A0AA82N7S2_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7S2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 361 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	47.8	Very low	170 Å²	170	134.5 Å²	134.5	84%	0.837	66%	0.658	S	S	*	*				0	107.4	0	-98.3	170.3	166.2	0	0	107.1	Y3	M1-Y3 PolarHBondContact O-N 3Å
2	R	39.4	Very low	49.1	Very low	244 Å²	244	129.8 Å²	129.8	92%	0.921	64%	0.642	S	S	*	*			trans	-68.3	116.6	169.8	-78.8	175.4	163	177.6	-6.5	107	N4	R2-N4 PolarHBondContact O-N 2.75Å
3	Y	46	Very low	50.3	Low	159 Å²	159	126 Å²	126	62%	0.624	63%	0.631	S	S	*	*			trans	-73.4	105.8	170.6	-90.8	-90.6	0	0	0	107.8	M1 L5	M1-Y3 PolarHBondContact O-N 3Å; Y3-L5 PolarHBondContact O-N 3.01Å; Y3-L5 VanDerWaalsContact O-N 3.14Å
4	N	43.2	Very low	51.3	Low	149 Å²	149	129 Å²	129	80%	0.797	63%	0.633	S	S	*	*			trans	-69.9	100.6	162.2	-74	-29.3	0	0	0	106.6	R2 L6	R2-N4 PolarHBondContact O-N 2.75Å; N4-L6 PolarHBondContact O-N 3.47Å
5	L	45.3	Very low	51.9	Low	151 Å²	151	124.5 Å²	124.5	79%	0.791	62%	0.619	S	S	*	*			trans	-54.9	121.8	160.1	-106.4	109.8	0	0	0	106.9	Y3 F7	Y3-L5 PolarHBondContact O-N 3.01Å; Y3-L5 VanDerWaalsContact O-N 3.14Å; L5-F7 PolarHBondContact O-N 3.04Å
6	L	48.7	Very low	52.6	Low	138 Å²	138	123.1 Å²	123.1	72%	0.723	61%	0.613	S	S	*	*			trans	-50.9	107.4	175.4	-85.5	144.4	0	0	0	109	N4 G8 Q9	N4-L6 PolarHBondContact O-N 3.47Å; L6-G8 PolarHBondContact O-N 2.87Å; L6-Q9 PolarHBondContact O-N 2.74Å
7	F	50	Low	53.2	Low	164 Å²	164	121.6 Å²	121.6	72%	0.719	61%	0.606	S	S	*	*	H	α-helix	trans	-49.4	-30.5	-177.7	-156.8	-103.2	0	0	0	112.1	L5 S10 I11	L5-F7 PolarHBondContact O-N 3.04Å; F7-S10 PolarHBondContact O-OG 3.46Å; F7-I11 HydrophobicContact CD1-CD1 3.53Å; F7-I11 HydrophobicContact CD1-CG1 4.41Å; F7-I11 HydrophobicContact CE1-CD1 3.78Å; F7-I11 HydrophobicContact CG-CD1 4.48Å; F7-I11 VanDerWaalsContact O-CD1 3.32Å; F7-I11 WeakPolarHBondContact O-CD1 3.26Å; F7-I11 VanDerWaalsContact O-CG1 3.24Å; F7-I11 WeakPolarHBondContact O-CG1 3.19Å; F7-I11 PolarHBondContact O-N 2.85Å
8	G	51.4	Low	53.4	Low	47 Å²	47	121.8 Å²	121.8	49%	0.485	60%	0.603	S	S	.	*	H	α-helix	trans	-69.1	-29.4	177.5	0	0	0	0	0	116.1	L6 T12	L6-G8 PolarHBondContact O-N 2.87Å; G8-T12 PolarHBondContact O-N 2.64Å; G8-T12 PolarHBondContact O-OG1 2.89Å
9	Q	50	Low	53.5	Low	133 Å²	133	121.3 Å²	121.3	62%	0.621	60%	0.6	S	S	*	*	H	α-helix	trans	-83.2	-28.2	179.1	-71.7	-155.2	-12.2	0	0	113	L6 T12 V13	L6-Q9 PolarHBondContact O-N 2.74Å; Q9-T12 PolarHBondContact O-OG1 3.05Å; Q9-T12 VanDerWaalsContact O-OG1 3.09Å; Q9-V13 WeakPolarHBondContact O-CG2 3.4Å; Q9-V13 PolarHBondContact O-N 2.57Å
10	S	52.8	Low	53.7	Low	41 Å²	41	119.5 Å²	119.5	29%	0.287	59%	0.592	S	S	.	*	H	α-helix	trans	-69.7	-41.3	171.9	81	0	0	0	0	110.3	F7 T12 V13 Y14	F7-S10 PolarHBondContact O-OG 3.46Å; S10-T12 VanDerWaalsContact C-N 3.33Å; S10-T12 PolarHBondContact O-N 3.28Å; S10-V13 PolarHBondContact O-N 3.43Å; S10-Y14 WeakPolarHBondContact O-CB 3.42Å; S10-Y14 WeakPolarHBondContact O-CD2 3.34Å; S10-Y14 PolarHBondContact O-N 2.91Å
11	I	60.1	Low	53.7	Low	84 Å²	84	116.7 Å²	116.7	43%	0.431	58%	0.584	S	S	.	*	H	α-helix	trans	-57.9	-43.3	179.8	-69.2	164.1	0	0	0	111.6	F7 S15	F7-I11 HydrophobicContact CD1-CD1 3.53Å; F7-I11 HydrophobicContact CD1-CG1 4.41Å; F7-I11 HydrophobicContact CE1-CD1 3.78Å; F7-I11 HydrophobicContact CG-CD1 4.48Å; F7-I11 VanDerWaalsContact O-CD1 3.32Å; F7-I11 WeakPolarHBondContact O-CD1 3.26Å; F7-I11 VanDerWaalsContact O-CG1 3.24Å; F7-I11 WeakPolarHBondContact O-CG1 3.19Å; F7-I11 PolarHBondContact O-N 2.85Å; I11-S15 WeakPolarHBondContact O-CB 3.43Å; I11-S15 PolarHBondContact O-N 2.8Å; I11-S15 PolarHBondContact O-OG 3.04Å
12	T	63.5	Low	54.3	Low	77 Å²	77	117.2 Å²	117.2	47%	0.472	58%	0.577	S	S	.	*	H	α-helix	trans	-68.8	-42.4	-179.8	47.7	0	0	0	0	112.2	G8 Q9 S10 S15 I16	G8-T12 PolarHBondContact O-N 2.64Å; G8-T12 PolarHBondContact O-OG1 2.89Å; Q9-T12 PolarHBondContact O-OG1 3.05Å; Q9-T12 VanDerWaalsContact O-OG1 3.09Å; S10-T12 VanDerWaalsContact C-N 3.33Å; S10-T12 PolarHBondContact O-N 3.28Å; T12-S15 PolarHBondContact O-N 2.66Å; T12-I16 WeakPolarHBondContact O-CD1 3.41Å; T12-I16 VanDerWaalsContact O-CG1 3.25Å; T12-I16 WeakPolarHBondContact O-CG1 2.98Å; T12-I16 PolarHBondContact O-N 2.93Å
13	V	64.3	Low	54.7	Low	81 Å²	81	113.8 Å²	113.8	49%	0.491	57%	0.569	S	S	.	*	H	α-helix	trans	-64.6	-46.2	176.7	175.3	0	0	0	0	111.1	Q9 S10 S15 I16 I17	Q9-V13 WeakPolarHBondContact O-CG2 3.4Å; Q9-V13 PolarHBondContact O-N 2.57Å; S10-V13 PolarHBondContact O-N 3.43Å; V13-S15 VanDerWaalsContact C-N 3.31Å; V13-S15 PolarHBondContact O-N 3.01Å; V13-I16 PolarHBondContact O-N 2.92Å; V13-I17 HydrophobicContact CG1-CD1 3.73Å; V13-I17 HydrophobicContact CG1-CG1 4.41Å; V13-I17 VanDerWaalsContact O-CG1 3.32Å; V13-I17 WeakPolarHBondContact O-CG1 3.38Å; V13-I17 PolarHBondContact O-N 3.49Å
14	Y	65.1	Low	55	Low	168 Å²	168	112.1 Å²	112.1	66%	0.659	57%	0.57	S	S	*	*	H	α-helix	trans	-62.3	-39.3	176.1	-81.2	-66.4	0	0	0	111.9	S10 I17 F18	S10-Y14 WeakPolarHBondContact O-CB 3.42Å; S10-Y14 WeakPolarHBondContact O-CD2 3.34Å; S10-Y14 PolarHBondContact O-N 2.91Å; Y14-I17 PolarHBondContact O-N 3.08Å; Y14-F18 WeakPolarHBondContact O-CB 3.45Å; Y14-F18 PolarHBondContact O-N 3Å
15	S	59.2	Low	55.8	Low	61 Å²	61	111.6 Å²	111.6	43%	0.427	56%	0.56	S	S	.	*	H	α-helix	trans	-65.2	-41	177.4	-61.9	0	0	0	0	111.8	I11 T12 V13 M19	I11-S15 WeakPolarHBondContact O-CB 3.43Å; I11-S15 PolarHBondContact O-N 2.8Å; I11-S15 PolarHBondContact O-OG 3.04Å; T12-S15 PolarHBondContact O-N 2.66Å; V13-S15 VanDerWaalsContact C-N 3.31Å; V13-S15 PolarHBondContact O-N 3.01Å; S15-M19 WeakPolarHBondContact O-CB 3.33Å; S15-M19 WeakPolarHBondContact O-CG 3.48Å; S15-M19 PolarHBondContact O-N 3.08Å
16	I	64.3	Low	57.1	Low	102 Å²	102	108.5 Å²	108.5	52%	0.523	55%	0.551	S	S	.	*	H	α-helix	trans	-67	-46.2	176.3	-67.8	164.3	0	0	0	110.6	T12 V13 F18 M19 I20	T12-I16 WeakPolarHBondContact O-CD1 3.41Å; T12-I16 VanDerWaalsContact O-CG1 3.25Å; T12-I16 WeakPolarHBondContact O-CG1 2.98Å; T12-I16 PolarHBondContact O-N 2.93Å; V13-I16 PolarHBondContact O-N 2.92Å; I16-F18 VanDerWaalsContact C-N 3.35Å; I16-F18 PolarHBondContact O-N 3.15Å; I16-M19 PolarHBondContact O-N 2.78Å; I16-I20 HydrophobicContact CG2-CD1 3.67Å; I16-I20 HydrophobicContact CG2-CG1 4.4Å; I16-I20 WeakPolarHBondContact O-CB 3.32Å; I16-I20 VanDerWaalsContact O-CG1 3.24Å; I16-I20 WeakPolarHBondContact O-CG1 3.45Å; I16-I20 PolarHBondContact O-N 2.91Å
17	I	61.7	Low	58.7	Low	98 Å²	98	104.4 Å²	104.4	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-42.9	177.7	-67.1	169.7	0	0	0	110.8	V13 Y14 I20 S21	V13-I17 HydrophobicContact CG1-CD1 3.73Å; V13-I17 HydrophobicContact CG1-CG1 4.41Å; V13-I17 VanDerWaalsContact O-CG1 3.32Å; V13-I17 WeakPolarHBondContact O-CG1 3.38Å; V13-I17 PolarHBondContact O-N 3.49Å; Y14-I17 PolarHBondContact O-N 3.08Å; I17-I20 PolarHBondContact O-N 3.01Å; I17-S21 WeakPolarHBondContact O-CB 3.44Å; I17-S21 PolarHBondContact O-N 2.74Å; I17-S21 PolarHBondContact O-OG 2.64Å
18	F	57.8	Low	60.4	Low	126 Å²	126	102 Å²	102	55%	0.553	52%	0.518	S	S	*	.	H	α-helix	trans	-65.1	-38.7	177.3	-176.6	-97	0	0	0	112.5	Y14 I16 S21 R22	Y14-F18 WeakPolarHBondContact O-CB 3.45Å; Y14-F18 PolarHBondContact O-N 3Å; I16-F18 VanDerWaalsContact C-N 3.35Å; I16-F18 PolarHBondContact O-N 3.15Å; F18-S21 WeakPolarHBondContact CA-OG 3.38Å; F18-S21 PolarHBondContact O-OG 3.12Å; F18-R22 WeakPolarHBondContact O-CB 3.25Å; F18-R22 PolarHBondContact O-N 3.25Å
19	M	55.3	Low	62.2	Low	111 Å²	111	99.7 Å²	99.7	55%	0.547	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-49.1	173	-74.1	-83.4	-83.7	0	0	110.4	S15 I16 S21 R22 F23	S15-M19 WeakPolarHBondContact O-CB 3.33Å; S15-M19 WeakPolarHBondContact O-CG 3.48Å; S15-M19 PolarHBondContact O-N 3.08Å; I16-M19 PolarHBondContact O-N 2.78Å; M19-S21 PolarHBondContact O-N 2.81Å; M19-R22 WeakPolarHBondContact O-CB 3.47Å; M19-R22 PolarHBondContact O-N 3.2Å; M19-F23 WeakPolarHBondContact O-CD2 3.48Å; M19-F23 PolarHBondContact O-N 3.18Å
20	I	56.6	Low	63.9	Low	86 Å²	86	95.1 Å²	95.1	44%	0.441	48%	0.477	S	S	.	.	H	α-helix	trans	-61.3	-42.7	178.5	-66.5	167.1	0	0	0	110.9	I16 I17 R22 F23 I24	I16-I20 HydrophobicContact CG2-CD1 3.67Å; I16-I20 HydrophobicContact CG2-CG1 4.4Å; I16-I20 WeakPolarHBondContact O-CB 3.32Å; I16-I20 VanDerWaalsContact O-CG1 3.24Å; I16-I20 WeakPolarHBondContact O-CG1 3.45Å; I16-I20 PolarHBondContact O-N 2.91Å; I17-I20 PolarHBondContact O-N 3.01Å; I20-R22 VanDerWaalsContact C-N 3.34Å; I20-R22 PolarHBondContact O-N 3.2Å; I20-F23 WeakPolarHBondContact O-CA 3.47Å; I20-F23 WeakPolarHBondContact O-CB 3.33Å; I20-F23 PolarHBondContact O-N 3.25Å; I20-I24 HydrophobicContact CG2-CD1 3.66Å; I20-I24 HydrophobicContact CG2-CG1 4.42Å; I20-I24 WeakPolarHBondContact O-CG1 2.93Å; I20-I24 PolarHBondContact O-N 3.38Å; I20-I24 VanDerWaalsContact O-N 3.1Å
21	S	55	Low	65.5	Low	60 Å²	60	98.1 Å²	98.1	42%	0.42	49%	0.494	S	S	.	.	H	α-helix	trans	-67.2	-34.8	179.3	68.8	0	0	0	0	112.4	I17 F18 M19 F23 I24	I17-S21 WeakPolarHBondContact O-CB 3.44Å; I17-S21 PolarHBondContact O-N 2.74Å; I17-S21 PolarHBondContact O-OG 2.64Å; F18-S21 WeakPolarHBondContact CA-OG 3.38Å; F18-S21 PolarHBondContact O-OG 3.12Å; M19-S21 PolarHBondContact O-N 2.81Å; S21-F23 PolarHBondContact O-N 3Å; S21-I24 CarbonylContact O-C 3.54Å; S21-I24 PolarHBondContact O-N 2.83Å; S21-I24 VanDerWaalsContact O-N 3.16Å
22	R	51.6	Low	66.9	Low	182 Å²	182	99.2 Å²	99.2	69%	0.687	50%	0.496	S	S	*	.	H	α-helix	trans	-60.2	-33.9	169.3	-105.5	-173.9	161.2	-168.3	-4.5	112.6	F18 M19 I20	F18-R22 WeakPolarHBondContact O-CB 3.25Å; F18-R22 PolarHBondContact O-N 3.25Å; M19-R22 WeakPolarHBondContact O-CB 3.47Å; M19-R22 PolarHBondContact O-N 3.2Å; I20-R22 VanDerWaalsContact C-N 3.34Å; I20-R22 PolarHBondContact O-N 3.2Å
23	F	46.7	Very low	67.9	Low	171 Å²	171	99.7 Å²	99.7	75%	0.75	50%	0.5	S	S	*	.	H	α-helix	trans	-78.9	-18	176.3	-75.5	-68.9	0	0	0	113.8	M19 I20 S21	M19-F23 WeakPolarHBondContact O-CD2 3.48Å; M19-F23 PolarHBondContact O-N 3.18Å; I20-F23 WeakPolarHBondContact O-CA 3.47Å; I20-F23 WeakPolarHBondContact O-CB 3.33Å; I20-F23 PolarHBondContact O-N 3.25Å; S21-F23 PolarHBondContact O-N 3Å
24	I	53	Low	69.1	Low	125 Å²	125	102.2 Å²	102.2	64%	0.641	51%	0.506	S	S	*	.			trans	-113.7	49.6	-179	-47	168.6	0	0	0	109.9	I20 S21 C26	I20-I24 HydrophobicContact CG2-CD1 3.66Å; I20-I24 HydrophobicContact CG2-CG1 4.42Å; I20-I24 WeakPolarHBondContact O-CG1 2.93Å; I20-I24 PolarHBondContact O-N 3.38Å; I20-I24 VanDerWaalsContact O-N 3.1Å; S21-I24 CarbonylContact O-C 3.54Å; S21-I24 PolarHBondContact O-N 2.83Å; S21-I24 VanDerWaalsContact O-N 3.16Å; I24-C26 PolarHBondContact O-N 2.6Å
25	K	60.7	Low	70.3	Confident	137 Å²	137	95.7 Å²	95.7	60%	0.596	48%	0.483	S	S	*	.			trans	-89.5	84.5	156.9	-76.5	-166.5	174.4	-160.2	0	107.8	H27	K25-H27 PolarHBondContact O-N 3.2Å
26	C	71.3	Confident	71.8	Confident	87 Å²	87	92.9 Å²	92.9	59%	0.588	46%	0.464	S	S	*	.			trans	-78.3	114.8	169.7	-164.9	0	0	0	0	108	I24	I24-C26 PolarHBondContact O-N 2.6Å
27	H	82.8	Confident	73.2	Confident	51 Å²	51	93.5 Å²	93.5	24%	0.236	47%	0.468	C	S	.	.			trans	-73.3	135.3	172.4	-77.3	-78.7	0	0	0	109.5	K25 I29 C30 Y54 Y55 I187	K25-H27 PolarHBondContact O-N 3.2Å; H27-I29 HydrophobicContact CB-CG2 3.98Å; H27-I29 PolarHBondContact O-N 2.7Å; H27-I29 VanDerWaalsContact O-N 3.16Å; H27-C30 WeakPolarHBondContact O-CB 3.24Å; H27-C30 PolarHBondContact O-N 2.76Å; H27-C30 PolarHBondContact O-SG 2.6Å; H27-Y54 WeakPolarHBondContact CB-OH 3.26Å; H27-Y55 AromaticContact CE1-CE2 3.7Å; H27-I187 HydrophobicContact CB-CG2 3.5Å; H27-I187 VanDerWaalsContact CB-CG2 3.5Å; H27-I187 VanDerWaalsContact CG-CG2 3.48Å
28	E	85.5	Confident	74.7	Confident	113 Å²	113	93 Å²	93	53%	0.528	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-58.2	-33	-176.3	-66.4	-175.2	-177.8	0	0	113.3	C30 T31 K32 L35 Y54	E28-C30 PolarHBondContact O-N 2.79Å; E28-C30 VanDerWaalsContact O-N 3.15Å; E28-T31 PolarHBondContact O-N 3.42Å; E28-T31 PolarHBondContact O-OG1 2.81Å; E28-K32 PolarHBondContact O-N 3.35Å; E28-L35 HydrophobicContact CB-CD1 3.79Å; E28-Y54 PolarHBondContact N-OH 2.92Å
29	I	88.2	Confident	76.6	Confident	0 Å²	0	90.8 Å²	90.8	0%	0	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-58.1	-26	176.2	-165.3	174.6	0	0	0	112.9	H27 T31 K32 P33 L35 G36 Y54 I187 P196 A198	H27-I29 HydrophobicContact CB-CG2 3.98Å; H27-I29 PolarHBondContact O-N 2.7Å; H27-I29 VanDerWaalsContact O-N 3.16Å; I29-T31 PolarHBondContact O-N 2.86Å; I29-K32 WeakPolarHBondContact CA-O 3.18Å; I29-K32 CarbonylContact O-C 3.47Å; I29-K32 VanDerWaalsContact O-C 3.29Å; I29-K32 PolarHBondContact O-N 3.08Å; I29-P33 WeakPolarHBondContact O-CA 3.15Å; I29-L35 HydrophobicContact CB-CB 4.43Å; I29-L35 HydrophobicContact CG1-CB 4.38Å; I29-G36 VanDerWaalsContact CD1-CA 3.49Å; I29-Y54 HydrophobicContact CB-CE1 3.9Å; I29-Y54 HydrophobicContact CB-CE2 3.89Å; I29-Y54 VanDerWaalsContact CB-CZ 3.48Å; I29-Y54 WeakPolarHBondContact CB-OH 3.48Å; I29-Y54 HydrophobicContact CD1-CD1 4.16Å; I29-Y54 HydrophobicContact CD1-CE1 4.06Å; I29-Y54 HydrophobicContact CG2-CE1 3.76Å; I29-Y54 HydrophobicContact CG2-CE2 4.46Å; I29-Y54 VanDerWaalsContact CG2-OH 3.25Å; I29-Y54 WeakPolarHBondContact CG2-OH 3.24Å; I29-Y54 PolarHBondContact N-OH 2.93Å; I29-I187 HydrophobicContact CD1-CG1 4.35Å; I29-I187 HydrophobicContact CG2-CB 3.84Å; I29-I187 HydrophobicContact CG2-CG1 4Å; I29-I187 HydrophobicContact CG2-CG2 3.58Å; I29-P196 HydrophobicContact CD1-CB 4.09Å; I29-P196 HydrophobicContact CD1-CG 4.26Å; I29-P196 HydrophobicContact CG1-CB 4.06Å; I29-P196 HydrophobicContact CG1-CG 4.02Å; I29-P196 HydrophobicContact CG2-CG 3.94Å; I29-A198 HydrophobicContact CD1-CB 4.31Å
30	C	86.7	Confident	78.5	Confident	37 Å²	37	89.1 Å²	89.1	25%	0.25	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-64.2	-23.1	175.4	-55.3	0	0	0	0	112.9	H27 E28 C189	H27-C30 WeakPolarHBondContact O-CB 3.24Å; H27-C30 PolarHBondContact O-N 2.76Å; H27-C30 PolarHBondContact O-SG 2.6Å; E28-C30 PolarHBondContact O-N 2.79Å; E28-C30 VanDerWaalsContact O-N 3.15Å; C30-C189 WeakPolarHBondContact CA-SG 3.24Å; C30-C189 HydrophobicContact CB-CB 3.54Å; C30-C189 WeakPolarHBondContact CB-SG 3.2Å; C30-C189 WeakPolarHBondContact SG-CA 3.5Å; C30-C189 WeakPolarHBondContact SG-CB 3.45Å; C30-C189 CovalentContact SG-SG 2.02Å; C30-C189 PolarHBondContact SG-SG 3.38Å
31	T	86.4	Confident	80.3	Confident	103 Å²	103	88.2 Å²	88.2	63%	0.632	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-17.6	176.3	60.2	0	0	0	0	113	E28 I29	E28-T31 PolarHBondContact O-N 3.42Å; E28-T31 PolarHBondContact O-OG1 2.81Å; I29-T31 PolarHBondContact O-N 2.86Å
32	K	88.7	Confident	82.2	Confident	107 Å²	107	86.1 Å²	86.1	47%	0.465	43%	0.429	S	S	.	.			trans	-138.3	76.3	-175.9	-67.8	-175.5	-176.5	177.7	0	110.2	E28 I29 E34 L35	E28-K32 PolarHBondContact O-N 3.35Å; I29-K32 WeakPolarHBondContact CA-O 3.18Å; I29-K32 CarbonylContact O-C 3.47Å; I29-K32 VanDerWaalsContact O-C 3.29Å; I29-K32 PolarHBondContact O-N 3.08Å; K32-E34 VanDerWaalsContact CA-OE2 3.29Å; K32-E34 WeakPolarHBondContact CA-OE2 3.24Å; K32-E34 WeakPolarHBondContact CB-OE1 3.35Å; K32-E34 PolarHBondContact O-N 3.06Å; K32-E34 VanDerWaalsContact O-N 3.11Å; K32-L35 HydrophobicContact CB-CD1 3.85Å; K32-L35 HydrophobicContact CB-CG 3.97Å; K32-L35 HydrophobicContact CD-CD1 4.34Å; K32-L35 WeakPolarHBondContact O-CB 3.08Å; K32-L35 WeakPolarHBondContact O-CG 3.29Å; K32-L35 PolarHBondContact O-N 2.76Å
33	P	85.7	Confident	84.2	Confident	87 Å²	87	78.2 Å²	78.2	57%	0.565	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-58.1	-25.3	-174.9	-24.9	35.3	0	0	0	114	I29 L35 G36	I29-P33 WeakPolarHBondContact O-CA 3.15Å; P33-L35 PolarHBondContact O-N 3.24Å; P33-L35 VanDerWaalsContact O-N 3.12Å; P33-G36 PolarHBondContact O-N 2.81Å
34	E	88.9	Confident	86.5	Confident	134 Å²	134	74.5 Å²	74.5	63%	0.626	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-59.2	-21.2	175.8	68.7	-83.3	-166.9	0	0	113.6	K32 G36	K32-E34 VanDerWaalsContact CA-OE2 3.29Å; K32-E34 WeakPolarHBondContact CA-OE2 3.24Å; K32-E34 WeakPolarHBondContact CB-OE1 3.35Å; K32-E34 PolarHBondContact O-N 3.06Å; K32-E34 VanDerWaalsContact O-N 3.11Å; E34-G36 PolarHBondContact O-N 2.88Å
35	L	91.2	Very high	88.4	Confident	31 Å²	31	71.4 Å²	71.4	16%	0.162	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-66.1	-16.5	174.5	-67.5	178	0	0	0	112.8	E28 I29 K32 P33 N37 Y38 Y54	E28-L35 HydrophobicContact CB-CD1 3.79Å; I29-L35 HydrophobicContact CB-CB 4.43Å; I29-L35 HydrophobicContact CG1-CB 4.38Å; K32-L35 HydrophobicContact CB-CD1 3.85Å; K32-L35 HydrophobicContact CB-CG 3.97Å; K32-L35 HydrophobicContact CD-CD1 4.34Å; K32-L35 WeakPolarHBondContact O-CB 3.08Å; K32-L35 WeakPolarHBondContact O-CG 3.29Å; K32-L35 PolarHBondContact O-N 2.76Å; P33-L35 PolarHBondContact O-N 3.24Å; P33-L35 VanDerWaalsContact O-N 3.12Å; L35-N37 PolarHBondContact O-N 2.78Å; L35-N37 VanDerWaalsContact O-N 3.11Å; L35-Y38 HydrophobicContact CD2-CD2 4.45Å; L35-Y38 VanDerWaalsContact O-CB 3.26Å; L35-Y38 WeakPolarHBondContact O-CB 3.09Å; L35-Y38 PolarHBondContact O-N 2.77Å; L35-Y54 HydrophobicContact CB-CD2 3.76Å; L35-Y54 HydrophobicContact CB-CE2 4.03Å; L35-Y54 HydrophobicContact CD1-CE2 4.17Å; L35-Y54 WeakPolarHBondContact O-CB 3.5Å
36	G	90.7	Very high	90	Very high	3 Å²	3	72.1 Å²	72.1	3%	0.031	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-55.6	-29	179.3	0	0	0	0	0	114.2	I29 P33 E34 A198 E199	I29-G36 VanDerWaalsContact CD1-CA 3.49Å; P33-G36 PolarHBondContact O-N 2.81Å; E34-G36 PolarHBondContact O-N 2.88Å; G36-A198 CarbonylContact O-C 3.56Å; G36-A198 VanDerWaalsContact O-CA 3.31Å; G36-A198 WeakPolarHBondContact O-CA 3.41Å; G36-E199 PolarHBondContact O-N 2.88Å
37	N	92.5	Very high	91.2	Very high	114 Å²	114	70.4 Å²	70.4	61%	0.61	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-113.5	20.8	178.8	-59.1	-20.2	0	0	0	112.1	L35 T39	L35-N37 PolarHBondContact O-N 2.78Å; L35-N37 VanDerWaalsContact O-N 3.11Å; N37-T39 PolarHBondContact O-N 2.82Å
38	Y	94.5	Very high	91.7	Very high	88 Å²	88	71.3 Å²	71.3	35%	0.345	37%	0.371	S	S	.	.			trans	-64.8	128.9	179.4	172.1	-94.5	0	0	0	110.4	L35 K40 H52 N53 Y54	L35-Y38 HydrophobicContact CD2-CD2 4.45Å; L35-Y38 VanDerWaalsContact O-CB 3.26Å; L35-Y38 WeakPolarHBondContact O-CB 3.09Å; L35-Y38 PolarHBondContact O-N 2.77Å; Y38-K40 HydrophobicContact CE1-CB 4.28Å; Y38-K40 HydrophobicContact CE2-CB 4.46Å; Y38-K40 WeakPolarHBondContact OH-CB 3.38Å; Y38-H52 HydrophobicContact CE1-CB 4.29Å; Y38-N53 WeakPolarHBondContact O-CA 3.45Å; Y38-Y54 PolarHBondContact O-N 2.8Å
39	T	96	Very high	92.3	Very high	79 Å²	79	66.1 Å²	66.1	49%	0.485	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.6	170.5	-54.9	0	0	0	0	109.7	N37 H52 N53	N37-T39 PolarHBondContact O-N 2.82Å; T39-H52 CarbonylContact C-O 3.6Å; T39-H52 VanDerWaalsContact CA-O 3.24Å; T39-H52 WeakPolarHBondContact CA-O 3.19Å; T39-N53 WeakPolarHBondContact CB-OD1 3.35Å; T39-N53 WeakPolarHBondContact CG2-OD1 3.19Å; T39-N53 PolarHBondContact OG1-OD1 2.85Å
40	K	95.3	Very high	92.7	Very high	77 Å²	77	66.1 Å²	66.1	34%	0.335	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	117.2	171.6	180	177.1	170	-172.9	0	110	Y38 I42 S51 H52 S246 I248	Y38-K40 HydrophobicContact CE1-CB 4.28Å; Y38-K40 HydrophobicContact CE2-CB 4.46Å; Y38-K40 WeakPolarHBondContact OH-CB 3.38Å; K40-I42 HydrophobicContact CD-CD1 4.48Å; K40-I42 HydrophobicContact CG-CD1 4.32Å; K40-S51 CarbonylContact O-C 3.53Å; K40-S51 VanDerWaalsContact O-CA 3.27Å; K40-S51 WeakPolarHBondContact O-CA 3.39Å; K40-S51 WeakPolarHBondContact O-CB 3.4Å; K40-H52 PolarHBondContact N-O 2.84Å; K40-H52 PolarHBondContact O-N 3.01Å; K40-S246 PolarHBondContact NZ-O 2.9Å; K40-I248 HydrophobicContact CD-CD1 3.56Å; K40-I248 VanDerWaalsContact NZ-CD1 3.25Å
41	V	95.6	Very high	93.2	Very high	67 Å²	67	64.3 Å²	64.3	41%	0.406	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	129.7	171.5	-178.4	0	0	0	0	109.1	E44 E49	V41-E44 HydrophobicContact CG1-CB 4.06Å; V41-E49 HydrophobicContact CG1-CG 3.98Å; V41-E49 HydrophobicContact CG2-CG 4.43Å
42	I	94.2	Very high	93.6	Very high	15 Å²	15	59.7 Å²	59.7	8%	0.077	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-48.5	-178.7	-55.6	-57.6	0	0	0	109.9	K40 Y50 H52 C243 I248	K40-I42 HydrophobicContact CD-CD1 4.48Å; K40-I42 HydrophobicContact CG-CD1 4.32Å; I42-Y50 HydrophobicContact CB-CD1 3.83Å; I42-Y50 HydrophobicContact CB-CE1 4.5Å; I42-Y50 WeakPolarHBondContact CB-O 3.4Å; I42-Y50 HydrophobicContact CG1-CD1 3.99Å; I42-Y50 HydrophobicContact CG1-CE1 4.26Å; I42-Y50 HydrophobicContact CG2-CD1 4.13Å; I42-Y50 PolarHBondContact N-O 3.38Å; I42-H52 HydrophobicContact CD1-CB 4.48Å; I42-C243 HydrophobicContact CG2-CB 4.18Å; I42-I248 HydrophobicContact CD1-CD1 3.82Å
43	F	93.5	Very high	94	Very high	17 Å²	17	54.7 Å²	54.7	8%	0.075	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	150.7	172.5	58.4	-103.9	0	0	0	109.9	Y48 Y50 F260 G264	F43-Y48 HydrophobicContact CD2-CD2 4.05Å; F43-Y48 AromaticContact CD2-CE2 3.69Å; F43-Y48 HydrophobicContact CD2-CE2 3.69Å; F43-Y48 HydrophobicContact CE2-CD2 4.03Å; F43-Y48 AromaticContact CE2-CE2 3.85Å; F43-Y48 HydrophobicContact CE2-CE2 3.85Å; F43-Y50 HydrophobicContact CD1-CD1 4.13Å; F43-Y50 AromaticContact CE1-CD1 3.5Å; F43-Y50 HydrophobicContact CE1-CD1 3.5Å; F43-Y50 HydrophobicContact CE1-CE1 4.47Å; F43-Y50 AromaticContact CE1-CG 3.81Å; F43-Y50 HydrophobicContact CE1-CG 3.81Å; F43-Y50 HydrophobicContact CE2-CG 4.3Å; F43-Y50 AromaticContact CZ-CD1 3.9Å; F43-Y50 HydrophobicContact CZ-CD1 3.9Å; F43-Y50 AromaticContact CZ-CG 3.7Å; F43-Y50 HydrophobicContact CZ-CG 3.7Å; F43-Y50 PolarHBondContact N-O 2.87Å; F43-Y50 PolarHBondContact O-N 2.96Å; F43-F260 AromaticContact CE2-CE1 3.6Å; F43-F260 HydrophobicContact CE2-CE1 3.6Å; F43-F260 HydrophobicContact CE2-CZ 4.05Å; F43-F260 HydrophobicContact CZ-CD1 4.34Å; F43-F260 AromaticContact CZ-CE1 3.82Å; F43-F260 HydrophobicContact CZ-CE1 3.82Å; F43-G264 VanDerWaalsContact CD1-C 3.45Å; F43-G264 WeakPolarHBondContact CD1-O 3.48Å
44	E	94.6	Very high	94.4	Very high	92 Å²	92	51.9 Å²	51.9	43%	0.43	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	147.7	-177.1	-174.5	-177.3	151	0	0	109.4	V41 Y48 E49 K205 W206	V41-E44 HydrophobicContact CG1-CB 4.06Å; E44-Y48 WeakPolarHBondContact CA-O 3.17Å; E44-E49 HydrophobicContact CB-CG 4.26Å; E44-E49 HydrophobicContact CG-CB 4.17Å; E44-E49 HydrophobicContact CG-CG 4.14Å; E44-K205 IonicContact OE1-NZ 2.79Å; E44-K205 PolarHBondContact OE1-NZ 2.66Å; E44-K205 IonicContact OE2-NZ 3.49Å; E44-K205 PolarHBondContact OE2-NZ 2.67Å; E44-W206 HydrophobicContact CG-CZ2 3.93Å
45	N	93.4	Very high	94.6	Very high	60 Å²	60	48 Å²	48	32%	0.321	24%	0.242	S	C	.	.			trans	-142.1	-167.1	161.8	77	-0.6	0	0	0	110.2	S47 Y48 W206	N45-S47 PolarHBondContact O-N 3.3Å; N45-S47 VanDerWaalsContact O-N 3.14Å; N45-S47 WeakPolarHBondContact OD1-CA 2.91Å; N45-S47 PolarHBondContact OD1-N 2.96Å; N45-Y48 HydrophobicContact CB-CE2 4.28Å; N45-Y48 VanDerWaalsContact CG-CE1 3.42Å; N45-Y48 VanDerWaalsContact CG-CZ 3.44Å; N45-Y48 PolarHBondContact N-O 2.86Å; N45-Y48 WeakPolarHBondContact ND2-CD1 3.19Å; N45-Y48 WeakPolarHBondContact ND2-CE1 3.17Å; N45-Y48 PolarHBondContact ND2-OH 3.22Å; N45-Y48 WeakPolarHBondContact OD1-CD1 3.29Å; N45-Y48 WeakPolarHBondContact OD1-CE1 2.8Å; N45-Y48 VanDerWaalsContact OD1-CG 3.23Å; N45-Y48 PolarHBondContact OD1-N 3.38Å; N45-W206 VanDerWaalsContact O-CH2 3.32Å; N45-W206 WeakPolarHBondContact O-CH2 3.4Å
46	D	94.7	Very high	94.9	Very high	153 Å²	153	46.5 Å²	46.5	82%	0.818	24%	0.235	S	C	*	.	S	Bend	trans	-67.6	-11.7	-178.3	-61.2	-21	0	0	0	115.1	L62	D46-L62 WeakPolarHBondContact O-CD1 3.15Å
47	S	95.3	Very high	95.2	Very high	51 Å²	51	46.4 Å²	46.4	36%	0.357	23%	0.233	S	C	.	.	S	Bend	trans	-125.6	-9.4	-173	-64.6	0	0	0	0	114.8	N45 L62	N45-S47 PolarHBondContact O-N 3.3Å; N45-S47 VanDerWaalsContact O-N 3.14Å; N45-S47 WeakPolarHBondContact OD1-CA 2.91Å; N45-S47 PolarHBondContact OD1-N 2.96Å; S47-L62 PolarHBondContact O-N 2.8Å
