-N 3.21Å; T261-L264 PolarHBondContact O-N 2.92Å; T261-K265 WeakPolarHBondContact O-CG 3.28Å; T261-K265 PolarHBondContact O-N 2.84Å
262	H	90.2	Very high	88.2	Confident	59 Å²	59	52.2 Å²	52.2	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-55.1	-170.1	177.1	77.3	0	0	0	111.7	S256 N258 P259 L264 K265 V266	S256-H262 PolarHBondContact O-ND1 3.29Å; S256-H262 WeakPolarHBondContact OG-CA 3.25Å; S256-H262 PolarHBondContact OG-ND1 3.04Å; N258-H262 PolarHBondContact O-N 2.81Å; P259-H262 PolarHBondContact O-N 3.17Å; H262-L264 VanDerWaalsContact C-N 3.27Å; H262-L264 PolarHBondContact O-N 2.88Å; H262-K265 PolarHBondContact O-N 3.23Å; H262-K265 VanDerWaalsContact O-N 3.15Å; H262-V266 WeakPolarHBondContact O-CG2 3.48Å; H262-V266 PolarHBondContact O-N 3.34Å
263	V	90.7	Very high	86.4	Confident	97 Å²	97	57.8 Å²	57.8	59%	0.588	31%	0.31	S	S	*	.	H	α-helix	trans	-58.6	-41.6	179	178.2	0	0	0	0	111.1	K265 V266 N267	V263-K265 PolarHBondContact O-N 3.29Å; V263-V266 PolarHBondContact O-N 3.02Å; V263-N267 PolarHBondContact O-N 3.13Å; V263-N267 PolarHBondContact O-ND2 2.88Å
264	L	90.5	Very high	84.2	Confident	56 Å²	56	67 Å²	67	29%	0.293	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-43.7	178.4	-175.5	60.2	0	0	0	111.6	T261 H262 N267 D268	T261-L264 PolarHBondContact O-N 2.92Å; H262-L264 VanDerWaalsContact C-N 3.27Å; H262-L264 PolarHBondContact O-N 2.88Å; L264-N267 PolarHBondContact O-N 2.97Å; L264-D268 WeakPolarHBondContact O-CB 3.28Å; L264-D268 PolarHBondContact O-N 3.04Å
265	K	92.1	Very high	81.6	Confident	9 Å²	9	71.3 Å²	71.3	4%	0.039	38%	0.381	C	S	.	.	H	α-helix	trans	-65.3	-36.7	175.7	-76	179.1	174.8	179.7	0	113	E219 I245 E255 T261 H262 V263 D268 C269	E219-K265 WeakPolarHBondContact OE1-CE 3.44Å; E219-K265 IonicContact OE1-NZ 2.64Å; E219-K265 PolarHBondContact OE1-NZ 2.99Å; E219-K265 WeakPolarHBondContact OE2-CE 3.08Å; E219-K265 IonicContact OE2-NZ 3.47Å; E219-K265 PolarHBondContact OE2-NZ 2.77Å; I245-K265 HydrophobicContact CD1-CB 3.92Å; E255-K265 PolarHBondContact O-NZ 3.18Å; T261-K265 WeakPolarHBondContact O-CG 3.28Å; T261-K265 PolarHBondContact O-N 2.84Å; H262-K265 PolarHBondContact O-N 3.23Å; H262-K265 VanDerWaalsContact O-N 3.15Å; V263-K265 PolarHBondContact O-N 3.29Å; K265-D268 PolarHBondContact O-N 2.86Å; K265-C269 WeakPolarHBondContact O-CB 3.49Å; K265-C269 PolarHBondContact O-N 2.67Å; K265-C269 VanDerWaalsContact O-N 3.15Å
266	V	91.5	Very high	78.8	Confident	34 Å²	34	77.8 Å²	77.8	21%	0.206	42%	0.417	C	S	.	.	H	α-helix	trans	-59	-53.4	173.1	173.8	0	0	0	0	109	I245 H262 V263 D268 C269 S270	I245-V266 HydrophobicContact CD1-CB 4.34Å; I245-V266 HydrophobicContact CD1-CG2 3.42Å; I245-V266 VanDerWaalsContact CD1-CG2 3.42Å; I245-V266 HydrophobicContact CG1-CG2 4.22Å; H262-V266 WeakPolarHBondContact O-CG2 3.48Å; H262-V266 PolarHBondContact O-N 3.34Å; V263-V266 PolarHBondContact O-N 3.02Å; V266-D268 VanDerWaalsContact C-N 3.27Å; V266-D268 PolarHBondContact O-N 2.79Å; V266-C269 PolarHBondContact O-N 3.21Å; V266-S270 WeakPolarHBondContact O-CB 3.33Å; V266-S270 PolarHBondContact O-N 2.97Å; V266-S270 PolarHBondContact O-OG 2.58Å
267	N	90.8	Very high	76	Confident	97 Å²	97	82.3 Å²	82.3	52%	0.519	44%	0.444	S	S	.	.	H	α-helix	trans	-60.3	-37.8	180	-66.2	-17.4	0	0	0	112.7	V263 L264 C269	V263-N267 PolarHBondContact O-N 3.13Å; V263-N267 PolarHBondContact O-ND2 2.88Å; L264-N267 PolarHBondContact O-N 2.97Å; N267-C269 PolarHBondContact O-N 2.96Å
268	D	91.8	Very high	73.3	Confident	4 Å²	4	87 Å²	87	2%	0.021	47%	0.469	C	S	.	.	H	α-helix	trans	-63.6	-28.6	176.4	-77.7	-25.5	0	0	0	113.6	I42 I43 Y48 Y50 R59 L264 K265 V266	I42-D268 WeakPolarHBondContact CG2-O 3.34Å; I43-D268 VanDerWaalsContact CD1-O 3.29Å; I43-D268 WeakPolarHBondContact CD1-O 3.47Å; Y48-D268 VanDerWaalsContact CE1-OD1 3.25Å; Y48-D268 WeakPolarHBondContact CE1-OD1 3.14Å; Y48-D268 PolarHBondContact OH-OD1 2.89Å; Y48-D268 PolarHBondContact OH-OD2 3.19Å; Y50-D268 HydrophobicContact CD1-CB 3.56Å; Y50-D268 HydrophobicContact CD2-CB 4.47Å; Y50-D268 HydrophobicContact CE1-CB 3.72Å; Y50-D268 HydrophobicContact CG-CB 3.96Å; R59-D268 IonicContact CZ-OD2 3.18Å; R59-D268 IonicContact NE-OD2 3.55Å; R59-D268 PolarHBondContact NE-OD2 3Å; R59-D268 IonicContact NH2-OD2 3.71Å; R59-D268 PolarHBondContact NH2-OD2 2.82Å; L264-D268 WeakPolarHBondContact O-CB 3.28Å; L264-D268 PolarHBondContact O-N 3.04Å; K265-D268 PolarHBondContact O-N 2.86Å; V266-D268 VanDerWaalsContact C-N 3.27Å; V266-D268 PolarHBondContact O-N 2.79Å
