A0AA82N7X8_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7X8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 358 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	51	Low	219 Å²	219	138.8 Å²	138.8	100%	1.079	66%	0.658	S	S	*	*				0	108.7	0	-77.8	173.8	177	0	0	108.6	Y3	M1-Y3 PolarHBondContact O-N 3.42Å
2	R	41.4	Very low	51.6	Low	246 Å²	246	136.4 Å²	136.4	93%	0.928	65%	0.652	S	S	*	*			trans	-76.7	104.5	169.7	-80.9	179.6	162.4	179.9	-5.8	107.2	N4	R2-N4 PolarHBondContact O-N 3.12Å
3	Y	48.1	Very low	52.3	Low	155 Å²	155	129.8 Å²	129.8	61%	0.608	63%	0.625	S	S	*	*			trans	-73.7	103.5	174.4	-99.9	-91.9	0	0	0	108.7	M1 F5	M1-Y3 PolarHBondContact O-N 3.42Å; Y3-F5 PolarHBondContact O-N 2.93Å
4	N	49.1	Very low	52.9	Low	143 Å²	143	132.6 Å²	132.6	77%	0.765	63%	0.628	S	S	*	*			trans	-74.4	98.9	167.4	-69.6	-26.9	0	0	0	107.7	R2 L6	R2-N4 PolarHBondContact O-N 3.12Å; N4-L6 PolarHBondContact O-N 3.49Å
5	F	44.1	Very low	53.6	Low	146 Å²	146	129.7 Å²	129.7	64%	0.64	62%	0.622	S	S	*	*			trans	-62	121.9	168.7	-95.8	-92.8	0	0	0	108.9	Y3	Y3-F5 PolarHBondContact O-N 2.93Å
6	L	54	Low	54.1	Low	116 Å²	116	125.4 Å²	125.4	61%	0.607	60%	0.603	S	S	*	*			trans	-62.3	132.8	177	-90.4	92.6	0	0	0	110	N4 S8 L9	N4-L6 PolarHBondContact O-N 3.49Å; L6-S8 PolarHBondContact O-N 2.96Å; L6-L9 PolarHBondContact O-N 3.47Å
7	P	57.6	Low	54.3	Low	97 Å²	97	124.5 Å²	124.5	63%	0.63	60%	0.596	S	S	*	*	H	α-helix	trans	-53.6	-26.1	177.9	-26.7	33.3	0	0	0	114.5	L9 W10 I11	P7-L9 VanDerWaalsContact C-N 3.3Å; P7-L9 PolarHBondContact O-N 3.28Å; P7-W10 PolarHBondContact O-N 2.65Å; P7-I11 WeakPolarHBondContact O-CG1 3.2Å; P7-I11 PolarHBondContact O-N 2.99Å
8	S	56.8	Low	54.6	Low	70 Å²	70	121.6 Å²	121.6	49%	0.49	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-30.2	-178.4	62.7	0	0	0	0	114	L6 I11 L12	L6-S8 PolarHBondContact O-N 2.96Å; S8-I11 PolarHBondContact O-N 2.84Å; S8-L12 PolarHBondContact O-N 3.19Å
9	L	54.5	Low	54.6	Low	54 Å²	54	123.9 Å²	123.9	28%	0.283	59%	0.589	S	S	.	*	H	α-helix	trans	-71.2	-36.1	178.1	-101.5	149.7	0	0	0	112	L6 P7 L12 V13 L333	L6-L9 PolarHBondContact O-N 3.47Å; P7-L9 VanDerWaalsContact C-N 3.3Å; P7-L9 PolarHBondContact O-N 3.28Å; L9-L12 PolarHBondContact O-N 3.01Å; L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 3.25Å; L9-L333 HydrophobicContact CD2-CD1 4.01Å; L9-L333 HydrophobicContact CD2-CD2 4.01Å; L9-L333 HydrophobicContact CD2-CG 3.83Å
10	W	55.5	Low	54.5	Low	170 Å²	170	121 Å²	121	64%	0.644	58%	0.576	S	S	*	*	H	α-helix	trans	-66.2	-39.3	175.6	-77.4	97.6	0	0	0	111.9	P7 L12 V13 Y14	P7-W10 PolarHBondContact O-N 2.65Å; W10-L12 VanDerWaalsContact C-N 3.35Å; W10-L12 PolarHBondContact O-N 2.89Å; W10-V13 PolarHBondContact O-N 3.24Å; W10-Y14 WeakPolarHBondContact O-CB 3.38Å; W10-Y14 PolarHBondContact O-N 2.94Å
11	I	59.6	Low	54.5	Low	111 Å²	111	122.6 Å²	122.6	57%	0.569	58%	0.578	S	S	*	*	H	α-helix	trans	-60.9	-45.2	178	-62.5	168.8	0	0	0	110.6	P7 S8 Y14 V15	P7-I11 WeakPolarHBondContact O-CG1 3.2Å; P7-I11 PolarHBondContact O-N 2.99Å; S8-I11 PolarHBondContact O-N 2.84Å; I11-Y14 PolarHBondContact O-N 2.58Å; I11-V15 HydrophobicContact CG2-CG2 4.34Å; I11-V15 VanDerWaalsContact O-CG2 3.25Å; I11-V15 WeakPolarHBondContact O-CG2 3.46Å; I11-V15 PolarHBondContact O-N 2.76Å
12	L	58.5	Low	54.9	Low	110 Å²	110	117.8 Å²	117.8	58%	0.576	55%	0.551	S	S	*	*	H	α-helix	trans	-65.3	-43.1	-178.3	-122.3	151.3	0	0	0	112.2	S8 L9 W10 V15 I16	S8-L12 PolarHBondContact O-N 3.19Å; L9-L12 PolarHBondContact O-N 3.01Å; W10-L12 VanDerWaalsContact C-N 3.35Å; W10-L12 PolarHBondContact O-N 2.89Å; L12-V15 PolarHBondContact O-N 3.33Å; L12-I16 HydrophobicContact CD2-CD1 4.09Å; L12-I16 VanDerWaalsContact O-CG1 3.3Å; L12-I16 WeakPolarHBondContact O-CG1 3.19Å; L12-I16 PolarHBondContact O-N 2.8Å; L12-I16 VanDerWaalsContact O-N 3.08Å
13	V	60.3	Low	55.3	Low	51 Å²	51	114.3 Å²	114.3	31%	0.309	54%	0.538	S	S	.	.	H	α-helix	trans	-62.1	-46	174.3	173.9	0	0	0	0	110.2	L9 W10 V15 I16 F17	L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 3.25Å; W10-V13 PolarHBondContact O-N 3.24Å; V13-V15 PolarHBondContact O-N 2.89Å; V13-I16 PolarHBondContact O-N 2.93Å; V13-F17 HydrophobicContact CG1-CD2 3.55Å; V13-F17 HydrophobicContact CG1-CE2 3.64Å; V13-F17 VanDerWaalsContact O-CD2 3.28Å; V13-F17 WeakPolarHBondContact O-CD2 3.48Å; V13-F17 PolarHBondContact O-N 3.23Å
14	Y	61.1	Low	55.3	Low	168 Å²	168	111.4 Å²	111.4	66%	0.659	54%	0.54	S	S	*	.	H	α-helix	trans	-61.3	-44.2	178.6	-136.7	-92.1	0	0	0	112	W10 I11 I16 F17 V18	W10-Y14 WeakPolarHBondContact O-CB 3.38Å; W10-Y14 PolarHBondContact O-N 2.94Å; I11-Y14 PolarHBondContact O-N 2.58Å; Y14-I16 PolarHBondContact O-N 3.48Å; Y14-F17 PolarHBondContact O-N 3.07Å; Y14-V18 HydrophobicContact CD1-CG2 3.57Å; Y14-V18 HydrophobicContact CE1-CG2 3.8Å; Y14-V18 VanDerWaalsContact O-CB 3.22Å; Y14-V18 WeakPolarHBondContact O-CB 3.42Å; Y14-V18 WeakPolarHBondContact O-CG2 3.3Å; Y14-V18 PolarHBondContact O-N 3Å
15	V	63.1	Low	55	Low	90 Å²	90	109.6 Å²	109.6	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-60.9	-44.5	177.6	171	0	0	0	0	110.9	I11 L12 V13 W19	I11-V15 HydrophobicContact CG2-CG2 4.34Å; I11-V15 VanDerWaalsContact O-CG2 3.25Å; I11-V15 WeakPolarHBondContact O-CG2 3.46Å; I11-V15 PolarHBondContact O-N 2.76Å; L12-V15 PolarHBondContact O-N 3.33Å; V13-V15 PolarHBondContact O-N 2.89Å; V15-W19 WeakPolarHBondContact O-CB 3.4Å; V15-W19 PolarHBondContact O-N 2.72Å
16	I	61.3	Low	55.3	Low	61 Å²	61	105.2 Å²	105.2	31%	0.313	52%	0.517	S	S	.	.	H	α-helix	trans	-65.2	-46.6	179.4	-66.4	166	0	0	0	111.2	L12 V13 Y14 W19 L20	L12-I16 HydrophobicContact CD2-CD1 4.09Å; L12-I16 VanDerWaalsContact O-CG1 3.3Å; L12-I16 WeakPolarHBondContact O-CG1 3.19Å; L12-I16 PolarHBondContact O-N 2.8Å; L12-I16 VanDerWaalsContact O-N 3.08Å; V13-I16 PolarHBondContact O-N 2.93Å; Y14-I16 PolarHBondContact O-N 3.48Å; I16-W19 PolarHBondContact O-N 3.01Å; I16-L20 HydrophobicContact CG2-CD1 3.91Å; I16-L20 WeakPolarHBondContact O-CB 3.38Å; I16-L20 WeakPolarHBondContact O-CG 3.38Å; I16-L20 PolarHBondContact O-N 3.34Å
17	F	57.5	Low	55.4	Low	110 Å²	110	103.3 Å²	103.3	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-44.5	179.5	-85.3	-76.1	0	0	0	112.1	V13 Y14 W19 L20 Y21 I340	V13-F17 HydrophobicContact CG1-CD2 3.55Å; V13-F17 HydrophobicContact CG1-CE2 3.64Å; V13-F17 VanDerWaalsContact O-CD2 3.28Å; V13-F17 WeakPolarHBondContact O-CD2 3.48Å; V13-F17 PolarHBondContact O-N 3.23Å; Y14-F17 PolarHBondContact O-N 3.07Å; F17-W19 VanDerWaalsContact C-N 3.3Å; F17-W19 PolarHBondContact O-N 2.76Å; F17-L20 PolarHBondContact O-N 3.22Å; F17-Y21 WeakPolarHBondContact O-CB 3.5Å; F17-Y21 PolarHBondContact O-N 2.89Å; F17-I340 HydrophobicContact CE2-CD1 4.48Å
18	V	59	Low	55.4	Low	72 Å²	72	104.7 Å²	104.7	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-62.1	-40.6	175.8	171.1	0	0	0	0	110.3	Y14 Y21 K22	Y14-V18 HydrophobicContact CD1-CG2 3.57Å; Y14-V18 HydrophobicContact CE1-CG2 3.8Å; Y14-V18 VanDerWaalsContact O-CB 3.22Å; Y14-V18 WeakPolarHBondContact O-CB 3.42Å; Y14-V18 WeakPolarHBondContact O-CG2 3.3Å; Y14-V18 PolarHBondContact O-N 3Å; V18-Y21 PolarHBondContact O-N 2.79Å; V18-K22 WeakPolarHBondContact O-CB 3.41Å; V18-K22 PolarHBondContact O-N 3.43Å
19	W	55.2	Low	55.5	Low	166 Å²	166	101.9 Å²	101.9	63%	0.629	49%	0.489	S	S	*	.	H	α-helix	trans	-68.8	-41.3	179.4	-158.8	69.9	0	0	0	112.6	V15 I16 F17 K22 R23	V15-W19 WeakPolarHBondContact O-CB 3.4Å; V15-W19 PolarHBondContact O-N 2.72Å; I16-W19 PolarHBondContact O-N 3.01Å; F17-W19 VanDerWaalsContact C-N 3.3Å; F17-W19 PolarHBondContact O-N 2.76Å; W19-K22 PolarHBondContact O-N 3.18Å; W19-R23 PolarHBondContact O-N 3.45Å
20	L	53.9	Low	56.1	Low	64 Å²	64	100.9 Å²	100.9	34%	0.335	49%	0.487	S	S	.	.	H	α-helix	trans	-67.6	-37.6	174.5	-73.6	170.9	0	0	0	112.4	I16 F17 R23 S24	I16-L20 HydrophobicContact CG2-CD1 3.91Å; I16-L20 WeakPolarHBondContact O-CB 3.38Å; I16-L20 WeakPolarHBondContact O-CG 3.38Å; I16-L20 PolarHBondContact O-N 3.34Å; F17-L20 PolarHBondContact O-N 3.22Å; L20-R23 PolarHBondContact O-N 2.77Å; L20-S24 WeakPolarHBondContact O-CB 3.39Å; L20-S24 PolarHBondContact O-N 3.32Å; L20-S24 PolarHBondContact O-OG 3Å
21	Y	53.8	Low	56.5	Low	156 Å²	156	99.4 Å²	99.4	61%	0.612	49%	0.491	S	S	*	.	H	α-helix	trans	-66.1	-44.5	173.7	-171.2	-96.4	0	0	0	111	F17 V18 R23 S24 N25	F17-Y21 WeakPolarHBondContact O-CB 3.5Å; F17-Y21 PolarHBondContact O-N 2.89Å; V18-Y21 PolarHBondContact O-N 2.79Å; Y21-R23 VanDerWaalsContact C-N 3.26Å; Y21-R23 PolarHBondContact O-N 3.5Å; Y21-S24 PolarHBondContact O-N 3.21Å; Y21-N25 PolarHBondContact O-N 3.13Å
22	K	48.6	Very low	56.7	Low	117 Å²	117	97.5 Å²	97.5	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-32.8	175.9	-169.8	169.2	-176.6	171	0	112.4	V18 W19	V18-K22 WeakPolarHBondContact O-CB 3.41Å; V18-K22 PolarHBondContact O-N 3.43Å; W19-K22 PolarHBondContact O-N 3.18Å
23	R	50	Low	57	Low	173 Å²	173	100.6 Å²	100.6	65%	0.653	49%	0.486	S	S	*	.	H	α-helix	trans	-78.7	-23.9	172.8	-166.7	172.4	-178.8	175.5	2.4	113.5	W19 L20 Y21 C26	W19-R23 PolarHBondContact O-N 3.45Å; L20-R23 PolarHBondContact O-N 2.77Å; Y21-R23 VanDerWaalsContact C-N 3.26Å; Y21-R23 PolarHBondContact O-N 3.5Å; R23-C26 PolarHBondContact O-SG 2.91Å; R23-C26 VanDerWaalsContact O-SG 3.33Å
24	S	47	Very low	56.9	Low	94 Å²	94	106.9 Å²	106.9	66%	0.657	51%	0.509	S	S	*	.	H	α-helix	trans	-86.9	-29.4	-178.6	-57.9	0	0	0	0	112.5	L20 Y21 C26	L20-S24 WeakPolarHBondContact O-CB 3.39Å; L20-S24 PolarHBondContact O-N 3.32Å; L20-S24 PolarHBondContact O-OG 3Å; Y21-S24 PolarHBondContact O-N 3.21Å; S24-C26 PolarHBondContact O-N 2.6Å
25	N	44.4	Very low	56.8	Low	106 Å²	106	102 Å²	102	57%	0.567	49%	0.494	S	S	*	.	S	Bend	trans	-77.8	42.3	166.2	-89.7	0.5	0	0	0	112.1	Y21 N27	Y21-N25 PolarHBondContact O-N 3.13Å; N25-N27 PolarHBondContact O-N 2.92Å
26	C	50.2	Low	56.7	Low	53 Å²	53	98.1 Å²	98.1	36%	0.358	47%	0.47	S	S	.	.			trans	-53.1	107	165.6	-90	0	0	0	0	108.7	R23 S24	R23-C26 PolarHBondContact O-SG 2.91Å; R23-C26 VanDerWaalsContact O-SG 3.33Å; S24-C26 PolarHBondContact O-N 2.6Å
27	N	55.7	Low	56.8	Low	77 Å²	77	100.2 Å²	100.2	41%	0.412	48%	0.479	S	S	.	.			trans	1.1	120.4	172.1	-78.4	-39.6	0	0	0	115.6	N25 I29 C30 F54	N25-N27 PolarHBondContact O-N 2.92Å; N27-I29 HydrophobicContact CB-CB 4.47Å; N27-I29 PolarHBondContact O-N 3.04Å; N27-C30 WeakPolarHBondContact O-CB 3.22Å; N27-C30 PolarHBondContact O-N 3.1Å; N27-F54 HydrophobicContact CB-CE2 4.1Å; N27-F54 HydrophobicContact CB-CZ 3.69Å; N27-F54 VanDerWaalsContact ND2-CZ 3.27Å; N27-F54 WeakPolarHBondContact ND2-CZ 3.4Å
28	D	57.9	Low	57.4	Low	125 Å²	125	100.3 Å²	100.3	67%	0.668	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-44.2	-29.1	172.7	-90.8	-30.3	0	0	0	113.9	C30 N31 N32 L35	D28-C30 VanDerWaalsContact C-N 3.29Å; D28-C30 PolarHBondContact O-N 3.17Å; D28-N31 CarbonylContact O-C 3.58Å; D28-N31 PolarHBondContact O-N 3.04Å; D28-N32 PolarHBondContact O-N 3.18Å; D28-L35 HydrophobicContact CB-CD1 4.47Å
29	I	58.9	Low	58.5	Low	11 Å²	11	97.9 Å²	97.9	6%	0.056	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-58.8	-35.9	175.7	-64	-137	0	0	0	113.5	N27 N31 N32 L35 L36 F54	N27-I29 HydrophobicContact CB-CB 4.47Å; N27-I29 PolarHBondContact O-N 3.04Å; I29-N31 PolarHBondContact O-N 2.95Å; I29-N32 CarbonylContact O-C 3.53Å; I29-N32 PolarHBondContact O-N 3.31Å; I29-L35 HydrophobicContact CD1-CB 3.97Å; I29-L35 HydrophobicContact CG1-CB 4.03Å; I29-L36 HydrophobicContact CG2-CB 4.41Å; I29-L36 HydrophobicContact CG2-CD1 3.42Å; I29-L36 VanDerWaalsContact CG2-CD1 3.42Å; I29-L36 HydrophobicContact CG2-CD2 4.35Å; I29-L36 HydrophobicContact CG2-CG 3.4Å; I29-L36 VanDerWaalsContact CG2-CG 3.4Å; I29-L36 WeakPolarHBondContact O-CD1 3.15Å; I29-F54 HydrophobicContact CB-CD2 4.45Å; I29-F54 HydrophobicContact CB-CE1 4.45Å; I29-F54 HydrophobicContact CB-CE2 3.94Å; I29-F54 HydrophobicContact CB-CZ 3.89Å; I29-F54 HydrophobicContact CD1-CB 3.58Å; I29-F54 HydrophobicContact CD1-CD1 3.83Å; I29-F54 HydrophobicContact CD1-CD2 3.03Å; I29-F54 HydrophobicContact CD1-CE1 4.21Å; I29-F54 HydrophobicContact CD1-CE2 3.43Å; I29-F54 VanDerWaalsContact CD1-CE2 3.43Å; I29-F54 HydrophobicContact CD1-CG 3.2Å; I29-F54 HydrophobicContact CD1-CZ 3.95Å; I29-F54 HydrophobicContact CG1-CD2 3.53Å; I29-F54 HydrophobicContact CG1-CE1 4.49Å; I29-F54 HydrophobicContact CG1-CE2 3.35Å; I29-F54 HydrophobicContact CG1-CG 4.11Å; I29-F54 HydrophobicContact CG1-CZ 3.83Å; I29-F54 HydrophobicContact CG2-CE1 4.42Å; I29-F54 HydrophobicContact CG2-CZ 4.33Å
30	C	67	Low	59.8	Low	34 Å²	34	92 Å²	92	23%	0.23	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-66.9	-22.7	176.2	-62.4	0	0	0	0	112.4	N27 D28 C193	N27-C30 WeakPolarHBondContact O-CB 3.22Å; N27-C30 PolarHBondContact O-N 3.1Å; D28-C30 VanDerWaalsContact C-N 3.29Å; D28-C30 PolarHBondContact O-N 3.17Å; C30-C193 WeakPolarHBondContact CA-SG 3.44Å; C30-C193 HydrophobicContact CB-CB 3.56Å; C30-C193 WeakPolarHBondContact CB-SG 3.45Å; C30-C193 WeakPolarHBondContact SG-CA 3.28Å; C30-C193 WeakPolarHBondContact SG-CB 3.46Å; C30-C193 CovalentContact SG-SG 2.04Å; C30-C193 PolarHBondContact SG-SG 3.09Å
31	N	64	Low	61.5	Low	139 Å²	139	90.8 Å²	90.8	74%	0.743	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-25.7	176.3	-62.6	-35	0	0	0	112.3	D28 I29	D28-N31 CarbonylContact O-C 3.58Å; D28-N31 PolarHBondContact O-N 3.04Å; I29-N31 PolarHBondContact O-N 2.95Å
32	N	64.2	Low	63	Low	70 Å²	70	83.6 Å²	83.6	37%	0.374	42%	0.418	S	S	.	.			trans	-125.9	93.7	-178.3	-169	-11	0	0	0	112.3	D28 I29 K34 L35	D28-N32 PolarHBondContact O-N 3.18Å; I29-N32 CarbonylContact O-C 3.53Å; I29-N32 PolarHBondContact O-N 3.31Å; N32-K34 PolarHBondContact O-N 2.85Å; N32-K34 WeakPolarHBondContact OD1-CB 3.39Å; N32-K34 PolarHBondContact OD1-N 2.88Å; N32-K34 VanDerWaalsContact OD1-N 3.15Å; N32-L35 HydrophobicContact CB-CD1 3.94Å; N32-L35 HydrophobicContact CB-CG 4.1Å; N32-L35 WeakPolarHBondContact O-CB 3.35Å; N32-L35 PolarHBondContact O-N 3.46Å
33	R	63.3	Low	64.9	Low	175 Å²	175	80.1 Å²	80.1	66%	0.66	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-54.7	-27	177.6	-74.8	-175.1	172.9	178.5	-3.4	114.3	L35 L36 E198	R33-L35 PolarHBondContact O-N 2.68Å; R33-L36 HydrophobicContact CB-CD1 4.43Å; R33-L36 HydrophobicContact CG-CD1 4.38Å; R33-L36 WeakPolarHBondContact O-CB 3.24Å; R33-L36 PolarHBondContact O-N 2.66Å; R33-E198 IonicContact CZ-OE1 3.01Å; R33-E198 IonicContact NE-OE1 2.74Å; R33-E198 IonicContact NH2-OE1 3.13Å; R33-E198 PolarHBondContact NH2-OE1 2.72Å
34	K	58.5	Low	66.9	Low	183 Å²	183	75.5 Å²	75.5	80%	0.796	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-66.3	-25.1	179.1	-64.3	-176.5	177.1	179.7	0	112.3	N32	N32-K34 PolarHBondContact O-N 2.85Å; N32-K34 WeakPolarHBondContact OD1-CB 3.39Å; N32-K34 PolarHBondContact OD1-N 2.88Å; N32-K34 VanDerWaalsContact OD1-N 3.15Å
35	L	60.1	Low	69.2	Low	66 Å²	66	74.6 Å²	74.6	35%	0.346	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-77.6	-19.3	178.4	-61.3	177.4	0	0	0	112.8	D28 I29 N32 R33 H37 H38	D28-L35 HydrophobicContact CB-CD1 4.47Å; I29-L35 HydrophobicContact CD1-CB 3.97Å; I29-L35 HydrophobicContact CG1-CB 4.03Å; N32-L35 HydrophobicContact CB-CD1 3.94Å; N32-L35 HydrophobicContact CB-CG 4.1Å; N32-L35 WeakPolarHBondContact O-CB 3.35Å; N32-L35 PolarHBondContact O-N 3.46Å; R33-L35 PolarHBondContact O-N 2.68Å; L35-H37 PolarHBondContact O-N 3.33Å; L35-H37 VanDerWaalsContact O-N 3.07Å; L35-H38 PolarHBondContact O-N 3.17Å; L35-H38 VanDerWaalsContact O-N 3.16Å
36	L	59.4	Low	71.5	Confident	8 Å²	8	76.9 Å²	76.9	4%	0.042	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-62.1	-17.8	-178.6	-92.7	105.4	0	0	0	114.5	I29 R33 E198 G199 H200	I29-L36 HydrophobicContact CG2-CB 4.41Å; I29-L36 HydrophobicContact CG2-CD1 3.42Å; I29-L36 VanDerWaalsContact CG2-CD1 3.42Å; I29-L36 HydrophobicContact CG2-CD2 4.35Å; I29-L36 HydrophobicContact CG2-CG 3.4Å; I29-L36 VanDerWaalsContact CG2-CG 3.4Å; I29-L36 WeakPolarHBondContact O-CD1 3.15Å; R33-L36 HydrophobicContact CB-CD1 4.43Å; R33-L36 HydrophobicContact CG-CD1 4.38Å; R33-L36 WeakPolarHBondContact O-CB 3.24Å; R33-L36 PolarHBondContact O-N 2.66Å; L36-E198 HydrophobicContact CD2-CB 4.22Å; L36-G199 WeakPolarHBondContact CD2-O 3.26Å; L36-H200 HydrophobicContact CD2-CB 4.12Å; L36-H200 PolarHBondContact O-CD2 2.92Å; L36-H200 PolarHBondContact O-NE2 3.15Å
37	H	64.7	Low	73.6	Confident	105 Å²	105	77.6 Å²	77.6	49%	0.486	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-118.9	3.4	-179.8	-60.7	-50	0	0	0	112.8	L35	L35-H37 PolarHBondContact O-N 3.33Å; L35-H37 VanDerWaalsContact O-N 3.07Å
38	H	69.3	Low	75.5	Confident	112 Å²	112	75.8 Å²	75.8	52%	0.519	38%	0.381	S	S	.	.			trans	-87	121.4	-176.8	-164	75.2	0	0	0	110.3	L35	L35-H38 PolarHBondContact O-N 3.17Å; L35-H38 VanDerWaalsContact O-N 3.16Å
39	G	81.7	Confident	77.3	Confident	21 Å²	21	71.6 Å²	71.6	22%	0.216	36%	0.355	C	S	.	.			trans	-113.6	137.4	166.8	0	0	0	0	0	109.5	I52 H53	G39-I52 CarbonylContact C-O 3.56Å; G39-I52 WeakPolarHBondContact CA-O 3.03Å; G39-H53 WeakPolarHBondContact CA-ND1 3.39Å
40	I	83.8	Confident	78.9	Confident	44 Å²	44	71.2 Å²	71.2	23%	0.226	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.6	177.7	-53	172	0	0	0	107.9	I42 S51 I52 G249	I40-I42 HydrophobicContact CB-CD1 4.49Å; I40-I42 HydrophobicContact CG2-CD1 4Å; I40-I42 PolarHBondContact O-N 3.19Å; I40-S51 CarbonylContact O-C 3.53Å; I40-S51 WeakPolarHBondContact O-CA 3.43Å; I40-S51 VanDerWaalsContact O-CB 3.26Å; I40-S51 WeakPolarHBondContact O-CB 3.39Å; I40-I52 PolarHBondContact N-O 2.83Å; I40-I52 PolarHBondContact O-N 2.99Å; I40-G249 WeakPolarHBondContact CD1-O 3.21Å
41	V	88.7	Confident	80	Confident	38 Å²	38	69.6 Å²	69.6	23%	0.23	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.8	175.3	-175.9	0	0	0	0	108.9	E44 R49 K248	V41-E44 HydrophobicContact CG1-CB 3.85Å; V41-R49 HydrophobicContact CG1-CG 4.38Å; V41-K248 WeakPolarHBondContact O-CE 3.08Å; V41-K248 PolarHBondContact O-NZ 3.21Å
42	I	86.4	Confident	81.1	Confident	4 Å²	4	63 Å²	63	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-54.1	-179.7	-55	-48	0	0	0	109.3	I40 Y50 I52 C246 K248	I40-I42 HydrophobicContact CB-CD1 4.49Å; I40-I42 HydrophobicContact CG2-CD1 4Å; I40-I42 PolarHBondContact O-N 3.19Å; I42-Y50 HydrophobicContact CB-CD1 3.93Å; I42-Y50 HydrophobicContact CG1-CD1 4.07Å; I42-Y50 HydrophobicContact CG1-CE1 4.34Å; I42-Y50 HydrophobicContact CG2-CD1 4.38Å; I42-Y50 PolarHBondContact N-O 2.91Å; I42-I52 HydrophobicContact CD1-CD1 3.79Å; I42-I52 HydrophobicContact CD1-CG1 4.06Å; I42-I52 HydrophobicContact CG1-CD1 3.85Å; I42-I52 HydrophobicContact CG1-CG1 3.77Å; I42-C246 WeakPolarHBondContact CD1-SG 3.11Å; I42-K248 HydrophobicContact CD1-CB 4.31Å; I42-K248 VanDerWaalsContact O-CD 3.27Å; I42-K248 WeakPolarHBondContact O-CD 3.22Å; I42-K248 WeakPolarHBondContact O-CE 3.32Å; I42-K248 PolarHBondContact O-NZ 3.44Å
43	I	88.7	Confident	82.1	Confident	44 Å²	44	60.4 Å²	60.4	23%	0.226	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.8	175.4	-169.5	169.1	0	0	0	110	Y48 R49 Y50 D263	I43-Y48 HydrophobicContact CG2-CD1 3.82Å; I43-Y48 HydrophobicContact CG2-CE1 3.49Å; I43-Y48 VanDerWaalsContact CG2-CE1 3.49Å; I43-R49 WeakPolarHBondContact O-CA 3.25Å; I43-Y50 PolarHBondContact N-O 2.93Å; I43-Y50 PolarHBondContact O-N 2.83Å; I43-D263 WeakPolarHBondContact CD1-OD2 3.36Å; I43-D263 HydrophobicContact CG2-CB 4.16Å
44	E	91.9	Very high	82.8	Confident	76 Å²	76	53.6 Å²	53.6	36%	0.355	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	127.8	176.2	179.9	165.8	151.9	0	0	109.3	V41 Y48 R49 K207 W208	V41-E44 HydrophobicContact CG1-CB 3.85Å; E44-Y48 WeakPolarHBondContact CA-O 3.5Å; E44-R49 HydrophobicContact CB-CG 4.49Å; E44-R49 HydrophobicContact CG-CB 4.44Å; E44-R49 IonicContact OE1-NH1 3.85Å; E44-R49 WeakPolarHBondContact OE2-CD 3.42Å; E44-R49 IonicContact OE2-CZ 3.37Å; E44-R49 IonicContact OE2-NE 3.02Å; E44-R49 IonicContact OE2-NH1 2.6Å; E44-R49 PolarHBondContact OE2-NH1 2.86Å; E44-K207 IonicContact OE1-NZ 2.65Å; E44-K207 PolarHBondContact OE1-NZ 2.94Å; E44-W208 HydrophobicContact CG-CZ2 3.99Å
45	N	93.5	Very high	83.9	Confident	76 Å²	76	46.3 Å²	46.3	41%	0.406	24%	0.239	S	C	.	.			trans	-135.2	-168.1	166.9	65.9	38.3	0	0	0	108.8	T47 Y48 W208	N45-T47 VanDerWaalsContact C-N 3.28Å; N45-T47 PolarHBondContact O-N 2.93Å; N45-T47 PolarHBondContact OD1-N 3.18Å; N45-T47 PolarHBondContact OD1-OG1 3.25Å; N45-Y48 PolarHBondContact N-O 2.93Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.22Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.17Å; N45-Y48 PolarHBondContact OD1-N 3.44Å; N45-Y48 PolarHBondContact OD1-O 3.36Å; N45-W208 WeakPolarHBondContact O-CH2 3.43Å
46	D	92.8	Very high	85.3	Confident	154 Å²	154	43.5 Å²	43.5	82%	0.824	22%	0.224	S	C	*	.	S	Bend	trans	-69.3	-21.4	-175.9	-66	-25.3	0	0	0	114.5	H62	D46-H62 PolarHBondContact O-CD2 2.87Å; D46-H62 VanDerWaalsContact O-CD2 3.23Å
47	T	95	Very high	86.9	Confident	68 Å²	68	43.5 Å²	43.5	42%	0.417	22%	0.224	S	C	.	.	S	Bend	trans	-119.6	-11.5	-174.7	60.1	0	0	0	0	114	N45 Q61 H62	N45-T47 VanDerWaalsContact C-N 3.28Å; N45-T47 PolarHBondContact O-N 2.93Å; N45-T47 PolarHBondContact OD1-N 3.18Å; N45-T47 PolarHBondContact OD1-OG1 3.25Å; T47-Q61 CarbonylContact O-C 3.6Å; T47-Q61 WeakPolarHBondContact O-CA 3.13Å; T47-H62 HydrophobicContact CG2-CB 4.5Å; T47-H62 PolarHBondContact O-N 2.76Å
48	Y	95.5	Very high	88.3	Confident	39 Å²	39	38.6 Å²	38.6	15%	0.153	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.7	-171.2	-174.7	-89.9	0	0	0	111.9	I43 E44 N45 R59 I60 Q61 W208	I43-Y48 HydrophobicContact CG2-CD1 3.82Å; I43-Y48 HydrophobicContact CG2-CE1 3.49Å; I43-Y48 VanDerWaalsContact CG2-CE1 3.49Å; E44-Y48 WeakPolarHBondContact CA-O 3.5Å; N45-Y48 PolarHBondContact N-O 2.93Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.22Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.17Å; N45-Y48 PolarHBondContact OD1-N 3.44Å; N45-Y48 PolarHBondContact OD1-O 3.36Å; Y48-R59 HydrophobicContact CE2-CG 3.91Å; Y48-I60 WeakPolarHBondContact CA-O 3.34Å; Y48-Q61 HydrophobicContact CD2-CG 3.83Å; Y48-Q61 HydrophobicContact CE2-CG 4.01Å; Y48-W208 VanDerWaalsContact C-CH2 3.43Å; Y48-W208 WeakPolarHBondContact O-CH2 3.36Å
49	R	95.3	Very high	89.5	Confident	36 Å²	36	36 Å²	36	14%	0.136	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.3	168.9	172.8	176.6	172.8	137.2	-5.7	110.9	V41 I43 E44 R59 I60 W208	V41-R49 HydrophobicContact CG1-CG 4.38Å; I43-R49 WeakPolarHBondContact O-CA 3.25Å; E44-R49 HydrophobicContact CB-CG 4.49Å; E44-R49 HydrophobicContact CG-CB 4.44Å; E44-R49 IonicContact OE1-NH1 3.85Å; E44-R49 WeakPolarHBondContact OE2-CD 3.42Å; E44-R49 IonicContact OE2-CZ 3.37Å; E44-R49 IonicContact OE2-NE 3.02Å; E44-R49 IonicContact OE2-NH1 2.6Å; E44-R49 PolarHBondContact OE2-NH1 2.86Å; R49-R59 CarbonylContact O-C 3.57Å; R49-R59 WeakPolarHBondContact O-CA 3.43Å; R49-I60 HydrophobicContact CB-CB 4.24Å; R49-I60 PolarHBondContact N-O 2.88Å; R49-I60 PolarHBondContact O-N 3.2Å; R49-W208 HydrophobicContact CB-CH2 3.68Å; R49-W208 HydrophobicContact CB-CZ2 3.43Å; R49-W208 VanDerWaalsContact CB-CZ2 3.43Å; R49-W208 HydrophobicContact CB-CZ3 4.34Å; R49-W208 HydrophobicContact CG-CZ2 4.32Å
50	Y	92.6	Very high	90.3	Very high	4 Å²	4	35 Å²	35	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.4	173.3	-177	-106.7	0	0	0	109.8	I42 I43 L57 M58 R59 H262	I42-Y50 HydrophobicContact CB-CD1 3.93Å; I42-Y50 HydrophobicContact CG1-CD1 4.07Å; I42-Y50 HydrophobicContact CG1-CE1 4.34Å; I42-Y50 HydrophobicContact CG2-CD1 4.38Å; I42-Y50 PolarHBondContact N-O 2.91Å; I43-Y50 PolarHBondContact N-O 2.93Å; I43-Y50 PolarHBondContact O-N 2.83Å; Y50-L57 HydrophobicContact CE2-CB 4.23Å; Y50-L57 WeakPolarHBondContact OH-CD1 3.42Å; Y50-L57 WeakPolarHBondContact OH-CD2 3.39Å; Y50-M58 WeakPolarHBondContact CA-O 3.27Å; Y50-R59 HydrophobicContact CD2-CB 4.17Å; Y50-H262 HydrophobicContact CE1-CB 4.48Å; Y50-H262 AromaticContact CE2-ND1 3.88Å; Y50-H262 AromaticContact CZ-ND1 3.68Å; Y50-H262 VanDerWaalsContact OH-CG 3.29Å; Y50-H262 PolarHBondContact OH-ND1 3.49Å
51	S	90.3	Very high	91	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	142.9	-178.2	55.4	0	0	0	0	113.1	I40 H53 M58	I40-S51 CarbonylContact O-C 3.53Å; I40-S51 WeakPolarHBondContact O-CA 3.43Å; I40-S51 VanDerWaalsContact O-CB 3.26Å; I40-S51 WeakPolarHBondContact O-CB 3.39Å; S51-H53 PolarHBondContact OG-NE2 3.04Å; S51-H53 VanDerWaalsContact OG-NE2 3.11Å; S51-M58 PolarHBondContact N-O 2.84Å; S51-M58 PolarHBondContact O-N 2.87Å; S51-M58 WeakPolarHBondContact OG-CE 3.44Å
