A0AA82N829_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N829, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 319 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	53.9	Low	220 Å²	220	134.8 Å²	134.8	100%	1.084	65%	0.651	S	S	*	*				0	112.6	0	-83.8	172.8	169.1	0	0	108.2	Y3	M1-Y3 PolarHBondContact O-N 3.08Å
2	R	43.3	Very low	54.8	Low	244 Å²	244	132.7 Å²	132.7	92%	0.921	64%	0.644	S	S	*	*			trans	-71.7	108	163.8	-72.5	-179.3	176.5	177.2	-1.4	105.7	N4	R2-N4 PolarHBondContact O-N 3.48Å; R2-N4 VanDerWaalsContact O-N 3.15Å
3	Y	53.4	Low	55.7	Low	177 Å²	177	127.1 Å²	127.1	69%	0.694	62%	0.623	S	S	*	*			trans	-73	103.8	173.2	-103	-89.9	0	0	0	107.3	M1 F5	M1-Y3 PolarHBondContact O-N 3.08Å; Y3-F5 PolarHBondContact O-N 3.31Å
4	N	47.6	Very low	56.4	Low	150 Å²	150	128.6 Å²	128.6	80%	0.802	62%	0.62	S	S	*	*			trans	-72.5	103.4	161.3	-74.5	-15.9	0	0	0	106	R2 S6	R2-N4 PolarHBondContact O-N 3.48Å; R2-N4 VanDerWaalsContact O-N 3.15Å; N4-S6 PolarHBondContact O-N 3.41Å
5	F	48	Very low	56.8	Low	128 Å²	128	125.7 Å²	125.7	56%	0.561	61%	0.613	S	S	*	*			trans	-55.8	124.4	167.4	-83	-90.1	0	0	0	108	Y3 L9 W10	Y3-F5 PolarHBondContact O-N 3.31Å; F5-L9 HydrophobicContact CD1-CD1 4.46Å; F5-W10 VanDerWaalsContact CB-NE1 3.31Å
6	S	55.6	Low	57.2	Low	55 Å²	55	123.3 Å²	123.3	39%	0.385	60%	0.602	S	S	.	*			trans	-54.4	135.9	174.8	173.2	0	0	0	0	109.3	N4 S8 L9	N4-S6 PolarHBondContact O-N 3.41Å; S6-S8 PolarHBondContact O-N 3.03Å; S6-S8 PolarHBondContact OG-N 3.38Å; S6-S8 PolarHBondContact OG-OG 3.2Å; S6-L9 WeakPolarHBondContact O-CB 3.34Å; S6-L9 PolarHBondContact O-N 3.31Å
7	P	62.9	Low	57.1	Low	98 Å²	98	122.8 Å²	122.8	64%	0.636	60%	0.597	S	S	*	*	H	α-helix	trans	-50.3	-30.4	176.7	-27	33.5	0	0	0	113.5	L9 W10 I11	P7-L9 VanDerWaalsContact C-N 3.32Å; P7-L9 PolarHBondContact O-N 2.87Å; P7-W10 PolarHBondContact O-N 3.28Å; P7-I11 WeakPolarHBondContact O-CG1 3.33Å; P7-I11 PolarHBondContact O-N 2.91Å; P7-I11 VanDerWaalsContact O-N 3.08Å
8	S	63.1	Low	57	Low	74 Å²	74	120.4 Å²	120.4	52%	0.517	59%	0.59	S	S	.	*	H	α-helix	trans	-62.1	-34.2	176.2	60.5	0	0	0	0	114	S6 L12	S6-S8 PolarHBondContact O-N 3.03Å; S6-S8 PolarHBondContact OG-N 3.38Å; S6-S8 PolarHBondContact OG-OG 3.2Å; S8-L12 PolarHBondContact O-N 3.42Å; S8-L12 VanDerWaalsContact O-N 3.12Å
9	L	55.2	Low	56.6	Low	92 Å²	92	122.5 Å²	122.5	48%	0.482	59%	0.591	S	S	.	*	H	α-helix	trans	-70.1	-38.2	176.2	-91.5	144.2	0	0	0	111.3	F5 S6 P7 L12 V13	F5-L9 HydrophobicContact CD1-CD1 4.46Å; S6-L9 WeakPolarHBondContact O-CB 3.34Å; S6-L9 PolarHBondContact O-N 3.31Å; P7-L9 VanDerWaalsContact C-N 3.32Å; P7-L9 PolarHBondContact O-N 2.87Å; L9-L12 PolarHBondContact O-N 3.28Å; L9-V13 WeakPolarHBondContact O-CB 3.25Å; L9-V13 WeakPolarHBondContact O-CG2 3.48Å; L9-V13 PolarHBondContact O-N 2.89Å
10	W	57.8	Low	56.2	Low	134 Å²	134	118.7 Å²	118.7	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-64.2	-45.9	175	-75.4	97.9	0	0	0	111.3	F5 P7 L12 V13 Y14	F5-W10 VanDerWaalsContact CB-NE1 3.31Å; P7-W10 PolarHBondContact O-N 3.28Å; W10-L12 VanDerWaalsContact C-N 3.3Å; W10-L12 PolarHBondContact O-N 3.48Å; W10-V13 PolarHBondContact O-N 3.41Å; W10-Y14 HydrophobicContact CB-CD2 4.42Å; W10-Y14 AromaticContact CE3-CE2 3.88Å; W10-Y14 HydrophobicContact CE3-CE2 3.88Å; W10-Y14 WeakPolarHBondContact O-CB 3.47Å; W10-Y14 WeakPolarHBondContact O-CD2 3.32Å; W10-Y14 PolarHBondContact O-N 3.39Å
11	I	66.2	Low	56	Low	111 Å²	111	118.4 Å²	118.4	57%	0.569	57%	0.571	S	S	*	*	H	α-helix	trans	-57.1	-46	176.5	-64.9	165.4	0	0	0	110.5	P7 V13 Y14 V15	P7-I11 WeakPolarHBondContact O-CG1 3.33Å; P7-I11 PolarHBondContact O-N 2.91Å; P7-I11 VanDerWaalsContact O-N 3.08Å; I11-V13 PolarHBondContact O-N 2.93Å; I11-Y14 PolarHBondContact O-N 3.24Å; I11-V15 HydrophobicContact CG2-CG2 4.27Å; I11-V15 WeakPolarHBondContact O-CB 3.36Å; I11-V15 VanDerWaalsContact O-CG2 3.23Å; I11-V15 WeakPolarHBondContact O-CG2 3.23Å; I11-V15 PolarHBondContact O-N 3.03Å
12	L	64.3	Low	56.5	Low	109 Å²	109	114.7 Å²	114.7	57%	0.571	55%	0.549	S	S	*	.	H	α-helix	trans	-63.7	-41.8	-179.5	-156.4	121.2	0	0	0	112	S8 L9 W10 V15 I16	S8-L12 PolarHBondContact O-N 3.42Å; S8-L12 VanDerWaalsContact O-N 3.12Å; L9-L12 PolarHBondContact O-N 3.28Å; W10-L12 VanDerWaalsContact C-N 3.3Å; W10-L12 PolarHBondContact O-N 3.48Å; L12-V15 PolarHBondContact O-N 2.87Å; L12-I16 HydrophobicContact CD2-CD1 3.73Å; L12-I16 HydrophobicContact CG-CD1 4.43Å; L12-I16 WeakPolarHBondContact O-CD1 3.29Å; L12-I16 VanDerWaalsContact O-CG1 3.23Å; L12-I16 WeakPolarHBondContact O-CG1 3.39Å; L12-I16 PolarHBondContact O-N 2.9Å
13	V	67.3	Low	56.7	Low	60 Å²	60	110.1 Å²	110.1	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-46.3	175.6	171.8	0	0	0	0	111.1	L9 W10 I11 V15 I16 F17	L9-V13 WeakPolarHBondContact O-CB 3.25Å; L9-V13 WeakPolarHBondContact O-CG2 3.48Å; L9-V13 PolarHBondContact O-N 2.89Å; W10-V13 PolarHBondContact O-N 3.41Å; I11-V13 PolarHBondContact O-N 2.93Å; V13-V15 PolarHBondContact O-N 3.28Å; V13-I16 PolarHBondContact O-N 3.2Å; V13-F17 HydrophobicContact CG1-CD2 3.52Å; V13-F17 HydrophobicContact CG1-CE2 3.38Å; V13-F17 WeakPolarHBondContact O-CD2 3.41Å; V13-F17 PolarHBondContact O-N 3.29Å
14	Y	64.3	Low	56.4	Low	148 Å²	148	105.4 Å²	105.4	58%	0.58	52%	0.515	S	S	*	.	H	α-helix	trans	-60.6	-43.3	175.4	-85.5	-72	0	0	0	112	W10 I11 I16 F17 V18	W10-Y14 HydrophobicContact CB-CD2 4.42Å; W10-Y14 AromaticContact CE3-CE2 3.88Å; W10-Y14 HydrophobicContact CE3-CE2 3.88Å; W10-Y14 WeakPolarHBondContact O-CB 3.47Å; W10-Y14 WeakPolarHBondContact O-CD2 3.32Å; W10-Y14 PolarHBondContact O-N 3.39Å; I11-Y14 PolarHBondContact O-N 3.24Å; Y14-I16 PolarHBondContact O-N 2.91Å; Y14-F17 PolarHBondContact O-N 3.47Å; Y14-V18 WeakPolarHBondContact O-CB 3.43Å; Y14-V18 VanDerWaalsContact O-CG2 3.23Å; Y14-V18 WeakPolarHBondContact O-CG2 3.49Å; Y14-V18 PolarHBondContact O-N 3.5Å
15	V	62.5	Low	56.3	Low	86 Å²	86	99.3 Å²	99.3	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-43.9	177.2	171.1	0	0	0	0	110.7	I11 L12 V13 W19	I11-V15 HydrophobicContact CG2-CG2 4.27Å; I11-V15 WeakPolarHBondContact O-CB 3.36Å; I11-V15 VanDerWaalsContact O-CG2 3.23Å; I11-V15 WeakPolarHBondContact O-CG2 3.23Å; I11-V15 PolarHBondContact O-N 3.03Å; L12-V15 PolarHBondContact O-N 2.87Å; V13-V15 PolarHBondContact O-N 3.28Å; V15-W19 WeakPolarHBondContact O-CB 3.49Å; V15-W19 PolarHBondContact O-N 2.89Å
16	I	64	Low	56.6	Low	86 Å²	86	96 Å²	96	44%	0.441	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-45.4	177.4	-68.6	165	0	0	0	110.9	L12 V13 Y14 S20	L12-I16 HydrophobicContact CD2-CD1 3.73Å; L12-I16 HydrophobicContact CG-CD1 4.43Å; L12-I16 WeakPolarHBondContact O-CD1 3.29Å; L12-I16 VanDerWaalsContact O-CG1 3.23Å; L12-I16 WeakPolarHBondContact O-CG1 3.39Å; L12-I16 PolarHBondContact O-N 2.9Å; V13-I16 PolarHBondContact O-N 3.2Å; Y14-I16 PolarHBondContact O-N 2.91Å; I16-S20 VanDerWaalsContact O-CB 3.25Å; I16-S20 WeakPolarHBondContact O-CB 3.49Å; I16-S20 PolarHBondContact O-N 3.43Å; I16-S20 PolarHBondContact O-OG 3.26Å
17	F	55.4	Low	56.2	Low	116 Å²	116	97.5 Å²	97.5	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-67.8	-46.5	179.7	-79.7	-65.3	0	0	0	112.7	V13 Y14 W19 S20 Y21 L294	V13-F17 HydrophobicContact CG1-CD2 3.52Å; V13-F17 HydrophobicContact CG1-CE2 3.38Å; V13-F17 WeakPolarHBondContact O-CD2 3.41Å; V13-F17 PolarHBondContact O-N 3.29Å; Y14-F17 PolarHBondContact O-N 3.47Å; F17-W19 VanDerWaalsContact C-N 3.31Å; F17-W19 PolarHBondContact O-N 2.84Å; F17-S20 PolarHBondContact O-N 2.87Å; F17-Y21 WeakPolarHBondContact O-CB 3.22Å; F17-Y21 PolarHBondContact O-N 3.16Å; F17-L294 HydrophobicContact CZ-CD2 4.41Å
18	V	54.2	Low	55.9	Low	79 Å²	79	95.4 Å²	95.4	48%	0.479	46%	0.462	S	S	.	.	H	α-helix	trans	-63	-40.4	177.9	172.4	0	0	0	0	110.8	Y14 Y21 K22	Y14-V18 WeakPolarHBondContact O-CB 3.43Å; Y14-V18 VanDerWaalsContact O-CG2 3.23Å; Y14-V18 WeakPolarHBondContact O-CG2 3.49Å; Y14-V18 PolarHBondContact O-N 3.5Å; V18-Y21 PolarHBondContact O-N 2.89Å; V18-K22 PolarHBondContact O-N 2.96Å
19	W	50.5	Low	55.6	Low	161 Å²	161	96 Å²	96	61%	0.61	45%	0.453	S	S	*	.	H	α-helix	trans	-69.2	-44.4	178.8	-170.5	35.1	0	0	0	112	V15 F17 Y21 K22 R23	V15-W19 WeakPolarHBondContact O-CB 3.49Å; V15-W19 PolarHBondContact O-N 2.89Å; F17-W19 VanDerWaalsContact C-N 3.31Å; F17-W19 PolarHBondContact O-N 2.84Å; W19-Y21 VanDerWaalsContact C-N 3.31Å; W19-Y21 PolarHBondContact O-N 3.25Å; W19-K22 PolarHBondContact O-N 3.41Å; W19-R23 WeakPolarHBondContact O-CB 3.43Å; W19-R23 PolarHBondContact O-N 3.31Å
20	S	48.5	Very low	56.1	Low	46 Å²	46	93.5 Å²	93.5	32%	0.322	44%	0.443	S	S	.	.	H	α-helix	trans	-61.4	-42.2	174.8	-55.1	0	0	0	0	111	I16 F17 R23 F24	I16-S20 VanDerWaalsContact O-CB 3.25Å; I16-S20 WeakPolarHBondContact O-CB 3.49Å; I16-S20 PolarHBondContact O-N 3.43Å; I16-S20 PolarHBondContact O-OG 3.26Å; F17-S20 PolarHBondContact O-N 2.87Å; S20-R23 WeakPolarHBondContact O-CB 3.27Å; S20-R23 PolarHBondContact O-N 2.95Å; S20-F24 WeakPolarHBondContact O-CD2 3.36Å; S20-F24 PolarHBondContact O-N 3.4Å
21	Y	52.6	Low	56.4	Low	113 Å²	113	93 Å²	93	44%	0.443	44%	0.444	S	S	.	.	H	α-helix	trans	-64.2	-47.9	178.7	-178.3	-94.5	0	0	0	112.4	F17 V18 W19 R23 F24 N25	F17-Y21 WeakPolarHBondContact O-CB 3.22Å; F17-Y21 PolarHBondContact O-N 3.16Å; V18-Y21 PolarHBondContact O-N 2.89Å; W19-Y21 VanDerWaalsContact C-N 3.31Å; W19-Y21 PolarHBondContact O-N 3.25Å; Y21-R23 PolarHBondContact O-N 3.12Å; Y21-F24 PolarHBondContact O-N 3.48Å; Y21-N25 WeakPolarHBondContact CE1-ND2 3.38Å; Y21-N25 PolarHBondContact O-N 3.34Å
22	K	50.5	Low	56.4	Low	141 Å²	141	90.5 Å²	90.5	61%	0.613	43%	0.432	S	S	*	.	H	α-helix	trans	-57.2	-40.4	173	-79.6	-170.8	175.7	-172.2	0	111.4	V18 W19 C26	V18-K22 PolarHBondContact O-N 2.96Å; W19-K22 PolarHBondContact O-N 3.41Å; K22-C26 PolarHBondContact O-N 3.31Å; K22-C26 VanDerWaalsContact O-N 3.12Å; K22-C26 PolarHBondContact O-SG 3.21Å; K22-C26 VanDerWaalsContact O-SG 3.41Å