269	C	91.4	Very high	70.7	Confident	0 Å²	0	91.8 Å²	91.8	0%	0	50%	0.495	C	S	.	.	H	α-helix	trans	-103.6	-19.7	-173.3	-77.2	0	0	0	0	113.9	I245 C247 E248 K265 V266 N267 V271	I245-C269 HydrophobicContact CG2-CB 3.88Å; C247-C269 HydrophobicContact CB-CB 3.6Å; C247-C269 WeakPolarHBondContact CB-SG 3.45Å; C247-C269 WeakPolarHBondContact SG-CB 3.16Å; C247-C269 CovalentContact SG-SG 2.03Å; C247-C269 PolarHBondContact SG-SG 3.35Å; E248-C269 PolarHBondContact N-O 2.91Å; K265-C269 WeakPolarHBondContact O-CB 3.49Å; K265-C269 PolarHBondContact O-N 2.67Å; K265-C269 VanDerWaalsContact O-N 3.15Å; V266-C269 PolarHBondContact O-N 3.21Å; N267-C269 PolarHBondContact O-N 2.96Å; C269-V271 PolarHBondContact O-N 3.26Å
270	S	86.6	Confident	68.1	Low	71 Å²	71	94 Å²	94	50%	0.497	50%	0.5	S	S	.	.			trans	-81	9.1	177.6	-60.3	0	0	0	0	114.4	V266 E272	V266-S270 WeakPolarHBondContact O-CB 3.33Å; V266-S270 PolarHBondContact O-N 2.97Å; V266-S270 PolarHBondContact O-OG 2.58Å; S270-E272 PolarHBondContact O-N 3.46Å
271	V	74.1	Confident	65.4	Low	55 Å²	55	94.2 Å²	94.2	33%	0.333	50%	0.502	S	S	.	.			trans	-70.2	108.2	173.7	171.6	0	0	0	0	109.1	I43 C269	I43-V271 HydrophobicContact CD1-CB 4.11Å; I43-V271 HydrophobicContact CD1-CG2 3.22Å; I43-V271 HydrophobicContact CG1-CB 3.99Å; I43-V271 HydrophobicContact CG1-CG1 4.44Å; I43-V271 HydrophobicContact CG1-CG2 3.56Å; C269-V271 PolarHBondContact O-N 3.26Å
272	E	64.3	Low	62.7	Low	167 Å²	167	98.4 Å²	98.4	78%	0.78	53%	0.531	S	S	*	.			trans	-55.1	139.9	178	-67	-177.5	174.7	0	0	110.6	S270 K274	S270-E272 PolarHBondContact O-N 3.46Å; E272-K274 PolarHBondContact O-N 3.28Å
273	K	54	Low	59.7	Low	157 Å²	157	101.1 Å²	101.1	68%	0.683	56%	0.557	S	S	*	*			trans	-60	106.3	164.8	-171.5	175.4	-173.7	171.3	0	105.9	S275	K273-S275 PolarHBondContact O-N 3.33Å
274	K	47	Very low	56.6	Low	193 Å²	193	101.5 Å²	101.5	84%	0.839	56%	0.56	S	S	*	*			trans	-50	112.9	168.1	-76.4	-173.3	176.7	-176.2	0	106.5	E272 D276	E272-K274 PolarHBondContact O-N 3.28Å; K274-D276 PolarHBondContact O-N 2.79Å
275	S	39.2	Very low	53.4	Low	96 Å²	96	104.9 Å²	104.9	67%	0.671	58%	0.583	S	S	*	*			trans	-65.1	115.3	174.7	48.3	0	0	0	0	107.4	K273 V277	K273-S275 PolarHBondContact O-N 3.33Å; S275-V277 PolarHBondContact O-N 2.88Å
276	D	36.8	Very low	50.4	Low	166 Å²	166	110.5 Å²	110.5	89%	0.888	62%	0.618	S	S	*	*			trans	-69.5	67.6	163.7	-75.2	-37.3	0	0	0	108.8	K274	K274-D276 PolarHBondContact O-N 2.79Å
277	V	32.5	Very low	47.3	Very low	97 Å²	97	117.2 Å²	117.2	59%	0.588	65%	0.647	S	S	*	*			trans	-146	105.8	165.3	-174.2	0	0	0	0	106.9	S275 D279	S275-V277 PolarHBondContact O-N 2.88Å; V277-D279 VanDerWaalsContact C-N 3.3Å; V277-D279 HydrophobicContact CG1-CB 4.26Å; V277-D279 PolarHBondContact O-N 2.98Å
278	N	31.4	Very low	44.5	Very low	167 Å²	167	120.8 Å²	120.8	89%	0.893	66%	0.66	S	S	*	*			trans	-60	96.6	157	-81.4	-27	0	0	0	107.3
279	D	32	Very low	41.4	Very low	138 Å²	138	125.8 Å²	125.8	74%	0.738	70%	0.695	S	S	*	*			trans	-151	144.6	154.9	-91	-37.4	0	0	0	109.9	V277	V277-D279 VanDerWaalsContact C-N 3.3Å; V277-D279 HydrophobicContact CG1-CB 4.26Å; V277-D279 PolarHBondContact O-N 2.98Å
280	L	30.9	Very low	38.4	Very low	148 Å²	148	134.1 Å²	134.1	78%	0.775	73%	0.734	S	S	*	*			trans	-55.6	154	-160.9	-81.5	76.8	0	0	0	116.9
281	N	29.7	Very low	35.6	Very low	155 Å²	155	140.6 Å²	140.6	83%	0.829	75%	0.748	S	S	*	*			trans	33.1	105.3	144.4	-72.1	2.8	0	0	0	118.3
282	S	28.7	Very low	33.3	Very low	101 Å²	101	144.1 Å²	144.1	71%	0.706	77%	0.77	S	S	*	*				-164.5	111.3	120.8	-178.2	0	0	0	0	108.6	T284	S282-T284 PolarHBondContact O-N 2.92Å; S282-T284 PolarHBondContact OG-OG1 3.09Å