52	I	86.6	Confident	91.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.2	177.9	-57	177.9	0	0	0	108.1	G39 I40 I42 L57 I220 C246 K251 I253	G39-I52 CarbonylContact C-O 3.56Å; G39-I52 WeakPolarHBondContact CA-O 3.03Å; I40-I52 PolarHBondContact N-O 2.83Å; I40-I52 PolarHBondContact O-N 2.99Å; I42-I52 HydrophobicContact CD1-CD1 3.79Å; I42-I52 HydrophobicContact CD1-CG1 4.06Å; I42-I52 HydrophobicContact CG1-CD1 3.85Å; I42-I52 HydrophobicContact CG1-CG1 3.77Å; I52-L57 HydrophobicContact CB-CD2 4.38Å; I52-L57 HydrophobicContact CG1-CD2 3.87Å; I52-L57 HydrophobicContact CG2-CD2 4.22Å; I52-I220 HydrophobicContact CG2-CD1 3.9Å; I52-C246 HydrophobicContact CD1-CB 3.94Å; I52-K251 HydrophobicContact CG2-CD 3.96Å; I52-I253 HydrophobicContact CD1-CG2 3.85Å
53	H	86.5	Confident	91.7	Very high	14 Å²	14	40.6 Å²	40.6	7%	0.065	20%	0.203	C	C	.	.			trans	-102.3	178.4	168.8	-60.3	-91.5	0	0	0	109.4	G39 S51 T55 H56 I202 I220	G39-H53 WeakPolarHBondContact CA-ND1 3.39Å; S51-H53 PolarHBondContact OG-NE2 3.04Å; S51-H53 VanDerWaalsContact OG-NE2 3.11Å; H53-T55 PolarHBondContact O-N 3.49Å; H53-H56 CarbonylContact C-O 3.57Å; H53-H56 WeakPolarHBondContact CA-O 3.4Å; H53-H56 VanDerWaalsContact CB-O 3.31Å; H53-H56 WeakPolarHBondContact CB-O 3.17Å; H53-H56 PolarHBondContact N-O 2.84Å; H53-I202 HydrophobicContact CB-CD1 3.54Å; H53-I202 HydrophobicContact CB-CG1 3.88Å; H53-I202 VanDerWaalsContact CE1-CG2 3.45Å; H53-I202 WeakPolarHBondContact CE1-CG2 3.28Å; H53-I202 WeakPolarHBondContact ND1-CG2 3.1Å; H53-I220 WeakPolarHBondContact O-CD1 3.36Å
54	F	78.2	Confident	92.1	Very high	33 Å²	33	41.6 Å²	41.6	15%	0.145	21%	0.207	C	C	.	.	S	Bend	trans	-58.8	-50.5	-175.1	174.7	-122.2	0	0	0	114.1	N27 I29 I191 H200	N27-F54 HydrophobicContact CB-CE2 4.1Å; N27-F54 HydrophobicContact CB-CZ 3.69Å; N27-F54 VanDerWaalsContact ND2-CZ 3.27Å; N27-F54 WeakPolarHBondContact ND2-CZ 3.4Å; I29-F54 HydrophobicContact CB-CD2 4.45Å; I29-F54 HydrophobicContact CB-CE1 4.45Å; I29-F54 HydrophobicContact CB-CE2 3.94Å; I29-F54 HydrophobicContact CB-CZ 3.89Å; I29-F54 HydrophobicContact CD1-CB 3.58Å; I29-F54 HydrophobicContact CD1-CD1 3.83Å; I29-F54 HydrophobicContact CD1-CD2 3.03Å; I29-F54 HydrophobicContact CD1-CE1 4.21Å; I29-F54 HydrophobicContact CD1-CE2 3.43Å; I29-F54 VanDerWaalsContact CD1-CE2 3.43Å; I29-F54 HydrophobicContact CD1-CG 3.2Å; I29-F54 HydrophobicContact CD1-CZ 3.95Å; I29-F54 HydrophobicContact CG1-CD2 3.53Å; I29-F54 HydrophobicContact CG1-CE1 4.49Å; I29-F54 HydrophobicContact CG1-CE2 3.35Å; I29-F54 HydrophobicContact CG1-CG 4.11Å; I29-F54 HydrophobicContact CG1-CZ 3.83Å; I29-F54 HydrophobicContact CG2-CE1 4.42Å; I29-F54 HydrophobicContact CG2-CZ 4.33Å; F54-I191 HydrophobicContact CD1-CD1 3.6Å; F54-I191 HydrophobicContact CE1-CD1 3.43Å; F54-I191 VanDerWaalsContact CE1-CD1 3.43Å; F54-I191 HydrophobicContact CE1-CG1 4.13Å; F54-I191 HydrophobicContact CE1-CG2 4.2Å; F54-H200 WeakPolarHBondContact CB-NE2 3.47Å
55	T	81.1	Confident	92.3	Very high	30 Å²	30	43 Å²	43	18%	0.184	23%	0.225	C	C	.	.	S	Bend	trans	-108.4	-9	-176.7	43.9	0	0	0	0	113.5	H53 Y92 A219 I220	H53-T55 PolarHBondContact O-N 3.49Å; T55-Y92 HydrophobicContact CG2-CD1 4.25Å; T55-Y92 HydrophobicContact CG2-CE1 4.43Å; T55-Y92 WeakPolarHBondContact OG1-CE1 3.45Å; T55-A219 WeakPolarHBondContact O-CA 3.21Å; T55-I220 PolarHBondContact O-N 2.93Å
56	H	89.9	Confident	92.3	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.028	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	149.8	-172	-60.7	74.1	0	0	0	112.1	H53 Y92 I202 E218	H53-H56 CarbonylContact C-O 3.57Å; H53-H56 WeakPolarHBondContact CA-O 3.4Å; H53-H56 VanDerWaalsContact CB-O 3.31Å; H53-H56 WeakPolarHBondContact CB-O 3.17Å; H53-H56 PolarHBondContact N-O 2.84Å; H56-Y92 AromaticContact CE1-CD2 3.54Å; H56-Y92 AromaticContact CE1-CE2 3.38Å; H56-Y92 WeakPolarHBondContact CE1-CE2 3.45Å; H56-Y92 AromaticContact CE1-CG 3.99Å; H56-Y92 AromaticContact CE1-CZ 3.68Å; H56-Y92 AromaticContact ND1-CZ 3.95Å; H56-I202 HydrophobicContact CB-CD1 3.7Å; H56-E218 CarbonylContact C-O 3.44Å; H56-E218 WeakPolarHBondContact CA-O 3.5Å; H56-E218 WeakPolarHBondContact CB-O 3.08Å
57	L	91.4	Very high	92.4	Very high	9 Å²	9	37.8 Å²	37.8	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	139.9	161.7	-54.3	170.7	0	0	0	107.7	Y50 I52 F217 E218 I220 I253	Y50-L57 HydrophobicContact CE2-CB 4.23Å; Y50-L57 WeakPolarHBondContact OH-CD1 3.42Å; Y50-L57 WeakPolarHBondContact OH-CD2 3.39Å; I52-L57 HydrophobicContact CB-CD2 4.38Å; I52-L57 HydrophobicContact CG1-CD2 3.87Å; I52-L57 HydrophobicContact CG2-CD2 4.22Å; L57-F217 VanDerWaalsContact O-CA 3.31Å; L57-F217 WeakPolarHBondContact O-CA 3.44Å; L57-E218 PolarHBondContact N-O 3.33Å; L57-E218 PolarHBondContact O-N 3.11Å; L57-I220 HydrophobicContact CD2-CD1 4.03Å; L57-I220 HydrophobicContact CD2-CG1 3.83Å; L57-I220 HydrophobicContact CG-CD1 4.47Å; L57-I220 HydrophobicContact CG-CG1 3.78Å; L57-I253 HydrophobicContact CD2-CG2 4.26Å
58	M	94.6	Very high	92.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124	172.8	-176.6	178.7	65	0	0	109.3	Y50 S51 I60 I202 V215 E216 F217	Y50-M58 WeakPolarHBondContact CA-O 3.27Å; S51-M58 PolarHBondContact N-O 2.84Å; S51-M58 PolarHBondContact O-N 2.87Å; S51-M58 WeakPolarHBondContact OG-CE 3.44Å; M58-I60 HydrophobicContact CE-CD1 3.97Å; M58-I60 HydrophobicContact CE-CG1 4.42Å; M58-I60 HydrophobicContact CG-CG1 4.26Å; M58-I60 HydrophobicContact SD-CD1 4.23Å; M58-I60 HydrophobicContact SD-CG1 4.4Å; M58-I202 HydrophobicContact SD-CG2 4.47Å; M58-V215 HydrophobicContact CG-CG1 3.99Å; M58-V215 HydrophobicContact SD-CG1 4.18Å; M58-E216 CarbonylContact C-O 3.42Å; M58-E216 WeakPolarHBondContact CA-O 3.28Å; M58-F217 HydrophobicContact CB-CD1 4.06Å; M58-F217 HydrophobicContact CB-CE1 3.84Å; M58-F217 HydrophobicContact CG-CD1 4.13Å; M58-F217 HydrophobicContact CG-CE1 3.59Å; M58-F217 HydrophobicContact CG-CZ 3.88Å; M58-F217 HydrophobicContact SD-CE1 3.53Å; M58-F217 VanDerWaalsContact SD-CE1 3.53Å; M58-F217 HydrophobicContact SD-CZ 3.54Å; M58-F217 VanDerWaalsContact SD-CZ 3.54Å
59	R	96	Very high	92.5	Very high	58 Å²	58	36.2 Å²	36.2	22%	0.219	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.6	171.7	-178.6	173.4	67.6	-171.8	5.4	109.3	Y48 R49 Y50 Q61 V215 E216	Y48-R59 HydrophobicContact CE2-CG 3.91Å; R49-R59 CarbonylContact O-C 3.57Å; R49-R59 WeakPolarHBondContact O-CA 3.43Å; Y50-R59 HydrophobicContact CD2-CB 4.17Å; R59-Q61 HydrophobicContact CG-CG 4.05Å; R59-V215 CarbonylContact O-C 3.59Å; R59-V215 WeakPolarHBondContact O-CA 3.16Å; R59-E216 IonicContact CZ-OE2 2.93Å; R59-E216 PolarHBondContact N-O 2.88Å; R59-E216 IonicContact NE-OE2 3.53Å; R59-E216 PolarHBondContact NE-OE2 2.83Å; R59-E216 VanDerWaalsContact NH2-CD 3.27Å; R59-E216 IonicContact NH2-OE1 3.48Å; R59-E216 PolarHBondContact NH2-OE1 3.43Å; R59-E216 IonicContact NH2-OE2 3.38Å; R59-E216 PolarHBondContact NH2-OE2 3.04Å; R59-E216 PolarHBondContact O-N 3.13Å
60	I	97.9	Very high	92.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.7	174.6	-48.6	-176.4	0	0	0	108.5	Y48 R49 M58 V204 W208 T213 L214 V215	Y48-I60 WeakPolarHBondContact CA-O 3.34Å; R49-I60 HydrophobicContact CB-CB 4.24Å; R49-I60 PolarHBondContact N-O 2.88Å; R49-I60 PolarHBondContact O-N 3.2Å; M58-I60 HydrophobicContact CE-CD1 3.97Å; M58-I60 HydrophobicContact CE-CG1 4.42Å; M58-I60 HydrophobicContact CG-CG1 4.26Å; M58-I60 HydrophobicContact SD-CD1 4.23Å; M58-I60 HydrophobicContact SD-CG1 4.4Å; I60-V204 HydrophobicContact CD1-CG1 4.29Å; I60-W208 HydrophobicContact CB-CD2 4.27Å; I60-W208 HydrophobicContact CB-CE3 3.99Å; I60-W208 HydrophobicContact CB-CZ3 4.41Å; I60-W208 HydrophobicContact CD1-CB 4.04Å; I60-W208 HydrophobicContact CD1-CD2 4.04Å; I60-W208 HydrophobicContact CD1-CG 3.72Å; I60-W208 HydrophobicContact CG2-CB 3.99Å; I60-W208 HydrophobicContact CG2-CD2 3.72Å; I60-W208 HydrophobicContact CG2-CE3 3.27Å; I60-W208 HydrophobicContact CG2-CG 4.03Å; I60-W208 HydrophobicContact CG2-CZ3 4Å; I60-T213 HydrophobicContact CG2-CG2 3.5Å; I60-T213 VanDerWaalsContact CG2-CG2 3.5Å; I60-L214 WeakPolarHBondContact CA-O 3.26Å; I60-V215 HydrophobicContact CD1-CG2 4.46Å; I60-V215 HydrophobicContact CG1-CG1 4.15Å; I60-V215 HydrophobicContact CG1-CG2 4.11Å; I60-V215 HydrophobicContact CG2-CG2 3.98Å
61	Q	97.8	Very high	92.7	Very high	42 Å²	42	43.7 Å²	43.7	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.4	179.1	-56.4	-177.4	102.5	0	0	109.5	T47 Y48 R59 Q64 T213 L214	T47-Q61 CarbonylContact O-C 3.6Å; T47-Q61 WeakPolarHBondContact O-CA 3.13Å; Y48-Q61 HydrophobicContact CD2-CG 3.83Å; Y48-Q61 HydrophobicContact CE2-CG 4.01Å; R59-Q61 HydrophobicContact CG-CG 4.05Å; Q61-Q64 HydrophobicContact CB-CG 3.78Å; Q61-Q64 WeakPolarHBondContact O-CG 3.16Å; Q61-T213 CarbonylContact O-C 3.41Å; Q61-T213 WeakPolarHBondContact O-CA 3.15Å; Q61-L214 PolarHBondContact N-O 2.99Å; Q61-L214 PolarHBondContact O-N 2.83Å
62	H	95.7	Very high	93	Very high	25 Å²	25	47.8 Å²	47.8	12%	0.116	25%	0.251	C	S	.	.	S	Bend	trans	-84.4	171.3	169.7	-77.6	-59.9	0	0	0	111.4	D46 T47 Q64 W208 G212 T213	D46-H62 PolarHBondContact O-CD2 2.87Å; D46-H62 VanDerWaalsContact O-CD2 3.23Å; T47-H62 HydrophobicContact CG2-CB 4.5Å; T47-H62 PolarHBondContact O-N 2.76Å; H62-Q64 PolarHBondContact O-N 2.65Å; H62-Q64 PolarHBondContact O-NE2 3.12Å; H62-W208 AromaticContact CD2-CE3 3.44Å; H62-W208 VanDerWaalsContact CD2-CE3 3.44Å; H62-W208 AromaticContact CD2-CZ3 3.28Å; H62-W208 WeakPolarHBondContact CD2-CZ3 3.5Å; H62-W208 AromaticContact CE1-CE3 3.89Å; H62-W208 PolarHBondContact CE1-O 3.31Å; H62-W208 AromaticContact NE2-CD2 3.97Å; H62-W208 AromaticContact NE2-CE3 3.1Å; H62-W208 AromaticContact NE2-CZ3 3.45Å; H62-W208 WeakPolarHBondContact NE2-CZ3 3.32Å; H62-G212 CarbonylContact C-O 3.54Å; H62-T213 PolarHBondContact CE1-OG1 3.49Å; H62-T213 PolarHBondContact ND1-OG1 3.4Å
63	N	94.8	Very high	93.5	Very high	136 Å²	136	48 Å²	48	73%	0.727	25%	0.252	S	S	*	.	S	Bend	trans	55.4	31.9	176.8	-55.3	-30.9	0	0	0	114.1	G212	N63-G212 PolarHBondContact N-O 2.93Å
64	Q	97.2	Very high	93.9	Very high	66 Å²	66	55.1 Å²	55.1	31%	0.308	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-87.9	141.8	176.2	-58.3	-58.5	-65.6	0	0	110.1	Q61 H62 Y170 G212 L214	Q61-Q64 HydrophobicContact CB-CG 3.78Å; Q61-Q64 WeakPolarHBondContact O-CG 3.16Å; H62-Q64 PolarHBondContact O-N 2.65Å; H62-Q64 PolarHBondContact O-NE2 3.12Å; Q64-Y170 HydrophobicContact CB-CE2 4.37Å; Q64-Y170 WeakPolarHBondContact O-CE2 3.45Å; Q64-Y170 PolarHBondContact O-OH 3.45Å; Q64-G212 PolarHBondContact N-O 3.37Å; Q64-L214 HydrophobicContact CB-CB 3.96Å; Q64-L214 HydrophobicContact CG-CB 3.7Å
65	S	95.2	Very high	94.8	Very high	105 Å²	105	56.4 Å²	56.4	73%	0.734	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-71.8	157.9	167.9	-58.3	0	0	0	0	110.7	P67	S65-P67 WeakPolarHBondContact O-CD 3.36Å
66	Q	94.3	Very high	95.5	Very high	62 Å²	62	60.5 Å²	60.5	29%	0.29	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-57.2	122.1	175.9	-172.7	179.1	1	0	0	110.6	V68 S70 Y170	Q66-V68 VanDerWaalsContact C-N 3.25Å; Q66-V68 VanDerWaalsContact CD-O 3.26Å; Q66-V68 VanDerWaalsContact CG-O 3.3Å; Q66-V68 WeakPolarHBondContact CG-O 3.23Å; Q66-V68 PolarHBondContact NE2-O 2.74Å; Q66-V68 PolarHBondContact O-N 2.84Å; Q66-S70 PolarHBondContact NE2-OG 3.27Å; Q66-Y170 VanDerWaalsContact CA-CZ 3.45Å; Q66-Y170 HydrophobicContact CB-CD1 4.38Å; Q66-Y170 HydrophobicContact CB-CE1 3.66Å; Q66-Y170 HydrophobicContact CG-CD1 4.04Å; Q66-Y170 HydrophobicContact CG-CE1 3.74Å; Q66-Y170 PolarHBondContact N-OH 3.36Å
67	P	95	Very high	95.7	Very high	59 Å²	59	60.5 Å²	60.5	38%	0.383	31%	0.307	S	S	.	.	S	Bend	trans	-70	-23	-172.8	25.7	-34.8	0	0	0	113.2	S65 L160 Y170 L214	S65-P67 WeakPolarHBondContact O-CD 3.36Å; P67-L160 HydrophobicContact CB-CD1 4.1Å; P67-L160 HydrophobicContact CG-CD1 3.77Å; P67-Y170 VanDerWaalsContact CD-CG 3.44Å; P67-Y170 HydrophobicContact CG-CD2 4.47Å; P67-Y170 HydrophobicContact CG-CG 4.15Å; P67-L214 HydrophobicContact CG-CD1 4.35Å
68	V	96.3	Very high	95.6	Very high	7 Å²	7	66.4 Å²	66.4	4%	0.042	34%	0.338	C	S	.	.	S	Bend	trans	-144.4	125.5	-177.4	-178.7	0	0	0	0	109.5	Q66 R72 F73 L132 L137 L160	Q66-V68 VanDerWaalsContact C-N 3.25Å; Q66-V68 VanDerWaalsContact CD-O 3.26Å; Q66-V68 VanDerWaalsContact CG-O 3.3Å; Q66-V68 WeakPolarHBondContact CG-O 3.23Å; Q66-V68 PolarHBondContact NE2-O 2.74Å; Q66-V68 PolarHBondContact O-N 2.84Å; V68-R72 HydrophobicContact CG1-CB 4.08Å; V68-R72 HydrophobicContact CG1-CG 4.46Å; V68-F73 HydrophobicContact CB-CE2 4.25Å; V68-F73 HydrophobicContact CG1-CE2 3.94Å; V68-F73 HydrophobicContact CG1-CZ 4.4Å; V68-L132 HydrophobicContact CG1-CD1 3.62Å; V68-L137 HydrophobicContact CG2-CD2 3.72Å; V68-L160 HydrophobicContact CB-CD1 4.45Å; V68-L160 HydrophobicContact CG2-CD1 3.54Å; V68-L160 HydrophobicContact CG2-CD2 3.99Å; V68-L160 HydrophobicContact CG2-CG 4.43Å
69	P	96.2	Very high	95.5	Very high	67 Å²	67	74.4 Å²	74.4	44%	0.435	37%	0.37	S	S	.	.			trans	-56.9	140.5	176.8	-24.7	33.4	0	0	0	112.9	E71 R72	P69-E71 WeakPolarHBondContact CB-OE2 3.33Å; P69-E71 PolarHBondContact O-N 2.76Å; P69-R72 PolarHBondContact O-N 2.88Å
70	S	95.4	Very high	95.4	Very high	45 Å²	45	77.6 Å²	77.6	32%	0.315	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-61.4	-27.7	-175.9	-60.4	0	0	0	0	113.2	Q66 R72 F73 Q141	Q66-S70 PolarHBondContact NE2-OG 3.27Å; S70-R72 PolarHBondContact O-N 3.28Å; S70-R72 VanDerWaalsContact O-N 3.13Å; S70-F73 PolarHBondContact O-N 2.96Å; S70-F73 VanDerWaalsContact O-N 3.14Å; S70-Q141 PolarHBondContact OG-NE2 2.9Å
71	E	95.7	Very high	95.4	Very high	151 Å²	151	80.5 Å²	80.5	71%	0.706	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-66.7	-15	179.9	-51.2	85.9	-176.3	0	0	113.5	P69 F73	P69-E71 WeakPolarHBondContact CB-OE2 3.33Å; P69-E71 PolarHBondContact O-N 2.76Å; E71-F73 VanDerWaalsContact C-N 3.33Å
72	R	97.2	Very high	95.4	Very high	87 Å²	87	82.3 Å²	82.3	33%	0.328	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-76.4	-19.9	176.1	-67.7	-177.3	61.4	-168.3	1.6	113.2	V68 P69 S70 K74 L132 E134	V68-R72 HydrophobicContact CG1-CB 4.08Å; V68-R72 HydrophobicContact CG1-CG 4.46Å; P69-R72 PolarHBondContact O-N 2.88Å; S70-R72 PolarHBondContact O-N 3.28Å; S70-R72 VanDerWaalsContact O-N 3.13Å; R72-K74 PolarHBondContact O-N 3.38Å; R72-L132 HydrophobicContact CB-CD1 3.67Å; R72-E134 IonicContact CZ-OE1 3.64Å; R72-E134 IonicContact CZ-OE2 2.79Å; R72-E134 IonicContact NE-OE1 3.9Å; R72-E134 PolarHBondContact NE-OE1 3.17Å; R72-E134 IonicContact NE-OE2 3.12Å; R72-E134 IonicContact NH2-OE1 2.62Å; R72-E134 PolarHBondContact NH2-OE1 3.13Å; R72-E134 VanDerWaalsContact NH2-OE1 3.13Å; R72-E134 IonicContact NH2-OE2 3.67Å; R72-E134 PolarHBondContact NH2-OE2 2.86Å
73	F	97.5	Very high	95.5	Very high	4 Å²	4	81.1 Å²	81.1	2%	0.018	40%	0.395	C	S	.	.			trans	-84.5	87.8	176.6	-63.2	-94.9	0	0	0	110	V68 S70 E71 R130 L132 Q141 T158 L160	V68-F73 HydrophobicContact CB-CE2 4.25Å; V68-F73 HydrophobicContact CG1-CE2 3.94Å; V68-F73 HydrophobicContact CG1-CZ 4.4Å; S70-F73 PolarHBondContact O-N 2.96Å; S70-F73 VanDerWaalsContact O-N 3.14Å; E71-F73 VanDerWaalsContact C-N 3.33Å; F73-R130 HydrophobicContact CB-CB 3.78Å; F73-R130 WeakPolarHBondContact CD1-O 3.45Å; F73-R130 WeakPolarHBondContact O-CB 3.37Å; F73-R130 WeakPolarHBondContact O-CD 3.35Å; F73-L132 HydrophobicContact CD1-CB 3.53Å; F73-L132 HydrophobicContact CE1-CB 3.68Å; F73-L132 HydrophobicContact CE1-CD1 4.44Å; F73-L132 HydrophobicContact CE2-CD1 4.37Å; F73-L132 HydrophobicContact CG-CB 4.08Å; F73-L132 HydrophobicContact CZ-CB 4.33Å; F73-L132 HydrophobicContact CZ-CD1 4.27Å; F73-Q141 HydrophobicContact CB-CB 4.25Å; F73-Q141 HydrophobicContact CD1-CB 3.59Å; F73-Q141 HydrophobicContact CD2-CB 3.9Å; F73-Q141 HydrophobicContact CE1-CB 3.81Å; F73-Q141 HydrophobicContact CE2-CB 4.11Å; F73-Q141 HydrophobicContact CG-CB 3.64Å; F73-Q141 HydrophobicContact CZ-CB 4.06Å; F73-T158 HydrophobicContact CE1-CG2 4.2Å; F73-T158 HydrophobicContact CE2-CG2 4.44Å; F73-T158 HydrophobicContact CZ-CG2 3.62Å; F73-L160 HydrophobicContact CE1-CD2 4.35Å; F73-L160 HydrophobicContact CZ-CD2 3.88Å
74	K	94.8	Very high	95.6	Very high	164 Å²	164	81.5 Å²	81.5	71%	0.713	39%	0.387	S	S	*	.			trans	-92.3	-28.9	-169.6	-63.1	178.5	-175.8	178.4	0	114.1	R72 K76 V131	R72-K74 PolarHBondContact O-N 3.38Å; K74-K76 PolarHBondContact O-N 2.89Å; K74-V131 PolarHBondContact N-O 3.49Å
75	N	96	Very high	95.5	Very high	60 Å²	60	79.3 Å²	79.3	32%	0.321	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	106.3	-166.5	-61.7	-34.9	0	0	0	111.2	Y81 R130 V131	N75-Y81 HydrophobicContact CB-CD2 4.07Å; N75-Y81 HydrophobicContact CB-CE2 3.56Å; N75-Y81 PolarHBondContact ND2-OH 2.79Å; N75-R130 CarbonylContact O-C 3.58Å; N75-R130 VanDerWaalsContact O-CA 3.25Å; N75-R130 WeakPolarHBondContact O-CA 3.42Å; N75-V131 HydrophobicContact CB-CB 4.15Å; N75-V131 PolarHBondContact N-O 2.65Å; N75-V131 VanDerWaalsContact N-O 3.15Å; N75-V131 PolarHBondContact O-N 3.23Å
76	K	95.7	Very high	95.4	Very high	116 Å²	116	80.3 Å²	80.3	50%	0.504	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	140.1	177.6	-173.3	174.7	177.3	172.3	0	111.7	K74 E128	K74-K76 PolarHBondContact O-N 2.89Å; K76-E128 IonicContact NZ-OE1 3.99Å
77	I	95.6	Very high	95.4	Very high	6 Å²	6	78.2 Å²	78.2	3%	0.031	36%	0.36	C	S	.	.			trans	-95.2	118.2	170.9	-50.7	-176.7	0	0	0	108.8	F101 S129 V131 V140	I77-F101 HydrophobicContact CD1-CB 3.63Å; I77-S129 PolarHBondContact N-O 3.27Å; I77-V131 HydrophobicContact CD1-CG2 3.62Å; I77-V131 HydrophobicContact CG1-CG2 3.7Å; I77-V140 HydrophobicContact CD1-CG2 3.93Å
78	D	89.6	Confident	95.2	Very high	133 Å²	133	85.3 Å²	85.3	71%	0.711	38%	0.379	S	S	*	.	S	Bend	trans	-88.8	-53.1	171.5	-65.9	-36	0	0	0	111.1
79	Y	90.8	Very high	95.1	Very high	170 Å²	170	85.4 Å²	85.4	67%	0.667	38%	0.379	S	S	*	.	S	Bend	trans	-126.2	-50.8	173.2	173.2	-111.4	0	0	0	111.2	Y102	Y79-Y102 HydrophobicContact CE1-CE1 4.06Å; Y79-Y102 HydrophobicContact CE2-CE1 4.33Å; Y79-Y102 AromaticContact CZ-CE1 3.91Å; Y79-Y102 VanDerWaalsContact O-CD1 3.31Å; Y79-Y102 WeakPolarHBondContact O-CD1 3.5Å
80	R	95.7	Very high	94.9	Very high	125 Å²	125	85.3 Å²	85.3	47%	0.472	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	138.3	-178.7	178.6	-179.4	66.9	169.8	-4	110.1	D100 F101 Y102	R80-D100 WeakPolarHBondContact CD-OD2 3.29Å; R80-D100 HydrophobicContact CG-CB 4.28Å; R80-D100 IonicContact CZ-OD2 3.98Å; R80-D100 IonicContact NH1-OD2 3.14Å; R80-D100 PolarHBondContact NH1-OD2 2.85Å; R80-D100 VanDerWaalsContact NH1-OD2 3.14Å; R80-F101 CarbonylContact C-O 3.45Å; R80-F101 WeakPolarHBondContact CA-O 3.4Å; R80-Y102 HydrophobicContact CB-CD1 4.35Å; R80-Y102 HydrophobicContact CB-CE1 4.05Å; R80-Y102 HydrophobicContact CG-CD2 4.49Å; R80-Y102 HydrophobicContact CG-CE1 4.34Å; R80-Y102 HydrophobicContact CG-CE2 4.08Å
81	Y	97.5	Very high	94.8	Very high	60 Å²	60	83.2 Å²	83.2	24%	0.235	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	117.5	165.1	-173.3	-81.9	0	0	0	108.9	N75 A83 F101 V131 D133	N75-Y81 HydrophobicContact CB-CD2 4.07Å; N75-Y81 HydrophobicContact CB-CE2 3.56Å; N75-Y81 PolarHBondContact ND2-OH 2.79Å; Y81-A83 HydrophobicContact CD1-CB 4.32Å; Y81-A83 HydrophobicContact CE1-CB 4.1Å; Y81-F101 HydrophobicContact CD1-CD2 4.28Å; Y81-F101 PolarHBondContact N-O 2.88Å; Y81-F101 PolarHBondContact O-N 2.85Å; Y81-V131 HydrophobicContact CD1-CB 4.11Å; Y81-V131 HydrophobicContact CD1-CG1 3.81Å; Y81-V131 HydrophobicContact CD1-CG2 3.99Å; Y81-V131 HydrophobicContact CE1-CB 4.33Å; Y81-V131 HydrophobicContact CE1-CG1 3.79Å; Y81-V131 HydrophobicContact CG-CB 4.33Å; Y81-V131 HydrophobicContact CG-CG2 4Å; Y81-D133 HydrophobicContact CE1-CB 4.37Å
82	K	97.3	Very high	94.6	Very high	80 Å²	80	76.9 Å²	76.9	35%	0.348	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.4	177.7	179.7	161.1	-166.6	167.6	0	109.5	Y84 D98 D100	K82-Y84 HydrophobicContact CD-CE2 4.4Å; K82-Y84 WeakPolarHBondContact CE-OH 3.47Å; K82-Y84 HydrophobicContact CG-CE2 4.15Å; K82-D98 WeakPolarHBondContact CE-OD2 3.38Å; K82-D98 IonicContact NZ-OD2 2.75Å; K82-D98 PolarHBondContact NZ-OD2 3.17Å; K82-D100 WeakPolarHBondContact CB-OD1 3.3Å; K82-D100 WeakPolarHBondContact CD-OD1 3.42Å; K82-D100 WeakPolarHBondContact CG-OD1 3.26Å
83	A	96.9	Very high	94.1	Very high	1 Å²	1	75.8 Å²	75.8	1%	0.008	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.8	178.6	0	0	0	0	0	111.1	Y81 D98 I99 F101 L138	Y81-A83 HydrophobicContact CD1-CB 4.32Å; Y81-A83 HydrophobicContact CE1-CB 4.1Å; A83-D98 WeakPolarHBondContact O-CA 2.93Å; A83-I99 PolarHBondContact N-O 2.75Å; A83-I99 PolarHBondContact O-N 2.82Å; A83-F101 HydrophobicContact CB-CD2 4.16Å; A83-F101 HydrophobicContact CB-CE2 3.72Å; A83-L138 HydrophobicContact CB-CD1 3.75Å; A83-L138 HydrophobicContact CB-CD2 4.14Å
84	Y	97	Very high	93.8	Very high	143 Å²	143	77.6 Å²	77.6	56%	0.561	36%	0.358	S	S	*	.			trans	-114.7	100.5	171.1	-63	-84.2	0	0	0	107.1	K82 K86 D98	K82-Y84 HydrophobicContact CD-CE2 4.4Å; K82-Y84 WeakPolarHBondContact CE-OH 3.47Å; K82-Y84 HydrophobicContact CG-CE2 4.15Å; Y84-K86 PolarHBondContact O-N 3.07Å; Y84-D98 HydrophobicContact CD1-CB 3.76Å; Y84-D98 HydrophobicContact CE1-CB 3.76Å
85	P	95.1	Very high	93.8	Very high	21 Å²	21	72.2 Å²	72.2	14%	0.136	34%	0.335	C	S	.	.			trans	-51.3	126.6	-178.6	-23.6	30.5	0	0	0	110.9	F87 F89 V96 I99 L138	P85-F87 HydrophobicContact CB-CD2 4.5Å; P85-F87 HydrophobicContact CB-CE2 4.36Å; P85-F87 HydrophobicContact CB-CZ 4.41Å; P85-F87 PolarHBondContact O-N 2.92Å; P85-F89 HydrophobicContact CB-CD1 4.37Å; P85-F89 HydrophobicContact CB-CE1 3.97Å; P85-F89 HydrophobicContact CG-CE1 3.77Å; P85-V96 HydrophobicContact CG-CG1 4.4Å; P85-I99 HydrophobicContact CG-CD1 4.08Å; P85-I99 HydrophobicContact CG-CG1 4.13Å; P85-L138 HydrophobicContact CB-CD2 4.38Å; P85-L138 HydrophobicContact CG-CD2 3.88Å
86	K	94	Very high	93.8	Very high	125 Å²	125	69.6 Å²	69.6	54%	0.543	32%	0.321	S	S	.	.	S	Bend	trans	-80.5	8.8	179.2	-60.5	175	-178.1	170.9	0	113.2	Y84 D135	Y84-K86 PolarHBondContact O-N 3.07Å; K86-D135 HydrophobicContact CD-CB 4.4Å; K86-D135 WeakPolarHBondContact CD-OD1 3.36Å; K86-D135 WeakPolarHBondContact CE-OD1 3.45Å; K86-D135 IonicContact NZ-OD1 2.76Å; K86-D135 PolarHBondContact NZ-OD1 3.22Å
87	F	94.4	Very high	93.8	Very high	19 Å²	19	69 Å²	69	8%	0.083	32%	0.319	C	S	.	.	S	Bend	trans	-134	149.7	178.5	53.5	-97.5	0	0	0	109.3	P85 F89 D135 L138 I161 P163	P85-F87 HydrophobicContact CB-CD2 4.5Å; P85-F87 HydrophobicContact CB-CE2 4.36Å; P85-F87 HydrophobicContact CB-CZ 4.41Å; P85-F87 PolarHBondContact O-N 2.92Å; F87-F89 HydrophobicContact CD2-CB 4.32Å; F87-F89 AromaticContact CD2-CD1 3.76Å; F87-F89 HydrophobicContact CD2-CD1 3.76Å; F87-F89 HydrophobicContact CD2-CG 4.4Å; F87-F89 HydrophobicContact CE2-CB 4.41Å; F87-F89 AromaticContact CE2-CD1 3.45Å; F87-F89 HydrophobicContact CE2-CD1 3.45Å; F87-F89 VanDerWaalsContact CE2-CD1 3.45Å; F87-F89 AromaticContact CE2-CE1 3.94Å; F87-F89 HydrophobicContact CE2-CE1 3.94Å; F87-F89 HydrophobicContact CE2-CG 4.12Å; F87-D135 WeakPolarHBondContact CD1-O 3.27Å; F87-L138 HydrophobicContact CE1-CB 4.15Å; F87-L138 HydrophobicContact CZ-CB 3.98Å; F87-I161 HydrophobicContact CE2-CG2 4.32Å; F87-I161 HydrophobicContact CZ-CG2 4.35Å; F87-I161 WeakPolarHBondContact CZ-O 3.2Å; F87-P163 HydrophobicContact CB-CB 4.12Å; F87-P163 HydrophobicContact CB-CG 4.26Å; F87-P163 HydrophobicContact CD1-CG 4.13Å; F87-P163 VanDerWaalsContact CD2-CA 3.47Å; F87-P163 HydrophobicContact CD2-CB 4.08Å; F87-P163 HydrophobicContact CD2-CG 4.23Å; F87-P163 HydrophobicContact CG-CB 4.07Å; F87-P163 HydrophobicContact CG-CG 3.95Å
88	W	91.2	Very high	93.9	Very high	208 Å²	208	69.8 Å²	69.8	79%	0.788	32%	0.323	S	S	*	.			trans	-85.3	125.8	178.7	-62.6	71.5	0	0	0	109.1	H95	W88-H95 AromaticContact CD2-CE1 3.64Å; W88-H95 AromaticContact CD2-NE2 3.89Å; W88-H95 AromaticContact CE3-CD2 3.82Å; W88-H95 AromaticContact CE3-CE1 2.97Å; W88-H95 AromaticContact CE3-ND1 3.7Å; W88-H95 AromaticContact CE3-NE2 3.03Å; W88-H95 AromaticContact CH2-NE2 3.95Å; W88-H95 AromaticContact CZ3-CD2 3.62Å; W88-H95 AromaticContact CZ3-CE1 3.55Å; W88-H95 AromaticContact CZ3-NE2 3.04Å; W88-H95 WeakPolarHBondContact CZ3-NE2 3.31Å