23	R	46.8	Very low	56.8	Low	148 Å²	148	88.3 Å²	88.3	56%	0.558	42%	0.424	S	S	*	.	H	α-helix	trans	-63.7	-43.8	178.4	-170.8	179.3	-177.9	178	-0.4	113.1	W19 S20 Y21 C26 N27	W19-R23 WeakPolarHBondContact O-CB 3.43Å; W19-R23 PolarHBondContact O-N 3.31Å; S20-R23 WeakPolarHBondContact O-CB 3.27Å; S20-R23 PolarHBondContact O-N 2.95Å; Y21-R23 PolarHBondContact O-N 3.12Å; R23-C26 PolarHBondContact O-N 2.91Å; R23-N27 PolarHBondContact O-N 3.2Å
24	F	46.9	Very low	57.7	Low	78 Å²	78	89.3 Å²	89.3	34%	0.342	43%	0.425	S	S	.	.	H	α-helix	trans	-63.5	-44.4	177.8	-82	-70.5	0	0	0	112.4	S20 Y21 N27 D28 Y289 V290	S20-F24 WeakPolarHBondContact O-CD2 3.36Å; S20-F24 PolarHBondContact O-N 3.4Å; Y21-F24 PolarHBondContact O-N 3.48Å; F24-N27 PolarHBondContact O-N 3.15Å; F24-D28 PolarHBondContact O-N 2.84Å; F24-Y289 HydrophobicContact CE1-CG 4.34Å; F24-V290 HydrophobicContact CD2-CG2 4.39Å; F24-V290 HydrophobicContact CE1-CG2 4.33Å; F24-V290 HydrophobicContact CE2-CG2 3.66Å; F24-V290 HydrophobicContact CZ-CG2 3.62Å
25	N	46.6	Very low	58.6	Low	23 Å²	23	85.1 Å²	85.1	12%	0.123	41%	0.412	C	S	.	.	H	α-helix	trans	-62.5	-45.2	178.4	-77.4	-13	0	0	0	110.8	Y21 N27 D28 Y29 K226	Y21-N25 WeakPolarHBondContact CE1-ND2 3.38Å; Y21-N25 PolarHBondContact O-N 3.34Å; N25-N27 PolarHBondContact O-N 3.29Å; N25-D28 PolarHBondContact O-N 3.49Å; N25-Y29 HydrophobicContact CB-CD2 4.43Å; N25-Y29 HydrophobicContact CB-CE2 4.08Å; N25-Y29 WeakPolarHBondContact O-CD2 3.27Å; N25-Y29 PolarHBondContact O-N 2.85Å; N25-K226 PolarHBondContact OD1-NZ 3.01Å
26	C	52.8	Low	59.8	Low	57 Å²	57	83 Å²	83	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-53.8	-40.9	175.2	-74.2	0	0	0	0	112.9	K22 R23 Y29 C30	K22-C26 PolarHBondContact O-N 3.31Å; K22-C26 VanDerWaalsContact O-N 3.12Å; K22-C26 PolarHBondContact O-SG 3.21Å; K22-C26 VanDerWaalsContact O-SG 3.41Å; R23-C26 PolarHBondContact O-N 2.91Å; C26-Y29 PolarHBondContact O-N 3.44Å; C26-C30 PolarHBondContact O-N 3.38Å; C26-C30 VanDerWaalsContact O-N 3.15Å; C26-C30 PolarHBondContact O-SG 2.92Å
27	N	48.9	Very low	60.8	Low	88 Å²	88	79.4 Å²	79.4	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-70.6	-34.6	-175	-129.6	18.4	0	0	0	113.8	R23 F24 N25	R23-N27 PolarHBondContact O-N 3.2Å; F24-N27 PolarHBondContact O-N 3.15Å; N25-N27 PolarHBondContact O-N 3.29Å
28	D	55.4	Low	62.3	Low	54 Å²	54	75 Å²	75	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-70.9	-39.1	175.1	-79.8	-20.8	0	0	0	111.3	F24 N25 C30 K31 H282	F24-D28 PolarHBondContact O-N 2.84Å; N25-D28 PolarHBondContact O-N 3.49Å; D28-C30 VanDerWaalsContact C-N 3.32Å; D28-C30 PolarHBondContact O-N 2.88Å; D28-K31 PolarHBondContact O-N 3.28Å; D28-H282 IonicContact OD2-CD2 3.66Å; D28-H282 IonicContact OD2-CE1 3.57Å; D28-H282 IonicContact OD2-NE2 2.76Å; D28-H282 PolarHBondContact OD2-NE2 2.85Å
29	Y	56.4	Low	64	Low	86 Å²	86	74.1 Å²	74.1	34%	0.337	35%	0.353	S	S	.	.	H	α-helix	trans	-68.5	-28.5	179.1	-72.4	-61.3	0	0	0	113.6	N25 C26 K31 N32 Y49	N25-Y29 HydrophobicContact CB-CD2 4.43Å; N25-Y29 HydrophobicContact CB-CE2 4.08Å; N25-Y29 WeakPolarHBondContact O-CD2 3.27Å; N25-Y29 PolarHBondContact O-N 2.85Å; C26-Y29 PolarHBondContact O-N 3.44Å; Y29-K31 PolarHBondContact O-N 3.33Å; Y29-N32 PolarHBondContact O-N 3.48Å; Y29-Y49 HydrophobicContact CD1-CD2 4.43Å; Y29-Y49 HydrophobicContact CG-CD2 4.36Å; Y29-Y49 HydrophobicContact CG-CE2 4.33Å
30	C	65.5	Low	66	Low	40 Å²	40	70 Å²	70	27%	0.27	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-11.1	177.6	-70.1	0	0	0	0	114.3	C26 D28 N32 C191	C26-C30 PolarHBondContact O-N 3.38Å; C26-C30 VanDerWaalsContact O-N 3.15Å; C26-C30 PolarHBondContact O-SG 2.92Å; D28-C30 VanDerWaalsContact C-N 3.32Å; D28-C30 PolarHBondContact O-N 2.88Å; C30-N32 PolarHBondContact O-N 3.5Å; C30-C191 HydrophobicContact CB-CB 4.02Å; C30-C191 WeakPolarHBondContact CB-SG 3.48Å; C30-C191 WeakPolarHBondContact SG-CA 3.45Å; C30-C191 WeakPolarHBondContact SG-CB 3.41Å; C30-C191 CovalentContact SG-SG 2.03Å; C30-C191 PolarHBondContact SG-SG 3.47Å
31	K	65.3	Low	68.1	Low	123 Å²	123	74.6 Å²	74.6	54%	0.535	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	4	177.2	-68.8	-179.6	178.2	171.5	0	113.9	D28 Y29 P33	D28-K31 PolarHBondContact O-N 3.28Å; Y29-K31 PolarHBondContact O-N 3.33Å; K31-P33 VanDerWaalsContact C-CD 3.43Å
32	N	64.9	Low	70.1	Confident	59 Å²	59	72.4 Å²	72.4	32%	0.316	36%	0.362	S	S	.	.			trans	43.2	53.8	-176.2	-164.3	11.2	0	0	0	114	Y29 C30 E34 H198 E199	Y29-N32 PolarHBondContact O-N 3.48Å; C30-N32 PolarHBondContact O-N 3.5Å; N32-E34 PolarHBondContact O-N 3.33Å; N32-H198 PolarHBondContact OD1-NE2 3.05Å; N32-H198 VanDerWaalsContact OD1-NE2 3.09Å; N32-E199 PolarHBondContact ND2-O 3.37Å
33	P	72.6	Confident	72.1	Confident	62 Å²	62	66.8 Å²	66.8	40%	0.403	34%	0.337	S	S	.	.			trans	-74.5	112.1	173.5	30.5	-30.7	0	0	0	109.3	K31 I35	K31-P33 VanDerWaalsContact C-CD 3.43Å; P33-I35 PolarHBondContact O-N 3.08Å
34	E	86.5	Confident	74.4	Confident	81 Å²	81	60.5 Å²	60.5	38%	0.379	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	127.1	157.7	172.4	172.3	-151.6	0	0	108.5	N32 V36 R44 H48	N32-E34 PolarHBondContact O-N 3.33Å; E34-V36 HydrophobicContact CG-CG2 4.05Å; E34-R44 VanDerWaalsContact CD-NH2 3.3Å; E34-R44 IonicContact OE1-CZ 2.89Å; E34-R44 IonicContact OE1-NE 3.45Å; E34-R44 IonicContact OE1-NH2 3.85Å; E34-R44 PolarHBondContact OE1-NH2 2.96Å; E34-R44 IonicContact OE2-NH2 3.56Å; E34-R44 PolarHBondContact OE2-NH2 2.84Å; E34-H48 WeakPolarHBondContact CG-CE1 3.15Å; E34-H48 IonicContact OE1-CE1 2.65Å; E34-H48 PolarHBondContact OE1-CE1 3.46Å; E34-H48 VanDerWaalsContact OE1-CE1 3.3Å; E34-H48 IonicContact OE1-NE2 3.7Å; E34-H48 PolarHBondContact OE1-NE2 3.36Å
35	I	84.9	Confident	76.6	Confident	61 Å²	61	57 Å²	57	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	105	172	-55.4	175.1	0	0	0	108.1	P33 I37 S46 L47	P33-I35 PolarHBondContact O-N 3.08Å; I35-I37 HydrophobicContact CG2-CD1 3.89Å; I35-I37 PolarHBondContact O-N 3.24Å; I35-S46 CarbonylContact O-C 3.57Å; I35-S46 VanDerWaalsContact O-CA 3.23Å; I35-S46 WeakPolarHBondContact O-CA 3.49Å; I35-L47 HydrophobicContact CB-CB 4.4Å; I35-L47 PolarHBondContact N-O 2.94Å; I35-L47 PolarHBondContact O-N 3.34Å
36	V	87.4	Confident	78.7	Confident	42 Å²	42	55.9 Å²	55.9	26%	0.255	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	113.3	173.1	-177	0	0	0	0	109.2	E34 E39	E34-V36 HydrophobicContact CG-CG2 4.05Å; V36-E39 HydrophobicContact CG1-CB 3.9Å
37	I	84.2	Confident	80.3	Confident	9 Å²	9	54 Å²	54	5%	0.046	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-55.3	-179.4	-59.4	-60.5	0	0	0	109.7	I35 Y45 L47 Y244 K246	I35-I37 HydrophobicContact CG2-CD1 3.89Å; I35-I37 PolarHBondContact O-N 3.24Å; I37-Y45 HydrophobicContact CB-CD1 3.82Å; I37-Y45 HydrophobicContact CG1-CD1 3.86Å; I37-Y45 HydrophobicContact CG1-CE1 4.2Å; I37-Y45 HydrophobicContact CG2-CD1 4.13Å; I37-Y45 PolarHBondContact N-O 3.49Å; I37-L47 HydrophobicContact CD1-CD1 3.99Å; I37-L47 HydrophobicContact CD1-CG 4.35Å; I37-L47 HydrophobicContact CG1-CD1 4.26Å; I37-L47 HydrophobicContact CG1-CG 4.12Å; I37-Y244 HydrophobicContact CG2-CD1 3.24Å; I37-Y244 HydrophobicContact CG2-CE1 3.69Å; I37-Y244 HydrophobicContact CG2-CG 4.09Å; I37-K246 WeakPolarHBondContact O-CD 3.49Å; I37-K246 WeakPolarHBondContact O-CE 3.4Å; I37-K246 PolarHBondContact O-NZ 3.29Å
38	I	86.3	Confident	82.1	Confident	23 Å²	23	50.1 Å²	50.1	12%	0.118	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	141.5	179.3	-177.7	166.2	0	0	0	109.1	Y43 R44 Y45 V268	I38-Y43 HydrophobicContact CG2-CD1 3.86Å; I38-Y43 HydrophobicContact CG2-CE1 3.63Å; I38-R44 CarbonylContact O-C 3.59Å; I38-R44 WeakPolarHBondContact O-CA 3.46Å; I38-Y45 PolarHBondContact N-O 3.3Å; I38-Y45 PolarHBondContact O-N 2.74Å; I38-V268 HydrophobicContact CD1-CB 4.12Å; I38-V268 HydrophobicContact CD1-CG2 3.85Å
39	E	91	Very high	83.2	Confident	62 Å²	62	50 Å²	50	29%	0.29	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	127.6	175.4	-177.3	163.6	178	0	0	108.4	V36 Y43 R44 K205 W206	V36-E39 HydrophobicContact CG1-CB 3.9Å; E39-Y43 CarbonylContact C-O 3.6Å; E39-Y43 WeakPolarHBondContact CA-O 3.23Å; E39-R44 HydrophobicContact CB-CB 4.49Å; E39-R44 HydrophobicContact CB-CG 4.3Å; E39-R44 HydrophobicContact CG-CB 4.24Å; E39-R44 HydrophobicContact CG-CG 4.24Å; E39-R44 IonicContact OE1-NH1 3.82Å; E39-R44 PolarHBondContact OE1-NH1 3.32Å; E39-R44 IonicContact OE2-CZ 3.27Å; E39-R44 IonicContact OE2-NE 3.84Å; E39-R44 IonicContact OE2-NH1 3.3Å; E39-R44 PolarHBondContact OE2-NH1 2.86Å; E39-K205 WeakPolarHBondContact OE1-CE 3.46Å; E39-K205 IonicContact OE1-NZ 3.36Å; E39-K205 PolarHBondContact OE1-NZ 3.36Å; E39-W206 HydrophobicContact CG-CZ2 4.1Å
40	N	92.6	Very high	84.3	Confident	75 Å²	75	49.4 Å²	49.4	40%	0.401	25%	0.253	S	S	.	.			trans	-137.7	-169.2	169.3	67.6	37.3	0	0	0	108.7	T42 Y43 W206	N40-T42 VanDerWaalsContact C-N 3.27Å; N40-T42 PolarHBondContact O-N 2.98Å; N40-T42 PolarHBondContact OD1-N 3.45Å; N40-T42 PolarHBondContact OD1-OG1 3.23Å; N40-Y43 PolarHBondContact N-O 3.42Å; N40-Y43 WeakPolarHBondContact OD1-CA 3.46Å; N40-Y43 WeakPolarHBondContact OD1-CB 3.48Å; N40-Y43 PolarHBondContact OD1-N 3.01Å; N40-Y43 PolarHBondContact OD1-O 3.37Å; N40-W206 WeakPolarHBondContact O-CH2 3.27Å; N40-W206 WeakPolarHBondContact O-CZ2 3.35Å
41	D	92.1	Very high	85.4	Confident	142 Å²	142	47.8 Å²	47.8	76%	0.759	24%	0.241	S	C	*	.	S	Bend	trans	-70	-18.9	-174.6	-65.8	-26.8	0	0	0	115	R57	D41-R57 WeakPolarHBondContact O-CD 3.25Å
42	T	94.2	Very high	86.7	Confident	66 Å²	66	42.1 Å²	42.1	41%	0.405	22%	0.216	S	C	.	.	S	Bend	trans	-123.4	-12.3	-174.8	59.7	0	0	0	0	114	N40 Q56 R57	N40-T42 VanDerWaalsContact C-N 3.27Å; N40-T42 PolarHBondContact O-N 2.98Å; N40-T42 PolarHBondContact OD1-N 3.45Å; N40-T42 PolarHBondContact OD1-OG1 3.23Å; T42-Q56 CarbonylContact O-C 3.56Å; T42-Q56 WeakPolarHBondContact O-CA 3.18Å; T42-R57 PolarHBondContact O-N 2.9Å