48	Y	94.9	Very high	95.4	Very high	69 Å²	69	41 Å²	41	27%	0.271	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	158.8	178.5	58.5	-110.6	0	0	0	113.1	F43 E44 N45 I60 F260	F43-Y48 HydrophobicContact CD2-CD2 4.05Å; F43-Y48 AromaticContact CD2-CE2 3.69Å; F43-Y48 HydrophobicContact CD2-CE2 3.69Å; F43-Y48 HydrophobicContact CE2-CD2 4.03Å; F43-Y48 AromaticContact CE2-CE2 3.85Å; F43-Y48 HydrophobicContact CE2-CE2 3.85Å; E44-Y48 WeakPolarHBondContact CA-O 3.17Å; N45-Y48 HydrophobicContact CB-CE2 4.28Å; N45-Y48 VanDerWaalsContact CG-CE1 3.42Å; N45-Y48 VanDerWaalsContact CG-CZ 3.44Å; N45-Y48 PolarHBondContact N-O 2.86Å; N45-Y48 WeakPolarHBondContact ND2-CD1 3.19Å; N45-Y48 WeakPolarHBondContact ND2-CE1 3.17Å; N45-Y48 PolarHBondContact ND2-OH 3.22Å; N45-Y48 WeakPolarHBondContact OD1-CD1 3.29Å; N45-Y48 WeakPolarHBondContact OD1-CE1 2.8Å; N45-Y48 VanDerWaalsContact OD1-CG 3.23Å; N45-Y48 PolarHBondContact OD1-N 3.38Å; Y48-I60 CarbonylContact C-O 3.49Å; Y48-I60 WeakPolarHBondContact CA-O 3.15Å; Y48-I60 WeakPolarHBondContact CB-O 3.19Å; Y48-F260 AromaticContact CD1-CE2 3.74Å; Y48-F260 HydrophobicContact CD1-CE2 3.74Å; Y48-F260 AromaticContact CD1-CZ 3.72Å; Y48-F260 HydrophobicContact CD1-CZ 3.72Å; Y48-F260 HydrophobicContact CD2-CE1 4.43Å; Y48-F260 HydrophobicContact CD2-CE2 4.38Å; Y48-F260 AromaticContact CD2-CZ 3.57Å; Y48-F260 HydrophobicContact CD2-CZ 3.57Å; Y48-F260 AromaticContact CE1-CE2 3.9Å; Y48-F260 HydrophobicContact CE1-CE2 3.9Å; Y48-F260 HydrophobicContact CE1-CZ 4.04Å; Y48-F260 AromaticContact CE2-CZ 3.94Å; Y48-F260 HydrophobicContact CE2-CZ 3.94Å; Y48-F260 AromaticContact CG-CE2 4Å; Y48-F260 HydrophobicContact CG-CE2 4Å; Y48-F260 AromaticContact CG-CZ 3.46Å; Y48-F260 HydrophobicContact CG-CZ 3.46Å; Y48-F260 VanDerWaalsContact CG-CZ 3.46Å
49	E	96.9	Very high	95.6	Very high	4 Å²	4	37 Å²	37	2%	0.019	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	137.7	170.7	-172	-170.5	106.1	0	0	108.9	V41 E44 S51 L59 I60 K205 W206	V41-E49 HydrophobicContact CG1-CG 3.98Å; V41-E49 HydrophobicContact CG2-CG 4.43Å; E44-E49 HydrophobicContact CB-CG 4.26Å; E44-E49 HydrophobicContact CG-CB 4.17Å; E44-E49 HydrophobicContact CG-CG 4.14Å; E49-S51 PolarHBondContact OE1-OG 3.49Å; E49-L59 WeakPolarHBondContact O-CA 3.33Å; E49-I60 HydrophobicContact CB-CB 4.17Å; E49-I60 HydrophobicContact CB-CD1 4.3Å; E49-I60 HydrophobicContact CB-CG1 4.45Å; E49-I60 PolarHBondContact N-O 2.84Å; E49-I60 VanDerWaalsContact N-O 3.08Å; E49-I60 PolarHBondContact O-N 2.67Å; E49-K205 WeakPolarHBondContact OE2-CE 3.39Å; E49-K205 IonicContact OE2-NZ 2.55Å; E49-W206 HydrophobicContact CB-CZ2 3.7Å; E49-W206 PolarHBondContact OE2-NE1 3.5Å
50	Y	96.6	Very high	95.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124	166.2	-173	-115.5	0	0	0	110	I42 F43 H52 S57 Q58 L59 T250 K261	I42-Y50 HydrophobicContact CB-CD1 3.83Å; I42-Y50 HydrophobicContact CB-CE1 4.5Å; I42-Y50 WeakPolarHBondContact CB-O 3.4Å; I42-Y50 HydrophobicContact CG1-CD1 3.99Å; I42-Y50 HydrophobicContact CG1-CE1 4.26Å; I42-Y50 HydrophobicContact CG2-CD1 4.13Å; I42-Y50 PolarHBondContact N-O 3.38Å; F43-Y50 HydrophobicContact CD1-CD1 4.13Å; F43-Y50 AromaticContact CE1-CD1 3.5Å; F43-Y50 HydrophobicContact CE1-CD1 3.5Å; F43-Y50 HydrophobicContact CE1-CE1 4.47Å; F43-Y50 AromaticContact CE1-CG 3.81Å; F43-Y50 HydrophobicContact CE1-CG 3.81Å; F43-Y50 HydrophobicContact CE2-CG 4.3Å; F43-Y50 AromaticContact CZ-CD1 3.9Å; F43-Y50 HydrophobicContact CZ-CD1 3.9Å; F43-Y50 AromaticContact CZ-CG 3.7Å; F43-Y50 HydrophobicContact CZ-CG 3.7Å; F43-Y50 PolarHBondContact N-O 2.87Å; F43-Y50 PolarHBondContact O-N 2.96Å; Y50-H52 AromaticContact CE1-NE2 3.99Å; Y50-S57 WeakPolarHBondContact OH-CB 3.5Å; Y50-S57 PolarHBondContact OH-OG 3.31Å; Y50-Q58 WeakPolarHBondContact CA-O 3.35Å; Y50-Q58 VanDerWaalsContact CD2-O 3.28Å; Y50-Q58 WeakPolarHBondContact CD2-O 3.38Å; Y50-L59 HydrophobicContact CD2-CB 4.07Å; Y50-L59 HydrophobicContact CD2-CD1 4.34Å; Y50-T250 HydrophobicContact CE1-CG2 4.3Å; Y50-T250 PolarHBondContact OH-OG1 2.95Å; Y50-K261 HydrophobicContact CE2-CD 4.23Å; Y50-K261 VanDerWaalsContact CE2-CE 3.49Å; Y50-K261 HydrophobicContact CE2-CG 4.25Å; Y50-K261 WeakPolarHBondContact OH-CE 3.42Å; Y50-K261 PolarHBondContact OH-NZ 2.97Å
51	S	96.7	Very high	95.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153.3	-178.7	47.5	0	0	0	0	112.1	K40 E49 S57 Q58	K40-S51 CarbonylContact O-C 3.53Å; K40-S51 VanDerWaalsContact O-CA 3.27Å; K40-S51 WeakPolarHBondContact O-CA 3.39Å; K40-S51 WeakPolarHBondContact O-CB 3.4Å; E49-S51 PolarHBondContact OE1-OG 3.49Å; S51-S57 CarbonylContact O-C 3.56Å; S51-S57 WeakPolarHBondContact O-CA 3.41Å; S51-Q58 PolarHBondContact N-O 2.94Å; S51-Q58 PolarHBondContact O-N 2.64Å; S51-Q58 PolarHBondContact OG-NE2 2.96Å
52	H	95.8	Very high	95.8	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.023	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.1	170.3	-86.1	-141.2	0	0	0	109	Y38 T39 K40 I42 Y50 I248 T250	Y38-H52 HydrophobicContact CE1-CB 4.29Å; T39-H52 CarbonylContact C-O 3.6Å; T39-H52 VanDerWaalsContact CA-O 3.24Å; T39-H52 WeakPolarHBondContact CA-O 3.19Å; K40-H52 PolarHBondContact N-O 2.84Å; K40-H52 PolarHBondContact O-N 3.01Å; I42-H52 HydrophobicContact CD1-CB 4.48Å; Y50-H52 AromaticContact CE1-NE2 3.99Å; H52-I248 WeakPolarHBondContact CE1-CG2 3.45Å; H52-I248 WeakPolarHBondContact ND1-CG2 3.43Å; H52-T250 PolarHBondContact CE1-OG1 3.15Å; H52-T250 WeakPolarHBondContact NE2-CB 3.1Å; H52-T250 PolarHBondContact NE2-OG1 2.02Å
53	N	96.1	Very high	95.9	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	174.5	167.9	-60.5	-79.7	0	0	0	109.7	Y38 T39 Y55 Y56 Q58 I200	Y38-N53 WeakPolarHBondContact O-CA 3.45Å; T39-N53 WeakPolarHBondContact CB-OD1 3.35Å; T39-N53 WeakPolarHBondContact CG2-OD1 3.19Å; T39-N53 PolarHBondContact OG1-OD1 2.85Å; N53-Y55 PolarHBondContact O-N 2.9Å; N53-Y56 CarbonylContact C-O 3.53Å; N53-Y56 WeakPolarHBondContact CA-O 3.14Å; N53-Y56 WeakPolarHBondContact CB-O 3.46Å; N53-Y56 PolarHBondContact N-O 2.7Å; N53-Y56 VanDerWaalsContact O-O 3.07Å; N53-Q58 WeakPolarHBondContact ND2-CB 3.36Å; N53-I200 HydrophobicContact CB-CD1 3.48Å; N53-I200 VanDerWaalsContact CB-CD1 3.48Å; N53-I200 HydrophobicContact CB-CG1 3.65Å; N53-I200 HydrophobicContact CB-CG2 4.33Å
54	Y	94	Very high	96.1	Very high	27 Å²	27	39.6 Å²	39.6	11%	0.106	19%	0.188	C	C	.	.	S	Bend	trans	-60.4	128.2	169.6	-167.1	-97.8	0	0	0	110.3	H27 E28 I29 L35 Y38 Y56 I187 A198	H27-Y54 WeakPolarHBondContact CB-OH 3.26Å; E28-Y54 PolarHBondContact N-OH 2.92Å; I29-Y54 HydrophobicContact CB-CE1 3.9Å; I29-Y54 HydrophobicContact CB-CE2 3.89Å; I29-Y54 VanDerWaalsContact CB-CZ 3.48Å; I29-Y54 WeakPolarHBondContact CB-OH 3.48Å; I29-Y54 HydrophobicContact CD1-CD1 4.16Å; I29-Y54 HydrophobicContact CD1-CE1 4.06Å; I29-Y54 HydrophobicContact CG2-CE1 3.76Å; I29-Y54 HydrophobicContact CG2-CE2 4.46Å; I29-Y54 VanDerWaalsContact CG2-OH 3.25Å; I29-Y54 WeakPolarHBondContact CG2-OH 3.24Å; I29-Y54 PolarHBondContact N-OH 2.93Å; L35-Y54 HydrophobicContact CB-CD2 3.76Å; L35-Y54 HydrophobicContact CB-CE2 4.03Å; L35-Y54 HydrophobicContact CD1-CE2 4.17Å; L35-Y54 WeakPolarHBondContact O-CB 3.5Å; Y38-Y54 PolarHBondContact O-N 2.8Å; Y54-Y56 PolarHBondContact O-N 2.92Å; Y54-I187 HydrophobicContact CE1-CD1 4.11Å; Y54-I187 HydrophobicContact CE1-CG1 4.07Å; Y54-A198 HydrophobicContact CD1-CB 3.78Å; Y54-A198 HydrophobicContact CG-CB 4.49Å
55	Y	94.8	Very high	96.2	Very high	52 Å²	52	39.9 Å²	39.9	20%	0.204	20%	0.2	C	C	.	.	S	Bend	trans	71.2	-30.7	-180	-152	-80.4	0	0	0	116.5	H27 N53 Y91 G92 I187 V217 L218	H27-Y55 AromaticContact CE1-CE2 3.7Å; N53-Y55 PolarHBondContact O-N 2.9Å; Y55-Y91 AromaticContact CD1-CD1 3.85Å; Y55-Y91 HydrophobicContact CD1-CD1 3.85Å; Y55-Y91 HydrophobicContact CD1-CE1 4.42Å; Y55-Y91 HydrophobicContact CD1-CG 4.45Å; Y55-Y91 AromaticContact CD2-CD1 3.87Å; Y55-Y91 HydrophobicContact CD2-CD1 3.87Å; Y55-Y91 AromaticContact CG-CD1 3.49Å; Y55-Y91 HydrophobicContact CG-CD1 3.49Å; Y55-Y91 VanDerWaalsContact CG-CD1 3.49Å; Y55-Y91 HydrophobicContact CG-CE1 4.01Å; Y55-Y91 HydrophobicContact CG-CG 4.43Å; Y55-G92 WeakPolarHBondContact OH-CA 3.25Å; Y55-G92 PolarHBondContact OH-N 2.84Å; Y55-I187 HydrophobicContact CD2-CD1 4.17Å; Y55-V217 HydrophobicContact CD1-CG1 4.11Å; Y55-V217 HydrophobicContact CD1-CG2 4.43Å; Y55-V217 HydrophobicContact CE1-CB 4.39Å; Y55-V217 HydrophobicContact CE1-CG1 3.58Å; Y55-V217 HydrophobicContact CE1-CG2 4.01Å; Y55-L218 PolarHBondContact O-N 3.45Å
56	Y	96.9	Very high	96.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.1	-174.9	-71.6	-91.3	0	0	0	113.5	N53 Y54 Y91 G161 F183 I200 H215 E216 V217 L218	N53-Y56 CarbonylContact C-O 3.53Å; N53-Y56 WeakPolarHBondContact CA-O 3.14Å; N53-Y56 WeakPolarHBondContact CB-O 3.46Å; N53-Y56 PolarHBondContact N-O 2.7Å; N53-Y56 VanDerWaalsContact O-O 3.07Å; Y54-Y56 PolarHBondContact O-N 2.92Å; Y56-Y91 HydrophobicContact CD2-CD1 4.29Å; Y56-Y91 AromaticContact CD2-CE1 3.75Å; Y56-Y91 HydrophobicContact CD2-CE1 3.75Å; Y56-Y91 HydrophobicContact CD2-CE2 4.32Å; Y56-Y91 AromaticContact CD2-CZ 3.79Å; Y56-Y91 AromaticContact CE2-CD1 3.82Å; Y56-Y91 HydrophobicContact CE2-CD1 3.82Å; Y56-Y91 AromaticContact CE2-CD2 3.85Å; Y56-Y91 HydrophobicContact CE2-CD2 3.85Å; Y56-Y91 AromaticContact CE2-CE1 3.66Å; Y56-Y91 HydrophobicContact CE2-CE1 3.66Å; Y56-Y91 AromaticContact CE2-CE2 3.72Å; Y56-Y91 HydrophobicContact CE2-CE2 3.72Å; Y56-Y91 AromaticContact CE2-CG 3.96Å; Y56-Y91 HydrophobicContact CE2-CG 3.96Å; Y56-Y91 AromaticContact CE2-CZ 3.63Å; Y56-G161 WeakPolarHBondContact CE1-O 3.48Å; Y56-G161 PolarHBondContact OH-O 2.82Å; Y56-F183 AromaticContact CD2-CE2 3.92Å; Y56-F183 HydrophobicContact CD2-CE2 3.92Å; Y56-F183 HydrophobicContact CD2-CZ 4.09Å; Y56-F183 AromaticContact CE2-CE2 3.84Å; Y56-F183 HydrophobicContact CE2-CE2 3.84Å; Y56-F183 HydrophobicContact CE2-CZ 4.38Å; Y56-F183 HydrophobicContact CG-CZ 4.25Å; Y56-I200 HydrophobicContact CD2-CD1 3.79Å; Y56-I200 HydrophobicContact CG-CD1 4.03Å; Y56-H215 HydrophobicContact CD1-CB 3.79Å; Y56-H215 HydrophobicContact CE1-CB 4.44Å; Y56-H215 HydrophobicContact CG-CB 4.28Å; Y56-E216 CarbonylContact C-O 3.45Å; Y56-E216 VanDerWaalsContact CA-O 3.24Å; Y56-E216 WeakPolarHBondContact CA-O 3.39Å; Y56-V217 HydrophobicContact CD1-CG2 4.14Å; Y56-V217 HydrophobicContact CE1-CG2 3.53Å; Y56-L218 VanDerWaalsContact C-CD1 3.49Å
57	S	96.6	Very high	96.3	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	145.7	157.3	62.1	0	0	0	0	109.3	Y50 S51 H215 E216 K261	Y50-S57 WeakPolarHBondContact OH-CB 3.5Å; Y50-S57 PolarHBondContact OH-OG 3.31Å; S51-S57 CarbonylContact O-C 3.56Å; S51-S57 WeakPolarHBondContact O-CA 3.41Å; S57-H215 CarbonylContact O-C 3.57Å; S57-H215 WeakPolarHBondContact O-CA 3.43Å; S57-E216 PolarHBondContact N-O 3.25Å; S57-E216 PolarHBondContact O-N 2.84Å; S57-E216 PolarHBondContact OG-O 2.85Å; S57-K261 PolarHBondContact OG-NZ 3.16Å
58	Q	97.8	Very high	96.3	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126	175	179.2	-178	-96.4	0	0	109.4	Y50 S51 N53 I60 V213 E214 H215	Y50-Q58 WeakPolarHBondContact CA-O 3.35Å; Y50-Q58 VanDerWaalsContact CD2-O 3.28Å; Y50-Q58 WeakPolarHBondContact CD2-O 3.38Å; S51-Q58 PolarHBondContact N-O 2.94Å; S51-Q58 PolarHBondContact O-N 2.64Å; S51-Q58 PolarHBondContact OG-NE2 2.96Å; N53-Q58 WeakPolarHBondContact ND2-CB 3.36Å; Q58-I60 HydrophobicContact CG-CD1 4.42Å; Q58-I60 HydrophobicContact CG-CG1 4.01Å; Q58-V213 HydrophobicContact CG-CG1 3.7Å; Q58-E214 CarbonylContact C-O 3.57Å; Q58-E214 WeakPolarHBondContact CA-O 3.35Å; Q58-H215 WeakPolarHBondContact CG-NE2 3.23Å; Q58-H215 PolarHBondContact OE1-NE2 3.21Å
59	L	97.4	Very high	96.2	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117.7	171.1	173.5	57.8	0	0	0	109.3	E49 Y50 R61 V213 E214 N257 F260	E49-L59 WeakPolarHBondContact O-CA 3.33Å; Y50-L59 HydrophobicContact CD2-CB 4.07Å; Y50-L59 HydrophobicContact CD2-CD1 4.34Å; L59-R61 HydrophobicContact CD1-CG 4.1Å; L59-R61 HydrophobicContact CG-CG 4.16Å; L59-V213 CarbonylContact O-C 3.58Å; L59-V213 WeakPolarHBondContact O-CA 2.92Å; L59-E214 PolarHBondContact N-O 2.92Å; L59-E214 PolarHBondContact O-N 3.44Å; L59-N257 HydrophobicContact CD2-CB 3.9Å; L59-N257 VanDerWaalsContact CD2-CG 3.49Å; L59-F260 HydrophobicContact CD1-CD1 3.8Å; L59-F260 HydrophobicContact CD1-CE1 3.21Å; L59-F260 HydrophobicContact CD1-CZ 3.88Å; L59-F260 HydrophobicContact CD2-CD1 4.03Å; L59-F260 HydrophobicContact CD2-CE1 4.29Å; L59-F260 HydrophobicContact CG-CE1 4.39Å
60	I	98	Very high	96	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.6	176.1	-57.3	-178.7	0	0	0	108.7	Y48 E49 Q58 P203 W206 T211 L212 V213	Y48-I60 CarbonylContact C-O 3.49Å; Y48-I60 WeakPolarHBondContact CA-O 3.15Å; Y48-I60 WeakPolarHBondContact CB-O 3.19Å; E49-I60 HydrophobicContact CB-CB 4.17Å; E49-I60 HydrophobicContact CB-CD1 4.3Å; E49-I60 HydrophobicContact CB-CG1 4.45Å; E49-I60 PolarHBondContact N-O 2.84Å; E49-I60 VanDerWaalsContact N-O 3.08Å; E49-I60 PolarHBondContact O-N 2.67Å; Q58-I60 HydrophobicContact CG-CD1 4.42Å; Q58-I60 HydrophobicContact CG-CG1 4.01Å; I60-P203 HydrophobicContact CD1-CG 4.34Å; I60-W206 HydrophobicContact CB-CD2 4.45Å; I60-W206 HydrophobicContact CB-CG 4.49Å; I60-W206 HydrophobicContact CD1-CB 3.97Å; I60-W206 HydrophobicContact CD1-CD2 4.28Å; I60-W206 HydrophobicContact CD1-CG 3.61Å; I60-W206 HydrophobicContact CG2-CB 3.77Å; I60-W206 HydrophobicContact CG2-CD2 3.64Å; I60-W206 HydrophobicContact CG2-CE3 3.67Å; I60-W206 HydrophobicContact CG2-CG 3.69Å; I60-W206 HydrophobicContact CG2-CZ3 4.46Å; I60-T211 HydrophobicContact CG2-CG2 3.74Å; I60-L212 WeakPolarHBondContact CA-O 3.4Å; I60-V213 HydrophobicContact CG1-CB 4.45Å; I60-V213 HydrophobicContact CG1-CG1 3.91Å; I60-V213 HydrophobicContact CG1-CG2 4.04Å; I60-V213 HydrophobicContact CG2-CG2 4.24Å
61	R	97.4	Very high	95.8	Very high	48 Å²	48	45.1 Å²	45.1	18%	0.181	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.8	174.4	-64.7	-177.9	-69.7	172.5	-2.2	110.8	L59 Q64 T211 L212 E214 N257	L59-R61 HydrophobicContact CD1-CG 4.1Å; L59-R61 HydrophobicContact CG-CG 4.16Å; R61-Q64 HydrophobicContact CB-CG 3.8Å; R61-Q64 WeakPolarHBondContact O-CG 3.46Å; R61-T211 WeakPolarHBondContact O-CA 3.49Å; R61-L212 PolarHBondContact N-O 2.89Å; R61-L212 PolarHBondContact O-N 3.14Å; R61-E214 IonicContact CZ-OE2 3.65Å; R61-E214 IonicContact NE-OE2 2.67Å; R61-E214 IonicContact NH2-OE2 2.67Å; R61-E214 PolarHBondContact NH2-OE2 3.46Å; R61-N257 PolarHBondContact NH1-OD1 2.88Å; R61-N257 PolarHBondContact NH2-OD1 3.39Å; R61-N257 VanDerWaalsContact NH2-OD1 3.08Å
62	L	97.1	Very high	95.7	Very high	21 Å²	21	46.8 Å²	46.8	11%	0.11	25%	0.252	C	S	.	.	S	Bend	trans	-81.5	163.9	174.1	-60.4	-172.4	0	0	0	112.2	D46 S47 Q64 W206 Q208 T211	D46-L62 WeakPolarHBondContact O-CD1 3.15Å; S47-L62 PolarHBondContact O-N 2.8Å; L62-Q64 VanDerWaalsContact C-N 3.25Å; L62-Q64 PolarHBondContact O-N 3.49Å; L62-Q64 PolarHBondContact O-NE2 2.91Å; L62-W206 HydrophobicContact CD1-CE3 4.33Å; L62-W206 HydrophobicContact CD1-CZ3 3.89Å; L62-W206 HydrophobicContact CD2-CE3 3.73Å; L62-W206 HydrophobicContact CD2-CZ3 4.05Å; L62-W206 HydrophobicContact CG-CE3 4.01Å; L62-W206 HydrophobicContact CG-CZ3 3.78Å; L62-Q208 HydrophobicContact CD2-CG 4.03Å; L62-T211 HydrophobicContact CD2-CG2 3.84Å; L62-T211 WeakPolarHBondContact CD2-OG1 3.44Å
63	K	96.1	Very high	95.7	Very high	182 Å²	182	47.6 Å²	47.6	79%	0.791	26%	0.256	S	S	*	.	S	Bend	trans	56.6	35.9	171.4	-55.7	175.3	-177.6	171	0	113.7	G210	K63-G210 PolarHBondContact N-O 3.1Å
64	Q	97	Very high	95.8	Very high	60 Å²	60	53.6 Å²	53.6	28%	0.28	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-87.5	145.2	177.1	-58.4	-57.7	-66.8	0	0	110.8	R61 L62 Y166 G210 L212	R61-Q64 HydrophobicContact CB-CG 3.8Å; R61-Q64 WeakPolarHBondContact O-CG 3.46Å; L62-Q64 VanDerWaalsContact C-N 3.25Å; L62-Q64 PolarHBondContact O-N 3.49Å; L62-Q64 PolarHBondContact O-NE2 2.91Å; Q64-Y166 HydrophobicContact CB-CE2 4.37Å; Q64-Y166 WeakPolarHBondContact O-CE2 3.17Å; Q64-Y166 PolarHBondContact O-OH 3.3Å; Q64-G210 PolarHBondContact N-O 3.37Å; Q64-L212 HydrophobicContact CB-CB 3.82Å; Q64-L212 HydrophobicContact CG-CB 3.71Å; Q64-L212 HydrophobicContact CG-CD2 4.44Å
65	S	96.5	Very high	95.8	Very high	98 Å²	98	59.5 Å²	59.5	69%	0.685	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-69.6	153.8	168.7	-62.3	0	0	0	0	110.6
66	P	96.4	Very high	95.8	Very high	67 Å²	67	59.7 Å²	59.7	44%	0.435	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-57.1	131	174.6	-21.9	31.1	0	0	0	111	V68 Y166	P66-V68 PolarHBondContact O-N 2.82Å; P66-Y166 HydrophobicContact CB-CD1 4.27Å; P66-Y166 HydrophobicContact CB-CE1 3.7Å; P66-Y166 WeakPolarHBondContact CD-OH 2.79Å; P66-Y166 HydrophobicContact CG-CE1 3.7Å
67	P	94.5	Very high	95.7	Very high	56 Å²	56	66.2 Å²	66.2	36%	0.364	35%	0.351	S	S	.	.	S	Bend	trans	-74.5	-13.5	-176.1	27.3	-33.6	0	0	0	113.6	L156 Y166 L212	P67-L156 HydrophobicContact CB-CD1 4.46Å; P67-L156 HydrophobicContact CB-CD2 4.36Å; P67-L156 HydrophobicContact CG-CD1 3.51Å; P67-L156 HydrophobicContact CG-CD2 3.84Å; P67-L156 HydrophobicContact CG-CG 4.32Å; P67-Y166 HydrophobicContact CG-CG 4.37Å; P67-L212 HydrophobicContact CG-CD1 4.31Å
68	V	94.9	Very high	95.4	Very high	19 Å²	19	68.6 Å²	68.6	12%	0.115	36%	0.363	C	S	.	.	S	Bend	trans	-133.5	134.2	-177.4	-177.9	0	0	0	0	109.4	P66 T72 F73 L137 A139 L156	P66-V68 PolarHBondContact O-N 2.82Å; V68-T72 WeakPolarHBondContact CG1-OG1 3.48Å; V68-F73 HydrophobicContact CB-CE2 3.97Å; V68-F73 HydrophobicContact CB-CZ 4.16Å; V68-F73 HydrophobicContact CG1-CD2 4.42Å; V68-F73 HydrophobicContact CG1-CE2 3.53Å; V68-F73 HydrophobicContact CG1-CZ 3.91Å; V68-L137 HydrophobicContact CG2-CD1 3.96Å; V68-L137 HydrophobicContact CG2-CD2 4.13Å; V68-A139 HydrophobicContact CG2-CB 4.3Å; V68-L156 HydrophobicContact CG2-CD2 3.39Å
69	S	93.3	Very high	95.1	Very high	72 Å²	72	73 Å²	73	50%	0.503	39%	0.387	S	S	.	.			trans	-67.9	142.3	179.1	-176.9	0	0	0	0	112.1	D71 T72 F73	S69-D71 VanDerWaalsContact C-N 3.28Å; S69-D71 WeakPolarHBondContact CB-OD1 3.47Å; S69-D71 PolarHBondContact O-N 2.83Å; S69-D71 PolarHBondContact OG-OD1 2.81Å; S69-T72 PolarHBondContact O-N 2.78Å; S69-T72 PolarHBondContact O-OG1 3.37Å; S69-F73 WeakPolarHBondContact O-CD2 3.48Å
70	N	92	Very high	94.8	Very high	102 Å²	102	74 Å²	74	55%	0.545	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-63.9	-29.5	-174.8	-77.3	-22.9	0	0	0	113.9	T72 R141	N70-T72 PolarHBondContact O-N 2.79Å; N70-R141 PolarHBondContact OD1-NH1 3.27Å; N70-R141 PolarHBondContact OD1-NH2 3.22Å
71	D	92.6	Very high	94.7	Very high	130 Å²	130	78 Å²	78	70%	0.695	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-69.5	-14.9	179.8	64.8	-28.5	0	0	0	113.9	S69 F73	S69-D71 VanDerWaalsContact C-N 3.28Å; S69-D71 WeakPolarHBondContact CB-OD1 3.47Å; S69-D71 PolarHBondContact O-N 2.83Å; S69-D71 PolarHBondContact OG-OD1 2.81Å; D71-F73 VanDerWaalsContact C-N 3.34Å
72	T	94.1	Very high	94.6	Very high	35 Å²	35	76.4 Å²	76.4	22%	0.215	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-82.8	-13.1	-178.6	69.6	0	0	0	0	114	V68 S69 N70 S132 R134	V68-T72 WeakPolarHBondContact CG1-OG1 3.48Å; S69-T72 PolarHBondContact O-N 2.78Å; S69-T72 PolarHBondContact O-OG1 3.37Å; N70-T72 PolarHBondContact O-N 2.79Å; T72-S132 WeakPolarHBondContact CB-OG 3.36Å; T72-S132 WeakPolarHBondContact O-CB 3.43Å; T72-S132 PolarHBondContact O-OG 2.88Å; T72-S132 PolarHBondContact OG1-OG 3.05Å; T72-R134 PolarHBondContact O-NH2 3.48Å; T72-R134 VanDerWaalsContact O-NH2 3.08Å
73	F	97.1	Very high	94.6	Very high	22 Å²	22	80.3 Å²	80.3	10%	0.096	45%	0.446	C	S	.	.			trans	-91	141.2	-173.4	-74	-88.4	0	0	0	112.6	V68 S69 D71 E130 A139 R141 T154	V68-F73 HydrophobicContact CB-CE2 3.97Å; V68-F73 HydrophobicContact CB-CZ 4.16Å; V68-F73 HydrophobicContact CG1-CD2 4.42Å; V68-F73 HydrophobicContact CG1-CE2 3.53Å; V68-F73 HydrophobicContact CG1-CZ 3.91Å; S69-F73 WeakPolarHBondContact O-CD2 3.48Å; D71-F73 VanDerWaalsContact C-N 3.34Å; F73-E130 HydrophobicContact CB-CB 4.12Å; F73-E130 HydrophobicContact CD1-CB 3.93Å; F73-E130 HydrophobicContact CG-CB 4.35Å; F73-A139 HydrophobicContact CE1-CB 3.68Å; F73-A139 HydrophobicContact CZ-CB 3.65Å; F73-R141 HydrophobicContact CD1-CB 4.21Å; F73-R141 HydrophobicContact CE1-CB 3.8Å; F73-R141 VanDerWaalsContact CE2-CZ 3.42Å; F73-R141 HydrophobicContact CZ-CB 4.43Å; F73-T154 HydrophobicContact CE1-CG2 4.42Å; F73-T154 HydrophobicContact CZ-CG2 4.01Å
74	E	96.3	Very high	94.7	Very high	130 Å²	130	72.1 Å²	72.1	61%	0.607	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.3	172.4	-66	172.1	-166	0	0	109.3	E130 I131	E74-E130 CarbonylContact O-C 3.51Å; E74-E130 VanDerWaalsContact O-CA 3.29Å; E74-E130 WeakPolarHBondContact O-CA 3.49Å; E74-I131 PolarHBondContact N-O 3.16Å; E74-I131 PolarHBondContact O-N 2.83Å
75	K	95.7	Very high	94.7	Very high	150 Å²	150	71.9 Å²	71.9	65%	0.652	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.5	172.9	-68.7	-175.3	-178.5	-174.6	0	109.7	L129 E130	K75-L129 WeakPolarHBondContact CA-O 3.24Å; K75-E130 HydrophobicContact CG-CG 3.8Å
76	V	94.7	Very high	94.7	Very high	56 Å²	56	68.8 Å²	68.8	34%	0.339	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	167.9	-178.9	-61.7	0	0	0	0	110.7	L129 I131	V76-L129 HydrophobicContact CG2-CB 3.91Å; V76-L129 HydrophobicContact CG2-CD2 3.66Å; V76-L129 HydrophobicContact CG2-CG 3.57Å; V76-L129 PolarHBondContact N-O 2.93Å; V76-I131 HydrophobicContact CG2-CD1 3.69Å; V76-I131 HydrophobicContact CG2-CG1 3.8Å
77	D	93.5	Very high	94.6	Very high	137 Å²	137	69.4 Å²	69.4	73%	0.733	39%	0.394	S	S	*	.			trans	-63.3	143.2	172.3	-65.3	-37	0	0	0	111	D79 L129	D77-D79 PolarHBondContact O-N 3.19Å; D77-L129 WeakPolarHBondContact O-CD2 3.42Å
78	I	90.1	Very high	94.7	Very high	51 Å²	51	66.8 Å²	66.8	26%	0.262	38%	0.376	S	S	.	.	S	Bend	trans	-68.5	-22	-173.9	-57.5	-179.6	0	0	0	111.6	D101 P102 Q126	I78-D101 CarbonylContact O-C 3.54Å; I78-P102 HydrophobicContact CG2-CB 4.43Å; I78-Q126 WeakPolarHBondContact CD1-O 3.29Å; I78-Q126 HydrophobicContact CG2-CB 3.83Å; I78-Q126 HydrophobicContact CG2-CG 3.98Å
79	D	92.8	Very high	94.8	Very high	94 Å²	94	69.9 Å²	69.9	50%	0.503	39%	0.389	S	S	.	.	S	Bend	trans	-111.6	115.9	171.6	-175.6	-1.5	0	0	0	109.4	D77 H99 I100 P102	D77-D79 PolarHBondContact O-N 3.19Å; D79-H99 IonicContact OD1-CE1 3.9Å; D79-H99 PolarHBondContact OD1-CE1 3.04Å; D79-H99 IonicContact OD1-ND1 3.51Å; D79-H99 IonicContact OD1-NE2 3.78Å; D79-I100 WeakPolarHBondContact CA-O 3.41Å; D79-P102 HydrophobicContact CB-CG 4.16Å
80	G	91.3	Very high	94.9	Very high	25 Å²	25	66.5 Å²	66.5	26%	0.258	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	161.4	-174.8	0	0	0	0	0	115.5	H99 I100	G80-H99 WeakPolarHBondContact O-CA 3.36Å; G80-H99 PolarHBondContact O-ND1 3.08Å; G80-I100 PolarHBondContact N-O 3.24Å; G80-I100 VanDerWaalsContact N-O 3.08Å; G80-I100 PolarHBondContact O-N 2.53Å
81	S	94.9	Very high	95	Very high	83 Å²	83	61.8 Å²	61.8	58%	0.58	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	136.5	170.6	-69.2	0	0	0	0	110.6	L98	S81-L98 CarbonylContact C-O 3.52Å; S81-L98 WeakPolarHBondContact CA-O 3.43Å
82	V	95.9	Very high	94.9	Very high	14 Å²	14	57.8 Å²	57.8	9%	0.085	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.7	178.3	-173.8	0	0	0	0	108.7	L98 I100 I131 L138	V82-L98 HydrophobicContact CB-CB 4.38Å; V82-L98 PolarHBondContact N-O 3.18Å; V82-L98 PolarHBondContact O-N 3.19Å; V82-I100 HydrophobicContact CG2-CD1 3.76Å; V82-I100 HydrophobicContact CG2-CG1 4.45Å; V82-I131 HydrophobicContact CG2-CD1 3.49Å; V82-I131 VanDerWaalsContact CG2-CD1 3.49Å; V82-L138 HydrophobicContact CG1-CD1 4.12Å; V82-L138 HydrophobicContact CG1-CD2 4.3Å
83	V	97.1	Very high	94.9	Very high	103 Å²	103	56.5 Å²	56.5	62%	0.624	32%	0.32	S	S	*	.			trans	-99.4	110.5	168.6	-179.8	0	0	0	0	107.2	N133	V83-N133 PolarHBondContact O-ND2 3.46Å
84	P	97.2	Very high	94.8	Very high	10 Å²	10	57.9 Å²	57.9	7%	0.065	33%	0.329	C	S	.	.			trans	-62.7	150.2	179.7	-10.7	21.8	0	0	0	111.1	F86 I88 N96 L98 N133 L138	P84-F86 WeakPolarHBondContact CB-O 3.43Å; P84-F86 PolarHBondContact O-N 3.42Å; P84-I88 HydrophobicContact CB-CD1 3.92Å; P84-I88 HydrophobicContact CB-CG1 4.36Å; P84-I88 HydrophobicContact CG-CD1 3.44Å; P84-I88 VanDerWaalsContact CG-CD1 3.44Å; P84-I88 HydrophobicContact CG-CG1 4.27Å; P84-N96 WeakPolarHBondContact CD-O 3.46Å; P84-L98 HydrophobicContact CG-CD1 3.35Å; P84-N133 WeakPolarHBondContact CA-OD1 3.21Å; P84-L138 HydrophobicContact CB-CD2 4.3Å; P84-L138 HydrophobicContact CG-CD2 4.3Å
85	A	97	Very high	94.9	Very high	56 Å²	56	51.7 Å²	51.7	46%	0.463	30%	0.3	S	S	.	.	S	Bend	trans	-69.4	2	176.9	0	0	0	0	0	114	N133	A85-N133 PolarHBondContact N-OD1 3.11Å
86	F	96.6	Very high	95	Very high	33 Å²	33	47.7 Å²	47.7	15%	0.145	29%	0.286	C	S	.	.	S	Bend	trans	-152.4	165.6	-177.1	53	-93.4	0	0	0	110.6	P84 I88 R134 K135 L138 I157 P159	P84-F86 WeakPolarHBondContact CB-O 3.43Å; P84-F86 PolarHBondContact O-N 3.42Å; F86-I88 HydrophobicContact CD2-CG1 3.86Å; F86-I88 HydrophobicContact CE2-CB 4.49Å; F86-I88 HydrophobicContact CE2-CD1 4.39Å; F86-I88 HydrophobicContact CE2-CG1 3.41Å; F86-I88 VanDerWaalsContact CE2-CG1 3.41Å; F86-I88 HydrophobicContact CZ-CG1 4.31Å; F86-R134 WeakPolarHBondContact CD1-O 3.44Å; F86-R134 VanDerWaalsContact CE1-O 3.24Å; F86-R134 WeakPolarHBondContact CE1-O 3.4Å; F86-K135 WeakPolarHBondContact CD1-O 3.31Å; F86-L138 HydrophobicContact CE1-CB 4.4Å; F86-L138 HydrophobicContact CZ-CB 4.07Å; F86-I157 WeakPolarHBondContact CZ-O 3.46Å; F86-P159 HydrophobicContact CB-CG 4.38Å; F86-P159 HydrophobicContact CD1-CG 4.14Å; F86-P159 HydrophobicContact CD2-CB 3.62Å; F86-P159 HydrophobicContact CD2-CG 3.51Å; F86-P159 HydrophobicContact CE1-CG 4.31Å; F86-P159 HydrophobicContact CE2-CB 3.99Å; F86-P159 HydrophobicContact CE2-CG 3.65Å; F86-P159 HydrophobicContact CG-CB 4.18Å; F86-P159 HydrophobicContact CG-CG 3.76Å; F86-P159 HydrophobicContact CZ-CG 4.08Å