89	F	93.5	Very high	94.3	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.035	29%	0.289	C	S	.	.			trans	-145.2	164.7	170	78.1	-79.6	0	0	0	111.1	P85 F87 F91 H95 V96 I99 I161	P85-F89 HydrophobicContact CB-CD1 4.37Å; P85-F89 HydrophobicContact CB-CE1 3.97Å; P85-F89 HydrophobicContact CG-CE1 3.77Å; F87-F89 HydrophobicContact CD2-CB 4.32Å; F87-F89 AromaticContact CD2-CD1 3.76Å; F87-F89 HydrophobicContact CD2-CD1 3.76Å; F87-F89 HydrophobicContact CD2-CG 4.4Å; F87-F89 HydrophobicContact CE2-CB 4.41Å; F87-F89 AromaticContact CE2-CD1 3.45Å; F87-F89 HydrophobicContact CE2-CD1 3.45Å; F87-F89 VanDerWaalsContact CE2-CD1 3.45Å; F87-F89 AromaticContact CE2-CE1 3.94Å; F87-F89 HydrophobicContact CE2-CE1 3.94Å; F87-F89 HydrophobicContact CE2-CG 4.12Å; F89-F91 HydrophobicContact CE2-CB 4.32Å; F89-H95 PolarHBondContact O-ND1 3.2Å; F89-V96 HydrophobicContact CD1-CB 4.24Å; F89-V96 HydrophobicContact CD2-CG2 4.1Å; F89-V96 HydrophobicContact CE1-CB 3.7Å; F89-V96 HydrophobicContact CE1-CG1 3.84Å; F89-V96 HydrophobicContact CE1-CG2 4.12Å; F89-V96 HydrophobicContact CE2-CB 4.07Å; F89-V96 HydrophobicContact CE2-CG2 3.53Å; F89-V96 HydrophobicContact CZ-CB 3.6Å; F89-V96 HydrophobicContact CZ-CG1 3.66Å; F89-V96 HydrophobicContact CZ-CG2 3.53Å; F89-V96 PolarHBondContact O-N 2.92Å; F89-V96 VanDerWaalsContact O-N 3.16Å; F89-I99 HydrophobicContact CE1-CD1 4.27Å; F89-I99 HydrophobicContact CZ-CD1 3.83Å; F89-I161 HydrophobicContact CD2-CG2 4.28Å; F89-I161 HydrophobicContact CE1-CG2 4.01Å; F89-I161 HydrophobicContact CE2-CG2 3.76Å; F89-I161 HydrophobicContact CZ-CG2 3.61Å
90	S	91.7	Very high	94.7	Very high	65 Å²	65	55.7 Å²	55.7	46%	0.455	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.7	177.6	-63.8	0	0	0	0	111.1	Y94	S90-Y94 CarbonylContact C-O 3.54Å; S90-Y94 WeakPolarHBondContact CA-O 3.28Å
91	F	93.7	Very high	94.8	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.009	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.3	172.7	-178.1	-109	0	0	0	108.6	F89 G93 Y94 V96 V108 I114 I117 I167 I187 V188	F89-F91 HydrophobicContact CE2-CB 4.32Å; F91-G93 PolarHBondContact O-N 3.37Å; F91-Y94 PolarHBondContact N-O 3.2Å; F91-Y94 PolarHBondContact O-N 3.21Å; F91-V96 HydrophobicContact CB-CG2 3.58Å; F91-V108 HydrophobicContact CB-CG1 4.26Å; F91-V108 HydrophobicContact CD1-CB 4.14Å; F91-V108 HydrophobicContact CD1-CG1 4.03Å; F91-V108 HydrophobicContact CD1-CG2 4.35Å; F91-V108 HydrophobicContact CE1-CB 4.41Å; F91-V108 HydrophobicContact CE1-CG2 4.33Å; F91-V108 HydrophobicContact CG-CG1 4.29Å; F91-I114 HydrophobicContact CB-CD1 4.36Å; F91-I114 HydrophobicContact CD1-CD1 4.21Å; F91-I114 HydrophobicContact CD1-CG1 4.42Å; F91-I117 HydrophobicContact CE2-CD1 4.46Å; F91-I117 HydrophobicContact CE2-CG1 4.18Å; F91-I117 HydrophobicContact CZ-CG1 4.19Å; F91-I167 HydrophobicContact CD2-CD1 3.64Å; F91-I167 HydrophobicContact CE2-CD1 3.46Å; F91-I167 VanDerWaalsContact CE2-CD1 3.46Å; F91-I187 HydrophobicContact CE2-CB 4.5Å; F91-V188 WeakPolarHBondContact CE1-O 3.35Å; F91-V188 WeakPolarHBondContact CZ-O 2.93Å
92	Y	90.6	Very high	94.6	Very high	17 Å²	17	49.3 Å²	49.3	7%	0.067	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	35.8	-173.1	-80.4	-101.5	0	0	0	113.7	T55 H56 Y94 I187 I191 H200	T55-Y92 HydrophobicContact CG2-CD1 4.25Å; T55-Y92 HydrophobicContact CG2-CE1 4.43Å; T55-Y92 WeakPolarHBondContact OG1-CE1 3.45Å; H56-Y92 AromaticContact CE1-CD2 3.54Å; H56-Y92 AromaticContact CE1-CE2 3.38Å; H56-Y92 WeakPolarHBondContact CE1-CE2 3.45Å; H56-Y92 AromaticContact CE1-CG 3.99Å; H56-Y92 AromaticContact CE1-CZ 3.68Å; H56-Y92 AromaticContact ND1-CZ 3.95Å; Y92-Y94 VanDerWaalsContact C-N 3.26Å; Y92-Y94 WeakPolarHBondContact O-CD2 3.39Å; Y92-Y94 PolarHBondContact O-N 3.32Å; Y92-I187 HydrophobicContact CE2-CD1 4.29Å; Y92-I191 HydrophobicContact CD1-CG1 4.22Å; Y92-H200 HydrophobicContact CE1-CB 3.89Å; Y92-H200 AromaticContact CE1-CG 3.93Å; Y92-H200 AromaticContact CE1-ND1 3.36Å; Y92-H200 WeakPolarHBondContact CE1-ND1 3.28Å; Y92-H200 AromaticContact CZ-ND1 3.6Å; Y92-H200 PolarHBondContact OH-ND1 2.76Å; Y92-H200 PolarHBondContact OH-O 2.82Å
93	G	87.8	Confident	94.2	Very high	65 Å²	65	47.8 Å²	47.8	67%	0.67	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	-7.8	-179.7	0	0	0	0	0	115.2	F91	F91-G93 PolarHBondContact O-N 3.37Å
94	Y	91.2	Very high	93.7	Very high	42 Å²	42	49.5 Å²	49.5	17%	0.165	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	145.1	175.4	-63.4	-82.5	0	0	0	111.2	S90 F91 Y92 V96 I114 T190	S90-Y94 CarbonylContact C-O 3.54Å; S90-Y94 WeakPolarHBondContact CA-O 3.28Å; F91-Y94 PolarHBondContact N-O 3.2Å; F91-Y94 PolarHBondContact O-N 3.21Å; Y92-Y94 VanDerWaalsContact C-N 3.26Å; Y92-Y94 WeakPolarHBondContact O-CD2 3.39Å; Y92-Y94 PolarHBondContact O-N 3.32Å; Y94-V96 PolarHBondContact O-N 2.88Å; Y94-I114 HydrophobicContact CD1-CG2 4.21Å; Y94-I114 HydrophobicContact CD2-CB 4.26Å; Y94-I114 HydrophobicContact CD2-CG2 4.15Å; Y94-I114 HydrophobicContact CG-CB 4.37Å; Y94-I114 HydrophobicContact CG-CD1 4.36Å; Y94-I114 HydrophobicContact CG-CG2 3.88Å; Y94-T190 WeakPolarHBondContact CE2-O 2.94Å
95	H	93.7	Very high	93.5	Very high	51 Å²	51	45.5 Å²	45.5	24%	0.236	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.8	176.8	177.2	53.5	0	0	0	110.4	W88 F89 K97 E110	W88-H95 AromaticContact CD2-CE1 3.64Å; W88-H95 AromaticContact CD2-NE2 3.89Å; W88-H95 AromaticContact CE3-CD2 3.82Å; W88-H95 AromaticContact CE3-CE1 2.97Å; W88-H95 AromaticContact CE3-ND1 3.7Å; W88-H95 AromaticContact CE3-NE2 3.03Å; W88-H95 AromaticContact CH2-NE2 3.95Å; W88-H95 AromaticContact CZ3-CD2 3.62Å; W88-H95 AromaticContact CZ3-CE1 3.55Å; W88-H95 AromaticContact CZ3-NE2 3.04Å; W88-H95 WeakPolarHBondContact CZ3-NE2 3.31Å; F89-H95 PolarHBondContact O-ND1 3.2Å; H95-K97 PolarHBondContact O-N 2.84Å; H95-E110 PolarHBondContact N-OE1 3.24Å; H95-E110 VanDerWaalsContact O-CB 3.25Å; H95-E110 WeakPolarHBondContact O-CB 3.34Å; H95-E110 VanDerWaalsContact O-CG 3.22Å; H95-E110 WeakPolarHBondContact O-CG 3.34Å
96	V	96.5	Very high	93.6	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.024	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-77.4	126.1	-175.3	-177.8	0	0	0	0	110.3	P85 F89 F91 Y94 I99 V108 Y109 I114	P85-V96 HydrophobicContact CG-CG1 4.4Å; F89-V96 HydrophobicContact CD1-CB 4.24Å; F89-V96 HydrophobicContact CD2-CG2 4.1Å; F89-V96 HydrophobicContact CE1-CB 3.7Å; F89-V96 HydrophobicContact CE1-CG1 3.84Å; F89-V96 HydrophobicContact CE1-CG2 4.12Å; F89-V96 HydrophobicContact CE2-CB 4.07Å; F89-V96 HydrophobicContact CE2-CG2 3.53Å; F89-V96 HydrophobicContact CZ-CB 3.6Å; F89-V96 HydrophobicContact CZ-CG1 3.66Å; F89-V96 HydrophobicContact CZ-CG2 3.53Å; F89-V96 PolarHBondContact O-N 2.92Å; F89-V96 VanDerWaalsContact O-N 3.16Å; F91-V96 HydrophobicContact CB-CG2 3.58Å; Y94-V96 PolarHBondContact O-N 2.88Å; V96-I99 HydrophobicContact CG1-CD1 4.21Å; V96-I99 HydrophobicContact CG1-CG1 3.82Å; V96-V108 HydrophobicContact CB-CG1 4.21Å; V96-V108 HydrophobicContact CG1-CG1 3.6Å; V96-V108 HydrophobicContact CG2-CG1 3.54Å; V96-Y109 WeakPolarHBondContact CA-O 3.36Å; V96-I114 HydrophobicContact CG2-CD1 4.19Å
97	K	97.1	Very high	93.8	Very high	105 Å²	105	41.2 Å²	41.2	46%	0.457	21%	0.205	S	C	.	.			trans	-99.9	-39.9	174.7	-63.6	-164.2	-164.9	159.6	0	112.8	H95 Y109 E110 S111	H95-K97 PolarHBondContact O-N 2.84Å; K97-Y109 PolarHBondContact N-O 3.42Å; K97-E110 WeakPolarHBondContact CB-O 3.28Å; K97-E110 WeakPolarHBondContact CD-O 3.39Å; K97-E110 WeakPolarHBondContact CG-O 3.41Å; K97-S111 PolarHBondContact NZ-OG 2.85Å
98	D	97.3	Very high	94	Very high	22 Å²	22	40.3 Å²	40.3	12%	0.118	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.8	-178	62.2	-71.7	0	0	0	112.4	K82 A83 Y84 Y109	K82-D98 WeakPolarHBondContact CE-OD2 3.38Å; K82-D98 IonicContact NZ-OD2 2.75Å; K82-D98 PolarHBondContact NZ-OD2 3.17Å; A83-D98 WeakPolarHBondContact O-CA 2.93Å; Y84-D98 HydrophobicContact CD1-CB 3.76Å; Y84-D98 HydrophobicContact CE1-CB 3.76Å; D98-Y109 PolarHBondContact N-O 3.16Å; D98-Y109 PolarHBondContact O-N 2.77Å
99	I	97.9	Very high	94.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	127.6	-179.2	-55.7	-173.1	0	0	0	108.7	A83 P85 F89 V96 F101 V106 F107 L138 I161	A83-I99 PolarHBondContact N-O 2.75Å; A83-I99 PolarHBondContact O-N 2.82Å; P85-I99 HydrophobicContact CG-CD1 4.08Å; P85-I99 HydrophobicContact CG-CG1 4.13Å; F89-I99 HydrophobicContact CE1-CD1 4.27Å; F89-I99 HydrophobicContact CZ-CD1 3.83Å; V96-I99 HydrophobicContact CG1-CD1 4.21Å; V96-I99 HydrophobicContact CG1-CG1 3.82Å; I99-F101 HydrophobicContact CB-CE2 4.1Å; I99-F101 HydrophobicContact CB-CZ 4.43Å; I99-F101 HydrophobicContact CG2-CD2 4.14Å; I99-F101 HydrophobicContact CG2-CE1 4.22Å; I99-F101 HydrophobicContact CG2-CE2 3.67Å; I99-F101 HydrophobicContact CG2-CZ 3.7Å; I99-V106 HydrophobicContact CG2-CG1 3.23Å; I99-F107 WeakPolarHBondContact CA-O 3.4Å; I99-F107 WeakPolarHBondContact CG2-O 3.47Å; I99-L138 HydrophobicContact CB-CD2 4.48Å; I99-L138 HydrophobicContact CD1-CD2 3.61Å; I99-L138 HydrophobicContact CG1-CD2 4.35Å; I99-I161 HydrophobicContact CD1-CD1 3.48Å; I99-I161 VanDerWaalsContact CD1-CD1 3.48Å
100	D	97.8	Very high	94.3	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.032	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	114.3	172.7	-77.5	-7.4	0	0	0	109.5	R80 K82 Y102 V106 F107 Y109	R80-D100 WeakPolarHBondContact CD-OD2 3.29Å; R80-D100 HydrophobicContact CG-CB 4.28Å; R80-D100 IonicContact CZ-OD2 3.98Å; R80-D100 IonicContact NH1-OD2 3.14Å; R80-D100 PolarHBondContact NH1-OD2 2.85Å; R80-D100 VanDerWaalsContact NH1-OD2 3.14Å; K82-D100 WeakPolarHBondContact CB-OD1 3.3Å; K82-D100 WeakPolarHBondContact CD-OD1 3.42Å; K82-D100 WeakPolarHBondContact CG-OD1 3.26Å; D100-Y102 HydrophobicContact CB-CD2 4.24Å; D100-Y102 HydrophobicContact CB-CE2 3.74Å; D100-V106 WeakPolarHBondContact O-CA 3.22Å; D100-F107 HydrophobicContact CB-CB 4.42Å; D100-F107 PolarHBondContact N-O 2.95Å; D100-F107 PolarHBondContact O-N 2.79Å; D100-Y109 HydrophobicContact CB-CE2 4.08Å
101	F	97.7	Very high	94.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.9	172.1	-63.3	-86.6	0	0	0	110	I77 R80 Y81 A83 I99 V106 V131 L138 V140	I77-F101 HydrophobicContact CD1-CB 3.63Å; R80-F101 CarbonylContact C-O 3.45Å; R80-F101 WeakPolarHBondContact CA-O 3.4Å; Y81-F101 HydrophobicContact CD1-CD2 4.28Å; Y81-F101 PolarHBondContact N-O 2.88Å; Y81-F101 PolarHBondContact O-N 2.85Å; A83-F101 HydrophobicContact CB-CD2 4.16Å; A83-F101 HydrophobicContact CB-CE2 3.72Å; I99-F101 HydrophobicContact CB-CE2 4.1Å; I99-F101 HydrophobicContact CB-CZ 4.43Å; I99-F101 HydrophobicContact CG2-CD2 4.14Å; I99-F101 HydrophobicContact CG2-CE1 4.22Å; I99-F101 HydrophobicContact CG2-CE2 3.67Å; I99-F101 HydrophobicContact CG2-CZ 3.7Å; F101-V106 HydrophobicContact CD1-CB 4.3Å; F101-V106 HydrophobicContact CD1-CG1 3.8Å; F101-V106 HydrophobicContact CD1-CG2 3.58Å; F101-V106 HydrophobicContact CE1-CB 4.46Å; F101-V106 HydrophobicContact CE1-CG1 3.66Å; F101-V106 HydrophobicContact CE1-CG2 3.9Å; F101-V106 HydrophobicContact CG-CG1 4.49Å; F101-V106 HydrophobicContact CZ-CG1 4.26Å; F101-V131 HydrophobicContact CB-CG2 3.98Å; F101-V131 HydrophobicContact CD2-CG1 4.23Å; F101-V131 HydrophobicContact CD2-CG2 4.2Å; F101-V131 HydrophobicContact CE2-CG1 4.27Å; F101-V131 HydrophobicContact CG-CG2 3.98Å; F101-L138 HydrophobicContact CE2-CD1 3.93Å; F101-L138 HydrophobicContact CE2-CD2 4.06Å; F101-L138 HydrophobicContact CE2-CG 4.02Å; F101-L138 HydrophobicContact CZ-CD1 4.14Å; F101-L138 HydrophobicContact CZ-CD2 4Å; F101-L138 HydrophobicContact CZ-CG 3.78Å; F101-V140 HydrophobicContact CD1-CB 3.65Å; F101-V140 HydrophobicContact CD1-CG1 3.61Å; F101-V140 HydrophobicContact CD1-CG2 4.43Å; F101-V140 HydrophobicContact CE1-CB 3.96Å; F101-V140 HydrophobicContact CE1-CG1 3.8Å
102	Y	95.1	Very high	94.3	Very high	51 Å²	51	40.8 Å²	40.8	20%	0.2	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	169.6	168.3	-70.4	-101.5	0	0	0	109.8	Y79 R80 D100 N104 H105 F107 R142	Y79-Y102 HydrophobicContact CE1-CE1 4.06Å; Y79-Y102 HydrophobicContact CE2-CE1 4.33Å; Y79-Y102 AromaticContact CZ-CE1 3.91Å; Y79-Y102 VanDerWaalsContact O-CD1 3.31Å; Y79-Y102 WeakPolarHBondContact O-CD1 3.5Å; R80-Y102 HydrophobicContact CB-CD1 4.35Å; R80-Y102 HydrophobicContact CB-CE1 4.05Å; R80-Y102 HydrophobicContact CG-CD2 4.49Å; R80-Y102 HydrophobicContact CG-CE1 4.34Å; R80-Y102 HydrophobicContact CG-CE2 4.08Å; D100-Y102 HydrophobicContact CB-CD2 4.24Å; D100-Y102 HydrophobicContact CB-CE2 3.74Å; Y102-N104 PolarHBondContact O-N 2.74Å; Y102-N104 VanDerWaalsContact O-N 3.13Å; Y102-H105 WeakPolarHBondContact CA-O 3.44Å; Y102-H105 WeakPolarHBondContact CB-O 3.33Å; Y102-H105 PolarHBondContact N-O 2.93Å; Y102-F107 AromaticContact CD2-CD2 3.5Å; Y102-F107 HydrophobicContact CD2-CD2 3.5Å; Y102-F107 VanDerWaalsContact CD2-CD2 3.5Å; Y102-F107 AromaticContact CD2-CE2 3.7Å; Y102-F107 HydrophobicContact CD2-CE2 3.7Å; Y102-F107 AromaticContact CE2-CD2 3.56Å; Y102-F107 HydrophobicContact CE2-CD2 3.56Å; Y102-F107 AromaticContact CE2-CE2 3.86Å; Y102-F107 HydrophobicContact CE2-CE2 3.86Å; Y102-F107 HydrophobicContact CG-CE2 4.36Å; Y102-R142 PolarHBondContact O-NH2 3.43Å
103	N	89.1	Confident	94.6	Very high	48 Å²	48	43.8 Å²	43.8	26%	0.257	23%	0.23	S	C	.	.	S	Bend	trans	-54.4	-34	178.9	-69.8	-26.3	0	0	0	113.3	S129 R142	N103-S129 PolarHBondContact O-OG 2.95Å; N103-R142 WeakPolarHBondContact O-CD 3.42Å; N103-R142 PolarHBondContact O-NE 3.05Å
104	N	85.9	Confident	94.9	Very high	38 Å²	38	41.1 Å²	41.1	20%	0.203	20%	0.2	C	C	.	.	S	Bend	trans	-122.8	-9.9	-176.4	-63.7	-17.3	0	0	0	115.3	Y102 Y120 Y124	Y102-N104 PolarHBondContact O-N 2.74Å; Y102-N104 VanDerWaalsContact O-N 3.13Å; N104-Y120 HydrophobicContact CB-CG 4.42Å; N104-Y120 WeakPolarHBondContact O-CD1 3.15Å; N104-Y124 PolarHBondContact ND2-OH 3.3Å; N104-Y124 PolarHBondContact OD1-OH 3.18Å; N104-Y124 VanDerWaalsContact OD1-OH 3.12Å
105	H	91.8	Very high	95.2	Very high	59 Å²	59	39.2 Å²	39.2	27%	0.273	19%	0.194	S	C	.	.			trans	-139.4	150.5	-172.2	-63	83.7	0	0	0	109.9	Y102 F107 N118	Y102-H105 WeakPolarHBondContact CA-O 3.44Å; Y102-H105 WeakPolarHBondContact CB-O 3.33Å; Y102-H105 PolarHBondContact N-O 2.93Å; H105-F107 HydrophobicContact CB-CD2 4.28Å; H105-F107 HydrophobicContact CB-CE2 3.67Å; H105-F107 HydrophobicContact CB-CZ 3.99Å; H105-N118 PolarHBondContact CD2-OD1 3.15Å
106	V	97.7	Very high	95.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.1	168.4	-176.8	0	0	0	0	107.1	I99 D100 F101 N116 I117 V140 I159	I99-V106 HydrophobicContact CG2-CG1 3.23Å; D100-V106 WeakPolarHBondContact O-CA 3.22Å; F101-V106 HydrophobicContact CD1-CB 4.3Å; F101-V106 HydrophobicContact CD1-CG1 3.8Å; F101-V106 HydrophobicContact CD1-CG2 3.58Å; F101-V106 HydrophobicContact CE1-CB 4.46Å; F101-V106 HydrophobicContact CE1-CG1 3.66Å; F101-V106 HydrophobicContact CE1-CG2 3.9Å; F101-V106 HydrophobicContact CG-CG1 4.49Å; F101-V106 HydrophobicContact CZ-CG1 4.26Å; V106-N116 CarbonylContact O-C 3.59Å; V106-N116 VanDerWaalsContact O-CA 3.24Å; V106-N116 WeakPolarHBondContact O-CA 3.45Å; V106-I117 HydrophobicContact CB-CB 4.13Å; V106-I117 VanDerWaalsContact CB-O 3.25Å; V106-I117 WeakPolarHBondContact CB-O 3.27Å; V106-I117 PolarHBondContact N-O 3.13Å; V106-I117 PolarHBondContact O-N 3.14Å; V106-V140 HydrophobicContact CG2-CG1 3.99Å; V106-I159 HydrophobicContact CG2-CD1 3.78Å
107	F	97.8	Very high	95.4	Very high	55 Å²	55	38 Å²	38	24%	0.241	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.6	178.9	-64.9	-87.5	0	0	0	109.4	I99 D100 Y102 H105 Y109 H113 N116	I99-F107 WeakPolarHBondContact CA-O 3.4Å; I99-F107 WeakPolarHBondContact CG2-O 3.47Å; D100-F107 HydrophobicContact CB-CB 4.42Å; D100-F107 PolarHBondContact N-O 2.95Å; D100-F107 PolarHBondContact O-N 2.79Å; Y102-F107 AromaticContact CD2-CD2 3.5Å; Y102-F107 HydrophobicContact CD2-CD2 3.5Å; Y102-F107 VanDerWaalsContact CD2-CD2 3.5Å; Y102-F107 AromaticContact CD2-CE2 3.7Å; Y102-F107 HydrophobicContact CD2-CE2 3.7Å; Y102-F107 AromaticContact CE2-CD2 3.56Å; Y102-F107 HydrophobicContact CE2-CD2 3.56Å; Y102-F107 AromaticContact CE2-CE2 3.86Å; Y102-F107 HydrophobicContact CE2-CE2 3.86Å; Y102-F107 HydrophobicContact CG-CE2 4.36Å; H105-F107 HydrophobicContact CB-CD2 4.28Å; H105-F107 HydrophobicContact CB-CE2 3.67Å; H105-F107 HydrophobicContact CB-CZ 3.99Å; F107-Y109 HydrophobicContact CB-CD2 4.42Å; F107-Y109 HydrophobicContact CB-CE2 3.43Å; F107-Y109 VanDerWaalsContact CB-CE2 3.43Å; F107-Y109 WeakPolarHBondContact CB-OH 3.41Å; F107-H113 AromaticContact CD1-CD2 3.85Å; F107-H113 AromaticContact CD1-NE2 3.54Å; F107-N116 WeakPolarHBondContact CD1-OD1 3.47Å; F107-N116 VanDerWaalsContact CE1-OD1 3.3Å; F107-N116 WeakPolarHBondContact CE1-OD1 3.34Å
108	V	97.9	Very high	95.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.5	-176.2	-169.3	0	0	0	0	109.2	F91 V96 I114 G115 I117	F91-V108 HydrophobicContact CB-CG1 4.26Å; F91-V108 HydrophobicContact CD1-CB 4.14Å; F91-V108 HydrophobicContact CD1-CG1 4.03Å; F91-V108 HydrophobicContact CD1-CG2 4.35Å; F91-V108 HydrophobicContact CE1-CB 4.41Å; F91-V108 HydrophobicContact CE1-CG2 4.33Å; F91-V108 HydrophobicContact CG-CG1 4.29Å; V96-V108 HydrophobicContact CB-CG1 4.21Å; V96-V108 HydrophobicContact CG1-CG1 3.6Å; V96-V108 HydrophobicContact CG2-CG1 3.54Å; V108-I114 HydrophobicContact CB-CG1 4.19Å; V108-I114 HydrophobicContact CG1-CD1 3.91Å; V108-I114 HydrophobicContact CG1-CG1 4.07Å; V108-I114 WeakPolarHBondContact O-CG1 3.36Å; V108-I114 PolarHBondContact O-N 2.87Å; V108-G115 PolarHBondContact N-O 2.88Å; V108-G115 PolarHBondContact O-N 2.92Å; V108-I117 HydrophobicContact CG2-CD1 3.91Å; V108-I117 HydrophobicContact CG2-CG1 3.98Å
109	Y	97.7	Very high	95.3	Very high	51 Å²	51	32.1 Å²	32.1	20%	0.2	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142.3	-174.5	-60.6	-94.6	0	0	0	112.3	V96 K97 D98 D100 F107 N112 H113	V96-Y109 WeakPolarHBondContact CA-O 3.36Å; K97-Y109 PolarHBondContact N-O 3.42Å; D98-Y109 PolarHBondContact N-O 3.16Å; D98-Y109 PolarHBondContact O-N 2.77Å; D100-Y109 HydrophobicContact CB-CE2 4.08Å; F107-Y109 HydrophobicContact CB-CD2 4.42Å; F107-Y109 HydrophobicContact CB-CE2 3.43Å; F107-Y109 VanDerWaalsContact CB-CE2 3.43Å; F107-Y109 WeakPolarHBondContact CB-OH 3.41Å; Y109-N112 WeakPolarHBondContact CA-O 3.37Å; Y109-H113 VanDerWaalsContact CD1-CA 3.48Å; Y109-H113 HydrophobicContact CD1-CB 4.02Å; Y109-H113 HydrophobicContact CE1-CB 3.67Å
110	E	94.7	Very high	95.1	Very high	62 Å²	62	33.6 Å²	33.6	29%	0.29	17%	0.168	S	C	.	.	S	Bend	trans	-102.1	-81.8	161.5	173.7	-171.7	-110.8	0	0	108.8	H95 K97 N112 I114	H95-E110 PolarHBondContact N-OE1 3.24Å; H95-E110 VanDerWaalsContact O-CB 3.25Å; H95-E110 WeakPolarHBondContact O-CB 3.34Å; H95-E110 VanDerWaalsContact O-CG 3.22Å; H95-E110 WeakPolarHBondContact O-CG 3.34Å; K97-E110 WeakPolarHBondContact CB-O 3.28Å; K97-E110 WeakPolarHBondContact CD-O 3.39Å; K97-E110 WeakPolarHBondContact CG-O 3.41Å; E110-N112 PolarHBondContact N-O 3.07Å; E110-N112 VanDerWaalsContact N-O 3.13Å; E110-I114 HydrophobicContact CB-CD1 4.43Å; E110-I114 HydrophobicContact CB-CG2 4.09Å
111	S	92.5	Very high	95	Very high	78 Å²	78	33.4 Å²	33.4	55%	0.545	17%	0.167	S	C	.	.	S	Bend	trans	-115.6	-17.6	164.7	-50.3	0	0	0	0	111.3	K97	K97-S111 PolarHBondContact NZ-OG 2.85Å
112	N	93.1	Very high	94.8	Very high	103 Å²	103	39.7 Å²	39.7	55%	0.551	19%	0.19	S	C	*	.	S	Bend	trans	-131.1	171.5	171.1	-62.6	-68.9	0	0	0	107.8	Y109 E110 I114	Y109-N112 WeakPolarHBondContact CA-O 3.37Å; E110-N112 PolarHBondContact N-O 3.07Å; E110-N112 VanDerWaalsContact N-O 3.13Å; N112-I114 PolarHBondContact O-N 2.85Å
113	H	95.5	Very high	94.5	Very high	80 Å²	80	43.8 Å²	43.8	37%	0.37	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	126.7	171	178	-107.5	0	0	0	110.3	F107 Y109 G115 N116	F107-H113 AromaticContact CD1-CD2 3.85Å; F107-H113 AromaticContact CD1-NE2 3.54Å; Y109-H113 VanDerWaalsContact CD1-CA 3.48Å; Y109-H113 HydrophobicContact CD1-CB 4.02Å; Y109-H113 HydrophobicContact CE1-CB 3.67Å; H113-G115 PolarHBondContact NE2-O 3.02Å; H113-N116 PolarHBondContact CE1-OD1 2.8Å; H113-N116 PolarHBondContact NE2-OD1 3.42Å
114	I	95	Very high	94.6	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.046	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-19.9	-179.7	55.1	167.6	0	0	0	112.8	F91 Y94 V96 V108 E110 N112 T190	F91-I114 HydrophobicContact CB-CD1 4.36Å; F91-I114 HydrophobicContact CD1-CD1 4.21Å; F91-I114 HydrophobicContact CD1-CG1 4.42Å; Y94-I114 HydrophobicContact CD1-CG2 4.21Å; Y94-I114 HydrophobicContact CD2-CB 4.26Å; Y94-I114 HydrophobicContact CD2-CG2 4.15Å; Y94-I114 HydrophobicContact CG-CB 4.37Å; Y94-I114 HydrophobicContact CG-CD1 4.36Å; Y94-I114 HydrophobicContact CG-CG2 3.88Å; V96-I114 HydrophobicContact CG2-CD1 4.19Å; V108-I114 HydrophobicContact CB-CG1 4.19Å; V108-I114 HydrophobicContact CG1-CD1 3.91Å; V108-I114 HydrophobicContact CG1-CG1 4.07Å; V108-I114 WeakPolarHBondContact O-CG1 3.36Å; V108-I114 PolarHBondContact O-N 2.87Å; E110-I114 HydrophobicContact CB-CD1 4.43Å; E110-I114 HydrophobicContact CB-CG2 4.09Å; N112-I114 PolarHBondContact O-N 2.85Å; I114-T190 PolarHBondContact O-N 3.23Å; I114-T190 PolarHBondContact O-OG1 2.75Å
115	G	96.4	Very high	95	Very high	2 Å²	2	49.2 Å²	49.2	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.5	-169.5	174.1	0	0	0	0	0	114.9	V108 H113 V188	V108-G115 PolarHBondContact N-O 2.88Å; V108-G115 PolarHBondContact O-N 2.92Å; H113-G115 PolarHBondContact NE2-O 3.02Å; G115-V188 CarbonylContact C-O 3.6Å; G115-V188 WeakPolarHBondContact CA-O 3.45Å
116	N	97	Very high	95.1	Very high	29 Å²	29	50.7 Å²	50.7	16%	0.155	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.1	-170.1	-54	-48.3	0	0	0	111.7	V106 F107 H113 V188	V106-N116 CarbonylContact O-C 3.59Å; V106-N116 VanDerWaalsContact O-CA 3.24Å; V106-N116 WeakPolarHBondContact O-CA 3.45Å; F107-N116 WeakPolarHBondContact CD1-OD1 3.47Å; F107-N116 VanDerWaalsContact CE1-OD1 3.3Å; F107-N116 WeakPolarHBondContact CE1-OD1 3.34Å; H113-N116 PolarHBondContact CE1-OD1 2.8Å; H113-N116 PolarHBondContact NE2-OD1 3.42Å; N116-V188 HydrophobicContact CB-CB 4.34Å; N116-V188 PolarHBondContact N-O 3.17Å; N116-V188 PolarHBondContact O-N 2.91Å
117	I	97.6	Very high	94.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	106	169.7	-52.1	171.4	0	0	0	106.9	F91 V106 V108 I159 I161 I167 F169 I187	F91-I117 HydrophobicContact CE2-CD1 4.46Å; F91-I117 HydrophobicContact CE2-CG1 4.18Å; F91-I117 HydrophobicContact CZ-CG1 4.19Å; V106-I117 HydrophobicContact CB-CB 4.13Å; V106-I117 VanDerWaalsContact CB-O 3.25Å; V106-I117 WeakPolarHBondContact CB-O 3.27Å; V106-I117 PolarHBondContact N-O 3.13Å; V106-I117 PolarHBondContact O-N 3.14Å; V108-I117 HydrophobicContact CG2-CD1 3.91Å; V108-I117 HydrophobicContact CG2-CG1 3.98Å; I117-I159 HydrophobicContact CG2-CD1 4.04Å; I117-I159 HydrophobicContact CG2-CG2 3.81Å; I117-I161 HydrophobicContact CD1-CD1 3.8Å; I117-I161 HydrophobicContact CD1-CG1 4.28Å; I117-I167 HydrophobicContact CD1-CD1 3.61Å; I117-I167 HydrophobicContact CD1-CG1 4.15Å; I117-I167 HydrophobicContact CD1-CG2 4.41Å; I117-I167 HydrophobicContact CG1-CD1 4.12Å; I117-I167 HydrophobicContact CG2-CG2 3.9Å; I117-F169 HydrophobicContact CG2-CE1 3.44Å; I117-F169 VanDerWaalsContact CG2-CE1 3.44Å; I117-F169 HydrophobicContact CG2-CZ 3.53Å; I117-I187 HydrophobicContact CG1-CG2 4.45Å; I117-I187 HydrophobicContact CG2-CG2 4.12Å
118	N	95.9	Very high	94.8	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.011	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.8	-172.3	-60.9	-39.7	0	0	0	110.1	H105 Y120 T185 R186	H105-N118 PolarHBondContact CD2-OD1 3.15Å; N118-Y120 HydrophobicContact CB-CD1 4.24Å; N118-Y120 HydrophobicContact CB-CE1 4.17Å; N118-T185 CarbonylContact O-C 3.46Å; N118-T185 VanDerWaalsContact O-CA 3.29Å; N118-T185 WeakPolarHBondContact O-CA 3.4Å; N118-R186 HydrophobicContact CB-CG 3.8Å; N118-R186 PolarHBondContact N-O 3.37Å; N118-R186 PolarHBondContact ND2-NE 3.4Å; N118-R186 PolarHBondContact O-N 2.01Å
119	N	96.4	Very high	94.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	91.8	173.9	-167.6	7.9	0	0	0	108.4	M157 T158 I159 F169 Y171 T185	N119-M157 WeakPolarHBondContact OD1-CE 3.42Å; N119-T158 PolarHBondContact ND2-O 2.87Å; N119-I159 HydrophobicContact CB-CD1 3.64Å; N119-I159 HydrophobicContact CB-CG1 3.6Å; N119-F169 HydrophobicContact CB-CD1 4.21Å; N119-F169 HydrophobicContact CB-CE1 4.25Å; N119-Y171 WeakPolarHBondContact OD1-CE1 3.16Å; N119-T185 HydrophobicContact CB-CG2 4.28Å; N119-T185 PolarHBondContact OD1-OG1 3.36Å