43	Y	94	Very high	88.1	Confident	23 Å²	23	39.3 Å²	39.3	9%	0.09	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.4	-174	-169.1	-104.1	0	0	0	111.9	I38 E39 N40 R54 I55 Q56 D265	I38-Y43 HydrophobicContact CG2-CD1 3.86Å; I38-Y43 HydrophobicContact CG2-CE1 3.63Å; E39-Y43 CarbonylContact C-O 3.6Å; E39-Y43 WeakPolarHBondContact CA-O 3.23Å; N40-Y43 PolarHBondContact N-O 3.42Å; N40-Y43 WeakPolarHBondContact OD1-CA 3.46Å; N40-Y43 WeakPolarHBondContact OD1-CB 3.48Å; N40-Y43 PolarHBondContact OD1-N 3.01Å; N40-Y43 PolarHBondContact OD1-O 3.37Å; Y43-R54 HydrophobicContact CE2-CG 3.72Å; Y43-R54 WeakPolarHBondContact OH-CD 3.23Å; Y43-I55 VanDerWaalsContact CA-O 3.32Å; Y43-I55 WeakPolarHBondContact CA-O 3.34Å; Y43-I55 WeakPolarHBondContact CD2-O 3.35Å; Y43-Q56 HydrophobicContact CD2-CG 3.76Å; Y43-Q56 HydrophobicContact CE2-CG 3.78Å; Y43-D265 WeakPolarHBondContact CE1-OD1 3.23Å; Y43-D265 PolarHBondContact OH-OD2 3.4Å
44	R	94.2	Very high	89.2	Confident	16 Å²	16	38.5 Å²	38.5	6%	0.06	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.1	167.6	175.7	177.1	172.9	151	-12.9	110.2	E34 I38 E39 R54 I55 P203 W206	E34-R44 VanDerWaalsContact CD-NH2 3.3Å; E34-R44 IonicContact OE1-CZ 2.89Å; E34-R44 IonicContact OE1-NE 3.45Å; E34-R44 IonicContact OE1-NH2 3.85Å; E34-R44 PolarHBondContact OE1-NH2 2.96Å; E34-R44 IonicContact OE2-NH2 3.56Å; E34-R44 PolarHBondContact OE2-NH2 2.84Å; I38-R44 CarbonylContact O-C 3.59Å; I38-R44 WeakPolarHBondContact O-CA 3.46Å; E39-R44 HydrophobicContact CB-CB 4.49Å; E39-R44 HydrophobicContact CB-CG 4.3Å; E39-R44 HydrophobicContact CG-CB 4.24Å; E39-R44 HydrophobicContact CG-CG 4.24Å; E39-R44 IonicContact OE1-NH1 3.82Å; E39-R44 PolarHBondContact OE1-NH1 3.32Å; E39-R44 IonicContact OE2-CZ 3.27Å; E39-R44 IonicContact OE2-NE 3.84Å; E39-R44 IonicContact OE2-NH1 3.3Å; E39-R44 PolarHBondContact OE2-NH1 2.86Å; R44-R54 CarbonylContact O-C 3.55Å; R44-R54 WeakPolarHBondContact O-CA 3.27Å; R44-I55 HydrophobicContact CB-CB 4.18Å; R44-I55 HydrophobicContact CB-CD1 4.47Å; R44-I55 HydrophobicContact CB-CG1 4.44Å; R44-I55 PolarHBondContact N-O 3.42Å; R44-I55 PolarHBondContact O-N 2.65Å; R44-P203 VanDerWaalsContact CZ-CG 3.44Å; R44-W206 HydrophobicContact CB-CH2 4.06Å; R44-W206 HydrophobicContact CB-CZ2 3.62Å
45	Y	92.3	Very high	89.8	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129	171.4	-173.4	-111.9	0	0	0	109.7	I37 I38 L47 S52 M53 R54 I251	I37-Y45 HydrophobicContact CB-CD1 3.82Å; I37-Y45 HydrophobicContact CG1-CD1 3.86Å; I37-Y45 HydrophobicContact CG1-CE1 4.2Å; I37-Y45 HydrophobicContact CG2-CD1 4.13Å; I37-Y45 PolarHBondContact N-O 3.49Å; I38-Y45 PolarHBondContact N-O 3.3Å; I38-Y45 PolarHBondContact O-N 2.74Å; Y45-L47 HydrophobicContact CE1-CD2 4.1Å; Y45-S52 WeakPolarHBondContact OH-CB 3.28Å; Y45-S52 PolarHBondContact OH-OG 2.97Å; Y45-M53 WeakPolarHBondContact CA-O 3.45Å; Y45-R54 HydrophobicContact CD2-CB 4.06Å; Y45-I251 HydrophobicContact CE1-CD1 4.16Å; Y45-I251 WeakPolarHBondContact OH-CD1 3.36Å
46	S	90.6	Very high	90.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	149.7	-177.2	52.8	0	0	0	0	111.4	I35 H48 S52 M53	I35-S46 CarbonylContact O-C 3.57Å; I35-S46 VanDerWaalsContact O-CA 3.23Å; I35-S46 WeakPolarHBondContact O-CA 3.49Å; S46-H48 PolarHBondContact OG-NE2 2.89Å; S46-S52 CarbonylContact O-C 3.55Å; S46-S52 WeakPolarHBondContact O-CA 3.4Å; S46-M53 PolarHBondContact N-O 3.46Å; S46-M53 PolarHBondContact O-N 3Å; S46-M53 WeakPolarHBondContact OG-CE 3.37Å; S46-M53 PolarHBondContact OG-O 3.45Å
47	L	87.3	Confident	90.8	Very high	19 Å²	19	35.3 Å²	35.3	10%	0.099	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.3	175.2	-59.6	175.3	0	0	0	109.4	I35 I37 Y45 V218 A249 I251	I35-L47 HydrophobicContact CB-CB 4.4Å; I35-L47 PolarHBondContact N-O 2.94Å; I35-L47 PolarHBondContact O-N 3.34Å; I37-L47 HydrophobicContact CD1-CD1 3.99Å; I37-L47 HydrophobicContact CD1-CG 4.35Å; I37-L47 HydrophobicContact CG1-CD1 4.26Å; I37-L47 HydrophobicContact CG1-CG 4.12Å; Y45-L47 HydrophobicContact CE1-CD2 4.1Å; L47-V218 HydrophobicContact CD2-CG2 4.1Å; L47-A249 HydrophobicContact CD1-CB 4.1Å; L47-I251 HydrophobicContact CD1-CG2 3.74Å; L47-I251 HydrophobicContact CD2-CG2 4.2Å
48	H	86.7	Confident	91.4	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.028	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	102.2	-175	-66.3	-98	0	0	0	108.5	E34 S46 K50 Y51 M53 I200	E34-H48 WeakPolarHBondContact CG-CE1 3.15Å; E34-H48 IonicContact OE1-CE1 2.65Å; E34-H48 PolarHBondContact OE1-CE1 3.46Å; E34-H48 VanDerWaalsContact OE1-CE1 3.3Å; E34-H48 IonicContact OE1-NE2 3.7Å; E34-H48 PolarHBondContact OE1-NE2 3.36Å; S46-H48 PolarHBondContact OG-NE2 2.89Å; H48-K50 PolarHBondContact O-N 3.47Å; H48-Y51 CarbonylContact C-O 3.56Å; H48-Y51 PolarHBondContact N-O 3.27Å; H48-Y51 PolarHBondContact O-N 3.34Å; H48-Y51 VanDerWaalsContact O-O 3.13Å; H48-M53 WeakPolarHBondContact NE2-CE 3.5Å; H48-I200 HydrophobicContact CB-CD1 3.63Å; H48-I200 HydrophobicContact CB-CG1 3.83Å; H48-I200 HydrophobicContact CB-CG2 4.16Å
49	Y	77.6	Confident	91.9	Very high	51 Å²	51	42.8 Å²	42.8	20%	0.2	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	-99.2	-177.8	-177.1	-111.9	0	0	0	113.2	Y29 I189 H198	Y29-Y49 HydrophobicContact CD1-CD2 4.43Å; Y29-Y49 HydrophobicContact CG-CD2 4.36Å; Y29-Y49 HydrophobicContact CG-CE2 4.33Å; Y49-I189 HydrophobicContact CD1-CG2 3.91Å; Y49-I189 HydrophobicContact CD2-CD1 4.49Å; Y49-I189 HydrophobicContact CE1-CB 4.11Å; Y49-I189 HydrophobicContact CE1-CD1 4.44Å; Y49-I189 HydrophobicContact CE1-CG2 3.5Å; Y49-I189 VanDerWaalsContact CE1-CG2 3.5Å; Y49-I189 HydrophobicContact CE2-CD1 4.31Å; Y49-H198 VanDerWaalsContact CB-NE2 3.25Å; Y49-H198 WeakPolarHBondContact CB-NE2 3.03Å
50	K	79.4	Confident	92.1	Very high	74 Å²	74	43.9 Å²	43.9	32%	0.322	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	13.5	179.1	-72.9	-173.2	-173.4	-157.3	0	113.8	H48 A217 V218 E220	H48-K50 PolarHBondContact O-N 3.47Å; K50-A217 CarbonylContact O-C 3.57Å; K50-A217 VanDerWaalsContact O-CA 3.3Å; K50-A217 WeakPolarHBondContact O-CA 3.12Å; K50-V218 PolarHBondContact O-N 2.86Å; K50-E220 WeakPolarHBondContact CE-OE1 3.32Å; K50-E220 IonicContact NZ-OE1 2.62Å; K50-E220 PolarHBondContact NZ-OE1 2.87Å
51	Y	89.7	Confident	92.2	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.02	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	146.5	-178.6	-79	-87.5	0	0	0	110	H48 Y87 I185 I200 F215 E216 A217	H48-Y51 CarbonylContact C-O 3.56Å; H48-Y51 PolarHBondContact N-O 3.27Å; H48-Y51 PolarHBondContact O-N 3.34Å; H48-Y51 VanDerWaalsContact O-O 3.13Å; Y51-Y87 HydrophobicContact CD2-CE1 4.48Å; Y51-Y87 HydrophobicContact CE2-CD1 4.11Å; Y51-Y87 AromaticContact CE2-CD2 3.84Å; Y51-Y87 HydrophobicContact CE2-CD2 3.84Å; Y51-Y87 HydrophobicContact CE2-CE1 4.08Å; Y51-Y87 AromaticContact CE2-CE2 3.84Å; Y51-Y87 HydrophobicContact CE2-CE2 3.84Å; Y51-Y87 HydrophobicContact CE2-CG 4.01Å; Y51-Y87 AromaticContact CE2-CZ 3.97Å; Y51-Y87 PolarHBondContact OH-N 3.41Å; Y51-I185 HydrophobicContact CD1-CD1 4.11Å; Y51-I185 HydrophobicContact CE1-CD1 4.2Å; Y51-I185 HydrophobicContact CG-CD1 4.29Å; Y51-I200 HydrophobicContact CD2-CD1 3.91Å; Y51-I200 HydrophobicContact CG-CD1 3.88Å; Y51-F215 HydrophobicContact CD1-CB 4.16Å; Y51-E216 CarbonylContact C-O 3.56Å; Y51-E216 WeakPolarHBondContact CA-O 3.21Å; Y51-A217 HydrophobicContact CE1-CB 4.43Å
52	S	91.5	Very high	92.3	Very high	4 Å²	4	39.2 Å²	39.2	3%	0.028	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.6	161.3	65.7	0	0	0	0	108.2	Y45 S46 F215 E216	Y45-S52 WeakPolarHBondContact OH-CB 3.28Å; Y45-S52 PolarHBondContact OH-OG 2.97Å; S46-S52 CarbonylContact O-C 3.55Å; S46-S52 WeakPolarHBondContact O-CA 3.4Å; S52-F215 VanDerWaalsContact O-CA 3.31Å; S52-F215 WeakPolarHBondContact O-CA 3.42Å; S52-E216 PolarHBondContact N-O 2.89Å; S52-E216 PolarHBondContact O-N 2.86Å; S52-E216 PolarHBondContact OG-O 2.87Å
53	M	95.1	Very high	92.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.7	173.4	177	177.9	58.1	0	0	108.3	Y45 S46 H48 I55 V202 V213 E214 F215	Y45-M53 WeakPolarHBondContact CA-O 3.45Å; S46-M53 PolarHBondContact N-O 3.46Å; S46-M53 PolarHBondContact O-N 3Å; S46-M53 WeakPolarHBondContact OG-CE 3.37Å; S46-M53 PolarHBondContact OG-O 3.45Å; H48-M53 WeakPolarHBondContact NE2-CE 3.5Å; M53-I55 HydrophobicContact CE-CD1 4.24Å; M53-I55 HydrophobicContact CG-CD1 4.46Å; M53-I55 HydrophobicContact CG-CG1 4.08Å; M53-I55 HydrophobicContact SD-CD1 4.1Å; M53-I55 HydrophobicContact SD-CG1 4.35Å; M53-V202 HydrophobicContact SD-CG2 4.3Å; M53-V213 HydrophobicContact CG-CG1 3.81Å; M53-V213 HydrophobicContact SD-CG1 4.04Å; M53-E214 CarbonylContact C-O 3.54Å; M53-E214 WeakPolarHBondContact CA-O 3.18Å; M53-F215 HydrophobicContact CB-CD1 4.04Å; M53-F215 HydrophobicContact CB-CE1 4.05Å; M53-F215 HydrophobicContact CG-CD1 4.16Å; M53-F215 HydrophobicContact CG-CE1 3.79Å; M53-F215 HydrophobicContact CG-CZ 4.37Å; M53-F215 HydrophobicContact SD-CE1 3.65Å; M53-F215 HydrophobicContact SD-CZ 4.03Å
54	R	95.9	Very high	92.5	Very high	45 Å²	45	38.4 Å²	38.4	17%	0.17	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.8	172.9	-179.5	171.6	70.9	-178.9	5.7	109.3	Y43 R44 Y45 Q56 V213 E214	Y43-R54 HydrophobicContact CE2-CG 3.72Å; Y43-R54 WeakPolarHBondContact OH-CD 3.23Å; R44-R54 CarbonylContact O-C 3.55Å; R44-R54 WeakPolarHBondContact O-CA 3.27Å; Y45-R54 HydrophobicContact CD2-CB 4.06Å; R54-Q56 HydrophobicContact CG-CG 4.19Å; R54-Q56 VanDerWaalsContact NE-OE1 3.13Å; R54-V213 CarbonylContact O-C 3.57Å; R54-V213 VanDerWaalsContact O-CA 3.32Å; R54-V213 WeakPolarHBondContact O-CA 3.07Å; R54-E214 IonicContact CZ-OE2 2.82Å; R54-E214 PolarHBondContact N-O 2.84Å; R54-E214 IonicContact NE-OE2 3.2Å; R54-E214 PolarHBondContact NE-OE2 3.05Å; R54-E214 IonicContact NH2-OE1 2.9Å; R54-E214 IonicContact NH2-OE2 3.54Å; R54-E214 PolarHBondContact NH2-OE2 2.83Å; R54-E214 PolarHBondContact O-N 3.03Å