87	L	95.3	Very high	95.1	Very high	80 Å²	80	49.8 Å²	49.8	42%	0.419	29%	0.288	S	S	.	.			trans	-83	116.3	173.1	-168.5	68.7	0	0	0	109.6	D94 N96	L87-D94 HydrophobicContact CD1-CB 4.07Å; L87-D94 HydrophobicContact CD2-CB 4.16Å; L87-D94 WeakPolarHBondContact CD2-OD2 3.36Å; L87-D94 HydrophobicContact CG-CB 4.2Å; L87-N96 HydrophobicContact CD1-CB 4.19Å
88	I	97.1	Very high	95.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136	177.5	-62.2	154.5	0	0	0	108.9	P84 F86 F90 D94 V95 L98 I157	P84-I88 HydrophobicContact CB-CD1 3.92Å; P84-I88 HydrophobicContact CB-CG1 4.36Å; P84-I88 HydrophobicContact CG-CD1 3.44Å; P84-I88 VanDerWaalsContact CG-CD1 3.44Å; P84-I88 HydrophobicContact CG-CG1 4.27Å; F86-I88 HydrophobicContact CD2-CG1 3.86Å; F86-I88 HydrophobicContact CE2-CB 4.49Å; F86-I88 HydrophobicContact CE2-CD1 4.39Å; F86-I88 HydrophobicContact CE2-CG1 3.41Å; F86-I88 VanDerWaalsContact CE2-CG1 3.41Å; F86-I88 HydrophobicContact CZ-CG1 4.31Å; I88-F90 HydrophobicContact CG2-CB 4.18Å; I88-D94 CarbonylContact O-C 3.45Å; I88-D94 WeakPolarHBondContact O-CA 3.32Å; I88-V95 HydrophobicContact CB-CB 4.01Å; I88-V95 HydrophobicContact CD1-CG1 4.16Å; I88-V95 HydrophobicContact CG2-CB 4.37Å; I88-V95 PolarHBondContact N-O 2.8Å; I88-V95 VanDerWaalsContact N-O 3.16Å; I88-V95 PolarHBondContact O-N 2.9Å; I88-L98 HydrophobicContact CD1-CD1 3.89Å; I88-I157 HydrophobicContact CB-CG2 4.44Å; I88-I157 HydrophobicContact CD1-CG2 3.73Å; I88-I157 HydrophobicContact CG1-CG2 3.85Å; I88-I157 HydrophobicContact CG2-CG2 3.68Å
89	K	95.7	Very high	95.6	Very high	85 Å²	85	43.2 Å²	43.2	37%	0.37	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	108.6	166.4	-61.5	-56.5	-170.7	-174.3	0	109.9	N93 D94 P159 G161	K89-N93 CarbonylContact C-O 3.52Å; K89-N93 WeakPolarHBondContact CA-O 3.39Å; K89-D94 WeakPolarHBondContact CD-OD1 3.48Å; K89-D94 WeakPolarHBondContact CE-OD1 3.37Å; K89-D94 IonicContact NZ-OD1 2.66Å; K89-D94 PolarHBondContact NZ-OD1 3.32Å; K89-D94 IonicContact NZ-OD2 3.5Å; K89-D94 PolarHBondContact NZ-OD2 3.03Å; K89-P159 PolarHBondContact N-O 3.34Å; K89-G161 WeakPolarHBondContact O-CA 3.24Å
90	F	96.1	Very high	95.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.8	-176.6	-175.9	-102.8	0	0	0	110.6	I88 G92 N93 V95 M108 I163 F183 T184	I88-F90 HydrophobicContact CG2-CB 4.18Å; F90-G92 PolarHBondContact O-N 2.88Å; F90-N93 PolarHBondContact N-O 3.26Å; F90-N93 WeakPolarHBondContact O-CB 3.3Å; F90-N93 PolarHBondContact O-N 2.84Å; F90-V95 HydrophobicContact CB-CG2 3.9Å; F90-M108 HydrophobicContact CB-SD 4.26Å; F90-M108 HydrophobicContact CD1-SD 3.89Å; F90-M108 HydrophobicContact CD2-CE 4.38Å; F90-M108 HydrophobicContact CD2-SD 3.87Å; F90-M108 HydrophobicContact CE1-SD 4.12Å; F90-M108 HydrophobicContact CE2-CE 4.25Å; F90-M108 HydrophobicContact CE2-SD 4.07Å; F90-M108 HydrophobicContact CG-SD 3.74Å; F90-M108 HydrophobicContact CZ-SD 4.17Å; F90-I163 HydrophobicContact CD2-CD1 3.96Å; F90-I163 HydrophobicContact CD2-CG1 4.15Å; F90-I163 HydrophobicContact CE2-CD1 4.06Å; F90-I163 HydrophobicContact CE2-CG1 3.96Å; F90-F183 AromaticContact CE2-CD2 3.76Å; F90-F183 HydrophobicContact CE2-CD2 3.76Å; F90-F183 HydrophobicContact CE2-CE2 4.22Å; F90-F183 AromaticContact CZ-CD2 3.69Å; F90-F183 HydrophobicContact CZ-CD2 3.69Å; F90-F183 HydrophobicContact CZ-CE2 4.43Å; F90-T184 WeakPolarHBondContact CE1-O 3.08Å; F90-T184 WeakPolarHBondContact CZ-O 3.46Å
91	Y	94.2	Very high	95.8	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.016	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	32.7	-169.4	-75.4	-84.2	0	0	0	113.9	Y55 Y56 N93 F183 I187 A198 I200	Y55-Y91 AromaticContact CD1-CD1 3.85Å; Y55-Y91 HydrophobicContact CD1-CD1 3.85Å; Y55-Y91 HydrophobicContact CD1-CE1 4.42Å; Y55-Y91 HydrophobicContact CD1-CG 4.45Å; Y55-Y91 AromaticContact CD2-CD1 3.87Å; Y55-Y91 HydrophobicContact CD2-CD1 3.87Å; Y55-Y91 AromaticContact CG-CD1 3.49Å; Y55-Y91 HydrophobicContact CG-CD1 3.49Å; Y55-Y91 VanDerWaalsContact CG-CD1 3.49Å; Y55-Y91 HydrophobicContact CG-CE1 4.01Å; Y55-Y91 HydrophobicContact CG-CG 4.43Å; Y56-Y91 HydrophobicContact CD2-CD1 4.29Å; Y56-Y91 AromaticContact CD2-CE1 3.75Å; Y56-Y91 HydrophobicContact CD2-CE1 3.75Å; Y56-Y91 HydrophobicContact CD2-CE2 4.32Å; Y56-Y91 AromaticContact CD2-CZ 3.79Å; Y56-Y91 AromaticContact CE2-CD1 3.82Å; Y56-Y91 HydrophobicContact CE2-CD1 3.82Å; Y56-Y91 AromaticContact CE2-CD2 3.85Å; Y56-Y91 HydrophobicContact CE2-CD2 3.85Å; Y56-Y91 AromaticContact CE2-CE1 3.66Å; Y56-Y91 HydrophobicContact CE2-CE1 3.66Å; Y56-Y91 AromaticContact CE2-CE2 3.72Å; Y56-Y91 HydrophobicContact CE2-CE2 3.72Å; Y56-Y91 AromaticContact CE2-CG 3.96Å; Y56-Y91 HydrophobicContact CE2-CG 3.96Å; Y56-Y91 AromaticContact CE2-CZ 3.63Å; Y91-N93 PolarHBondContact O-N 3.32Å; Y91-F183 AromaticContact CE2-CD2 3.68Å; Y91-F183 HydrophobicContact CE2-CD2 3.68Å; Y91-F183 AromaticContact CE2-CE2 3.56Å; Y91-F183 HydrophobicContact CE2-CE2 3.56Å; Y91-F183 AromaticContact CZ-CE2 3.74Å; Y91-F183 WeakPolarHBondContact OH-CE2 3.24Å; Y91-I187 HydrophobicContact CD1-CD1 3.6Å; Y91-I187 HydrophobicContact CE1-CD1 4.48Å; Y91-I187 HydrophobicContact CG-CD1 4.08Å; Y91-A198 HydrophobicContact CD1-CB 4.38Å; Y91-A198 HydrophobicContact CE1-CB 3.64Å; Y91-I200 WeakPolarHBondContact OH-CD1 3.41Å; Y91-I200 WeakPolarHBondContact OH-CG1 3.36Å
92	G	90.8	Very high	95.5	Very high	46 Å²	46	37.3 Å²	37.3	47%	0.474	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-5.1	-179.6	0	0	0	0	0	114.5	Y55 F90	Y55-G92 WeakPolarHBondContact OH-CA 3.25Å; Y55-G92 PolarHBondContact OH-N 2.84Å; F90-G92 PolarHBondContact O-N 2.88Å
93	N	93.4	Very high	95.1	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.037	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	150.2	170.2	-61.4	-75.6	0	0	0	111	K89 F90 Y91 V114 A186 K188	K89-N93 CarbonylContact C-O 3.52Å; K89-N93 WeakPolarHBondContact CA-O 3.39Å; F90-N93 PolarHBondContact N-O 3.26Å; F90-N93 WeakPolarHBondContact O-CB 3.3Å; F90-N93 PolarHBondContact O-N 2.84Å; Y91-N93 PolarHBondContact O-N 3.32Å; N93-V114 HydrophobicContact CB-CB 4.01Å; N93-V114 HydrophobicContact CB-CG1 4.14Å; N93-V114 HydrophobicContact CB-CG2 4.2Å; N93-A186 PolarHBondContact ND2-O 3.25Å; N93-K188 WeakPolarHBondContact OD1-CD 3.45Å; N93-K188 WeakPolarHBondContact OD1-CE 3.15Å; N93-K188 PolarHBondContact OD1-NZ 3.45Å
94	D	96	Very high	94.7	Very high	52 Å²	52	34 Å²	34	28%	0.278	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.9	171.7	-67.3	5.7	0	0	0	108.2	L87 I88 K89 N110	L87-D94 HydrophobicContact CD1-CB 4.07Å; L87-D94 HydrophobicContact CD2-CB 4.16Å; L87-D94 WeakPolarHBondContact CD2-OD2 3.36Å; L87-D94 HydrophobicContact CG-CB 4.2Å; I88-D94 CarbonylContact O-C 3.45Å; I88-D94 WeakPolarHBondContact O-CA 3.32Å; K89-D94 WeakPolarHBondContact CD-OD1 3.48Å; K89-D94 WeakPolarHBondContact CE-OD1 3.37Å; K89-D94 IonicContact NZ-OD1 2.66Å; K89-D94 PolarHBondContact NZ-OD1 3.32Å; K89-D94 IonicContact NZ-OD2 3.5Å; K89-D94 PolarHBondContact NZ-OD2 3.03Å; D94-N110 WeakPolarHBondContact O-CB 3.37Å; D94-N110 VanDerWaalsContact O-CG 3.28Å; D94-N110 PolarHBondContact O-ND2 3.14Å
95	V	97.5	Very high	94.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.9	175.2	169.9	0	0	0	0	108.6	I88 F90 L98 M108 Y109 V114	I88-V95 HydrophobicContact CB-CB 4.01Å; I88-V95 HydrophobicContact CD1-CG1 4.16Å; I88-V95 HydrophobicContact CG2-CB 4.37Å; I88-V95 PolarHBondContact N-O 2.8Å; I88-V95 VanDerWaalsContact N-O 3.16Å; I88-V95 PolarHBondContact O-N 2.9Å; F90-V95 HydrophobicContact CB-CG2 3.9Å; V95-L98 HydrophobicContact CG1-CD1 4.25Å; V95-L98 HydrophobicContact CG1-CG 4.4Å; V95-M108 HydrophobicContact CG1-CB 3.87Å; V95-M108 HydrophobicContact CG1-CG 4.29Å; V95-M108 HydrophobicContact CG1-SD 4.44Å; V95-M108 HydrophobicContact CG2-CB 3.9Å; V95-M108 HydrophobicContact CG2-SD 4.32Å; V95-Y109 WeakPolarHBondContact CA-O 3.05Å; V95-V114 HydrophobicContact CG2-CG2 3.37Å
96	N	96.8	Very high	94.6	Very high	65 Å²	65	31.9 Å²	31.9	35%	0.348	17%	0.173	S	C	.	.			trans	-120.7	-8.3	-177.3	64.2	13.3	0	0	0	113.6	P84 L87 Y109 N110	P84-N96 WeakPolarHBondContact CD-O 3.46Å; L87-N96 HydrophobicContact CD1-CB 4.19Å; N96-Y109 PolarHBondContact N-O 3.41Å; N96-Y109 PolarHBondContact OD1-O 3.47Å; N96-N110 PolarHBondContact ND2-OD1 3.48Å
97	R	97.6	Very high	94.7	Very high	101 Å²	101	33.5 Å²	33.5	38%	0.381	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	141.2	177.4	-177.9	176	66.3	-105.6	-2.2	109.7	Y109	R97-Y109 PolarHBondContact N-O 3.34Å; R97-Y109 PolarHBondContact O-N 2.8Å
98	L	98	Very high	94.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	153.2	167.6	-59.3	86.3	0	0	0	109	S81 V82 P84 I88 V95 I106 R107 M108 L138 I140 I157	S81-L98 CarbonylContact C-O 3.52Å; S81-L98 WeakPolarHBondContact CA-O 3.43Å; V82-L98 HydrophobicContact CB-CB 4.38Å; V82-L98 PolarHBondContact N-O 3.18Å; V82-L98 PolarHBondContact O-N 3.19Å; P84-L98 HydrophobicContact CG-CD1 3.35Å; I88-L98 HydrophobicContact CD1-CD1 3.89Å; V95-L98 HydrophobicContact CG1-CD1 4.25Å; V95-L98 HydrophobicContact CG1-CG 4.4Å; L98-I106 HydrophobicContact CB-CG2 4.22Å; L98-I106 HydrophobicContact CD2-CG2 3.56Å; L98-I106 HydrophobicContact CG-CG2 4.45Å; L98-R107 CarbonylContact C-O 3.58Å; L98-R107 WeakPolarHBondContact CA-O 3.33Å; L98-M108 HydrophobicContact CD2-CE 4.05Å; L98-M108 HydrophobicContact CD2-CG 3.99Å; L98-M108 HydrophobicContact CG-CG 4.19Å; L98-L138 HydrophobicContact CD1-CD2 3.87Å; L98-L138 HydrophobicContact CD2-CD2 4.16Å; L98-I140 HydrophobicContact CD2-CD1 4.21Å; L98-I157 HydrophobicContact CD2-CD1 3.66Å
99	H	97.3	Very high	94.8	Very high	50 Å²	50	31.8 Å²	31.8	23%	0.231	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.1	170.5	178	58.9	0	0	0	108.3	D79 G80 I106 R107 Y109	D79-H99 IonicContact OD1-CE1 3.9Å; D79-H99 PolarHBondContact OD1-CE1 3.04Å; D79-H99 IonicContact OD1-ND1 3.51Å; D79-H99 IonicContact OD1-NE2 3.78Å; G80-H99 WeakPolarHBondContact O-CA 3.36Å; G80-H99 PolarHBondContact O-ND1 3.08Å; H99-I106 CarbonylContact O-C 3.41Å; H99-R107 PolarHBondContact N-O 2.79Å; H99-R107 PolarHBondContact O-N 2.93Å; H99-Y109 HydrophobicContact CB-CE2 3.91Å
100	I	95.5	Very high	94.7	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122	-178.4	-52.5	167.4	0	0	0	105.8	D79 G80 V82 T105 I106 L129 I131 I140	D79-I100 WeakPolarHBondContact CA-O 3.41Å; G80-I100 PolarHBondContact N-O 3.24Å; G80-I100 VanDerWaalsContact N-O 3.08Å; G80-I100 PolarHBondContact O-N 2.53Å; V82-I100 HydrophobicContact CG2-CD1 3.76Å; V82-I100 HydrophobicContact CG2-CG1 4.45Å; I100-T105 WeakPolarHBondContact CA-O 3.05Å; I100-I106 HydrophobicContact CG1-CG1 4.21Å; I100-I106 HydrophobicContact CG1-CG2 4.24Å; I100-I106 HydrophobicContact CG2-CG1 4.38Å; I100-L129 HydrophobicContact CB-CD2 4.1Å; I100-L129 HydrophobicContact CD1-CD1 4.34Å; I100-L129 HydrophobicContact CD1-CD2 3.8Å; I100-L129 HydrophobicContact CG2-CD1 4.28Å; I100-L129 HydrophobicContact CG2-CD2 3.75Å; I100-I131 HydrophobicContact CD1-CD1 3.74Å; I100-I140 HydrophobicContact CD1-CD1 3.98Å; I100-I140 HydrophobicContact CD1-CG1 4.3Å; I100-I140 HydrophobicContact CD1-CG2 3.8Å
101	D	91.4	Very high	94.5	Very high	18 Å²	18	39 Å²	39	10%	0.096	20%	0.204	C	C	.	.			trans	-96.2	167.9	179.9	76.3	22.3	0	0	0	112.3	I78 S103 G104 T105 R107	I78-D101 CarbonylContact O-C 3.54Å; D101-S103 PolarHBondContact O-N 3.11Å; D101-S103 VanDerWaalsContact O-N 3.15Å; D101-S103 WeakPolarHBondContact OD1-CA 3.32Å; D101-S103 WeakPolarHBondContact OD1-CB 3.26Å; D101-S103 PolarHBondContact OD1-N 3Å; D101-S103 PolarHBondContact OD1-OG 3.12Å; D101-S103 PolarHBondContact OD2-OG 2.87Å; D101-G104 PolarHBondContact O-N 3.13Å; D101-G104 PolarHBondContact OD1-N 2.96Å; D101-T105 PolarHBondContact N-O 2.92Å; D101-T105 VanDerWaalsContact N-O 3.08Å; D101-T105 PolarHBondContact OD1-N 2.85Å; D101-T105 WeakPolarHBondContact OD2-CB 3.25Å; D101-R107 IonicContact OD2-CZ 3.78Å; D101-R107 IonicContact OD2-NH1 3.97Å; D101-R107 PolarHBondContact OD2-NH1 3.1Å; D101-R107 IonicContact OD2-NH2 3.05Å; D101-R107 PolarHBondContact OD2-NH2 3.03Å
102	P	90	Very high	94.4	Very high	59 Å²	59	40.5 Å²	40.5	38%	0.383	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26	179.4	-28.8	37	0	0	0	115.8	I78 D79 G104 Q126	I78-P102 HydrophobicContact CG2-CB 4.43Å; D79-P102 HydrophobicContact CB-CG 4.16Å; P102-G104 PolarHBondContact O-N 3.03Å; P102-Q126 WeakPolarHBondContact O-CB 3.48Å; P102-Q126 PolarHBondContact O-N 3.04Å
103	S	87	Confident	94.7	Very high	47 Å²	47	42.3 Å²	42.3	33%	0.329	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-14.9	177.4	75.1	0	0	0	0	112.4	D101	D101-S103 PolarHBondContact O-N 3.11Å; D101-S103 VanDerWaalsContact O-N 3.15Å; D101-S103 WeakPolarHBondContact OD1-CA 3.32Å; D101-S103 WeakPolarHBondContact OD1-CB 3.26Å; D101-S103 PolarHBondContact OD1-N 3Å; D101-S103 PolarHBondContact OD1-OG 3.12Å; D101-S103 PolarHBondContact OD2-OG 2.87Å
104	G	89.4	Confident	94.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.			trans	95.4	8.1	-178.1	0	0	0	0	0	114.1	D101 P102 I106 Q142 Y144	D101-G104 PolarHBondContact O-N 3.13Å; D101-G104 PolarHBondContact OD1-N 2.96Å; P102-G104 PolarHBondContact O-N 3.03Å; G104-I106 PolarHBondContact O-N 2.91Å; G104-Q142 VanDerWaalsContact C-NE2 3.34Å; G104-Q142 PolarHBondContact O-NE2 2.9Å; G104-Y144 WeakPolarHBondContact CA-OH 3.44Å
105	T	94.1	Very high	94.8	Very high	21 Å²	21	40 Å²	40	13%	0.129	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	123.7	171.7	-61.1	0	0	0	0	109.3	I100 D101 R107 D118	I100-T105 WeakPolarHBondContact CA-O 3.05Å; D101-T105 PolarHBondContact N-O 2.92Å; D101-T105 VanDerWaalsContact N-O 3.08Å; D101-T105 PolarHBondContact OD1-N 2.85Å; D101-T105 WeakPolarHBondContact OD2-CB 3.25Å; T105-R107 HydrophobicContact CG2-CG 3.83Å; T105-D118 VanDerWaalsContact CB-OD1 3.29Å; T105-D118 WeakPolarHBondContact CB-OD1 3.2Å; T105-D118 WeakPolarHBondContact CG2-OD1 3.07Å; T105-D118 PolarHBondContact OG1-OD1 2.75Å
106	I	97.1	Very high	94.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	101.5	173.6	-52.7	169	0	0	0	107.5	L98 H99 I100 G104 G116 I117 I140	L98-I106 HydrophobicContact CB-CG2 4.22Å; L98-I106 HydrophobicContact CD2-CG2 3.56Å; L98-I106 HydrophobicContact CG-CG2 4.45Å; H99-I106 CarbonylContact O-C 3.41Å; I100-I106 HydrophobicContact CG1-CG1 4.21Å; I100-I106 HydrophobicContact CG1-CG2 4.24Å; I100-I106 HydrophobicContact CG2-CG1 4.38Å; G104-I106 PolarHBondContact O-N 2.91Å; I106-G116 CarbonylContact O-C 3.58Å; I106-G116 WeakPolarHBondContact O-CA 3.46Å; I106-I117 HydrophobicContact CB-CB 4.16Å; I106-I117 HydrophobicContact CD1-CB 4.23Å; I106-I117 HydrophobicContact CD1-CG2 4.22Å; I106-I117 PolarHBondContact N-O 2.82Å; I106-I117 PolarHBondContact O-N 2.93Å; I106-I140 HydrophobicContact CD1-CB 4.11Å; I106-I140 HydrophobicContact CD1-CD1 3.9Å; I106-I140 HydrophobicContact CD1-CG2 3.8Å; I106-I140 HydrophobicContact CG1-CG2 4.48Å; I106-I140 HydrophobicContact CG2-CD1 3.98Å
107	R	97.7	Very high	94.9	Very high	67 Å²	67	37 Å²	37	25%	0.253	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	134.7	176.5	-62.9	-172	-176	73.9	12.1	110.8	L98 H99 D101 T105 Y109	L98-R107 CarbonylContact C-O 3.58Å; L98-R107 WeakPolarHBondContact CA-O 3.33Å; H99-R107 PolarHBondContact N-O 2.79Å; H99-R107 PolarHBondContact O-N 2.93Å; D101-R107 IonicContact OD2-CZ 3.78Å; D101-R107 IonicContact OD2-NH1 3.97Å; D101-R107 PolarHBondContact OD2-NH1 3.1Å; D101-R107 IonicContact OD2-NH2 3.05Å; D101-R107 PolarHBondContact OD2-NH2 3.03Å; T105-R107 HydrophobicContact CG2-CG 3.83Å; R107-Y109 HydrophobicContact CB-CD2 4.35Å; R107-Y109 HydrophobicContact CB-CE2 3.42Å; R107-Y109 VanDerWaalsContact CB-CE2 3.42Å; R107-Y109 VanDerWaalsContact CD-OH 3.24Å; R107-Y109 WeakPolarHBondContact CD-OH 3.32Å
108	M	98	Very high	94.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.2	-179.3	-63.2	-167.8	-176.2	0	0	111.5	F90 V95 L98 Q113 V114 G115 I117 I157	F90-M108 HydrophobicContact CB-SD 4.26Å; F90-M108 HydrophobicContact CD1-SD 3.89Å; F90-M108 HydrophobicContact CD2-CE 4.38Å; F90-M108 HydrophobicContact CD2-SD 3.87Å; F90-M108 HydrophobicContact CE1-SD 4.12Å; F90-M108 HydrophobicContact CE2-CE 4.25Å; F90-M108 HydrophobicContact CE2-SD 4.07Å; F90-M108 HydrophobicContact CG-SD 3.74Å; F90-M108 HydrophobicContact CZ-SD 4.17Å; V95-M108 HydrophobicContact CG1-CB 3.87Å; V95-M108 HydrophobicContact CG1-CG 4.29Å; V95-M108 HydrophobicContact CG1-SD 4.44Å; V95-M108 HydrophobicContact CG2-CB 3.9Å; V95-M108 HydrophobicContact CG2-SD 4.32Å; L98-M108 HydrophobicContact CD2-CE 4.05Å; L98-M108 HydrophobicContact CD2-CG 3.99Å; L98-M108 HydrophobicContact CG-CG 4.19Å; M108-Q113 WeakPolarHBondContact O-CA 3.4Å; M108-V114 HydrophobicContact CB-CG2 4.39Å; M108-V114 PolarHBondContact O-N 2.93Å; M108-G115 PolarHBondContact N-O 2.8Å; M108-I117 HydrophobicContact CE-CD1 3.39Å; M108-I117 HydrophobicContact CE-CG1 3.82Å; M108-I157 HydrophobicContact CE-CD1 3.61Å; M108-I157 HydrophobicContact CE-CG1 4.3Å
109	Y	97.6	Very high	94.5	Very high	45 Å²	45	33.4 Å²	33.4	18%	0.176	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.8	-172.4	-64.8	-88	0	0	0	114.2	V95 N96 R97 H99 R107 G112 Q113	V95-Y109 WeakPolarHBondContact CA-O 3.05Å; N96-Y109 PolarHBondContact N-O 3.41Å; N96-Y109 PolarHBondContact OD1-O 3.47Å; R97-Y109 PolarHBondContact N-O 3.34Å; R97-Y109 PolarHBondContact O-N 2.8Å; H99-Y109 HydrophobicContact CB-CE2 3.91Å; R107-Y109 HydrophobicContact CB-CD2 4.35Å; R107-Y109 HydrophobicContact CB-CE2 3.42Å; R107-Y109 VanDerWaalsContact CB-CE2 3.42Å; R107-Y109 VanDerWaalsContact CD-OH 3.24Å; R107-Y109 WeakPolarHBondContact CD-OH 3.32Å; Y109-G112 WeakPolarHBondContact CA-O 3.41Å; Y109-Q113 HydrophobicContact CD1-CB 4.05Å; Y109-Q113 HydrophobicContact CE1-CB 3.69Å; Y109-Q113 HydrophobicContact CE1-CG 4.19Å
110	N	94.4	Very high	94	Very high	45 Å²	45	33.9 Å²	33.9	24%	0.241	18%	0.177	C	C	.	.	S	Bend	trans	-130	-114.2	159.1	-164.9	-11.1	0	0	0	108.8	D94 N96 G112 V114	D94-N110 WeakPolarHBondContact O-CB 3.37Å; D94-N110 VanDerWaalsContact O-CG 3.28Å; D94-N110 PolarHBondContact O-ND2 3.14Å; N96-N110 PolarHBondContact ND2-OD1 3.48Å; N110-G112 PolarHBondContact N-O 3.19Å; N110-G112 PolarHBondContact O-N 3.16Å; N110-V114 HydrophobicContact CB-CG1 4.34Å
111	E	91.1	Very high	93.5	Very high	192 Å²	192	34 Å²	34	90%	0.897	18%	0.178	S	C	*	.	S	Bend	trans	-65.3	-28.5	166.2	-63.9	-180	172.7	0	0	112.3
112	G	93	Very high	92.8	Very high	35 Å²	35	37.5 Å²	37.5	36%	0.361	19%	0.192	S	C	.	.	S	Bend	trans	-147.6	-174.4	174.4	0	0	0	0	0	110.5	Y109 N110 V114	Y109-G112 WeakPolarHBondContact CA-O 3.41Å; N110-G112 PolarHBondContact N-O 3.19Å; N110-G112 PolarHBondContact O-N 3.16Å; G112-V114 PolarHBondContact O-N 3.48Å
113	Q	95.2	Very high	91.9	Very high	84 Å²	84	39.4 Å²	39.4	39%	0.393	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	128	173.6	-169.1	-179.1	-18.8	0	0	109.2	M108 Y109 G115 W197	M108-Q113 WeakPolarHBondContact O-CA 3.4Å; Y109-Q113 HydrophobicContact CD1-CB 4.05Å; Y109-Q113 HydrophobicContact CE1-CB 3.69Å; Y109-Q113 HydrophobicContact CE1-CG 4.19Å; Q113-G115 PolarHBondContact NE2-O 2.86Å; Q113-W197 HydrophobicContact CG-CH2 4.16Å
114	V	95.6	Very high	91.2	Very high	10 Å²	10	40.8 Å²	40.8	6%	0.061	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-4.7	179.7	-61.9	0	0	0	0	112.5	N93 V95 M108 N110 G112 G185 A186	N93-V114 HydrophobicContact CB-CB 4.01Å; N93-V114 HydrophobicContact CB-CG1 4.14Å; N93-V114 HydrophobicContact CB-CG2 4.2Å; V95-V114 HydrophobicContact CG2-CG2 3.37Å; M108-V114 HydrophobicContact CB-CG2 4.39Å; M108-V114 PolarHBondContact O-N 2.93Å; N110-V114 HydrophobicContact CB-CG1 4.34Å; G112-V114 PolarHBondContact O-N 3.48Å; V114-G185 WeakPolarHBondContact O-CA 3.49Å; V114-A186 PolarHBondContact O-N 3.2Å
115	G	97.2	Very high	90.7	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.3	178	-176	0	0	0	0	0	114.2	M108 Q113 T184	M108-G115 PolarHBondContact N-O 2.8Å; Q113-G115 PolarHBondContact NE2-O 2.86Å; G115-T184 CarbonylContact C-O 3.56Å; G115-T184 WeakPolarHBondContact CA-O 3.46Å
116	G	97.5	Very high	90.2	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	155.6	168.9	0	0	0	0	0	112.6	I106 F183 T184	I106-G116 CarbonylContact O-C 3.58Å; I106-G116 WeakPolarHBondContact O-CA 3.46Å; G116-F183 CarbonylContact O-C 3.55Å; G116-F183 WeakPolarHBondContact O-CA 3.5Å; G116-F183 VanDerWaalsContact O-CB 3.26Å; G116-F183 WeakPolarHBondContact O-CB 3.46Å; G116-T184 PolarHBondContact N-O 3.49Å; G116-T184 PolarHBondContact O-N 3.33Å
117	I	97.8	Very high	89.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.5	166.4	-66.5	165.3	0	0	0	106.7	I106 M108 I157 I163 F165 F183	I106-I117 HydrophobicContact CB-CB 4.16Å; I106-I117 HydrophobicContact CD1-CB 4.23Å; I106-I117 HydrophobicContact CD1-CG2 4.22Å; I106-I117 PolarHBondContact N-O 2.82Å; I106-I117 PolarHBondContact O-N 2.93Å; M108-I117 HydrophobicContact CE-CD1 3.39Å; M108-I117 HydrophobicContact CE-CG1 3.82Å; I117-I157 HydrophobicContact CD1-CD1 3.97Å; I117-I157 HydrophobicContact CD1-CG1 4.07Å; I117-I163 HydrophobicContact CD1-CG2 4.14Å; I117-F165 HydrophobicContact CG2-CE1 3.46Å; I117-F165 VanDerWaalsContact CG2-CE1 3.46Å; I117-F165 HydrophobicContact CG2-CZ 3.79Å; I117-F183 HydrophobicContact CB-CB 4.4Å; I117-F183 HydrophobicContact CG1-CB 3.76Å
118	D	95.4	Very high	89.7	Confident	25 Å²	25	47.2 Å²	47.2	13%	0.134	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.6	175.8	-66.3	-79.1	0	0	0	108.5	T105 S181 W182	T105-D118 VanDerWaalsContact CB-OD1 3.29Å; T105-D118 WeakPolarHBondContact CB-OD1 3.2Å; T105-D118 WeakPolarHBondContact CG2-OD1 3.07Å; T105-D118 PolarHBondContact OG1-OD1 2.75Å; D118-S181 WeakPolarHBondContact O-CA 3.42Å; D118-W182 HydrophobicContact CB-CD2 4.01Å; D118-W182 HydrophobicContact CB-CG 4.38Å; D118-W182 HydrophobicContact CB-CH2 4.46Å; D118-W182 HydrophobicContact CB-CZ2 3.57Å; D118-W182 PolarHBondContact N-O 3.16Å; D118-W182 PolarHBondContact O-N 2.81Å; D118-W182 PolarHBondContact OD2-NE1 2.83Å
119	N	93.3	Very high	89.6	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.2	161.2	-56.4	-71.9	0	0	0	106.3	Q142 Y144 F151 V153 S155 F165 S181	N119-Q142 PolarHBondContact ND2-OE1 3.04Å; N119-Y144 PolarHBondContact O-OH 2.86Å; N119-F151 HydrophobicContact CB-CE1 4.3Å; N119-V153 HydrophobicContact CB-CG1 3.61Å; N119-S155 PolarHBondContact ND2-OG 3.25Å; N119-F165 WeakPolarHBondContact OD1-CD1 3.24Å; N119-F165 WeakPolarHBondContact OD1-CE1 3.48Å; N119-S181 WeakPolarHBondContact OD1-CB 3.32Å; N119-S181 PolarHBondContact OD1-OG 2.93Å
120	Y	86	Confident	89.5	Confident	60 Å²	60	46.4 Å²	46.4	24%	0.235	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	154.8	177.2	68.3	-63.3	0	0	0	111.2	K122 D180 W182	Y120-K122 HydrophobicContact CD2-CG 4.31Å; Y120-K122 HydrophobicContact CE2-CB 4.39Å; Y120-K122 HydrophobicContact CE2-CG 3.61Å; Y120-D180 HydrophobicContact CD1-CB 4.24Å; Y120-D180 HydrophobicContact CE1-CB 3.34Å; Y120-D180 PolarHBondContact N-O 3.08Å; Y120-D180 PolarHBondContact O-N 2.81Å; Y120-D180 PolarHBondContact OH-OD2 3.35Å; Y120-W182 AromaticContact CD1-CH2 3.94Å; Y120-W182 HydrophobicContact CD1-CH2 3.94Å; Y120-W182 HydrophobicContact CD1-CZ3 4.2Å; Y120-W182 HydrophobicContact CE1-CE3 4.01Å; Y120-W182 AromaticContact CE1-CH2 2.99Å; Y120-W182 HydrophobicContact CE1-CH2 2.99Å; Y120-W182 AromaticContact CE1-CZ2 3.94Å; Y120-W182 HydrophobicContact CE1-CZ2 3.94Å; Y120-W182 AromaticContact CE1-CZ3 3.09Å; Y120-W182 HydrophobicContact CE1-CZ3 3.09Å; Y120-W182 AromaticContact CZ-CH2 3.37Å; Y120-W182 AromaticContact CZ-CZ3 3.56Å; Y120-W182 VanDerWaalsContact OH-CH2 3.24Å; Y120-W182 WeakPolarHBondContact OH-CH2 3.47Å; Y120-W182 VanDerWaalsContact OH-CZ3 3.24Å; Y120-W182 WeakPolarHBondContact OH-CZ3 3.37Å
121	L	84.4	Confident	89.7	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.7	166.2	177.3	64.6	0	0	0	106	V123 F124 Y144 K146 F174 D178 V179	L121-V123 PolarHBondContact O-N 2.88Å; L121-F124 HydrophobicContact CD2-CB 4.43Å; L121-F124 HydrophobicContact CD2-CD2 4.38Å; L121-F124 PolarHBondContact O-N 3.05Å; L121-Y144 HydrophobicContact CB-CD1 4.35Å; L121-Y144 HydrophobicContact CB-CG 4.27Å; L121-K146 HydrophobicContact CD2-CB 3.81Å; L121-F174 HydrophobicContact CD1-CD1 3.87Å; L121-F174 HydrophobicContact CD1-CE1 3.34Å; L121-F174 HydrophobicContact CD1-CZ 3.86Å; L121-F174 HydrophobicContact CD2-CE1 4.14Å; L121-F174 HydrophobicContact CD2-CZ 4.3Å; L121-F174 HydrophobicContact CG-CE1 4.41Å; L121-D178 CarbonylContact C-O 3.52Å; L121-D178 WeakPolarHBondContact CA-O 3.4Å; L121-D178 HydrophobicContact CD1-CB 4.01Å; L121-V179 HydrophobicContact CD1-CG1 3.85Å