283	S	27.2	Very low	31.8	Very low	115 Å²	115	142.7 Å²	142.7	80%	0.804	77%	0.767	S	S	*	*			trans	-67.2	117.5	161.1	67.1	0	0	0	0	107.4
284	T	26.8	Very low	30.3	Very low	106 Å²	106	138.1 Å²	138.1	65%	0.65	76%	0.764	S	S	*	*			trans	-129.4	96.8	159.8	-49.2	0	0	0	0	107.5	S282 T286	S282-T284 PolarHBondContact O-N 2.92Å; S282-T284 PolarHBondContact OG-OG1 3.09Å; T284-T286 PolarHBondContact O-N 2.71Å; T284-T286 PolarHBondContact O-OG1 2.92Å
285	T	23.6	Very low	29.6	Very low	126 Å²	126	136.4 Å²	136.4	77%	0.773	76%	0.763	S	S	*	*			trans	-47.8	106.4	166.1	-51.2	0	0	0	0	108.6	E287	T285-E287 PolarHBondContact O-N 2.73Å
286	T	29.4	Very low	28.9	Very low	128 Å²	128	137.6 Å²	137.6	79%	0.785	77%	0.766	S	S	*	*			trans	-91.5	98.8	171.4	-54.5	0	0	0	0	106.7	T284 H288	T284-T286 PolarHBondContact O-N 2.71Å; T284-T286 PolarHBondContact O-OG1 2.92Å; T286-H288 PolarHBondContact O-N 3.19Å
287	E	24.4	Very low	28.3	Very low	175 Å²	175	138.8 Å²	138.8	82%	0.818	77%	0.766	S	S	*	*			trans	-56.7	119.7	168.9	-81.8	-175.1	147	0	0	109.4	T285 S289	T285-E287 PolarHBondContact O-N 2.73Å; E287-S289 PolarHBondContact O-N 3.21Å; E287-S289 VanDerWaalsContact O-N 3.1Å
288	H	31.9	Very low	28.1	Very low	171 Å²	171	140.7 Å²	140.7	79%	0.792	78%	0.778	S	S	*	*			trans	-72.5	100.7	173.5	-152.1	63.6	0	0	0	107.9	T286 E290	T286-H288 PolarHBondContact O-N 3.19Å; H288-E290 PolarHBondContact O-N 3.02Å
289	S	28	Very low	27.7	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	78%	0.775	S	S	*	*			trans	-68.1	98	174.3	-175.4	0	0	0	0	109.6	E287 R291	E287-S289 PolarHBondContact O-N 3.21Å; E287-S289 VanDerWaalsContact O-N 3.1Å; S289-R291 PolarHBondContact O-N 2.88Å
290	E	28.8	Very low	27.3	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	78%	0.782	S	S	*	*			trans	-63.7	94.6	159.9	-87.4	-177.4	149.5	0	0	108.8	H288 T292	H288-E290 PolarHBondContact O-N 3.02Å; E290-T292 PolarHBondContact O-N 3.14Å
291	R	28	Very low	27	Very low	207 Å²	207	140.7 Å²	140.7	78%	0.781	78%	0.783	S	S	*	*			trans	-85.9	86.3	169.7	-161.4	177.9	-160.3	163.1	5.5	109.4	S289 L293	S289-R291 PolarHBondContact O-N 2.88Å; R291-L293 VanDerWaalsContact C-N 3.34Å; R291-L293 PolarHBondContact O-N 3.47Å
292	T	25.8	Very low	26.8	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	79%	0.785	S	S	*	*			trans	-60.1	95.5	162.6	-55.4	0	0	0	0	108.7	E290 G294	E290-T292 PolarHBondContact O-N 3.14Å; T292-G294 VanDerWaalsContact C-N 3.3Å; T292-G294 PolarHBondContact O-N 2.87Å
293	L	31	Very low	26.9	Very low	138 Å²	138	142.9 Å²	142.9	72%	0.723	78%	0.781	S	S	*	*			trans	-74.1	84.4	173	-96	151.3	0	0	0	109	R291 I295	R291-L293 VanDerWaalsContact C-N 3.34Å; R291-L293 PolarHBondContact O-N 3.47Å; L293-I295 PolarHBondContact O-N 2.78Å
294	G	22.7	Very low	27.3	Very low	61 Å²	61	143.1 Å²	143.1	63%	0.629	78%	0.778	S	S	*	*			trans	-66.7	108.9	161.7	0	0	0	0	0	109.4	T292 T296	T292-G294 VanDerWaalsContact C-N 3.3Å; T292-G294 PolarHBondContact O-N 2.87Å; G294-T296 PolarHBondContact O-N 2.85Å
295	I	32.9	Very low	27.9	Very low	157 Å²	157	143.9 Å²	143.9	81%	0.805	78%	0.778	S	S	*	*			trans	-88.7	101.1	167.7	-61.9	175.2	0	0	0	106.5	L293	L293-I295 PolarHBondContact O-N 2.78Å
296	T	25.1	Very low	28.8	Very low	120 Å²	120	145 Å²	145	74%	0.736	77%	0.774	S	S	*	*			trans	-67.5	132.5	169.5	-43.1	0	0	0	0	109.6	G294 V298	G294-T296 PolarHBondContact O-N 2.85Å; T296-V298 PolarHBondContact O-N 3.11Å
297	E	23.8	Very low	29.5	Very low	191 Å²	191	144.4 Å²	144.4	89%	0.893	77%	0.767	S	S	*	*			trans	-55.2	122.4	169.1	-67.4	176.1	143.9	0	0	110.4
298	V	27.7	Very low	30.5	Very low	138 Å²	138	144.2 Å²	144.2	84%	0.836	76%	0.763	S	S	*	*			trans	-121.9	134.1	165.7	176.9	0	0	0	0	109.4	T296	T296-V298 PolarHBondContact O-N 3.11Å
299	Q	23.6	Very low	31.2	Very low	177 Å²	177	142.5 Å²	142.5	83%	0.827	76%	0.756	S	S	*	*			trans	-53.2	137.4	-165.1	-73.5	166.9	-29.7	0	0	116.8	T301	Q299-T301 PolarHBondContact O-N 2.95Å
300	T	23.1	Very low	32.4	Very low	145 Å²	145	144 Å²	144	89%	0.89	75%	0.75	S	S	*	*			trans	-43.8	106.8	157	-44.4	0	0	0	0	112.5