55	I	97.9	Very high	92.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.9	177.1	-48.9	-175	0	0	0	108.7	Y43 R44 M53 V202 W206 T211 L212 V213	Y43-I55 VanDerWaalsContact CA-O 3.32Å; Y43-I55 WeakPolarHBondContact CA-O 3.34Å; Y43-I55 WeakPolarHBondContact CD2-O 3.35Å; R44-I55 HydrophobicContact CB-CB 4.18Å; R44-I55 HydrophobicContact CB-CD1 4.47Å; R44-I55 HydrophobicContact CB-CG1 4.44Å; R44-I55 PolarHBondContact N-O 3.42Å; R44-I55 PolarHBondContact O-N 2.65Å; M53-I55 HydrophobicContact CE-CD1 4.24Å; M53-I55 HydrophobicContact CG-CD1 4.46Å; M53-I55 HydrophobicContact CG-CG1 4.08Å; M53-I55 HydrophobicContact SD-CD1 4.1Å; M53-I55 HydrophobicContact SD-CG1 4.35Å; I55-V202 HydrophobicContact CD1-CG1 4.32Å; I55-W206 HydrophobicContact CB-CD2 4.37Å; I55-W206 HydrophobicContact CB-CE3 4.17Å; I55-W206 HydrophobicContact CD1-CB 4.01Å; I55-W206 HydrophobicContact CD1-CD2 4.21Å; I55-W206 HydrophobicContact CD1-CG 3.8Å; I55-W206 HydrophobicContact CG2-CB 4.03Å; I55-W206 HydrophobicContact CG2-CD2 3.73Å; I55-W206 HydrophobicContact CG2-CE3 3.31Å; I55-W206 HydrophobicContact CG2-CG 4.04Å; I55-W206 HydrophobicContact CG2-CZ3 3.98Å; I55-T211 HydrophobicContact CG2-CG2 3.43Å; I55-T211 VanDerWaalsContact CG2-CG2 3.43Å; I55-L212 CarbonylContact C-O 3.49Å; I55-L212 WeakPolarHBondContact CA-O 3.5Å; I55-V213 HydrophobicContact CD1-CG2 4.42Å; I55-V213 HydrophobicContact CG1-CG1 4.19Å; I55-V213 HydrophobicContact CG1-CG2 4.11Å; I55-V213 HydrophobicContact CG2-CG2 4.06Å
56	Q	97.6	Very high	92.6	Very high	37 Å²	37	48.9 Å²	48.9	17%	0.173	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	129	179.2	-63.3	-178.2	-109.6	0	0	110	T42 Y43 R54 Q59 T211 L212	T42-Q56 CarbonylContact O-C 3.56Å; T42-Q56 WeakPolarHBondContact O-CA 3.18Å; Y43-Q56 HydrophobicContact CD2-CG 3.76Å; Y43-Q56 HydrophobicContact CE2-CG 3.78Å; R54-Q56 HydrophobicContact CG-CG 4.19Å; R54-Q56 VanDerWaalsContact NE-OE1 3.13Å; Q56-Q59 HydrophobicContact CB-CG 3.65Å; Q56-Q59 WeakPolarHBondContact O-CG 3.14Å; Q56-T211 CarbonylContact O-C 3.41Å; Q56-T211 WeakPolarHBondContact O-CA 3.47Å; Q56-L212 PolarHBondContact N-O 3.43Å; Q56-L212 PolarHBondContact O-N 2.9Å
57	R	96.6	Very high	92.9	Very high	81 Å²	81	49.9 Å²	49.9	31%	0.306	26%	0.257	S	S	.	.	S	Bend	trans	-89.6	167.8	171.2	-69.1	-172	73.2	-158.9	-4.7	111.9	D41 T42 Q59 W206 G210	D41-R57 WeakPolarHBondContact O-CD 3.25Å; T42-R57 PolarHBondContact O-N 2.9Å; R57-Q59 PolarHBondContact O-N 3.45Å; R57-Q59 PolarHBondContact O-NE2 2.85Å; R57-W206 HydrophobicContact CG-CE3 3.96Å; R57-W206 HydrophobicContact CG-CZ3 3.75Å; R57-G210 CarbonylContact C-O 3.57Å
58	N	95.8	Very high	93.4	Very high	123 Å²	123	49.2 Å²	49.2	66%	0.658	25%	0.253	S	S	*	.	S	Bend	trans	57.1	33.5	178	-50	-35.3	0	0	0	112.3	G210	N58-G210 PolarHBondContact N-O 2.93Å
59	Q	97.4	Very high	93.8	Very high	65 Å²	65	55.4 Å²	55.4	30%	0.304	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-88.5	143.5	175.5	-58.7	-53.3	-62.5	0	0	109.3	Q56 R57 Y168 G210 L212	Q56-Q59 HydrophobicContact CB-CG 3.65Å; Q56-Q59 WeakPolarHBondContact O-CG 3.14Å; R57-Q59 PolarHBondContact O-N 3.45Å; R57-Q59 PolarHBondContact O-NE2 2.85Å; Q59-Y168 HydrophobicContact CB-CE2 4.4Å; Q59-Y168 WeakPolarHBondContact O-CE2 3.44Å; Q59-Y168 PolarHBondContact O-OH 2.78Å; Q59-G210 PolarHBondContact N-O 3.01Å; Q59-L212 HydrophobicContact CB-CB 3.97Å; Q59-L212 HydrophobicContact CG-CB 3.82Å
60	A	95.9	Very high	94.7	Very high	85 Å²	85	58.1 Å²	58.1	70%	0.702	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-72.5	160.3	169.3	0	0	0	0	0	110.2	Y168	A60-Y168 WeakPolarHBondContact O-CE2 3.39Å
61	Q	94.7	Very high	95.5	Very high	60 Å²	60	60.3 Å²	60.3	28%	0.28	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-58.5	125	174	-171.5	-178.5	-2.3	0	0	109.9	V63 S65 Y168	Q61-V63 VanDerWaalsContact C-N 3.29Å; Q61-V63 VanDerWaalsContact CG-O 3.24Å; Q61-V63 WeakPolarHBondContact CG-O 3.37Å; Q61-V63 PolarHBondContact NE2-O 3.46Å; Q61-V63 PolarHBondContact O-N 3.05Å; Q61-S65 PolarHBondContact NE2-OG 3.48Å; Q61-Y168 VanDerWaalsContact CA-CZ 3.48Å; Q61-Y168 HydrophobicContact CB-CD1 4.38Å; Q61-Y168 HydrophobicContact CB-CE1 3.7Å; Q61-Y168 HydrophobicContact CG-CD1 4.06Å; Q61-Y168 HydrophobicContact CG-CE1 3.79Å; Q61-Y168 PolarHBondContact N-OH 2.96Å
62	P	94.6	Very high	95.7	Very high	59 Å²	59	60.3 Å²	60.3	38%	0.383	30%	0.302	S	S	.	.	S	Bend	trans	-69.8	-26.7	-172.8	25.4	-34.5	0	0	0	113.2	L158 Y168	P62-L158 HydrophobicContact CB-CD1 4.05Å; P62-L158 HydrophobicContact CG-CD1 3.72Å; P62-Y168 VanDerWaalsContact CD-CG 3.47Å; P62-Y168 HydrophobicContact CG-CG 4.22Å
63	V	95.7	Very high	95.7	Very high	17 Å²	17	68.8 Å²	68.8	10%	0.103	34%	0.339	C	S	.	.	S	Bend	trans	-140.9	130.7	-179.3	-178.1	0	0	0	0	109	Q61 F68 L130 L135 L158	Q61-V63 VanDerWaalsContact C-N 3.29Å; Q61-V63 VanDerWaalsContact CG-O 3.24Å; Q61-V63 WeakPolarHBondContact CG-O 3.37Å; Q61-V63 PolarHBondContact NE2-O 3.46Å; Q61-V63 PolarHBondContact O-N 3.05Å; V63-F68 HydrophobicContact CB-CE2 4.22Å; V63-F68 HydrophobicContact CG1-CE2 4.07Å; V63-L130 HydrophobicContact CG1-CD1 3.98Å; V63-L135 HydrophobicContact CG2-CD2 3.58Å; V63-L158 HydrophobicContact CG2-CD1 3.75Å; V63-L158 HydrophobicContact CG2-CD2 4.21Å
64	P	95.4	Very high	95.5	Very high	56 Å²	56	74.9 Å²	74.9	36%	0.364	37%	0.367	S	S	.	.			trans	-57.6	142.9	177.9	-23.4	33.7	0	0	0	113.1	Y66 S67	P64-Y66 HydrophobicContact CB-CD1 3.57Å; P64-Y66 HydrophobicContact CB-CE1 3.18Å; P64-Y66 HydrophobicContact CB-CE2 4.37Å; P64-Y66 HydrophobicContact CB-CG 4.31Å; P64-Y66 HydrophobicContact CG-CE1 3.85Å; P64-Y66 PolarHBondContact O-N 3.19Å; P64-Y66 VanDerWaalsContact O-N 3.13Å; P64-S67 WeakPolarHBondContact O-CB 3.42Å; P64-S67 PolarHBondContact O-N 3.29Å; P64-S67 VanDerWaalsContact O-N 3.08Å; P64-S67 PolarHBondContact O-OG 2.86Å
65	S	94.6	Very high	95.4	Very high	52 Å²	52	76.2 Å²	76.2	36%	0.364	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-61.9	-24.7	-177	-59.6	0	0	0	0	114.4	Q61 S67 F68 Q139	Q61-S65 PolarHBondContact NE2-OG 3.48Å; S65-S67 PolarHBondContact O-N 2.8Å; S65-F68 PolarHBondContact O-N 3.41Å; S65-Q139 PolarHBondContact OG-NE2 3.27Å
66	Y	95	Very high	95.3	Very high	188 Å²	188	78.7 Å²	78.7	74%	0.737	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-70.3	-19.3	177.7	65.2	-101.9	0	0	0	113.5	P64 F68	P64-Y66 HydrophobicContact CB-CD1 3.57Å; P64-Y66 HydrophobicContact CB-CE1 3.18Å; P64-Y66 HydrophobicContact CB-CE2 4.37Å; P64-Y66 HydrophobicContact CB-CG 4.31Å; P64-Y66 HydrophobicContact CG-CE1 3.85Å; P64-Y66 PolarHBondContact O-N 3.19Å; P64-Y66 VanDerWaalsContact O-N 3.13Å; Y66-F68 PolarHBondContact O-N 3.18Å
67	S	96.9	Very high	95.1	Very high	21 Å²	21	78.8 Å²	78.8	15%	0.147	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-72	-16.3	177.3	-53	0	0	0	0	112.5	P64 S65 E69 L130	P64-S67 WeakPolarHBondContact O-CB 3.42Å; P64-S67 PolarHBondContact O-N 3.29Å; P64-S67 VanDerWaalsContact O-N 3.08Å; P64-S67 PolarHBondContact O-OG 2.86Å; S65-S67 PolarHBondContact O-N 2.8Å; S67-E69 PolarHBondContact O-N 3.34Å; S67-L130 WeakPolarHBondContact O-CD1 3.39Å
68	F	97.5	Very high	95.1	Very high	4 Å²	4	74.9 Å²	74.9	2%	0.018	38%	0.378	C	S	.	.			trans	-86	85.1	174.1	-62.9	-95.3	0	0	0	109.7	V63 S65 Y66 R128 V129 L130 Q139 T156 L158	V63-F68 HydrophobicContact CB-CE2 4.22Å; V63-F68 HydrophobicContact CG1-CE2 4.07Å; S65-F68 PolarHBondContact O-N 3.41Å; Y66-F68 PolarHBondContact O-N 3.18Å; F68-R128 HydrophobicContact CB-CB 3.73Å; F68-R128 WeakPolarHBondContact CD1-O 3.1Å; F68-R128 WeakPolarHBondContact O-CB 3.45Å; F68-R128 WeakPolarHBondContact O-CD 3.32Å; F68-V129 CarbonylContact C-O 3.58Å; F68-L130 HydrophobicContact CD1-CB 3.57Å; F68-L130 HydrophobicContact CE1-CB 3.7Å; F68-L130 HydrophobicContact CG-CB 4.09Å; F68-L130 HydrophobicContact CZ-CB 4.31Å; F68-Q139 HydrophobicContact CB-CB 4.36Å; F68-Q139 HydrophobicContact CD1-CB 3.63Å; F68-Q139 HydrophobicContact CD2-CB 3.97Å; F68-Q139 HydrophobicContact CE1-CB 3.82Å; F68-Q139 HydrophobicContact CE2-CB 4.14Å; F68-Q139 HydrophobicContact CG-CB 3.71Å; F68-Q139 HydrophobicContact CZ-CB 4.07Å; F68-T156 HydrophobicContact CE1-CG2 4.04Å; F68-T156 HydrophobicContact CE2-CG2 4.28Å; F68-T156 HydrophobicContact CZ-CG2 3.46Å; F68-T156 VanDerWaalsContact CZ-CG2 3.46Å; F68-L158 HydrophobicContact CE1-CD2 4.27Å; F68-L158 HydrophobicContact CZ-CD2 3.9Å
69	E	95.3	Very high	95	Very high	137 Å²	137	74.4 Å²	74.4	64%	0.64	37%	0.371	S	S	*	.			trans	-84.3	-36.4	-170.4	-62.7	-176.4	172.6	0	0	113.7	S67 K71 V129	S67-E69 PolarHBondContact O-N 3.34Å; E69-K71 PolarHBondContact O-N 3.12Å; E69-V129 PolarHBondContact N-O 3.39Å; E69-V129 VanDerWaalsContact N-O 3.14Å
70	Y	96.2	Very high	94.9	Very high	107 Å²	107	72.4 Å²	72.4	42%	0.42	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	109.8	-166.8	-57	-77.3	0	0	0	112.2	I72 Y76 R128 V129 D131	Y70-I72 PolarHBondContact O-N 3.26Å; Y70-Y76 HydrophobicContact CD1-CE2 4.33Å; Y70-Y76 HydrophobicContact CD2-CE2 4.36Å; Y70-Y76 AromaticContact CG-CE2 3.9Å; Y70-Y76 HydrophobicContact CG-CE2 3.9Å; Y70-R128 CarbonylContact O-C 3.52Å; Y70-R128 VanDerWaalsContact O-CA 3.22Å; Y70-R128 WeakPolarHBondContact O-CA 3.43Å; Y70-V129 PolarHBondContact N-O 2.83Å; Y70-V129 VanDerWaalsContact N-O 3.15Å; Y70-V129 PolarHBondContact O-N 2.82Å; Y70-D131 HydrophobicContact CD2-CB 4.39Å; Y70-D131 HydrophobicContact CE2-CB 4.22Å
71	K	95.4	Very high	94.8	Very high	120 Å²	120	76.2 Å²	76.2	52%	0.522	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	128.1	175.5	-177.9	173	-177.9	152.1	0	112.1	E69 E126	E69-K71 PolarHBondContact O-N 3.12Å; K71-E126 WeakPolarHBondContact CD-OE1 3.42Å; K71-E126 VanDerWaalsContact CE-OE1 3.24Å; K71-E126 WeakPolarHBondContact CE-OE1 3.48Å; K71-E126 IonicContact NZ-OE1 3.62Å; K71-E126 PolarHBondContact NZ-OE1 2.95Å