122	K	78.2	Confident	90	Very high	90 Å²	90	36.2 Å²	36.2	39%	0.391	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43	-10.5	-161.7	-91.7	-166.2	-169.1	155.9	0	120.2	Y120 N177 D178	Y120-K122 HydrophobicContact CD2-CG 4.31Å; Y120-K122 HydrophobicContact CE2-CB 4.39Å; Y120-K122 HydrophobicContact CE2-CG 3.61Å; K122-N177 WeakPolarHBondContact CD-O 3.35Å; K122-N177 WeakPolarHBondContact CE-O 3.36Å; K122-N177 PolarHBondContact NZ-O 2.9Å; K122-D178 PolarHBondContact N-O 2.79Å
123	V	69.3	Low	90.2	Very high	100 Å²	100	37.2 Å²	37.2	61%	0.606	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-136.5	-3.4	-170.1	-173.4	0	0	0	0	112.5	L121	L121-V123 PolarHBondContact O-N 2.88Å
124	F	73.3	Confident	90.2	Very high	75 Å²	75	38.6 Å²	38.6	33%	0.329	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-134.4	140.3	-171.1	-67.1	-89.9	0	0	0	112.3	L121 K146	L121-F124 HydrophobicContact CD2-CB 4.43Å; L121-F124 HydrophobicContact CD2-CD2 4.38Å; L121-F124 PolarHBondContact O-N 3.05Å; F124-K146 HydrophobicContact CD1-CB 4.43Å; F124-K146 HydrophobicContact CD2-CB 3.79Å; F124-K146 HydrophobicContact CD2-CD 3.48Å; F124-K146 VanDerWaalsContact CD2-CD 3.48Å; F124-K146 HydrophobicContact CD2-CG 3.67Å; F124-K146 HydrophobicContact CE1-CG 4.14Å; F124-K146 HydrophobicContact CE2-CB 3.97Å; F124-K146 HydrophobicContact CE2-CD 3.09Å; F124-K146 HydrophobicContact CE2-CG 3.31Å; F124-K146 HydrophobicContact CG-CB 4.08Å; F124-K146 HydrophobicContact CG-CG 4.31Å; F124-K146 HydrophobicContact CZ-CB 4.31Å; F124-K146 HydrophobicContact CZ-CD 3.82Å; F124-K146 HydrophobicContact CZ-CG 3.55Å
125	D	78.1	Confident	90.2	Very high	111 Å²	111	46.1 Å²	46.1	59%	0.594	23%	0.226	S	C	*	.			trans	-70.5	160.4	172.3	-62.4	-40.8	0	0	0	110.9	S127	D125-S127 PolarHBondContact O-N 2.81Å
126	Q	85	Confident	90	Very high	9 Å²	9	52.3 Å²	52.3	4%	0.042	26%	0.255	C	S	.	.			trans	-60.6	134.8	172.5	-179.3	177	-87.3	0	0	109.9	I78 P102 N128 Y144	I78-Q126 WeakPolarHBondContact CD1-O 3.29Å; I78-Q126 HydrophobicContact CG2-CB 3.83Å; I78-Q126 HydrophobicContact CG2-CG 3.98Å; P102-Q126 WeakPolarHBondContact O-CB 3.48Å; P102-Q126 PolarHBondContact O-N 3.04Å; Q126-N128 VanDerWaalsContact CG-O 3.25Å; Q126-N128 WeakPolarHBondContact CG-O 3.42Å; Q126-Y144 HydrophobicContact CB-CD1 4.41Å; Q126-Y144 HydrophobicContact CB-CE1 3.95Å
127	S	89.6	Confident	90	Very high	66 Å²	66	53.3 Å²	53.3	46%	0.462	26%	0.26	S	S	.	.	S	Bend	trans	-95.8	-27.9	-179.4	63.4	0	0	0	0	113.7	D125 F143	D125-S127 PolarHBondContact O-N 2.81Å; S127-F143 PolarHBondContact N-O 3.32Å; S127-F143 VanDerWaalsContact OG-C 3.31Å; S127-F143 PolarHBondContact OG-O 3Å
128	N	93.5	Very high	90	Very high	38 Å²	38	53.3 Å²	53.3	20%	0.203	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	152.7	177.1	-173.1	17.8	0	0	0	109.7	Q126 F143	Q126-N128 VanDerWaalsContact CG-O 3.25Å; Q126-N128 WeakPolarHBondContact CG-O 3.42Å; N128-F143 HydrophobicContact CB-CB 3.97Å; N128-F143 HydrophobicContact CB-CD2 3.79Å; N128-F143 HydrophobicContact CB-CE2 4.49Å; N128-F143 HydrophobicContact CB-CG 4.04Å; N128-F143 PolarHBondContact N-O 3.27Å; N128-F143 WeakPolarHBondContact O-CD2 3.49Å; N128-F143 PolarHBondContact O-N 3.11Å; N128-F143 VanDerWaalsContact O-N 3.08Å
129	L	95.5	Very high	90.1	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	127.8	178	-172.7	57.6	0	0	0	109.7	K75 V76 D77 I100 I131 I140 Q142	K75-L129 WeakPolarHBondContact CA-O 3.24Å; V76-L129 HydrophobicContact CG2-CB 3.91Å; V76-L129 HydrophobicContact CG2-CD2 3.66Å; V76-L129 HydrophobicContact CG2-CG 3.57Å; V76-L129 PolarHBondContact N-O 2.93Å; D77-L129 WeakPolarHBondContact O-CD2 3.42Å; I100-L129 HydrophobicContact CB-CD2 4.1Å; I100-L129 HydrophobicContact CD1-CD1 4.34Å; I100-L129 HydrophobicContact CD1-CD2 3.8Å; I100-L129 HydrophobicContact CG2-CD1 4.28Å; I100-L129 HydrophobicContact CG2-CD2 3.75Å; L129-I131 HydrophobicContact CD2-CD1 4.41Å; L129-I131 HydrophobicContact CG-CG1 4.33Å; L129-I140 HydrophobicContact CD1-CG2 3.7Å; L129-Q142 HydrophobicContact CD1-CG 3.99Å
130	E	97	Very high	90.4	Very high	26 Å²	26	52.1 Å²	52.1	12%	0.121	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.8	176.4	-80.5	174.3	-166	0	0	109.7	F73 E74 K75 R141 F143	F73-E130 HydrophobicContact CB-CB 4.12Å; F73-E130 HydrophobicContact CD1-CB 3.93Å; F73-E130 HydrophobicContact CG-CB 4.35Å; E74-E130 CarbonylContact O-C 3.51Å; E74-E130 VanDerWaalsContact O-CA 3.29Å; E74-E130 WeakPolarHBondContact O-CA 3.49Å; K75-E130 HydrophobicContact CG-CG 3.8Å; E130-R141 HydrophobicContact CB-CB 4.05Å; E130-R141 HydrophobicContact CB-CG 4.45Å; E130-R141 PolarHBondContact N-O 3.01Å; E130-R141 PolarHBondContact O-N 2.62Å; E130-R141 WeakPolarHBondContact OE2-CD 3.16Å; E130-R141 IonicContact OE2-CZ 2.84Å; E130-R141 IonicContact OE2-NE 2.67Å; E130-R141 IonicContact OE2-NH1 3.17Å; E130-R141 PolarHBondContact OE2-NH1 2.93Å; E130-F143 HydrophobicContact CB-CE2 4.13Å; E130-F143 HydrophobicContact CG-CE2 3.88Å; E130-F143 HydrophobicContact CG-CZ 4.41Å; E130-F143 WeakPolarHBondContact OE2-CZ 3.07Å
131	I	97.4	Very high	90.9	Very high	20 Å²	20	49.6 Å²	49.6	10%	0.103	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.4	-178.2	-59.4	-176.8	0	0	0	110.6	E74 V76 V82 I100 L129 N133 L138 A139	E74-I131 PolarHBondContact N-O 3.16Å; E74-I131 PolarHBondContact O-N 2.83Å; V76-I131 HydrophobicContact CG2-CD1 3.69Å; V76-I131 HydrophobicContact CG2-CG1 3.8Å; V82-I131 HydrophobicContact CG2-CD1 3.49Å; V82-I131 VanDerWaalsContact CG2-CD1 3.49Å; I100-I131 HydrophobicContact CD1-CD1 3.74Å; L129-I131 HydrophobicContact CD2-CD1 4.41Å; L129-I131 HydrophobicContact CG-CG1 4.33Å; I131-N133 HydrophobicContact CG2-CB 4.29Å; I131-L138 HydrophobicContact CG2-CD1 3.83Å; I131-A139 WeakPolarHBondContact CA-O 3.5Å
132	S	97.6	Very high	91.4	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	106.8	166	-176.5	0	0	0	0	108.4	T72 L138 A139	T72-S132 WeakPolarHBondContact CB-OG 3.36Å; T72-S132 WeakPolarHBondContact O-CB 3.43Å; T72-S132 PolarHBondContact O-OG 2.88Å; T72-S132 PolarHBondContact OG1-OG 3.05Å; S132-L138 WeakPolarHBondContact O-CA 3.48Å; S132-A139 PolarHBondContact N-O 2.89Å; S132-A139 PolarHBondContact O-N 2.77Å
133	N	97.1	Very high	92.2	Very high	57 Å²	57	47.1 Å²	47.1	31%	0.305	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	89.1	-176.2	-175.6	18.1	0	0	0	110	V83 P84 A85 I131 L138	V83-N133 PolarHBondContact O-ND2 3.46Å; P84-N133 WeakPolarHBondContact CA-OD1 3.21Å; A85-N133 PolarHBondContact N-OD1 3.11Å; I131-N133 HydrophobicContact CG2-CB 4.29Å; N133-L138 HydrophobicContact CB-CD1 3.86Å
134	R	96.1	Very high	93.3	Very high	113 Å²	113	42.5 Å²	42.5	43%	0.426	20%	0.204	S	C	.	.			trans	-110.1	175.5	-175.9	-53.4	-61.8	176.4	179.1	-5	110.2	T72 F86 E136 L137	T72-R134 PolarHBondContact O-NH2 3.48Å; T72-R134 VanDerWaalsContact O-NH2 3.08Å; F86-R134 WeakPolarHBondContact CD1-O 3.44Å; F86-R134 VanDerWaalsContact CE1-O 3.24Å; F86-R134 WeakPolarHBondContact CE1-O 3.4Å; R134-E136 VanDerWaalsContact C-N 3.26Å; R134-E136 WeakPolarHBondContact CB-OE2 3.26Å; R134-E136 PolarHBondContact O-N 3.24Å; R134-L137 PolarHBondContact N-O 3.39Å
135	K	94.5	Very high	93.9	Very high	168 Å²	168	41.9 Å²	41.9	73%	0.73	21%	0.21	S	C	*	.	S	Bend	trans	-72.1	-26.9	-178.2	-69.3	-178.4	179.3	177.8	0	112.1	F86	F86-K135 WeakPolarHBondContact CD1-O 3.31Å
136	E	94.2	Very high	93.9	Very high	130 Å²	130	38.9 Å²	38.9	61%	0.607	19%	0.191	S	C	*	.	S	Bend	trans	-85.5	-38.5	-173.5	-58	74.6	-163.7	0	0	111.8	R134 P159	R134-E136 VanDerWaalsContact C-N 3.26Å; R134-E136 WeakPolarHBondContact CB-OE2 3.26Å; R134-E136 PolarHBondContact O-N 3.24Å; E136-P159 WeakPolarHBondContact O-CD 3.21Å
137	L	96.8	Very high	93.6	Very high	23 Å²	23	45 Å²	45	12%	0.12	22%	0.224	C	C	.	.			trans	-160.3	159	179.4	65.6	87.1	0	0	0	111.6	V68 R134 A139 L156 I157 Y158	V68-L137 HydrophobicContact CG2-CD1 3.96Å; V68-L137 HydrophobicContact CG2-CD2 4.13Å; R134-L137 PolarHBondContact N-O 3.39Å; L137-A139 HydrophobicContact CD1-CB 3.73Å; L137-L156 HydrophobicContact CD1-CD2 4.18Å; L137-L156 HydrophobicContact CD2-CD2 4.41Å; L137-I157 WeakPolarHBondContact CA-O 3.39Å; L137-Y158 HydrophobicContact CB-CD1 3.92Å; L137-Y158 HydrophobicContact CB-CE1 3.92Å; L137-Y158 HydrophobicContact CB-CG 4.41Å; L137-Y158 HydrophobicContact CD2-CE1 3.75Å
138	L	98	Very high	93.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.6	165.9	169.8	62.5	0	0	0	107.9	V82 P84 F86 L98 I131 S132 N133 I140 L156 I157	V82-L138 HydrophobicContact CG1-CD1 4.12Å; V82-L138 HydrophobicContact CG1-CD2 4.3Å; P84-L138 HydrophobicContact CB-CD2 4.3Å; P84-L138 HydrophobicContact CG-CD2 4.3Å; F86-L138 HydrophobicContact CE1-CB 4.4Å; F86-L138 HydrophobicContact CZ-CB 4.07Å; L98-L138 HydrophobicContact CD1-CD2 3.87Å; L98-L138 HydrophobicContact CD2-CD2 4.16Å; I131-L138 HydrophobicContact CG2-CD1 3.83Å; S132-L138 WeakPolarHBondContact O-CA 3.48Å; N133-L138 HydrophobicContact CB-CD1 3.86Å; L138-I140 HydrophobicContact CD1-CG1 4.23Å; L138-I140 HydrophobicContact CD2-CD1 4.15Å; L138-I140 HydrophobicContact CG-CD1 4.29Å; L138-I140 HydrophobicContact CG-CG1 4.17Å; L138-L156 WeakPolarHBondContact O-CA 3.48Å; L138-I157 HydrophobicContact CB-CB 4.37Å; L138-I157 HydrophobicContact CD2-CD1 4.18Å; L138-I157 PolarHBondContact N-O 3.49Å; L138-I157 PolarHBondContact O-N 2.97Å
139	A	98.2	Very high	92.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.8	173	0	0	0	0	0	110	V68 F73 I131 S132 L137 T154 S155 L156	V68-A139 HydrophobicContact CG2-CB 4.3Å; F73-A139 HydrophobicContact CE1-CB 3.68Å; F73-A139 HydrophobicContact CZ-CB 3.65Å; I131-A139 WeakPolarHBondContact CA-O 3.5Å; S132-A139 PolarHBondContact N-O 2.89Å; S132-A139 PolarHBondContact O-N 2.77Å; L137-A139 HydrophobicContact CD1-CB 3.73Å; A139-T154 HydrophobicContact CB-CG2 4.13Å; A139-S155 CarbonylContact C-O 3.55Å; A139-S155 WeakPolarHBondContact CA-O 3.4Å; A139-L156 HydrophobicContact CB-CD2 4.18Å
140	I	97.7	Very high	92.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	114.9	177.2	-61.5	167	0	0	0	107	L98 I100 I106 L129 L138 Q142 T154 S155 I157	L98-I140 HydrophobicContact CD2-CD1 4.21Å; I100-I140 HydrophobicContact CD1-CD1 3.98Å; I100-I140 HydrophobicContact CD1-CG1 4.3Å; I100-I140 HydrophobicContact CD1-CG2 3.8Å; I106-I140 HydrophobicContact CD1-CB 4.11Å; I106-I140 HydrophobicContact CD1-CD1 3.9Å; I106-I140 HydrophobicContact CD1-CG2 3.8Å; I106-I140 HydrophobicContact CG1-CG2 4.48Å; I106-I140 HydrophobicContact CG2-CD1 3.98Å; L129-I140 HydrophobicContact CD1-CG2 3.7Å; L138-I140 HydrophobicContact CD1-CG1 4.23Å; L138-I140 HydrophobicContact CD2-CD1 4.15Å; L138-I140 HydrophobicContact CG-CD1 4.29Å; L138-I140 HydrophobicContact CG-CG1 4.17Å; I140-Q142 HydrophobicContact CG2-CG 4.17Å; I140-T154 CarbonylContact O-C 3.29Å; I140-T154 WeakPolarHBondContact O-CA 3.46Å; I140-S155 PolarHBondContact N-O 2.89Å; I140-S155 PolarHBondContact O-N 2.8Å; I140-I157 HydrophobicContact CD1-CD1 4.3Å
141	R	97.4	Very high	92.2	Very high	7 Å²	7	47.7 Å²	47.7	3%	0.026	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121	-176.4	174.8	-168.7	-75.6	173.3	-2.1	109.8	N70 F73 E130 F143 K152 V153 T154 D168	N70-R141 PolarHBondContact OD1-NH1 3.27Å; N70-R141 PolarHBondContact OD1-NH2 3.22Å; F73-R141 HydrophobicContact CD1-CB 4.21Å; F73-R141 HydrophobicContact CE1-CB 3.8Å; F73-R141 VanDerWaalsContact CE2-CZ 3.42Å; F73-R141 HydrophobicContact CZ-CB 4.43Å; E130-R141 HydrophobicContact CB-CB 4.05Å; E130-R141 HydrophobicContact CB-CG 4.45Å; E130-R141 PolarHBondContact N-O 3.01Å; E130-R141 PolarHBondContact O-N 2.62Å; E130-R141 WeakPolarHBondContact OE2-CD 3.16Å; E130-R141 IonicContact OE2-CZ 2.84Å; E130-R141 IonicContact OE2-NE 2.67Å; E130-R141 IonicContact OE2-NH1 3.17Å; E130-R141 PolarHBondContact OE2-NH1 2.93Å; R141-F143 HydrophobicContact CG-CD2 4.33Å; R141-F143 HydrophobicContact CG-CE2 3.65Å; R141-F143 HydrophobicContact CG-CZ 3.97Å; R141-K152 HydrophobicContact CG-CG 4.42Å; R141-V153 WeakPolarHBondContact CA-O 3.49Å; R141-T154 HydrophobicContact CB-CG2 4.3Å; R141-T154 PolarHBondContact NE-OG1 2.91Å; R141-D168 IonicContact NE-OD1 3.01Å; R141-D168 IonicContact NH2-OD1 2.62Å
142	Q	96	Very high	92.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139	-173.3	-53.9	-178.6	-88.9	0	0	109.1	G104 N119 L129 I140 Y144 K152 V153	G104-Q142 VanDerWaalsContact C-NE2 3.34Å; G104-Q142 PolarHBondContact O-NE2 2.9Å; N119-Q142 PolarHBondContact ND2-OE1 3.04Å; L129-Q142 HydrophobicContact CD1-CG 3.99Å; I140-Q142 HydrophobicContact CG2-CG 4.17Å; Q142-Y144 HydrophobicContact CB-CE2 3.64Å; Q142-Y144 PolarHBondContact NE2-OH 3.22Å; Q142-K152 WeakPolarHBondContact O-CA 3.33Å; Q142-V153 HydrophobicContact CB-CG1 4.25Å; Q142-V153 PolarHBondContact N-O 2.99Å; Q142-V153 PolarHBondContact O-N 2.95Å
143	F	94.4	Very high	92	Very high	42 Å²	42	48.4 Å²	48.4	18%	0.184	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.3	-179.9	-60.3	-107.5	0	0	0	109.5	S127 N128 E130 R141 K152	S127-F143 PolarHBondContact N-O 3.32Å; S127-F143 VanDerWaalsContact OG-C 3.31Å; S127-F143 PolarHBondContact OG-O 3Å; N128-F143 HydrophobicContact CB-CB 3.97Å; N128-F143 HydrophobicContact CB-CD2 3.79Å; N128-F143 HydrophobicContact CB-CE2 4.49Å; N128-F143 HydrophobicContact CB-CG 4.04Å; N128-F143 PolarHBondContact N-O 3.27Å; N128-F143 WeakPolarHBondContact O-CD2 3.49Å; N128-F143 PolarHBondContact O-N 3.11Å; N128-F143 VanDerWaalsContact O-N 3.08Å; E130-F143 HydrophobicContact CB-CE2 4.13Å; E130-F143 HydrophobicContact CG-CE2 3.88Å; E130-F143 HydrophobicContact CG-CZ 4.41Å; E130-F143 WeakPolarHBondContact OE2-CZ 3.07Å; R141-F143 HydrophobicContact CG-CD2 4.33Å; R141-F143 HydrophobicContact CG-CE2 3.65Å; R141-F143 HydrophobicContact CG-CZ 3.97Å; F143-K152 HydrophobicContact CD1-CB 4.32Å; F143-K152 HydrophobicContact CD1-CD 3.87Å; F143-K152 HydrophobicContact CD1-CG 3.72Å; F143-K152 HydrophobicContact CE1-CD 3.44Å; F143-K152 VanDerWaalsContact CE1-CD 3.44Å; F143-K152 HydrophobicContact CE1-CG 3.75Å; F143-K152 HydrophobicContact CG-CG 4.31Å; F143-K152 HydrophobicContact CZ-CD 4.11Å; F143-K152 HydrophobicContact CZ-CG 4.33Å
144	Y	92.1	Very high	92.1	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.7	173.6	-50	-102.6	0	0	0	108	G104 N119 L121 Q126 Q142 T150 F151 V153	G104-Y144 WeakPolarHBondContact CA-OH 3.44Å; N119-Y144 PolarHBondContact O-OH 2.86Å; L121-Y144 HydrophobicContact CB-CD1 4.35Å; L121-Y144 HydrophobicContact CB-CG 4.27Å; Q126-Y144 HydrophobicContact CB-CD1 4.41Å; Q126-Y144 HydrophobicContact CB-CE1 3.95Å; Q142-Y144 HydrophobicContact CB-CE2 3.64Å; Q142-Y144 PolarHBondContact NE2-OH 3.22Å; Y144-T150 WeakPolarHBondContact O-CA 3.15Å; Y144-F151 HydrophobicContact CD2-CB 4.41Å; Y144-F151 AromaticContact CD2-CD1 3.43Å; Y144-F151 HydrophobicContact CD2-CD1 3.43Å; Y144-F151 VanDerWaalsContact CD2-CD1 3.43Å; Y144-F151 HydrophobicContact CD2-CE1 4.1Å; Y144-F151 HydrophobicContact CD2-CG 4.25Å; Y144-F151 WeakPolarHBondContact CD2-O 3.49Å; Y144-F151 AromaticContact CE2-CD1 3.92Å; Y144-F151 HydrophobicContact CE2-CD1 3.92Å; Y144-F151 HydrophobicContact CE2-CE1 4.13Å; Y144-F151 HydrophobicContact CG-CD1 4.1Å; Y144-F151 PolarHBondContact N-O 2.97Å; Y144-F151 PolarHBondContact O-N 2.72Å; Y144-V153 HydrophobicContact CE2-CG1 4.32Å
145	S	86.6	Confident	92.2	Very high	63 Å²	63	40.4 Å²	40.4	44%	0.441	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.5	179.2	-175.5	0	0	0	0	110.3	F149	S145-F149 CarbonylContact C-O 3.49Å; S145-F149 WeakPolarHBondContact CA-O 3.32Å
146	K	76.7	Confident	92.4	Very high	48 Å²	48	32.4 Å²	32.4	21%	0.209	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	120.1	179.4	173.4	-169.3	-171.7	168.2	0	109.7	L121 F124 G148 F149	L121-K146 HydrophobicContact CD2-CB 3.81Å; F124-K146 HydrophobicContact CD1-CB 4.43Å; F124-K146 HydrophobicContact CD2-CB 3.79Å; F124-K146 HydrophobicContact CD2-CD 3.48Å; F124-K146 VanDerWaalsContact CD2-CD 3.48Å; F124-K146 HydrophobicContact CD2-CG 3.67Å; F124-K146 HydrophobicContact CE1-CG 4.14Å; F124-K146 HydrophobicContact CE2-CB 3.97Å; F124-K146 HydrophobicContact CE2-CD 3.09Å; F124-K146 HydrophobicContact CE2-CG 3.31Å; F124-K146 HydrophobicContact CG-CB 4.08Å; F124-K146 HydrophobicContact CG-CG 4.31Å; F124-K146 HydrophobicContact CZ-CB 4.31Å; F124-K146 HydrophobicContact CZ-CD 3.82Å; F124-K146 HydrophobicContact CZ-CG 3.55Å; K146-G148 PolarHBondContact O-N 2.02Å; K146-F149 PolarHBondContact N-O 3.18Å; K146-F149 WeakPolarHBondContact O-CA 2.95Å; K146-F149 VanDerWaalsContact O-CB 3.26Å; K146-F149 WeakPolarHBondContact O-CB 3.26Å; K146-F149 WeakPolarHBondContact O-CD2 2.97Å; K146-F149 PolarHBondContact O-N 3.18Å
147	N	79.5	Confident	92.5	Very high	136 Å²	136	26.2 Å²	26.2	73%	0.727	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	33.7	170.5	-60	-17.4	0	0	0	114.1	F149	N147-F149 VanDerWaalsContact C-N 3.35Å; N147-F149 HydrophobicContact CB-CD2 4.31Å; N147-F149 HydrophobicContact CB-CE2 4.33Å
148	G	78.2	Confident	92.6	Very high	71 Å²	71	27.4 Å²	27.4	73%	0.732	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.2	-11.4	-175.3	0	0	0	0	0	115.4	K146	K146-G148 PolarHBondContact O-N 2.02Å
149	F	84	Confident	92.4	Very high	66 Å²	66	29.6 Å²	29.6	29%	0.289	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	135.8	171.7	-51.3	-58.8	0	0	0	111	S145 K146 N147 A171 E173 F174	S145-F149 CarbonylContact C-O 3.49Å; S145-F149 WeakPolarHBondContact CA-O 3.32Å; K146-F149 PolarHBondContact N-O 3.18Å; K146-F149 WeakPolarHBondContact O-CA 2.95Å; K146-F149 VanDerWaalsContact O-CB 3.26Å; K146-F149 WeakPolarHBondContact O-CB 3.26Å; K146-F149 WeakPolarHBondContact O-CD2 2.97Å; K146-F149 PolarHBondContact O-N 3.18Å; N147-F149 VanDerWaalsContact C-N 3.35Å; N147-F149 HydrophobicContact CB-CD2 4.31Å; N147-F149 HydrophobicContact CB-CE2 4.33Å; F149-A171 HydrophobicContact CB-CB 3.87Å; F149-A171 HydrophobicContact CD1-CB 3.98Å; F149-A171 HydrophobicContact CG-CB 4.39Å; F149-E173 HydrophobicContact CD1-CB 3.74Å; F149-E173 HydrophobicContact CD1-CG 4.22Å; F149-E173 HydrophobicContact CE1-CB 3.23Å; F149-E173 HydrophobicContact CE1-CG 3.52Å; F149-E173 HydrophobicContact CZ-CB 3.89Å; F149-E173 HydrophobicContact CZ-CG 4.35Å; F149-F174 HydrophobicContact CB-CD1 4.5Å; F149-F174 HydrophobicContact CB-CE1 3.66Å; F149-F174 HydrophobicContact CB-CZ 3.86Å; F149-F174 HydrophobicContact CG-CE1 4.41Å
150	T	90	Very high	92.2	Very high	51 Å²	51	34.8 Å²	34.8	31%	0.313	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.4	-178.2	45.2	0	0	0	0	110.4	Y144 D169 A171 F174	Y144-T150 WeakPolarHBondContact O-CA 3.15Å; T150-D169 WeakPolarHBondContact CB-OD2 3.25Å; T150-D169 PolarHBondContact OG1-OD2 3.27Å; T150-A171 PolarHBondContact O-N 2.93Å; T150-F174 WeakPolarHBondContact O-CE2 3.3Å; T150-F174 WeakPolarHBondContact O-CZ 3.17Å
151	F	93.5	Very high	92.1	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	113.9	166.8	175.2	-127.7	0	0	0	107.7	N119 Y144 V153 F167 D169 V170 F174 V179 I207	N119-F151 HydrophobicContact CB-CE1 4.3Å; Y144-F151 HydrophobicContact CD2-CB 4.41Å; Y144-F151 AromaticContact CD2-CD1 3.43Å; Y144-F151 HydrophobicContact CD2-CD1 3.43Å; Y144-F151 VanDerWaalsContact CD2-CD1 3.43Å; Y144-F151 HydrophobicContact CD2-CE1 4.1Å; Y144-F151 HydrophobicContact CD2-CG 4.25Å; Y144-F151 WeakPolarHBondContact CD2-O 3.49Å; Y144-F151 AromaticContact CE2-CD1 3.92Å; Y144-F151 HydrophobicContact CE2-CD1 3.92Å; Y144-F151 HydrophobicContact CE2-CE1 4.13Å; Y144-F151 HydrophobicContact CG-CD1 4.1Å; Y144-F151 PolarHBondContact N-O 2.97Å; Y144-F151 PolarHBondContact O-N 2.72Å; F151-V153 HydrophobicContact CE1-CB 4.42Å; F151-V153 HydrophobicContact CE1-CG1 3.83Å; F151-V153 HydrophobicContact CE2-CB 4.14Å; F151-V153 HydrophobicContact CE2-CG1 4.42Å; F151-V153 HydrophobicContact CZ-CB 3.89Å; F151-V153 HydrophobicContact CZ-CG1 3.77Å; F151-V153 HydrophobicContact CZ-CG2 4.45Å; F151-F167 AromaticContact CE2-CD1 3.8Å; F151-F167 HydrophobicContact CE2-CD1 3.8Å; F151-F167 HydrophobicContact CE2-CE1 4.04Å; F151-F167 HydrophobicContact CZ-CD1 4.31Å; F151-F167 HydrophobicContact CZ-CE1 4.14Å; F151-D169 CarbonylContact C-O 3.57Å; F151-D169 WeakPolarHBondContact CA-O 3.41Å; F151-V170 HydrophobicContact CD2-CG2 4.08Å; F151-V170 HydrophobicContact CE2-CG2 4.24Å; F151-F174 HydrophobicContact CB-CE2 3.85Å; F151-F174 HydrophobicContact CB-CZ 3.9Å; F151-V179 HydrophobicContact CB-CG1 4.36Å; F151-V179 HydrophobicContact CD1-CG1 4.33Å; F151-V179 HydrophobicContact CD2-CG1 4.06Å; F151-V179 HydrophobicContact CE2-CB 4.46Å; F151-V179 HydrophobicContact CE2-CG1 4.4Å; F151-V179 HydrophobicContact CG-CG1 4.01Å; F151-I207 HydrophobicContact CE2-CG2 4.18Å
152	K	95.1	Very high	92	Very high	37 Å²	37	35.3 Å²	35.3	16%	0.161	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.4	178.9	-174	-170.8	172.5	-143.5	0	108.1	R141 Q142 F143 D168 D169	R141-K152 HydrophobicContact CG-CG 4.42Å; Q142-K152 WeakPolarHBondContact O-CA 3.33Å; F143-K152 HydrophobicContact CD1-CB 4.32Å; F143-K152 HydrophobicContact CD1-CD 3.87Å; F143-K152 HydrophobicContact CD1-CG 3.72Å; F143-K152 HydrophobicContact CE1-CD 3.44Å; F143-K152 VanDerWaalsContact CE1-CD 3.44Å; F143-K152 HydrophobicContact CE1-CG 3.75Å; F143-K152 HydrophobicContact CG-CG 4.31Å; F143-K152 HydrophobicContact CZ-CD 4.11Å; F143-K152 HydrophobicContact CZ-CG 4.33Å; K152-D168 HydrophobicContact CB-CB 3.95Å; K152-D168 HydrophobicContact CD-CB 3.49Å; K152-D168 VanDerWaalsContact CD-CB 3.49Å; K152-D168 WeakPolarHBondContact CE-OD1 3.48Å; K152-D168 HydrophobicContact CG-CB 3.66Å; K152-D168 IonicContact NZ-OD1 2.89Å; K152-D168 PolarHBondContact NZ-OD1 2.97Å; K152-D168 PolarHBondContact O-N 3.44Å; K152-D169 HydrophobicContact CB-CB 3.93Å; K152-D169 PolarHBondContact N-O 2.55Å; K152-D169 PolarHBondContact O-N 3.01Å; K152-D169 VanDerWaalsContact O-N 3.16Å
153	V	96.6	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	134.3	-175.4	58.5	0	0	0	0	109.9	N119 R141 Q142 Y144 F151 F165 Y166 F167	N119-V153 HydrophobicContact CB-CG1 3.61Å; R141-V153 WeakPolarHBondContact CA-O 3.49Å; Q142-V153 HydrophobicContact CB-CG1 4.25Å; Q142-V153 PolarHBondContact N-O 2.99Å; Q142-V153 PolarHBondContact O-N 2.95Å; Y144-V153 HydrophobicContact CE2-CG1 4.32Å; F151-V153 HydrophobicContact CE1-CB 4.42Å; F151-V153 HydrophobicContact CE1-CG1 3.83Å; F151-V153 HydrophobicContact CE2-CB 4.14Å; F151-V153 HydrophobicContact CE2-CG1 4.42Å; F151-V153 HydrophobicContact CZ-CB 3.89Å; F151-V153 HydrophobicContact CZ-CG1 3.77Å; F151-V153 HydrophobicContact CZ-CG2 4.45Å; V153-F165 HydrophobicContact CG2-CD1 4.42Å; V153-Y166 CarbonylContact C-O 3.5Å; V153-Y166 WeakPolarHBondContact CA-O 3.46Å; V153-F167 HydrophobicContact CB-CD1 4.26Å; V153-F167 HydrophobicContact CG2-CD1 3.86Å; V153-F167 HydrophobicContact CG2-CE1 3.87Å
154	T	98	Very high	92.3	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.6	175.8	-57.5	0	0	0	0	109.3	F73 A139 I140 R141 L156 F165 Y166 D168	F73-T154 HydrophobicContact CE1-CG2 4.42Å; F73-T154 HydrophobicContact CZ-CG2 4.01Å; A139-T154 HydrophobicContact CB-CG2 4.13Å; I140-T154 CarbonylContact O-C 3.29Å; I140-T154 WeakPolarHBondContact O-CA 3.46Å; R141-T154 HydrophobicContact CB-CG2 4.3Å; R141-T154 PolarHBondContact NE-OG1 2.91Å; T154-L156 HydrophobicContact CG2-CD2 4.47Å; T154-L156 HydrophobicContact CG2-CG 4.26Å; T154-F165 WeakPolarHBondContact O-CA 3.41Å; T154-Y166 PolarHBondContact N-O 2.71Å; T154-Y166 PolarHBondContact O-N 2.87Å; T154-D168 WeakPolarHBondContact CB-OD2 3.33Å; T154-D168 PolarHBondContact N-OD2 2.82Å; T154-D168 PolarHBondContact OG1-OD2 3.02Å
155	S	98.3	Very high	92.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.4	170	-59.4	0	0	0	0	109.7	N119 A139 I140 A164	N119-S155 PolarHBondContact ND2-OG 3.25Å; A139-S155 CarbonylContact C-O 3.55Å; A139-S155 WeakPolarHBondContact CA-O 3.4Å; I140-S155 PolarHBondContact N-O 2.89Å; I140-S155 PolarHBondContact O-N 2.8Å; S155-A164 CarbonylContact C-O 3.53Å; S155-A164 WeakPolarHBondContact CA-O 3.28Å
156	L	98.2	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.4	-178.3	-56.4	125	0	0	0	109	P67 V68 L137 L138 A139 T154 Y158 I163 A164 L212	P67-L156 HydrophobicContact CB-CD1 4.46Å; P67-L156 HydrophobicContact CB-CD2 4.36Å; P67-L156 HydrophobicContact CG-CD1 3.51Å; P67-L156 HydrophobicContact CG-CD2 3.84Å; P67-L156 HydrophobicContact CG-CG 4.32Å; V68-L156 HydrophobicContact CG2-CD2 3.39Å; L137-L156 HydrophobicContact CD1-CD2 4.18Å; L137-L156 HydrophobicContact CD2-CD2 4.41Å; L138-L156 WeakPolarHBondContact O-CA 3.48Å; A139-L156 HydrophobicContact CB-CD2 4.18Å; T154-L156 HydrophobicContact CG2-CD2 4.47Å; T154-L156 HydrophobicContact CG2-CG 4.26Å; L156-Y158 HydrophobicContact CB-CE2 3.92Å; L156-I163 CarbonylContact O-C 3.52Å; L156-I163 WeakPolarHBondContact O-CA 3.41Å; L156-A164 HydrophobicContact CB-CB 4.13Å; L156-A164 HydrophobicContact CD1-CB 3.82Å; L156-A164 PolarHBondContact N-O 3.38Å; L156-A164 PolarHBondContact O-N 3.04Å; L156-L212 HydrophobicContact CD1-CD1 4.48Å