120	Y	94.8	Very high	94.7	Very high	32 Å²	32	53.9 Å²	53.9	13%	0.125	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	166.9	-177.1	71.7	-80.7	0	0	0	111.4	N104 N118 K184	N104-Y120 HydrophobicContact CB-CG 4.42Å; N104-Y120 WeakPolarHBondContact O-CD1 3.15Å; N118-Y120 HydrophobicContact CB-CD1 4.24Å; N118-Y120 HydrophobicContact CB-CE1 4.17Å; Y120-K184 HydrophobicContact CD1-CB 3.91Å; Y120-K184 HydrophobicContact CD2-CB 4.31Å; Y120-K184 HydrophobicContact CE1-CB 3.46Å; Y120-K184 VanDerWaalsContact CE1-CB 3.46Å; Y120-K184 HydrophobicContact CE1-CG 4.31Å; Y120-K184 HydrophobicContact CE2-CB 3.91Å; Y120-K184 HydrophobicContact CE2-CG 4.01Å; Y120-K184 HydrophobicContact CG-CB 4.3Å; Y120-K184 VanDerWaalsContact CZ-CB 3.46Å; Y120-K184 PolarHBondContact N-O 2.99Å; Y120-K184 PolarHBondContact O-N 3.06Å
121	I	95	Very high	94.9	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	150.4	171.6	-162.9	-178.6	0	0	0	110.2	Y124 F144 V146 F155 I178 Q182 F183	I121-Y124 HydrophobicContact CG2-CD1 4.09Å; I121-Y124 HydrophobicContact CG2-CG 4.37Å; I121-Y124 VanDerWaalsContact O-CD1 3.31Å; I121-Y124 WeakPolarHBondContact O-CD1 3.18Å; I121-F144 HydrophobicContact CG2-CB 4.23Å; I121-F144 HydrophobicContact CG2-CD1 3.92Å; I121-F144 HydrophobicContact CG2-CD2 4.42Å; I121-F144 HydrophobicContact CG2-CE1 4.39Å; I121-F144 HydrophobicContact CG2-CG 3.94Å; I121-V146 HydrophobicContact CD1-CG1 4.28Å; I121-V146 HydrophobicContact CG2-CG1 4.43Å; I121-F155 HydrophobicContact CB-CZ 4.06Å; I121-F155 HydrophobicContact CD1-CE1 4.16Å; I121-F155 HydrophobicContact CD1-CZ 3.67Å; I121-F155 HydrophobicContact CG1-CZ 4.42Å; I121-F155 HydrophobicContact CG2-CZ 3.84Å; I121-I178 HydrophobicContact CD1-CD1 4.02Å; I121-I178 HydrophobicContact CD1-CG2 3.72Å; I121-Q182 HydrophobicContact CD1-CB 4.23Å; I121-Q182 HydrophobicContact CG1-CB 3.86Å; I121-F183 HydrophobicContact CB-CD1 4.18Å; I121-F183 HydrophobicContact CB-CE1 4.38Å; I121-F183 HydrophobicContact CD1-CD1 4.15Å; I121-F183 HydrophobicContact CD1-CE1 3.72Å; I121-F183 HydrophobicContact CD1-CZ 4.08Å; I121-F183 HydrophobicContact CG1-CD1 3.92Å; I121-F183 HydrophobicContact CG1-CE1 4.01Å
122	R	93.1	Very high	95.1	Very high	132 Å²	132	47.2 Å²	47.2	50%	0.498	22%	0.223	S	C	.	.	S	Bend	trans	-77.4	163.2	165.8	-66.1	179.1	174	179.6	-3	110.9	Y124 Q182 K184	R122-Y124 VanDerWaalsContact C-N 3.28Å; R122-Y124 PolarHBondContact O-N 3.21Å; R122-Y124 VanDerWaalsContact O-N 3.15Å; R122-Q182 PolarHBondContact N-O 3.06Å; R122-K184 HydrophobicContact CG-CG 4.26Å; R122-K184 VanDerWaalsContact NE-CE 3.25Å
123	N	88.9	Confident	95.3	Very high	138 Å²	138	44.1 Å²	44.1	74%	0.738	21%	0.206	S	C	*	.	S	Bend	trans	56.8	30	169	-54.6	-21.2	0	0	0	116.3
124	Y	92.9	Very high	95.3	Very high	67 Å²	67	43.5 Å²	43.5	26%	0.263	20%	0.203	S	C	.	.			trans	-79.5	153.3	172.5	66.6	-88.1	0	0	0	112	N104 I121 R122 N126 S127 F144	N104-Y124 PolarHBondContact ND2-OH 3.3Å; N104-Y124 PolarHBondContact OD1-OH 3.18Å; N104-Y124 VanDerWaalsContact OD1-OH 3.12Å; I121-Y124 HydrophobicContact CG2-CD1 4.09Å; I121-Y124 HydrophobicContact CG2-CG 4.37Å; I121-Y124 VanDerWaalsContact O-CD1 3.31Å; I121-Y124 WeakPolarHBondContact O-CD1 3.18Å; R122-Y124 VanDerWaalsContact C-N 3.28Å; R122-Y124 PolarHBondContact O-N 3.21Å; R122-Y124 VanDerWaalsContact O-N 3.15Å; Y124-N126 WeakPolarHBondContact CD2-O 2.8Å; Y124-S127 WeakPolarHBondContact CE2-OG 3.44Å; Y124-F144 AromaticContact CD1-CD1 3.95Å; Y124-F144 HydrophobicContact CD1-CD1 3.95Å; Y124-F144 HydrophobicContact CD1-CE1 4.03Å; Y124-F144 HydrophobicContact CD2-CD1 4.04Å; Y124-F144 HydrophobicContact CE1-CD1 4.43Å; Y124-F144 HydrophobicContact CE1-CE1 4.11Å; Y124-F144 HydrophobicContact CE2-CD1 4.5Å; Y124-F144 AromaticContact CG-CD1 3.74Å; Y124-F144 HydrophobicContact CG-CD1 3.74Å; Y124-F144 HydrophobicContact CG-CE1 4.24Å
125	K	93.4	Very high	95.3	Very high	133 Å²	133	48 Å²	48	58%	0.578	23%	0.227	S	C	*	.	S	Bend	trans	-82.1	-52.9	177.5	-179.6	-176.7	173.9	-171.1	0	110.9	S145 E152	K125-S145 PolarHBondContact N-O 3.01Å; K125-E152 IonicContact NZ-OE2 3.63Å; K125-E152 PolarHBondContact NZ-OE2 2.89Å
126	N	93.2	Very high	95.2	Very high	89 Å²	89	56 Å²	56	48%	0.476	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	153.5	-179.3	-72	-34.1	0	0	0	110.4	Y124 S145	Y124-N126 WeakPolarHBondContact CD2-O 2.8Å; N126-S145 PolarHBondContact N-O 2.82Å; N126-S145 PolarHBondContact O-N 3.48Å
127	S	94.3	Very high	95.2	Very high	36 Å²	36	55.4 Å²	55.4	25%	0.252	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	135.9	173.5	62.5	0	0	0	0	110.2	Y124 N143	Y124-S127 WeakPolarHBondContact CE2-OG 3.44Å; S127-N143 CarbonylContact C-O 3.56Å; S127-N143 VanDerWaalsContact CA-O 3.27Å; S127-N143 WeakPolarHBondContact CA-O 3.36Å
128	E	95.1	Very high	95.2	Very high	60 Å²	60	55.3 Å²	55.3	28%	0.28	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.3	168.3	-173.5	173.4	-144.6	0	0	109.7	K76 R130 R142 N143	K76-E128 IonicContact NZ-OE1 3.99Å; E128-R130 IonicContact OE1-CZ 3.18Å; E128-R130 IonicContact OE1-NH1 2.88Å; E128-R130 IonicContact OE1-NH2 3.58Å; E128-R130 PolarHBondContact OE1-NH2 3.25Å; E128-R130 IonicContact OE2-CZ 2.8Å; E128-R130 VanDerWaalsContact OE2-CZ 3.23Å; E128-R130 IonicContact OE2-NH1 2.74Å; E128-R130 PolarHBondContact OE2-NH1 2.73Å; E128-R130 IonicContact OE2-NH2 3.64Å; E128-R130 PolarHBondContact OE2-NH2 2.67Å; E128-R142 CarbonylContact O-C 3.58Å; E128-R142 WeakPolarHBondContact O-CA 3.41Å; E128-N143 PolarHBondContact N-O 2.78Å; E128-N143 PolarHBondContact O-N 3.14Å
129	S	97	Very high	95.3	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.007	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.4	-179.6	-59.9	0	0	0	0	111	I77 N103 Q141 R142	I77-S129 PolarHBondContact N-O 3.27Å; N103-S129 PolarHBondContact O-OG 2.95Å; S129-Q141 CarbonylContact C-O 3.57Å; S129-Q141 WeakPolarHBondContact CA-O 3.23Å; S129-R142 WeakPolarHBondContact OG-CG 3.16Å
130	R	97.4	Very high	95.3	Very high	76 Å²	76	55.2 Å²	55.2	29%	0.287	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.4	174.1	-64.3	-172.5	177.5	76.3	3.5	111	F73 N75 E128 V140 Q141	F73-R130 HydrophobicContact CB-CB 3.78Å; F73-R130 WeakPolarHBondContact CD1-O 3.45Å; F73-R130 WeakPolarHBondContact O-CB 3.37Å; F73-R130 WeakPolarHBondContact O-CD 3.35Å; N75-R130 CarbonylContact O-C 3.58Å; N75-R130 VanDerWaalsContact O-CA 3.25Å; N75-R130 WeakPolarHBondContact O-CA 3.42Å; E128-R130 IonicContact OE1-CZ 3.18Å; E128-R130 IonicContact OE1-NH1 2.88Å; E128-R130 IonicContact OE1-NH2 3.58Å; E128-R130 PolarHBondContact OE1-NH2 3.25Å; E128-R130 IonicContact OE2-CZ 2.8Å; E128-R130 VanDerWaalsContact OE2-CZ 3.23Å; E128-R130 IonicContact OE2-NH1 2.74Å; E128-R130 PolarHBondContact OE2-NH1 2.73Å; E128-R130 IonicContact OE2-NH2 3.64Å; E128-R130 PolarHBondContact OE2-NH2 2.67Å; R130-V140 CarbonylContact O-C 3.58Å; R130-V140 WeakPolarHBondContact O-CA 3.48Å; R130-V140 WeakPolarHBondContact O-CG2 3.39Å; R130-Q141 PolarHBondContact N-O 3Å; R130-Q141 PolarHBondContact O-N 3.1Å
131	V	98	Very high	95.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.7	-177.9	178	0	0	0	0	110.4	K74 N75 I77 Y81 F101 D133 L138 G139 V140	K74-V131 PolarHBondContact N-O 3.49Å; N75-V131 HydrophobicContact CB-CB 4.15Å; N75-V131 PolarHBondContact N-O 2.65Å; N75-V131 VanDerWaalsContact N-O 3.15Å; N75-V131 PolarHBondContact O-N 3.23Å; I77-V131 HydrophobicContact CD1-CG2 3.62Å; I77-V131 HydrophobicContact CG1-CG2 3.7Å; Y81-V131 HydrophobicContact CD1-CB 4.11Å; Y81-V131 HydrophobicContact CD1-CG1 3.81Å; Y81-V131 HydrophobicContact CD1-CG2 3.99Å; Y81-V131 HydrophobicContact CE1-CB 4.33Å; Y81-V131 HydrophobicContact CE1-CG1 3.79Å; Y81-V131 HydrophobicContact CG-CB 4.33Å; Y81-V131 HydrophobicContact CG-CG2 4Å; F101-V131 HydrophobicContact CB-CG2 3.98Å; F101-V131 HydrophobicContact CD2-CG1 4.23Å; F101-V131 HydrophobicContact CD2-CG2 4.2Å; F101-V131 HydrophobicContact CE2-CG1 4.27Å; F101-V131 HydrophobicContact CG-CG2 3.98Å; V131-D133 HydrophobicContact CG1-CB 4.23Å; V131-L138 HydrophobicContact CG1-CD1 4.45Å; V131-G139 CarbonylContact C-O 3.42Å; V131-G139 WeakPolarHBondContact CA-O 3.27Å; V131-G139 WeakPolarHBondContact CG1-O 3.4Å; V131-V140 HydrophobicContact CG2-CB 4.4Å; V131-V140 HydrophobicContact CG2-CG2 4.31Å
132	L	97.7	Very high	95.6	Very high	1 Å²	1	54 Å²	54	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.7	164.2	-179.6	162.4	0	0	0	106.6	V68 R72 F73 E134 L137 L138 G139	V68-L132 HydrophobicContact CG1-CD1 3.62Å; R72-L132 HydrophobicContact CB-CD1 3.67Å; F73-L132 HydrophobicContact CD1-CB 3.53Å; F73-L132 HydrophobicContact CE1-CB 3.68Å; F73-L132 HydrophobicContact CE1-CD1 4.44Å; F73-L132 HydrophobicContact CE2-CD1 4.37Å; F73-L132 HydrophobicContact CG-CB 4.08Å; F73-L132 HydrophobicContact CZ-CB 4.33Å; F73-L132 HydrophobicContact CZ-CD1 4.27Å; L132-E134 HydrophobicContact CD2-CB 4.02Å; L132-E134 HydrophobicContact CD2-CG 3.81Å; L132-E134 HydrophobicContact CG-CG 4.2Å; L132-L137 HydrophobicContact CD1-CD2 4.14Å; L132-L137 HydrophobicContact CD2-CB 3.87Å; L132-L137 HydrophobicContact CD2-CD2 4.06Å; L132-L137 HydrophobicContact CD2-CG 3.9Å; L132-L137 WeakPolarHBondContact CD2-O 3.48Å; L132-L138 CarbonylContact O-C 3.51Å; L132-L138 WeakPolarHBondContact O-CA 2.93Å; L132-L138 WeakPolarHBondContact O-CD1 3.46Å; L132-G139 PolarHBondContact N-O 3.38Å; L132-G139 PolarHBondContact O-N 2.91Å
133	D	96.7	Very high	95.7	Very high	37 Å²	37	50 Å²	50	20%	0.198	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	85.7	-179.2	-172	-3.1	0	0	0	109.5	Y81 V131 L138	Y81-D133 HydrophobicContact CE1-CB 4.37Å; V131-D133 HydrophobicContact CG1-CB 4.23Å; D133-L138 HydrophobicContact CB-CD1 3.81Å
134	E	95.8	Very high	96.1	Very high	68 Å²	68	43.5 Å²	43.5	32%	0.318	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	165.5	-175.4	-64.1	-176.6	-158.1	0	0	111.5	R72 L132 K136 L137	R72-E134 IonicContact CZ-OE1 3.64Å; R72-E134 IonicContact CZ-OE2 2.79Å; R72-E134 IonicContact NE-OE1 3.9Å; R72-E134 PolarHBondContact NE-OE1 3.17Å; R72-E134 IonicContact NE-OE2 3.12Å; R72-E134 IonicContact NH2-OE1 2.62Å; R72-E134 PolarHBondContact NH2-OE1 3.13Å; R72-E134 VanDerWaalsContact NH2-OE1 3.13Å; R72-E134 IonicContact NH2-OE2 3.67Å; R72-E134 PolarHBondContact NH2-OE2 2.86Å; L132-E134 HydrophobicContact CD2-CB 4.02Å; L132-E134 HydrophobicContact CD2-CG 3.81Å; L132-E134 HydrophobicContact CG-CG 4.2Å; E134-K136 PolarHBondContact O-N 3.21Å; E134-K136 VanDerWaalsContact O-N 3.1Å; E134-L137 CarbonylContact C-O 3.59Å; E134-L137 WeakPolarHBondContact CA-O 3.21Å; E134-L137 PolarHBondContact N-O 3.33Å; E134-L137 PolarHBondContact O-N 2.86Å
135	D	94.1	Very high	96.2	Very high	103 Å²	103	41.1 Å²	41.1	55%	0.551	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.4	-172.3	-63	-0.1	0	0	0	114.4	K86 F87	K86-D135 HydrophobicContact CD-CB 4.4Å; K86-D135 WeakPolarHBondContact CD-OD1 3.36Å; K86-D135 WeakPolarHBondContact CE-OD1 3.45Å; K86-D135 IonicContact NZ-OD1 2.76Å; K86-D135 PolarHBondContact NZ-OD1 3.22Å; F87-D135 WeakPolarHBondContact CD1-O 3.27Å
136	K	94.6	Very high	96.3	Very high	171 Å²	171	35.1 Å²	35.1	74%	0.743	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.1	10.4	-176.7	-63.2	-174.6	180	179.9	0	113.3	E134 P163	E134-K136 PolarHBondContact O-N 3.21Å; E134-K136 VanDerWaalsContact O-N 3.1Å; K136-P163 HydrophobicContact CB-CG 4.32Å; K136-P163 WeakPolarHBondContact O-CD 3.27Å; K136-P163 WeakPolarHBondContact O-CG 3.25Å
137	L	97	Very high	96.2	Very high	15 Å²	15	36.1 Å²	36.1	8%	0.079	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	133.7	-179.1	-166.8	65.2	0	0	0	110.2	V68 L132 E134 L160	V68-L137 HydrophobicContact CG2-CD2 3.72Å; L132-L137 HydrophobicContact CD1-CD2 4.14Å; L132-L137 HydrophobicContact CD2-CB 3.87Å; L132-L137 HydrophobicContact CD2-CD2 4.06Å; L132-L137 HydrophobicContact CD2-CG 3.9Å; L132-L137 WeakPolarHBondContact CD2-O 3.48Å; E134-L137 CarbonylContact C-O 3.59Å; E134-L137 WeakPolarHBondContact CA-O 3.21Å; E134-L137 PolarHBondContact N-O 3.33Å; E134-L137 PolarHBondContact O-N 2.86Å; L137-L160 HydrophobicContact CD1-CB 4.35Å; L137-L160 HydrophobicContact CD1-CD2 4.48Å; L137-L160 HydrophobicContact CD2-CD2 4.19Å; L137-L160 HydrophobicContact CG-CD2 4.36Å
138	L	97.6	Very high	96.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145	173.3	-178.2	67	0	0	0	108.3	A83 P85 F87 I99 F101 V131 L132 D133 L160 I161	A83-L138 HydrophobicContact CB-CD1 3.75Å; A83-L138 HydrophobicContact CB-CD2 4.14Å; P85-L138 HydrophobicContact CB-CD2 4.38Å; P85-L138 HydrophobicContact CG-CD2 3.88Å; F87-L138 HydrophobicContact CE1-CB 4.15Å; F87-L138 HydrophobicContact CZ-CB 3.98Å; I99-L138 HydrophobicContact CB-CD2 4.48Å; I99-L138 HydrophobicContact CD1-CD2 3.61Å; I99-L138 HydrophobicContact CG1-CD2 4.35Å; F101-L138 HydrophobicContact CE2-CD1 3.93Å; F101-L138 HydrophobicContact CE2-CD2 4.06Å; F101-L138 HydrophobicContact CE2-CG 4.02Å; F101-L138 HydrophobicContact CZ-CD1 4.14Å; F101-L138 HydrophobicContact CZ-CD2 4Å; F101-L138 HydrophobicContact CZ-CG 3.78Å; V131-L138 HydrophobicContact CG1-CD1 4.45Å; L132-L138 CarbonylContact O-C 3.51Å; L132-L138 WeakPolarHBondContact O-CA 2.93Å; L132-L138 WeakPolarHBondContact O-CD1 3.46Å; D133-L138 HydrophobicContact CB-CD1 3.81Å; L138-L160 CarbonylContact O-C 3.53Å; L138-I161 HydrophobicContact CB-CB 4.41Å; L138-I161 PolarHBondContact N-O 2.86Å; L138-I161 VanDerWaalsContact N-O 3.11Å; L138-I161 PolarHBondContact O-N 2.84Å
139	G	97.6	Very high	95.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177	171.7	-179.2	0	0	0	0	0	114.4	V131 L132 I159	V131-G139 CarbonylContact C-O 3.42Å; V131-G139 WeakPolarHBondContact CA-O 3.27Å; V131-G139 WeakPolarHBondContact CG1-O 3.4Å; L132-G139 PolarHBondContact N-O 3.38Å; L132-G139 PolarHBondContact O-N 2.91Å; G139-I159 CarbonylContact C-O 3.59Å; G139-I159 WeakPolarHBondContact CA-O 3.25Å
140	V	98	Very high	95.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.3	175	58.5	0	0	0	0	109.6	I77 F101 V106 R130 V131 R142 T158 I159	I77-V140 HydrophobicContact CD1-CG2 3.93Å; F101-V140 HydrophobicContact CD1-CB 3.65Å; F101-V140 HydrophobicContact CD1-CG1 3.61Å; F101-V140 HydrophobicContact CD1-CG2 4.43Å; F101-V140 HydrophobicContact CE1-CB 3.96Å; F101-V140 HydrophobicContact CE1-CG1 3.8Å; V106-V140 HydrophobicContact CG2-CG1 3.99Å; R130-V140 CarbonylContact O-C 3.58Å; R130-V140 WeakPolarHBondContact O-CA 3.48Å; R130-V140 WeakPolarHBondContact O-CG2 3.39Å; V131-V140 HydrophobicContact CG2-CB 4.4Å; V131-V140 HydrophobicContact CG2-CG2 4.31Å; V140-R142 HydrophobicContact CG2-CG 4.14Å; V140-T158 CarbonylContact O-C 3.53Å; V140-T158 WeakPolarHBondContact O-CA 3.49Å; V140-I159 HydrophobicContact CG1-CB 3.9Å; V140-I159 HydrophobicContact CG1-CD1 3.99Å; V140-I159 HydrophobicContact CG1-CG1 4.11Å; V140-I159 PolarHBondContact N-O 2.77Å; V140-I159 PolarHBondContact O-N 3.45Å
141	Q	97.6	Very high	95.3	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.037	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.7	170.8	-177.9	178.6	78.3	0	0	108.5	S70 F73 S129 R130 T156	S70-Q141 PolarHBondContact OG-NE2 2.9Å; F73-Q141 HydrophobicContact CB-CB 4.25Å; F73-Q141 HydrophobicContact CD1-CB 3.59Å; F73-Q141 HydrophobicContact CD2-CB 3.9Å; F73-Q141 HydrophobicContact CE1-CB 3.81Å; F73-Q141 HydrophobicContact CE2-CB 4.11Å; F73-Q141 HydrophobicContact CG-CB 3.64Å; F73-Q141 HydrophobicContact CZ-CB 4.06Å; S129-Q141 CarbonylContact C-O 3.57Å; S129-Q141 WeakPolarHBondContact CA-O 3.23Å; R130-Q141 PolarHBondContact N-O 3Å; R130-Q141 PolarHBondContact O-N 3.1Å; Q141-T156 HydrophobicContact CG-CG2 3.31Å
142	R	96.8	Very high	95.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.9	180	-56	-170	169.7	87.3	2.3	110.1	Y102 N103 E128 S129 V140 F144 T156 M157	Y102-R142 PolarHBondContact O-NH2 3.43Å; N103-R142 WeakPolarHBondContact O-CD 3.42Å; N103-R142 PolarHBondContact O-NE 3.05Å; E128-R142 CarbonylContact O-C 3.58Å; E128-R142 WeakPolarHBondContact O-CA 3.41Å; S129-R142 WeakPolarHBondContact OG-CG 3.16Å; V140-R142 HydrophobicContact CG2-CG 4.14Å; R142-F144 HydrophobicContact CB-CD2 4.22Å; R142-F144 HydrophobicContact CB-CE2 3.55Å; R142-F144 HydrophobicContact CB-CZ 3.92Å; R142-F144 HydrophobicContact CG-CE2 4.47Å; R142-T156 CarbonylContact O-C 3.43Å; R142-T156 WeakPolarHBondContact O-CA 3.35Å; R142-M157 PolarHBondContact N-O 2.94Å; R142-M157 PolarHBondContact O-N 2.96Å
143	N	96.4	Very high	95	Very high	48 Å²	48	48.6 Å²	48.6	26%	0.257	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.6	172	-61.6	-14.9	0	0	0	107.8	S127 E128 F155 T156	S127-N143 CarbonylContact C-O 3.56Å; S127-N143 VanDerWaalsContact CA-O 3.27Å; S127-N143 WeakPolarHBondContact CA-O 3.36Å; E128-N143 PolarHBondContact N-O 2.78Å; E128-N143 PolarHBondContact O-N 3.14Å; N143-F155 CarbonylContact C-O 3.48Å; N143-F155 WeakPolarHBondContact CA-O 3.38Å; N143-T156 WeakPolarHBondContact OD1-CG2 3.02Å; N143-T156 PolarHBondContact OD1-OG1 2.89Å; N143-T156 VanDerWaalsContact OD1-OG1 3.04Å
144	F	96	Very high	95	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139	177	-67.6	-79.1	0	0	0	109.9	I121 Y124 R142 T154 F155 M157	I121-F144 HydrophobicContact CG2-CB 4.23Å; I121-F144 HydrophobicContact CG2-CD1 3.92Å; I121-F144 HydrophobicContact CG2-CD2 4.42Å; I121-F144 HydrophobicContact CG2-CE1 4.39Å; I121-F144 HydrophobicContact CG2-CG 3.94Å; Y124-F144 AromaticContact CD1-CD1 3.95Å; Y124-F144 HydrophobicContact CD1-CD1 3.95Å; Y124-F144 HydrophobicContact CD1-CE1 4.03Å; Y124-F144 HydrophobicContact CD2-CD1 4.04Å; Y124-F144 HydrophobicContact CE1-CD1 4.43Å; Y124-F144 HydrophobicContact CE1-CE1 4.11Å; Y124-F144 HydrophobicContact CE2-CD1 4.5Å; Y124-F144 AromaticContact CG-CD1 3.74Å; Y124-F144 HydrophobicContact CG-CD1 3.74Å; Y124-F144 HydrophobicContact CG-CE1 4.24Å; R142-F144 HydrophobicContact CB-CD2 4.22Å; R142-F144 HydrophobicContact CB-CE2 3.55Å; R142-F144 HydrophobicContact CB-CZ 3.92Å; R142-F144 HydrophobicContact CG-CE2 4.47Å; F144-T154 VanDerWaalsContact O-CA 3.25Å; F144-T154 WeakPolarHBondContact O-CA 3.35Å; F144-F155 HydrophobicContact CB-CD2 4.42Å; F144-F155 HydrophobicContact CB-CE1 4.06Å; F144-F155 HydrophobicContact CB-CE2 3.95Å; F144-F155 HydrophobicContact CB-CZ 3.75Å; F144-F155 AromaticContact CD2-CE2 3.91Å; F144-F155 HydrophobicContact CD2-CE2 3.91Å; F144-F155 HydrophobicContact CD2-CZ 4.39Å; F144-F155 HydrophobicContact CG-CE2 4.3Å; F144-F155 HydrophobicContact CG-CZ 4.34Å; F144-F155 PolarHBondContact N-O 3.2Å; F144-F155 PolarHBondContact O-N 3.47Å; F144-M157 HydrophobicContact CD2-CG 3.94Å; F144-M157 HydrophobicContact CD2-SD 3.71Å; F144-M157 HydrophobicContact CE2-CB 4.18Å; F144-M157 HydrophobicContact CE2-CG 3.94Å; F144-M157 HydrophobicContact CE2-SD 3.47Å; F144-M157 WeakPolarHBondContact CE2-SD 3.34Å; F144-M157 HydrophobicContact CZ-SD 4.49Å
145	S	95.8	Very high	95	Very high	18 Å²	18	48 Å²	48	13%	0.126	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.7	170.3	-49.7	0	0	0	0	109.2	K125 N126 E152 V153 T154	K125-S145 PolarHBondContact N-O 3.01Å; N126-S145 PolarHBondContact N-O 2.82Å; N126-S145 PolarHBondContact O-N 3.48Å; S145-E152 WeakPolarHBondContact CB-OE1 3.31Å; S145-V153 WeakPolarHBondContact CA-O 3.31Å; S145-T154 WeakPolarHBondContact OG-CG2 3.31Å
146	V	94.6	Very high	95.2	Very high	7 Å²	7	44 Å²	44	4%	0.042	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	155.1	-179.3	-57.1	0	0	0	0	110.4	I121 V148 E152 V153 F155 I178	I121-V146 HydrophobicContact CD1-CG1 4.28Å; I121-V146 HydrophobicContact CG2-CG1 4.43Å; V146-V148 HydrophobicContact CG2-CG2 3.99Å; V146-E152 WeakPolarHBondContact O-CA 3.13Å; V146-V153 HydrophobicContact CG2-CG2 3.52Å; V146-V153 PolarHBondContact N-O 2.83Å; V146-V153 PolarHBondContact O-N 2.81Å; V146-F155 HydrophobicContact CB-CE1 4.46Å; V146-F155 HydrophobicContact CG1-CE1 3.72Å; V146-F155 HydrophobicContact CG1-CZ 4.33Å; V146-F155 HydrophobicContact CG2-CD1 4.27Å; V146-F155 HydrophobicContact CG2-CE1 3.8Å; V146-I178 HydrophobicContact CG2-CD1 3.76Å
147	N	93	Very high	95.3	Very high	110 Å²	110	35.9 Å²	35.9	59%	0.588	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.8	172.7	-169.6	-53.6	0	0	0	109.2	G150 S151	N147-G150 WeakPolarHBondContact OD1-CA 3.43Å; N147-G150 PolarHBondContact OD1-N 3.48Å; N147-S151 CarbonylContact C-O 3.56Å; N147-S151 WeakPolarHBondContact CA-O 3.19Å
148	V	90.5	Very high	95.4	Very high	17 Å²	17	35.3 Å²	35.3	10%	0.103	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.6	173.3	173.9	0	0	0	0	107.7	V146 G150 S151 V153 P175 E177 I178	V146-V148 HydrophobicContact CG2-CG2 3.99Å; V148-G150 PolarHBondContact O-N 2.8Å; V148-G150 VanDerWaalsContact O-N 3.12Å; V148-S151 PolarHBondContact N-O 2.97Å; V148-S151 PolarHBondContact O-N 2.83Å; V148-V153 HydrophobicContact CB-CG1 4.48Å; V148-V153 HydrophobicContact CB-CG2 3.93Å; V148-V153 HydrophobicContact CG2-CG2 3.52Å; V148-P175 HydrophobicContact CG2-CB 4.39Å; V148-E177 HydrophobicContact CG1-CB 3.58Å; V148-E177 HydrophobicContact CG1-CG 3.92Å; V148-I178 HydrophobicContact CG2-CD1 4.45Å; V148-I178 HydrophobicContact CG2-CG1 3.92Å
149	N	90.3	Very high	95.4	Very high	144 Å²	144	35.3 Å²	35.3	77%	0.77	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	37.2	178.3	-59.2	-28.4	0	0	0	114	S151	N149-S151 VanDerWaalsContact C-N 3.31Å; N149-S151 PolarHBondContact O-N 2.84Å
150	G	90.5	Very high	95.4	Very high	62 Å²	62	35.4 Å²	35.4	64%	0.639	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.4	-9	179.8	0	0	0	0	0	114.7	N147 V148	N147-G150 WeakPolarHBondContact OD1-CA 3.43Å; N147-G150 PolarHBondContact OD1-N 3.48Å; V148-G150 PolarHBondContact O-N 2.8Å; V148-G150 VanDerWaalsContact O-N 3.12Å
151	S	92.9	Very high	95.4	Very high	76 Å²	76	35.4 Å²	35.4	53%	0.531	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	140.9	178.7	-59.8	0	0	0	0	111.5	N147 V148 N149	N147-S151 CarbonylContact C-O 3.56Å; N147-S151 WeakPolarHBondContact CA-O 3.19Å; V148-S151 PolarHBondContact N-O 2.97Å; V148-S151 PolarHBondContact O-N 2.83Å; N149-S151 VanDerWaalsContact C-N 3.31Å; N149-S151 PolarHBondContact O-N 2.84Å
152	E	93.9	Very high	95.3	Very high	93 Å²	93	37.2 Å²	37.2	44%	0.435	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	119.8	173	-174.1	166.4	171.8	0	0	109.5	K125 S145 V146	K125-E152 IonicContact NZ-OE2 3.63Å; K125-E152 PolarHBondContact NZ-OE2 2.89Å; S145-E152 WeakPolarHBondContact CB-OE1 3.31Å; V146-E152 WeakPolarHBondContact O-CA 3.13Å
153	V	94.9	Very high	95.2	Very high	44 Å²	44	39.7 Å²	39.7	27%	0.267	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.9	177.7	-62	0	0	0	0	109.5	S145 V146 V148 P175	S145-V153 WeakPolarHBondContact CA-O 3.31Å; V146-V153 HydrophobicContact CG2-CG2 3.52Å; V146-V153 PolarHBondContact N-O 2.83Å; V146-V153 PolarHBondContact O-N 2.81Å; V148-V153 HydrophobicContact CB-CG1 4.48Å; V148-V153 HydrophobicContact CB-CG2 3.93Å; V148-V153 HydrophobicContact CG2-CG2 3.52Å; V153-P175 HydrophobicContact CB-CG 4.22Å; V153-P175 HydrophobicContact CG2-CB 4.36Å; V153-P175 HydrophobicContact CG2-CG 3.54Å
154	T	96.5	Very high	94.9	Very high	92 Å²	92	42 Å²	42	56%	0.564	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.1	-179.9	55.9	0	0	0	0	111.3	F144 S145	F144-T154 VanDerWaalsContact O-CA 3.25Å; F144-T154 WeakPolarHBondContact O-CA 3.35Å; S145-T154 WeakPolarHBondContact OG-CG2 3.31Å
155	F	96.7	Very high	94.8	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	162.4	177.7	66.7	-97.4	0	0	0	111.2	I121 N143 F144 V146 M157 D172 N173 I174 P175 I178 F183	I121-F155 HydrophobicContact CB-CZ 4.06Å; I121-F155 HydrophobicContact CD1-CE1 4.16Å; I121-F155 HydrophobicContact CD1-CZ 3.67Å; I121-F155 HydrophobicContact CG1-CZ 4.42Å; I121-F155 HydrophobicContact CG2-CZ 3.84Å; N143-F155 CarbonylContact C-O 3.48Å; N143-F155 WeakPolarHBondContact CA-O 3.38Å; F144-F155 HydrophobicContact CB-CD2 4.42Å; F144-F155 HydrophobicContact CB-CE1 4.06Å; F144-F155 HydrophobicContact CB-CE2 3.95Å; F144-F155 HydrophobicContact CB-CZ 3.75Å; F144-F155 AromaticContact CD2-CE2 3.91Å; F144-F155 HydrophobicContact CD2-CE2 3.91Å; F144-F155 HydrophobicContact CD2-CZ 4.39Å; F144-F155 HydrophobicContact CG-CE2 4.3Å; F144-F155 HydrophobicContact CG-CZ 4.34Å; F144-F155 PolarHBondContact N-O 3.2Å; F144-F155 PolarHBondContact O-N 3.47Å; V146-F155 HydrophobicContact CB-CE1 4.46Å; V146-F155 HydrophobicContact CG1-CE1 3.72Å; V146-F155 HydrophobicContact CG1-CZ 4.33Å; V146-F155 HydrophobicContact CG2-CD1 4.27Å; V146-F155 HydrophobicContact CG2-CE1 3.8Å; F155-M157 HydrophobicContact CD2-CG 3.99Å; F155-M157 HydrophobicContact CE2-CG 3.77Å; F155-M157 HydrophobicContact CE2-SD 3.79Å; F155-D172 WeakPolarHBondContact CB-O 3.45Å; F155-N173 HydrophobicContact CB-CB 4.43Å; F155-N173 WeakPolarHBondContact CB-O 3.47Å; F155-I174 HydrophobicContact CB-CD1 4.13Å; F155-I174 HydrophobicContact CD2-CD1 3.29Å; F155-I174 HydrophobicContact CE2-CD1 3.83Å; F155-I174 HydrophobicContact CG-CD1 3.9Å; F155-P175 HydrophobicContact CD1-CG 4.35Å; F155-I178 HydrophobicContact CD1-CD1 4.34Å; F155-I178 HydrophobicContact CE1-CD1 3.77Å; F155-I178 HydrophobicContact CZ-CD1 4.42Å; F155-F183 HydrophobicContact CE2-CE1 4.1Å; F155-F183 HydrophobicContact CZ-CE1 4.04Å