72	I	94.3	Very high	94.8	Very high	5 Å²	5	74.6 Å²	74.6	3%	0.026	35%	0.351	C	S	.	.			trans	-79.5	125.7	172	-51.7	-179.2	0	0	0	108.9	Y70 F96 E98 S127 V129 V138	Y70-I72 PolarHBondContact O-N 3.26Å; I72-F96 HydrophobicContact CD1-CB 3.5Å; I72-F96 VanDerWaalsContact CD1-CB 3.5Å; I72-E98 HydrophobicContact CG2-CB 4.37Å; I72-S127 PolarHBondContact N-O 3.23Å; I72-V129 HydrophobicContact CD1-CG2 3.61Å; I72-V129 HydrophobicContact CG1-CG2 3.66Å; I72-V138 HydrophobicContact CD1-CG2 3.79Å
73	K	91	Very high	94.7	Very high	183 Å²	183	75.8 Å²	75.8	80%	0.796	36%	0.361	S	S	*	.	S	Bend	trans	-102.1	-22.3	172.9	-70.1	-173.6	178.8	179.6	0	114.4	E98	K73-E98 VanDerWaalsContact O-OE2 3.11Å
74	H	90.8	Very high	94.5	Very high	127 Å²	127	75.1 Å²	75.1	59%	0.588	36%	0.357	S	S	*	.	S	Bend	trans	-157.9	-66.5	176.1	-176.8	-71.9	0	0	0	107.5	E98	H74-E98 PolarHBondContact O-N 2.93Å
75	I	94	Very high	94.4	Very high	74 Å²	74	74.5 Å²	74.5	38%	0.379	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	141.2	174.4	-70.1	157.6	0	0	0	109.1	H95 F96 N97	I75-H95 HydrophobicContact CG2-CB 3.86Å; I75-F96 WeakPolarHBondContact CA-O 2.9Å; I75-N97 WeakPolarHBondContact CG1-OD1 3.23Å
76	Y	95.7	Very high	94.3	Very high	52 Å²	52	72.3 Å²	72.3	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.8	161.7	-177.8	-79	0	0	0	108.7	Y70 H95 F96 V129 D131	Y70-Y76 HydrophobicContact CD1-CE2 4.33Å; Y70-Y76 HydrophobicContact CD2-CE2 4.36Å; Y70-Y76 AromaticContact CG-CE2 3.9Å; Y70-Y76 HydrophobicContact CG-CE2 3.9Å; Y76-H95 WeakPolarHBondContact O-CA 3.46Å; Y76-F96 HydrophobicContact CD1-CD2 4.06Å; Y76-F96 PolarHBondContact N-O 3.3Å; Y76-F96 PolarHBondContact O-N 3.48Å; Y76-V129 HydrophobicContact CD1-CB 4.26Å; Y76-V129 HydrophobicContact CD1-CG1 3.87Å; Y76-V129 HydrophobicContact CD1-CG2 4.03Å; Y76-V129 HydrophobicContact CE1-CB 4.42Å; Y76-V129 HydrophobicContact CE1-CG1 3.75Å; Y76-V129 HydrophobicContact CG-CB 4.38Å; Y76-V129 HydrophobicContact CG-CG1 4.48Å; Y76-V129 HydrophobicContact CG-CG2 3.97Å; Y76-D131 HydrophobicContact CE1-CB 4.49Å; Y76-D131 PolarHBondContact OH-OD2 3.22Å
77	A	95	Very high	94.1	Very high	38 Å²	38	64.4 Å²	64.4	31%	0.314	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	108.5	174.5	0	0	0	0	0	109.5	F79 E93	A77-F79 HydrophobicContact CB-CE2 4.01Å; A77-F79 HydrophobicContact CB-CZ 4.21Å; A77-E93 WeakPolarHBondContact CB-OE1 3.36Å
78	G	95	Very high	93.6	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	136.9	174.7	0	0	0	0	0	111.2	E93 I94	G78-E93 WeakPolarHBondContact O-CA 3.41Å; G78-I94 PolarHBondContact N-O 3.23Å; G78-I94 PolarHBondContact O-N 3.21Å
79	F	95.1	Very high	93.3	Very high	113 Å²	113	69.7 Å²	69.7	50%	0.496	35%	0.347	S	S	.	.			trans	-117.1	100.1	178.7	-61.4	-86.9	0	0	0	108.5	A77 R81 E92 E93	A77-F79 HydrophobicContact CB-CE2 4.01Å; A77-F79 HydrophobicContact CB-CZ 4.21Å; F79-R81 PolarHBondContact O-N 3.31Å; F79-R81 VanDerWaalsContact O-N 3.13Å; F79-E92 WeakPolarHBondContact CD1-O 3.36Å; F79-E93 HydrophobicContact CD1-CB 4.19Å; F79-E93 HydrophobicContact CD1-CG 4.38Å; F79-E93 HydrophobicContact CE1-CB 3.98Å; F79-E93 HydrophobicContact CE1-CG 3.87Å; F79-E93 HydrophobicContact CZ-CG 4.22Å
80	P	94.3	Very high	93.2	Very high	22 Å²	22	67.6 Å²	67.6	14%	0.143	34%	0.338	C	S	.	.			trans	-52.1	121.6	178.8	-25.5	33.6	0	0	0	111.3	F82 C84 V91 I94 L136	P80-F82 HydrophobicContact CB-CD2 4.25Å; P80-F82 HydrophobicContact CB-CE1 4.28Å; P80-F82 HydrophobicContact CB-CE2 4Å; P80-F82 HydrophobicContact CB-CZ 4.03Å; P80-F82 PolarHBondContact O-N 2.98Å; P80-C84 HydrophobicContact CB-CB 4.34Å; P80-V91 HydrophobicContact CG-CG1 4.22Å; P80-I94 HydrophobicContact CG-CD1 4.31Å; P80-L136 HydrophobicContact CG-CD2 3.86Å
81	R	94.5	Very high	93.1	Very high	165 Å²	165	62.7 Å²	62.7	62%	0.623	32%	0.318	S	S	*	.	S	Bend	trans	-86.6	17.6	178.2	-55.7	-180	-163.8	164.4	11.3	112.5	F79 D131	F79-R81 PolarHBondContact O-N 3.31Å; F79-R81 VanDerWaalsContact O-N 3.13Å; R81-D131 IonicContact NH2-OD1 2.68Å
82	F	94.7	Very high	93.1	Very high	26 Å²	26	60.8 Å²	60.8	11%	0.114	31%	0.311	C	S	.	.	S	Bend	trans	-139.7	157.7	-175.5	50.7	-96.5	0	0	0	109.3	P80 C84 K133 L136 I159 H160 P161	P80-F82 HydrophobicContact CB-CD2 4.25Å; P80-F82 HydrophobicContact CB-CE1 4.28Å; P80-F82 HydrophobicContact CB-CE2 4Å; P80-F82 HydrophobicContact CB-CZ 4.03Å; P80-F82 PolarHBondContact O-N 2.98Å; F82-C84 HydrophobicContact CD2-CB 4.1Å; F82-C84 HydrophobicContact CE2-CB 4Å; F82-C84 PolarHBondContact O-N 3.29Å; F82-K133 VanDerWaalsContact CD1-O 3.31Å; F82-K133 WeakPolarHBondContact CD1-O 3.34Å; F82-L136 HydrophobicContact CE1-CB 4.23Å; F82-L136 HydrophobicContact CZ-CB 4.02Å; F82-I159 HydrophobicContact CE2-CG2 4.22Å; F82-I159 HydrophobicContact CZ-CG2 4.35Å; F82-I159 WeakPolarHBondContact CZ-O 3.3Å; F82-H160 WeakPolarHBondContact CE2-O 3.15Å; F82-P161 HydrophobicContact CB-CG 4.49Å; F82-P161 HydrophobicContact CD2-CB 4.38Å; F82-P161 HydrophobicContact CD2-CG 4.37Å; F82-P161 HydrophobicContact CG-CG 4.37Å
83	S	92.5	Very high	93.1	Very high	84 Å²	84	62 Å²	62	59%	0.587	32%	0.317	S	S	*	.			trans	-66.7	119.9	176.6	-170.8	0	0	0	0	110.1	N162	S83-N162 PolarHBondContact O-N 3.45Å
84	C	92.1	Very high	93.3	Very high	4 Å²	4	53.3 Å²	53.3	3%	0.027	28%	0.279	C	S	.	.			trans	-132.7	138.7	179.9	-179.2	0	0	0	0	109.3	P80 F82 H90 V91	P80-C84 HydrophobicContact CB-CB 4.34Å; F82-C84 HydrophobicContact CD2-CB 4.1Å; F82-C84 HydrophobicContact CE2-CB 4Å; F82-C84 PolarHBondContact O-N 3.29Å; C84-H90 PolarHBondContact O-ND1 3.27Å; C84-H90 VanDerWaalsContact O-ND1 3.14Å; C84-V91 HydrophobicContact CB-CB 4.18Å; C84-V91 PolarHBondContact O-N 3.35Å
85	S	92.2	Very high	93.5	Very high	43 Å²	43	48.9 Å²	48.9	30%	0.301	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145.3	173.4	74.9	0	0	0	0	110.7	K89 G163	S85-K89 CarbonylContact C-O 3.47Å; S85-K89 WeakPolarHBondContact CA-O 3.46Å; S85-G163 WeakPolarHBondContact O-CA 3.42Å
86	Y	93.5	Very high	93.6	Very high	5 Å²	5	45.4 Å²	45.4	2%	0.02	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	122.9	178.4	-173.9	-102.1	0	0	0	108.6	G88 K89 V104 I112 T114 I115 L165 I185 Y186	Y86-G88 PolarHBondContact O-N 3.33Å; Y86-G88 VanDerWaalsContact O-N 3.17Å; Y86-K89 PolarHBondContact N-O 3.27Å; Y86-K89 PolarHBondContact O-N 3.15Å; Y86-V104 HydrophobicContact CD1-CB 4.22Å; Y86-V104 HydrophobicContact CD1-CG1 4.07Å; Y86-V104 HydrophobicContact CD1-CG2 4.4Å; Y86-V104 HydrophobicContact CE1-CG2 4.42Å; Y86-V104 HydrophobicContact CG-CG1 4.11Å; Y86-I112 HydrophobicContact CD1-CD1 4.24Å; Y86-I112 HydrophobicContact CD1-CG1 4.27Å; Y86-T114 PolarHBondContact OH-O 3.05Å; Y86-I115 HydrophobicContact CE2-CD1 4.27Å; Y86-I115 HydrophobicContact CE2-CG1 4Å; Y86-L165 HydrophobicContact CD2-CD1 3.98Å; Y86-L165 HydrophobicContact CE2-CD1 3.65Å; Y86-I185 HydrophobicContact CE2-CB 4.43Å; Y86-Y186 WeakPolarHBondContact CE1-O 3.1Å; Y86-Y186 VanDerWaalsContact OH-C 3.31Å; Y86-Y186 PolarHBondContact OH-N 3.24Å; Y86-Y186 PolarHBondContact OH-O 3.43Å
87	Y	90	Very high	93.5	Very high	23 Å²	23	43.7 Å²	43.7	9%	0.09	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	38.8	-172.6	-80.3	-99.4	0	0	0	113.4	Y51 K89 I185 I189 H198	Y51-Y87 HydrophobicContact CD2-CE1 4.48Å; Y51-Y87 HydrophobicContact CE2-CD1 4.11Å; Y51-Y87 AromaticContact CE2-CD2 3.84Å; Y51-Y87 HydrophobicContact CE2-CD2 3.84Å; Y51-Y87 HydrophobicContact CE2-CE1 4.08Å; Y51-Y87 AromaticContact CE2-CE2 3.84Å; Y51-Y87 HydrophobicContact CE2-CE2 3.84Å; Y51-Y87 HydrophobicContact CE2-CG 4.01Å; Y51-Y87 AromaticContact CE2-CZ 3.97Å; Y51-Y87 PolarHBondContact OH-N 3.41Å; Y87-K89 VanDerWaalsContact C-N 3.28Å; Y87-K89 PolarHBondContact O-N 3.3Å; Y87-I185 HydrophobicContact CE2-CD1 4.48Å; Y87-I185 PolarHBondContact OH-O 3.2Å; Y87-I189 HydrophobicContact CD1-CG2 3.67Å; Y87-I189 HydrophobicContact CE1-CG2 3.9Å; Y87-H198 HydrophobicContact CE1-CB 3.89Å; Y87-H198 AromaticContact CE1-CG 3.97Å; Y87-H198 AromaticContact CE1-ND1 3.54Å; Y87-H198 AromaticContact CZ-ND1 3.72Å; Y87-H198 PolarHBondContact OH-ND1 3.37Å; Y87-H198 PolarHBondContact OH-O 3.08Å
88	G	87.1	Confident	93	Very high	70 Å²	70	45.2 Å²	45.2	72%	0.722	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	9.4	179.4	0	0	0	0	0	115.1	Y86	Y86-G88 PolarHBondContact O-N 3.33Å; Y86-G88 VanDerWaalsContact O-N 3.17Å
89	K	90.4	Very high	92.2	Very high	65 Å²	65	50.8 Å²	50.8	28%	0.283	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.6	176.5	-60.6	177.5	-178	-178.2	0	110.4	S85 Y86 Y87 I112	S85-K89 CarbonylContact C-O 3.47Å; S85-K89 WeakPolarHBondContact CA-O 3.46Å; Y86-K89 PolarHBondContact N-O 3.27Å; Y86-K89 PolarHBondContact O-N 3.15Å; Y87-K89 VanDerWaalsContact C-N 3.28Å; Y87-K89 PolarHBondContact O-N 3.3Å; K89-I112 HydrophobicContact CB-CD1 3.83Å; K89-I112 HydrophobicContact CB-CG2 4.36Å; K89-I112 HydrophobicContact CD-CB 3.88Å; K89-I112 HydrophobicContact CD-CG2 3.41Å; K89-I112 VanDerWaalsContact CD-CG2 3.41Å
90	H	93.1	Very high	91.5	Very high	94 Å²	94	46.8 Å²	46.8	44%	0.435	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	135.6	176.5	-176.9	54.4	0	0	0	110.7	C84	C84-H90 PolarHBondContact O-ND1 3.27Å; C84-H90 VanDerWaalsContact O-ND1 3.14Å
91	V	94.7	Very high	90.9	Very high	3 Å²	3	46 Å²	46	2%	0.018	24%	0.244	C	C	.	.			trans	-96.4	119.8	176.6	-177.4	0	0	0	0	108.8	P80 C84 I94 V104 I112	P80-V91 HydrophobicContact CG-CG1 4.22Å; C84-V91 HydrophobicContact CB-CB 4.18Å; C84-V91 PolarHBondContact O-N 3.35Å; V91-I94 HydrophobicContact CG1-CD1 3.94Å; V91-I94 HydrophobicContact CG1-CG1 3.64Å; V91-V104 HydrophobicContact CB-CG1 4.35Å; V91-V104 HydrophobicContact CG1-CG1 3.75Å; V91-V104 HydrophobicContact CG2-CG1 3.69Å; V91-I112 HydrophobicContact CG2-CD1 4.26Å
92	E	94.3	Very high	90.6	Very high	80 Å²	80	38.1 Å²	38.1	37%	0.374	21%	0.214	S	C	.	.			trans	-99.1	-34.1	174.5	-70.4	-179.9	-161.5	0	0	111.5	F79 Y105 F107	F79-E92 WeakPolarHBondContact CD1-O 3.36Å; E92-Y105 PolarHBondContact N-O 3.25Å; E92-Y105 VanDerWaalsContact N-O 3.13Å; E92-F107 VanDerWaalsContact CD-CA 3.47Å; E92-F107 VanDerWaalsContact CD-N 3.31Å; E92-F107 WeakPolarHBondContact OE1-CA 3.27Å; E92-F107 WeakPolarHBondContact OE1-CB 3.25Å; E92-F107 PolarHBondContact OE1-N 2.9Å; E92-F107 VanDerWaalsContact OE2-CA 3.23Å; E92-F107 WeakPolarHBondContact OE2-CA 3.31Å; E92-F107 PolarHBondContact OE2-N 3.28Å