157	I	98.2	Very high	94.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.9	-177.2	-54.3	166.6	0	0	0	108.1	F86 I88 L98 M108 I117 L137 L138 I140 I163	F86-I157 WeakPolarHBondContact CZ-O 3.46Å; I88-I157 HydrophobicContact CB-CG2 4.44Å; I88-I157 HydrophobicContact CD1-CG2 3.73Å; I88-I157 HydrophobicContact CG1-CG2 3.85Å; I88-I157 HydrophobicContact CG2-CG2 3.68Å; L98-I157 HydrophobicContact CD2-CD1 3.66Å; M108-I157 HydrophobicContact CE-CD1 3.61Å; M108-I157 HydrophobicContact CE-CG1 4.3Å; I117-I157 HydrophobicContact CD1-CD1 3.97Å; I117-I157 HydrophobicContact CD1-CG1 4.07Å; L137-I157 WeakPolarHBondContact CA-O 3.39Å; L138-I157 HydrophobicContact CB-CB 4.37Å; L138-I157 HydrophobicContact CD2-CD1 4.18Å; L138-I157 PolarHBondContact N-O 3.49Å; L138-I157 PolarHBondContact O-N 2.97Å; I140-I157 HydrophobicContact CD1-CD1 4.3Å; I157-I163 HydrophobicContact CB-CD1 4.2Å; I157-I163 HydrophobicContact CG1-CD1 4.01Å; I157-I163 HydrophobicContact CG2-CD1 3.78Å
158	Y	97.1	Very high	94.9	Very high	48 Å²	48	23.4 Å²	23.4	19%	0.188	14%	0.137	C	C	.	.			trans	-106.6	154.5	-177.6	-65	-97.8	0	0	0	111.4	L137 L156 N160 G161 K162	L137-Y158 HydrophobicContact CB-CD1 3.92Å; L137-Y158 HydrophobicContact CB-CE1 3.92Å; L137-Y158 HydrophobicContact CB-CG 4.41Å; L137-Y158 HydrophobicContact CD2-CE1 3.75Å; L156-Y158 HydrophobicContact CB-CE2 3.92Å; Y158-N160 VanDerWaalsContact CB-OD1 3.3Å; Y158-N160 WeakPolarHBondContact CB-OD1 3.21Å; Y158-N160 PolarHBondContact O-N 2.85Å; Y158-G161 PolarHBondContact O-N 3.3Å; Y158-K162 HydrophobicContact CD2-CB 3.89Å; Y158-K162 HydrophobicContact CD2-CD 3.95Å; Y158-K162 HydrophobicContact CD2-CG 3.81Å; Y158-K162 WeakPolarHBondContact CD2-O 3.33Å; Y158-K162 HydrophobicContact CE2-CD 4.04Å; Y158-K162 HydrophobicContact CE2-CG 4.21Å; Y158-K162 HydrophobicContact CG-CB 4.14Å; Y158-K162 HydrophobicContact CG-CD 4.38Å; Y158-K162 HydrophobicContact CG-CG 4.44Å; Y158-K162 PolarHBondContact N-O 2.87Å
159	P	95.6	Very high	95.7	Very high	46 Å²	46	23 Å²	23	30%	0.299	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-35.7	-179.7	-22	27.5	0	0	0	114.1	F86 K89 E136 G161	F86-P159 HydrophobicContact CB-CG 4.38Å; F86-P159 HydrophobicContact CD1-CG 4.14Å; F86-P159 HydrophobicContact CD2-CB 3.62Å; F86-P159 HydrophobicContact CD2-CG 3.51Å; F86-P159 HydrophobicContact CE1-CG 4.31Å; F86-P159 HydrophobicContact CE2-CB 3.99Å; F86-P159 HydrophobicContact CE2-CG 3.65Å; F86-P159 HydrophobicContact CG-CB 4.18Å; F86-P159 HydrophobicContact CG-CG 3.76Å; F86-P159 HydrophobicContact CZ-CG 4.08Å; K89-P159 PolarHBondContact N-O 3.34Å; E136-P159 WeakPolarHBondContact O-CD 3.21Å; P159-G161 PolarHBondContact O-N 2.93Å
160	N	93	Very high	96.1	Very high	108 Å²	108	20.4 Å²	20.4	58%	0.578	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-2.4	-179.5	68.2	-7.6	0	0	0	113.9	Y158 K162	Y158-N160 VanDerWaalsContact CB-OD1 3.3Å; Y158-N160 WeakPolarHBondContact CB-OD1 3.21Å; Y158-N160 PolarHBondContact O-N 2.85Å; N160-K162 WeakPolarHBondContact OD1-CB 3.37Å; N160-K162 PolarHBondContact OD1-N 3.5Å
161	G	94.8	Very high	96.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	92.4	0.3	-179.6	0	0	0	0	0	116.1	Y56 K89 Y158 P159 I163	Y56-G161 WeakPolarHBondContact CE1-O 3.48Å; Y56-G161 PolarHBondContact OH-O 2.82Å; K89-G161 WeakPolarHBondContact O-CA 3.24Å; Y158-G161 PolarHBondContact O-N 3.3Å; P159-G161 PolarHBondContact O-N 2.93Å; G161-I163 PolarHBondContact O-N 3.33Å
162	K	96.1	Very high	95.7	Very high	19 Å²	19	28 Å²	28	8%	0.083	14%	0.138	C	C	.	.			trans	-58.8	133.7	167.4	178	-177.1	179.8	179.5	0	108.8	Y158 N160 E214 H215 D254	Y158-K162 HydrophobicContact CD2-CB 3.89Å; Y158-K162 HydrophobicContact CD2-CD 3.95Å; Y158-K162 HydrophobicContact CD2-CG 3.81Å; Y158-K162 WeakPolarHBondContact CD2-O 3.33Å; Y158-K162 HydrophobicContact CE2-CD 4.04Å; Y158-K162 HydrophobicContact CE2-CG 4.21Å; Y158-K162 HydrophobicContact CG-CB 4.14Å; Y158-K162 HydrophobicContact CG-CD 4.38Å; Y158-K162 HydrophobicContact CG-CG 4.44Å; Y158-K162 PolarHBondContact N-O 2.87Å; N160-K162 WeakPolarHBondContact OD1-CB 3.37Å; N160-K162 PolarHBondContact OD1-N 3.5Å; K162-E214 VanDerWaalsContact CE-OE1 3.26Å; K162-E214 WeakPolarHBondContact CE-OE1 3.34Å; K162-E214 IonicContact NZ-OE1 3.14Å; K162-E214 PolarHBondContact NZ-OE1 2.87Å; K162-H215 VanDerWaalsContact CA-O 3.24Å; K162-H215 WeakPolarHBondContact CA-O 3.23Å; K162-H215 WeakPolarHBondContact CG-O 3.49Å; K162-D254 IonicContact NZ-OD2 2.67Å; K162-D254 PolarHBondContact NZ-OD2 3.44Å
163	I	97.7	Very high	94.9	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.8	174.7	-55.5	-61.4	0	0	0	107.5	F90 I117 L156 I157 G161 F165 H215	F90-I163 HydrophobicContact CD2-CD1 3.96Å; F90-I163 HydrophobicContact CD2-CG1 4.15Å; F90-I163 HydrophobicContact CE2-CD1 4.06Å; F90-I163 HydrophobicContact CE2-CG1 3.96Å; I117-I163 HydrophobicContact CD1-CG2 4.14Å; L156-I163 CarbonylContact O-C 3.52Å; L156-I163 WeakPolarHBondContact O-CA 3.41Å; I157-I163 HydrophobicContact CB-CD1 4.2Å; I157-I163 HydrophobicContact CG1-CD1 4.01Å; I157-I163 HydrophobicContact CG2-CD1 3.78Å; G161-I163 PolarHBondContact O-N 3.33Å; I163-F165 HydrophobicContact CG2-CE2 4.15Å; I163-F165 HydrophobicContact CG2-CZ 4.38Å; I163-H215 HydrophobicContact CB-CB 4.29Å; I163-H215 PolarHBondContact N-O 3.37Å; I163-H215 WeakPolarHBondContact O-CA 3.48Å; I163-H215 WeakPolarHBondContact O-CB 3.32Å; I163-H215 PolarHBondContact O-N 2.64Å; I163-H215 PolarHBondContact O-ND1 3.43Å
164	A	98.2	Very high	93.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.008	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.7	172.2	0	0	0	0	0	112.3	S155 L156 L212 V213 E214	S155-A164 CarbonylContact C-O 3.53Å; S155-A164 WeakPolarHBondContact CA-O 3.28Å; L156-A164 HydrophobicContact CB-CB 4.13Å; L156-A164 HydrophobicContact CD1-CB 3.82Å; L156-A164 PolarHBondContact N-O 3.38Å; L156-A164 PolarHBondContact O-N 3.04Å; A164-L212 HydrophobicContact CB-CD1 4.35Å; A164-V213 CarbonylContact C-O 3.51Å; A164-V213 WeakPolarHBondContact CA-O 3.34Å; A164-V213 VanDerWaalsContact CB-O 3.28Å; A164-V213 WeakPolarHBondContact CB-O 3.5Å; A164-E214 HydrophobicContact CB-CB 4.49Å; A164-E214 HydrophobicContact CB-CG 3.98Å
165	F	98.5	Very high	92.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.2	170.8	-59.6	-90.3	0	0	0	108	I117 N119 V153 T154 I163 F167 F183 V202 L212 V213 H215	I117-F165 HydrophobicContact CG2-CE1 3.46Å; I117-F165 VanDerWaalsContact CG2-CE1 3.46Å; I117-F165 HydrophobicContact CG2-CZ 3.79Å; N119-F165 WeakPolarHBondContact OD1-CD1 3.24Å; N119-F165 WeakPolarHBondContact OD1-CE1 3.48Å; V153-F165 HydrophobicContact CG2-CD1 4.42Å; T154-F165 WeakPolarHBondContact O-CA 3.41Å; I163-F165 HydrophobicContact CG2-CE2 4.15Å; I163-F165 HydrophobicContact CG2-CZ 4.38Å; F165-F167 HydrophobicContact CB-CE2 4.28Å; F165-F167 HydrophobicContact CB-CZ 4.24Å; F165-F183 AromaticContact CE2-CD1 3.83Å; F165-F183 HydrophobicContact CE2-CD1 3.83Å; F165-F183 HydrophobicContact CE2-CE1 4.29Å; F165-F183 HydrophobicContact CZ-CB 4.49Å; F165-F183 HydrophobicContact CZ-CD1 4.02Å; F165-V202 HydrophobicContact CD2-CG2 4.1Å; F165-V202 HydrophobicContact CE2-CG2 4.4Å; F165-L212 WeakPolarHBondContact O-CA 3.36Å; F165-V213 HydrophobicContact CB-CB 4.35Å; F165-V213 PolarHBondContact N-O 3.04Å; F165-V213 PolarHBondContact O-N 3.41Å; F165-H215 AromaticContact CD2-CE1 3.74Å; F165-H215 AromaticContact CE2-CE1 3.69Å; F165-H215 AromaticContact CE2-ND1 3.95Å
166	Y	98.5	Very high	90.4	Very high	15 Å²	15	43 Å²	43	6%	0.059	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.5	166.9	-177.2	-107.7	0	0	0	108.8	Q64 P66 P67 V153 T154 D168 L212	Q64-Y166 HydrophobicContact CB-CE2 4.37Å; Q64-Y166 WeakPolarHBondContact O-CE2 3.17Å; Q64-Y166 PolarHBondContact O-OH 3.3Å; P66-Y166 HydrophobicContact CB-CD1 4.27Å; P66-Y166 HydrophobicContact CB-CE1 3.7Å; P66-Y166 WeakPolarHBondContact CD-OH 2.79Å; P66-Y166 HydrophobicContact CG-CE1 3.7Å; P67-Y166 HydrophobicContact CG-CG 4.37Å; V153-Y166 CarbonylContact C-O 3.5Å; V153-Y166 WeakPolarHBondContact CA-O 3.46Å; T154-Y166 PolarHBondContact N-O 2.71Å; T154-Y166 PolarHBondContact O-N 2.87Å; Y166-D168 HydrophobicContact CD1-CB 4.29Å; Y166-D168 WeakPolarHBondContact CD1-OD2 3.44Å; Y166-D168 HydrophobicContact CE1-CB 4.2Å; Y166-D168 PolarHBondContact O-N 2.94Å; Y166-L212 HydrophobicContact CD2-CB 4.26Å; Y166-L212 HydrophobicContact CD2-CD1 4.25Å
167	F	97.3	Very high	89.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	88.9	177.1	-64.1	-70.9	0	0	0	108.7	F151 V153 F165 V170 S181 V202 I207 Q208 S209 G210 T211 V213	F151-F167 AromaticContact CE2-CD1 3.8Å; F151-F167 HydrophobicContact CE2-CD1 3.8Å; F151-F167 HydrophobicContact CE2-CE1 4.04Å; F151-F167 HydrophobicContact CZ-CD1 4.31Å; F151-F167 HydrophobicContact CZ-CE1 4.14Å; V153-F167 HydrophobicContact CB-CD1 4.26Å; V153-F167 HydrophobicContact CG2-CD1 3.86Å; V153-F167 HydrophobicContact CG2-CE1 3.87Å; F165-F167 HydrophobicContact CB-CE2 4.28Å; F165-F167 HydrophobicContact CB-CZ 4.24Å; F167-V170 HydrophobicContact CB-CG2 3.85Å; F167-V170 HydrophobicContact CD1-CG2 4.34Å; F167-V170 HydrophobicContact CG-CG2 4.42Å; F167-S181 WeakPolarHBondContact CE1-OG 3.37Å; F167-V202 HydrophobicContact CE2-CG1 4.08Å; F167-V202 HydrophobicContact CZ-CG1 4.13Å; F167-I207 HydrophobicContact CD1-CG2 3.8Å; F167-I207 HydrophobicContact CE1-CB 4.38Å; F167-I207 HydrophobicContact CE1-CG1 4.16Å; F167-I207 HydrophobicContact CE1-CG2 3.63Å; F167-I207 HydrophobicContact CE2-CG1 4.16Å; F167-I207 HydrophobicContact CG-CG2 4.35Å; F167-I207 HydrophobicContact CZ-CB 4.3Å; F167-I207 HydrophobicContact CZ-CD1 4.24Å; F167-I207 HydrophobicContact CZ-CG1 3.72Å; F167-I207 HydrophobicContact CZ-CG2 4.04Å; F167-Q208 WeakPolarHBondContact CB-O 3.38Å; F167-S209 CarbonylContact O-C 3.46Å; F167-S209 WeakPolarHBondContact O-CA 3.44Å; F167-G210 PolarHBondContact O-N 3.02Å; F167-T211 HydrophobicContact CD2-CG2 4.24Å; F167-T211 PolarHBondContact N-O 3.17Å; F167-V213 HydrophobicContact CD2-CG2 4.48Å; F167-V213 HydrophobicContact CE2-CG2 3.81Å
168	D	96.4	Very high	88.8	Confident	26 Å²	26	49.7 Å²	49.7	14%	0.139	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	-46.7	-177.7	-66.4	-116.8	0	0	0	112.2	R141 K152 T154 Y166	R141-D168 IonicContact NE-OD1 3.01Å; R141-D168 IonicContact NH2-OD1 2.62Å; K152-D168 HydrophobicContact CB-CB 3.95Å; K152-D168 HydrophobicContact CD-CB 3.49Å; K152-D168 VanDerWaalsContact CD-CB 3.49Å; K152-D168 WeakPolarHBondContact CE-OD1 3.48Å; K152-D168 HydrophobicContact CG-CB 3.66Å; K152-D168 IonicContact NZ-OD1 2.89Å; K152-D168 PolarHBondContact NZ-OD1 2.97Å; K152-D168 PolarHBondContact O-N 3.44Å; T154-D168 WeakPolarHBondContact CB-OD2 3.33Å; T154-D168 PolarHBondContact N-OD2 2.82Å; T154-D168 PolarHBondContact OG1-OD2 3.02Å; Y166-D168 HydrophobicContact CD1-CB 4.29Å; Y166-D168 WeakPolarHBondContact CD1-OD2 3.44Å; Y166-D168 HydrophobicContact CE1-CB 4.2Å; Y166-D168 PolarHBondContact O-N 2.94Å
169	D	94.2	Very high	88.4	Confident	62 Å²	62	47.8 Å²	47.8	33%	0.332	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	126.3	-178.3	-173.6	27.5	0	0	0	110.6	T150 F151 K152	T150-D169 WeakPolarHBondContact CB-OD2 3.25Å; T150-D169 PolarHBondContact OG1-OD2 3.27Å; F151-D169 CarbonylContact C-O 3.57Å; F151-D169 WeakPolarHBondContact CA-O 3.41Å; K152-D169 HydrophobicContact CB-CB 3.93Å; K152-D169 PolarHBondContact N-O 2.55Å; K152-D169 PolarHBondContact O-N 3.01Å; K152-D169 VanDerWaalsContact O-N 3.16Å
170	V	93.1	Very high	88.3	Confident	11 Å²	11	45.7 Å²	45.7	7%	0.067	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	107.1	-179.9	-174.2	0	0	0	0	106.6	F151 F167 K172 F174 I207 S209	F151-V170 HydrophobicContact CD2-CG2 4.08Å; F151-V170 HydrophobicContact CE2-CG2 4.24Å; F167-V170 HydrophobicContact CB-CG2 3.85Å; F167-V170 HydrophobicContact CD1-CG2 4.34Å; F167-V170 HydrophobicContact CG-CG2 4.42Å; V170-K172 PolarHBondContact O-N 3.14Å; V170-F174 HydrophobicContact CG1-CD2 3.66Å; V170-F174 HydrophobicContact CG1-CE2 4.13Å; V170-I207 HydrophobicContact CG1-CG2 4.36Å; V170-I207 HydrophobicContact CG2-CG2 4.33Å; V170-S209 PolarHBondContact N-OG 3.21Å; V170-S209 PolarHBondContact O-OG 2.79Å
171	A	91	Very high	88.4	Confident	12 Å²	12	40.6 Å²	40.6	10%	0.099	21%	0.211	C	C	.	.			trans	-53.5	133.5	177	0	0	0	0	0	111.2	F149 T150 E173 F174	F149-A171 HydrophobicContact CB-CB 3.87Å; F149-A171 HydrophobicContact CD1-CB 3.98Å; F149-A171 HydrophobicContact CG-CB 4.39Å; T150-A171 PolarHBondContact O-N 2.93Å; A171-E173 PolarHBondContact O-N 2.83Å; A171-F174 HydrophobicContact CB-CD2 3.95Å; A171-F174 HydrophobicContact CB-CE2 3.68Å; A171-F174 HydrophobicContact CB-CZ 4.01Å; A171-F174 WeakPolarHBondContact O-CD2 3.17Å; A171-F174 PolarHBondContact O-N 3.15Å
172	K	84.6	Confident	88.5	Confident	201 Å²	201	42.6 Å²	42.6	87%	0.874	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.3	-175	-69.7	-176.2	178.2	179.6	0	112.9	V170 F174	V170-K172 PolarHBondContact O-N 3.14Å; K172-F174 VanDerWaalsContact C-N 3.28Å
173	E	76.8	Confident	88.6	Confident	120 Å²	120	41.7 Å²	41.7	56%	0.561	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-9	-177.2	-59	82.9	-179.7	0	0	112.9	F149 A171 Q175	F149-E173 HydrophobicContact CD1-CB 3.74Å; F149-E173 HydrophobicContact CD1-CG 4.22Å; F149-E173 HydrophobicContact CE1-CB 3.23Å; F149-E173 HydrophobicContact CE1-CG 3.52Å; F149-E173 HydrophobicContact CZ-CB 3.89Å; F149-E173 HydrophobicContact CZ-CG 4.35Å; A171-E173 PolarHBondContact O-N 2.83Å; E173-Q175 PolarHBondContact O-N 2.78Å; E173-Q175 VanDerWaalsContact O-N 3.12Å
174	F	74.1	Confident	88.6	Confident	27 Å²	27	42.8 Å²	42.8	12%	0.118	22%	0.221	C	C	.	.			trans	-58	119.9	170.7	-69.4	-45.5	0	0	0	109.5	L121 F149 T150 F151 V170 A171 K172 D178 V179	L121-F174 HydrophobicContact CD1-CD1 3.87Å; L121-F174 HydrophobicContact CD1-CE1 3.34Å; L121-F174 HydrophobicContact CD1-CZ 3.86Å; L121-F174 HydrophobicContact CD2-CE1 4.14Å; L121-F174 HydrophobicContact CD2-CZ 4.3Å; L121-F174 HydrophobicContact CG-CE1 4.41Å; F149-F174 HydrophobicContact CB-CD1 4.5Å; F149-F174 HydrophobicContact CB-CE1 3.66Å; F149-F174 HydrophobicContact CB-CZ 3.86Å; F149-F174 HydrophobicContact CG-CE1 4.41Å; T150-F174 WeakPolarHBondContact O-CE2 3.3Å; T150-F174 WeakPolarHBondContact O-CZ 3.17Å; F151-F174 HydrophobicContact CB-CE2 3.85Å; F151-F174 HydrophobicContact CB-CZ 3.9Å; V170-F174 HydrophobicContact CG1-CD2 3.66Å; V170-F174 HydrophobicContact CG1-CE2 4.13Å; A171-F174 HydrophobicContact CB-CD2 3.95Å; A171-F174 HydrophobicContact CB-CE2 3.68Å; A171-F174 HydrophobicContact CB-CZ 4.01Å; A171-F174 WeakPolarHBondContact O-CD2 3.17Å; A171-F174 PolarHBondContact O-N 3.15Å; K172-F174 VanDerWaalsContact C-N 3.28Å; F174-D178 HydrophobicContact CB-CB 4.2Å; F174-D178 HydrophobicContact CD1-CB 3.86Å; F174-D178 HydrophobicContact CG-CB 4.33Å; F174-V179 HydrophobicContact CD1-CG1 4.29Å; F174-V179 HydrophobicContact CD2-CG1 3.73Å; F174-V179 HydrophobicContact CE1-CG1 4.46Å; F174-V179 HydrophobicContact CE2-CG1 3.89Å; F174-V179 HydrophobicContact CG-CG1 3.95Å; F174-V179 HydrophobicContact CZ-CG1 4.27Å
175	Q	63.1	Low	88.5	Confident	153 Å²	153	42.7 Å²	42.7	72%	0.715	22%	0.221	S	C	*	.			trans	-76	147.6	168.8	-63	-171.7	14	0	0	107.1	E173 N177 D178	E173-Q175 PolarHBondContact O-N 2.78Å; E173-Q175 VanDerWaalsContact O-N 3.12Å; Q175-N177 PolarHBondContact O-N 2.8Å; Q175-D178 PolarHBondContact N-OD2 2.84Å; Q175-D178 WeakPolarHBondContact O-CB 3.46Å; Q175-D178 PolarHBondContact O-N 2.81Å
176	G	62.8	Low	88.3	Confident	54 Å²	54	43.1 Å²	43.1	56%	0.557	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	10.1	-169	0	0	0	0	0	116.8	R204	G176-R204 WeakPolarHBondContact O-CD 3.38Å; G176-R204 PolarHBondContact O-NE 3.34Å
177	N	75.8	Confident	88	Confident	96 Å²	96	42.4 Å²	42.4	51%	0.513	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-4.6	168.2	-78.1	-32.7	0	0	0	113.5	K122 Q175 R204	K122-N177 WeakPolarHBondContact CD-O 3.35Å; K122-N177 WeakPolarHBondContact CE-O 3.36Å; K122-N177 PolarHBondContact NZ-O 2.9Å; Q175-N177 PolarHBondContact O-N 2.8Å; N177-R204 PolarHBondContact OD1-NH1 3.33Å
178	D	85.8	Confident	87.5	Confident	45 Å²	45	47.9 Å²	47.9	24%	0.241	25%	0.245	C	C	.	.	S	Bend	trans	-79.9	-37.9	-171.6	-69.1	-40.6	0	0	0	113.3	L121 K122 F174 Q175	L121-D178 CarbonylContact C-O 3.52Å; L121-D178 WeakPolarHBondContact CA-O 3.4Å; L121-D178 HydrophobicContact CD1-CB 4.01Å; K122-D178 PolarHBondContact N-O 2.79Å; F174-D178 HydrophobicContact CB-CB 4.2Å; F174-D178 HydrophobicContact CD1-CB 3.86Å; F174-D178 HydrophobicContact CG-CB 4.33Å; Q175-D178 PolarHBondContact N-OD2 2.84Å; Q175-D178 WeakPolarHBondContact O-CB 3.46Å; Q175-D178 PolarHBondContact O-N 2.81Å
179	V	89.8	Confident	86.9	Confident	8 Å²	8	48.4 Å²	48.4	5%	0.048	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.8	-176.2	-64.5	0	0	0	0	111.2	L121 F151 F174 I207	L121-V179 HydrophobicContact CD1-CG1 3.85Å; F151-V179 HydrophobicContact CB-CG1 4.36Å; F151-V179 HydrophobicContact CD1-CG1 4.33Å; F151-V179 HydrophobicContact CD2-CG1 4.06Å; F151-V179 HydrophobicContact CE2-CB 4.46Å; F151-V179 HydrophobicContact CE2-CG1 4.4Å; F151-V179 HydrophobicContact CG-CG1 4.01Å; F174-V179 HydrophobicContact CD1-CG1 4.29Å; F174-V179 HydrophobicContact CD2-CG1 3.73Å; F174-V179 HydrophobicContact CE1-CG1 4.46Å; F174-V179 HydrophobicContact CE2-CG1 3.89Å; F174-V179 HydrophobicContact CG-CG1 3.95Å; F174-V179 HydrophobicContact CZ-CG1 4.27Å; V179-I207 HydrophobicContact CB-CG2 4.36Å; V179-I207 HydrophobicContact CG2-CB 4.34Å; V179-I207 HydrophobicContact CG2-CG2 3.71Å
180	D	92.4	Very high	86	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.011	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	142.6	176.3	-90.4	-47.2	0	0	0	109.6	Y120 W182 K201 R204	Y120-D180 HydrophobicContact CD1-CB 4.24Å; Y120-D180 HydrophobicContact CE1-CB 3.34Å; Y120-D180 PolarHBondContact N-O 3.08Å; Y120-D180 PolarHBondContact O-N 2.81Å; Y120-D180 PolarHBondContact OH-OD2 3.35Å; D180-W182 HydrophobicContact CB-CE3 3.95Å; D180-W182 HydrophobicContact CB-CZ3 3.61Å; D180-K201 WeakPolarHBondContact OD1-CE 3.26Å; D180-K201 IonicContact OD1-NZ 2.8Å; D180-K201 PolarHBondContact OD1-NZ 3.2Å; D180-K201 IonicContact OD2-NZ 2.66Å; D180-K201 PolarHBondContact OD2-NZ 3.44Å; D180-R204 IonicContact OD1-CZ 2.86Å; D180-R204 IonicContact OD1-NE 3.6Å; D180-R204 PolarHBondContact OD1-NE 3.08Å; D180-R204 IonicContact OD1-NH2 3.38Å; D180-R204 PolarHBondContact OD1-NH2 3.07Å; D180-R204 IonicContact OD2-CZ 2.8Å; D180-R204 IonicContact OD2-NE 3.22Å; D180-R204 PolarHBondContact OD2-NE 3.28Å; D180-R204 IonicContact OD2-NH2 3.37Å; D180-R204 PolarHBondContact OD2-NH2 3.41Å
181	S	95.6	Very high	84.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.8	171.9	-72.1	0	0	0	0	109.7	D118 N119 F167 V202	D118-S181 WeakPolarHBondContact O-CA 3.42Å; N119-S181 WeakPolarHBondContact OD1-CB 3.32Å; N119-S181 PolarHBondContact OD1-OG 2.93Å; F167-S181 WeakPolarHBondContact CE1-OG 3.37Å; S181-V202 PolarHBondContact O-N 2.85Å
182	W	96.9	Very high	83.1	Confident	42 Å²	42	63.9 Å²	63.9	16%	0.159	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	173.6	174.9	67.6	79.4	0	0	0	110.8	D118 Y120 D180 I200 K201	D118-W182 HydrophobicContact CB-CD2 4.01Å; D118-W182 HydrophobicContact CB-CG 4.38Å; D118-W182 HydrophobicContact CB-CH2 4.46Å; D118-W182 HydrophobicContact CB-CZ2 3.57Å; D118-W182 PolarHBondContact N-O 3.16Å; D118-W182 PolarHBondContact O-N 2.81Å; D118-W182 PolarHBondContact OD2-NE1 2.83Å; Y120-W182 AromaticContact CD1-CH2 3.94Å; Y120-W182 HydrophobicContact CD1-CH2 3.94Å; Y120-W182 HydrophobicContact CD1-CZ3 4.2Å; Y120-W182 HydrophobicContact CE1-CE3 4.01Å; Y120-W182 AromaticContact CE1-CH2 2.99Å; Y120-W182 HydrophobicContact CE1-CH2 2.99Å; Y120-W182 AromaticContact CE1-CZ2 3.94Å; Y120-W182 HydrophobicContact CE1-CZ2 3.94Å; Y120-W182 AromaticContact CE1-CZ3 3.09Å; Y120-W182 HydrophobicContact CE1-CZ3 3.09Å; Y120-W182 AromaticContact CZ-CH2 3.37Å; Y120-W182 AromaticContact CZ-CZ3 3.56Å; Y120-W182 VanDerWaalsContact OH-CH2 3.24Å; Y120-W182 WeakPolarHBondContact OH-CH2 3.47Å; Y120-W182 VanDerWaalsContact OH-CZ3 3.24Å; Y120-W182 WeakPolarHBondContact OH-CZ3 3.37Å; D180-W182 HydrophobicContact CB-CE3 3.95Å; D180-W182 HydrophobicContact CB-CZ3 3.61Å; W182-I200 CarbonylContact C-O 3.57Å; W182-I200 WeakPolarHBondContact CA-O 3.43Å; W182-I200 WeakPolarHBondContact CB-O 3.27Å; W182-K201 HydrophobicContact CB-CB 4.07Å; W182-K201 HydrophobicContact CB-CG 4.27Å
183	F	98	Very high	82.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	150.2	167	65.9	-81.5	0	0	0	111	Y56 F90 Y91 G116 I117 F165 I200 H215	Y56-F183 AromaticContact CD2-CE2 3.92Å; Y56-F183 HydrophobicContact CD2-CE2 3.92Å; Y56-F183 HydrophobicContact CD2-CZ 4.09Å; Y56-F183 AromaticContact CE2-CE2 3.84Å; Y56-F183 HydrophobicContact CE2-CE2 3.84Å; Y56-F183 HydrophobicContact CE2-CZ 4.38Å; Y56-F183 HydrophobicContact CG-CZ 4.25Å; F90-F183 AromaticContact CE2-CD2 3.76Å; F90-F183 HydrophobicContact CE2-CD2 3.76Å; F90-F183 HydrophobicContact CE2-CE2 4.22Å; F90-F183 AromaticContact CZ-CD2 3.69Å; F90-F183 HydrophobicContact CZ-CD2 3.69Å; F90-F183 HydrophobicContact CZ-CE2 4.43Å; Y91-F183 AromaticContact CE2-CD2 3.68Å; Y91-F183 HydrophobicContact CE2-CD2 3.68Å; Y91-F183 AromaticContact CE2-CE2 3.56Å; Y91-F183 HydrophobicContact CE2-CE2 3.56Å; Y91-F183 AromaticContact CZ-CE2 3.74Å; Y91-F183 WeakPolarHBondContact OH-CE2 3.24Å; G116-F183 CarbonylContact O-C 3.55Å; G116-F183 WeakPolarHBondContact O-CA 3.5Å; G116-F183 VanDerWaalsContact O-CB 3.26Å; G116-F183 WeakPolarHBondContact O-CB 3.46Å; I117-F183 HydrophobicContact CB-CB 4.4Å; I117-F183 HydrophobicContact CG1-CB 3.76Å; F165-F183 AromaticContact CE2-CD1 3.83Å; F165-F183 HydrophobicContact CE2-CD1 3.83Å; F165-F183 HydrophobicContact CE2-CE1 4.29Å; F165-F183 HydrophobicContact CZ-CB 4.49Å; F165-F183 HydrophobicContact CZ-CD1 4.02Å; F183-I200 HydrophobicContact CD1-CB 4.15Å; F183-I200 HydrophobicContact CE1-CB 3.61Å; F183-I200 HydrophobicContact CE1-CD1 4.25Å; F183-I200 HydrophobicContact CE1-CG1 4.45Å; F183-I200 HydrophobicContact CE1-CG2 3.78Å; F183-I200 HydrophobicContact CE2-CB 4.35Å; F183-I200 HydrophobicContact CE2-CD1 3.99Å; F183-I200 HydrophobicContact CE2-CG1 4.47Å; F183-I200 HydrophobicContact CZ-CB 3.76Å; F183-I200 HydrophobicContact CZ-CD1 3.52Å; F183-I200 HydrophobicContact CZ-CG1 4.09Å; F183-I200 HydrophobicContact CZ-CG2 4.15Å; F183-I200 PolarHBondContact N-O 3.43Å; F183-I200 PolarHBondContact O-N 3.47Å; F183-H215 HydrophobicContact CE1-CB 4.25Å; F183-H215 AromaticContact CE1-CD2 3.55Å; F183-H215 AromaticContact CE1-CE1 3.63Å; F183-H215 AromaticContact CE1-CG 3.54Å; F183-H215 AromaticContact CE1-ND1 3.61Å; F183-H215 AromaticContact CE1-NE2 3.6Å; F183-H215 HydrophobicContact CZ-CB 3.99Å; F183-H215 AromaticContact CZ-CD2 3.83Å; F183-H215 AromaticContact CZ-CG 3.75Å
184	T	97.4	Very high	82.2	Confident	23 Å²	23	60.1 Å²	60.1	14%	0.141	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.5	179.4	61.6	0	0	0	0	110.8	F90 G115 G116 A198 E199	F90-T184 WeakPolarHBondContact CE1-O 3.08Å; F90-T184 WeakPolarHBondContact CZ-O 3.46Å; G115-T184 CarbonylContact C-O 3.56Å; G115-T184 WeakPolarHBondContact CA-O 3.46Å; G116-T184 PolarHBondContact N-O 3.49Å; G116-T184 PolarHBondContact O-N 3.33Å; T184-A198 CarbonylContact C-O 3.55Å; T184-A198 WeakPolarHBondContact CA-O 3.1Å; T184-E199 HydrophobicContact CG2-CB 3.92Å; T184-E199 HydrophobicContact CG2-CG 3.84Å
185	G	96.5	Very high	82.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	141.9	175.3	0	0	0	0	0	113.6	V114 W197 A198	V114-G185 WeakPolarHBondContact O-CA 3.49Å; G185-W197 WeakPolarHBondContact O-CA 3.26Å; G185-A198 PolarHBondContact N-O 2.85Å; G185-A198 PolarHBondContact O-N 2.81Å
186	A	94	Very high	84.1	Confident	8 Å²	8	55.6 Å²	55.6	7%	0.066	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	132.8	178.5	0	0	0	0	0	110.8	N93 V114 W197	N93-A186 PolarHBondContact ND2-O 3.25Å; V114-A186 PolarHBondContact O-N 3.2Å; A186-W197 HydrophobicContact CB-CD2 4.22Å; A186-W197 HydrophobicContact CB-CH2 4.41Å; A186-W197 HydrophobicContact CB-CZ2 4.04Å