301	T	25.2	Very low	33.7	Very low	130 Å²	130	142.7 Å²	142.7	80%	0.798	74%	0.742	S	S	*	*			trans	-112	133.6	159.7	13.7	0	0	0	0	109.8	Q299 T303	Q299-T301 PolarHBondContact O-N 2.95Å; T301-T303 PolarHBondContact O-N 2.81Å
302	K	24.9	Very low	35.4	Very low	200 Å²	200	135.9 Å²	135.9	87%	0.87	73%	0.726	S	S	*	*			trans	-61.3	119.8	-172.8	-71	168	173.8	171	0	111.9
303	T	30.3	Very low	37	Very low	102 Å²	102	134 Å²	134	63%	0.626	71%	0.708	S	S	*	*			trans	-124.7	84.5	157.4	-0.8	0	0	0	0	108.7	T301	T301-T303 PolarHBondContact O-N 2.81Å
304	T	36.9	Very low	38.8	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	70%	0.699	S	S	*	*			trans	-105.8	87.3	161.8	-42.3	0	0	0	0	102.8
305	D	39.7	Very low	41	Very low	123 Å²	123	138.2 Å²	138.2	66%	0.658	70%	0.696	S	S	*	*	S	Bend		-159.6	-2	108	-83.4	-36.9	0	0	0	114.8	N307	D305-N307 VanDerWaalsContact C-N 3.3Å; D305-N307 PolarHBondContact O-N 3.43Å
306	E	41.5	Very low	42.9	Very low	148 Å²	148	135.4 Å²	135.4	69%	0.692	68%	0.682	S	S	*	*	H	α-helix	trans	-70.7	-25	178.5	-70.7	-175.5	151.2	0	0	113.4	K308 Q309 H310	E306-K308 VanDerWaalsContact C-N 3.31Å; E306-K308 PolarHBondContact O-N 3.48Å; E306-Q309 PolarHBondContact O-N 3.04Å; E306-H310 PolarHBondContact O-N 2.71Å
307	N	45.3	Very low	45.4	Very low	117 Å²	117	137.4 Å²	137.4	63%	0.626	68%	0.678	S	S	*	*	H	α-helix	trans	-71.8	-21.3	-172.5	-122.7	-16.4	0	0	0	114	D305 K311	D305-N307 VanDerWaalsContact C-N 3.3Å; D305-N307 PolarHBondContact O-N 3.43Å; N307-K311 PolarHBondContact O-N 3.49Å
308	K	44.9	Very low	47.8	Very low	171 Å²	171	131.3 Å²	131.3	74%	0.743	65%	0.653	S	S	*	*	H	α-helix	trans	-75	-38.4	174.8	-86.5	-178.3	178.8	172.3	0	111.8	E306 S312	E306-K308 VanDerWaalsContact C-N 3.31Å; E306-K308 PolarHBondContact O-N 3.48Å; K308-S312 PolarHBondContact O-N 3Å; K308-S312 VanDerWaalsContact O-N 3.13Å
309	Q	46.3	Very low	50.1	Low	135 Å²	135	126.4 Å²	126.4	63%	0.631	62%	0.624	S	S	*	*	H	α-helix	trans	-71.1	-40.9	-178.9	-164.1	169	0	0	0	111.1	E306 K311 S312 H313	E306-Q309 PolarHBondContact O-N 3.04Å; Q309-K311 PolarHBondContact O-N 3.29Å; Q309-S312 PolarHBondContact O-N 3.1Å; Q309-H313 PolarHBondContact O-CD2 3.2Å; Q309-H313 PolarHBondContact O-N 3.34Å; Q309-H313 VanDerWaalsContact O-N 3.11Å
310	H	53.2	Low	52.7	Low	140 Å²	140	122.4 Å²	122.4	65%	0.648	61%	0.607	S	S	*	*	H	α-helix	trans	-66.4	-37.6	177.4	-159	-84.2	0	0	0	112.8	E306 W314	E306-H310 PolarHBondContact O-N 2.71Å; H310-W314 VanDerWaalsContact O-CB 3.31Å; H310-W314 WeakPolarHBondContact O-CB 3.41Å; H310-W314 PolarHBondContact O-N 2.86Å
311	K	56.7	Low	55.5	Low	148 Å²	148	118.1 Å²	118.1	64%	0.643	58%	0.581	S	S	*	*	H	α-helix	trans	-65.1	-41.9	174.2	-94.7	-176.8	176.8	178	0	112.8	N307 Q309 W314 Y315	N307-K311 PolarHBondContact O-N 3.49Å; Q309-K311 PolarHBondContact O-N 3.29Å; K311-W314 PolarHBondContact O-N 2.79Å; K311-Y315 WeakPolarHBondContact O-CB 3.47Å; K311-Y315 PolarHBondContact O-N 2.5Å
312	S	62.8	Low	58.2	Low	63 Å²	63	116.5 Å²	116.5	44%	0.441	57%	0.568	S	S	.	*	H	α-helix	trans	-59.2	-49.6	177	171.4	0	0	0	0	111.2	K308 Q309 Y315 L316	K308-S312 PolarHBondContact O-N 3Å; K308-S312 VanDerWaalsContact O-N 3.13Å; Q309-S312 PolarHBondContact O-N 3.1Å; S312-Y315 PolarHBondContact O-N 2.94Å; S312-L316 WeakPolarHBondContact O-CB 3.44Å; S312-L316 PolarHBondContact O-N 2.91Å
313	H	59.2	Low	60.9	Low	89 Å²	89	110.1 Å²	110.1	41%	0.412	55%	0.545	S	S	.	.	H	α-helix	trans	-66.1	-43	179.4	-76.8	-118.9	0	0	0	111.7	Q309 Y315 L316 Y317	Q309-H313 PolarHBondContact O-CD2 3.2Å; Q309-H313 PolarHBondContact O-N 3.34Å; Q309-H313 VanDerWaalsContact O-N 3.11Å; H313-Y315 VanDerWaalsContact C-N 3.31Å; H313-Y315 PolarHBondContact O-N 3.43Å; H313-L316 PolarHBondContact O-N 3.33Å; H313-Y317 HydrophobicContact CB-CD2 4.15Å; H313-Y317 HydrophobicContact CB-CE2 4.29Å; H313-Y317 AromaticContact ND1-CE2 3.7Å; H313-Y317 WeakPolarHBondContact O-CD2 3.14Å; H313-Y317 PolarHBondContact O-N 3.36Å