156	T	97.1	Very high	94.7	Very high	18 Å²	18	43.5 Å²	43.5	11%	0.11	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.4	-170.4	-53.5	0	0	0	0	111.1	Q141 R142 N143 D172	Q141-T156 HydrophobicContact CG-CG2 3.31Å; R142-T156 CarbonylContact O-C 3.43Å; R142-T156 WeakPolarHBondContact O-CA 3.35Å; N143-T156 WeakPolarHBondContact OD1-CG2 3.02Å; N143-T156 PolarHBondContact OD1-OG1 2.89Å; N143-T156 VanDerWaalsContact OD1-OG1 3.04Å; T156-D172 PolarHBondContact N-O 3.01Å; T156-D172 PolarHBondContact O-N 3.13Å
157	M	97.4	Very high	94.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.4	172.6	-51.3	-179	89.1	0	0	108.9	N119 R142 F144 F155 Y171 F183 I209	N119-M157 WeakPolarHBondContact OD1-CE 3.42Å; R142-M157 PolarHBondContact N-O 2.94Å; R142-M157 PolarHBondContact O-N 2.96Å; F144-M157 HydrophobicContact CD2-CG 3.94Å; F144-M157 HydrophobicContact CD2-SD 3.71Å; F144-M157 HydrophobicContact CE2-CB 4.18Å; F144-M157 HydrophobicContact CE2-CG 3.94Å; F144-M157 HydrophobicContact CE2-SD 3.47Å; F144-M157 WeakPolarHBondContact CE2-SD 3.34Å; F144-M157 HydrophobicContact CZ-SD 4.49Å; F155-M157 HydrophobicContact CD2-CG 3.99Å; F155-M157 HydrophobicContact CE2-CG 3.77Å; F155-M157 HydrophobicContact CE2-SD 3.79Å; M157-Y171 HydrophobicContact CB-CD1 4.49Å; M157-Y171 HydrophobicContact CE-CD1 3.69Å; M157-Y171 HydrophobicContact CE-CE1 3.47Å; M157-Y171 VanDerWaalsContact CE-CE1 3.47Å; M157-Y171 HydrophobicContact CG-CD1 4.26Å; M157-F183 HydrophobicContact CE-CD1 3.95Å; M157-I209 HydrophobicContact CE-CG2 4.4Å
158	T	98.1	Very high	95.1	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.1	-177.1	-60.7	0	0	0	0	110.9	F73 N119 V140 L160 F169 Y170	F73-T158 HydrophobicContact CE1-CG2 4.2Å; F73-T158 HydrophobicContact CE2-CG2 4.44Å; F73-T158 HydrophobicContact CZ-CG2 3.62Å; N119-T158 PolarHBondContact ND2-O 2.87Å; V140-T158 CarbonylContact O-C 3.53Å; V140-T158 WeakPolarHBondContact O-CA 3.49Å; T158-L160 HydrophobicContact CG2-CD2 4.11Å; T158-L160 HydrophobicContact CG2-CG 4.01Å; T158-F169 VanDerWaalsContact O-CA 3.28Å; T158-F169 WeakPolarHBondContact O-CA 3.48Å; T158-Y170 PolarHBondContact N-O 2.76Å; T158-Y170 PolarHBondContact O-N 2.93Å
159	I	98.4	Very high	95.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.5	166.3	-54.5	-179.4	0	0	0	107.6	V106 I117 N119 G139 V140 I167 S168 F169	V106-I159 HydrophobicContact CG2-CD1 3.78Å; I117-I159 HydrophobicContact CG2-CD1 4.04Å; I117-I159 HydrophobicContact CG2-CG2 3.81Å; N119-I159 HydrophobicContact CB-CD1 3.64Å; N119-I159 HydrophobicContact CB-CG1 3.6Å; G139-I159 CarbonylContact C-O 3.59Å; G139-I159 WeakPolarHBondContact CA-O 3.25Å; V140-I159 HydrophobicContact CG1-CB 3.9Å; V140-I159 HydrophobicContact CG1-CD1 3.99Å; V140-I159 HydrophobicContact CG1-CG1 4.11Å; V140-I159 PolarHBondContact N-O 2.77Å; V140-I159 PolarHBondContact O-N 3.45Å; I159-I167 HydrophobicContact CG2-CG2 4.44Å; I159-S168 CarbonylContact C-O 3.6Å; I159-S168 WeakPolarHBondContact CA-O 3.27Å; I159-F169 HydrophobicContact CB-CD1 4.21Å; I159-F169 HydrophobicContact CB-CE1 4.23Å; I159-F169 HydrophobicContact CD1-CE1 4.06Å; I159-F169 HydrophobicContact CG1-CD1 3.76Å; I159-F169 HydrophobicContact CG1-CE1 3.72Å; I159-F169 HydrophobicContact CG2-CD1 4.2Å; I159-F169 HydrophobicContact CG2-CE1 3.86Å
160	L	98.1	Very high	95.9	Very high	2 Å²	2	31 Å²	31	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.2	170.9	-60.9	172.7	0	0	0	110	P67 V68 F73 L137 L138 T158 I167 S168	P67-L160 HydrophobicContact CB-CD1 4.1Å; P67-L160 HydrophobicContact CG-CD1 3.77Å; V68-L160 HydrophobicContact CB-CD1 4.45Å; V68-L160 HydrophobicContact CG2-CD1 3.54Å; V68-L160 HydrophobicContact CG2-CD2 3.99Å; V68-L160 HydrophobicContact CG2-CG 4.43Å; F73-L160 HydrophobicContact CE1-CD2 4.35Å; F73-L160 HydrophobicContact CZ-CD2 3.88Å; L137-L160 HydrophobicContact CD1-CB 4.35Å; L137-L160 HydrophobicContact CD1-CD2 4.48Å; L137-L160 HydrophobicContact CD2-CD2 4.19Å; L137-L160 HydrophobicContact CG-CD2 4.36Å; L138-L160 CarbonylContact O-C 3.53Å; T158-L160 HydrophobicContact CG2-CD2 4.11Å; T158-L160 HydrophobicContact CG2-CG 4.01Å; L160-I167 CarbonylContact O-C 3.47Å; L160-I167 WeakPolarHBondContact O-CA 3.36Å; L160-S168 PolarHBondContact N-O 2.81Å; L160-S168 PolarHBondContact O-N 3.31Å
161	I	97.9	Very high	96.2	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	118.6	178.1	-56.3	175.1	0	0	0	106.6	F87 F89 I99 I117 L138	F87-I161 HydrophobicContact CE2-CG2 4.32Å; F87-I161 HydrophobicContact CZ-CG2 4.35Å; F87-I161 WeakPolarHBondContact CZ-O 3.2Å; F89-I161 HydrophobicContact CD2-CG2 4.28Å; F89-I161 HydrophobicContact CE1-CG2 4.01Å; F89-I161 HydrophobicContact CE2-CG2 3.76Å; F89-I161 HydrophobicContact CZ-CG2 3.61Å; I99-I161 HydrophobicContact CD1-CD1 3.48Å; I99-I161 VanDerWaalsContact CD1-CD1 3.48Å; I117-I161 HydrophobicContact CD1-CD1 3.8Å; I117-I161 HydrophobicContact CD1-CG1 4.28Å; L138-I161 HydrophobicContact CB-CB 4.41Å; L138-I161 PolarHBondContact N-O 2.86Å; L138-I161 VanDerWaalsContact N-O 3.11Å; L138-I161 PolarHBondContact O-N 2.84Å
162	H	96.4	Very high	96.4	Very high	46 Å²	46	26.1 Å²	26.1	21%	0.213	15%	0.151	C	C	.	.			trans	-99.1	157.9	-175.8	-62.5	-93.5	0	0	0	111.5	S164 G165 K166 S168	H162-S164 PolarHBondContact O-N 2.84Å; H162-S164 VanDerWaalsContact O-N 3.12Å; H162-G165 PolarHBondContact O-N 3.02Å; H162-K166 HydrophobicContact CB-CB 4.17Å; H162-K166 PolarHBondContact CD2-O 3.36Å; H162-K166 PolarHBondContact N-O 2.87Å; H162-S168 PolarHBondContact CD2-OG 2.8Å; H162-S168 PolarHBondContact NE2-OG 3.45Å
163	P	93.9	Very high	96.5	Very high	53 Å²	53	26.3 Å²	26.3	34%	0.344	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.2	176	-28.3	36.2	0	0	0	115	F87 K136 G165	F87-P163 HydrophobicContact CB-CB 4.12Å; F87-P163 HydrophobicContact CB-CG 4.26Å; F87-P163 HydrophobicContact CD1-CG 4.13Å; F87-P163 VanDerWaalsContact CD2-CA 3.47Å; F87-P163 HydrophobicContact CD2-CB 4.08Å; F87-P163 HydrophobicContact CD2-CG 4.23Å; F87-P163 HydrophobicContact CG-CB 4.07Å; F87-P163 HydrophobicContact CG-CG 3.95Å; K136-P163 HydrophobicContact CB-CG 4.32Å; K136-P163 WeakPolarHBondContact O-CD 3.27Å; K136-P163 WeakPolarHBondContact O-CG 3.25Å; P163-G165 PolarHBondContact O-N 2.8Å
164	S	90.8	Very high	96.6	Very high	96 Å²	96	24.7 Å²	24.7	67%	0.671	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.8	174.9	59	0	0	0	0	114.1	H162 K166	H162-S164 PolarHBondContact O-N 2.84Å; H162-S164 VanDerWaalsContact O-N 3.12Å; S164-K166 VanDerWaalsContact C-N 3.27Å; S164-K166 WeakPolarHBondContact OG-CB 3.36Å; S164-K166 PolarHBondContact OG-N 2.89Å
165	G	92.3	Very high	96.5	Very high	10 Å²	10	21.3 Å²	21.3	10%	0.103	12%	0.124	C	C	.	.	S	Bend	trans	83.6	-0.4	-168.3	0	0	0	0	0	113.9	H162 P163 I167	H162-G165 PolarHBondContact O-N 3.02Å; P163-G165 PolarHBondContact O-N 2.8Å; G165-I167 PolarHBondContact O-N 3.33Å
166	K	95.1	Very high	96.3	Very high	39 Å²	39	27.3 Å²	27.3	17%	0.17	16%	0.162	C	C	.	.			trans	-62.9	133.5	173.2	-177.6	172	75.8	171.2	0	110.7	H162 S164 E216 F217 E218	H162-K166 HydrophobicContact CB-CB 4.17Å; H162-K166 PolarHBondContact CD2-O 3.36Å; H162-K166 PolarHBondContact N-O 2.87Å; S164-K166 VanDerWaalsContact C-N 3.27Å; S164-K166 WeakPolarHBondContact OG-CB 3.36Å; S164-K166 PolarHBondContact OG-N 2.89Å; K166-E216 HydrophobicContact CD-CB 4.27Å; K166-E216 HydrophobicContact CD-CG 4.29Å; K166-E216 WeakPolarHBondContact CE-OE1 3.49Å; K166-E216 IonicContact NZ-OE1 3.68Å; K166-E216 PolarHBondContact NZ-OE1 3.37Å; K166-F217 VanDerWaalsContact CA-O 3.31Å; K166-F217 WeakPolarHBondContact CA-O 3.35Å; K166-E218 HydrophobicContact CB-CG 4.12Å; K166-E218 HydrophobicContact CD-CG 3.88Å; K166-E218 VanDerWaalsContact CD-OE1 3.23Å; K166-E218 WeakPolarHBondContact CD-OE1 3.43Å; K166-E218 HydrophobicContact CG-CG 3.81Å
167	I	97.6	Very high	96.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.7	174	-62.2	163.4	0	0	0	108.5	F91 I117 I159 L160 G165 F169 I187 E216 F217	F91-I167 HydrophobicContact CD2-CD1 3.64Å; F91-I167 HydrophobicContact CE2-CD1 3.46Å; F91-I167 VanDerWaalsContact CE2-CD1 3.46Å; I117-I167 HydrophobicContact CD1-CD1 3.61Å; I117-I167 HydrophobicContact CD1-CG1 4.15Å; I117-I167 HydrophobicContact CD1-CG2 4.41Å; I117-I167 HydrophobicContact CG1-CD1 4.12Å; I117-I167 HydrophobicContact CG2-CG2 3.9Å; I159-I167 HydrophobicContact CG2-CG2 4.44Å; L160-I167 CarbonylContact O-C 3.47Å; L160-I167 WeakPolarHBondContact O-CA 3.36Å; G165-I167 PolarHBondContact O-N 3.33Å; I167-F169 HydrophobicContact CG2-CE1 3.99Å; I167-F169 HydrophobicContact CG2-CZ 4.12Å; I167-I187 HydrophobicContact CD1-CG2 4.33Å; I167-I187 HydrophobicContact CG2-CG2 4.46Å; I167-E216 CarbonylContact O-C 3.54Å; I167-E216 WeakPolarHBondContact O-CA 3.4Å; I167-F217 HydrophobicContact CB-CB 4.37Å; I167-F217 PolarHBondContact N-O 3.23Å; I167-F217 PolarHBondContact O-N 3.12Å
168	S	98.2	Very high	95.8	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.7	-178.4	-43.1	0	0	0	0	110.8	I159 L160 H162 V215	I159-S168 CarbonylContact C-O 3.6Å; I159-S168 WeakPolarHBondContact CA-O 3.27Å; L160-S168 PolarHBondContact N-O 2.81Å; L160-S168 PolarHBondContact O-N 3.31Å; H162-S168 PolarHBondContact CD2-OG 2.8Å; H162-S168 PolarHBondContact NE2-OG 3.45Å; S168-V215 CarbonylContact C-O 3.55Å; S168-V215 VanDerWaalsContact CA-O 3.22Å; S168-V215 WeakPolarHBondContact CA-O 3.45Å
169	F	98.5	Very high	95.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.2	167.6	-54.8	-47.5	0	0	0	110.1	I117 N119 T158 I159 I167 Y171 T185 I187 V204 L214 V215 F217	I117-F169 HydrophobicContact CG2-CE1 3.44Å; I117-F169 VanDerWaalsContact CG2-CE1 3.44Å; I117-F169 HydrophobicContact CG2-CZ 3.53Å; N119-F169 HydrophobicContact CB-CD1 4.21Å; N119-F169 HydrophobicContact CB-CE1 4.25Å; T158-F169 VanDerWaalsContact O-CA 3.28Å; T158-F169 WeakPolarHBondContact O-CA 3.48Å; I159-F169 HydrophobicContact CB-CD1 4.21Å; I159-F169 HydrophobicContact CB-CE1 4.23Å; I159-F169 HydrophobicContact CD1-CE1 4.06Å; I159-F169 HydrophobicContact CG1-CD1 3.76Å; I159-F169 HydrophobicContact CG1-CE1 3.72Å; I159-F169 HydrophobicContact CG2-CD1 4.2Å; I159-F169 HydrophobicContact CG2-CE1 3.86Å; I167-F169 HydrophobicContact CG2-CE1 3.99Å; I167-F169 HydrophobicContact CG2-CZ 4.12Å; F169-Y171 HydrophobicContact CB-CE2 4.35Å; F169-T185 HydrophobicContact CB-CG2 4.47Å; F169-T185 HydrophobicContact CD1-CG2 4.4Å; F169-T185 HydrophobicContact CD2-CG2 3.2Å; F169-T185 HydrophobicContact CE1-CG2 4.47Å; F169-T185 HydrophobicContact CE2-CG2 3.28Å; F169-T185 HydrophobicContact CG-CG2 3.79Å; F169-T185 HydrophobicContact CZ-CG2 3.95Å; F169-I187 HydrophobicContact CE2-CG2 4.24Å; F169-I187 HydrophobicContact CZ-CG2 3.88Å; F169-V204 HydrophobicContact CD2-CG2 4.06Å; F169-V204 HydrophobicContact CE2-CG2 4.31Å; F169-L214 CarbonylContact O-C 3.53Å; F169-L214 WeakPolarHBondContact O-CA 3.33Å; F169-V215 HydrophobicContact CB-CB 4.21Å; F169-V215 HydrophobicContact CD2-CB 4.36Å; F169-V215 HydrophobicContact CD2-CG1 4.4Å; F169-V215 PolarHBondContact N-O 3.14Å; F169-V215 PolarHBondContact O-N 3.01Å; F169-F217 HydrophobicContact CD2-CD2 4.31Å; F169-F217 AromaticContact CD2-CE2 3.63Å; F169-F217 HydrophobicContact CD2-CE2 3.63Å; F169-F217 AromaticContact CE2-CD2 3.98Å; F169-F217 HydrophobicContact CE2-CD2 3.98Å; F169-F217 AromaticContact CE2-CE2 3.35Å; F169-F217 HydrophobicContact CE2-CE2 3.35Å; F169-F217 HydrophobicContact CE2-CZ 4.27Å; F169-F217 HydrophobicContact CZ-CE2 4.39Å
170	Y	98.5	Very high	95.3	Very high	11 Å²	11	42.6 Å²	42.6	4%	0.043	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	143.9	174.4	-179.4	-101.8	0	0	0	110	Q64 Q66 P67 T158 D172 T213 L214	Q64-Y170 HydrophobicContact CB-CE2 4.37Å; Q64-Y170 WeakPolarHBondContact O-CE2 3.45Å; Q64-Y170 PolarHBondContact O-OH 3.45Å; Q66-Y170 VanDerWaalsContact CA-CZ 3.45Å; Q66-Y170 HydrophobicContact CB-CD1 4.38Å; Q66-Y170 HydrophobicContact CB-CE1 3.66Å; Q66-Y170 HydrophobicContact CG-CD1 4.04Å; Q66-Y170 HydrophobicContact CG-CE1 3.74Å; Q66-Y170 PolarHBondContact N-OH 3.36Å; P67-Y170 VanDerWaalsContact CD-CG 3.44Å; P67-Y170 HydrophobicContact CG-CD2 4.47Å; P67-Y170 HydrophobicContact CG-CG 4.15Å; T158-Y170 PolarHBondContact N-O 2.76Å; T158-Y170 PolarHBondContact O-N 2.93Å; Y170-D172 HydrophobicContact CD1-CB 4.45Å; Y170-D172 HydrophobicContact CE1-CB 3.79Å; Y170-T213 WeakPolarHBondContact CA-O 3.37Å; Y170-T213 WeakPolarHBondContact CD2-O 3.36Å; Y170-L214 HydrophobicContact CD2-CB 4.46Å; Y170-L214 HydrophobicContact CD2-CD1 4.44Å
171	Y	98.1	Very high	95	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.5	-177.2	-49.9	-82.7	0	0	0	110.2	N119 M157 F169 T185 I209 K210 G212 T213 V215	N119-Y171 WeakPolarHBondContact OD1-CE1 3.16Å; M157-Y171 HydrophobicContact CB-CD1 4.49Å; M157-Y171 HydrophobicContact CE-CD1 3.69Å; M157-Y171 HydrophobicContact CE-CE1 3.47Å; M157-Y171 VanDerWaalsContact CE-CE1 3.47Å; M157-Y171 HydrophobicContact CG-CD1 4.26Å; F169-Y171 HydrophobicContact CB-CE2 4.35Å; Y171-T185 VanDerWaalsContact OH-CB 3.23Å; Y171-T185 WeakPolarHBondContact OH-CB 3.24Å; Y171-T185 WeakPolarHBondContact OH-CG2 3.44Å; Y171-T185 PolarHBondContact OH-OG1 2.77Å; Y171-I209 HydrophobicContact CD1-CG2 3.67Å; Y171-I209 HydrophobicContact CD2-CG2 4.45Å; Y171-I209 HydrophobicContact CE1-CB 4.47Å; Y171-I209 HydrophobicContact CE1-CG1 4.32Å; Y171-I209 HydrophobicContact CE1-CG2 3.58Å; Y171-I209 HydrophobicContact CE2-CG1 4.25Å; Y171-I209 HydrophobicContact CE2-CG2 4.36Å; Y171-I209 HydrophobicContact CG-CG2 4.09Å; Y171-K210 WeakPolarHBondContact CB-O 3.41Å; Y171-G212 PolarHBondContact O-N 3.43Å; Y171-T213 HydrophobicContact CD2-CG2 4.31Å; Y171-T213 WeakPolarHBondContact CD2-O 3.03Å; Y171-T213 HydrophobicContact CE2-CG2 4.44Å; Y171-T213 PolarHBondContact N-O 3.26Å; Y171-V215 HydrophobicContact CE2-CG2 3.95Å
172	D	97.1	Very high	94.8	Very high	37 Å²	37	47.5 Å²	47.5	20%	0.198	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.7	-176.1	-165.3	26.6	0	0	0	110.7	F155 T156 Y170 I174	F155-D172 WeakPolarHBondContact CB-O 3.45Å; T156-D172 PolarHBondContact N-O 3.01Å; T156-D172 PolarHBondContact O-N 3.13Å; Y170-D172 HydrophobicContact CD1-CB 4.45Å; Y170-D172 HydrophobicContact CE1-CB 3.79Å; D172-I174 PolarHBondContact O-N 2.62Å
173	N	95.9	Very high	94.7	Very high	96 Å²	96	45.8 Å²	45.8	51%	0.513	25%	0.253	S	S	.	.	S	Bend	trans	53.8	30.3	-179.3	-55.7	-54.1	0	0	0	115.3	F155 P175 S211	F155-N173 HydrophobicContact CB-CB 4.43Å; F155-N173 WeakPolarHBondContact CB-O 3.47Å; N173-P175 VanDerWaalsContact O-CD 3.24Å; N173-P175 WeakPolarHBondContact O-CD 3.31Å; N173-S211 WeakPolarHBondContact CA-OG 3.18Å; N173-S211 PolarHBondContact N-OG 3.19Å
174	I	95.9	Very high	94.8	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.056	25%	0.247	C	C	.	.			trans	-62.9	118.2	174	-52.8	-58.2	0	0	0	110.3	F155 D172 F183 S211	F155-I174 HydrophobicContact CB-CD1 4.13Å; F155-I174 HydrophobicContact CD2-CD1 3.29Å; F155-I174 HydrophobicContact CE2-CD1 3.83Å; F155-I174 HydrophobicContact CG-CD1 3.9Å; D172-I174 PolarHBondContact O-N 2.62Å; I174-F183 HydrophobicContact CD1-CE1 4.46Å; I174-F183 HydrophobicContact CG2-CE1 4.16Å; I174-F183 HydrophobicContact CG2-CE2 4.27Å; I174-F183 HydrophobicContact CG2-CZ 3.55Å; I174-S211 PolarHBondContact N-OG 3.31Å; I174-S211 PolarHBondContact O-OG 3.02Å
175	P	94	Very high	95.1	Very high	20 Å²	20	41.3 Å²	41.3	13%	0.13	22%	0.217	C	C	.	.			trans	-66.7	139.9	176	-17	29.8	0	0	0	111.9	V148 V153 F155 N173 E177 I178	V148-P175 HydrophobicContact CG2-CB 4.39Å; V153-P175 HydrophobicContact CB-CG 4.22Å; V153-P175 HydrophobicContact CG2-CB 4.36Å; V153-P175 HydrophobicContact CG2-CG 3.54Å; F155-P175 HydrophobicContact CD1-CG 4.35Å; N173-P175 VanDerWaalsContact O-CD 3.24Å; N173-P175 WeakPolarHBondContact O-CD 3.31Å; P175-E177 VanDerWaalsContact C-N 3.29Å; P175-E177 WeakPolarHBondContact CB-OE2 3.49Å; P175-E177 PolarHBondContact O-N 3.39Å; P175-I178 HydrophobicContact CB-CD1 4.13Å; P175-I178 HydrophobicContact CB-CG1 4.16Å; P175-I178 HydrophobicContact CG-CD1 3.82Å; P175-I178 HydrophobicContact CG-CG1 4.37Å
176	T	92.9	Very high	95.3	Very high	128 Å²	128	43.9 Å²	43.9	79%	0.785	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.8	-177.2	43.9	0	0	0	0	113.9	I178	T176-I178 VanDerWaalsContact C-N 3.35Å
177	E	92.8	Very high	95.3	Very high	111 Å²	111	42 Å²	42	52%	0.519	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.9	-177	-57.1	78.6	-174.3	0	0	113.1	V148 P175 E179	V148-E177 HydrophobicContact CG1-CB 3.58Å; V148-E177 HydrophobicContact CG1-CG 3.92Å; P175-E177 VanDerWaalsContact C-N 3.29Å; P175-E177 WeakPolarHBondContact CB-OE2 3.49Å; P175-E177 PolarHBondContact O-N 3.39Å; E177-E179 PolarHBondContact O-N 3.21Å
178	I	91.8	Very high	95.2	Very high	19 Å²	19	43.2 Å²	43.2	10%	0.097	22%	0.222	C	C	.	.	S	Bend	trans	-73.6	128.8	179.3	-62.6	176.9	0	0	0	109.3	I121 V146 V148 F155 P175 T176 E180 Q182 F183	I121-I178 HydrophobicContact CD1-CD1 4.02Å; I121-I178 HydrophobicContact CD1-CG2 3.72Å; V146-I178 HydrophobicContact CG2-CD1 3.76Å; V148-I178 HydrophobicContact CG2-CD1 4.45Å; V148-I178 HydrophobicContact CG2-CG1 3.92Å; F155-I178 HydrophobicContact CD1-CD1 4.34Å; F155-I178 HydrophobicContact CE1-CD1 3.77Å; F155-I178 HydrophobicContact CZ-CD1 4.42Å; P175-I178 HydrophobicContact CB-CD1 4.13Å; P175-I178 HydrophobicContact CB-CG1 4.16Å; P175-I178 HydrophobicContact CG-CD1 3.82Å; P175-I178 HydrophobicContact CG-CG1 4.37Å; T176-I178 VanDerWaalsContact C-N 3.35Å; I178-E180 PolarHBondContact O-N 3.25Å; I178-Q182 HydrophobicContact CG2-CB 4.3Å; I178-F183 HydrophobicContact CB-CE2 4.16Å; I178-F183 HydrophobicContact CB-CZ 4.08Å; I178-F183 HydrophobicContact CD1-CZ 4.16Å; I178-F183 HydrophobicContact CG2-CE2 3.63Å; I178-F183 HydrophobicContact CG2-CZ 3.65Å
179	E	92.8	Very high	95	Very high	122 Å²	122	43.1 Å²	43.1	57%	0.57	22%	0.222	S	C	*	.			trans	-60	123.6	174.2	-171.2	-165.6	158.5	0	0	110.8	E177 S181 Q182	E177-E179 PolarHBondContact O-N 3.21Å; E179-S181 PolarHBondContact O-N 3.03Å; E179-S181 VanDerWaalsContact OE1-CB 3.3Å; E179-S181 WeakPolarHBondContact OE1-CB 3.3Å; E179-S181 PolarHBondContact OE1-OG 3.44Å; E179-Q182 HydrophobicContact CB-CG 4.29Å; E179-Q182 WeakPolarHBondContact O-CB 3.47Å; E179-Q182 WeakPolarHBondContact O-CG 3.1Å; E179-Q182 PolarHBondContact O-N 3.44Å
180	E	92.7	Very high	94.6	Very high	90 Å²	90	44.3 Å²	44.3	42%	0.421	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-50.7	-34.2	-178	-64.3	-173.6	178.1	0	0	112.8	I178 Q182 F183 A206 K207	I178-E180 PolarHBondContact O-N 3.25Å; E180-Q182 PolarHBondContact O-N 3.26Å; E180-Q182 VanDerWaalsContact O-N 3.1Å; E180-F183 PolarHBondContact O-N 2.01Å; E180-A206 HydrophobicContact CB-CB 3.72Å; E180-A206 VanDerWaalsContact O-CB 3.22Å; E180-A206 WeakPolarHBondContact O-CB 3.06Å; E180-K207 VanDerWaalsContact CD-CA 3.45Å; E180-K207 WeakPolarHBondContact OE1-CA 2.91Å; E180-K207 WeakPolarHBondContact OE2-CA 3.28Å; E180-K207 WeakPolarHBondContact OE2-CB 3.43Å; E180-K207 PolarHBondContact OE2-N 2.8Å
181	S	91.8	Very high	93.9	Very high	59 Å²	59	44.5 Å²	44.5	41%	0.413	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-63	-17.6	-178.9	86.4	0	0	0	0	113.9	E179 K184	E179-S181 PolarHBondContact O-N 3.03Å; E179-S181 VanDerWaalsContact OE1-CB 3.3Å; E179-S181 WeakPolarHBondContact OE1-CB 3.3Å; E179-S181 PolarHBondContact OE1-OG 3.44Å; S181-K184 PolarHBondContact O-NZ 2.84Å
182	Q	93.9	Very high	93.2	Very high	46 Å²	46	49.1 Å²	49.1	22%	0.215	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-74.8	-28.1	178.4	-62.3	-168.5	33.4	0	0	112.6	I121 R122 I178 E179 E180	I121-Q182 HydrophobicContact CD1-CB 4.23Å; I121-Q182 HydrophobicContact CG1-CB 3.86Å; R122-Q182 PolarHBondContact N-O 3.06Å; I178-Q182 HydrophobicContact CG2-CB 4.3Å; E179-Q182 HydrophobicContact CB-CG 4.29Å; E179-Q182 WeakPolarHBondContact O-CB 3.47Å; E179-Q182 WeakPolarHBondContact O-CG 3.1Å; E179-Q182 PolarHBondContact O-N 3.44Å; E180-Q182 PolarHBondContact O-N 3.26Å; E180-Q182 VanDerWaalsContact O-N 3.1Å
183	F	95.2	Very high	92.4	Very high	10 Å²	10	48.2 Å²	48.2	4%	0.044	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	140.5	178.8	-60.5	-74.6	0	0	0	111.4	I121 F155 M157 I174 I178 E180 I209	I121-F183 HydrophobicContact CB-CD1 4.18Å; I121-F183 HydrophobicContact CB-CE1 4.38Å; I121-F183 HydrophobicContact CD1-CD1 4.15Å; I121-F183 HydrophobicContact CD1-CE1 3.72Å; I121-F183 HydrophobicContact CD1-CZ 4.08Å; I121-F183 HydrophobicContact CG1-CD1 3.92Å; I121-F183 HydrophobicContact CG1-CE1 4.01Å; F155-F183 HydrophobicContact CE2-CE1 4.1Å; F155-F183 HydrophobicContact CZ-CE1 4.04Å; M157-F183 HydrophobicContact CE-CD1 3.95Å; I174-F183 HydrophobicContact CD1-CE1 4.46Å; I174-F183 HydrophobicContact CG2-CE1 4.16Å; I174-F183 HydrophobicContact CG2-CE2 4.27Å; I174-F183 HydrophobicContact CG2-CZ 3.55Å; I178-F183 HydrophobicContact CB-CE2 4.16Å; I178-F183 HydrophobicContact CB-CZ 4.08Å; I178-F183 HydrophobicContact CD1-CZ 4.16Å; I178-F183 HydrophobicContact CG2-CE2 3.63Å; I178-F183 HydrophobicContact CG2-CZ 3.65Å; E180-F183 PolarHBondContact O-N 2.01Å; F183-I209 HydrophobicContact CB-CD1 3.56Å; F183-I209 HydrophobicContact CB-CG2 4.21Å; F183-I209 HydrophobicContact CD1-CG2 3.79Å; F183-I209 HydrophobicContact CD2-CB 4.42Å; F183-I209 HydrophobicContact CD2-CG2 4.16Å; F183-I209 HydrophobicContact CE1-CG2 4.17Å; F183-I209 HydrophobicContact CG-CB 4.33Å; F183-I209 HydrophobicContact CG-CD1 4.28Å; F183-I209 HydrophobicContact CG-CG2 3.78Å
184	K	94.9	Very high	91.2	Very high	49 Å²	49	47 Å²	47	21%	0.213	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	80.2	-179.7	-63.2	-69.4	158.2	-107.1	0	109.1	Y120 R122 S181	Y120-K184 HydrophobicContact CD1-CB 3.91Å; Y120-K184 HydrophobicContact CD2-CB 4.31Å; Y120-K184 HydrophobicContact CE1-CB 3.46Å; Y120-K184 VanDerWaalsContact CE1-CB 3.46Å; Y120-K184 HydrophobicContact CE1-CG 4.31Å; Y120-K184 HydrophobicContact CE2-CB 3.91Å; Y120-K184 HydrophobicContact CE2-CG 4.01Å; Y120-K184 HydrophobicContact CG-CB 4.3Å; Y120-K184 VanDerWaalsContact CZ-CB 3.46Å; Y120-K184 PolarHBondContact N-O 2.99Å; Y120-K184 PolarHBondContact O-N 3.06Å; R122-K184 HydrophobicContact CG-CG 4.26Å; R122-K184 VanDerWaalsContact NE-CE 3.25Å; S181-K184 PolarHBondContact O-NZ 2.84Å
185	T	96.8	Very high	90.2	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.2	172.1	-48.8	0	0	0	0	111.5	N118 N119 F169 Y171 V204 I209	N118-T185 CarbonylContact O-C 3.46Å; N118-T185 VanDerWaalsContact O-CA 3.29Å; N118-T185 WeakPolarHBondContact O-CA 3.4Å; N119-T185 HydrophobicContact CB-CG2 4.28Å; N119-T185 PolarHBondContact OD1-OG1 3.36Å; F169-T185 HydrophobicContact CB-CG2 4.47Å; F169-T185 HydrophobicContact CD1-CG2 4.4Å; F169-T185 HydrophobicContact CD2-CG2 3.2Å; F169-T185 HydrophobicContact CE1-CG2 4.47Å; F169-T185 HydrophobicContact CE2-CG2 3.28Å; F169-T185 HydrophobicContact CG-CG2 3.79Å; F169-T185 HydrophobicContact CZ-CG2 3.95Å; Y171-T185 VanDerWaalsContact OH-CB 3.23Å; Y171-T185 WeakPolarHBondContact OH-CB 3.24Å; Y171-T185 WeakPolarHBondContact OH-CG2 3.44Å; Y171-T185 PolarHBondContact OH-OG1 2.77Å; T185-V204 HydrophobicContact CG2-CB 4.23Å; T185-V204 HydrophobicContact CG2-CG2 3.58Å; T185-V204 PolarHBondContact O-N 2.93Å; T185-I209 WeakPolarHBondContact OG1-CD1 3.32Å