187	I	91.8	Very high	85.5	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.308	C	S	.	.			trans	-105.7	119.3	176.8	-53.2	-64.4	0	0	0	109.2	H27 I29 Y54 Y55 Y91 C189 D195 P196	H27-I187 HydrophobicContact CB-CG2 3.5Å; H27-I187 VanDerWaalsContact CB-CG2 3.5Å; H27-I187 VanDerWaalsContact CG-CG2 3.48Å; I29-I187 HydrophobicContact CD1-CG1 4.35Å; I29-I187 HydrophobicContact CG2-CB 3.84Å; I29-I187 HydrophobicContact CG2-CG1 4Å; I29-I187 HydrophobicContact CG2-CG2 3.58Å; Y54-I187 HydrophobicContact CE1-CD1 4.11Å; Y54-I187 HydrophobicContact CE1-CG1 4.07Å; Y55-I187 HydrophobicContact CD2-CD1 4.17Å; Y91-I187 HydrophobicContact CD1-CD1 3.6Å; Y91-I187 HydrophobicContact CE1-CD1 4.48Å; Y91-I187 HydrophobicContact CG-CD1 4.08Å; I187-C189 PolarHBondContact O-N 2.78Å; I187-D195 VanDerWaalsContact O-CB 3.26Å; I187-D195 WeakPolarHBondContact O-CB 3.4Å; I187-P196 HydrophobicContact CB-CG 4.38Å; I187-P196 PolarHBondContact N-O 2.81Å; I187-P196 WeakPolarHBondContact O-CD 3.35Å
188	K	87.2	Confident	86.5	Confident	116 Å²	116	53.7 Å²	53.7	50%	0.504	28%	0.284	S	S	.	.			trans	-70.4	114.4	-179.4	-72.3	-179.4	174.6	169.2	0	111.3	N93 D195	N93-K188 WeakPolarHBondContact OD1-CD 3.45Å; N93-K188 WeakPolarHBondContact OD1-CE 3.15Å; N93-K188 PolarHBondContact OD1-NZ 3.45Å; K188-D195 WeakPolarHBondContact CA-OD1 3.28Å
189	C	84.7	Confident	87	Confident	37 Å²	37	55.2 Å²	55.2	25%	0.25	29%	0.29	C	S	.	.			trans	-107.2	8.2	-175.3	-73.5	0	0	0	0	115.2	C30 I187 D195 P196	C30-C189 WeakPolarHBondContact CA-SG 3.24Å; C30-C189 HydrophobicContact CB-CB 3.54Å; C30-C189 WeakPolarHBondContact CB-SG 3.2Å; C30-C189 WeakPolarHBondContact SG-CA 3.5Å; C30-C189 WeakPolarHBondContact SG-CB 3.45Å; C30-C189 CovalentContact SG-SG 2.02Å; C30-C189 PolarHBondContact SG-SG 3.38Å; I187-C189 PolarHBondContact O-N 2.78Å; C189-D195 PolarHBondContact N-OD1 2.92Å; C189-P196 WeakPolarHBondContact SG-CD 3.47Å; C189-P196 WeakPolarHBondContact SG-CG 3.41Å
190	G	75.6	Confident	87.4	Confident	48 Å²	48	54.9 Å²	54.9	50%	0.495	29%	0.288	S	S	.	.			trans	81.2	165.5	-176.7	0	0	0	0	0	112.3	N192	G190-N192 PolarHBondContact O-N 3.46Å
191	K	61	Low	87.5	Confident	200 Å²	200	58 Å²	58	87%	0.87	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	12.7	-153.3	-69.5	-169	173.5	-175.2	0	118.2
192	N	60.8	Low	87.6	Confident	161 Å²	161	58 Å²	58	86%	0.861	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	8.5	-173.8	-64.7	-10.7	0	0	0	114.4	G190	G190-N192 PolarHBondContact O-N 3.46Å
193	G	63.8	Low	87.5	Confident	51 Å²	51	58 Å²	58	53%	0.526	31%	0.306	S	S	.	.	S	Bend	trans	-151.4	162	175.5	0	0	0	0	0	111.9
194	E	79.3	Confident	87.3	Confident	192 Å²	192	62.1 Å²	62.1	90%	0.897	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-60.6	137.1	164.6	-69	179.4	179.3	0	0	108.8	P196	E194-P196 VanDerWaalsContact O-CD 3.3Å; E194-P196 WeakPolarHBondContact O-CD 3.17Å
195	D	85.4	Confident	87.1	Confident	59 Å²	59	66.7 Å²	66.7	32%	0.316	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-67.3	116.5	177.5	-75.1	-26.1	0	0	0	108.6	I187 K188 C189 W197	I187-D195 VanDerWaalsContact O-CB 3.26Å; I187-D195 WeakPolarHBondContact O-CB 3.4Å; K188-D195 WeakPolarHBondContact CA-OD1 3.28Å; C189-D195 PolarHBondContact N-OD1 2.92Å; D195-W197 VanDerWaalsContact O-CD1 3.3Å
196	P	90.9	Very high	87	Confident	25 Å²	25	67.2 Å²	67.2	16%	0.162	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-64.6	150.3	179	27.8	-35.3	0	0	0	110.5	I29 I187 C189 E194	I29-P196 HydrophobicContact CD1-CB 4.09Å; I29-P196 HydrophobicContact CD1-CG 4.26Å; I29-P196 HydrophobicContact CG1-CB 4.06Å; I29-P196 HydrophobicContact CG1-CG 4.02Å; I29-P196 HydrophobicContact CG2-CG 3.94Å; I187-P196 HydrophobicContact CB-CG 4.38Å; I187-P196 PolarHBondContact N-O 2.81Å; I187-P196 WeakPolarHBondContact O-CD 3.35Å; C189-P196 WeakPolarHBondContact SG-CD 3.47Å; C189-P196 WeakPolarHBondContact SG-CG 3.41Å; E194-P196 VanDerWaalsContact O-CD 3.3Å; E194-P196 WeakPolarHBondContact O-CD 3.17Å
197	W	93	Very high	87	Confident	110 Å²	110	67.4 Å²	67.4	42%	0.417	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.9	177.4	-69.6	69.1	0	0	0	109.6	Q113 G185 A186 D195	Q113-W197 HydrophobicContact CG-CH2 4.16Å; G185-W197 WeakPolarHBondContact O-CA 3.26Å; A186-W197 HydrophobicContact CB-CD2 4.22Å; A186-W197 HydrophobicContact CB-CH2 4.41Å; A186-W197 HydrophobicContact CB-CZ2 4.04Å; D195-W197 VanDerWaalsContact O-CD1 3.3Å
198	A	95.9	Very high	87.1	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	139.3	166.9	0	0	0	0	0	109.3	I29 G36 Y54 Y91 T184 G185	I29-A198 HydrophobicContact CD1-CB 4.31Å; G36-A198 CarbonylContact O-C 3.56Å; G36-A198 VanDerWaalsContact O-CA 3.31Å; G36-A198 WeakPolarHBondContact O-CA 3.41Å; Y54-A198 HydrophobicContact CD1-CB 3.78Å; Y54-A198 HydrophobicContact CG-CB 4.49Å; Y91-A198 HydrophobicContact CD1-CB 4.38Å; Y91-A198 HydrophobicContact CE1-CB 3.64Å; T184-A198 CarbonylContact C-O 3.55Å; T184-A198 WeakPolarHBondContact CA-O 3.1Å; G185-A198 PolarHBondContact N-O 2.85Å; G185-A198 PolarHBondContact O-N 2.81Å
199	E	96.8	Very high	87.6	Confident	77 Å²	77	68.8 Å²	68.8	36%	0.36	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.9	178.1	-178.1	177.8	120.2	0	0	109.8	G36 T184	G36-E199 PolarHBondContact O-N 2.88Å; T184-E199 HydrophobicContact CG2-CB 3.92Å; T184-E199 HydrophobicContact CG2-CG 3.84Å
200	I	97.4	Very high	88.1	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	118.7	172.2	-60.7	177.5	0	0	0	108.5	N53 Y56 Y91 W182 F183	N53-I200 HydrophobicContact CB-CD1 3.48Å; N53-I200 VanDerWaalsContact CB-CD1 3.48Å; N53-I200 HydrophobicContact CB-CG1 3.65Å; N53-I200 HydrophobicContact CB-CG2 4.33Å; Y56-I200 HydrophobicContact CD2-CD1 3.79Å; Y56-I200 HydrophobicContact CG-CD1 4.03Å; Y91-I200 WeakPolarHBondContact OH-CD1 3.41Å; Y91-I200 WeakPolarHBondContact OH-CG1 3.36Å; W182-I200 CarbonylContact C-O 3.57Å; W182-I200 WeakPolarHBondContact CA-O 3.43Å; W182-I200 WeakPolarHBondContact CB-O 3.27Å; F183-I200 HydrophobicContact CD1-CB 4.15Å; F183-I200 HydrophobicContact CE1-CB 3.61Å; F183-I200 HydrophobicContact CE1-CD1 4.25Å; F183-I200 HydrophobicContact CE1-CG1 4.45Å; F183-I200 HydrophobicContact CE1-CG2 3.78Å; F183-I200 HydrophobicContact CE2-CB 4.35Å; F183-I200 HydrophobicContact CE2-CD1 3.99Å; F183-I200 HydrophobicContact CE2-CG1 4.47Å; F183-I200 HydrophobicContact CZ-CB 3.76Å; F183-I200 HydrophobicContact CZ-CD1 3.52Å; F183-I200 HydrophobicContact CZ-CG1 4.09Å; F183-I200 HydrophobicContact CZ-CG2 4.15Å; F183-I200 PolarHBondContact N-O 3.43Å; F183-I200 PolarHBondContact O-N 3.47Å
201	K	96.5	Very high	89.2	Confident	69 Å²	69	65.3 Å²	65.3	30%	0.3	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.5	-178.2	-177	166.6	-175.1	158.9	0	111.1	D180 W182 P203 R204	D180-K201 WeakPolarHBondContact OD1-CE 3.26Å; D180-K201 IonicContact OD1-NZ 2.8Å; D180-K201 PolarHBondContact OD1-NZ 3.2Å; D180-K201 IonicContact OD2-NZ 2.66Å; D180-K201 PolarHBondContact OD2-NZ 3.44Å; W182-K201 HydrophobicContact CB-CB 4.07Å; W182-K201 HydrophobicContact CB-CG 4.27Å; K201-P203 WeakPolarHBondContact O-CD 3.32Å; K201-R204 VanDerWaalsContact NZ-NH2 3.19Å
202	V	96.9	Very high	91	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.288	C	S	.	.			trans	-67.8	122.8	171.2	-178.6	0	0	0	0	108.4	F165 F167 S181 R204 I207 V213	F165-V202 HydrophobicContact CD2-CG2 4.1Å; F165-V202 HydrophobicContact CE2-CG2 4.4Å; F167-V202 HydrophobicContact CE2-CG1 4.08Å; F167-V202 HydrophobicContact CZ-CG1 4.13Å; S181-V202 PolarHBondContact O-N 2.85Å; V202-R204 PolarHBondContact O-N 3.49Å; V202-I207 HydrophobicContact CB-CD1 4.39Å; V202-I207 HydrophobicContact CB-CG1 4.42Å; V202-I207 HydrophobicContact CG1-CD1 4.33Å; V202-I207 HydrophobicContact CG1-CG1 3.82Å; V202-V213 HydrophobicContact CG1-CG2 3.91Å; V202-V213 HydrophobicContact CG2-CG1 4.14Å; V202-V213 HydrophobicContact CG2-CG2 4.44Å
203	P	95.1	Very high	92.8	Very high	40 Å²	40	48.7 Å²	48.7	26%	0.26	25%	0.247	S	C	.	.			trans	-62.7	127.1	178.2	-16.2	27.4	0	0	0	109.8	I60 K201 K205 W206	I60-P203 HydrophobicContact CD1-CG 4.34Å; K201-P203 WeakPolarHBondContact O-CD 3.32Å; P203-K205 HydrophobicContact CB-CG 4.38Å; P203-K205 PolarHBondContact O-N 3.19Å; P203-W206 WeakPolarHBondContact O-CB 3.48Å; P203-W206 PolarHBondContact O-N 2.86Å
204	R	92.8	Very high	94.4	Very high	87 Å²	87	47 Å²	47	33%	0.328	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-57.7	-27.7	-170.7	-60.3	-172.9	-175.1	126.9	-4.5	114.5	G176 N177 D180 K201 V202 W206 I207	G176-R204 WeakPolarHBondContact O-CD 3.38Å; G176-R204 PolarHBondContact O-NE 3.34Å; N177-R204 PolarHBondContact OD1-NH1 3.33Å; D180-R204 IonicContact OD1-CZ 2.86Å; D180-R204 IonicContact OD1-NE 3.6Å; D180-R204 PolarHBondContact OD1-NE 3.08Å; D180-R204 IonicContact OD1-NH2 3.38Å; D180-R204 PolarHBondContact OD1-NH2 3.07Å; D180-R204 IonicContact OD2-CZ 2.8Å; D180-R204 IonicContact OD2-NE 3.22Å; D180-R204 PolarHBondContact OD2-NE 3.28Å; D180-R204 IonicContact OD2-NH2 3.37Å; D180-R204 PolarHBondContact OD2-NH2 3.41Å; K201-R204 VanDerWaalsContact NZ-NH2 3.19Å; V202-R204 PolarHBondContact O-N 3.49Å; R204-W206 PolarHBondContact O-N 3.42Å; R204-W206 VanDerWaalsContact O-N 3.11Å; R204-I207 PolarHBondContact O-N 2.9Å
205	K	92.8	Very high	95.3	Very high	120 Å²	120	37.9 Å²	37.9	52%	0.522	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-57.8	-22.7	175	70.8	179.9	-174.8	179.9	0	113.1	E44 E49 P203	E44-K205 IonicContact OE1-NZ 2.79Å; E44-K205 PolarHBondContact OE1-NZ 2.66Å; E44-K205 IonicContact OE2-NZ 3.49Å; E44-K205 PolarHBondContact OE2-NZ 2.67Å; E49-K205 WeakPolarHBondContact OE2-CE 3.39Å; E49-K205 IonicContact OE2-NZ 2.55Å; P203-K205 HydrophobicContact CB-CG 4.38Å; P203-K205 PolarHBondContact O-N 3.19Å
206	W	95.1	Very high	95.8	Very high	11 Å²	11	35.8 Å²	35.8	4%	0.042	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-97.4	-8.8	179.3	-62.6	117.7	0	0	0	113.7	E44 N45 E49 I60 L62 P203 R204 Q208 T211	E44-W206 HydrophobicContact CG-CZ2 3.93Å; N45-W206 VanDerWaalsContact O-CH2 3.32Å; N45-W206 WeakPolarHBondContact O-CH2 3.4Å; E49-W206 HydrophobicContact CB-CZ2 3.7Å; E49-W206 PolarHBondContact OE2-NE1 3.5Å; I60-W206 HydrophobicContact CB-CD2 4.45Å; I60-W206 HydrophobicContact CB-CG 4.49Å; I60-W206 HydrophobicContact CD1-CB 3.97Å; I60-W206 HydrophobicContact CD1-CD2 4.28Å; I60-W206 HydrophobicContact CD1-CG 3.61Å; I60-W206 HydrophobicContact CG2-CB 3.77Å; I60-W206 HydrophobicContact CG2-CD2 3.64Å; I60-W206 HydrophobicContact CG2-CE3 3.67Å; I60-W206 HydrophobicContact CG2-CG 3.69Å; I60-W206 HydrophobicContact CG2-CZ3 4.46Å; L62-W206 HydrophobicContact CD1-CE3 4.33Å; L62-W206 HydrophobicContact CD1-CZ3 3.89Å; L62-W206 HydrophobicContact CD2-CE3 3.73Å; L62-W206 HydrophobicContact CD2-CZ3 4.05Å; L62-W206 HydrophobicContact CG-CE3 4.01Å; L62-W206 HydrophobicContact CG-CZ3 3.78Å; P203-W206 WeakPolarHBondContact O-CB 3.48Å; P203-W206 PolarHBondContact O-N 2.86Å; R204-W206 PolarHBondContact O-N 3.42Å; R204-W206 VanDerWaalsContact O-N 3.11Å; W206-Q208 PolarHBondContact O-N 3.4Å; W206-T211 WeakPolarHBondContact O-CB 3.48Å; W206-T211 VanDerWaalsContact O-CG2 3.24Å; W206-T211 WeakPolarHBondContact O-CG2 3.04Å; W206-T211 PolarHBondContact O-OG1 2.87Å; W206-T211 VanDerWaalsContact O-OG1 3.13Å
207	I	94.4	Very high	96	Very high	12 Å²	12	36.1 Å²	36.1	6%	0.062	17%	0.172	C	C	.	.			trans	-79.9	87.5	-179.9	-58.3	-178.9	0	0	0	108.6	F151 F167 V170 V179 V202 R204	F151-I207 HydrophobicContact CE2-CG2 4.18Å; F167-I207 HydrophobicContact CD1-CG2 3.8Å; F167-I207 HydrophobicContact CE1-CB 4.38Å; F167-I207 HydrophobicContact CE1-CG1 4.16Å; F167-I207 HydrophobicContact CE1-CG2 3.63Å; F167-I207 HydrophobicContact CE2-CG1 4.16Å; F167-I207 HydrophobicContact CG-CG2 4.35Å; F167-I207 HydrophobicContact CZ-CB 4.3Å; F167-I207 HydrophobicContact CZ-CD1 4.24Å; F167-I207 HydrophobicContact CZ-CG1 3.72Å; F167-I207 HydrophobicContact CZ-CG2 4.04Å; V170-I207 HydrophobicContact CG1-CG2 4.36Å; V170-I207 HydrophobicContact CG2-CG2 4.33Å; V179-I207 HydrophobicContact CB-CG2 4.36Å; V179-I207 HydrophobicContact CG2-CB 4.34Å; V179-I207 HydrophobicContact CG2-CG2 3.71Å; V202-I207 HydrophobicContact CB-CD1 4.39Å; V202-I207 HydrophobicContact CB-CG1 4.42Å; V202-I207 HydrophobicContact CG1-CD1 4.33Å; V202-I207 HydrophobicContact CG1-CG1 3.82Å; R204-I207 PolarHBondContact O-N 2.9Å
208	Q	94.3	Very high	96	Very high	88 Å²	88	31.2 Å²	31.2	41%	0.411	16%	0.155	S	C	.	.	S	Bend	trans	-147.1	157.7	175.6	64	-178.6	-28.1	0	0	111.4	L62 F167 W206 G210 T211	L62-Q208 HydrophobicContact CD2-CG 4.03Å; F167-Q208 WeakPolarHBondContact CB-O 3.38Å; W206-Q208 PolarHBondContact O-N 3.4Å; Q208-G210 PolarHBondContact O-N 3.16Å; Q208-T211 VanDerWaalsContact CG-OG1 3.25Å; Q208-T211 WeakPolarHBondContact CG-OG1 3.47Å; Q208-T211 VanDerWaalsContact O-CB 3.25Å; Q208-T211 WeakPolarHBondContact O-CB 3.2Å; Q208-T211 PolarHBondContact O-N 3.04Å; Q208-T211 VanDerWaalsContact O-N 3.1Å; Q208-T211 PolarHBondContact O-OG1 2.67Å
209	S	96	Very high	95.8	Very high	57 Å²	57	33.5 Å²	33.5	40%	0.399	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	134.2	-178.1	-50.8	0	0	0	0	112.6	F167 V170 T211	F167-S209 CarbonylContact O-C 3.46Å; F167-S209 WeakPolarHBondContact O-CA 3.44Å; V170-S209 PolarHBondContact N-OG 3.21Å; V170-S209 PolarHBondContact O-OG 2.79Å; S209-T211 VanDerWaalsContact C-N 3.33Å
210	G	96.8	Very high	95.5	Very high	11 Å²	11	33.3 Å²	33.3	11%	0.113	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	12.1	-178.6	0	0	0	0	0	114.4	K63 Q64 F167 Q208	K63-G210 PolarHBondContact N-O 3.1Å; Q64-G210 PolarHBondContact N-O 3.37Å; F167-G210 PolarHBondContact O-N 3.02Å; Q208-G210 PolarHBondContact O-N 3.16Å
211	T	97.9	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.8	174.2	-53.1	0	0	0	0	110.8	I60 R61 L62 F167 W206 Q208 S209 V213	I60-T211 HydrophobicContact CG2-CG2 3.74Å; R61-T211 WeakPolarHBondContact O-CA 3.49Å; L62-T211 HydrophobicContact CD2-CG2 3.84Å; L62-T211 WeakPolarHBondContact CD2-OG1 3.44Å; F167-T211 HydrophobicContact CD2-CG2 4.24Å; F167-T211 PolarHBondContact N-O 3.17Å; W206-T211 WeakPolarHBondContact O-CB 3.48Å; W206-T211 VanDerWaalsContact O-CG2 3.24Å; W206-T211 WeakPolarHBondContact O-CG2 3.04Å; W206-T211 PolarHBondContact O-OG1 2.87Å; W206-T211 VanDerWaalsContact O-OG1 3.13Å; Q208-T211 VanDerWaalsContact CG-OG1 3.25Å; Q208-T211 WeakPolarHBondContact CG-OG1 3.47Å; Q208-T211 VanDerWaalsContact O-CB 3.25Å; Q208-T211 WeakPolarHBondContact O-CB 3.2Å; Q208-T211 PolarHBondContact O-N 3.04Å; Q208-T211 VanDerWaalsContact O-N 3.1Å; Q208-T211 PolarHBondContact O-OG1 2.67Å; S209-T211 VanDerWaalsContact C-N 3.33Å; T211-V213 HydrophobicContact CG2-CG2 4.11Å
212	L	98.3	Very high	95.2	Very high	13 Å²	13	32.8 Å²	32.8	7%	0.068	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.8	171	-178.2	63.7	0	0	0	109	I60 R61 Q64 P67 L156 A164 F165 Y166 E214	I60-L212 WeakPolarHBondContact CA-O 3.4Å; R61-L212 PolarHBondContact N-O 2.89Å; R61-L212 PolarHBondContact O-N 3.14Å; Q64-L212 HydrophobicContact CB-CB 3.82Å; Q64-L212 HydrophobicContact CG-CB 3.71Å; Q64-L212 HydrophobicContact CG-CD2 4.44Å; P67-L212 HydrophobicContact CG-CD1 4.31Å; L156-L212 HydrophobicContact CD1-CD1 4.48Å; A164-L212 HydrophobicContact CB-CD1 4.35Å; F165-L212 WeakPolarHBondContact O-CA 3.36Å; Y166-L212 HydrophobicContact CD2-CB 4.26Å; Y166-L212 HydrophobicContact CD2-CD1 4.25Å; L212-E214 HydrophobicContact CD1-CG 4.3Å; L212-E214 HydrophobicContact CD2-CG 4.09Å; L212-E214 HydrophobicContact CG-CG 3.89Å
213	V	98.3	Very high	95	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.7	176.1	-175.6	0	0	0	0	108.6	Q58 L59 I60 A164 F165 F167 V202 T211 H215	Q58-V213 HydrophobicContact CG-CG1 3.7Å; L59-V213 CarbonylContact O-C 3.58Å; L59-V213 WeakPolarHBondContact O-CA 2.92Å; I60-V213 HydrophobicContact CG1-CB 4.45Å; I60-V213 HydrophobicContact CG1-CG1 3.91Å; I60-V213 HydrophobicContact CG1-CG2 4.04Å; I60-V213 HydrophobicContact CG2-CG2 4.24Å; A164-V213 CarbonylContact C-O 3.51Å; A164-V213 WeakPolarHBondContact CA-O 3.34Å; A164-V213 VanDerWaalsContact CB-O 3.28Å; A164-V213 WeakPolarHBondContact CB-O 3.5Å; F165-V213 HydrophobicContact CB-CB 4.35Å; F165-V213 PolarHBondContact N-O 3.04Å; F165-V213 PolarHBondContact O-N 3.41Å; F167-V213 HydrophobicContact CD2-CG2 4.48Å; F167-V213 HydrophobicContact CE2-CG2 3.81Å; V202-V213 HydrophobicContact CG1-CG2 3.91Å; V202-V213 HydrophobicContact CG2-CG1 4.14Å; V202-V213 HydrophobicContact CG2-CG2 4.44Å; T211-V213 HydrophobicContact CG2-CG2 4.11Å; V213-H215 VanDerWaalsContact CG1-CE1 3.41Å; V213-H215 WeakPolarHBondContact CG1-CE1 3.35Å
214	E	98	Very high	94.9	Very high	15 Å²	15	39.8 Å²	39.8	7%	0.07	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.1	-176.2	-63.4	175.1	98.4	0	0	110.9	Q58 L59 R61 K162 A164 L212 N257	Q58-E214 CarbonylContact C-O 3.57Å; Q58-E214 WeakPolarHBondContact CA-O 3.35Å; L59-E214 PolarHBondContact N-O 2.92Å; L59-E214 PolarHBondContact O-N 3.44Å; R61-E214 IonicContact CZ-OE2 3.65Å; R61-E214 IonicContact NE-OE2 2.67Å; R61-E214 IonicContact NH2-OE2 2.67Å; R61-E214 PolarHBondContact NH2-OE2 3.46Å; K162-E214 VanDerWaalsContact CE-OE1 3.26Å; K162-E214 WeakPolarHBondContact CE-OE1 3.34Å; K162-E214 IonicContact NZ-OE1 3.14Å; K162-E214 PolarHBondContact NZ-OE1 2.87Å; A164-E214 HydrophobicContact CB-CB 4.49Å; A164-E214 HydrophobicContact CB-CG 3.98Å; L212-E214 HydrophobicContact CD1-CG 4.3Å; L212-E214 HydrophobicContact CD2-CG 4.09Å; L212-E214 HydrophobicContact CG-CG 3.89Å; E214-N257 PolarHBondContact OE1-ND2 2.04Å; E214-N257 PolarHBondContact OE2-ND2 2.86Å; E214-N257 VanDerWaalsContact OE2-ND2 3.07Å
215	H	97.7	Very high	94.9	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.4	176.9	-56.7	89.3	0	0	0	109.7	Y56 S57 Q58 K162 I163 F165 F183 V213	Y56-H215 HydrophobicContact CD1-CB 3.79Å; Y56-H215 HydrophobicContact CE1-CB 4.44Å; Y56-H215 HydrophobicContact CG-CB 4.28Å; S57-H215 CarbonylContact O-C 3.57Å; S57-H215 WeakPolarHBondContact O-CA 3.43Å; Q58-H215 WeakPolarHBondContact CG-NE2 3.23Å; Q58-H215 PolarHBondContact OE1-NE2 3.21Å; K162-H215 VanDerWaalsContact CA-O 3.24Å; K162-H215 WeakPolarHBondContact CA-O 3.23Å; K162-H215 WeakPolarHBondContact CG-O 3.49Å; I163-H215 HydrophobicContact CB-CB 4.29Å; I163-H215 PolarHBondContact N-O 3.37Å; I163-H215 WeakPolarHBondContact O-CA 3.48Å; I163-H215 WeakPolarHBondContact O-CB 3.32Å; I163-H215 PolarHBondContact O-N 2.64Å; I163-H215 PolarHBondContact O-ND1 3.43Å; F165-H215 AromaticContact CD2-CE1 3.74Å; F165-H215 AromaticContact CE2-CE1 3.69Å; F165-H215 AromaticContact CE2-ND1 3.95Å; F183-H215 HydrophobicContact CE1-CB 4.25Å; F183-H215 AromaticContact CE1-CD2 3.55Å; F183-H215 AromaticContact CE1-CE1 3.63Å; F183-H215 AromaticContact CE1-CG 3.54Å; F183-H215 AromaticContact CE1-ND1 3.61Å; F183-H215 AromaticContact CE1-NE2 3.6Å; F183-H215 HydrophobicContact CZ-CB 3.99Å; F183-H215 AromaticContact CZ-CD2 3.83Å; F183-H215 AromaticContact CZ-CG 3.75Å; V213-H215 VanDerWaalsContact CG1-CE1 3.41Å; V213-H215 WeakPolarHBondContact CG1-CE1 3.35Å
216	E	96.1	Very high	94.9	Very high	14 Å²	14	38.6 Å²	38.6	7%	0.065	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.7	178.9	-166.4	-168.7	155.1	0	0	110.3	Y56 S57 L218 N253 D254 K261	Y56-E216 CarbonylContact C-O 3.45Å; Y56-E216 VanDerWaalsContact CA-O 3.24Å; Y56-E216 WeakPolarHBondContact CA-O 3.39Å; S57-E216 PolarHBondContact N-O 3.25Å; S57-E216 PolarHBondContact O-N 2.84Å; S57-E216 PolarHBondContact OG-O 2.85Å; E216-L218 PolarHBondContact O-N 3.4Å; E216-N253 VanDerWaalsContact OE1-CA 3.31Å; E216-N253 WeakPolarHBondContact OE1-CA 3.29Å; E216-N253 WeakPolarHBondContact OE1-CB 3.35Å; E216-N253 PolarHBondContact OE1-N 2.03Å; E216-N253 PolarHBondContact OE1-ND2 3.3Å; E216-D254 PolarHBondContact OE1-N 2.94Å; E216-K261 IonicContact OE2-NZ 2.67Å; E216-K261 PolarHBondContact OE2-NZ 2.67Å
217	V	95.5	Very high	94.8	Very high	32 Å²	32	40.4 Å²	40.4	19%	0.194	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	125.5	178.1	177	0	0	0	0	110	Y55 Y56	Y55-V217 HydrophobicContact CD1-CG1 4.11Å; Y55-V217 HydrophobicContact CD1-CG2 4.43Å; Y55-V217 HydrophobicContact CE1-CB 4.39Å; Y55-V217 HydrophobicContact CE1-CG1 3.58Å; Y55-V217 HydrophobicContact CE1-CG2 4.01Å; Y56-V217 HydrophobicContact CD1-CG2 4.14Å; Y56-V217 HydrophobicContact CE1-CG2 3.53Å
218	L	94.3	Very high	94.8	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.042	26%	0.257	C	S	.	.			trans	-74.2	-27.6	179.7	-76.8	168.6	0	0	0	113.4	Y55 Y56 E216 D220 C221 P222 A251	Y55-L218 PolarHBondContact O-N 3.45Å; Y56-L218 VanDerWaalsContact C-CD1 3.49Å; E216-L218 PolarHBondContact O-N 3.4Å; L218-D220 PolarHBondContact O-N 2.8Å; L218-C221 PolarHBondContact O-N 2.92Å; L218-P222 HydrophobicContact CB-CG 3.75Å; L218-P222 HydrophobicContact CD1-CG 3.93Å; L218-P222 HydrophobicContact CD2-CG 4.06Å; L218-P222 HydrophobicContact CG-CG 4.12Å; L218-A251 HydrophobicContact CD2-CB 4.38Å
219	G	91.3	Very high	94.9	Very high	47 Å²	47	43.5 Å²	43.5	49%	0.485	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	-133	-176.6	0	0	0	0	0	112
220	D	91	Very high	94.8	Very high	74 Å²	74	40.8 Å²	40.8	40%	0.396	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.1	-178.4	-67.9	-40.7	0	0	0	113.2	L218 K223 H224	L218-D220 PolarHBondContact O-N 2.8Å; D220-K223 HydrophobicContact CB-CD 4.17Å; D220-K223 VanDerWaalsContact O-CB 3.27Å; D220-K223 WeakPolarHBondContact O-CB 3.37Å; D220-K223 WeakPolarHBondContact O-CG 3.39Å; D220-K223 PolarHBondContact O-N 3.3Å; D220-K223 WeakPolarHBondContact OD1-CE 3.45Å; D220-K223 IonicContact OD1-NZ 3.91Å; D220-K223 PolarHBondContact OD1-NZ 3.38Å; D220-H224 PolarHBondContact O-CD2 2.9Å
221	C	94.1	Very high	94.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-52.1	-48.6	-176.7	-60.6	0	0	0	0	113	L218 K223 H224 T238 C240 C249	L218-C221 PolarHBondContact O-N 2.92Å; C221-K223 PolarHBondContact O-N 2.96Å; C221-H224 PolarHBondContact O-CD2 2.67Å; C221-H224 PolarHBondContact O-N 3.4Å; C221-T238 VanDerWaalsContact SG-CG2 3.58Å; C221-C240 VanDerWaalsContact CA-SG 3.59Å; C221-C240 HydrophobicContact CB-CB 3.79Å; C221-C240 WeakPolarHBondContact CB-SG 3.27Å; C221-C240 VanDerWaalsContact SG-CA 3.6Å; C221-C240 WeakPolarHBondContact SG-CB 3.07Å; C221-C240 CovalentContact SG-SG 2.04Å; C221-C240 PolarHBondContact SG-SG 3.33Å; C221-C249 WeakPolarHBondContact O-CB 3.24Å; C221-C249 PolarHBondContact O-SG 3.39Å
222	P	93	Very high	94.3	Very high	57 Å²	57	52 Å²	52	37%	0.37	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-63.6	-10	-177.5	-22.3	34.6	0	0	0	115.4	L218 H224 C249	L218-P222 HydrophobicContact CB-CG 3.75Å; L218-P222 HydrophobicContact CD1-CG 3.93Å; L218-P222 HydrophobicContact CD2-CG 4.06Å; L218-P222 HydrophobicContact CG-CG 4.12Å; P222-H224 VanDerWaalsContact C-N 3.26Å; P222-C249 VanDerWaalsContact CA-O 3.32Å; P222-C249 WeakPolarHBondContact CA-O 3.41Å
223	K	91.3	Very high	94	Very high	130 Å²	130	52.2 Å²	52.2	57%	0.565	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-74.5	-19.2	175.3	-61.1	176.5	175.5	172.4	0	112.5	D220 C221	D220-K223 HydrophobicContact CB-CD 4.17Å; D220-K223 VanDerWaalsContact O-CB 3.27Å; D220-K223 WeakPolarHBondContact O-CB 3.37Å; D220-K223 WeakPolarHBondContact O-CG 3.39Å; D220-K223 PolarHBondContact O-N 3.3Å; D220-K223 WeakPolarHBondContact OD1-CE 3.45Å; D220-K223 IonicContact OD1-NZ 3.91Å; D220-K223 PolarHBondContact OD1-NZ 3.38Å; C221-K223 PolarHBondContact O-N 2.96Å
224	H	93.1	Very high	93.5	Very high	58 Å²	58	59.2 Å²	59.2	27%	0.269	32%	0.322	S	S	.	.			trans	-86.7	126.5	179.4	-61.1	-78.5	0	0	0	109.6	D220 C221 P222 T229 C230 A233 C249	D220-H224 PolarHBondContact O-CD2 2.9Å; C221-H224 PolarHBondContact O-CD2 2.67Å; C221-H224 PolarHBondContact O-N 3.4Å; P222-H224 VanDerWaalsContact C-N 3.26Å; H224-T229 PolarHBondContact ND1-O 2.9Å; H224-C230 HydrophobicContact CB-CB 4.18Å; H224-A233 VanDerWaalsContact CD2-CB 3.47Å; H224-A233 WeakPolarHBondContact CD2-CB 3.17Å; H224-A233 WeakPolarHBondContact NE2-CB 3.04Å; H224-C249 HydrophobicContact CB-CB 4.15Å; H224-C249 VanDerWaalsContact O-CB 3.3Å; H224-C249 WeakPolarHBondContact O-CB 3.39Å
225	N	93	Very high	93	Very high	138 Å²	138	61.7 Å²	61.7	74%	0.738	34%	0.338	S	S	*	.			trans	-112.5	13	-169.4	67.4	-8.6	0	0	0	113.7	W242	N225-W242 WeakPolarHBondContact O-CH2 3.31Å
226	S	93.4	Very high	92.5	Very high	44 Å²	44	68.1 Å²	68.1	31%	0.308	38%	0.38	S	S	.	.	S	Bend	trans	-146.4	154.6	172.8	68.2	0	0	0	0	110.5	N228 T229 C230	S226-N228 PolarHBondContact O-N 3.34Å; S226-T229 PolarHBondContact N-OG1 3.47Å; S226-T229 PolarHBondContact O-N 2.89Å; S226-T229 PolarHBondContact O-OG1 3.44Å; S226-T229 VanDerWaalsContact OG-CG2 3.3Å; S226-T229 WeakPolarHBondContact OG-CG2 3.24Å; S226-T229 PolarHBondContact OG-N 2.93Å; S226-T229 PolarHBondContact OG-OG1 2.81Å; S226-C230 WeakPolarHBondContact O-CB 3.49Å; S226-C230 PolarHBondContact O-N 3.45Å