93	E	94.8	Very high	90.4	Very high	30 Å²	30	41 Å²	41	14%	0.14	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	143.7	-170.9	178.8	178.3	-153.2	0	0	110.9	A77 G78 F79 H95 Y105	A77-E93 WeakPolarHBondContact CB-OE1 3.36Å; G78-E93 WeakPolarHBondContact O-CA 3.41Å; F79-E93 HydrophobicContact CD1-CB 4.19Å; F79-E93 HydrophobicContact CD1-CG 4.38Å; F79-E93 HydrophobicContact CE1-CB 3.98Å; F79-E93 HydrophobicContact CE1-CG 3.87Å; F79-E93 HydrophobicContact CZ-CG 4.22Å; E93-H95 IonicContact OE1-CD2 2.75Å; E93-H95 PolarHBondContact OE1-CD2 2.88Å; E93-H95 IonicContact OE1-CE1 3.28Å; E93-H95 IonicContact OE1-NE2 2.88Å; E93-H95 PolarHBondContact OE1-NE2 2.03Å; E93-H95 IonicContact OE2-NE2 3.41Å; E93-Y105 PolarHBondContact N-O 2.88Å; E93-Y105 PolarHBondContact O-N 3.23Å
94	I	95.6	Very high	90.2	Very high	2 Å²	2	37 Å²	37	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.8	172.4	-58.6	173.1	0	0	0	109.1	G78 P80 V91 F96 N102 Y103 V104 L136 I159	G78-I94 PolarHBondContact N-O 3.23Å; G78-I94 PolarHBondContact O-N 3.21Å; P80-I94 HydrophobicContact CG-CD1 4.31Å; V91-I94 HydrophobicContact CG1-CD1 3.94Å; V91-I94 HydrophobicContact CG1-CG1 3.64Å; I94-F96 HydrophobicContact CB-CE2 4.24Å; I94-F96 HydrophobicContact CB-CZ 4.28Å; I94-F96 HydrophobicContact CG2-CD1 4.38Å; I94-F96 HydrophobicContact CG2-CD2 4.38Å; I94-F96 HydrophobicContact CG2-CE1 3.97Å; I94-F96 HydrophobicContact CG2-CE2 3.96Å; I94-F96 HydrophobicContact CG2-CZ 3.74Å; I94-N102 HydrophobicContact CG2-CB 4.41Å; I94-Y103 CarbonylContact C-O 3.46Å; I94-Y103 WeakPolarHBondContact CA-O 3.3Å; I94-V104 HydrophobicContact CG1-CG1 4.34Å; I94-L136 HydrophobicContact CD1-CD2 4.08Å; I94-I159 HydrophobicContact CD1-CD1 3.5Å; I94-I159 VanDerWaalsContact CD1-CD1 3.5Å; I94-I159 HydrophobicContact CD1-CG1 4.11Å; I94-I159 HydrophobicContact CD1-CG2 4.44Å
95	H	95.7	Very high	89.9	Confident	34 Å²	34	38.6 Å²	38.6	16%	0.157	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	111.1	173.3	-69.1	-176.1	0	0	0	109.9	I75 Y76 E93 N97 N102 Y103 Y105	I75-H95 HydrophobicContact CG2-CB 3.86Å; Y76-H95 WeakPolarHBondContact O-CA 3.46Å; E93-H95 IonicContact OE1-CD2 2.75Å; E93-H95 PolarHBondContact OE1-CD2 2.88Å; E93-H95 IonicContact OE1-CE1 3.28Å; E93-H95 IonicContact OE1-NE2 2.88Å; E93-H95 PolarHBondContact OE1-NE2 2.03Å; E93-H95 IonicContact OE2-NE2 3.41Å; H95-N97 PolarHBondContact O-N 3.42Å; H95-N97 PolarHBondContact O-ND2 3.26Å; H95-N102 CarbonylContact O-C 3.57Å; H95-N102 VanDerWaalsContact O-CA 3.3Å; H95-N102 WeakPolarHBondContact O-CA 3.02Å; H95-Y103 PolarHBondContact N-O 3.14Å; H95-Y103 PolarHBondContact O-N 3.1Å; H95-Y105 HydrophobicContact CB-CE2 3.87Å; H95-Y105 AromaticContact CD2-CE2 3.87Å; H95-Y105 AromaticContact CE1-CE2 3.79Å; H95-Y105 AromaticContact CG-CE2 3.47Å; H95-Y105 VanDerWaalsContact CG-CE2 3.47Å; H95-Y105 AromaticContact ND1-CE2 3.45Å; H95-Y105 WeakPolarHBondContact ND1-CE2 3.37Å; H95-Y105 AromaticContact ND1-CZ 3.91Å
96	F	95.8	Very high	89.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	109.5	170.5	-58.1	-82.1	0	0	0	108.8	I72 I75 Y76 I94 N102 V129 L136 V138 I159	I72-F96 HydrophobicContact CD1-CB 3.5Å; I72-F96 VanDerWaalsContact CD1-CB 3.5Å; I75-F96 WeakPolarHBondContact CA-O 2.9Å; Y76-F96 HydrophobicContact CD1-CD2 4.06Å; Y76-F96 PolarHBondContact N-O 3.3Å; Y76-F96 PolarHBondContact O-N 3.48Å; I94-F96 HydrophobicContact CB-CE2 4.24Å; I94-F96 HydrophobicContact CB-CZ 4.28Å; I94-F96 HydrophobicContact CG2-CD1 4.38Å; I94-F96 HydrophobicContact CG2-CD2 4.38Å; I94-F96 HydrophobicContact CG2-CE1 3.97Å; I94-F96 HydrophobicContact CG2-CE2 3.96Å; I94-F96 HydrophobicContact CG2-CZ 3.74Å; F96-N102 HydrophobicContact CD1-CB 4.34Å; F96-N102 WeakPolarHBondContact CD1-OD1 3.22Å; F96-V129 HydrophobicContact CB-CG2 4.13Å; F96-V129 HydrophobicContact CD2-CG1 4.31Å; F96-V129 HydrophobicContact CD2-CG2 4.07Å; F96-V129 HydrophobicContact CE2-CG1 4.28Å; F96-V129 HydrophobicContact CG-CG2 4.1Å; F96-L136 HydrophobicContact CE2-CD1 4.06Å; F96-L136 HydrophobicContact CE2-CD2 4Å; F96-L136 HydrophobicContact CE2-CG 3.95Å; F96-L136 HydrophobicContact CZ-CD1 4.36Å; F96-L136 HydrophobicContact CZ-CD2 3.99Å; F96-L136 HydrophobicContact CZ-CG 3.8Å; F96-V138 HydrophobicContact CD1-CB 3.58Å; F96-V138 HydrophobicContact CD1-CG1 3.54Å; F96-V138 HydrophobicContact CD1-CG2 4.4Å; F96-V138 HydrophobicContact CE1-CB 3.99Å; F96-V138 HydrophobicContact CE1-CG1 3.86Å; F96-V138 HydrophobicContact CG-CB 4.3Å; F96-I159 HydrophobicContact CE1-CD1 4.05Å; F96-I159 HydrophobicContact CZ-CD1 3.82Å
97	N	92.5	Very high	89.1	Confident	17 Å²	17	44.8 Å²	44.8	9%	0.091	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	151.6	176.4	-62.3	-94.4	0	0	0	111.3	I75 H95 N99 A101 Y103 R140	I75-N97 WeakPolarHBondContact CG1-OD1 3.23Å; H95-N97 PolarHBondContact O-N 3.42Å; H95-N97 PolarHBondContact O-ND2 3.26Å; N97-N99 VanDerWaalsContact C-N 3.28Å; N97-A101 VanDerWaalsContact CB-O 3.24Å; N97-A101 WeakPolarHBondContact CB-O 2.9Å; N97-A101 PolarHBondContact N-O 3.15Å; N97-A101 PolarHBondContact ND2-O 3.32Å; N97-Y103 WeakPolarHBondContact ND2-CD2 3.47Å; N97-Y103 WeakPolarHBondContact ND2-CE2 3.47Å; N97-R140 PolarHBondContact O-NH2 3.4Å
98	E	85.7	Confident	88.6	Confident	69 Å²	69	51.4 Å²	51.4	32%	0.322	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-40.3	165.2	-172.2	173.7	-160.8	0	0	111.1	I72 K73 H74 H100	I72-E98 HydrophobicContact CG2-CB 4.37Å; K73-E98 VanDerWaalsContact O-OE2 3.11Å; H74-E98 PolarHBondContact O-N 2.93Å; E98-H100 PolarHBondContact O-N 3.33Å
99	N	77.8	Confident	88.3	Confident	117 Å²	117	51.5 Å²	51.5	63%	0.626	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	33	-177	-57.2	-14.4	0	0	0	114.5	N97 A101	N97-N99 VanDerWaalsContact C-N 3.28Å; N99-A101 VanDerWaalsContact C-N 3.34Å; N99-A101 PolarHBondContact O-N 3.24Å; N99-A101 VanDerWaalsContact O-N 3.14Å
100	H	79.7	Confident	88.2	Confident	30 Å²	30	53 Å²	53	14%	0.139	26%	0.258	C	S	.	.	S	Bend	trans	82.7	-35.2	170	-41.7	138.5	0	0	0	117.9	E98 Y118 Y122 R140	E98-H100 PolarHBondContact O-N 3.33Å; H100-Y118 HydrophobicContact CB-CD1 3.87Å; H100-Y118 HydrophobicContact CB-CD2 3.62Å; H100-Y118 HydrophobicContact CB-CE1 4.49Å; H100-Y118 HydrophobicContact CB-CE2 4.24Å; H100-Y118 HydrophobicContact CB-CG 3.41Å; H100-Y118 VanDerWaalsContact CB-CG 3.41Å; H100-Y118 AromaticContact CE1-CD2 3.88Å; H100-Y118 AromaticContact CG-CD2 3.3Å; H100-Y118 AromaticContact CG-CE2 3.99Å; H100-Y118 AromaticContact CG-CG 3.58Å; H100-Y118 AromaticContact ND1-CD2 3.13Å; H100-Y118 WeakPolarHBondContact ND1-CD2 3.06Å; H100-Y118 AromaticContact ND1-CE2 3.44Å; H100-Y118 WeakPolarHBondContact ND1-CE2 3.36Å; H100-Y118 AromaticContact ND1-CG 3.91Å; H100-Y122 AromaticContact CE1-CE1 3.58Å; H100-Y122 AromaticContact NE2-CE1 3.08Å; H100-Y122 WeakPolarHBondContact NE2-CE1 3.45Å; H100-Y122 AromaticContact NE2-CZ 3.29Å; H100-Y122 VanDerWaalsContact NE2-CZ 3.29Å; H100-Y122 PolarHBondContact NE2-OH 3.41Å; H100-R140 PolarHBondContact O-NH1 3.34Å; H100-R140 PolarHBondContact O-NH2 2.76Å
101	A	82.5	Confident	88.1	Confident	5 Å²	5	50.9 Å²	50.9	4%	0.041	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.1	-177.5	0	0	0	0	0	111.7	N97 N99 Y103 T114 F116	N97-A101 VanDerWaalsContact CB-O 3.24Å; N97-A101 WeakPolarHBondContact CB-O 2.9Å; N97-A101 PolarHBondContact N-O 3.15Å; N97-A101 PolarHBondContact ND2-O 3.32Å; N99-A101 VanDerWaalsContact C-N 3.34Å; N99-A101 PolarHBondContact O-N 3.24Å; N99-A101 VanDerWaalsContact O-N 3.14Å; A101-Y103 HydrophobicContact CB-CE1 4.08Å; A101-Y103 HydrophobicContact CB-CE2 4.13Å; A101-T114 HydrophobicContact CB-CG2 3.91Å; A101-F116 HydrophobicContact CB-CD1 4.23Å; A101-F116 HydrophobicContact CB-CE1 3.76Å
102	N	88.9	Confident	88	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	108.5	165.1	-60	-30.1	0	0	0	108	I94 H95 F96 T114 I115 R140	I94-N102 HydrophobicContact CG2-CB 4.41Å; H95-N102 CarbonylContact O-C 3.57Å; H95-N102 VanDerWaalsContact O-CA 3.3Å; H95-N102 WeakPolarHBondContact O-CA 3.02Å; F96-N102 HydrophobicContact CD1-CB 4.34Å; F96-N102 WeakPolarHBondContact CD1-OD1 3.22Å; N102-T114 WeakPolarHBondContact O-CA 3.41Å; N102-I115 HydrophobicContact CB-CB 4.08Å; N102-I115 PolarHBondContact N-O 3.03Å; N102-I115 PolarHBondContact O-N 3.39Å; N102-R140 PolarHBondContact OD1-NH2 3.29Å
103	Y	89.9	Confident	88	Confident	85 Å²	85	47 Å²	47	33%	0.333	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.9	179.1	-61.5	-65.5	0	0	0	109.9	I94 H95 N97 A101 Y105 T114	I94-Y103 CarbonylContact C-O 3.46Å; I94-Y103 WeakPolarHBondContact CA-O 3.3Å; H95-Y103 PolarHBondContact N-O 3.14Å; H95-Y103 PolarHBondContact O-N 3.1Å; N97-Y103 WeakPolarHBondContact ND2-CD2 3.47Å; N97-Y103 WeakPolarHBondContact ND2-CE2 3.47Å; A101-Y103 HydrophobicContact CB-CE1 4.08Å; A101-Y103 HydrophobicContact CB-CE2 4.13Å; Y103-Y105 WeakPolarHBondContact CB-OH 3.4Å; Y103-T114 HydrophobicContact CD1-CG2 3.92Å; Y103-T114 HydrophobicContact CE1-CG2 4.03Å
104	V	87.7	Confident	88	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.9	-178.8	-172.4	0	0	0	0	108.5	Y86 V91 I94 I112 G113 I115	Y86-V104 HydrophobicContact CD1-CB 4.22Å; Y86-V104 HydrophobicContact CD1-CG1 4.07Å; Y86-V104 HydrophobicContact CD1-CG2 4.4Å; Y86-V104 HydrophobicContact CE1-CG2 4.42Å; Y86-V104 HydrophobicContact CG-CG1 4.11Å; V91-V104 HydrophobicContact CB-CG1 4.35Å; V91-V104 HydrophobicContact CG1-CG1 3.75Å; V91-V104 HydrophobicContact CG2-CG1 3.69Å; I94-V104 HydrophobicContact CG1-CG1 4.34Å; V104-I112 HydrophobicContact CB-CG1 4.16Å; V104-I112 HydrophobicContact CG1-CD1 3.9Å; V104-I112 HydrophobicContact CG1-CG1 3.85Å; V104-I112 VanDerWaalsContact O-CG1 3.29Å; V104-I112 WeakPolarHBondContact O-CG1 3.29Å; V104-I112 PolarHBondContact O-N 3.4Å; V104-G113 PolarHBondContact N-O 2.77Å; V104-G113 PolarHBondContact O-N 3.33Å; V104-I115 HydrophobicContact CG2-CD1 3.76Å; V104-I115 HydrophobicContact CG2-CG1 4.03Å