186	R	96.1	Very high	89.5	Confident	65 Å²	65	53.9 Å²	53.9	25%	0.245	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	153	-177.8	56.2	-179.7	177.3	176.5	3.9	112.8	N118 V188 E201 I202 R203	N118-R186 HydrophobicContact CB-CG 3.8Å; N118-R186 PolarHBondContact N-O 3.37Å; N118-R186 PolarHBondContact ND2-NE 3.4Å; N118-R186 PolarHBondContact O-N 2.01Å; R186-V188 HydrophobicContact CG-CG2 4.31Å; R186-E201 HydrophobicContact CB-CG 4.3Å; R186-E201 WeakPolarHBondContact CD-OE1 3.49Å; R186-E201 IonicContact CZ-OE1 3.23Å; R186-E201 IonicContact NE-OE1 2.65Å; R186-E201 VanDerWaalsContact NH1-CD 3.3Å; R186-E201 IonicContact NH1-OE1 3.16Å; R186-E201 PolarHBondContact NH1-OE1 3.48Å; R186-E201 IonicContact NH1-OE2 2.93Å; R186-E201 PolarHBondContact NH1-OE2 2.88Å; R186-I202 CarbonylContact C-O 3.5Å; R186-I202 WeakPolarHBondContact CA-O 3.2Å; R186-I202 VanDerWaalsContact CB-O 3.27Å; R186-I202 WeakPolarHBondContact CB-O 3.47Å; R186-R203 HydrophobicContact CB-CG 4.23Å
187	I	96.3	Very high	89	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.4	160.9	60.7	171	0	0	0	109.6	F91 Y92 I117 I167 F169 E201 I202 F217	F91-I187 HydrophobicContact CE2-CB 4.5Å; Y92-I187 HydrophobicContact CE2-CD1 4.29Å; I117-I187 HydrophobicContact CG1-CG2 4.45Å; I117-I187 HydrophobicContact CG2-CG2 4.12Å; I167-I187 HydrophobicContact CD1-CG2 4.33Å; I167-I187 HydrophobicContact CG2-CG2 4.46Å; F169-I187 HydrophobicContact CE2-CG2 4.24Å; F169-I187 HydrophobicContact CZ-CG2 3.88Å; I187-E201 WeakPolarHBondContact O-CA 3Å; I187-I202 HydrophobicContact CD1-CD1 3.96Å; I187-I202 HydrophobicContact CG1-CB 3.9Å; I187-I202 HydrophobicContact CG1-CD1 4.17Å; I187-I202 HydrophobicContact CG1-CG1 4.37Å; I187-I202 PolarHBondContact N-O 2.96Å; I187-I202 PolarHBondContact O-N 2.89Å; I187-F217 HydrophobicContact CD1-CB 3.94Å; I187-F217 HydrophobicContact CD1-CD1 3.54Å; I187-F217 HydrophobicContact CD1-CD2 4.39Å; I187-F217 HydrophobicContact CD1-CE1 4.14Å; I187-F217 HydrophobicContact CD1-CG 3.68Å; I187-F217 HydrophobicContact CG1-CD1 4.09Å; I187-F217 HydrophobicContact CG1-CE1 4.19Å; I187-F217 HydrophobicContact CG1-CG 4.37Å; I187-F217 HydrophobicContact CG2-CD2 4.32Å
188	V	95.1	Very high	88.5	Confident	26 Å²	26	53.3 Å²	53.3	16%	0.158	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.7	178.2	-174.8	0	0	0	0	107.6	F91 G115 N116 R186 H200 E201	F91-V188 WeakPolarHBondContact CE1-O 3.35Å; F91-V188 WeakPolarHBondContact CZ-O 2.93Å; G115-V188 CarbonylContact C-O 3.6Å; G115-V188 WeakPolarHBondContact CA-O 3.45Å; N116-V188 HydrophobicContact CB-CB 4.34Å; N116-V188 PolarHBondContact N-O 3.17Å; N116-V188 PolarHBondContact O-N 2.91Å; R186-V188 HydrophobicContact CG-CG2 4.31Å; V188-H200 CarbonylContact C-O 3.57Å; V188-H200 VanDerWaalsContact CA-O 3.27Å; V188-H200 WeakPolarHBondContact CA-O 3.31Å; V188-E201 HydrophobicContact CG2-CB 4.13Å; V188-E201 HydrophobicContact CG2-CG 3.9Å
189	G	93.4	Very high	88.3	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	161	176.3	0	0	0	0	0	112	H200	G189-H200 PolarHBondContact N-O 3.15Å; G189-H200 PolarHBondContact O-N 2.86Å
190	T	90.1	Very high	88.1	Confident	25 Å²	25	48.7 Å²	48.7	15%	0.153	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	139	176.8	-54.5	0	0	0	0	109.9	Y94 I114 R197 E198	Y94-T190 WeakPolarHBondContact CE2-O 2.94Å; I114-T190 PolarHBondContact O-N 3.23Å; I114-T190 PolarHBondContact O-OG1 2.75Å; T190-R197 HydrophobicContact CG2-CB 3.51Å; T190-R197 HydrophobicContact CG2-CG 3.64Å; T190-E198 CarbonylContact C-O 3.55Å
191	I	85.2	Confident	88.1	Confident	14 Å²	14	45.6 Å²	45.6	7%	0.072	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.6	170.8	-60	156.4	0	0	0	108.4	F54 Y92 R197 E198 H200	F54-I191 HydrophobicContact CD1-CD1 3.6Å; F54-I191 HydrophobicContact CE1-CD1 3.43Å; F54-I191 VanDerWaalsContact CE1-CD1 3.43Å; F54-I191 HydrophobicContact CE1-CG1 4.13Å; F54-I191 HydrophobicContact CE1-CG2 4.2Å; Y92-I191 HydrophobicContact CD1-CG1 4.22Å; I191-R197 WeakPolarHBondContact O-CA 3.36Å; I191-E198 PolarHBondContact N-O 3.11Å; I191-E198 PolarHBondContact O-N 3.36Å; I191-H200 HydrophobicContact CD1-CB 3.27Å; I191-H200 HydrophobicContact CG1-CB 4.09Å
192	N	82.1	Confident	88.2	Confident	98 Å²	98	42.9 Å²	42.9	52%	0.524	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.9	174.7	-165.3	0.8	0	0	0	111.2	G195	N192-G195 PolarHBondContact OD1-N 2.86Å
193	C	81.2	Confident	88.3	Confident	17 Å²	17	47.1 Å²	47.1	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	70.2	-179.9	-76.2	0	0	0	0	110.9	C30 G195 N196 E198	C30-C193 WeakPolarHBondContact CA-SG 3.44Å; C30-C193 HydrophobicContact CB-CB 3.56Å; C30-C193 WeakPolarHBondContact CB-SG 3.45Å; C30-C193 WeakPolarHBondContact SG-CA 3.28Å; C30-C193 WeakPolarHBondContact SG-CB 3.46Å; C30-C193 CovalentContact SG-SG 2.04Å; C30-C193 PolarHBondContact SG-SG 3.09Å; C193-G195 PolarHBondContact O-N 3Å; C193-G195 VanDerWaalsContact O-N 3.1Å; C193-N196 WeakPolarHBondContact CA-O 3.22Å; C193-N196 PolarHBondContact N-O 2.94Å; C193-N196 PolarHBondContact O-N 3.11Å; C193-E198 HydrophobicContact CB-CG 4.39Å
194	G	70.6	Confident	88.3	Confident	71 Å²	71	47.1 Å²	47.1	73%	0.732	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	24.7	171.9	0	0	0	0	0	115.2
195	G	74.8	Confident	88.3	Confident	65 Å²	65	46.4 Å²	46.4	67%	0.67	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.2	-22.5	-177	0	0	0	0	0	113.8	N192 C193	N192-G195 PolarHBondContact OD1-N 2.86Å; C193-G195 PolarHBondContact O-N 3Å; C193-G195 VanDerWaalsContact O-N 3.1Å
196	N	79.5	Confident	88.2	Confident	111 Å²	111	47.5 Å²	47.5	59%	0.594	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	147.4	172.4	-66.9	-27	0	0	0	110.7	C193	C193-N196 WeakPolarHBondContact CA-O 3.22Å; C193-N196 PolarHBondContact N-O 2.94Å; C193-N196 PolarHBondContact O-N 3.11Å
197	R	81	Confident	88.1	Confident	179 Å²	179	48.5 Å²	48.5	68%	0.675	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.3	172.3	-78.1	177.9	179.6	145.9	1.3	108.3	T190 I191	T190-R197 HydrophobicContact CG2-CB 3.51Å; T190-R197 HydrophobicContact CG2-CG 3.64Å; I191-R197 WeakPolarHBondContact O-CA 3.36Å
198	E	84.1	Confident	88.1	Confident	47 Å²	47	48.9 Å²	48.9	22%	0.22	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139	177.7	-71.9	-73.9	-175.6	0	0	109.6	R33 L36 T190 I191 C193	R33-E198 IonicContact CZ-OE1 3.01Å; R33-E198 IonicContact NE-OE1 2.74Å; R33-E198 IonicContact NH2-OE1 3.13Å; R33-E198 PolarHBondContact NH2-OE1 2.72Å; L36-E198 HydrophobicContact CD2-CB 4.22Å; T190-E198 CarbonylContact C-O 3.55Å; I191-E198 PolarHBondContact N-O 3.11Å; I191-E198 PolarHBondContact O-N 3.36Å; C193-E198 HydrophobicContact CB-CG 4.39Å
199	G	86.9	Confident	88.2	Confident	44 Å²	44	47.9 Å²	47.9	45%	0.454	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.8	-179.3	0	0	0	0	0	111.3	L36	L36-G199 WeakPolarHBondContact CD2-O 3.26Å
200	H	89.1	Confident	88.3	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.4	174	175.3	-87.6	0	0	0	110.7	L36 F54 Y92 V188 G189 I191 I202	L36-H200 HydrophobicContact CD2-CB 4.12Å; L36-H200 PolarHBondContact O-CD2 2.92Å; L36-H200 PolarHBondContact O-NE2 3.15Å; F54-H200 WeakPolarHBondContact CB-NE2 3.47Å; Y92-H200 HydrophobicContact CE1-CB 3.89Å; Y92-H200 AromaticContact CE1-CG 3.93Å; Y92-H200 AromaticContact CE1-ND1 3.36Å; Y92-H200 WeakPolarHBondContact CE1-ND1 3.28Å; Y92-H200 AromaticContact CZ-ND1 3.6Å; Y92-H200 PolarHBondContact OH-ND1 2.76Å; Y92-H200 PolarHBondContact OH-O 2.82Å; V188-H200 CarbonylContact C-O 3.57Å; V188-H200 VanDerWaalsContact CA-O 3.27Å; V188-H200 WeakPolarHBondContact CA-O 3.31Å; G189-H200 PolarHBondContact N-O 3.15Å; G189-H200 PolarHBondContact O-N 2.86Å; I191-H200 HydrophobicContact CD1-CB 3.27Å; I191-H200 HydrophobicContact CG1-CB 4.09Å; H200-I202 WeakPolarHBondContact CE1-CG1 3.39Å
201	E	92.2	Very high	88.6	Confident	24 Å²	24	54.1 Å²	54.1	11%	0.112	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.9	-175.3	175.5	175.6	173.7	0	0	110	R186 I187 V188 R203	R186-E201 HydrophobicContact CB-CG 4.3Å; R186-E201 WeakPolarHBondContact CD-OE1 3.49Å; R186-E201 IonicContact CZ-OE1 3.23Å; R186-E201 IonicContact NE-OE1 2.65Å; R186-E201 VanDerWaalsContact NH1-CD 3.3Å; R186-E201 IonicContact NH1-OE1 3.16Å; R186-E201 PolarHBondContact NH1-OE1 3.48Å; R186-E201 IonicContact NH1-OE2 2.93Å; R186-E201 PolarHBondContact NH1-OE2 2.88Å; I187-E201 WeakPolarHBondContact O-CA 3Å; V188-E201 HydrophobicContact CG2-CB 4.13Å; V188-E201 HydrophobicContact CG2-CG 3.9Å; E201-R203 VanDerWaalsContact CD-CZ 3.41Å; E201-R203 HydrophobicContact CG-CG 3.99Å; E201-R203 VanDerWaalsContact OE1-CG 3.28Å; E201-R203 WeakPolarHBondContact OE1-CG 3.42Å; E201-R203 IonicContact OE1-CZ 3.25Å; E201-R203 IonicContact OE1-NE 3.64Å; E201-R203 PolarHBondContact OE1-NE 3.49Å; E201-R203 IonicContact OE1-NH2 2.73Å; E201-R203 PolarHBondContact OE1-NH2 2.84Å; E201-R203 IonicContact OE2-CZ 2.65Å; E201-R203 IonicContact OE2-NE 2.68Å; E201-R203 IonicContact OE2-NH2 3.84Å; E201-R203 PolarHBondContact OE2-NH2 2.92Å
202	I	94	Very high	89.2	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.3	169.1	-52.9	167.6	0	0	0	108	H53 H56 M58 R186 I187 H200 F217	H53-I202 HydrophobicContact CB-CD1 3.54Å; H53-I202 HydrophobicContact CB-CG1 3.88Å; H53-I202 VanDerWaalsContact CE1-CG2 3.45Å; H53-I202 WeakPolarHBondContact CE1-CG2 3.28Å; H53-I202 WeakPolarHBondContact ND1-CG2 3.1Å; H56-I202 HydrophobicContact CB-CD1 3.7Å; M58-I202 HydrophobicContact SD-CG2 4.47Å; R186-I202 CarbonylContact C-O 3.5Å; R186-I202 WeakPolarHBondContact CA-O 3.2Å; R186-I202 VanDerWaalsContact CB-O 3.27Å; R186-I202 WeakPolarHBondContact CB-O 3.47Å; I187-I202 HydrophobicContact CD1-CD1 3.96Å; I187-I202 HydrophobicContact CG1-CB 3.9Å; I187-I202 HydrophobicContact CG1-CD1 4.17Å; I187-I202 HydrophobicContact CG1-CG1 4.37Å; I187-I202 PolarHBondContact N-O 2.96Å; I187-I202 PolarHBondContact O-N 2.89Å; H200-I202 WeakPolarHBondContact CE1-CG1 3.39Å; I202-F217 HydrophobicContact CB-CE1 4.12Å; I202-F217 HydrophobicContact CG2-CD1 4.41Å; I202-F217 HydrophobicContact CG2-CE1 3.54Å; I202-F217 HydrophobicContact CG2-CZ 4.33Å
203	R	95.4	Very high	89.9	Confident	136 Å²	136	49.2 Å²	49.2	51%	0.513	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.5	178.5	-62.3	-177.5	-178.7	105	8.5	110.1	R186 E201	R186-R203 HydrophobicContact CB-CG 4.23Å; E201-R203 VanDerWaalsContact CD-CZ 3.41Å; E201-R203 HydrophobicContact CG-CG 3.99Å; E201-R203 VanDerWaalsContact OE1-CG 3.28Å; E201-R203 WeakPolarHBondContact OE1-CG 3.42Å; E201-R203 IonicContact OE1-CZ 3.25Å; E201-R203 IonicContact OE1-NE 3.64Å; E201-R203 PolarHBondContact OE1-NE 3.49Å; E201-R203 IonicContact OE1-NH2 2.73Å; E201-R203 PolarHBondContact OE1-NH2 2.84Å; E201-R203 IonicContact OE2-CZ 2.65Å; E201-R203 IonicContact OE2-NE 2.68Å; E201-R203 IonicContact OE2-NH2 3.84Å; E201-R203 PolarHBondContact OE2-NH2 2.92Å
204	V	96.3	Very high	90.8	Very high	9 Å²	9	49.3 Å²	49.3	6%	0.055	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-73.3	125.5	164.5	-177	0	0	0	0	107.4	I60 F169 T185 A206 I209 V215 F217	I60-V204 HydrophobicContact CD1-CG1 4.29Å; F169-V204 HydrophobicContact CD2-CG2 4.06Å; F169-V204 HydrophobicContact CE2-CG2 4.31Å; T185-V204 HydrophobicContact CG2-CB 4.23Å; T185-V204 HydrophobicContact CG2-CG2 3.58Å; T185-V204 PolarHBondContact O-N 2.93Å; V204-A206 PolarHBondContact O-N 2.04Å; V204-I209 HydrophobicContact CG1-CD1 4.43Å; V204-I209 HydrophobicContact CG1-CG1 4.06Å; V204-V215 HydrophobicContact CG1-CG2 3.83Å; V204-V215 HydrophobicContact CG2-CG1 3.9Å; V204-V215 HydrophobicContact CG2-CG2 4.36Å; V204-F217 HydrophobicContact CG2-CE2 4.14Å; V204-F217 HydrophobicContact CG2-CZ 3.87Å
205	P	95	Very high	92.1	Very high	35 Å²	35	46 Å²	46	23%	0.227	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-64.8	128.3	177.3	-8.9	20.8	0	0	0	109.5	K207 W208	P205-K207 HydrophobicContact CB-CG 4.5Å; P205-K207 PolarHBondContact O-N 2.86Å; P205-K207 VanDerWaalsContact O-N 3.13Å; P205-W208 WeakPolarHBondContact O-CB 3.42Å; P205-W208 PolarHBondContact O-N 2.82Å
206	A	94.3	Very high	93.2	Very high	27 Å²	27	43.4 Å²	43.4	22%	0.223	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-61.7	-28.9	-165.9	0	0	0	0	0	114.3	E180 V204 W208 I209	E180-A206 HydrophobicContact CB-CB 3.72Å; E180-A206 VanDerWaalsContact O-CB 3.22Å; E180-A206 WeakPolarHBondContact O-CB 3.06Å; V204-A206 PolarHBondContact O-N 2.04Å; A206-W208 PolarHBondContact O-N 3Å; A206-I209 WeakPolarHBondContact O-CB 3.38Å; A206-I209 PolarHBondContact O-N 2.94Å
207	K	94.2	Very high	94	Very high	87 Å²	87	38.2 Å²	38.2	38%	0.378	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-54.8	-22.2	172.5	71.6	175.2	-171	168.5	0	115.5	E44 E180 P205 K210	E44-K207 IonicContact OE1-NZ 2.65Å; E44-K207 PolarHBondContact OE1-NZ 2.94Å; E180-K207 VanDerWaalsContact CD-CA 3.45Å; E180-K207 WeakPolarHBondContact OE1-CA 2.91Å; E180-K207 WeakPolarHBondContact OE2-CA 3.28Å; E180-K207 WeakPolarHBondContact OE2-CB 3.43Å; E180-K207 PolarHBondContact OE2-N 2.8Å; P205-K207 HydrophobicContact CB-CG 4.5Å; P205-K207 PolarHBondContact O-N 2.86Å; P205-K207 VanDerWaalsContact O-N 3.13Å; K207-K210 WeakPolarHBondContact O-CE 3.5Å
208	W	95.7	Very high	94.5	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.027	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-87.7	-14.9	177.7	-70.1	93.5	0	0	0	113	E44 N45 Y48 R49 I60 H62 P205 A206 K210 T213	E44-W208 HydrophobicContact CG-CZ2 3.99Å; N45-W208 WeakPolarHBondContact O-CH2 3.43Å; Y48-W208 VanDerWaalsContact C-CH2 3.43Å; Y48-W208 WeakPolarHBondContact O-CH2 3.36Å; R49-W208 HydrophobicContact CB-CH2 3.68Å; R49-W208 HydrophobicContact CB-CZ2 3.43Å; R49-W208 VanDerWaalsContact CB-CZ2 3.43Å; R49-W208 HydrophobicContact CB-CZ3 4.34Å; R49-W208 HydrophobicContact CG-CZ2 4.32Å; I60-W208 HydrophobicContact CB-CD2 4.27Å; I60-W208 HydrophobicContact CB-CE3 3.99Å; I60-W208 HydrophobicContact CB-CZ3 4.41Å; I60-W208 HydrophobicContact CD1-CB 4.04Å; I60-W208 HydrophobicContact CD1-CD2 4.04Å; I60-W208 HydrophobicContact CD1-CG 3.72Å; I60-W208 HydrophobicContact CG2-CB 3.99Å; I60-W208 HydrophobicContact CG2-CD2 3.72Å; I60-W208 HydrophobicContact CG2-CE3 3.27Å; I60-W208 HydrophobicContact CG2-CG 4.03Å; I60-W208 HydrophobicContact CG2-CZ3 4Å; H62-W208 AromaticContact CD2-CE3 3.44Å; H62-W208 VanDerWaalsContact CD2-CE3 3.44Å; H62-W208 AromaticContact CD2-CZ3 3.28Å; H62-W208 WeakPolarHBondContact CD2-CZ3 3.5Å; H62-W208 AromaticContact CE1-CE3 3.89Å; H62-W208 PolarHBondContact CE1-O 3.31Å; H62-W208 AromaticContact NE2-CD2 3.97Å; H62-W208 AromaticContact NE2-CE3 3.1Å; H62-W208 AromaticContact NE2-CZ3 3.45Å; H62-W208 WeakPolarHBondContact NE2-CZ3 3.32Å; P205-W208 WeakPolarHBondContact O-CB 3.42Å; P205-W208 PolarHBondContact O-N 2.82Å; A206-W208 PolarHBondContact O-N 3Å; W208-K210 VanDerWaalsContact C-N 3.31Å; W208-K210 PolarHBondContact O-N 3.19Å; W208-T213 VanDerWaalsContact O-CB 3.28Å; W208-T213 WeakPolarHBondContact O-CB 3.37Å; W208-T213 WeakPolarHBondContact O-CG2 2.96Å; W208-T213 PolarHBondContact O-OG1 2.98Å
209	I	96.5	Very high	94.7	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.026	18%	0.176	C	C	.	.			trans	-79.8	82.8	-177.2	-56.7	178.1	0	0	0	108.4	M157 Y171 F183 T185 V204 A206	M157-I209 HydrophobicContact CE-CG2 4.4Å; Y171-I209 HydrophobicContact CD1-CG2 3.67Å; Y171-I209 HydrophobicContact CD2-CG2 4.45Å; Y171-I209 HydrophobicContact CE1-CB 4.47Å; Y171-I209 HydrophobicContact CE1-CG1 4.32Å; Y171-I209 HydrophobicContact CE1-CG2 3.58Å; Y171-I209 HydrophobicContact CE2-CG1 4.25Å; Y171-I209 HydrophobicContact CE2-CG2 4.36Å; Y171-I209 HydrophobicContact CG-CG2 4.09Å; F183-I209 HydrophobicContact CB-CD1 3.56Å; F183-I209 HydrophobicContact CB-CG2 4.21Å; F183-I209 HydrophobicContact CD1-CG2 3.79Å; F183-I209 HydrophobicContact CD2-CB 4.42Å; F183-I209 HydrophobicContact CD2-CG2 4.16Å; F183-I209 HydrophobicContact CE1-CG2 4.17Å; F183-I209 HydrophobicContact CG-CB 4.33Å; F183-I209 HydrophobicContact CG-CD1 4.28Å; F183-I209 HydrophobicContact CG-CG2 3.78Å; T185-I209 WeakPolarHBondContact OG1-CD1 3.32Å; V204-I209 HydrophobicContact CG1-CD1 4.43Å; V204-I209 HydrophobicContact CG1-CG1 4.06Å; A206-I209 WeakPolarHBondContact O-CB 3.38Å; A206-I209 PolarHBondContact O-N 2.94Å
210	K	95.8	Very high	94.3	Very high	106 Å²	106	30.8 Å²	30.8	46%	0.461	16%	0.16	S	C	.	.	S	Bend	trans	-135.7	162.9	-178.6	-64.6	178.5	177.9	170.3	0	109.3	Y171 K207 W208 G212 T213	Y171-K210 WeakPolarHBondContact CB-O 3.41Å; K207-K210 WeakPolarHBondContact O-CE 3.5Å; W208-K210 VanDerWaalsContact C-N 3.31Å; W208-K210 PolarHBondContact O-N 3.19Å; K210-G212 PolarHBondContact O-N 3.1Å; K210-T213 WeakPolarHBondContact O-CB 3.38Å; K210-T213 PolarHBondContact O-N 2.75Å; K210-T213 PolarHBondContact O-OG1 3.37Å
211	S	97	Very high	93.4	Very high	51 Å²	51	31.8 Å²	31.8	36%	0.357	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	134.8	175.5	-58	0	0	0	0	111.6	N173 I174 T213	N173-S211 WeakPolarHBondContact CA-OG 3.18Å; N173-S211 PolarHBondContact N-OG 3.19Å; I174-S211 PolarHBondContact N-OG 3.31Å; I174-S211 PolarHBondContact O-OG 3.02Å; S211-T213 VanDerWaalsContact C-N 3.31Å; S211-T213 PolarHBondContact O-N 3.37Å
212	G	97.2	Very high	92.1	Very high	10 Å²	10	37.6 Å²	37.6	10%	0.103	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	11.8	-180	0	0	0	0	0	114.3	H62 N63 Q64 Y171 K210	H62-G212 CarbonylContact C-O 3.54Å; N63-G212 PolarHBondContact N-O 2.93Å; Q64-G212 PolarHBondContact N-O 3.37Å; Y171-G212 PolarHBondContact O-N 3.43Å; K210-G212 PolarHBondContact O-N 3.1Å
213	T	98.2	Very high	90.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.2	172.7	-53.6	0	0	0	0	111	I60 Q61 H62 Y170 Y171 W208 K210 S211 V215	I60-T213 HydrophobicContact CG2-CG2 3.5Å; I60-T213 VanDerWaalsContact CG2-CG2 3.5Å; Q61-T213 CarbonylContact O-C 3.41Å; Q61-T213 WeakPolarHBondContact O-CA 3.15Å; H62-T213 PolarHBondContact CE1-OG1 3.49Å; H62-T213 PolarHBondContact ND1-OG1 3.4Å; Y170-T213 WeakPolarHBondContact CA-O 3.37Å; Y170-T213 WeakPolarHBondContact CD2-O 3.36Å; Y171-T213 HydrophobicContact CD2-CG2 4.31Å; Y171-T213 WeakPolarHBondContact CD2-O 3.03Å; Y171-T213 HydrophobicContact CE2-CG2 4.44Å; Y171-T213 PolarHBondContact N-O 3.26Å; W208-T213 VanDerWaalsContact O-CB 3.28Å; W208-T213 WeakPolarHBondContact O-CB 3.37Å; W208-T213 WeakPolarHBondContact O-CG2 2.96Å; W208-T213 PolarHBondContact O-OG1 2.98Å; K210-T213 WeakPolarHBondContact O-CB 3.38Å; K210-T213 PolarHBondContact O-N 2.75Å; K210-T213 PolarHBondContact O-OG1 3.37Å; S211-T213 VanDerWaalsContact C-N 3.31Å; S211-T213 PolarHBondContact O-N 3.37Å; T213-V215 HydrophobicContact CG2-CG2 4.1Å
214	L	98.4	Very high	89.3	Confident	19 Å²	19	33 Å²	33	10%	0.099	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.9	164.4	-176.2	66.2	0	0	0	109.7	I60 Q61 Q64 P67 F169 Y170 E216	I60-L214 WeakPolarHBondContact CA-O 3.26Å; Q61-L214 PolarHBondContact N-O 2.99Å; Q61-L214 PolarHBondContact O-N 2.83Å; Q64-L214 HydrophobicContact CB-CB 3.96Å; Q64-L214 HydrophobicContact CG-CB 3.7Å; P67-L214 HydrophobicContact CG-CD1 4.35Å; F169-L214 CarbonylContact O-C 3.53Å; F169-L214 WeakPolarHBondContact O-CA 3.33Å; Y170-L214 HydrophobicContact CD2-CB 4.46Å; Y170-L214 HydrophobicContact CD2-CD1 4.44Å; L214-E216 HydrophobicContact CD2-CG 4.28Å; L214-E216 HydrophobicContact CG-CG 4.1Å
215	V	98.4	Very high	87.8	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.3	171.9	-178.4	0	0	0	0	108.5	M58 R59 I60 S168 F169 Y171 V204 T213 F217	M58-V215 HydrophobicContact CG-CG1 3.99Å; M58-V215 HydrophobicContact SD-CG1 4.18Å; R59-V215 CarbonylContact O-C 3.59Å; R59-V215 WeakPolarHBondContact O-CA 3.16Å; I60-V215 HydrophobicContact CD1-CG2 4.46Å; I60-V215 HydrophobicContact CG1-CG1 4.15Å; I60-V215 HydrophobicContact CG1-CG2 4.11Å; I60-V215 HydrophobicContact CG2-CG2 3.98Å; S168-V215 CarbonylContact C-O 3.55Å; S168-V215 VanDerWaalsContact CA-O 3.22Å; S168-V215 WeakPolarHBondContact CA-O 3.45Å; F169-V215 HydrophobicContact CB-CB 4.21Å; F169-V215 HydrophobicContact CD2-CB 4.36Å; F169-V215 HydrophobicContact CD2-CG1 4.4Å; F169-V215 PolarHBondContact N-O 3.14Å; F169-V215 PolarHBondContact O-N 3.01Å; Y171-V215 HydrophobicContact CE2-CG2 3.95Å; V204-V215 HydrophobicContact CG1-CG2 3.83Å; V204-V215 HydrophobicContact CG2-CG1 3.9Å; V204-V215 HydrophobicContact CG2-CG2 4.36Å; T213-V215 HydrophobicContact CG2-CG2 4.1Å; V215-F217 HydrophobicContact CG1-CD2 4.29Å; V215-F217 HydrophobicContact CG1-CE2 3.57Å; V215-F217 HydrophobicContact CG1-CZ 3.94Å
216	E	97.9	Very high	86.4	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.056	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132	-179.6	-70.1	167.6	110.3	0	0	110.6	M58 R59 K166 I167 L214	M58-E216 CarbonylContact C-O 3.42Å; M58-E216 WeakPolarHBondContact CA-O 3.28Å; R59-E216 IonicContact CZ-OE2 2.93Å; R59-E216 PolarHBondContact N-O 2.88Å; R59-E216 IonicContact NE-OE2 3.53Å; R59-E216 PolarHBondContact NE-OE2 2.83Å; R59-E216 VanDerWaalsContact NH2-CD 3.27Å; R59-E216 IonicContact NH2-OE1 3.48Å; R59-E216 PolarHBondContact NH2-OE1 3.43Å; R59-E216 IonicContact NH2-OE2 3.38Å; R59-E216 PolarHBondContact NH2-OE2 3.04Å; R59-E216 PolarHBondContact O-N 3.13Å; K166-E216 HydrophobicContact CD-CB 4.27Å; K166-E216 HydrophobicContact CD-CG 4.29Å; K166-E216 WeakPolarHBondContact CE-OE1 3.49Å; K166-E216 IonicContact NZ-OE1 3.68Å; K166-E216 PolarHBondContact NZ-OE1 3.37Å; I167-E216 CarbonylContact O-C 3.54Å; I167-E216 WeakPolarHBondContact O-CA 3.4Å; L214-E216 HydrophobicContact CD2-CG 4.28Å; L214-E216 HydrophobicContact CG-CG 4.1Å
217	F	96.3	Very high	85.3	Confident	1 Å²	1	40.1 Å²	40.1	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.5	172.5	-64.2	-86.5	0	0	0	109.9	L57 M58 K166 I167 F169 I187 I202 V204 V215	L57-F217 VanDerWaalsContact O-CA 3.31Å; L57-F217 WeakPolarHBondContact O-CA 3.44Å; M58-F217 HydrophobicContact CB-CD1 4.06Å; M58-F217 HydrophobicContact CB-CE1 3.84Å; M58-F217 HydrophobicContact CG-CD1 4.13Å; M58-F217 HydrophobicContact CG-CE1 3.59Å; M58-F217 HydrophobicContact CG-CZ 3.88Å; M58-F217 HydrophobicContact SD-CE1 3.53Å; M58-F217 VanDerWaalsContact SD-CE1 3.53Å; M58-F217 HydrophobicContact SD-CZ 3.54Å; M58-F217 VanDerWaalsContact SD-CZ 3.54Å; K166-F217 VanDerWaalsContact CA-O 3.31Å; K166-F217 WeakPolarHBondContact CA-O 3.35Å; I167-F217 HydrophobicContact CB-CB 4.37Å; I167-F217 PolarHBondContact N-O 3.23Å; I167-F217 PolarHBondContact O-N 3.12Å; F169-F217 HydrophobicContact CD2-CD2 4.31Å; F169-F217 AromaticContact CD2-CE2 3.63Å; F169-F217 HydrophobicContact CD2-CE2 3.63Å; F169-F217 AromaticContact CE2-CD2 3.98Å; F169-F217 HydrophobicContact CE2-CD2 3.98Å; F169-F217 AromaticContact CE2-CE2 3.35Å; F169-F217 HydrophobicContact CE2-CE2 3.35Å; F169-F217 HydrophobicContact CE2-CZ 4.27Å; F169-F217 HydrophobicContact CZ-CE2 4.39Å; I187-F217 HydrophobicContact CD1-CB 3.94Å; I187-F217 HydrophobicContact CD1-CD1 3.54Å; I187-F217 HydrophobicContact CD1-CD2 4.39Å; I187-F217 HydrophobicContact CD1-CE1 4.14Å; I187-F217 HydrophobicContact CD1-CG 3.68Å; I187-F217 HydrophobicContact CG1-CD1 4.09Å; I187-F217 HydrophobicContact CG1-CE1 4.19Å; I187-F217 HydrophobicContact CG1-CG 4.37Å; I187-F217 HydrophobicContact CG2-CD2 4.32Å; I202-F217 HydrophobicContact CB-CE1 4.12Å; I202-F217 HydrophobicContact CG2-CD1 4.41Å; I202-F217 HydrophobicContact CG2-CE1 3.54Å; I202-F217 HydrophobicContact CG2-CZ 4.33Å; V204-F217 HydrophobicContact CG2-CE2 4.14Å; V204-F217 HydrophobicContact CG2-CZ 3.87Å; V215-F217 HydrophobicContact CG1-CD2 4.29Å; V215-F217 HydrophobicContact CG1-CE2 3.57Å; V215-F217 HydrophobicContact CG1-CZ 3.94Å
218	E	92.7	Very high	84.2	Confident	45 Å²	45	42.2 Å²	42.2	21%	0.21	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.5	175.3	-67.5	-177.9	-178.9	0	0	109.3	H56 L57 K166 I220	H56-E218 CarbonylContact C-O 3.44Å; H56-E218 WeakPolarHBondContact CA-O 3.5Å; H56-E218 WeakPolarHBondContact CB-O 3.08Å; L57-E218 PolarHBondContact N-O 3.33Å; L57-E218 PolarHBondContact O-N 3.11Å; K166-E218 HydrophobicContact CB-CG 4.12Å; K166-E218 HydrophobicContact CD-CG 3.88Å; K166-E218 VanDerWaalsContact CD-OE1 3.23Å; K166-E218 WeakPolarHBondContact CD-OE1 3.43Å; K166-E218 HydrophobicContact CG-CG 3.81Å; E218-I220 PolarHBondContact O-N 3.1Å
219	A	88.1	Confident	83.3	Confident	45 Å²	45	44.4 Å²	44.4	37%	0.372	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	134	179.5	0	0	0	0	0	110.5	T55 G221	T55-A219 WeakPolarHBondContact O-CA 3.21Å; A219-G221 PolarHBondContact O-N 3.49Å; A219-G221 VanDerWaalsContact O-N 3.09Å
220	I	78.8	Confident	82.5	Confident	24 Å²	24	47.1 Å²	47.1	12%	0.123	26%	0.263	C	S	.	.			trans	-73.1	104.3	170.1	-59.4	168	0	0	0	106	I52 H53 T55 L57 E218 S225	I52-I220 HydrophobicContact CG2-CD1 3.9Å; H53-I220 WeakPolarHBondContact O-CD1 3.36Å; T55-I220 PolarHBondContact O-N 2.93Å; L57-I220 HydrophobicContact CD2-CD1 4.03Å; L57-I220 HydrophobicContact CD2-CG1 3.83Å; L57-I220 HydrophobicContact CG-CD1 4.47Å; L57-I220 HydrophobicContact CG-CG1 3.78Å; E218-I220 PolarHBondContact O-N 3.1Å; I220-S225 WeakPolarHBondContact CG2-OG 3.14Å