227	T	94	Very high	91.9	Very high	49 Å²	49	74.2 Å²	74.2	30%	0.301	41%	0.413	S	S	.	.	H	α-helix	trans	-48.1	-55.8	178.8	-47.1	0	0	0	0	111.9	T229 C230 E231 W242	T227-T229 PolarHBondContact O-N 3.46Å; T227-C230 WeakPolarHBondContact O-CB 3.35Å; T227-C230 PolarHBondContact O-N 3.46Å; T227-C230 VanDerWaalsContact O-N 3.08Å; T227-E231 WeakPolarHBondContact O-CG 3.32Å; T227-E231 PolarHBondContact O-N 3.44Å; T227-W242 HydrophobicContact CG2-CB 4.07Å; T227-W242 HydrophobicContact CG2-CG 4.14Å; T227-W242 VanDerWaalsContact OG1-CD1 3.3Å; T227-W242 PolarHBondContact OG1-NE1 3.31Å
228	N	93.8	Very high	91.6	Very high	112 Å²	112	74.4 Å²	74.4	60%	0.599	41%	0.414	S	S	*	.	H	α-helix	trans	-58.1	-49.1	-178.3	-61.6	-8	0	0	0	111.6	S226 C230 E231 D232	S226-N228 PolarHBondContact O-N 3.34Å; N228-C230 PolarHBondContact O-N 3.03Å; N228-E231 PolarHBondContact O-N 3.28Å; N228-D232 VanDerWaalsContact O-CB 3.28Å; N228-D232 WeakPolarHBondContact O-CB 3.11Å; N228-D232 PolarHBondContact O-N 3.29Å
229	T	95.6	Very high	91.6	Very high	52 Å²	52	75.9 Å²	75.9	32%	0.319	42%	0.424	S	S	.	.	H	α-helix	trans	-65	-28.4	-179.5	58.2	0	0	0	0	113.1	H224 S226 T227 A233	H224-T229 PolarHBondContact ND1-O 2.9Å; S226-T229 PolarHBondContact N-OG1 3.47Å; S226-T229 PolarHBondContact O-N 2.89Å; S226-T229 PolarHBondContact O-OG1 3.44Å; S226-T229 VanDerWaalsContact OG-CG2 3.3Å; S226-T229 WeakPolarHBondContact OG-CG2 3.24Å; S226-T229 PolarHBondContact OG-N 2.93Å; S226-T229 PolarHBondContact OG-OG1 2.81Å; T227-T229 PolarHBondContact O-N 3.46Å; T229-A233 WeakPolarHBondContact O-CB 3.48Å; T229-A233 PolarHBondContact O-N 2.85Å
230	C	95.3	Very high	91.7	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-74.4	-48	178.2	-178.6	0	0	0	0	111.1	H224 S226 T227 N228 D232 A233 C240 I241 W242 C249	H224-C230 HydrophobicContact CB-CB 4.18Å; S226-C230 WeakPolarHBondContact O-CB 3.49Å; S226-C230 PolarHBondContact O-N 3.45Å; T227-C230 WeakPolarHBondContact O-CB 3.35Å; T227-C230 PolarHBondContact O-N 3.46Å; T227-C230 VanDerWaalsContact O-N 3.08Å; N228-C230 PolarHBondContact O-N 3.03Å; C230-D232 VanDerWaalsContact C-N 3.34Å; C230-D232 PolarHBondContact O-N 3.44Å; C230-A233 VanDerWaalsContact O-CB 3.3Å; C230-A233 WeakPolarHBondContact O-CB 2.97Å; C230-A233 PolarHBondContact O-N 2.84Å; C230-C240 VanDerWaalsContact O-CB 3.31Å; C230-C240 WeakPolarHBondContact O-CB 3.3Å; C230-I241 PolarHBondContact SG-O 3.48Å; C230-W242 HydrophobicContact CB-CB 4.43Å; C230-W242 HydrophobicContact CB-CE3 3.76Å; C230-C249 VanDerWaalsContact CA-SG 3.5Å; C230-C249 HydrophobicContact CB-CB 3.63Å; C230-C249 WeakPolarHBondContact CB-SG 3.08Å; C230-C249 VanDerWaalsContact SG-CA 3.53Å; C230-C249 WeakPolarHBondContact SG-CB 3.47Å; C230-C249 CovalentContact SG-SG 2.02Å; C230-C249 PolarHBondContact SG-SG 3.5Å
231	E	91.4	Very high	91.9	Very high	111 Å²	111	71.5 Å²	71.5	52%	0.519	39%	0.39	S	S	.	.	H	α-helix	trans	-64.7	-39.2	178.6	-68.3	177.5	173.9	0	0	111.7	T227 N228 A233 K234	T227-E231 WeakPolarHBondContact O-CG 3.32Å; T227-E231 PolarHBondContact O-N 3.44Å; N228-E231 PolarHBondContact O-N 3.28Å; E231-A233 PolarHBondContact O-N 2.81Å; E231-K234 PolarHBondContact O-N 3.01Å
232	D	92.7	Very high	91.9	Very high	135 Å²	135	73.1 Å²	73.1	72%	0.722	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.9	176.7	-71.8	-22.7	0	0	0	113.3	N228 C230 K234	N228-D232 VanDerWaalsContact O-CB 3.28Å; N228-D232 WeakPolarHBondContact O-CB 3.11Å; N228-D232 PolarHBondContact O-N 3.29Å; C230-D232 VanDerWaalsContact C-N 3.34Å; C230-D232 PolarHBondContact O-N 3.44Å; D232-K234 PolarHBondContact O-N 2.82Å; D232-K234 VanDerWaalsContact O-N 3.17Å
233	A	91.1	Very high	92	Very high	19 Å²	19	70.4 Å²	70.4	16%	0.157	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	0.6	-179.8	0	0	0	0	0	113.8	H224 T229 C230 E231 T235	H224-A233 VanDerWaalsContact CD2-CB 3.47Å; H224-A233 WeakPolarHBondContact CD2-CB 3.17Å; H224-A233 WeakPolarHBondContact NE2-CB 3.04Å; T229-A233 WeakPolarHBondContact O-CB 3.48Å; T229-A233 PolarHBondContact O-N 2.85Å; C230-A233 VanDerWaalsContact O-CB 3.3Å; C230-A233 WeakPolarHBondContact O-CB 2.97Å; C230-A233 PolarHBondContact O-N 2.84Å; E231-A233 PolarHBondContact O-N 2.81Å; A233-T235 PolarHBondContact O-N 3.47Å
234	K	87.7	Confident	92	Very high	146 Å²	146	69.2 Å²	69.2	64%	0.635	38%	0.375	S	S	*	.			trans	-58.3	128	-179.9	-172.2	174.1	-176.4	173.2	0	111.6	E231 D232 T238	E231-K234 PolarHBondContact O-N 3.01Å; D232-K234 PolarHBondContact O-N 2.82Å; D232-K234 VanDerWaalsContact O-N 3.17Å; K234-T238 CarbonylContact C-O 3.55Å; K234-T238 WeakPolarHBondContact CA-O 3.48Å
235	T	88.3	Confident	91.7	Very high	67 Å²	67	71.2 Å²	71.2	41%	0.411	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-120.4	168.5	171.3	77	0	0	0	0	109.7	A233 N237 T238	A233-T235 PolarHBondContact O-N 3.47Å; T235-N237 PolarHBondContact O-N 3.1Å; T235-N237 PolarHBondContact OG1-N 3.44Å; T235-T238 PolarHBondContact N-O 3.28Å; T235-T238 PolarHBondContact O-N 3.08Å; T235-T238 VanDerWaalsContact O-N 3.14Å; T235-T238 VanDerWaalsContact O-O 3.05Å; T235-T238 WeakPolarHBondContact OG1-CB 3.42Å; T235-T238 PolarHBondContact OG1-N 3.25Å; T235-T238 VanDerWaalsContact OG1-N 3.13Å; T235-T238 PolarHBondContact OG1-OG1 2.93Å
236	P	85.6	Confident	91.6	Very high	136 Å²	136	65.2 Å²	65.2	88%	0.883	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-25	176.9	-28.3	36.6	0	0	0	114.7
237	N	83.9	Confident	91.6	Very high	143 Å²	143	68.9 Å²	68.9	77%	0.765	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	1.9	-177.9	-61.1	-20.6	0	0	0	113	T235	T235-N237 PolarHBondContact O-N 3.1Å; T235-N237 PolarHBondContact OG1-N 3.44Å
238	T	90	Very high	91.5	Very high	35 Å²	35	67.6 Å²	67.6	22%	0.215	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-141.2	118.2	-175.8	-51.8	0	0	0	0	110.7	C221 K234 T235 N253	C221-T238 VanDerWaalsContact SG-CG2 3.58Å; K234-T238 CarbonylContact C-O 3.55Å; K234-T238 WeakPolarHBondContact CA-O 3.48Å; T235-T238 PolarHBondContact N-O 3.28Å; T235-T238 PolarHBondContact O-N 3.08Å; T235-T238 VanDerWaalsContact O-N 3.14Å; T235-T238 VanDerWaalsContact O-O 3.05Å; T235-T238 WeakPolarHBondContact OG1-CB 3.42Å; T235-T238 PolarHBondContact OG1-N 3.25Å; T235-T238 VanDerWaalsContact OG1-N 3.13Å; T235-T238 PolarHBondContact OG1-OG1 2.93Å; T238-N253 WeakPolarHBondContact CA-OD1 3.43Å
239	T	93	Very high	91.6	Very high	39 Å²	39	62.3 Å²	62.3	24%	0.239	33%	0.331	C	S	.	.			trans	-105.9	123.2	169.6	-62.2	0	0	0	0	107.5	S252 N253	T239-S252 PolarHBondContact O-N 2.88Å; T239-N253 PolarHBondContact N-OD1 3.24Å; T239-N253 PolarHBondContact O-OD1 2.89Å
240	C	94.7	Very high	91.6	Very high	10 Å²	10	59.9 Å²	59.9	7%	0.068	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	144.9	174.3	-55.1	0	0	0	0	109.5	C221 C230 T250	C221-C240 VanDerWaalsContact CA-SG 3.59Å; C221-C240 HydrophobicContact CB-CB 3.79Å; C221-C240 WeakPolarHBondContact CB-SG 3.27Å; C221-C240 VanDerWaalsContact SG-CA 3.6Å; C221-C240 WeakPolarHBondContact SG-CB 3.07Å; C221-C240 CovalentContact SG-SG 2.04Å; C221-C240 PolarHBondContact SG-SG 3.33Å; C230-C240 VanDerWaalsContact O-CB 3.31Å; C230-C240 WeakPolarHBondContact O-CB 3.3Å; C240-T250 CarbonylContact C-O 3.58Å; C240-T250 VanDerWaalsContact CA-O 3.29Å; C240-T250 WeakPolarHBondContact CA-O 3.31Å
241	I	94.3	Very high	91.5	Very high	19 Å²	19	59.9 Å²	59.9	10%	0.097	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147	172.9	66.6	174.1	0	0	0	109.5	C230 T250 K261 V262	C230-I241 PolarHBondContact SG-O 3.48Å; I241-T250 HydrophobicContact CD1-CG2 3.97Å; I241-T250 HydrophobicContact CG1-CG2 3.42Å; I241-T250 VanDerWaalsContact CG1-CG2 3.42Å; I241-T250 PolarHBondContact N-O 3.05Å; I241-T250 PolarHBondContact O-N 3.03Å; I241-K261 HydrophobicContact CD1-CB 3.68Å; I241-V262 HydrophobicContact CD1-CG2 3.93Å; I241-V262 HydrophobicContact CG2-CG2 4.17Å
242	W	95.3	Very high	91.6	Very high	35 Å²	35	54.7 Å²	54.7	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	133.4	176.8	-173.4	-103.2	0	0	0	111	N225 T227 C230 D247 C249	N225-W242 WeakPolarHBondContact O-CH2 3.31Å; T227-W242 HydrophobicContact CG2-CB 4.07Å; T227-W242 HydrophobicContact CG2-CG 4.14Å; T227-W242 VanDerWaalsContact OG1-CD1 3.3Å; T227-W242 PolarHBondContact OG1-NE1 3.31Å; C230-W242 HydrophobicContact CB-CB 4.43Å; C230-W242 HydrophobicContact CB-CE3 3.76Å; W242-D247 HydrophobicContact CZ2-CB 4.24Å; W242-C249 HydrophobicContact CE3-CB 3.84Å; W242-C249 HydrophobicContact CZ3-CB 3.96Å
243	C	94.2	Very high	91.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	91.5	177.3	-61.1	0	0	0	0	111.1	I42 K245 S246 D247 I248 T250 C265	I42-C243 HydrophobicContact CG2-CB 4.18Å; C243-K245 VanDerWaalsContact C-N 3.28Å; C243-K245 PolarHBondContact O-N 3.44Å; C243-S246 WeakPolarHBondContact CB-OG 3.11Å; C243-S246 PolarHBondContact O-N 2.93Å; C243-S246 PolarHBondContact O-OG 3.16Å; C243-D247 PolarHBondContact O-N 3.05Å; C243-I248 WeakPolarHBondContact CB-O 3.19Å; C243-I248 PolarHBondContact N-O 3.18Å; C243-T250 VanDerWaalsContact SG-CG2 3.5Å; C243-C265 HydrophobicContact CB-CB 3.62Å; C243-C265 WeakPolarHBondContact CB-SG 2.98Å; C243-C265 WeakPolarHBondContact SG-CB 3.17Å; C243-C265 CovalentContact SG-SG 2.03Å; C243-C265 PolarHBondContact SG-SG 2.92Å
244	E	91.7	Very high	91.3	Very high	105 Å²	105	51.5 Å²	51.5	49%	0.491	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-53.2	-41.7	-175.7	-66.6	-175.8	164.1	0	0	112.9	S246 C265 V267	E244-S246 PolarHBondContact O-N 3.2Å; E244-C265 PolarHBondContact N-O 3.02Å; E244-V267 HydrophobicContact CB-CG2 3.86Å
245	K	86.3	Confident	91.3	Very high	100 Å²	100	52.8 Å²	52.8	44%	0.435	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-57.8	-24.9	179.1	-74.4	177.3	174.3	152.8	0	114.2	C243 G264 Q266 V267	C243-K245 VanDerWaalsContact C-N 3.28Å; C243-K245 PolarHBondContact O-N 3.44Å; K245-G264 PolarHBondContact NZ-O 3.07Å; K245-Q266 WeakPolarHBondContact CE-O 3Å; K245-Q266 PolarHBondContact NZ-O 3.01Å; K245-V267 HydrophobicContact CG-CG2 4.13Å
246	S	90.7	Very high	91.3	Very high	13 Å²	13	57.4 Å²	57.4	9%	0.091	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-126.3	-3	-168	68.6	0	0	0	0	114.6	K40 C243 E244 I248	K40-S246 PolarHBondContact NZ-O 2.9Å; C243-S246 WeakPolarHBondContact CB-OG 3.11Å; C243-S246 PolarHBondContact O-N 2.93Å; C243-S246 PolarHBondContact O-OG 3.16Å; E244-S246 PolarHBondContact O-N 3.2Å; S246-I248 VanDerWaalsContact C-N 3.32Å; S246-I248 PolarHBondContact O-N 2.85Å
247	D	93.1	Very high	91.4	Very high	121 Å²	121	51.1 Å²	51.1	65%	0.647	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	45.9	-172.9	-62.7	-48.7	0	0	0	113.6	W242 C243	W242-D247 HydrophobicContact CZ2-CB 4.24Å; C243-D247 PolarHBondContact O-N 3.05Å
248	I	93.6	Very high	91.7	Very high	22 Å²	22	47.5 Å²	47.5	11%	0.113	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.8	-177.8	-75.5	177.2	0	0	0	110.9	K40 I42 H52 C243 S246	K40-I248 HydrophobicContact CD-CD1 3.56Å; K40-I248 VanDerWaalsContact NZ-CD1 3.25Å; I42-I248 HydrophobicContact CD1-CD1 3.82Å; H52-I248 WeakPolarHBondContact CE1-CG2 3.45Å; H52-I248 WeakPolarHBondContact ND1-CG2 3.43Å; C243-I248 WeakPolarHBondContact CB-O 3.19Å; C243-I248 PolarHBondContact N-O 3.18Å; S246-I248 VanDerWaalsContact C-N 3.32Å; S246-I248 PolarHBondContact O-N 2.85Å
249	C	95.4	Very high	91.8	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.3	166.6	-175.8	0	0	0	0	110.7	C221 P222 H224 C230 W242	C221-C249 WeakPolarHBondContact O-CB 3.24Å; C221-C249 PolarHBondContact O-SG 3.39Å; P222-C249 VanDerWaalsContact CA-O 3.32Å; P222-C249 WeakPolarHBondContact CA-O 3.41Å; H224-C249 HydrophobicContact CB-CB 4.15Å; H224-C249 VanDerWaalsContact O-CB 3.3Å; H224-C249 WeakPolarHBondContact O-CB 3.39Å; C230-C249 VanDerWaalsContact CA-SG 3.5Å; C230-C249 HydrophobicContact CB-CB 3.63Å; C230-C249 WeakPolarHBondContact CB-SG 3.08Å; C230-C249 VanDerWaalsContact SG-CA 3.53Å; C230-C249 WeakPolarHBondContact SG-CB 3.47Å; C230-C249 CovalentContact SG-SG 2.02Å; C230-C249 PolarHBondContact SG-SG 3.5Å; W242-C249 HydrophobicContact CE3-CB 3.84Å; W242-C249 HydrophobicContact CZ3-CB 3.96Å
250	T	94.9	Very high	91.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.9	-176.1	-171	0	0	0	0	112.7	Y50 H52 C240 I241 C243	Y50-T250 HydrophobicContact CE1-CG2 4.3Å; Y50-T250 PolarHBondContact OH-OG1 2.95Å; H52-T250 PolarHBondContact CE1-OG1 3.15Å; H52-T250 WeakPolarHBondContact NE2-CB 3.1Å; H52-T250 PolarHBondContact NE2-OG1 2.02Å; C240-T250 CarbonylContact C-O 3.58Å; C240-T250 VanDerWaalsContact CA-O 3.29Å; C240-T250 WeakPolarHBondContact CA-O 3.31Å; I241-T250 HydrophobicContact CD1-CG2 3.97Å; I241-T250 HydrophobicContact CG1-CG2 3.42Å; I241-T250 VanDerWaalsContact CG1-CG2 3.42Å; I241-T250 PolarHBondContact N-O 3.05Å; I241-T250 PolarHBondContact O-N 3.03Å; C243-T250 VanDerWaalsContact SG-CG2 3.5Å
251	A	94.1	Very high	91.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	142.5	169	0	0	0	0	0	111.6	L218 K261	L218-A251 HydrophobicContact CD2-CB 4.38Å; A251-K261 PolarHBondContact O-NZ 3.4Å
252	S	93.1	Very high	91.4	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.021	26%	0.256	C	S	.	.			trans	-143.5	56.3	179.3	-164	0	0	0	0	109.3	T239 H258	T239-S252 PolarHBondContact O-N 2.88Å; S252-H258 WeakPolarHBondContact OG-CA 3.33Å; S252-H258 PolarHBondContact OG-ND1 2.95Å
253	N	88.6	Confident	91.2	Very high	62 Å²	62	55.7 Å²	55.7	33%	0.332	27%	0.272	S	S	.	.			trans	-87.7	-20.2	-175.1	-41.6	-54	0	0	0	112.2	E216 T238 T239 E255	E216-N253 VanDerWaalsContact OE1-CA 3.31Å; E216-N253 WeakPolarHBondContact OE1-CA 3.29Å; E216-N253 WeakPolarHBondContact OE1-CB 3.35Å; E216-N253 PolarHBondContact OE1-N 2.03Å; E216-N253 PolarHBondContact OE1-ND2 3.3Å; T238-N253 WeakPolarHBondContact CA-OD1 3.43Å; T239-N253 PolarHBondContact N-OD1 3.24Å; T239-N253 PolarHBondContact O-OD1 2.89Å; N253-E255 PolarHBondContact O-N 3.02Å
254	D	87.7	Confident	91	Very high	24 Å²	24	56 Å²	56	13%	0.128	28%	0.275	C	S	.	.			trans	-81.7	108.8	173.4	-169.9	-12.9	0	0	0	110.8	K162 E216 H256 N257 H258	K162-D254 IonicContact NZ-OD2 2.67Å; K162-D254 PolarHBondContact NZ-OD2 3.44Å; E216-D254 PolarHBondContact OE1-N 2.94Å; D254-H256 PolarHBondContact O-N 3.26Å; D254-H256 IonicContact OD1-CG 3.72Å; D254-H256 PolarHBondContact OD1-N 3.44Å; D254-H256 VanDerWaalsContact OD1-N 3.1Å; D254-H256 IonicContact OD1-ND1 3.99Å; D254-H256 PolarHBondContact OD1-ND1 2.88Å; D254-H256 VanDerWaalsContact OD1-ND1 3.14Å; D254-N257 HydrophobicContact CB-CB 4.32Å; D254-N257 CarbonylContact O-C 3.59Å; D254-N257 PolarHBondContact O-N 2.94Å; D254-N257 VanDerWaalsContact O-N 3.08Å; D254-N257 PolarHBondContact OD2-ND2 3.38Å; D254-H258 PolarHBondContact O-N 2.86Å
255	E	88	Confident	91	Very high	174 Å²	174	51.2 Å²	51.2	81%	0.813	25%	0.253	S	S	*	.	H	α-helix	trans	-55.4	-37.1	180	-170.7	175.2	-178	0	0	112.6	N253 N257 H258	N253-E255 PolarHBondContact O-N 3.02Å; E255-N257 PolarHBondContact O-N 3.47Å; E255-H258 PolarHBondContact O-N 3.31Å
256	H	88.4	Confident	91.1	Very high	164 Å²	164	51.4 Å²	51.4	76%	0.759	26%	0.255	S	S	*	.	H	α-helix	trans	-67.5	-26.1	-178.8	-57.9	89.8	0	0	0	113.1	D254	D254-H256 PolarHBondContact O-N 3.26Å; D254-H256 IonicContact OD1-CG 3.72Å; D254-H256 PolarHBondContact OD1-N 3.44Å; D254-H256 VanDerWaalsContact OD1-N 3.1Å; D254-H256 IonicContact OD1-ND1 3.99Å; D254-H256 PolarHBondContact OD1-ND1 2.88Å; D254-H256 VanDerWaalsContact OD1-ND1 3.14Å
257	N	89	Confident	90.3	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-107.6	-2.9	-177.5	-68.1	-34.1	0	0	0	111.8	L59 R61 E214 D254 E255 F260 K261	L59-N257 HydrophobicContact CD2-CB 3.9Å; L59-N257 VanDerWaalsContact CD2-CG 3.49Å; R61-N257 PolarHBondContact NH1-OD1 2.88Å; R61-N257 PolarHBondContact NH2-OD1 3.39Å; R61-N257 VanDerWaalsContact NH2-OD1 3.08Å; E214-N257 PolarHBondContact OE1-ND2 2.04Å; E214-N257 PolarHBondContact OE2-ND2 2.86Å; E214-N257 VanDerWaalsContact OE2-ND2 3.07Å; D254-N257 HydrophobicContact CB-CB 4.32Å; D254-N257 CarbonylContact O-C 3.59Å; D254-N257 PolarHBondContact O-N 2.94Å; D254-N257 VanDerWaalsContact O-N 3.08Å; D254-N257 PolarHBondContact OD2-ND2 3.38Å; E255-N257 PolarHBondContact O-N 3.47Å; N257-F260 PolarHBondContact O-N 3.49Å; N257-K261 WeakPolarHBondContact O-CG 3.36Å; N257-K261 PolarHBondContact O-N 3.44Å
258	H	90.3	Very high	89.1	Confident	68 Å²	68	56.1 Å²	56.1	32%	0.315	28%	0.277	S	S	.	.	H	α-helix	trans	-60.6	-56	-173.7	178.9	78	0	0	0	111.9	S252 D254 E255 F260 K261 V262	S252-H258 WeakPolarHBondContact OG-CA 3.33Å; S252-H258 PolarHBondContact OG-ND1 2.95Å; D254-H258 PolarHBondContact O-N 2.86Å; E255-H258 PolarHBondContact O-N 3.31Å; H258-F260 VanDerWaalsContact C-N 3.29Å; H258-F260 PolarHBondContact O-N 3.5Å; H258-K261 PolarHBondContact O-N 2.84Å; H258-V262 WeakPolarHBondContact O-CG2 3.37Å; H258-V262 PolarHBondContact O-N 3.46Å
259	E	91.3	Very high	87	Confident	137 Å²	137	60.9 Å²	60.9	64%	0.64	31%	0.307	S	S	*	.	H	α-helix	trans	-60.6	-41.3	179.6	-174.3	-176.8	171.9	0	0	111.4	K261 V262 N263	E259-K261 PolarHBondContact O-N 3.13Å; E259-V262 PolarHBondContact O-N 3.33Å; E259-N263 WeakPolarHBondContact O-CB 3.33Å; E259-N263 VanDerWaalsContact O-CG 3.24Å; E259-N263 PolarHBondContact O-N 2.82Å; E259-N263 PolarHBondContact O-ND2 2.94Å
260	F	90.4	Very high	84.6	Confident	49 Å²	49	66.3 Å²	66.3	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-58	-47.6	176.5	179.8	-84.2	0	0	0	111.7	F43 Y48 L59 N257 H258 G264	F43-F260 AromaticContact CE2-CE1 3.6Å; F43-F260 HydrophobicContact CE2-CE1 3.6Å; F43-F260 HydrophobicContact CE2-CZ 4.05Å; F43-F260 HydrophobicContact CZ-CD1 4.34Å; F43-F260 AromaticContact CZ-CE1 3.82Å; F43-F260 HydrophobicContact CZ-CE1 3.82Å; Y48-F260 AromaticContact CD1-CE2 3.74Å; Y48-F260 HydrophobicContact CD1-CE2 3.74Å; Y48-F260 AromaticContact CD1-CZ 3.72Å; Y48-F260 HydrophobicContact CD1-CZ 3.72Å; Y48-F260 HydrophobicContact CD2-CE1 4.43Å; Y48-F260 HydrophobicContact CD2-CE2 4.38Å; Y48-F260 AromaticContact CD2-CZ 3.57Å; Y48-F260 HydrophobicContact CD2-CZ 3.57Å; Y48-F260 AromaticContact CE1-CE2 3.9Å; Y48-F260 HydrophobicContact CE1-CE2 3.9Å; Y48-F260 HydrophobicContact CE1-CZ 4.04Å; Y48-F260 AromaticContact CE2-CZ 3.94Å; Y48-F260 HydrophobicContact CE2-CZ 3.94Å; Y48-F260 AromaticContact CG-CE2 4Å; Y48-F260 HydrophobicContact CG-CE2 4Å; Y48-F260 AromaticContact CG-CZ 3.46Å; Y48-F260 HydrophobicContact CG-CZ 3.46Å; Y48-F260 VanDerWaalsContact CG-CZ 3.46Å; L59-F260 HydrophobicContact CD1-CD1 3.8Å; L59-F260 HydrophobicContact CD1-CE1 3.21Å; L59-F260 HydrophobicContact CD1-CZ 3.88Å; L59-F260 HydrophobicContact CD2-CD1 4.03Å; L59-F260 HydrophobicContact CD2-CE1 4.29Å; L59-F260 HydrophobicContact CG-CE1 4.39Å; N257-F260 PolarHBondContact O-N 3.49Å; H258-F260 VanDerWaalsContact C-N 3.29Å; H258-F260 PolarHBondContact O-N 3.5Å; F260-G264 PolarHBondContact O-N 2.92Å
261	K	91.8	Very high	81.9	Confident	3 Å²	3	71 Å²	71	1%	0.013	37%	0.373	C	S	.	.	H	α-helix	trans	-64.2	-43.8	177.5	-72.3	178.3	173.1	-167.6	0	111.4	Y50 S57 E216 I241 A251 N257 H258 E259 G264 C265	Y50-K261 HydrophobicContact CE2-CD 4.23Å; Y50-K261 VanDerWaalsContact CE2-CE 3.49Å; Y50-K261 HydrophobicContact CE2-CG 4.25Å; Y50-K261 WeakPolarHBondContact OH-CE 3.42Å; Y50-K261 PolarHBondContact OH-NZ 2.97Å; S57-K261 PolarHBondContact OG-NZ 3.16Å; E216-K261 IonicContact OE2-NZ 2.67Å; E216-K261 PolarHBondContact OE2-NZ 2.67Å; I241-K261 HydrophobicContact CD1-CB 3.68Å; A251-K261 PolarHBondContact O-NZ 3.4Å; N257-K261 WeakPolarHBondContact O-CG 3.36Å; N257-K261 PolarHBondContact O-N 3.44Å; H258-K261 PolarHBondContact O-N 2.84Å; E259-K261 PolarHBondContact O-N 3.13Å; K261-G264 PolarHBondContact O-N 3.14Å; K261-C265 WeakPolarHBondContact O-CB 3.41Å; K261-C265 PolarHBondContact O-N 2.83Å; K261-C265 PolarHBondContact O-SG 2.95Å
262	V	91.7	Very high	79	Confident	36 Å²	36	78.2 Å²	78.2	22%	0.218	41%	0.411	C	S	.	.	H	α-helix	trans	-58.1	-51.5	177.2	170.2	0	0	0	0	110.7	I241 H258 E259 G264 C265 Q266	I241-V262 HydrophobicContact CD1-CG2 3.93Å; I241-V262 HydrophobicContact CG2-CG2 4.17Å; H258-V262 WeakPolarHBondContact O-CG2 3.37Å; H258-V262 PolarHBondContact O-N 3.46Å; E259-V262 PolarHBondContact O-N 3.33Å; V262-G264 PolarHBondContact O-N 3.45Å; V262-C265 PolarHBondContact O-N 3.02Å; V262-Q266 WeakPolarHBondContact O-CG 3.41Å; V262-Q266 PolarHBondContact O-N 2.67Å
263	N	90.8	Very high	76.3	Confident	85 Å²	85	83.5 Å²	83.5	46%	0.455	44%	0.443	S	S	.	.	H	α-helix	trans	-63.3	-41.5	-178.6	-67.7	-14	0	0	0	112.1	E259 C265 Q266	E259-N263 WeakPolarHBondContact O-CB 3.33Å; E259-N263 VanDerWaalsContact O-CG 3.24Å; E259-N263 PolarHBondContact O-N 2.82Å; E259-N263 PolarHBondContact O-ND2 2.94Å; N263-C265 VanDerWaalsContact C-N 3.27Å; N263-C265 PolarHBondContact O-N 3.29Å; N263-Q266 PolarHBondContact O-N 3.3Å
264	G	90.7	Very high	73.7	Confident	7 Å²	7	88.2 Å²	88.2	7%	0.072	47%	0.469	C	S	.	.	H	α-helix	trans	-65.3	-31.4	177.2	0	0	0	0	0	113.3	F43 K245 F260 K261 V262	F43-G264 VanDerWaalsContact CD1-C 3.45Å; F43-G264 WeakPolarHBondContact CD1-O 3.48Å; K245-G264 PolarHBondContact NZ-O 3.07Å; F260-G264 PolarHBondContact O-N 2.92Å; K261-G264 PolarHBondContact O-N 3.14Å; V262-G264 PolarHBondContact O-N 3.45Å
265	C	91.1	Very high	71.1	Confident	3 Å²	3	93.2 Å²	93.2	2%	0.02	50%	0.499	C	S	.	.	H	α-helix	trans	-81.7	-20.3	-177.4	-79	0	0	0	0	114.7	C243 E244 K261 V262 N263	C243-C265 HydrophobicContact CB-CB 3.62Å; C243-C265 WeakPolarHBondContact CB-SG 2.98Å; C243-C265 WeakPolarHBondContact SG-CB 3.17Å; C243-C265 CovalentContact SG-SG 2.03Å; C243-C265 PolarHBondContact SG-SG 2.92Å; E244-C265 PolarHBondContact N-O 3.02Å; K261-C265 WeakPolarHBondContact O-CB 3.41Å; K261-C265 PolarHBondContact O-N 2.83Å; K261-C265 PolarHBondContact O-SG 2.95Å; V262-C265 PolarHBondContact O-N 3.02Å; N263-C265 VanDerWaalsContact C-N 3.27Å; N263-C265 PolarHBondContact O-N 3.29Å
266	Q	87.8	Confident	68.7	Low	104 Å²	104	94.2 Å²	94.2	49%	0.486	50%	0.501	S	S	.	.	S	Bend	trans	-71.4	140.8	174.3	-72.1	173.7	5.7	0	0	111.5	K245 V262 N263	K245-Q266 WeakPolarHBondContact CE-O 3Å; K245-Q266 PolarHBondContact NZ-O 3.01Å; V262-Q266 WeakPolarHBondContact O-CG 3.41Å; V262-Q266 PolarHBondContact O-N 2.67Å; N263-Q266 PolarHBondContact O-N 3.3Å
267	V	74.9	Confident	66	Low	72 Å²	72	91.6 Å²	91.6	44%	0.436	50%	0.502	S	S	.	.			trans	-68.4	129.9	166	179	0	0	0	0	107.7	E244 K245 T269	E244-V267 HydrophobicContact CB-CG2 3.86Å; K245-V267 HydrophobicContact CG-CG2 4.13Å; V267-T269 PolarHBondContact O-N 3.36Å
268	E	66.6	Low	63.5	Low	162 Å²	162	100.8 Å²	100.8	76%	0.757	54%	0.544	S	S	*	.			trans	-63.4	99.4	173.1	-72.9	-179.4	-172.5	0	0	108.6	V270	E268-V270 PolarHBondContact O-N 3.42Å
269	T	50.9	Low	60.7	Low	122 Å²	122	102.1 Å²	102.1	75%	0.748	57%	0.567	S	S	*	*			trans	-70.7	98.3	171.6	-18.5	0	0	0	0	106.6	V267 S271	V267-T269 PolarHBondContact O-N 3.36Å; T269-S271 PolarHBondContact O-N 3.24Å; T269-S271 PolarHBondContact O-OG 2.9Å
270	V	43.9	Very low	57.9	Low	115 Å²	115	102 Å²	102	70%	0.697	58%	0.576	S	S	*	*			trans	-57.1	96	168.8	-178.3	0	0	0	0	106.8	E268 N272	E268-V270 PolarHBondContact O-N 3.42Å; V270-N272 PolarHBondContact O-N 3.48Å
271	S	38.9	Very low	55.2	Low	99 Å²	99	108.1 Å²	108.1	69%	0.692	61%	0.605	S	S	*	*			trans	-73.8	88.4	174.4	-61.2	0	0	0	0	105.8	T269 V273	T269-S271 PolarHBondContact O-N 3.24Å; T269-S271 PolarHBondContact O-OG 2.9Å; S271-V273 PolarHBondContact O-N 2.95Å
272	N	32.7	Very low	52.6	Low	150 Å²	150	115.5 Å²	115.5	80%	0.802	64%	0.643	S	S	*	*			trans	-66	68.6	164	-83.1	-19.3	0	0	0	108.6	V270 N274	V270-N272 PolarHBondContact O-N 3.48Å; N272-N274 PolarHBondContact O-N 3.22Å
273	V	37.1	Very low	49.9	Very low	115 Å²	115	120.8 Å²	120.8	70%	0.697	67%	0.67	S	S	*	*			trans	-79.1	102.3	162.8	-180	0	0	0	0	105.7	S271 V275	S271-V273 PolarHBondContact O-N 2.95Å; V273-V275 VanDerWaalsContact C-N 3.26Å; V273-V275 PolarHBondContact O-N 3.32Å
274	N	32.7	Very low	47	Very low	161 Å²	161	125.9 Å²	125.9	86%	0.861	69%	0.691	S	S	*	*			trans	-51.1	86.1	168.4	-123	2.8	0	0	0	109.7	N272 K276	N272-N274 PolarHBondContact O-N 3.22Å; N274-K276 VanDerWaalsContact C-N 3.29Å; N274-K276 PolarHBondContact O-N 3.18Å
275	V	34.8	Very low	44.2	Very low	128 Å²	128	136.9 Å²	136.9	78%	0.776	73%	0.73	S	S	*	*			trans	-77.7	94.2	164.6	-178.6	0	0	0	0	106	V273 S277	V273-V275 VanDerWaalsContact C-N 3.26Å; V273-V275 PolarHBondContact O-N 3.32Å; V275-S277 PolarHBondContact O-N 3.39Å
276	K	36.6	Very low	41.4	Very low	196 Å²	196	144.9 Å²	144.9	85%	0.852	77%	0.767	S	S	*	*			trans	-49	114.6	168.5	-149.4	177.3	-173.8	-175.8	0	107.5	N274 E278	N274-K276 VanDerWaalsContact C-N 3.29Å; N274-K276 PolarHBondContact O-N 3.18Å; K276-E278 PolarHBondContact O-N 2.84Å
277	S	32.3	Very low	38.7	Very low	109 Å²	109	145.8 Å²	145.8	76%	0.762	78%	0.78	S	S	*	*			trans	-47.6	119.8	173.4	51.2	0	0	0	0	111.6	V275	V275-S277 PolarHBondContact O-N 3.39Å
278	E	36.8	Very low	36.6	Very low	196 Å²	196	147.9 Å²	147.9	92%	0.916	79%	0.794	S	S	*	*			trans	-141.2	107.2	146.8	-136.3	164.9	-158.6	0	0	108.3	K276	K276-E278 PolarHBondContact O-N 2.84Å