105	Y	87.2	Confident	88.1	Confident	38 Å²	38	46.2 Å²	46.2	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	144.3	-175.9	-61.3	-85.3	0	0	0	112.1	E92 E93 H95 Y103 S109 L110	E92-Y105 PolarHBondContact N-O 3.25Å; E92-Y105 VanDerWaalsContact N-O 3.13Å; E93-Y105 PolarHBondContact N-O 2.88Å; E93-Y105 PolarHBondContact O-N 3.23Å; H95-Y105 HydrophobicContact CB-CE2 3.87Å; H95-Y105 AromaticContact CD2-CE2 3.87Å; H95-Y105 AromaticContact CE1-CE2 3.79Å; H95-Y105 AromaticContact CG-CE2 3.47Å; H95-Y105 VanDerWaalsContact CG-CE2 3.47Å; H95-Y105 AromaticContact ND1-CE2 3.45Å; H95-Y105 WeakPolarHBondContact ND1-CE2 3.37Å; H95-Y105 AromaticContact ND1-CZ 3.91Å; Y103-Y105 WeakPolarHBondContact CB-OH 3.4Å; Y105-S109 VanDerWaalsContact CD1-O 3.22Å; Y105-S109 WeakPolarHBondContact CD1-O 3.27Å; Y105-L110 WeakPolarHBondContact CA-O 3.5Å
106	Q	88.7	Confident	88.1	Confident	61 Å²	61	46.7 Å²	46.7	29%	0.285	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	176.9	163.3	174.8	171.5	22.3	0	0	109.2	S109 L110 I112	Q106-S109 PolarHBondContact O-N 2.87Å; Q106-S109 VanDerWaalsContact O-N 3.1Å; Q106-L110 PolarHBondContact N-O 2.65Å; Q106-L110 PolarHBondContact O-N 3.17Å; Q106-I112 HydrophobicContact CB-CD1 4.48Å; Q106-I112 HydrophobicContact CB-CG2 3.59Å
107	F	78.4	Confident	88.2	Confident	117 Å²	117	46.8 Å²	46.8	51%	0.513	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-19.9	131	164.3	-167.4	-105.9	0	0	0	115.3	E92 S109 L110	E92-F107 VanDerWaalsContact CD-CA 3.47Å; E92-F107 VanDerWaalsContact CD-N 3.31Å; E92-F107 WeakPolarHBondContact OE1-CA 3.27Å; E92-F107 WeakPolarHBondContact OE1-CB 3.25Å; E92-F107 PolarHBondContact OE1-N 2.9Å; E92-F107 VanDerWaalsContact OE2-CA 3.23Å; E92-F107 WeakPolarHBondContact OE2-CA 3.31Å; E92-F107 PolarHBondContact OE2-N 3.28Å; F107-S109 PolarHBondContact O-N 3.41Å; F107-L110 PolarHBondContact O-N 2.99Å
108	E	80.5	Confident	88.1	Confident	161 Å²	161	47.4 Å²	47.4	75%	0.752	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	55.7	32	-179.1	-72.3	175	178.4	0	0	113.8	L110	E108-L110 PolarHBondContact O-N 3.49Å
109	S	80.2	Confident	88.5	Confident	72 Å²	72	44.2 Å²	44.2	50%	0.503	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	59.8	32.4	177.8	-51.7	0	0	0	0	113.4	Y105 Q106 F107 S111	Y105-S109 VanDerWaalsContact CD1-O 3.22Å; Y105-S109 WeakPolarHBondContact CD1-O 3.27Å; Q106-S109 PolarHBondContact O-N 2.87Å; Q106-S109 VanDerWaalsContact O-N 3.1Å; F107-S109 PolarHBondContact O-N 3.41Å; S109-S111 PolarHBondContact O-N 3.46Å
110	L	88	Confident	89.1	Confident	98 Å²	98	43 Å²	43	51%	0.513	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	114.3	169.5	-173.6	82.8	0	0	0	109.5	Y105 Q106 F107 E108 I112	Y105-L110 WeakPolarHBondContact CA-O 3.5Å; Q106-L110 PolarHBondContact N-O 2.65Å; Q106-L110 PolarHBondContact O-N 3.17Å; F107-L110 PolarHBondContact O-N 2.99Å; E108-L110 PolarHBondContact O-N 3.49Å; L110-I112 HydrophobicContact CD2-CG2 4.46Å; L110-I112 PolarHBondContact O-N 2.83Å
111	S	90.7	Very high	89.5	Confident	49 Å²	49	45.1 Å²	45.1	34%	0.343	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	119.5	175.4	178.4	0	0	0	0	110.7	S109	S109-S111 PolarHBondContact O-N 3.46Å
112	I	92.6	Very high	89.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-13.4	178.9	58.5	167	0	0	0	113.2	Y86 K89 V91 V104 Q106 L110 F188	Y86-I112 HydrophobicContact CD1-CD1 4.24Å; Y86-I112 HydrophobicContact CD1-CG1 4.27Å; K89-I112 HydrophobicContact CB-CD1 3.83Å; K89-I112 HydrophobicContact CB-CG2 4.36Å; K89-I112 HydrophobicContact CD-CB 3.88Å; K89-I112 HydrophobicContact CD-CG2 3.41Å; K89-I112 VanDerWaalsContact CD-CG2 3.41Å; V91-I112 HydrophobicContact CG2-CD1 4.26Å; V104-I112 HydrophobicContact CB-CG1 4.16Å; V104-I112 HydrophobicContact CG1-CD1 3.9Å; V104-I112 HydrophobicContact CG1-CG1 3.85Å; V104-I112 VanDerWaalsContact O-CG1 3.29Å; V104-I112 WeakPolarHBondContact O-CG1 3.29Å; V104-I112 PolarHBondContact O-N 3.4Å; Q106-I112 HydrophobicContact CB-CD1 4.48Å; Q106-I112 HydrophobicContact CB-CG2 3.59Å; L110-I112 HydrophobicContact CD2-CG2 4.46Å; L110-I112 PolarHBondContact O-N 2.83Å; I112-F188 WeakPolarHBondContact O-CD2 3.49Å; I112-F188 PolarHBondContact O-N 2.9Å
113	G	94.7	Very high	90.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.7	-165.8	166.9	0	0	0	0	0	112.8	V104 Y186	V104-G113 PolarHBondContact N-O 2.77Å; V104-G113 PolarHBondContact O-N 3.33Å; G113-Y186 CarbonylContact C-O 3.56Å; G113-Y186 VanDerWaalsContact CA-O 3.27Å; G113-Y186 WeakPolarHBondContact CA-O 3.45Å
114	T	95.9	Very high	90.2	Very high	14 Å²	14	56.7 Å²	56.7	9%	0.086	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	138.8	-170.3	-45.7	0	0	0	0	110	Y86 A101 N102 Y103 F116 Y186	Y86-T114 PolarHBondContact OH-O 3.05Å; A101-T114 HydrophobicContact CB-CG2 3.91Å; N102-T114 WeakPolarHBondContact O-CA 3.41Å; Y103-T114 HydrophobicContact CD1-CG2 3.92Å; Y103-T114 HydrophobicContact CE1-CG2 4.03Å; T114-F116 HydrophobicContact CG2-CD1 4.33Å; T114-F116 HydrophobicContact CG2-CD2 3.89Å; T114-F116 HydrophobicContact CG2-CE1 3.82Å; T114-F116 HydrophobicContact CG2-CE2 3.36Å; T114-F116 HydrophobicContact CG2-CG 4.37Å; T114-F116 HydrophobicContact CG2-CZ 3.32Å; T114-Y186 PolarHBondContact N-O 3.15Å; T114-Y186 PolarHBondContact O-N 3.42Å
115	I	97.3	Very high	90.4	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.5	173.2	-60.3	163	0	0	0	107.6	Y86 N102 V104 T157 L165 F167 I185	Y86-I115 HydrophobicContact CE2-CD1 4.27Å; Y86-I115 HydrophobicContact CE2-CG1 4Å; N102-I115 HydrophobicContact CB-CB 4.08Å; N102-I115 PolarHBondContact N-O 3.03Å; N102-I115 PolarHBondContact O-N 3.39Å; V104-I115 HydrophobicContact CG2-CD1 3.76Å; V104-I115 HydrophobicContact CG2-CG1 4.03Å; I115-T157 HydrophobicContact CG2-CG2 3.92Å; I115-L165 HydrophobicContact CD1-CD1 3.79Å; I115-L165 HydrophobicContact CD1-CD2 3.83Å; I115-L165 HydrophobicContact CD1-CG 4.5Å; I115-L165 HydrophobicContact CG1-CD1 4.12Å; I115-F167 HydrophobicContact CG2-CE1 3.54Å; I115-F167 HydrophobicContact CG2-CZ 3.63Å; I115-I185 HydrophobicContact CG1-CG2 4.31Å; I115-I185 HydrophobicContact CG2-CG2 4.32Å
116	F	96.3	Very high	90.7	Very high	45 Å²	45	58.3 Å²	58.3	20%	0.197	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.6	178.5	-62.3	-86.8	0	0	0	109.5	A101 T114 Y118 S183 E184	A101-F116 HydrophobicContact CB-CD1 4.23Å; A101-F116 HydrophobicContact CB-CE1 3.76Å; T114-F116 HydrophobicContact CG2-CD1 4.33Å; T114-F116 HydrophobicContact CG2-CD2 3.89Å; T114-F116 HydrophobicContact CG2-CE1 3.82Å; T114-F116 HydrophobicContact CG2-CE2 3.36Å; T114-F116 HydrophobicContact CG2-CG 4.37Å; T114-F116 HydrophobicContact CG2-CZ 3.32Å; F116-Y118 HydrophobicContact CB-CD1 4.11Å; F116-Y118 HydrophobicContact CB-CE1 4.04Å; F116-Y118 HydrophobicContact CD1-CD1 4.47Å; F116-Y118 HydrophobicContact CD1-CE1 4.03Å; F116-Y118 HydrophobicContact CG-CE1 4.44Å; F116-S183 CarbonylContact O-C 3.6Å; F116-S183 VanDerWaalsContact O-CA 3.26Å; F116-S183 WeakPolarHBondContact O-CA 3.18Å; F116-E184 HydrophobicContact CB-CG 3.66Å; F116-E184 HydrophobicContact CD2-CG 3.69Å; F116-E184 VanDerWaalsContact CD2-OE1 3.24Å; F116-E184 WeakPolarHBondContact CD2-OE1 3.23Å; F116-E184 HydrophobicContact CG-CG 4.07Å; F116-E184 PolarHBondContact N-O 3.09Å; F116-E184 PolarHBondContact O-N 3.43Å; F116-E184 VanDerWaalsContact O-O 3.06Å
117	N	96.3	Very high	91	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	89.2	175.7	-174.7	24.4	0	0	0	108.1	T156 T157 F167 Y169 S183	N117-T156 PolarHBondContact ND2-O 3.25Å; N117-T157 VanDerWaalsContact CB-OG1 3.24Å; N117-T157 WeakPolarHBondContact CB-OG1 3.24Å; N117-T157 PolarHBondContact ND2-OG1 2.01Å; N117-F167 HydrophobicContact CB-CD1 4.22Å; N117-F167 HydrophobicContact CB-CD2 4.41Å; N117-F167 HydrophobicContact CB-CE1 4.24Å; N117-F167 HydrophobicContact CB-CE2 4.4Å; N117-F167 HydrophobicContact CB-CG 4.33Å; N117-F167 HydrophobicContact CB-CZ 4.33Å; N117-Y169 WeakPolarHBondContact OD1-CE1 3.48Å; N117-S183 PolarHBondContact OD1-OG 3.21Å
118	Y	91.5	Very high	91.9	Very high	31 Å²	31	53.7 Å²	53.7	12%	0.122	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	164.9	-167.5	74	-75.3	0	0	0	114.5	H100 F116 K120 M155 Q182	H100-Y118 HydrophobicContact CB-CD1 3.87Å; H100-Y118 HydrophobicContact CB-CD2 3.62Å; H100-Y118 HydrophobicContact CB-CE1 4.49Å; H100-Y118 HydrophobicContact CB-CE2 4.24Å; H100-Y118 HydrophobicContact CB-CG 3.41Å; H100-Y118 VanDerWaalsContact CB-CG 3.41Å; H100-Y118 AromaticContact CE1-CD2 3.88Å; H100-Y118 AromaticContact CG-CD2 3.3Å; H100-Y118 AromaticContact CG-CE2 3.99Å; H100-Y118 AromaticContact CG-CG 3.58Å; H100-Y118 AromaticContact ND1-CD2 3.13Å; H100-Y118 WeakPolarHBondContact ND1-CD2 3.06Å; H100-Y118 AromaticContact ND1-CE2 3.44Å; H100-Y118 WeakPolarHBondContact ND1-CE2 3.36Å; H100-Y118 AromaticContact ND1-CG 3.91Å; F116-Y118 HydrophobicContact CB-CD1 4.11Å; F116-Y118 HydrophobicContact CB-CE1 4.04Å; F116-Y118 HydrophobicContact CD1-CD1 4.47Å; F116-Y118 HydrophobicContact CD1-CE1 4.03Å; F116-Y118 HydrophobicContact CG-CE1 4.44Å; Y118-K120 HydrophobicContact CD2-CG 4.29Å; Y118-K120 HydrophobicContact CE2-CB 4.34Å; Y118-K120 HydrophobicContact CE2-CG 3.52Å; Y118-M155 WeakPolarHBondContact CA-SD 3.14Å; Y118-M155 PolarHBondContact N-SD 3.43Å; Y118-Q182 HydrophobicContact CE1-CB 3.98Å; Y118-Q182 HydrophobicContact CE1-CG 4.22Å; Y118-Q182 PolarHBondContact N-O 2.9Å; Y118-Q182 PolarHBondContact O-N 3.2Å; Y118-Q182 PolarHBondContact OH-OE1 2.73Å