221	G	69.2	Low	81.7	Confident	22 Å²	22	49.3 Å²	49.3	23%	0.227	28%	0.275	C	S	.	.			trans	-58.6	147.1	176	0	0	0	0	0	111.1	A219 I223	A219-G221 PolarHBondContact O-N 3.49Å; A219-G221 VanDerWaalsContact O-N 3.09Å; G221-I223 PolarHBondContact O-N 2.9Å; G221-I223 VanDerWaalsContact O-N 3.11Å
222	E	64.5	Low	80.9	Confident	147 Å²	147	49.4 Å²	49.4	69%	0.687	27%	0.273	S	S	*	.	H	α-helix	trans	-66.5	-17.4	-169.7	-61.6	-175.5	172	0	0	114.1
223	I	61.5	Low	80	Confident	41 Å²	41	49 Å²	49	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-49	-169.5	-59.5	178.1	0	0	0	111.4	G221 Q226 Y227 I238 W239	G221-I223 PolarHBondContact O-N 2.9Å; G221-I223 VanDerWaalsContact O-N 3.11Å; I223-Q226 VanDerWaalsContact O-CG 3.24Å; I223-Q226 WeakPolarHBondContact O-CG 3.46Å; I223-Q226 PolarHBondContact O-NE2 2.88Å; I223-Y227 WeakPolarHBondContact O-CE2 3.24Å; I223-I238 HydrophobicContact CD1-CG2 4.49Å; I223-I238 HydrophobicContact CG2-CB 3.87Å; I223-I238 HydrophobicContact CG2-CD1 3.85Å; I223-I238 HydrophobicContact CG2-CG1 4.27Å; I223-I238 HydrophobicContact CG2-CG2 4.47Å; I223-W239 HydrophobicContact CD1-CE3 4.45Å
224	C	68.5	Low	78.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-78.2	-30.9	-177	-60.9	0	0	0	0	112.2	Q226 Y227 C243 C252 I254	C224-Q226 PolarHBondContact O-N 3.02Å; C224-Y227 PolarHBondContact O-N 3.49Å; C224-C243 WeakPolarHBondContact CA-SG 3.16Å; C224-C243 HydrophobicContact CB-CB 3.83Å; C224-C243 WeakPolarHBondContact CB-SG 3.04Å; C224-C243 WeakPolarHBondContact SG-CA 3.45Å; C224-C243 WeakPolarHBondContact SG-CB 2.93Å; C224-C243 CovalentContact SG-SG 2.01Å; C224-C243 PolarHBondContact SG-SG 3.2Å; C224-C252 HydrophobicContact CB-CB 4.31Å; C224-C252 VanDerWaalsContact O-CB 3.28Å; C224-C252 WeakPolarHBondContact O-CB 3.22Å; C224-C252 PolarHBondContact O-SG 2.79Å; C224-I254 HydrophobicContact CB-CG1 3.97Å; C224-I254 WeakPolarHBondContact SG-CA 3.43Å; C224-I254 WeakPolarHBondContact SG-CG1 3.48Å
225	S	66.3	Low	77.4	Confident	71 Å²	71	57.7 Å²	57.7	50%	0.497	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-16	-179	-56.8	0	0	0	0	114.2	I220 Y227	I220-S225 WeakPolarHBondContact CG2-OG 3.14Å; S225-Y227 VanDerWaalsContact C-N 3.29Å
226	Q	65.5	Low	75.7	Confident	93 Å²	93	57.8 Å²	57.8	44%	0.435	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-16	174.8	79.2	-165.8	-5.7	0	0	113.5	I223 C224	I223-Q226 VanDerWaalsContact O-CG 3.24Å; I223-Q226 WeakPolarHBondContact O-CG 3.46Å; I223-Q226 PolarHBondContact O-NE2 2.88Å; C224-Q226 PolarHBondContact O-N 3.02Å
227	Y	70.3	Confident	73.8	Confident	57 Å²	57	61.6 Å²	61.6	22%	0.224	34%	0.344	C	S	.	.			trans	-100.4	111.6	178.7	-56.9	-82	0	0	0	109.1	I223 C224 S225 A236 C252	I223-Y227 WeakPolarHBondContact O-CE2 3.24Å; C224-Y227 PolarHBondContact O-N 3.49Å; S225-Y227 VanDerWaalsContact C-N 3.29Å; Y227-A236 HydrophobicContact CD1-CB 4.27Å; Y227-A236 HydrophobicContact CD2-CB 3.33Å; Y227-A236 HydrophobicContact CE1-CB 4Å; Y227-A236 HydrophobicContact CE2-CB 3.03Å; Y227-A236 HydrophobicContact CG-CB 3.94Å; Y227-C252 WeakPolarHBondContact O-CB 3.41Å
228	N	71.1	Confident	72	Confident	131 Å²	131	64 Å²	64	70%	0.701	36%	0.356	S	S	*	.			trans	-105	11.5	-173.7	64.7	-17.6	0	0	0	113.2	W245	N228-W245 WeakPolarHBondContact O-CH2 3.22Å
229	T	77.1	Confident	70.1	Confident	52 Å²	52	72.7 Å²	72.7	32%	0.319	39%	0.387	S	S	.	.	S	Bend	trans	-129.9	148.8	177	69.2	0	0	0	0	111.4	E231 T232 C233	T229-E231 PolarHBondContact O-N 3.27Å; T229-T232 PolarHBondContact O-N 3.16Å; T229-T232 PolarHBondContact O-OG1 3.35Å; T229-T232 WeakPolarHBondContact OG1-CB 3.5Å; T229-T232 VanDerWaalsContact OG1-CG2 3.28Å; T229-T232 WeakPolarHBondContact OG1-CG2 3.42Å; T229-T232 PolarHBondContact OG1-N 2.94Å; T229-T232 PolarHBondContact OG1-OG1 3.06Å; T229-C233 VanDerWaalsContact O-CB 3.31Å; T229-C233 WeakPolarHBondContact O-CB 3.35Å; T229-C233 PolarHBondContact O-N 3.13Å
230	S	79.6	Confident	68.6	Low	62 Å²	62	78.4 Å²	78.4	43%	0.434	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.5	175.7	56	0	0	0	0	113.3	P234	S230-P234 WeakPolarHBondContact O-CD 3.18Å; S230-P234 WeakPolarHBondContact O-CG 3.36Å
231	E	78.9	Confident	67.8	Low	152 Å²	152	78.5 Å²	78.5	71%	0.71	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-37.7	180	-61.4	175.3	179	0	0	112.6	T229 N235	T229-E231 PolarHBondContact O-N 3.27Å; E231-N235 PolarHBondContact O-ND2 2.94Å
232	T	80.4	Confident	67.9	Low	54 Å²	54	79.5 Å²	79.5	33%	0.331	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-26.6	-176.3	60.1	0	0	0	0	112.2	T229 N235 A236	T229-T232 PolarHBondContact O-N 3.16Å; T229-T232 PolarHBondContact O-OG1 3.35Å; T229-T232 WeakPolarHBondContact OG1-CB 3.5Å; T229-T232 VanDerWaalsContact OG1-CG2 3.28Å; T229-T232 WeakPolarHBondContact OG1-CG2 3.42Å; T229-T232 PolarHBondContact OG1-N 2.94Å; T229-T232 PolarHBondContact OG1-OG1 3.06Å; T232-N235 PolarHBondContact O-N 2.97Å; T232-A236 PolarHBondContact O-N 2.84Å
233	C	78.3	Confident	68.4	Low	0 Å²	0	72.6 Å²	72.6	0%	0	38%	0.383	C	S	.	.	S	Bend	trans	-62.1	-52.5	-177	177.3	0	0	0	0	113.9	T229 N235 A236 C243 T244 W245 C252	T229-C233 VanDerWaalsContact O-CB 3.31Å; T229-C233 WeakPolarHBondContact O-CB 3.35Å; T229-C233 PolarHBondContact O-N 3.13Å; C233-N235 PolarHBondContact O-N 2.75Å; C233-A236 WeakPolarHBondContact O-CB 3.44Å; C233-A236 PolarHBondContact O-N 2.87Å; C233-C243 VanDerWaalsContact O-CB 3.26Å; C233-C243 WeakPolarHBondContact O-CB 2.91Å; C233-T244 PolarHBondContact SG-O 2.94Å; C233-T244 VanDerWaalsContact SG-O 3.38Å; C233-W245 HydrophobicContact CB-CB 4.19Å; C233-W245 HydrophobicContact CB-CE3 3.73Å; C233-W245 PolarHBondContact SG-N 2.99Å; C233-C252 WeakPolarHBondContact CA-SG 3.49Å; C233-C252 HydrophobicContact CB-CB 3.57Å; C233-C252 WeakPolarHBondContact CB-SG 3.4Å; C233-C252 WeakPolarHBondContact SG-CA 3.4Å; C233-C252 WeakPolarHBondContact SG-CB 3.2Å; C233-C252 CovalentContact SG-SG 2.01Å; C233-C252 PolarHBondContact SG-SG 2.98Å
234	P	75.3	Confident	69.2	Low	68 Å²	68	71.4 Å²	71.4	44%	0.442	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.9	-179.9	-21.1	33.5	0	0	0	113.3	S230 A236	S230-P234 WeakPolarHBondContact O-CD 3.18Å; S230-P234 WeakPolarHBondContact O-CG 3.36Å; P234-A236 PolarHBondContact O-N 3.41Å
235	N	66.5	Low	69.8	Low	135 Å²	135	73.5 Å²	73.5	72%	0.722	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-8	179	-68.9	-32.4	0	0	0	113	E231 T232 C233 T237	E231-N235 PolarHBondContact O-ND2 2.94Å; T232-N235 PolarHBondContact O-N 2.97Å; C233-N235 PolarHBondContact O-N 2.75Å; N235-T237 PolarHBondContact O-N 2.99Å; N235-T237 VanDerWaalsContact O-N 3.13Å
236	A	62.4	Low	70.4	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.008	36%	0.362	C	S	.	.			trans	-80.9	90.9	175.4	0	0	0	0	0	110.5	Y227 T232 C233 P234 C243	Y227-A236 HydrophobicContact CD1-CB 4.27Å; Y227-A236 HydrophobicContact CD2-CB 3.33Å; Y227-A236 HydrophobicContact CE1-CB 4Å; Y227-A236 HydrophobicContact CE2-CB 3.03Å; Y227-A236 HydrophobicContact CG-CB 3.94Å; T232-A236 PolarHBondContact O-N 2.84Å; C233-A236 WeakPolarHBondContact O-CB 3.44Å; C233-A236 PolarHBondContact O-N 2.87Å; P234-A236 PolarHBondContact O-N 3.41Å; A236-C243 HydrophobicContact CB-CB 3.92Å; A236-C243 VanDerWaalsContact CB-SG 3.57Å; A236-C243 PolarHBondContact O-N 3.49Å; A236-C243 PolarHBondContact O-SG 2.78Å
237	T	59.6	Low	71.1	Confident	93 Å²	93	72.8 Å²	72.8	57%	0.571	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.7	164.5	-54.8	0	0	0	0	108.5	N235	N235-T237 PolarHBondContact O-N 2.99Å; N235-T237 VanDerWaalsContact O-N 3.13Å
238	I	57.2	Low	71.4	Confident	50 Å²	50	76.4 Å²	76.4	26%	0.256	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	122.2	174.9	-63.1	170.9	0	0	0	107.5	I223 N240 T241	I223-I238 HydrophobicContact CD1-CG2 4.49Å; I223-I238 HydrophobicContact CG2-CB 3.87Å; I223-I238 HydrophobicContact CG2-CD1 3.85Å; I223-I238 HydrophobicContact CG2-CG1 4.27Å; I223-I238 HydrophobicContact CG2-CG2 4.47Å; I238-N240 PolarHBondContact O-N 2.95Å; I238-T241 PolarHBondContact N-O 3.33Å; I238-T241 WeakPolarHBondContact O-CB 3.43Å; I238-T241 PolarHBondContact O-N 3.05Å; I238-T241 PolarHBondContact O-OG1 3.33Å
239	W	52.7	Low	71.4	Confident	228 Å²	228	70.3 Å²	70.3	86%	0.864	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	55.5	173	-50.8	-33.4	0	0	0	114.5	I223 T241	I223-W239 HydrophobicContact CD1-CE3 4.45Å; W239-T241 PolarHBondContact O-N 3.3Å; W239-T241 VanDerWaalsContact O-N 3.14Å
240	N	57.8	Low	71.4	Confident	165 Å²	165	75.2 Å²	75.2	88%	0.882	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	11.4	-177.9	-61.5	-8.8	0	0	0	115.5	I238	I238-N240 PolarHBondContact O-N 2.95Å
241	T	61.7	Low	71.2	Confident	26 Å²	26	75.9 Å²	75.9	16%	0.16	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.1	173.3	-53.2	0	0	0	0	108.8	I238 W239 I254	I238-T241 PolarHBondContact N-O 3.33Å; I238-T241 WeakPolarHBondContact O-CB 3.43Å; I238-T241 PolarHBondContact O-N 3.05Å; I238-T241 PolarHBondContact O-OG1 3.33Å; W239-T241 PolarHBondContact O-N 3.3Å; W239-T241 VanDerWaalsContact O-N 3.14Å; T241-I254 HydrophobicContact CG2-CB 4.07Å; T241-I254 HydrophobicContact CG2-CD1 4.1Å; T241-I254 HydrophobicContact CG2-CG1 3.73Å; T241-I254 HydrophobicContact CG2-CG2 3.42Å; T241-I254 VanDerWaalsContact CG2-CG2 3.42Å
242	T	70.3	Confident	71	Confident	44 Å²	44	68.9 Å²	68.9	27%	0.27	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.4	173.4	-52	0	0	0	0	108.3	M255	T242-M255 HydrophobicContact CG2-SD 4.37Å; T242-M255 WeakPolarHBondContact O-CB 3.48Å; T242-M255 PolarHBondContact O-N 3.14Å
243	C	74.7	Confident	70.7	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.007	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	141.1	173.9	-61.9	0	0	0	0	111	C224 C233 A236 C252 I253	C224-C243 WeakPolarHBondContact CA-SG 3.16Å; C224-C243 HydrophobicContact CB-CB 3.83Å; C224-C243 WeakPolarHBondContact CB-SG 3.04Å; C224-C243 WeakPolarHBondContact SG-CA 3.45Å; C224-C243 WeakPolarHBondContact SG-CB 2.93Å; C224-C243 CovalentContact SG-SG 2.01Å; C224-C243 PolarHBondContact SG-SG 3.2Å; C233-C243 VanDerWaalsContact O-CB 3.26Å; C233-C243 WeakPolarHBondContact O-CB 2.91Å; A236-C243 HydrophobicContact CB-CB 3.92Å; A236-C243 VanDerWaalsContact CB-SG 3.57Å; A236-C243 PolarHBondContact O-N 3.49Å; A236-C243 PolarHBondContact O-SG 2.78Å; C243-C252 VanDerWaalsContact CB-SG 3.53Å; C243-I253 CarbonylContact C-O 3.54Å; C243-I253 VanDerWaalsContact CA-O 3.28Å; C243-I253 WeakPolarHBondContact CA-O 3.3Å
244	T	78.3	Confident	70.2	Confident	16 Å²	16	66.8 Å²	66.8	10%	0.098	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.6	173.7	-78.8	0	0	0	0	110.5	C233 I253 M255	C233-T244 PolarHBondContact SG-O 2.94Å; C233-T244 VanDerWaalsContact SG-O 3.38Å; T244-I253 PolarHBondContact N-O 3.4Å; T244-I253 VanDerWaalsContact O-CG1 3.27Å; T244-I253 WeakPolarHBondContact O-CG1 3.4Å; T244-I253 PolarHBondContact O-N 3.45Å; T244-M255 PolarHBondContact OG1-SD 3.23Å
245	W	81.2	Confident	69.6	Low	45 Å²	45	64.3 Å²	64.3	17%	0.17	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	124.7	174.7	-174.8	-104.8	0	0	0	110	N228 C233 E250 C252	N228-W245 WeakPolarHBondContact O-CH2 3.22Å; C233-W245 HydrophobicContact CB-CB 4.19Å; C233-W245 HydrophobicContact CB-CE3 3.73Å; C233-W245 PolarHBondContact SG-N 2.99Å; W245-E250 WeakPolarHBondContact CH2-O 3.25Å; W245-E250 HydrophobicContact CZ2-CB 4.29Å; W245-C252 HydrophobicContact CE3-CB 4.09Å; W245-C252 HydrophobicContact CZ3-CB 4.3Å
246	C	78.7	Confident	69.1	Low	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	104.2	169.6	-175.3	0	0	0	0	108.9	I42 I52 K248 G249 E250 K251 C264	I42-C246 WeakPolarHBondContact CD1-SG 3.11Å; I52-C246 HydrophobicContact CD1-CB 3.94Å; C246-K248 PolarHBondContact O-N 3.21Å; C246-G249 CarbonylContact O-C 3.59Å; C246-G249 PolarHBondContact O-N 3.33Å; C246-G249 PolarHBondContact SG-N 3.41Å; C246-E250 PolarHBondContact O-N 3.39Å; C246-K251 WeakPolarHBondContact CB-O 3.22Å; C246-K251 PolarHBondContact N-O 3.48Å; C246-K251 PolarHBondContact O-N 3.06Å; C246-C264 HydrophobicContact CB-CB 3.89Å; C246-C264 PolarHBondContact SG-SG 3.32Å
247	E	81.2	Confident	68.5	Low	149 Å²	149	69.8 Å²	69.8	70%	0.696	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-50.2	-177.7	-69.7	-172.7	171.2	0	0	111.8	G249 E250	E247-G249 VanDerWaalsContact C-N 3.27Å; E247-G249 PolarHBondContact O-N 2.76Å; E247-E250 PolarHBondContact O-N 3.43Å
248	K	77.6	Confident	67.7	Low	133 Å²	133	71.9 Å²	71.9	58%	0.578	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.3	-179	-172.1	169.7	175.4	-170.1	0	113.5	V41 I42 C246	V41-K248 WeakPolarHBondContact O-CE 3.08Å; V41-K248 PolarHBondContact O-NZ 3.21Å; I42-K248 HydrophobicContact CD1-CB 4.31Å; I42-K248 VanDerWaalsContact O-CD 3.27Å; I42-K248 WeakPolarHBondContact O-CD 3.22Å; I42-K248 WeakPolarHBondContact O-CE 3.32Å; I42-K248 PolarHBondContact O-NZ 3.44Å; C246-K248 PolarHBondContact O-N 3.21Å
249	G	70.4	Confident	67	Low	3 Å²	3	75.8 Å²	75.8	3%	0.031	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-13	177.6	0	0	0	0	0	114.3	I40 C246 E247 K251	I40-G249 WeakPolarHBondContact CD1-O 3.21Å; C246-G249 CarbonylContact O-C 3.59Å; C246-G249 PolarHBondContact O-N 3.33Å; C246-G249 PolarHBondContact SG-N 3.41Å; E247-G249 VanDerWaalsContact C-N 3.27Å; E247-G249 PolarHBondContact O-N 2.76Å; G249-K251 WeakPolarHBondContact O-CG 3.36Å; G249-K251 PolarHBondContact O-N 2.84Å
250	E	77.8	Confident	66.8	Low	155 Å²	155	69.9 Å²	69.9	72%	0.724	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.5	40.7	-166.7	-62.2	-175.4	161.9	0	0	112.6	W245 C246 E247	W245-E250 WeakPolarHBondContact CH2-O 3.25Å; W245-E250 HydrophobicContact CZ2-CB 4.29Å; C246-E250 PolarHBondContact O-N 3.39Å; E247-E250 PolarHBondContact O-N 3.43Å
251	K	74.3	Confident	66.5	Low	75 Å²	75	64.3 Å²	64.3	33%	0.326	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	142.7	-173	-80.7	-179.5	-179.8	-173.3	0	111.8	I52 C246 G249	I52-K251 HydrophobicContact CG2-CD 3.96Å; C246-K251 WeakPolarHBondContact CB-O 3.22Å; C246-K251 PolarHBondContact N-O 3.48Å; C246-K251 PolarHBondContact O-N 3.06Å; G249-K251 WeakPolarHBondContact O-CG 3.36Å; G249-K251 PolarHBondContact O-N 2.84Å
252	C	74.8	Confident	66.3	Low	5 Å²	5	63.7 Å²	63.7	3%	0.034	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.5	170.4	-169	0	0	0	0	110.3	C224 Y227 C233 C243 W245	C224-C252 HydrophobicContact CB-CB 4.31Å; C224-C252 VanDerWaalsContact O-CB 3.28Å; C224-C252 WeakPolarHBondContact O-CB 3.22Å; C224-C252 PolarHBondContact O-SG 2.79Å; Y227-C252 WeakPolarHBondContact O-CB 3.41Å; C233-C252 WeakPolarHBondContact CA-SG 3.49Å; C233-C252 HydrophobicContact CB-CB 3.57Å; C233-C252 WeakPolarHBondContact CB-SG 3.4Å; C233-C252 WeakPolarHBondContact SG-CA 3.4Å; C233-C252 WeakPolarHBondContact SG-CB 3.2Å; C233-C252 CovalentContact SG-SG 2.01Å; C233-C252 PolarHBondContact SG-SG 2.98Å; C243-C252 VanDerWaalsContact CB-SG 3.53Å; W245-C252 HydrophobicContact CE3-CB 4.09Å; W245-C252 HydrophobicContact CZ3-CB 4.3Å
253	I	73.3	Confident	65.8	Low	2 Å²	2	64.4 Å²	64.4	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	152.3	-178	59.4	159.9	0	0	0	111.1	I52 L57 C243 T244 H262 C264	I52-I253 HydrophobicContact CD1-CG2 3.85Å; L57-I253 HydrophobicContact CD2-CG2 4.26Å; C243-I253 CarbonylContact C-O 3.54Å; C243-I253 VanDerWaalsContact CA-O 3.28Å; C243-I253 WeakPolarHBondContact CA-O 3.3Å; T244-I253 PolarHBondContact N-O 3.4Å; T244-I253 VanDerWaalsContact O-CG1 3.27Å; T244-I253 WeakPolarHBondContact O-CG1 3.4Å; T244-I253 PolarHBondContact O-N 3.45Å; I253-H262 HydrophobicContact CD1-CB 3.57Å; I253-C264 HydrophobicContact CD1-CB 4.18Å; I253-C264 WeakPolarHBondContact CD1-SG 3.28Å
254	I	68.6	Low	65.4	Low	9 Å²	9	64.8 Å²	64.8	5%	0.046	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	135.9	172.6	-70.5	173.9	0	0	0	109.2	C224 T241 Y256 H262	C224-I254 HydrophobicContact CB-CG1 3.97Å; C224-I254 WeakPolarHBondContact SG-CA 3.43Å; C224-I254 WeakPolarHBondContact SG-CG1 3.48Å; T241-I254 HydrophobicContact CG2-CB 4.07Å; T241-I254 HydrophobicContact CG2-CD1 4.1Å; T241-I254 HydrophobicContact CG2-CG1 3.73Å; T241-I254 HydrophobicContact CG2-CG2 3.42Å; T241-I254 VanDerWaalsContact CG2-CG2 3.42Å; I254-Y256 HydrophobicContact CG2-CD2 4.04Å; I254-Y256 HydrophobicContact CG2-CE1 4.4Å; I254-Y256 HydrophobicContact CG2-CE2 3.85Å; I254-Y256 HydrophobicContact CG2-CG 4.39Å; I254-H262 PolarHBondContact O-CD2 3.18Å; I254-H262 PolarHBondContact O-NE2 3.36Å; I254-H262 VanDerWaalsContact O-NE2 3.1Å
255	M	63.2	Low	64.5	Low	16 Å²	16	71.2 Å²	71.2	8%	0.079	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.8	160	-63.1	-175.8	76.9	0	0	110.1	T242 T244 D260	T242-M255 HydrophobicContact CG2-SD 4.37Å; T242-M255 WeakPolarHBondContact O-CB 3.48Å; T242-M255 PolarHBondContact O-N 3.14Å; T244-M255 PolarHBondContact OG1-SD 3.23Å; M255-D260 WeakPolarHBondContact CE-OD1 3.4Å
256	Y	54.7	Low	62.8	Low	109 Å²	109	74 Å²	74	43%	0.427	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-89.2	131.3	166.7	-73.9	-77.5	0	0	0	110.7	I254 N258	I254-Y256 HydrophobicContact CG2-CD2 4.04Å; I254-Y256 HydrophobicContact CG2-CE1 4.4Å; I254-Y256 HydrophobicContact CG2-CE2 3.85Å; I254-Y256 HydrophobicContact CG2-CG 4.39Å; Y256-N258 PolarHBondContact O-N 3.48Å
257	N	50	Low	60.9	Low	141 Å²	141	82.3 Å²	82.3	75%	0.754	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	33.7	165.3	-64.4	-16.7	0	0	0	118.3	Q259	N257-Q259 PolarHBondContact O-N 3.44Å
258	N	43.3	Very low	58.5	Low	138 Å²	138	84.7 Å²	84.7	74%	0.738	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	12.3	177.4	-74.5	-12.3	0	0	0	115	Y256	Y256-N258 PolarHBondContact O-N 3.48Å
259	Q	42.6	Very low	56.3	Low	131 Å²	131	84.5 Å²	84.5	61%	0.612	42%	0.416	S	S	*	.	S	Bend	trans	-97.5	131.1	173.4	-111.5	170.1	-17.3	0	0	105.2	N257 T261	N257-Q259 PolarHBondContact O-N 3.44Å; Q259-T261 HydrophobicContact CB-CG2 3.81Å; Q259-T261 PolarHBondContact O-N 2.89Å; Q259-T261 PolarHBondContact O-OG1 3.49Å
260	D	49.2	Very low	54.4	Low	105 Å²	105	89.3 Å²	89.3	56%	0.561	45%	0.449	S	S	*	.			trans	-64	48.1	170.5	-75.2	-43.6	0	0	0	110.8	M255 H262 R265	M255-D260 WeakPolarHBondContact CE-OD1 3.4Å; D260-H262 PolarHBondContact O-N 2.89Å; D260-R265 IonicContact OD1-NH1 3.23Å; D260-R265 PolarHBondContact OD1-NH1 3.41Å; D260-R265 IonicContact OD2-NH1 3.64Å
261	T	50.9	Low	52.1	Low	47 Å²	47	89.7 Å²	89.7	29%	0.288	46%	0.456	S	S	.	.			trans	-73.1	-8.6	178.8	47.6	0	0	0	0	112.1	Q259	Q259-T261 HydrophobicContact CB-CG2 3.81Å; Q259-T261 PolarHBondContact O-N 2.89Å; Q259-T261 PolarHBondContact O-OG1 3.49Å
262	H	56.9	Low	50.1	Low	14 Å²	14	92.2 Å²	92.2	7%	0.065	48%	0.478	C	S	.	.	S	Bend	trans	-110.3	107.2	169.7	-56.4	-41.1	0	0	0	108.4	Y50 I253 I254 D260 C264	Y50-H262 HydrophobicContact CE1-CB 4.48Å; Y50-H262 AromaticContact CE2-ND1 3.88Å; Y50-H262 AromaticContact CZ-ND1 3.68Å; Y50-H262 VanDerWaalsContact OH-CG 3.29Å; Y50-H262 PolarHBondContact OH-ND1 3.49Å; I253-H262 HydrophobicContact CD1-CB 3.57Å; I254-H262 PolarHBondContact O-CD2 3.18Å; I254-H262 PolarHBondContact O-NE2 3.36Å; I254-H262 VanDerWaalsContact O-NE2 3.1Å; D260-H262 PolarHBondContact O-N 2.89Å; H262-C264 PolarHBondContact O-N 2.97Å
263	D	61	Low	48.1	Very low	58 Å²	58	98.6 Å²	98.6	31%	0.31	51%	0.512	S	S	.	.			trans	-72.6	44.2	-174.6	-159.8	7.2	0	0	0	112.7	I43 R265	I43-D263 WeakPolarHBondContact CD1-OD2 3.36Å; I43-D263 HydrophobicContact CG2-CB 4.16Å; D263-R265 VanDerWaalsContact C-N 3.34Å
264	C	65.6	Low	46.2	Very low	10 Å²	10	105 Å²	105	7%	0.068	55%	0.546	C	S	.	.			trans	-86.8	-10	-177.7	-68.8	0	0	0	0	112.4	C246 I253 H262	C246-C264 HydrophobicContact CB-CB 3.89Å; C246-C264 PolarHBondContact SG-SG 3.32Å; I253-C264 HydrophobicContact CD1-CB 4.18Å; I253-C264 WeakPolarHBondContact CD1-SG 3.28Å; H262-C264 PolarHBondContact O-N 2.97Å
265	R	58.7	Low	44.4	Very low	150 Å²	150	111.3 Å²	111.3	57%	0.566	58%	0.579	S	S	*	*			trans	-98.3	81.5	172.6	-69.8	179.8	176.9	161.9	-3.6	108.8	D260 D263 E267	D260-R265 IonicContact OD1-NH1 3.23Å; D260-R265 PolarHBondContact OD1-NH1 3.41Å; D260-R265 IonicContact OD2-NH1 3.64Å; D263-R265 VanDerWaalsContact C-N 3.34Å; R265-E267 PolarHBondContact O-N 2.92Å; R265-E267 VanDerWaalsContact O-N 3.17Å
266	V	47	Very low	42.9	Very low	104 Å²	104	117.1 Å²	117.1	63%	0.63	61%	0.611	S	S	*	*			trans	-72.2	107.5	163.5	-177.8	0	0	0	0	106.1	K268	V266-K268 PolarHBondContact O-N 2.87Å
267	E	38	Very low	41.7	Very low	174 Å²	174	117 Å²	117	81%	0.813	63%	0.625	S	S	*	*			trans	-53.7	130	172.9	-76	-175.5	155.1	0	0	109.5	R265 T269	R265-E267 PolarHBondContact O-N 2.92Å; R265-E267 VanDerWaalsContact O-N 3.17Å; E267-T269 VanDerWaalsContact C-N 3.35Å; E267-T269 PolarHBondContact O-N 3.44Å
268	K	30.4	Very low	40.9	Very low	199 Å²	199	114.8 Å²	114.8	87%	0.865	62%	0.621	S	S	*	*			trans	-58.5	103.2	160.4	-77.8	176.6	177.1	173.8	0	106.7	V266 S270	V266-K268 PolarHBondContact O-N 2.87Å; K268-S270 PolarHBondContact O-N 3.45Å
269	T	31.1	Very low	40.2	Very low	129 Å²	129	114.3 Å²	114.3	79%	0.791	62%	0.623	S	S	*	*			trans	-51.8	114.3	161.6	39.6	0	0	0	0	107.5	E267 D271	E267-T269 VanDerWaalsContact C-N 3.35Å; E267-T269 PolarHBondContact O-N 3.44Å; T269-D271 PolarHBondContact O-N 2.82Å
270	S	30.3	Very low	39.7	Very low	104 Å²	104	113.4 Å²	113.4	73%	0.727	63%	0.627	S	S	*	*			trans	-64.5	107.3	-179.7	49.1	0	0	0	0	110.5	K268 V272	K268-S270 PolarHBondContact O-N 3.45Å; S270-V272 PolarHBondContact O-N 3.4Å
271	D	30.2	Very low	38.8	Very low	163 Å²	163	113.6 Å²	113.6	87%	0.872	63%	0.632	S	S	*	*			trans	-78.2	88.9	154	-74.5	-35.6	0	0	0	108.2	T269	T269-D271 PolarHBondContact O-N 2.82Å
272	V	32.9	Very low	37.8	Very low	129 Å²	129	118.8 Å²	118.8	78%	0.782	65%	0.653	S	S	*	*			trans	-129.9	93.1	159.4	-177.3	0	0	0	0	107.7	S270	S270-V272 PolarHBondContact O-N 3.4Å
273	N	32.2	Very low	36.6	Very low	138 Å²	138	125.8 Å²	125.8	74%	0.738	69%	0.686	S	S	*	*			trans	-60.3	156.9	154.2	-79.2	-30.1	0	0	0	110.2
274	D	33.4	Very low	35.2	Very low	138 Å²	138	126.5 Å²	126.5	74%	0.738	71%	0.707	S	S	*	*			trans	94	99.6	153.1	-57	-31.5	0	0	0	119.5
275	L	31	Very low	33.5	Very low	140 Å²	140	134.1 Å²	134.1	73%	0.733	74%	0.741	S	S	*	*				69.9	119.5	123.4	-91.5	80.7	0	0	0	120.4
276	N	32.5	Very low	32.2	Very low	139 Å²	139	133 Å²	133	74%	0.743	75%	0.751	S	S	*	*			trans	80.7	111.9	130.4	-74.9	-3.2	0	0	0	120.4
277	S	28.2	Very low	31.4	Very low	105 Å²	105	133.8 Å²	133.8	73%	0.734	76%	0.756	S	S	*	*				71.5	103	118	176.7	0	0	0	0	118.5
278	S	34.1	Very low	30.9	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	76%	0.758	S	S	*	*				146	104.9	110.9	64.2	0	0	0	0	109.8
279	T	29	Very low	31	Very low	127 Å²	127	124.9 Å²	124.9	78%	0.779	75%	0.749	S	S	*	*				53.8	121.4	102.4	-20.8	0	0	0	0	112.1
280	T	30.2	Very low	30.9	Very low	112 Å²	112	126 Å²	126	69%	0.687	75%	0.749	S	S	*	*				171.8	119	74.3	-47.4	0	0	0	0	105
281	T	30.7	Very low	31	Very low	109 Å²	109	126.3 Å²	126.3	67%	0.669	75%	0.746	S	S	*	*				76.5	133.3	107.5	-44.2	0	0	0	0	112.4
282	E	30.7	Very low	31	Very low	156 Å²	156	126.8 Å²	126.8	73%	0.729	74%	0.743	S	S	*	*			cis	-171.6	160.9	16.9	-129.9	168.9	-179.1	0	0	110.2
283	H	31.7	Very low	30.8	Very low	162 Å²	162	125.7 Å²	125.7	75%	0.75	74%	0.736	S	S	*	*			trans	29.1	142.8	143.5	-71.9	-45.6	0	0	0	122.7
284	G	31.6	Very low	30.7	Very low	73 Å²	73	127.4 Å²	127.4	75%	0.753	74%	0.74	S	S	*	*			cis	-172.5	-177.1	29.2	0	0	0	0	0	115.9
285	E	30.5	Very low	30.4	Very low	170 Å²	170	127.7 Å²	127.7	79%	0.794	75%	0.746	S	S	*	*			trans	-78.2	168.5	-158.5	-58.4	162.9	130.1	0	0	116
286	T	31.1	Very low	30.4	Very low	126 Å²	126	126 Å²	126	77%	0.773	75%	0.746	S	S	*	*				153.7	100.3	122.9	-61.5	0	0	0	0	109.5
287	T	29.9	Very low	30.3	Very low	121 Å²	121	128 Å²	128	74%	0.742	75%	0.751	S	S	*	*				90.7	111.1	84.3	-56.2	0	0	0	0	115.6
288	S	27.8	Very low	30.4	Very low	120 Å²	120	130.7 Å²	130.7	84%	0.839	76%	0.757	S	S	*	*			trans	21.1	143.3	138.9	-59	0	0	0	0	124.9
289	G	31.1	Very low	30	Very low	66 Å²	66	134 Å²	134	68%	0.68	77%	0.766	S	S	*	*			trans	169.5	88.5	154	0	0	0	0	0	111.2
290	I	30.5	Very low	30.2	Very low	153 Å²	153	136.5 Å²	136.5	79%	0.785	77%	0.772	S	S	*	*				48.2	127.1	97.6	-39.6	171.6	0	0	0	111.6
291	T	31	Very low	30.2	Very low	109 Å²	109	140.3 Å²	140.3	67%	0.669	78%	0.778	S	S	*	*			cis	-178.3	131.5	48.4	-21.2	0	0	0	0	106.1