314	W	69.8	Low	63.4	Low	144 Å²	144	107.5 Å²	107.5	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-59.5	-41.6	177	178.9	60.8	0	0	0	112.5	H310 K311 V318	H310-W314 VanDerWaalsContact O-CB 3.31Å; H310-W314 WeakPolarHBondContact O-CB 3.41Å; H310-W314 PolarHBondContact O-N 2.86Å; K311-W314 PolarHBondContact O-N 2.79Å; W314-V318 VanDerWaalsContact O-CB 3.28Å; W314-V318 WeakPolarHBondContact O-CB 3.24Å; W314-V318 PolarHBondContact O-N 2.85Å
315	Y	69.1	Low	65.6	Low	145 Å²	145	103.3 Å²	103.3	57%	0.569	51%	0.509	S	S	*	.	I	π-helix	trans	-66.1	-42.8	177.9	-153	-94	0	0	0	112	K311 S312 H313 V319 I320	K311-Y315 WeakPolarHBondContact O-CB 3.47Å; K311-Y315 PolarHBondContact O-N 2.5Å; S312-Y315 PolarHBondContact O-N 2.94Å; H313-Y315 VanDerWaalsContact C-N 3.31Å; H313-Y315 PolarHBondContact O-N 3.43Å; Y315-V319 HydrophobicContact CD2-CB 4.18Å; Y315-V319 HydrophobicContact CD2-CG1 4.4Å; Y315-V319 HydrophobicContact CD2-CG2 3.93Å; Y315-V319 HydrophobicContact CE2-CB 4.34Å; Y315-V319 HydrophobicContact CE2-CG1 4.05Å; Y315-V319 HydrophobicContact CE2-CG2 4.29Å; Y315-V319 HydrophobicContact CG-CB 4.32Å; Y315-V319 HydrophobicContact CG-CG2 4.38Å; Y315-V319 WeakPolarHBondContact O-CB 3.46Å; Y315-V319 PolarHBondContact O-N 3.12Å; Y315-I320 PolarHBondContact O-N 2.94Å
316	L	71.9	Confident	67.7	Low	98 Å²	98	102.4 Å²	102.4	51%	0.513	50%	0.504	S	S	.	.	I	π-helix	trans	-69.2	-40.6	-177.8	-122.4	139.8	0	0	0	113	S312 H313 I320	S312-L316 WeakPolarHBondContact O-CB 3.44Å; S312-L316 PolarHBondContact O-N 2.91Å; H313-L316 PolarHBondContact O-N 3.33Å; L316-I320 HydrophobicContact CG-CD1 4.24Å
317	Y	76.8	Confident	69.7	Low	162 Å²	162	101.8 Å²	101.8	64%	0.635	50%	0.499	S	S	*	.	I	π-helix	trans	-96.3	-21	-172.9	-66.5	-69.4	0	0	0	114.7	H313 P321	H313-Y317 HydrophobicContact CB-CD2 4.15Å; H313-Y317 HydrophobicContact CB-CE2 4.29Å; H313-Y317 AromaticContact ND1-CE2 3.7Å; H313-Y317 WeakPolarHBondContact O-CD2 3.14Å; H313-Y317 PolarHBondContact O-N 3.36Å; Y317-P321 WeakPolarHBondContact O-CG 3.37Å
318	V	75.4	Confident	71.7	Confident	63 Å²	63	100.3 Å²	100.3	38%	0.382	49%	0.491	S	S	.	.	I	π-helix	trans	-112.8	-49	-176.4	-174.7	0	0	0	0	111.6	W314 L322	W314-V318 VanDerWaalsContact O-CB 3.28Å; W314-V318 WeakPolarHBondContact O-CB 3.24Å; W314-V318 PolarHBondContact O-N 2.85Å; V318-L322 HydrophobicContact CG1-CD1 4Å; V318-L322 WeakPolarHBondContact O-CB 3.37Å; V318-L322 PolarHBondContact O-N 3.44Å
319	V	74.9	Confident	73.7	Confident	35 Å²	35	96.3 Å²	96.3	21%	0.212	48%	0.477	C	S	.	.	I	π-helix	trans	-74.3	-46.6	-173.3	-177.2	0	0	0	0	111.7	Y315 L322 V323	Y315-V319 HydrophobicContact CD2-CB 4.18Å; Y315-V319 HydrophobicContact CD2-CG1 4.4Å; Y315-V319 HydrophobicContact CD2-CG2 3.93Å; Y315-V319 HydrophobicContact CE2-CB 4.34Å; Y315-V319 HydrophobicContact CE2-CG1 4.05Å; Y315-V319 HydrophobicContact CE2-CG2 4.29Å; Y315-V319 HydrophobicContact CG-CB 4.32Å; Y315-V319 HydrophobicContact CG-CG2 4.38Å; Y315-V319 WeakPolarHBondContact O-CB 3.46Å; Y315-V319 PolarHBondContact O-N 3.12Å; V319-L322 PolarHBondContact O-N 3.41Å; V319-V323 HydrophobicContact CG1-CG2 4.18Å; V319-V323 WeakPolarHBondContact O-CG2 3.47Å; V319-V323 PolarHBondContact O-N 2.94Å
320	I	79.1	Confident	75.5	Confident	92 Å²	92	92.9 Å²	92.9	47%	0.472	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-46.8	-179.4	-62.4	174.9	0	0	0	111.9	Y315 L316 L322 V323 A324	Y315-I320 PolarHBondContact O-N 2.94Å; L316-I320 HydrophobicContact CG-CD1 4.24Å; I320-L322 PolarHBondContact O-N 3.44Å; I320-V323 PolarHBondContact O-N 2.97Å; I320-A324 WeakPolarHBondContact O-CB 3.46Å; I320-A324 PolarHBondContact O-N 3.29Å
321	P	82.3	Confident	77.1	Confident	55 Å²	55	90.4 Å²	90.4	36%	0.357	46%	0.457	S	S	.	.	H	α-helix	trans	-65.8	-34.9	177.5	-25.5	38.2	0	0	0	113.9	Y317 S325	Y317-P321 WeakPolarHBondContact O-CG 3.37Å; P321-S325 WeakPolarHBondContact O-CB 2.95Å; P321-S325 PolarHBondContact O-N 3.25Å; P321-S325 PolarHBondContact O-OG 3.07Å
322	L	81.5	Confident	78.3	Confident	97 Å²	97	85.2 Å²	85.2	51%	0.508	45%	0.446	S	S	.	.	H	α-helix	trans	-65.5	-43.6	175.4	-97.1	160.9	0	0	0	112.1	V318 V319 I320 S325 L326	V318-L322 HydrophobicContact CG1-CD1 4Å; V318-L322 WeakPolarHBondContact O-CB 3.37Å; V318-L322 PolarHBondContact O-N 3.44Å; V319-L322 PolarHBondContact O-N 3.41Å; I320-L322 PolarHBondContact O-N 3.44Å; L322-S325 PolarHBondContact O-N 3.08Å; L322-S325 PolarHBondContact O-OG 2.85Å; L322-L326 PolarHBondContact O-N 2.94Å