279	A	31.4	Very low	34.8	Very low	95 Å²	95	146.5 Å²	146.5	79%	0.785	80%	0.796	S	S	*	*			trans	-74.8	130.5	178.4	0	0	0	0	0	109.1
280	T	32.9	Very low	33.7	Very low	135 Å²	135	144 Å²	144	83%	0.828	79%	0.794	S	S	*	*			trans	-148.1	113.3	146.8	-58.5	0	0	0	0	108.5
281	Q	32.1	Very low	33.3	Very low	177 Å²	177	146.2 Å²	146.2	83%	0.827	80%	0.801	S	S	*	*			trans	-58.6	147	169.5	-66.2	174.8	-9.1	0	0	110.1
282	I	37.1	Very low	33	Very low	158 Å²	158	147 Å²	147	81%	0.81	80%	0.801	S	S	*	*				-171.7	109.2	127.8	-87	145	0	0	0	109
283	N	35.1	Very low	33	Very low	148 Å²	148	148.3 Å²	148.3	79%	0.791	80%	0.803	S	S	*	*			trans	29.3	123.1	146.3	-67.5	-20	0	0	0	123.1
284	Q	30.5	Very low	32.7	Very low	191 Å²	191	153.4 Å²	153.4	89%	0.893	81%	0.809	S	S	*	*			trans	-22.4	137.2	146.4	-67.8	170	-49.8	0	0	116.4
285	R	33.1	Very low	32.5	Very low	238 Å²	238	151.8 Å²	151.8	90%	0.898	80%	0.801	S	S	*	*				-161.2	134	119.8	-159	166.2	-177.8	173.3	-0.8	112.1
286	E	31.7	Very low	32.4	Very low	171 Å²	171	153.8 Å²	153.8	80%	0.799	81%	0.806	S	S	*	*			trans	-55.5	153	174	-59.1	159.8	143.1	0	0	113.5
287	T	31.3	Very low	32	Very low	123 Å²	123	151.1 Å²	151.1	76%	0.755	81%	0.807	S	S	*	*				170	110.7	117.5	-65.5	0	0	0	0	110.9
288	T	29.1	Very low	32.2	Very low	117 Å²	117	153.4 Å²	153.4	72%	0.718	81%	0.805	S	S	*	*				36.3	141.6	126.5	-34.5	0	0	0	0	122.1
289	T	29.5	Very low	32	Very low	133 Å²	133	152.4 Å²	152.4	82%	0.816	80%	0.8	S	S	*	*			trans	90.7	105.8	145.9	15.4	0	0	0	0	120
290	G	28.9	Very low	31.9	Very low	68 Å²	68	156 Å²	156	70%	0.701	81%	0.805	S	S	*	*				109.3	136.8	111.7	0	0	0	0	0	118.1
291	I	35.7	Very low	31.8	Very low	163 Å²	163	155.9 Å²	155.9	84%	0.836	81%	0.805	S	S	*	*			trans	104.8	95.1	148.3	-51.6	170.5	0	0	0	116.7
292	T	31.2	Very low	31.9	Very low	115 Å²	115	156.3 Å²	156.3	71%	0.706	81%	0.806	S	S	*	*				57.2	109.1	118.3	-29.3	0	0	0	0	121.4
293	E	32.6	Very low	31.8	Very low	177 Å²	177	154.9 Å²	154.9	83%	0.827	81%	0.805	S	S	*	*				28.4	107.4	129.9	-161.4	179.1	-175.6	0	0	119.4
294	R	31.3	Very low	31.8	Very low	223 Å²	223	153.7 Å²	153.7	84%	0.842	80%	0.804	S	S	*	*			trans	-172.8	141.8	130.3	-118	-174.6	-169.2	114	2.2	112.4
295	D	29.2	Very low	31.8	Very low	126 Å²	126	153.1 Å²	153.1	67%	0.674	80%	0.801	S	S	*	*			trans	58.8	109.8	152.4	-73.7	-37.6	0	0	0	119
296	L	32.4	Very low	31.6	Very low	170 Å²	170	148.2 Å²	148.2	89%	0.89	80%	0.798	S	S	*	*			trans	-160.5	87.1	132.5	-106.4	134.2	0	0	0	110.5
297	T	27.5	Very low	31.6	Very low	141 Å²	141	146.3 Å²	146.3	87%	0.865	80%	0.798	S	S	*	*			trans	-91	101.1	158	-53.6	0	0	0	0	106.6
298	H	36.1	Very low	31.4	Very low	157 Å²	157	150.6 Å²	150.6	73%	0.727	81%	0.806	S	S	*	*			trans	-159.1	119.1	162.4	-158.4	-91.1	0	0	0	110.3
299	E	34	Very low	31.5	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	81%	0.805	S	S	*	*			trans	141.9	87.1	145	-80.1	-164.2	135.3	0	0	111.4
300	L	27.6	Very low	31.6	Very low	170 Å²	170	152.5 Å²	152.5	89%	0.89	81%	0.808	S	S	*	*			trans	-142.1	91.5	157.5	-159.1	90.6	0	0	0	108.1
301	T	32.2	Very low	31.6	Very low	134 Å²	134	157 Å²	157	82%	0.822	82%	0.815	S	S	*	*			trans	-159.9	140.5	160.4	17.6	0	0	0	0	110.8
302	E	34.6	Very low	31.3	Very low	185 Å²	185	156.4 Å²	156.4	86%	0.864	81%	0.814	S	S	*	*			trans	81.6	119.3	177.4	-56.6	-173.3	150.2	0	0	113.5
303	T	33.9	Very low	31.4	Very low	128 Å²	128	160.5 Å²	160.5	79%	0.785	82%	0.822	S	S	*	*				-159.1	114.8	55.2	-56.9	0	0	0	0	111.6
304	T	35.3	Very low	31.5	Very low	123 Å²	123	157.5 Å²	157.5	76%	0.755	82%	0.816	S	S	*	*				62.3	113.2	129.4	-21.2	0	0	0	0	123.3
305	Q	30.4	Very low	31.4	Very low	180 Å²	180	153.6 Å²	153.6	84%	0.841	82%	0.817	S	S	*	*			trans	-33	129.7	153.6	-68	165.8	-35.8	0	0	117.2
306	T	30	Very low	31.5	Very low	135 Å²	135	150.9 Å²	150.9	83%	0.828	82%	0.818	S	S	*	*			trans	-168.8	113.9	132.1	-21.4	0	0	0	0	106.8
307	T	30.9	Very low	31.7	Very low	130 Å²	130	149.6 Å²	149.6	80%	0.798	82%	0.818	S	S	*	*				173.1	108.1	88	-57.7	0	0	0	0	108
308	K	27.9	Very low	31.9	Very low	214 Å²	214	148.7 Å²	148.7	93%	0.93	81%	0.812	S	S	*	*			trans	-137.6	100.8	163.4	-98.5	-173.9	-179.3	174.3	0	107.3
309	S	30.6	Very low	31.8	Very low	100 Å²	100	147.9 Å²	147.9	70%	0.699	81%	0.813	S	S	*	*			trans	179.7	99.7	163.9	157.1	0	0	0	0	108.5
310	H	31.1	Very low	32.1	Very low	190 Å²	190	147.4 Å²	147.4	88%	0.88	82%	0.816	S	S	*	*			trans	-167.5	84.8	146.5	-101.9	-65.3	0	0	0	109.1
311	L	29.6	Very low	32.6	Very low	161 Å²	161	147.8 Å²	147.8	84%	0.843	81%	0.806	S	S	*	*			trans	-139.7	134.5	155.9	-136.8	95.9	0	0	0	108.6
312	N	29.8	Very low	33	Very low	151 Å²	151	150.4 Å²	150.4	81%	0.807	81%	0.809	S	S	*	*			trans	102.3	104.1	172.6	-59.4	-14.6	0	0	0	116.4
313	K	33.3	Very low	33.2	Very low	201 Å²	201	146.6 Å²	146.6	87%	0.874	81%	0.809	S	S	*	*				-158.9	128.5	129.3	-133.1	-169.6	170.8	167.6	0	113.4
314	T	33.2	Very low	33.4	Very low	114 Å²	114	151.2 Å²	151.2	70%	0.699	81%	0.812	S	S	*	*			trans	87.8	101.6	141.2	-11.5	0	0	0	0	120.4
315	T	28.9	Very low	33.9	Very low	142 Å²	142	148.8 Å²	148.8	87%	0.871	80%	0.795	S	S	*	*			trans	-50.5	140.7	147.8	37.3	0	0	0	0	114.2
316	G	32.8	Very low	34.7	Very low	68 Å²	68	144.9 Å²	144.9	70%	0.701	79%	0.787	S	S	*	*			trans	-176.6	112	167	0	0	0	0	0	113.9
317	T	36.1	Very low	35.5	Very low	144 Å²	144	146.5 Å²	146.5	88%	0.883	78%	0.783	S	S	*	*			trans	78.2	91.8	144.3	-5	0	0	0	0	119.9
318	T	31.8	Very low	36.6	Very low	122 Å²	122	142.9 Å²	142.9	75%	0.748	76%	0.763	S	S	*	*			trans	-46.1	142	136.3	22.8	0	0	0	0	109.9
319	D	34.8	Very low	37.9	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	74%	0.74	S	S	*	*			cis	-163	163.3	44.6	-98.4	-44.7	0	0	0	108
320	N	40.1	Very low	39.3	Very low	165 Å²	165	136.1 Å²	136.1	88%	0.882	73%	0.733	S	S	*	*			trans	127.3	17.8	166.5	-66.5	-26.9	0	0	0	117.5
321	R	38.3	Very low	40.9	Very low	177 Å²	177	136.1 Å²	136.1	67%	0.668	73%	0.727	S	S	*	*			trans	-103.2	2.5	-172.8	-120.6	179.1	-173.5	149.8	4.7	117.6
322	E	40.6	Very low	42.9	Very low	189 Å²	189	132.7 Å²	132.7	88%	0.883	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-22.7	-167.6	-101.1	177.4	156.9	0	0	116.4
323	A	38.7	Very low	45	Very low	106 Å²	106	129.4 Å²	129.4	88%	0.876	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-10.8	-174.6	0	0	0	0	0	115.6
324	R	38.1	Very low	47	Very low	225 Å²	225	124.2 Å²	124.2	85%	0.849	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-14.2	-173.2	-137.5	176.3	-157.9	165	5.1	114.8
325	N	44.9	Very low	49.3	Very low	71 Å²	71	122 Å²	122	38%	0.38	66%	0.662	S	S	.	*	H	α-helix	trans	-79.6	-21.3	-172.5	-76.3	-14.2	0	0	0	114.4	K327 S328	N325-K327 PolarHBondContact O-N 2.82Å; N325-S328 PolarHBondContact O-N 3.06Å
326	S	48.1	Very low	51.6	Low	98 Å²	98	120.3 Å²	120.3	69%	0.685	65%	0.647	S	S	*	*	H	α-helix	trans	-71.4	-32.1	-177.1	105.9	0	0	0	0	113.2
327	K	46.7	Very low	53.9	Low	170 Å²	170	120.2 Å²	120.2	74%	0.739	63%	0.633	S	S	*	*	H	α-helix	trans	-76.7	-25.9	178.5	-76.3	-176.2	176.5	180	0	113.5	N325 Y331	N325-K327 PolarHBondContact O-N 2.82Å; K327-Y331 WeakPolarHBondContact O-CD2 3.38Å
328	S	53.4	Low	56.1	Low	53 Å²	53	117 Å²	117	37%	0.371	61%	0.613	S	S	.	*	H	α-helix	trans	-78.5	-34.5	-178.2	-170.7	0	0	0	0	113.2	N325 L330 Y331	N325-S328 PolarHBondContact O-N 3.06Å; S328-L330 VanDerWaalsContact C-N 3.3Å; S328-L330 PolarHBondContact O-N 3.08Å; S328-Y331 PolarHBondContact O-N 2.95Å
329	S	54.6	Low	58.6	Low	64 Å²	64	115.2 Å²	115.2	45%	0.448	60%	0.602	S	S	.	*	H	α-helix	trans	-67.7	-31.9	176.9	-72.9	0	0	0	0	112.3	Y331 I332 V333	S329-Y331 VanDerWaalsContact C-N 3.3Å; S329-Y331 PolarHBondContact O-N 3.26Å; S329-I332 PolarHBondContact O-N 3.37Å; S329-V333 VanDerWaalsContact O-CG2 3.26Å; S329-V333 WeakPolarHBondContact O-CG2 3.15Å; S329-V333 PolarHBondContact O-N 3.2Å; S329-V333 VanDerWaalsContact O-N 3.1Å
330	L	59.8	Low	60.9	Low	109 Å²	109	115.1 Å²	115.1	57%	0.571	60%	0.595	S	S	*	*	H	α-helix	trans	-61.7	-38.3	179.9	-143.6	98.6	0	0	0	112.1	S328 I332 I334	S328-L330 VanDerWaalsContact C-N 3.3Å; S328-L330 PolarHBondContact O-N 3.08Å; L330-I332 VanDerWaalsContact C-N 3.31Å; L330-I332 PolarHBondContact O-N 2.96Å; L330-I334 HydrophobicContact CD2-CD1 3.68Å; L330-I334 HydrophobicContact CG-CD1 3.86Å; L330-I334 WeakPolarHBondContact O-CB 3.32Å; L330-I334 WeakPolarHBondContact O-CD1 3.5Å; L330-I334 WeakPolarHBondContact O-CG1 3.16Å; L330-I334 PolarHBondContact O-N 3.36Å
331	Y	66.5	Low	63	Low	190 Å²	190	113 Å²	113	75%	0.745	58%	0.578	S	S	*	*	H	α-helix	trans	-70.2	-20.7	-178.7	-90.7	-84.1	0	0	0	114.6	K327 S328 S329 P335	K327-Y331 WeakPolarHBondContact O-CD2 3.38Å; S328-Y331 PolarHBondContact O-N 2.95Å; S329-Y331 VanDerWaalsContact C-N 3.3Å; S329-Y331 PolarHBondContact O-N 3.26Å; Y331-P335 WeakPolarHBondContact O-CD 3.42Å; Y331-P335 WeakPolarHBondContact O-CG 3.21Å
332	I	71	Confident	65.2	Low	89 Å²	89	109.8 Å²	109.8	46%	0.456	57%	0.574	S	S	.	*	H	α-helix	trans	-97.5	-37.2	179.1	-61.9	171.7	0	0	0	110.7	S329 L330 P335 L336	S329-I332 PolarHBondContact O-N 3.37Å; L330-I332 VanDerWaalsContact C-N 3.31Å; L330-I332 PolarHBondContact O-N 2.96Å; I332-P335 WeakPolarHBondContact O-CD 3.36Å; I332-L336 HydrophobicContact CG2-CD1 4.06Å; I332-L336 WeakPolarHBondContact O-CG 3.4Å; I332-L336 PolarHBondContact O-N 3.19Å
333	V	73.7	Confident	67.4	Low	81 Å²	81	105 Å²	105	49%	0.491	56%	0.557	S	S	.	*	H	α-helix	trans	-68.8	-39.8	-179.4	176.1	0	0	0	0	111.1	S329 L336 V337	S329-V333 VanDerWaalsContact O-CG2 3.26Å; S329-V333 WeakPolarHBondContact O-CG2 3.15Å; S329-V333 PolarHBondContact O-N 3.2Å; S329-V333 VanDerWaalsContact O-N 3.1Å; V333-L336 PolarHBondContact O-N 3.49Å; V333-V337 HydrophobicContact CG1-CG2 4.03Å; V333-V337 WeakPolarHBondContact O-CB 3.47Å; V333-V337 VanDerWaalsContact O-CG2 3.24Å; V333-V337 WeakPolarHBondContact O-CG2 3.3Å; V333-V337 PolarHBondContact O-N 2.95Å
334	I	76.1	Confident	69.6	Low	93 Å²	93	105.9 Å²	105.9	48%	0.477	54%	0.541	S	S	.	.	H	α-helix	trans	-61.5	-51.6	-178.2	-67.2	167.3	0	0	0	112	L330 L336 V337 V338	L330-I334 HydrophobicContact CD2-CD1 3.68Å; L330-I334 HydrophobicContact CG-CD1 3.86Å; L330-I334 WeakPolarHBondContact O-CB 3.32Å; L330-I334 WeakPolarHBondContact O-CD1 3.5Å; L330-I334 WeakPolarHBondContact O-CG1 3.16Å; L330-I334 PolarHBondContact O-N 3.36Å; I334-L336 VanDerWaalsContact C-N 3.33Å; I334-L336 PolarHBondContact O-N 3.38Å; I334-V337 PolarHBondContact O-N 3.3Å; I334-V338 HydrophobicContact CG2-CG2 4.4Å; I334-V338 VanDerWaalsContact O-CG2 3.29Å; I334-V338 WeakPolarHBondContact O-CG2 3.32Å; I334-V338 PolarHBondContact O-N 3.36Å
335	P	80.3	Confident	72	Confident	68 Å²	68	99.1 Å²	99.1	44%	0.442	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-39.7	177.6	-24.9	33.3	0	0	0	113.5	Y331 I332 V338 V339	Y331-P335 WeakPolarHBondContact O-CD 3.42Å; Y331-P335 WeakPolarHBondContact O-CG 3.21Å; I332-P335 WeakPolarHBondContact O-CD 3.36Å; P335-V338 PolarHBondContact O-N 3.17Å; P335-V339 VanDerWaalsContact O-CG2 3.31Å; P335-V339 WeakPolarHBondContact O-CG2 3.25Å; P335-V339 PolarHBondContact O-N 3.26Å
336	L	78.3	Confident	73.9	Confident	105 Å²	105	97.5 Å²	97.5	55%	0.55	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-42.6	179.2	-77.3	170.4	0	0	0	112	I332 V333 I334 V338 V339 F340	I332-L336 HydrophobicContact CG2-CD1 4.06Å; I332-L336 WeakPolarHBondContact O-CG 3.4Å; I332-L336 PolarHBondContact O-N 3.19Å; V333-L336 PolarHBondContact O-N 3.49Å; I334-L336 VanDerWaalsContact C-N 3.33Å; I334-L336 PolarHBondContact O-N 3.38Å; L336-V338 VanDerWaalsContact C-N 3.35Å; L336-V339 PolarHBondContact O-N 3.28Å; L336-F340 WeakPolarHBondContact O-CB 3.36Å; L336-F340 PolarHBondContact O-N 2.97Å
337	V	80.5	Confident	75.7	Confident	67 Å²	67	96.1 Å²	96.1	41%	0.406	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-41.5	176.2	172.5	0	0	0	0	110.4	V333 I334 F340 F341	V333-V337 HydrophobicContact CG1-CG2 4.03Å; V333-V337 WeakPolarHBondContact O-CB 3.47Å; V333-V337 VanDerWaalsContact O-CG2 3.24Å; V333-V337 WeakPolarHBondContact O-CG2 3.3Å; V333-V337 PolarHBondContact O-N 2.95Å; I334-V337 PolarHBondContact O-N 3.3Å; V337-F340 PolarHBondContact O-N 3.5Å; V337-F341 HydrophobicContact CG1-CD2 3.6Å; V337-F341 HydrophobicContact CG1-CE2 3.35Å; V337-F341 WeakPolarHBondContact O-CD2 3.49Å; V337-F341 PolarHBondContact O-N 3.45Å
338	V	82.6	Confident	77.5	Confident	75 Å²	75	91 Å²	91	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-46.1	175.8	173	0	0	0	0	111.4	I334 P335 L336 F340 F341 L342	I334-V338 HydrophobicContact CG2-CG2 4.4Å; I334-V338 VanDerWaalsContact O-CG2 3.29Å; I334-V338 WeakPolarHBondContact O-CG2 3.32Å; I334-V338 PolarHBondContact O-N 3.36Å; P335-V338 PolarHBondContact O-N 3.17Å; L336-V338 VanDerWaalsContact C-N 3.35Å; V338-F340 VanDerWaalsContact C-N 3.34Å; V338-F340 PolarHBondContact O-N 2.91Å; V338-F341 PolarHBondContact O-N 3.33Å; V338-L342 HydrophobicContact CG1-CD1 4.04Å; V338-L342 HydrophobicContact CG1-CG 4.39Å; V338-L342 VanDerWaalsContact O-CG 3.32Å; V338-L342 WeakPolarHBondContact O-CG 3.11Å; V338-L342 PolarHBondContact O-N 3.27Å
339	V	84.3	Confident	79	Confident	86 Å²	86	92.8 Å²	92.8	52%	0.521	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-42.2	176.9	172	0	0	0	0	111.1	P335 L336 F341 L342 V343	P335-V339 VanDerWaalsContact O-CG2 3.31Å; P335-V339 WeakPolarHBondContact O-CG2 3.25Å; P335-V339 PolarHBondContact O-N 3.26Å; L336-V339 PolarHBondContact O-N 3.28Å; V339-F341 PolarHBondContact O-N 2.94Å; V339-L342 PolarHBondContact O-N 3.38Å; V339-V343 HydrophobicContact CG1-CG2 4.43Å; V339-V343 WeakPolarHBondContact O-CG2 3.37Å; V339-V343 PolarHBondContact O-N 3.33Å
340	F	82.4	Confident	80.4	Confident	137 Å²	137	93.9 Å²	93.9	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-60.1	-45	176.4	-176.1	-96	0	0	0	111.9	L336 V337 V338 V343 F344	L336-F340 WeakPolarHBondContact O-CB 3.36Å; L336-F340 PolarHBondContact O-N 2.97Å; V337-F340 PolarHBondContact O-N 3.5Å; V338-F340 VanDerWaalsContact C-N 3.34Å; V338-F340 PolarHBondContact O-N 2.91Å; F340-V343 PolarHBondContact O-N 3.09Å; F340-F344 WeakPolarHBondContact O-CB 3.1Å; F340-F344 PolarHBondContact O-N 3.47Å
341	F	83.5	Confident	81.4	Confident	119 Å²	119	93.6 Å²	93.6	52%	0.522	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-39.7	175.8	-78.8	-64.3	0	0	0	112.6	V337 V338 V339 V343 F344 I345	V337-F341 HydrophobicContact CG1-CD2 3.6Å; V337-F341 HydrophobicContact CG1-CE2 3.35Å; V337-F341 WeakPolarHBondContact O-CD2 3.49Å; V337-F341 PolarHBondContact O-N 3.45Å; V338-F341 PolarHBondContact O-N 3.33Å; V339-F341 PolarHBondContact O-N 2.94Å; F341-V343 PolarHBondContact O-N 3.44Å; F341-F344 PolarHBondContact O-N 2.87Å; F341-I345 WeakPolarHBondContact O-CB 3.32Å; F341-I345 WeakPolarHBondContact O-CD1 3.3Å; F341-I345 WeakPolarHBondContact O-CG1 3.24Å; F341-I345 PolarHBondContact O-N 3.34Å
342	L	86.1	Confident	82.2	Confident	111 Å²	111	91.8 Å²	91.8	58%	0.581	50%	0.495	S	S	*	.	H	α-helix	trans	-63.7	-41.4	176.8	-71	173.8	0	0	0	112.2	V338 V339 G346	V338-L342 HydrophobicContact CG1-CD1 4.04Å; V338-L342 HydrophobicContact CG1-CG 4.39Å; V338-L342 VanDerWaalsContact O-CG 3.32Å; V338-L342 WeakPolarHBondContact O-CG 3.11Å; V338-L342 PolarHBondContact O-N 3.27Å; V339-L342 PolarHBondContact O-N 3.38Å; L342-G346 PolarHBondContact O-N 2.85Å
343	V	85.9	Confident	82.7	Confident	88 Å²	88	92 Å²	92	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-65.8	-42.4	174.7	173.6	0	0	0	0	110.8	V339 F340 F341 G346 C347	V339-V343 HydrophobicContact CG1-CG2 4.43Å; V339-V343 WeakPolarHBondContact O-CG2 3.37Å; V339-V343 PolarHBondContact O-N 3.33Å; F340-V343 PolarHBondContact O-N 3.09Å; F341-V343 PolarHBondContact O-N 3.44Å; V343-G346 PolarHBondContact O-N 2.73Å; V343-C347 WeakPolarHBondContact O-CB 3.42Å; V343-C347 PolarHBondContact O-N 2.89Å; V343-C347 PolarHBondContact O-SG 2.76Å
344	F	85.8	Confident	82.8	Confident	124 Å²	124	94.8 Å²	94.8	54%	0.544	50%	0.5	S	S	.	.	H	α-helix	trans	-66.1	-41.1	178.5	-160	-92.4	0	0	0	112.2	F340 F341 C347 T348	F340-F344 WeakPolarHBondContact O-CB 3.1Å; F340-F344 PolarHBondContact O-N 3.47Å; F341-F344 PolarHBondContact O-N 2.87Å; F344-C347 PolarHBondContact O-N 3.33Å; F344-T348 HydrophobicContact CD1-CG2 3.98Å; F344-T348 HydrophobicContact CE1-CG2 3.8Å; F344-T348 WeakPolarHBondContact O-CB 3.28Å; F344-T348 VanDerWaalsContact O-CG2 3.32Å; F344-T348 WeakPolarHBondContact O-CG2 3.29Å; F344-T348 PolarHBondContact O-N 3.5Å; F344-T348 PolarHBondContact O-OG1 3.31Å
345	I	87.7	Confident	83	Confident	84 Å²	84	99.1 Å²	99.1	43%	0.431	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-45.1	173.1	-68.2	164.4	0	0	0	110	F341 C347 T348 I349	F341-I345 WeakPolarHBondContact O-CB 3.32Å; F341-I345 WeakPolarHBondContact O-CD1 3.3Å; F341-I345 WeakPolarHBondContact O-CG1 3.24Å; F341-I345 PolarHBondContact O-N 3.34Å; I345-C347 PolarHBondContact O-N 2.94Å; I345-T348 WeakPolarHBondContact CA-OG1 3.44Å; I345-T348 PolarHBondContact O-N 2.9Å; I345-T348 PolarHBondContact O-OG1 3.32Å; I345-I349 HydrophobicContact CG2-CD1 3.6Å; I345-I349 HydrophobicContact CG2-CG1 4.3Å; I345-I349 WeakPolarHBondContact O-CB 3.31Å; I345-I349 VanDerWaalsContact O-CG1 3.23Å; I345-I349 WeakPolarHBondContact O-CG1 3.24Å; I345-I349 PolarHBondContact O-N 2.98Å
346	G	85.1	Confident	82.7	Confident	36 Å²	36	103.4 Å²	103.4	37%	0.371	52%	0.517	S	S	.	.	H	α-helix	trans	-58.9	-46.2	175.2	0	0	0	0	0	112.8	L342 V343 I349 C350	L342-G346 PolarHBondContact O-N 2.85Å; V343-G346 PolarHBondContact O-N 2.73Å; G346-I349 PolarHBondContact O-N 3.31Å; G346-C350 WeakPolarHBondContact O-CB 3.47Å; G346-C350 PolarHBondContact O-N 3.37Å
347	C	85.3	Confident	82.2	Confident	69 Å²	69	107 Å²	107	47%	0.466	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-44.3	176.3	-78.4	0	0	0	0	112.4	V343 F344 I345 C350 L351	V343-C347 WeakPolarHBondContact O-CB 3.42Å; V343-C347 PolarHBondContact O-N 2.89Å; V343-C347 PolarHBondContact O-SG 2.76Å; F344-C347 PolarHBondContact O-N 3.33Å; I345-C347 PolarHBondContact O-N 2.94Å; C347-C350 PolarHBondContact O-N 3Å; C347-L351 WeakPolarHBondContact O-CB 3.49Å; C347-L351 VanDerWaalsContact O-CG 3.26Å; C347-L351 WeakPolarHBondContact O-CG 3.02Å; C347-L351 PolarHBondContact O-N 2.97Å
348	T	84.8	Confident	81.2	Confident	63 Å²	63	111.8 Å²	111.8	39%	0.387	54%	0.544	S	S	.	.	H	α-helix	trans	-66.9	-39.3	178.6	50.5	0	0	0	0	112.2	F344 I345 L351 W352	F344-T348 HydrophobicContact CD1-CG2 3.98Å; F344-T348 HydrophobicContact CE1-CG2 3.8Å; F344-T348 WeakPolarHBondContact O-CB 3.28Å; F344-T348 VanDerWaalsContact O-CG2 3.32Å; F344-T348 WeakPolarHBondContact O-CG2 3.29Å; F344-T348 PolarHBondContact O-N 3.5Å; F344-T348 PolarHBondContact O-OG1 3.31Å; I345-T348 WeakPolarHBondContact CA-OG1 3.44Å; I345-T348 PolarHBondContact O-N 2.9Å; I345-T348 PolarHBondContact O-OG1 3.32Å; T348-L351 PolarHBondContact O-N 3.41Å; T348-W352 WeakPolarHBondContact O-CB 3.44Å; T348-W352 PolarHBondContact O-N 3.18Å
349	I	85.1	Confident	80.4	Confident	90 Å²	90	112.9 Å²	112.9	46%	0.462	56%	0.555	S	S	.	*	H	α-helix	trans	-64.3	-46.3	173.7	-67.6	169.1	0	0	0	110.5	I345 G346 L351 W352 L353	I345-I349 HydrophobicContact CG2-CD1 3.6Å; I345-I349 HydrophobicContact CG2-CG1 4.3Å; I345-I349 WeakPolarHBondContact O-CB 3.31Å; I345-I349 VanDerWaalsContact O-CG1 3.23Å; I345-I349 WeakPolarHBondContact O-CG1 3.24Å; I345-I349 PolarHBondContact O-N 2.98Å; G346-I349 PolarHBondContact O-N 3.31Å; I349-L351 VanDerWaalsContact C-N 3.35Å; I349-L351 PolarHBondContact O-N 3.36Å; I349-W352 PolarHBondContact O-N 3.47Å; I349-L353 HydrophobicContact CG2-CD1 3.93Å; I349-L353 HydrophobicContact CG2-CG 4.3Å; I349-L353 WeakPolarHBondContact O-CB 3.21Å; I349-L353 WeakPolarHBondContact O-CG 3.38Å; I349-L353 PolarHBondContact O-N 3.06Å
350	C	83	Confident	78.7	Confident	87 Å²	87	115 Å²	115	59%	0.588	56%	0.563	S	S	*	*	H	α-helix	trans	-58.5	-44.8	175	-91	0	0	0	0	112	G346 C347 W352 L353 Y354	G346-C350 WeakPolarHBondContact O-CB 3.47Å; G346-C350 PolarHBondContact O-N 3.37Å; C347-C350 PolarHBondContact O-N 3Å; C350-W352 VanDerWaalsContact C-N 3.35Å; C350-W352 PolarHBondContact O-N 2.93Å; C350-L353 PolarHBondContact O-N 3.22Å; C350-Y354 WeakPolarHBondContact O-CB 3.22Å; C350-Y354 PolarHBondContact O-N 2.79Å
351	L	82.6	Confident	77	Confident	104 Å²	104	117.8 Å²	117.8	55%	0.545	60%	0.595	S	S	.	*	H	α-helix	trans	-64.5	-38.2	176.3	-74.9	170.3	0	0	0	112.2	C347 T348 I349 R355	C347-L351 WeakPolarHBondContact O-CB 3.49Å; C347-L351 VanDerWaalsContact O-CG 3.26Å; C347-L351 WeakPolarHBondContact O-CG 3.02Å; C347-L351 PolarHBondContact O-N 2.97Å; T348-L351 PolarHBondContact O-N 3.41Å; I349-L351 VanDerWaalsContact C-N 3.35Å; I349-L351 PolarHBondContact O-N 3.36Å; L351-R355 WeakPolarHBondContact O-CB 3.5Å; L351-R355 WeakPolarHBondContact O-CG 3.26Å; L351-R355 PolarHBondContact O-N 3.1Å
352	W	82.4	Confident	76.6	Confident	151 Å²	151	117.7 Å²	117.7	57%	0.572	60%	0.599	S	S	*	*	H	α-helix	trans	-68.6	-44.4	177.3	-174.1	80.7	0	0	0	111.8	T348 I349 C350 Y354 R355 R356	T348-W352 WeakPolarHBondContact O-CB 3.44Å; T348-W352 PolarHBondContact O-N 3.18Å; I349-W352 PolarHBondContact O-N 3.47Å; C350-W352 VanDerWaalsContact C-N 3.35Å; C350-W352 PolarHBondContact O-N 2.93Å; W352-Y354 VanDerWaalsContact C-N 3.34Å; W352-Y354 PolarHBondContact O-N 3.19Å; W352-R355 PolarHBondContact O-N 3.37Å; W352-R356 VanDerWaalsContact CH2-NH1 3.31Å; W352-R356 WeakPolarHBondContact O-CB 3.49Å; W352-R356 PolarHBondContact O-N 3.14Å
353	L	81.2	Confident	76.1	Confident	93 Å²	93	118.1 Å²	118.1	49%	0.487	60%	0.6	S	S	.	*	H	α-helix	trans	-63.6	-40.2	174.3	-69.3	175.4	0	0	0	111.7	I349 C350 R356 K357	I349-L353 HydrophobicContact CG2-CD1 3.93Å; I349-L353 HydrophobicContact CG2-CG 4.3Å; I349-L353 WeakPolarHBondContact O-CB 3.21Å; I349-L353 WeakPolarHBondContact O-CG 3.38Å; I349-L353 PolarHBondContact O-N 3.06Å; C350-L353 PolarHBondContact O-N 3.22Å; L353-R356 PolarHBondContact O-N 3.04Å; L353-K357 PolarHBondContact O-N 3.3Å
354	Y	76.4	Confident	75.6	Confident	141 Å²	141	119.7 Å²	119.7	55%	0.553	60%	0.603	S	S	*	*	H	α-helix	trans	-61.4	-44.8	174.2	-178.5	-99.4	0	0	0	111.8	C350 W352 K357 K358	C350-Y354 WeakPolarHBondContact O-CB 3.22Å; C350-Y354 PolarHBondContact O-N 2.79Å; W352-Y354 VanDerWaalsContact C-N 3.34Å; W352-Y354 PolarHBondContact O-N 3.19Å; Y354-K357 PolarHBondContact O-N 3.36Å; Y354-K358 PolarHBondContact O-N 3.5Å
355	R	79.2	Confident	75	Confident	184 Å²	184	119.5 Å²	119.5	69%	0.694	61%	0.607	S	S	*	*	H	α-helix	trans	-65.8	-40.2	175	-75.8	-178.2	-179	-176	1.4	112.4	L351 W352 K357 K358 S359	L351-R355 WeakPolarHBondContact O-CB 3.5Å; L351-R355 WeakPolarHBondContact O-CG 3.26Å; L351-R355 PolarHBondContact O-N 3.1Å; W352-R355 PolarHBondContact O-N 3.37Å; R355-K357 VanDerWaalsContact C-N 3.35Å; R355-K357 PolarHBondContact O-N 3.29Å; R355-K358 PolarHBondContact O-N 3.47Å; R355-K358 VanDerWaalsContact O-N 3.16Å; R355-S359 PolarHBondContact O-N 3.48Å; R355-S359 VanDerWaalsContact O-N 3.14Å
356	R	75.2	Confident	74.2	Confident	157 Å²	157	121.7 Å²	121.7	59%	0.592	62%	0.618	S	S	*	*	H	α-helix	trans	-64.6	-38.8	178.8	-164.6	176.2	-176.4	-178.5	0.8	111.9	W352 L353 K358 S359 N360	W352-R356 VanDerWaalsContact CH2-NH1 3.31Å; W352-R356 WeakPolarHBondContact O-CB 3.49Å; W352-R356 PolarHBondContact O-N 3.14Å; L353-R356 PolarHBondContact O-N 3.04Å; R356-K358 VanDerWaalsContact C-N 3.3Å; R356-K358 PolarHBondContact O-N 3.48Å; R356-S359 PolarHBondContact O-N 3.2Å; R356-N360 PolarHBondContact O-N 3.4Å
357	K	67.7	Low	73.5	Confident	182 Å²	182	127.4 Å²	127.4	79%	0.791	63%	0.634	S	S	*	*	H	α-helix	trans	-70.4	-24.2	174.8	-159.8	175.2	-178.5	-179	0	112.9	L353 Y354 R355	L353-K357 PolarHBondContact O-N 3.3Å; Y354-K357 PolarHBondContact O-N 3.36Å; R355-K357 VanDerWaalsContact C-N 3.35Å; R355-K357 PolarHBondContact O-N 3.29Å
358	K	60	Low	72.6	Confident	166 Å²	166	131.6 Å²	131.6	72%	0.722	65%	0.646	S	S	*	*	H	α-helix	trans	-78.8	-24.1	173.6	-168	176.5	179.9	-179.6	0	113.5	Y354 R355 R356	Y354-K358 PolarHBondContact O-N 3.5Å; R355-K358 PolarHBondContact O-N 3.47Å; R355-K358 VanDerWaalsContact O-N 3.16Å; R356-K358 VanDerWaalsContact C-N 3.3Å; R356-K358 PolarHBondContact O-N 3.48Å
359	S	65.7	Low	71.7	Confident	99 Å²	99	136.8 Å²	136.8	69%	0.692	67%	0.666	S	S	*	*	H	α-helix	trans	-91.3	-7.6	179.9	-77.6	0	0	0	0	114.7	R355 R356	R355-S359 PolarHBondContact O-N 3.48Å; R355-S359 VanDerWaalsContact O-N 3.14Å; R356-S359 PolarHBondContact O-N 3.2Å
360	N	48.5	Very low	70.6	Confident	129 Å²	129	140.8 Å²	140.8	69%	0.69	68%	0.683	S	S	*	*			trans	-110.7	108.1	165.9	-91.2	-3.4	0	0	0	108	R356	R356-N360 PolarHBondContact O-N 3.4Å
361	P	45.3	Very low	69.5	Low	196 Å²	196	145.6 Å²	145.6	100%	1.273	69%	0.692	S	S	*	*			trans	-61.8	0	174.5	26.6	-32.6	0	0	0	112.5

Retrieved 361 of 361 residues in 98.8 ms (Link to these results)

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