292	E	30.5	Very low	30.2	Very low	173 Å²	173	140.6 Å²	140.6	81%	0.808	78%	0.781	S	S	*	*				80.7	135.7	106.9	-94.1	-171.8	170.5	0	0	120.7
293	V	28.4	Very low	30.4	Very low	107 Å²	107	139.3 Å²	139.3	65%	0.648	78%	0.783	S	S	*	*			trans	103.2	109.1	133.7	167.6	0	0	0	0	121.3
294	Q	30.6	Very low	30.4	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	79%	0.788	S	S	*	*			trans	73	109.7	131.1	-65.3	-175.1	-15.5	0	0	124.7
295	V	26.8	Very low	30.4	Very low	144 Å²	144	145.5 Å²	145.5	87%	0.873	79%	0.793	S	S	*	*				14.2	125.4	122.1	-173.5	0	0	0	0	119.3
296	S	31.1	Very low	30.5	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	79%	0.792	S	S	*	*				-172.2	128	127.7	-174.5	0	0	0	0	111.2
297	E	29.7	Very low	30.7	Very low	181 Å²	181	144.3 Å²	144.3	85%	0.846	79%	0.792	S	S	*	*			trans	-63.4	150.1	160.3	-84.6	174.7	131.6	0	0	111.2
298	N	31.9	Very low	30.8	Very low	162 Å²	162	148.7 Å²	148.7	87%	0.866	80%	0.801	S	S	*	*			trans	-157.1	133.8	146.6	-94	-29.3	0	0	0	112
299	L	26.1	Very low	31.2	Very low	164 Å²	164	151.9 Å²	151.9	86%	0.859	80%	0.803	S	S	*	*			trans	-69.9	146.4	178.1	-168.9	81.4	0	0	0	111.8
300	M	32.6	Very low	31.5	Very low	181 Å²	181	153.2 Å²	153.2	89%	0.892	80%	0.801	S	S	*	*			trans	-141.2	133.5	161.8	-149.2	175	173.4	0	0	112.3
301	K	29.2	Very low	31.8	Very low	191 Å²	191	151.6 Å²	151.6	83%	0.83	80%	0.799	S	S	*	*			trans	-131.2	120.5	-173.8	-158.6	-170.1	-164.4	-171.8	0	107
302	T	31.7	Very low	32.1	Very low	116 Å²	116	153.1 Å²	153.1	71%	0.712	81%	0.808	S	S	*	*			trans	-170.4	141.1	165.9	-15.8	0	0	0	0	105.6
303	T	35	Very low	32.6	Very low	128 Å²	128	153.7 Å²	153.7	79%	0.785	81%	0.808	S	S	*	*			cis	-163.9	149.7	23.9	-41.4	0	0	0	0	108
304	E	31.9	Very low	33.2	Very low	182 Å²	182	151.9 Å²	151.9	85%	0.85	80%	0.797	S	S	*	*			trans	-86.5	169.1	168.1	-83.5	-178.5	144.5	0	0	112.4
305	E	31.1	Very low	33.7	Very low	183 Å²	183	148.2 Å²	148.2	86%	0.855	79%	0.787	S	S	*	*			trans	102.6	89	164.1	-62.6	-165.2	150.8	0	0	117.8
306	T	32.3	Very low	34.5	Very low	126 Å²	126	149.4 Å²	149.4	77%	0.773	78%	0.783	S	S	*	*				-160.6	135.4	127.9	-9	0	0	0	0	111.7
307	D	35.7	Very low	35.3	Very low	145 Å²	145	151.3 Å²	151.3	78%	0.775	78%	0.78	S	S	*	*			trans	86.7	82.1	148.2	-55.5	-28.6	0	0	0	122.4	Q309	D307-Q309 PolarHBondContact O-N 2.97Å
308	K	32.7	Very low	36	Very low	213 Å²	213	147.2 Å²	147.2	93%	0.926	76%	0.764	S	S	*	*			trans	-70.2	85.4	149.1	-73.7	175.2	175.6	171.2	0	111
309	Q	35.3	Very low	36.7	Very low	188 Å²	188	147.2 Å²	147.2	88%	0.879	76%	0.756	S	S	*	*			trans	-154.6	22.2	163.2	-148.3	163.6	-12.6	0	0	117.1	D307	D307-Q309 PolarHBondContact O-N 2.97Å
310	S	37.1	Very low	37.9	Very low	93 Å²	93	145.8 Å²	145.8	65%	0.65	75%	0.745	S	S	*	*			trans	-137.9	35	-172.4	-165.1	0	0	0	0	116.3	T314	S310-T314 PolarHBondContact O-OG1 3.28Å
311	T	36.8	Very low	38.9	Very low	120 Å²	120	143.7 Å²	143.7	74%	0.736	73%	0.733	S	S	*	*			trans	-99.8	-4.3	-168.9	-30.4	0	0	0	0	115.7
312	T	38.3	Very low	40	Very low	141 Å²	141	141.7 Å²	141.7	87%	0.865	72%	0.724	S	S	*	*	S	Bend	trans	-101.6	-17.3	-175.2	15.6	0	0	0	0	115.9
313	K	39.7	Very low	41.3	Very low	184 Å²	184	139.4 Å²	139.4	80%	0.8	71%	0.713	S	S	*	*	S	Bend	trans	-92.3	-19.7	176.9	-82.5	-175.1	174	-178.9	0	114.6	T315	K313-T315 VanDerWaalsContact C-N 3.3Å; K313-T315 PolarHBondContact O-N 3.45Å
314	T	41.2	Very low	42.5	Very low	70 Å²	70	138 Å²	138	43%	0.429	70%	0.697	S	S	.	*	H	α-helix	trans	-75.2	-15.6	-172.2	-27.1	0	0	0	0	113.7	S310 N318	S310-T314 PolarHBondContact O-OG1 3.28Å; T314-N318 WeakPolarHBondContact O-CB 3.12Å; T314-N318 PolarHBondContact O-N 3.02Å
315	T	40.8	Very low	44.2	Very low	96 Å²	96	136.4 Å²	136.4	59%	0.589	68%	0.684	S	S	*	*	H	α-helix	trans	-78.1	-27.7	-172.8	-48.4	0	0	0	0	113.5	K313	K313-T315 VanDerWaalsContact C-N 3.3Å; K313-T315 PolarHBondContact O-N 3.45Å
316	E	44.8	Very low	46	Very low	169 Å²	169	134.5 Å²	134.5	79%	0.79	67%	0.67	S	S	*	*	H	α-helix	trans	-82.5	-41.9	177	-76.4	-168.6	148.9	0	0	112.7	N318 K319 Q320	E316-N318 VanDerWaalsContact C-N 3.29Å; E316-N318 PolarHBondContact O-N 3.36Å; E316-K319 PolarHBondContact O-N 3.39Å; E316-Q320 PolarHBondContact O-N 2.87Å
317	E	46.5	Very low	47.9	Very low	145 Å²	145	133.1 Å²	133.1	68%	0.678	66%	0.657	S	S	*	*	H	α-helix	trans	-63	-35.5	177.2	-71.8	-176.5	158.9	0	0	112.3	K319 Q320 H321	E317-K319 VanDerWaalsContact C-N 3.32Å; E317-K319 PolarHBondContact O-N 2.88Å; E317-Q320 PolarHBondContact O-N 2.94Å; E317-H321 PolarHBondContact O-N 3.08Å
318	N	46	Very low	49.7	Very low	94 Å²	94	132.2 Å²	132.2	50%	0.503	64%	0.644	S	S	.	*	H	α-helix	trans	-72	-24.6	-179.3	-144.4	-16.6	0	0	0	112.8	T314 E316 K322	T314-N318 WeakPolarHBondContact O-CB 3.12Å; T314-N318 PolarHBondContact O-N 3.02Å; E316-N318 VanDerWaalsContact C-N 3.29Å; E316-N318 PolarHBondContact O-N 3.36Å; N318-K322 WeakPolarHBondContact O-CB 3.36Å; N318-K322 PolarHBondContact O-N 3.33Å
319	K	46.7	Very low	51.7	Low	162 Å²	162	124.6 Å²	124.6	70%	0.704	62%	0.615	S	S	*	*	H	α-helix	trans	-72.3	-42	171	-87.2	-177.1	177	177.2	0	111.6	E316 E317 K322 S323	E316-K319 PolarHBondContact O-N 3.39Å; E317-K319 VanDerWaalsContact C-N 3.32Å; E317-K319 PolarHBondContact O-N 2.88Å; K319-K322 PolarHBondContact O-N 3.44Å; K319-S323 PolarHBondContact O-N 3.46Å; K319-S323 VanDerWaalsContact O-N 3.15Å
320	Q	49.5	Very low	53.5	Low	134 Å²	134	117.1 Å²	117.1	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-68.4	-40.6	-179.7	-163.5	173.1	-1.6	0	0	111.6	E316 E317 S323 H324	E316-Q320 PolarHBondContact O-N 2.87Å; E317-Q320 PolarHBondContact O-N 2.94Å; Q320-S323 PolarHBondContact O-N 3.23Å; Q320-H324 PolarHBondContact O-CD2 3.21Å; Q320-H324 PolarHBondContact O-N 3.42Å
321	H	54	Low	55.4	Low	138 Å²	138	117 Å²	117	64%	0.639	57%	0.573	S	S	*	*	H	α-helix	trans	-66.7	-38	176.8	-163.2	-75.8	0	0	0	112.8	E317 W325	E317-H321 PolarHBondContact O-N 3.08Å; H321-W325 WeakPolarHBondContact O-CB 3.43Å; H321-W325 PolarHBondContact O-N 2.97Å
322	K	53	Low	57.6	Low	148 Å²	148	114.6 Å²	114.6	64%	0.643	56%	0.559	S	S	*	*	H	α-helix	trans	-64.2	-40	174.4	-90.7	-177.6	176.3	177.8	0	112.9	N318 K319 W325 Y326	N318-K322 WeakPolarHBondContact O-CB 3.36Å; N318-K322 PolarHBondContact O-N 3.33Å; K319-K322 PolarHBondContact O-N 3.44Å; K322-W325 PolarHBondContact O-N 3.43Å; K322-Y326 PolarHBondContact O-N 2.9Å; K322-Y326 VanDerWaalsContact O-N 3.1Å
323	S	59	Low	59.5	Low	68 Å²	68	110.8 Å²	110.8	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-45.1	179.3	-177.5	0	0	0	0	111.6	K319 Q320 Y326 L327	K319-S323 PolarHBondContact O-N 3.46Å; K319-S323 VanDerWaalsContact O-N 3.15Å; Q320-S323 PolarHBondContact O-N 3.23Å; S323-Y326 PolarHBondContact O-N 3.45Å; S323-L327 WeakPolarHBondContact O-CB 3.26Å; S323-L327 PolarHBondContact O-N 3.36Å; S323-L327 VanDerWaalsContact O-N 3.11Å
324	H	61	Low	61.5	Low	99 Å²	99	105.2 Å²	105.2	46%	0.458	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-41.9	176.9	-83.2	-113.7	0	0	0	112.2	Q320 Y326 L327 Y328	Q320-H324 PolarHBondContact O-CD2 3.21Å; Q320-H324 PolarHBondContact O-N 3.42Å; H324-Y326 VanDerWaalsContact C-N 3.33Å; H324-Y326 PolarHBondContact O-N 3.28Å; H324-L327 PolarHBondContact O-N 3.48Å; H324-Y328 HydrophobicContact CB-CD2 4.28Å; H324-Y328 HydrophobicContact CB-CE2 4.5Å; H324-Y328 AromaticContact ND1-CE2 3.58Å; H324-Y328 WeakPolarHBondContact O-CD2 3.25Å; H324-Y328 PolarHBondContact O-N 2.94Å
325	W	67.1	Low	63.5	Low	149 Å²	149	104.1 Å²	104.1	56%	0.564	51%	0.513	S	S	*	.	H	α-helix	trans	-61	-41.7	177.7	-177.5	75	0	0	0	112.3	H321 K322 V329 V330	H321-W325 WeakPolarHBondContact O-CB 3.43Å; H321-W325 PolarHBondContact O-N 2.97Å; K322-W325 PolarHBondContact O-N 3.43Å; W325-V329 HydrophobicContact CG-CG2 4.46Å; W325-V329 VanDerWaalsContact O-CB 3.23Å; W325-V329 WeakPolarHBondContact O-CB 3.36Å; W325-V329 PolarHBondContact O-N 3.46Å; W325-V330 HydrophobicContact CE3-CG2 4.15Å; W325-V330 HydrophobicContact CH2-CG2 4.1Å; W325-V330 HydrophobicContact CZ3-CG2 3.89Å
326	Y	68.9	Low	65.5	Low	142 Å²	142	101.6 Å²	101.6	56%	0.557	50%	0.499	S	S	*	.	I	π-helix	trans	-64.9	-43.7	177.8	-156	-92.7	0	0	0	112.1	K322 S323 H324 V330 I331	K322-Y326 PolarHBondContact O-N 2.9Å; K322-Y326 VanDerWaalsContact O-N 3.1Å; S323-Y326 PolarHBondContact O-N 3.45Å; H324-Y326 VanDerWaalsContact C-N 3.33Å; H324-Y326 PolarHBondContact O-N 3.28Å; Y326-V330 HydrophobicContact CD2-CB 4.11Å; Y326-V330 HydrophobicContact CD2-CG1 4.3Å; Y326-V330 HydrophobicContact CD2-CG2 3.9Å; Y326-V330 HydrophobicContact CE2-CB 4.28Å; Y326-V330 HydrophobicContact CE2-CG1 3.96Å; Y326-V330 HydrophobicContact CE2-CG2 4.3Å; Y326-V330 HydrophobicContact CG-CB 4.27Å; Y326-V330 HydrophobicContact CG-CG2 4.35Å; Y326-V330 WeakPolarHBondContact O-CB 3.32Å; Y326-V330 PolarHBondContact O-N 3.29Å; Y326-I331 PolarHBondContact O-N 3.5Å
327	L	72.2	Confident	67.3	Low	98 Å²	98	97.4 Å²	97.4	51%	0.513	48%	0.482	S	S	.	.	I	π-helix	trans	-72.8	-37	-173.8	-146.1	142.1	0	0	0	112.7	S323 H324 I331	S323-L327 WeakPolarHBondContact O-CB 3.26Å; S323-L327 PolarHBondContact O-N 3.36Å; S323-L327 VanDerWaalsContact O-N 3.11Å; H324-L327 PolarHBondContact O-N 3.48Å; L327-I331 HydrophobicContact CG-CD1 4.25Å
328	Y	73.9	Confident	69.1	Low	126 Å²	126	96.8 Å²	96.8	49%	0.494	48%	0.477	S	S	.	.	I	π-helix	trans	-98.7	-19.1	-176.4	-65.6	-72.8	0	0	0	115	H324 P332	H324-Y328 HydrophobicContact CB-CD2 4.28Å; H324-Y328 HydrophobicContact CB-CE2 4.5Å; H324-Y328 AromaticContact ND1-CE2 3.58Å; H324-Y328 WeakPolarHBondContact O-CD2 3.25Å; H324-Y328 PolarHBondContact O-N 2.94Å; Y328-P332 WeakPolarHBondContact O-CG 3.5Å
329	V	72.9	Confident	70.9	Confident	53 Å²	53	98.2 Å²	98.2	32%	0.321	48%	0.484	S	S	.	.	I	π-helix	trans	-110.8	-52.5	-178.9	-173.6	0	0	0	0	111.3	W325 L333	W325-V329 HydrophobicContact CG-CG2 4.46Å; W325-V329 VanDerWaalsContact O-CB 3.23Å; W325-V329 WeakPolarHBondContact O-CB 3.36Å; W325-V329 PolarHBondContact O-N 3.46Å; V329-L333 HydrophobicContact CG1-CD1 4.26Å; V329-L333 WeakPolarHBondContact O-CB 3.28Å; V329-L333 PolarHBondContact O-N 2.98Å
330	V	73.4	Confident	72.8	Confident	31 Å²	31	92.6 Å²	92.6	19%	0.188	46%	0.461	C	S	.	.	I	π-helix	trans	-71.9	-45.8	-171.8	-177.8	0	0	0	0	111.5	W325 Y326 L333 V334	W325-V330 HydrophobicContact CE3-CG2 4.15Å; W325-V330 HydrophobicContact CH2-CG2 4.1Å; W325-V330 HydrophobicContact CZ3-CG2 3.89Å; Y326-V330 HydrophobicContact CD2-CB 4.11Å; Y326-V330 HydrophobicContact CD2-CG1 4.3Å; Y326-V330 HydrophobicContact CD2-CG2 3.9Å; Y326-V330 HydrophobicContact CE2-CB 4.28Å; Y326-V330 HydrophobicContact CE2-CG1 3.96Å; Y326-V330 HydrophobicContact CE2-CG2 4.3Å; Y326-V330 HydrophobicContact CG-CB 4.27Å; Y326-V330 HydrophobicContact CG-CG2 4.35Å; Y326-V330 WeakPolarHBondContact O-CB 3.32Å; Y326-V330 PolarHBondContact O-N 3.29Å; V330-L333 WeakPolarHBondContact O-CB 3.45Å; V330-L333 PolarHBondContact O-N 3.43Å; V330-V334 HydrophobicContact CG1-CG2 4.22Å; V330-V334 VanDerWaalsContact O-CG2 3.32Å; V330-V334 WeakPolarHBondContact O-CG2 3.3Å; V330-V334 PolarHBondContact O-N 3.28Å
331	I	78	Confident	74.5	Confident	90 Å²	90	89.6 Å²	89.6	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-61.7	-48.9	-178.3	-62.3	175.4	0	0	0	112	Y326 L327 L333 V334 A335	Y326-I331 PolarHBondContact O-N 3.5Å; L327-I331 HydrophobicContact CG-CD1 4.25Å; I331-L333 VanDerWaalsContact C-N 3.32Å; I331-L333 PolarHBondContact O-N 2.93Å; I331-V334 PolarHBondContact O-N 2.94Å; I331-A335 WeakPolarHBondContact O-CB 3.39Å; I331-A335 PolarHBondContact O-N 3.32Å
332	P	81.7	Confident	76	Confident	69 Å²	69	87.2 Å²	87.2	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-35.2	176.8	-25.3	37.2	0	0	0	113.4	Y328 A335 S336	Y328-P332 WeakPolarHBondContact O-CG 3.5Å; P332-A335 PolarHBondContact O-N 3.35Å; P332-S336 WeakPolarHBondContact O-CB 3.42Å; P332-S336 PolarHBondContact O-N 3.21Å
333	L	79.5	Confident	77.6	Confident	61 Å²	61	82.1 Å²	82.1	32%	0.319	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-50.3	175.9	-116.5	155.2	0	0	0	111.4	L9 V329 V330 I331 A335 S336 L337	L9-L333 HydrophobicContact CD2-CD1 4.01Å; L9-L333 HydrophobicContact CD2-CD2 4.01Å; L9-L333 HydrophobicContact CD2-CG 3.83Å; V329-L333 HydrophobicContact CG1-CD1 4.26Å; V329-L333 WeakPolarHBondContact O-CB 3.28Å; V329-L333 PolarHBondContact O-N 2.98Å; V330-L333 WeakPolarHBondContact O-CB 3.45Å; V330-L333 PolarHBondContact O-N 3.43Å; I331-L333 VanDerWaalsContact C-N 3.32Å; I331-L333 PolarHBondContact O-N 2.93Å; L333-A335 PolarHBondContact O-N 3.4Å; L333-S336 PolarHBondContact O-N 3.32Å; L333-S336 PolarHBondContact O-OG 3.34Å; L333-L337 WeakPolarHBondContact O-CG 3.4Å; L333-L337 PolarHBondContact O-N 3.04Å
334	V	81.7	Confident	78.9	Confident	67 Å²	67	81.2 Å²	81.2	41%	0.406	43%	0.428	S	S	.	.	H	α-helix	trans	-62.5	-44.5	178.8	173.9	0	0	0	0	110.4	V330 I331 S336 L337 F338	V330-V334 HydrophobicContact CG1-CG2 4.22Å; V330-V334 VanDerWaalsContact O-CG2 3.32Å; V330-V334 WeakPolarHBondContact O-CG2 3.3Å; V330-V334 PolarHBondContact O-N 3.28Å; I331-V334 PolarHBondContact O-N 2.94Å; V334-S336 VanDerWaalsContact C-N 3.33Å; V334-S336 PolarHBondContact O-N 3.18Å; V334-L337 PolarHBondContact O-N 3.19Å; V334-F338 HydrophobicContact CG1-CD2 3.72Å; V334-F338 HydrophobicContact CG1-CE2 3.49Å; V334-F338 VanDerWaalsContact CG1-CE2 3.49Å; V334-F338 WeakPolarHBondContact O-CD2 3.26Å; V334-F338 PolarHBondContact O-N 2.74Å
335	A	81.9	Confident	80	Confident	47 Å²	47	82.1 Å²	82.1	39%	0.388	44%	0.435	S	S	.	.	H	α-helix	trans	-60.2	-41	175.4	0	0	0	0	0	112.4	I331 P332 L333 L337 F338 L339	I331-A335 WeakPolarHBondContact O-CB 3.39Å; I331-A335 PolarHBondContact O-N 3.32Å; P332-A335 PolarHBondContact O-N 3.35Å; L333-A335 PolarHBondContact O-N 3.4Å; A335-L337 PolarHBondContact O-N 3.02Å; A335-F338 PolarHBondContact O-N 2.94Å; A335-L339 WeakPolarHBondContact O-CG 3.49Å; A335-L339 PolarHBondContact O-N 3Å
336	S	82.7	Confident	80.8	Confident	43 Å²	43	79.4 Å²	79.4	30%	0.301	43%	0.43	S	S	.	.	H	α-helix	trans	-64.1	-40.1	176.7	81.1	0	0	0	0	112.3	P332 L333 V334 L339 I340	P332-S336 WeakPolarHBondContact O-CB 3.42Å; P332-S336 PolarHBondContact O-N 3.21Å; L333-S336 PolarHBondContact O-N 3.32Å; L333-S336 PolarHBondContact O-OG 3.34Å; V334-S336 VanDerWaalsContact C-N 3.33Å; V334-S336 PolarHBondContact O-N 3.18Å; S336-L339 PolarHBondContact O-N 3.22Å; S336-I340 VanDerWaalsContact O-CG1 3.28Å; S336-I340 WeakPolarHBondContact O-CG1 3.39Å; S336-I340 PolarHBondContact O-N 3.5Å
337	L	84.2	Confident	81.5	Confident	81 Å²	81	80.9 Å²	80.9	42%	0.424	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-40.7	176.5	-72.5	169.3	0	0	0	111.3	L333 V334 A335 I340 C341	L333-L337 WeakPolarHBondContact O-CG 3.4Å; L333-L337 PolarHBondContact O-N 3.04Å; V334-L337 PolarHBondContact O-N 3.19Å; A335-L337 PolarHBondContact O-N 3.02Å; L337-I340 PolarHBondContact O-N 3.24Å; L337-C341 WeakPolarHBondContact O-CB 3.19Å; L337-C341 PolarHBondContact O-N 3.01Å; L337-C341 PolarHBondContact O-SG 3.19Å
338	F	82.9	Confident	82	Confident	132 Å²	132	84.4 Å²	84.4	58%	0.579	44%	0.442	S	S	*	.	H	α-helix	trans	-62.7	-43.6	174.7	-83.7	-70.6	0	0	0	112.2	V334 A335 C341 I342	V334-F338 HydrophobicContact CG1-CD2 3.72Å; V334-F338 HydrophobicContact CG1-CE2 3.49Å; V334-F338 VanDerWaalsContact CG1-CE2 3.49Å; V334-F338 WeakPolarHBondContact O-CD2 3.26Å; V334-F338 PolarHBondContact O-N 2.74Å; A335-F338 PolarHBondContact O-N 2.94Å; F338-C341 PolarHBondContact O-N 3.3Å; F338-I342 VanDerWaalsContact O-CG1 3.26Å; F338-I342 WeakPolarHBondContact O-CG1 3.4Å; F338-I342 PolarHBondContact O-N 3.49Å
339	L	85.4	Confident	82.3	Confident	124 Å²	124	85.9 Å²	85.9	65%	0.649	45%	0.446	S	S	*	.	H	α-helix	trans	-64.1	-41	177.4	-70.7	173.5	0	0	0	112.3	A335 S336 I342 G343	A335-L339 WeakPolarHBondContact O-CG 3.49Å; A335-L339 PolarHBondContact O-N 3Å; S336-L339 PolarHBondContact O-N 3.22Å; L339-I342 PolarHBondContact O-N 3.46Å; L339-G343 PolarHBondContact O-N 2.87Å
340	I	85.8	Confident	82.7	Confident	44 Å²	44	87.8 Å²	87.8	23%	0.226	45%	0.454	C	S	.	.	H	α-helix	trans	-63.3	-45	175.2	-67.6	165.6	0	0	0	110.5	F17 S336 L337 I342 G343 C344	F17-I340 HydrophobicContact CE2-CD1 4.48Å; S336-I340 VanDerWaalsContact O-CG1 3.28Å; S336-I340 WeakPolarHBondContact O-CG1 3.39Å; S336-I340 PolarHBondContact O-N 3.5Å; L337-I340 PolarHBondContact O-N 3.24Å; I340-I342 PolarHBondContact O-N 3.41Å; I340-G343 PolarHBondContact O-N 3.33Å; I340-C344 PolarHBondContact O-N 3.27Å; I340-C344 PolarHBondContact O-SG 2.98Å; I340-C344 VanDerWaalsContact O-SG 3.36Å
341	C	84.3	Confident	82.8	Confident	72 Å²	72	91 Å²	91	49%	0.486	47%	0.469	S	S	.	.	H	α-helix	trans	-60	-44.5	176.8	-76.1	0	0	0	0	112.2	L337 F338 C344 I345	L337-C341 WeakPolarHBondContact O-CB 3.19Å; L337-C341 PolarHBondContact O-N 3.01Å; L337-C341 PolarHBondContact O-SG 3.19Å; F338-C341 PolarHBondContact O-N 3.3Å; C341-C344 PolarHBondContact O-N 3.4Å; C341-I345 VanDerWaalsContact O-CG1 3.26Å; C341-I345 WeakPolarHBondContact O-CG1 3.4Å; C341-I345 PolarHBondContact O-N 3.23Å
342	I	87	Confident	82.7	Confident	88 Å²	88	96.2 Å²	96.2	45%	0.451	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-45.4	175.9	-67.5	163.7	0	0	0	110.2	F338 L339 I340 C344 I345 I346	F338-I342 VanDerWaalsContact O-CG1 3.26Å; F338-I342 WeakPolarHBondContact O-CG1 3.4Å; F338-I342 PolarHBondContact O-N 3.49Å; L339-I342 PolarHBondContact O-N 3.46Å; I340-I342 PolarHBondContact O-N 3.41Å; I342-C344 PolarHBondContact O-N 2.93Å; I342-I345 PolarHBondContact O-N 3.3Å; I342-I346 HydrophobicContact CG2-CD1 3.7Å; I342-I346 HydrophobicContact CG2-CG1 4.37Å; I342-I346 VanDerWaalsContact O-CG1 3.32Å; I342-I346 WeakPolarHBondContact O-CG1 3.32Å; I342-I346 PolarHBondContact O-N 2.97Å
343	G	86.3	Confident	82.3	Confident	40 Å²	40	99.8 Å²	99.8	41%	0.412	49%	0.488	S	S	.	.	H	α-helix	trans	-58.1	-44.8	175.4	0	0	0	0	0	112.9	L339 I340 I345 I346 W347	L339-G343 PolarHBondContact O-N 2.87Å; I340-G343 PolarHBondContact O-N 3.33Å; G343-I345 PolarHBondContact O-N 3.36Å; G343-I346 PolarHBondContact O-N 3.28Å; G343-W347 VanDerWaalsContact O-CB 3.3Å; G343-W347 WeakPolarHBondContact O-CB 3.46Å; G343-W347 PolarHBondContact O-N 3.46Å
344	C	85.2	Confident	81.9	Confident	50 Å²	50	104.1 Å²	104.1	34%	0.338	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-37.4	176.3	-70.6	0	0	0	0	112.9	I340 C341 I342 R348	I340-C344 PolarHBondContact O-N 3.27Å; I340-C344 PolarHBondContact O-SG 2.98Å; I340-C344 VanDerWaalsContact O-SG 3.36Å; C341-C344 PolarHBondContact O-N 3.4Å; I342-C344 PolarHBondContact O-N 2.93Å; C344-R348 WeakPolarHBondContact O-CB 3.46Å; C344-R348 WeakPolarHBondContact O-CG 3.43Å; C344-R348 PolarHBondContact O-N 3.19Å
345	I	84.6	Confident	81.1	Confident	118 Å²	118	111 Å²	111	61%	0.605	52%	0.523	S	S	*	.	H	α-helix	trans	-67.3	-46.7	176.9	-68.8	165.7	0	0	0	110.2	C341 I342 G343 W347 R348 W349	C341-I345 VanDerWaalsContact O-CG1 3.26Å; C341-I345 WeakPolarHBondContact O-CG1 3.4Å; C341-I345 PolarHBondContact O-N 3.23Å; I342-I345 PolarHBondContact O-N 3.3Å; G343-I345 PolarHBondContact O-N 3.36Å; I345-W347 PolarHBondContact O-N 3.07Å; I345-R348 PolarHBondContact O-N 3.11Å; I345-W349 WeakPolarHBondContact O-CB 3.23Å; I345-W349 PolarHBondContact O-N 3.23Å
346	I	85	Confident	80.4	Confident	91 Å²	91	113.1 Å²	113.1	47%	0.467	54%	0.535	S	S	.	.	H	α-helix	trans	-61.5	-45	177.2	-65.6	168	0	0	0	110.3	I342 G343 R348 W349 L350	I342-I346 HydrophobicContact CG2-CD1 3.7Å; I342-I346 HydrophobicContact CG2-CG1 4.37Å; I342-I346 VanDerWaalsContact O-CG1 3.32Å; I342-I346 WeakPolarHBondContact O-CG1 3.32Å; I342-I346 PolarHBondContact O-N 2.97Å; G343-I346 PolarHBondContact O-N 3.28Å; I346-R348 PolarHBondContact O-N 3.4Å; I346-W349 WeakPolarHBondContact O-CB 3.22Å; I346-W349 PolarHBondContact O-N 3.1Å; I346-L350 HydrophobicContact CG2-CD1 4.05Å; I346-L350 HydrophobicContact CG2-CG 4.43Å; I346-L350 WeakPolarHBondContact O-CG 3.48Å; I346-L350 PolarHBondContact O-N 3.39Å
347	W	82.3	Confident	79.2	Confident	174 Å²	174	117.7 Å²	117.7	66%	0.659	56%	0.556	S	S	*	*	H	α-helix	trans	-60.4	-46.4	177.3	-177.1	-87.4	0	0	0	112.3	G343 I345 W349 L350 L351	G343-W347 VanDerWaalsContact O-CB 3.3Å; G343-W347 WeakPolarHBondContact O-CB 3.46Å; G343-W347 PolarHBondContact O-N 3.46Å; I345-W347 PolarHBondContact O-N 3.07Å; W347-W349 VanDerWaalsContact C-N 3.29Å; W347-W349 PolarHBondContact O-N 3.31Å; W347-L350 PolarHBondContact O-N 3.02Å; W347-L351 VanDerWaalsContact CD1-CD1 3.49Å; W347-L351 PolarHBondContact O-N 3.39Å
348	R	82.5	Confident	77.6	Confident	172 Å²	172	123.9 Å²	123.9	65%	0.649	58%	0.583	S	S	*	*	H	α-helix	trans	-61.6	-37.9	174.9	-81.6	-175.9	173	-174.7	0.1	112.2	C344 I345 I346 R352	C344-R348 WeakPolarHBondContact O-CB 3.46Å; C344-R348 WeakPolarHBondContact O-CG 3.43Å; C344-R348 PolarHBondContact O-N 3.19Å; I345-R348 PolarHBondContact O-N 3.11Å; I346-R348 PolarHBondContact O-N 3.4Å; R348-R352 WeakPolarHBondContact O-CG 3.34Å; R348-R352 PolarHBondContact O-N 3.36Å
349	W	81.2	Confident	77.3	Confident	157 Å²	157	123.5 Å²	123.5	60%	0.595	58%	0.583	S	S	*	*	H	α-helix	trans	-67.1	-43.2	177.4	-170.9	78	0	0	0	111.7	I345 I346 W347 R352 R353	I345-W349 WeakPolarHBondContact O-CB 3.23Å; I345-W349 PolarHBondContact O-N 3.23Å; I346-W349 WeakPolarHBondContact O-CB 3.22Å; I346-W349 PolarHBondContact O-N 3.1Å; W347-W349 VanDerWaalsContact C-N 3.29Å; W347-W349 PolarHBondContact O-N 3.31Å; W349-R352 PolarHBondContact O-N 3.15Å; W349-R353 PolarHBondContact O-N 3.26Å
350	L	80.8	Confident	76.9	Confident	93 Å²	93	123.4 Å²	123.4	49%	0.487	58%	0.58	S	S	.	*	H	α-helix	trans	-64	-42.2	175.3	-71.4	172.4	0	0	0	112.5	I346 W347 R352 R353 K354	I346-L350 HydrophobicContact CG2-CD1 4.05Å; I346-L350 HydrophobicContact CG2-CG 4.43Å; I346-L350 WeakPolarHBondContact O-CG 3.48Å; I346-L350 PolarHBondContact O-N 3.39Å; W347-L350 PolarHBondContact O-N 3.02Å; L350-R352 PolarHBondContact O-N 3.49Å; L350-R353 PolarHBondContact O-N 3.34Å; L350-K354 PolarHBondContact O-N 3.38Å
351	L	76.1	Confident	76.4	Confident	97 Å²	97	127.8 Å²	127.8	51%	0.508	60%	0.599	S	S	.	*	H	α-helix	trans	-61.8	-41.2	174.9	-82.8	173.3	0	0	0	112.3	W347 K354 R355	W347-L351 VanDerWaalsContact CD1-CD1 3.49Å; W347-L351 PolarHBondContact O-N 3.39Å; L351-K354 PolarHBondContact O-N 3.29Å; L351-R355 PolarHBondContact O-N 3.41Å
352	R	76.1	Confident	75.9	Confident	200 Å²	200	131.1 Å²	131.1	76%	0.755	61%	0.606	S	S	*	*	H	α-helix	trans	-64.6	-39.3	174.6	-78.4	-173.5	-172.5	-175.4	2.4	112	R348 W349 L350 R355 S356	R348-R352 WeakPolarHBondContact O-CG 3.34Å; R348-R352 PolarHBondContact O-N 3.36Å; W349-R352 PolarHBondContact O-N 3.15Å; L350-R352 PolarHBondContact O-N 3.49Å; R352-R355 PolarHBondContact O-N 3.36Å; R352-S356 PolarHBondContact O-N 3.23Å
353	R	73.6	Confident	75.2	Confident	145 Å²	145	133.8 Å²	133.8	55%	0.547	62%	0.616	S	S	.	*	H	α-helix	trans	-66.6	-39.6	178.6	-165.9	175.1	-176.2	176.4	0.2	112.1	W349 L350 R355 S356	W349-R353 PolarHBondContact O-N 3.26Å; L350-R353 PolarHBondContact O-N 3.34Å; R353-R355 VanDerWaalsContact C-N 3.3Å; R353-R355 PolarHBondContact O-N 3.22Å; R353-S356 PolarHBondContact O-N 3.19Å
354	K	70.8	Confident	74.5	Confident	152 Å²	152	140.1 Å²	140.1	66%	0.661	63%	0.629	S	S	*	*	H	α-helix	trans	-62.7	-38.1	176.3	-162.8	175.8	-179.6	-177	0	111.8	L350 L351 S356 N357	L350-K354 PolarHBondContact O-N 3.38Å; L351-K354 PolarHBondContact O-N 3.29Å; K354-S356 VanDerWaalsContact C-N 3.27Å; K354-S356 PolarHBondContact O-N 3.31Å; K354-N357 PolarHBondContact O-N 3.03Å
355	R	65.6	Low	73.7	Confident	210 Å²	210	146.5 Å²	146.5	79%	0.792	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-7	177.6	-153.5	-176.1	-78.4	-175.7	-7.4	114.6	L351 R352 R353	L351-R355 PolarHBondContact O-N 3.41Å; R352-R355 PolarHBondContact O-N 3.36Å; R353-R355 VanDerWaalsContact C-N 3.3Å; R353-R355 PolarHBondContact O-N 3.22Å
356	S	65.3	Low	72.9	Confident	93 Å²	93	148.7 Å²	148.7	65%	0.65	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-8	175	-175.8	0	0	0	0	112.9	R352 R353 K354	R352-S356 PolarHBondContact O-N 3.23Å; R353-S356 PolarHBondContact O-N 3.19Å; K354-S356 VanDerWaalsContact C-N 3.27Å; K354-S356 PolarHBondContact O-N 3.31Å
357	N	59	Low	71.9	Confident	138 Å²	138	153.5 Å²	153.5	74%	0.738	67%	0.669	S	S	*	*			trans	-108.3	1.8	-179.9	-77.3	2.1	0	0	0	112.7	K354	K354-N357 PolarHBondContact O-N 3.03Å
358	E	49.6	Very low	71	Confident	211 Å²	211	151.6 Å²	151.6	99%	0.986	67%	0.67	S	S	*	*			trans	-108.2	0	161.8	-74.9	172.7	179.8	0	0	107.3

Retrieved 358 of 358 residues in 291.7 ms (Link to these results)

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