323	V	81.9	Confident	79.2	Confident	66 Å²	66	85.5 Å²	85.5	40%	0.4	45%	0.447	S	S	.	.	H	α-helix	trans	-67	-43.2	177	173.5	0	0	0	0	110.2	V319 I320 S325 L326 F327	V319-V323 HydrophobicContact CG1-CG2 4.18Å; V319-V323 WeakPolarHBondContact O-CG2 3.47Å; V319-V323 PolarHBondContact O-N 2.94Å; I320-V323 PolarHBondContact O-N 2.97Å; V323-S325 VanDerWaalsContact C-N 3.34Å; V323-S325 PolarHBondContact O-N 3.16Å; V323-L326 WeakPolarHBondContact O-CB 3.47Å; V323-L326 PolarHBondContact O-N 3.05Å; V323-F327 HydrophobicContact CG1-CD2 3.68Å; V323-F327 HydrophobicContact CG1-CE2 3.47Å; V323-F327 VanDerWaalsContact CG1-CE2 3.47Å; V323-F327 WeakPolarHBondContact O-CD2 3.47Å; V323-F327 PolarHBondContact O-N 3.41Å
324	A	81.9	Confident	80.4	Confident	46 Å²	46	86.7 Å²	86.7	38%	0.38	46%	0.455	S	S	.	.	H	α-helix	trans	-61.6	-39.5	176	0	0	0	0	0	112.7	I320 F327 L328	I320-A324 WeakPolarHBondContact O-CB 3.46Å; I320-A324 PolarHBondContact O-N 3.29Å; A324-F327 PolarHBondContact O-N 2.66Å; A324-L328 VanDerWaalsContact O-CG 3.31Å; A324-L328 WeakPolarHBondContact O-CG 3.41Å; A324-L328 PolarHBondContact O-N 3.15Å
325	S	83.5	Confident	80.9	Confident	32 Å²	32	84.2 Å²	84.2	22%	0.224	45%	0.452	C	S	.	.	H	α-helix	trans	-67.3	-39.9	176.9	71.8	0	0	0	0	111.9	P321 L322 V323 L328 I329	P321-S325 WeakPolarHBondContact O-CB 2.95Å; P321-S325 PolarHBondContact O-N 3.25Å; P321-S325 PolarHBondContact O-OG 3.07Å; L322-S325 PolarHBondContact O-N 3.08Å; L322-S325 PolarHBondContact O-OG 2.85Å; V323-S325 VanDerWaalsContact C-N 3.34Å; V323-S325 PolarHBondContact O-N 3.16Å; S325-L328 PolarHBondContact O-N 3.24Å; S325-I329 VanDerWaalsContact O-CG1 3.25Å; S325-I329 WeakPolarHBondContact O-CG1 3.39Å; S325-I329 PolarHBondContact O-N 2.81Å
326	L	84	Confident	81.6	Confident	104 Å²	104	85.9 Å²	85.9	55%	0.545	46%	0.457	S	S	.	.	H	α-helix	trans	-58.6	-46.8	171.7	-99.1	150.1	0	0	0	112	L322 V323 L328 I329 C330	L322-L326 PolarHBondContact O-N 2.94Å; V323-L326 WeakPolarHBondContact O-CB 3.47Å; V323-L326 PolarHBondContact O-N 3.05Å; L326-L328 VanDerWaalsContact C-N 3.35Å; L326-L328 PolarHBondContact O-N 2.89Å; L326-I329 PolarHBondContact O-N 2.72Å; L326-C330 PolarHBondContact O-N 3.07Å; L326-C330 PolarHBondContact O-SG 3.08Å
327	F	84.3	Confident	81.8	Confident	135 Å²	135	90.4 Å²	90.4	59%	0.592	47%	0.467	S	S	*	.	H	α-helix	trans	-61.5	-41.6	176.5	-84.4	-70.8	0	0	0	112.4	V323 A324 C330 I331	V323-F327 HydrophobicContact CG1-CD2 3.68Å; V323-F327 HydrophobicContact CG1-CE2 3.47Å; V323-F327 VanDerWaalsContact CG1-CE2 3.47Å; V323-F327 WeakPolarHBondContact O-CD2 3.47Å; V323-F327 PolarHBondContact O-N 3.41Å; A324-F327 PolarHBondContact O-N 2.66Å; F327-C330 PolarHBondContact O-N 3.16Å; F327-I331 VanDerWaalsContact O-CG1 3.25Å; F327-I331 WeakPolarHBondContact O-CG1 3.38Å; F327-I331 PolarHBondContact O-N 2.84Å
328	L	87.3	Confident	82	Confident	86 Å²	86	90 Å²	90	45%	0.45	47%	0.465	S	S	.	.	H	α-helix	trans	-65.5	-39.6	177.5	-71.8	168.1	0	0	0	112.2	F5 A324 S325 L326 I331 G332	F5-L328 HydrophobicContact CE1-CD1 3.8Å; F5-L328 HydrophobicContact CZ-CD1 3.92Å; A324-L328 VanDerWaalsContact O-CG 3.31Å; A324-L328 WeakPolarHBondContact O-CG 3.41Å; A324-L328 PolarHBondContact O-N 3.15Å; S325-L328 PolarHBondContact O-N 3.24Å; L326-L328 VanDerWaalsContact C-N 3.35Å; L326-L328 PolarHBondContact O-N 2.89Å; L328-I331 PolarHBondContact O-N 2.84Å; L328-G332 PolarHBondContact O-N 3.23Å
329	I	86.6	Confident	82.1	Confident	88 Å²	88	91.7 Å²	91.7	45%	0.451	47%	0.471	S	S	.	.	H	α-helix	trans	-63.1	-46.2	173.7	-67.9	164.5	0	0	0	110	S325 L326 I331 G332 C333	S325-I329 VanDerWaalsContact O-CG1 3.25Å; S325-I329 WeakPolarHBondContact O-CG1 3.39Å; S325-I329 PolarHBondContact O-N 2.81Å; L326-I329 PolarHBondContact O-N 2.72Å; I329-I331 PolarHBondContact O-N 2.88Å; I329-G332 PolarHBondContact O-N 3.46Å; I329-C333 PolarHBondContact O-N 2.86Å; I329-C333 PolarHBondContact O-SG 2.86Å
330	C	83.6	Confident	81.9	Confident	63 Å²	63	94.6 Å²	94.6	43%	0.426	49%	0.485	S	S	.	.	H	α-helix	trans	-60.3	-44.2	176.9	-71.1	0	0	0	0	112.3	L326 F327 C333 I334	L326-C330 PolarHBondContact O-N 3.07Å; L326-C330 PolarHBondContact O-SG 3.08Å; F327-C330 PolarHBondContact O-N 3.16Å; C330-C333 PolarHBondContact O-N 2.89Å; C330-I334 VanDerWaalsContact O-CG1 3.26Å; C330-I334 WeakPolarHBondContact O-CG1 3.23Å; C330-I334 PolarHBondContact O-N 2.76Å
331	I	86.8	Confident	81.7	Confident	87 Å²	87	100 Å²	100	45%	0.446	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-44.2	175.9	-68.3	164.7	0	0	0	110.3	F327 L328 I329 C333 I334 I335	F327-I331 VanDerWaalsContact O-CG1 3.25Å; F327-I331 WeakPolarHBondContact O-CG1 3.38Å; F327-I331 PolarHBondContact O-N 2.84Å; L328-I331 PolarHBondContact O-N 2.84Å; I329-I331 PolarHBondContact O-N 2.88Å; I331-C333 VanDerWaalsContact C-N 3.34Å; I331-C333 PolarHBondContact O-N 2.91Å; I331-I334 PolarHBondContact O-N 2.9Å; I331-I335 HydrophobicContact CG2-CD1 3.66Å; I331-I335 HydrophobicContact CG2-CG1 4.3Å; I331-I335 VanDerWaalsContact O-CG1 3.29Å; I331-I335 WeakPolarHBondContact O-CG1 3.18Å; I331-I335 PolarHBondContact O-N 2.79Å
332	G	82.3	Confident	81.1	Confident	39 Å²	39	104.8 Å²	104.8	40%	0.402	51%	0.511	S	S	.	.	H	α-helix	trans	-57.8	-44.8	174.6	0	0	0	0	0	112.4	L328 I329 I335 W336	L328-G332 PolarHBondContact O-N 3.23Å; I329-G332 PolarHBondContact O-N 3.46Å; G332-I335 PolarHBondContact O-N 2.75Å; G332-W336 VanDerWaalsContact O-CB 3.24Å; G332-W336 WeakPolarHBondContact O-CB 3.49Å; G332-W336 PolarHBondContact O-N 3.27Å
333	C	81.7	Confident	80.4	Confident	69 Å²	69	108.1 Å²	108.1	47%	0.466	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-38.7	175.5	-69.3	0	0	0	0	112.7	I329 C330 I331 R337	I329-C333 PolarHBondContact O-N 2.86Å; I329-C333 PolarHBondContact O-SG 2.86Å; C330-C333 PolarHBondContact O-N 2.89Å; I331-C333 VanDerWaalsContact C-N 3.34Å; I331-C333 PolarHBondContact O-N 2.91Å; C333-R337 WeakPolarHBondContact O-CB 3.23Å; C333-R337 WeakPolarHBondContact O-CG 3.34Å; C333-R337 PolarHBondContact O-N 3.03Å
334	I	83.4	Confident	79.5	Confident	115 Å²	115	115 Å²	115	59%	0.59	54%	0.54	S	S	*	.	H	α-helix	trans	-66.6	-46.6	176.8	-69	165.4	0	0	0	110.2	C330 I331 W336 R337 W338	C330-I334 VanDerWaalsContact O-CG1 3.26Å; C330-I334 WeakPolarHBondContact O-CG1 3.23Å; C330-I334 PolarHBondContact O-N 2.76Å; I331-I334 PolarHBondContact O-N 2.9Å; I334-W336 VanDerWaalsContact C-N 3.35Å; I334-W336 PolarHBondContact O-N 2.76Å; I334-R337 PolarHBondContact O-N 3.15Å; I334-W338 WeakPolarHBondContact O-CB 3.38Å; I334-W338 PolarHBondContact O-N 3.46Å
335	I	81.7	Confident	78.5	Confident	91 Å²	91	117.2 Å²	117.2	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-62.6	-43.7	177.7	-66.3	168.2	0	0	0	110.3	I331 G332 W338 L339	I331-I335 HydrophobicContact CG2-CD1 3.66Å; I331-I335 HydrophobicContact CG2-CG1 4.3Å; I331-I335 VanDerWaalsContact O-CG1 3.29Å; I331-I335 WeakPolarHBondContact O-CG1 3.18Å; I331-I335 PolarHBondContact O-N 2.79Å; G332-I335 PolarHBondContact O-N 2.75Å; I335-W338 PolarHBondContact O-N 3.42Å; I335-L339 HydrophobicContact CG2-CD1 4.01Å; I335-L339 HydrophobicContact CG2-CG 4.42Å; I335-L339 WeakPolarHBondContact O-CG 3.47Å; I335-L339 PolarHBondContact O-N 3.29Å
336	W	82.1	Confident	77.1	Confident	180 Å²	180	122.6 Å²	122.6	68%	0.682	58%	0.578	S	S	*	*	H	α-helix	trans	-59.9	-46.4	175.5	-177.6	-84	0	0	0	111.9	G332 I334 W338 L339 L340	G332-W336 VanDerWaalsContact O-CB 3.24Å; G332-W336 WeakPolarHBondContact O-CB 3.49Å; G332-W336 PolarHBondContact O-N 3.27Å; I334-W336 VanDerWaalsContact C-N 3.35Å; I334-W336 PolarHBondContact O-N 2.76Å; W336-W338 VanDerWaalsContact C-N 3.3Å; W336-W338 PolarHBondContact O-N 3.1Å; W336-L339 PolarHBondContact O-N 3.34Å; W336-L340 VanDerWaalsContact CD1-CD1 3.41Å; W336-L340 WeakPolarHBondContact O-CB 3.26Å; W336-L340 WeakPolarHBondContact O-CG 3.4Å; W336-L340 PolarHBondContact O-N 3.21Å
337	R	77.8	Confident	75.4	Confident	193 Å²	193	128.2 Å²	128.2	73%	0.728	60%	0.602	S	S	*	*	H	α-helix	trans	-62.6	-37	174.7	-79.3	-175.5	174.5	-157.7	-0.5	112.2	C333 I334 R341	C333-R337 WeakPolarHBondContact O-CB 3.23Å; C333-R337 WeakPolarHBondContact O-CG 3.34Å; C333-R337 PolarHBondContact O-N 3.03Å; I334-R337 PolarHBondContact O-N 3.15Å; R337-R341 PolarHBondContact O-N 3.23Å
338	W	79	Confident	75	Confident	155 Å²	155	127.9 Å²	127.9	59%	0.587	60%	0.603	S	S	*	*	H	α-helix	trans	-68.5	-42.2	177.6	-162.6	79.1	0	0	0	111.8	I334 I335 W336 R341 R342	I334-W338 WeakPolarHBondContact O-CB 3.38Å; I334-W338 PolarHBondContact O-N 3.46Å; I335-W338 PolarHBondContact O-N 3.42Å; W336-W338 VanDerWaalsContact C-N 3.3Å; W336-W338 PolarHBondContact O-N 3.1Å; W338-R341 PolarHBondContact O-N 2.91Å; W338-R342 PolarHBondContact O-N 2.81Å
339	L	77.7	Confident	74.3	Confident	98 Å²	98	130.1 Å²	130.1	51%	0.513	61%	0.611	S	S	.	*	H	α-helix	trans	-64.3	-41.6	174.1	-73.5	169.9	0	0	0	112.3	I335 W336 R341 R342 K343	I335-L339 HydrophobicContact CG2-CD1 4.01Å; I335-L339 HydrophobicContact CG2-CG 4.42Å; I335-L339 WeakPolarHBondContact O-CG 3.47Å; I335-L339 PolarHBondContact O-N 3.29Å; W336-L339 PolarHBondContact O-N 3.34Å; L339-R341 VanDerWaalsContact C-N 3.34Å; L339-R341 PolarHBondContact O-N 3.48Å; L339-R342 PolarHBondContact O-N 3.11Å; L339-K343 PolarHBondContact O-N 3.04Å
340	L	72	Confident	73.6	Confident	96 Å²	96	132.4 Å²	132.4	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-61.4	-40.6	173.8	-82.1	170.1	0	0	0	112.2	W336 K343 R344	W336-L340 VanDerWaalsContact CD1-CD1 3.41Å; W336-L340 WeakPolarHBondContact O-CB 3.26Å; W336-L340 WeakPolarHBondContact O-CG 3.4Å; W336-L340 PolarHBondContact O-N 3.21Å; L340-K343 PolarHBondContact O-N 2.83Å; L340-R344 PolarHBondContact O-N 3.25Å
341	R	73.7	Confident	73	Confident	205 Å²	205	136.5 Å²	136.5	77%	0.774	63%	0.631	S	S	*	*	H	α-helix	trans	-63.7	-40.5	173.7	-93	-172.1	-179.5	176.9	0.5	112.1	R337 W338 L339 K343 R344 S345	R337-R341 PolarHBondContact O-N 3.23Å; W338-R341 PolarHBondContact O-N 2.91Å; L339-R341 VanDerWaalsContact C-N 3.34Å; L339-R341 PolarHBondContact O-N 3.48Å; R341-K343 VanDerWaalsContact C-N 3.34Å; R341-R344 PolarHBondContact O-N 3.28Å; R341-S345 PolarHBondContact O-N 2.87Å
342	R	69.6	Low	72.2	Confident	156 Å²	156	139.6 Å²	139.6	59%	0.589	64%	0.642	S	S	*	*	H	α-helix	trans	-67.6	-35.3	-179.6	-153.1	175.2	-170.6	-178.6	2.7	112.2	W338 L339 R344 S345	W338-R342 PolarHBondContact O-N 2.81Å; L339-R342 PolarHBondContact O-N 3.11Å; R342-R344 VanDerWaalsContact C-N 3.31Å; R342-R344 PolarHBondContact O-N 2.9Å; R342-S345 PolarHBondContact O-N 3.25Å
343	K	67.4	Low	71.5	Confident	166 Å²	166	146.3 Å²	146.3	72%	0.722	66%	0.658	S	S	*	*	H	α-helix	trans	-65.8	-33.1	176.1	-144.4	178.3	-176	-173.6	0	112.4	L339 L340 R341 S345	L339-K343 PolarHBondContact O-N 3.04Å; L340-K343 PolarHBondContact O-N 2.83Å; R341-K343 VanDerWaalsContact C-N 3.34Å; K343-S345 VanDerWaalsContact C-N 3.32Å; K343-S345 PolarHBondContact O-N 3.05Å
344	R	62.8	Low	70.8	Confident	212 Å²	212	151.9 Å²	151.9	80%	0.8	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-10.8	174.6	-94.4	-172.1	-176.1	177	1.3	115.7	L340 R341 R342	L340-R344 PolarHBondContact O-N 3.25Å; R341-R344 PolarHBondContact O-N 3.28Å; R342-R344 VanDerWaalsContact C-N 3.31Å; R342-R344 PolarHBondContact O-N 2.9Å
345	S	61.7	Low	69.8	Low	92 Å²	92	154.7 Å²	154.7	64%	0.643	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-7.7	178	-174.1	0	0	0	0	112.9	R341 R342 K343	R341-S345 PolarHBondContact O-N 2.87Å; R342-S345 PolarHBondContact O-N 3.25Å; K343-S345 VanDerWaalsContact C-N 3.32Å; K343-S345 PolarHBondContact O-N 3.05Å
346	N	53.3	Low	68.8	Low	144 Å²	144	160 Å²	160	77%	0.77	70%	0.696	S	S	*	*			trans	-106.9	4.3	177.5	-78.2	5.9	0	0	0	112.4
347	E	48.8	Very low	67.6	Low	223 Å²	223	158.2 Å²	158.2	100%	1.042	70%	0.697	S	S	*	*			trans	-102.8	0	153.6	-83.5	175.7	155.4	0	0	106.9

Retrieved 347 of 347 residues in 140.8 ms (Link to these results)

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