119	I	93.1	Very high	92.7	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.8	168.4	-57.5	-178.8	0	0	0	107.9	S121 Y122 C142 I144 A153 M155 I176 Q180 L181	I119-S121 WeakPolarHBondContact CG2-O 3.37Å; I119-Y122 WeakPolarHBondContact O-CD1 3.48Å; I119-Y122 WeakPolarHBondContact O-CE1 3.24Å; I119-C142 HydrophobicContact CD1-CB 4.37Å; I119-I144 HydrophobicContact CD1-CD1 4.44Å; I119-I144 HydrophobicContact CD1-CG2 4.49Å; I119-I144 HydrophobicContact CG2-CG2 4.13Å; I119-A153 HydrophobicContact CD1-CB 3.4Å; I119-A153 VanDerWaalsContact CD1-CB 3.4Å; I119-M155 HydrophobicContact CD1-CE 4.07Å; I119-M155 HydrophobicContact CG1-CE 3.39Å; I119-M155 HydrophobicContact CG1-SD 3.85Å; I119-I176 HydrophobicContact CD1-CD1 4.25Å; I119-I176 HydrophobicContact CG2-CD1 3.91Å; I119-Q180 CarbonylContact C-O 3.52Å; I119-Q180 WeakPolarHBondContact CA-O 3.35Å; I119-Q180 HydrophobicContact CG2-CB 4.4Å; I119-L181 HydrophobicContact CD1-CD2 4.5Å; I119-L181 HydrophobicContact CG1-CD2 4.13Å
120	K	91.3	Very high	93.5	Very high	91 Å²	91	42.6 Å²	42.6	40%	0.396	21%	0.207	S	C	.	.	S	Bend	trans	-69.5	-50.7	-175.4	-70.5	176.6	-172.6	164.9	0	113.3	Y118 S179 Q180 Q182	Y118-K120 HydrophobicContact CD2-CG 4.29Å; Y118-K120 HydrophobicContact CE2-CB 4.34Å; Y118-K120 HydrophobicContact CE2-CG 3.52Å; K120-S179 WeakPolarHBondContact CD-O 3.18Å; K120-S179 PolarHBondContact NZ-O 3.18Å; K120-Q180 PolarHBondContact N-O 2.87Å; K120-Q182 VanDerWaalsContact NZ-OE1 3.08Å
121	S	88.7	Confident	93.9	Very high	76 Å²	76	38.9 Å²	38.9	53%	0.531	19%	0.187	S	C	.	.	S	Bend	trans	-105.1	122.3	-179.1	-172.9	0	0	0	0	111.2	I119 I144	I119-S121 WeakPolarHBondContact CG2-O 3.37Å; S121-I144 WeakPolarHBondContact O-CG2 3.36Å
122	Y	90.6	Very high	94.1	Very high	62 Å²	62	41.2 Å²	41.2	24%	0.243	19%	0.193	C	C	.	.			trans	-153.2	159.1	175.2	56.9	-93.2	0	0	0	109.7	H100 I119 K124 S125 C142 S143	H100-Y122 AromaticContact CE1-CE1 3.58Å; H100-Y122 AromaticContact NE2-CE1 3.08Å; H100-Y122 WeakPolarHBondContact NE2-CE1 3.45Å; H100-Y122 AromaticContact NE2-CZ 3.29Å; H100-Y122 VanDerWaalsContact NE2-CZ 3.29Å; H100-Y122 PolarHBondContact NE2-OH 3.41Å; I119-Y122 WeakPolarHBondContact O-CD1 3.48Å; I119-Y122 WeakPolarHBondContact O-CE1 3.24Å; Y122-K124 VanDerWaalsContact CD2-C 3.46Å; Y122-S125 WeakPolarHBondContact CE2-OG 3.34Å; Y122-S125 PolarHBondContact OH-OG 3.36Å; Y122-C142 HydrophobicContact CG-CB 4.27Å; Y122-S143 CarbonylContact C-O 3.52Å; Y122-S143 WeakPolarHBondContact CA-O 3.45Å; Y122-S143 VanDerWaalsContact CB-O 3.25Å; Y122-S143 WeakPolarHBondContact CB-O 3.47Å
123	K	91.9	Very high	94.2	Very high	125 Å²	125	48.4 Å²	48.4	54%	0.543	22%	0.224	S	C	.	.	S	Bend	trans	-81.1	-42.8	176.5	-73.9	179.7	172.1	166.1	0	112	S143 D145	K123-S143 PolarHBondContact N-O 2.68Å; K123-D145 HydrophobicContact CD-CB 4.46Å; K123-D145 WeakPolarHBondContact CE-OD2 3.13Å; K123-D145 IonicContact NZ-OD2 2.67Å; K123-D145 PolarHBondContact NZ-OD2 2.85Å
124	K	91.9	Very high	94.2	Very high	146 Å²	146	54.8 Å²	54.8	64%	0.635	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	142.2	-179.4	-177.4	179.5	177.6	-175	0	109.7	Y122 S143	Y122-K124 VanDerWaalsContact CD2-C 3.46Å; K124-S143 PolarHBondContact O-N 2.86Å
125	S	92.7	Very high	94.2	Very high	23 Å²	23	55.2 Å²	55.2	16%	0.161	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	151.3	171	61.8	0	0	0	0	110.8	Y122 N141	Y122-S125 WeakPolarHBondContact CE2-OG 3.34Å; Y122-S125 PolarHBondContact OH-OG 3.36Å; S125-N141 CarbonylContact C-O 3.58Å; S125-N141 VanDerWaalsContact CA-O 3.28Å; S125-N141 WeakPolarHBondContact CA-O 3.48Å
126	E	93.7	Very high	94.2	Very high	49 Å²	49	55.1 Å²	55.1	23%	0.229	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	123.1	166.6	179.6	166.7	-134.9	0	0	108.8	K71 R128 N141	K71-E126 WeakPolarHBondContact CD-OE1 3.42Å; K71-E126 VanDerWaalsContact CE-OE1 3.24Å; K71-E126 WeakPolarHBondContact CE-OE1 3.48Å; K71-E126 IonicContact NZ-OE1 3.62Å; K71-E126 PolarHBondContact NZ-OE1 2.95Å; E126-R128 VanDerWaalsContact CD-NH1 3.26Å; E126-R128 IonicContact OE1-CZ 2.62Å; E126-R128 IonicContact OE1-NH1 3.19Å; E126-R128 IonicContact OE1-NH2 2.98Å; E126-R128 PolarHBondContact OE1-NH2 3.13Å; E126-R128 IonicContact OE2-CZ 3.31Å; E126-R128 IonicContact OE2-NH1 3.52Å; E126-R128 PolarHBondContact OE2-NH1 2.87Å; E126-R128 IonicContact OE2-NH2 3.63Å; E126-R128 PolarHBondContact OE2-NH2 3.03Å; E126-N141 PolarHBondContact N-O 3.26Å; E126-N141 PolarHBondContact O-N 3.46Å
127	S	95.5	Very high	94.2	Very high	4 Å²	4	53 Å²	53	3%	0.028	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.9	178.2	-57.3	0	0	0	0	110.3	I72 Q139 R140	I72-S127 PolarHBondContact N-O 3.23Å; S127-Q139 CarbonylContact C-O 3.59Å; S127-Q139 VanDerWaalsContact CA-O 3.3Å; S127-Q139 WeakPolarHBondContact CA-O 3.1Å; S127-R140 WeakPolarHBondContact OG-CG 3.32Å
128	R	96.3	Very high	94.3	Very high	77 Å²	77	52.9 Å²	52.9	29%	0.291	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.7	175.8	-64.2	-168.3	176.2	78.6	3.9	111.3	F68 Y70 E126 V138 Q139	F68-R128 HydrophobicContact CB-CB 3.73Å; F68-R128 WeakPolarHBondContact CD1-O 3.1Å; F68-R128 WeakPolarHBondContact O-CB 3.45Å; F68-R128 WeakPolarHBondContact O-CD 3.32Å; Y70-R128 CarbonylContact O-C 3.52Å; Y70-R128 VanDerWaalsContact O-CA 3.22Å; Y70-R128 WeakPolarHBondContact O-CA 3.43Å; E126-R128 VanDerWaalsContact CD-NH1 3.26Å; E126-R128 IonicContact OE1-CZ 2.62Å; E126-R128 IonicContact OE1-NH1 3.19Å; E126-R128 IonicContact OE1-NH2 2.98Å; E126-R128 PolarHBondContact OE1-NH2 3.13Å; E126-R128 IonicContact OE2-CZ 3.31Å; E126-R128 IonicContact OE2-NH1 3.52Å; E126-R128 PolarHBondContact OE2-NH1 2.87Å; E126-R128 IonicContact OE2-NH2 3.63Å; E126-R128 PolarHBondContact OE2-NH2 3.03Å; R128-V138 CarbonylContact O-C 3.5Å; R128-V138 VanDerWaalsContact O-CA 3.32Å; R128-V138 WeakPolarHBondContact O-CA 3.29Å; R128-V138 WeakPolarHBondContact O-CG2 3.3Å; R128-Q139 PolarHBondContact N-O 3.14Å; R128-Q139 PolarHBondContact O-N 2.87Å
129	V	97.6	Very high	94.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.4	-177.3	177.6	0	0	0	0	110.5	F68 E69 Y70 I72 Y76 F96 D131 L136 G137 V138	F68-V129 CarbonylContact C-O 3.58Å; E69-V129 PolarHBondContact N-O 3.39Å; E69-V129 VanDerWaalsContact N-O 3.14Å; Y70-V129 PolarHBondContact N-O 2.83Å; Y70-V129 VanDerWaalsContact N-O 3.15Å; Y70-V129 PolarHBondContact O-N 2.82Å; I72-V129 HydrophobicContact CD1-CG2 3.61Å; I72-V129 HydrophobicContact CG1-CG2 3.66Å; Y76-V129 HydrophobicContact CD1-CB 4.26Å; Y76-V129 HydrophobicContact CD1-CG1 3.87Å; Y76-V129 HydrophobicContact CD1-CG2 4.03Å; Y76-V129 HydrophobicContact CE1-CB 4.42Å; Y76-V129 HydrophobicContact CE1-CG1 3.75Å; Y76-V129 HydrophobicContact CG-CB 4.38Å; Y76-V129 HydrophobicContact CG-CG1 4.48Å; Y76-V129 HydrophobicContact CG-CG2 3.97Å; F96-V129 HydrophobicContact CB-CG2 4.13Å; F96-V129 HydrophobicContact CD2-CG1 4.31Å; F96-V129 HydrophobicContact CD2-CG2 4.07Å; F96-V129 HydrophobicContact CE2-CG1 4.28Å; F96-V129 HydrophobicContact CG-CG2 4.1Å; V129-D131 HydrophobicContact CG1-CB 4.26Å; V129-L136 HydrophobicContact CG1-CD1 4.34Å; V129-G137 CarbonylContact C-O 3.59Å; V129-G137 VanDerWaalsContact CA-O 3.26Å; V129-G137 WeakPolarHBondContact CA-O 3.25Å; V129-G137 WeakPolarHBondContact CG1-O 3.41Å; V129-V138 HydrophobicContact CG2-CG2 4.46Å
130	L	97.3	Very high	94.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.6	163.1	168.5	115.5	0	0	0	107	V63 S67 F68 E132 L135 L136 G137 L158	V63-L130 HydrophobicContact CG1-CD1 3.98Å; S67-L130 WeakPolarHBondContact O-CD1 3.39Å; F68-L130 HydrophobicContact CD1-CB 3.57Å; F68-L130 HydrophobicContact CE1-CB 3.7Å; F68-L130 HydrophobicContact CG-CB 4.09Å; F68-L130 HydrophobicContact CZ-CB 4.31Å; L130-E132 HydrophobicContact CD1-CG 4.14Å; L130-E132 HydrophobicContact CG-CG 4.2Å; L130-L135 HydrophobicContact CD2-CB 3.82Å; L130-L135 HydrophobicContact CD2-CD2 3.6Å; L130-L135 HydrophobicContact CD2-CG 3.48Å; L130-L135 VanDerWaalsContact CD2-CG 3.48Å; L130-L136 CarbonylContact O-C 3.59Å; L130-L136 WeakPolarHBondContact O-CA 3.23Å; L130-L136 WeakPolarHBondContact O-CD1 3.3Å; L130-G137 PolarHBondContact N-O 2.9Å; L130-G137 PolarHBondContact O-N 2.71Å; L130-L158 HydrophobicContact CD2-CD2 4.34Å
131	D	96.2	Very high	94.8	Very high	19 Å²	19	48.9 Å²	48.9	10%	0.102	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	79.6	-177.6	-173	-14	0	0	0	109.6	Y70 Y76 R81 V129 L136	Y70-D131 HydrophobicContact CD2-CB 4.39Å; Y70-D131 HydrophobicContact CE2-CB 4.22Å; Y76-D131 HydrophobicContact CE1-CB 4.49Å; Y76-D131 PolarHBondContact OH-OD2 3.22Å; R81-D131 IonicContact NH2-OD1 2.68Å; V129-D131 HydrophobicContact CG1-CB 4.26Å; D131-L136 HydrophobicContact CB-CD1 3.81Å
132	E	95.1	Very high	95.1	Very high	98 Å²	98	45.3 Å²	45.3	46%	0.458	21%	0.205	S	C	.	.			trans	-108.1	169.7	-178.5	-67.2	-174.3	178.9	0	0	111.6	L130 E134 L135	L130-E132 HydrophobicContact CD1-CG 4.14Å; L130-E132 HydrophobicContact CG-CG 4.2Å; E132-E134 PolarHBondContact O-N 2.87Å; E132-L135 WeakPolarHBondContact CA-O 3.32Å; E132-L135 PolarHBondContact N-O 2.98Å
133	K	94.1	Very high	95.3	Very high	151 Å²	151	42.7 Å²	42.7	66%	0.657	20%	0.196	S	C	*	.	S	Bend	trans	-61.6	-30.2	-176.6	-173.7	-177.7	174.5	-166.9	0	113.5	F82	F82-K133 VanDerWaalsContact CD1-O 3.31Å; F82-K133 WeakPolarHBondContact CD1-O 3.34Å
134	E	94.1	Very high	95.3	Very high	134 Å²	134	37 Å²	37	63%	0.626	17%	0.171	S	C	*	.	S	Bend	trans	-124.1	6.6	-175	-62.1	-173.3	169.6	0	0	112.7	E132 P161	E132-E134 PolarHBondContact O-N 2.87Å; E134-P161 VanDerWaalsContact O-CD 3.25Å; E134-P161 WeakPolarHBondContact O-CD 3.28Å
135	L	96.4	Very high	95.2	Very high	23 Å²	23	33.9 Å²	33.9	12%	0.12	16%	0.162	C	C	.	.			trans	-156.5	130.4	-177.7	-165.1	63.8	0	0	0	110.4	V63 L130 E132 L158 H160	V63-L135 HydrophobicContact CG2-CD2 3.58Å; L130-L135 HydrophobicContact CD2-CB 3.82Å; L130-L135 HydrophobicContact CD2-CD2 3.6Å; L130-L135 HydrophobicContact CD2-CG 3.48Å; L130-L135 VanDerWaalsContact CD2-CG 3.48Å; E132-L135 WeakPolarHBondContact CA-O 3.32Å; E132-L135 PolarHBondContact N-O 2.98Å; L135-L158 HydrophobicContact CD1-CB 4.26Å; L135-L158 HydrophobicContact CD2-CD2 4.25Å; L135-L158 HydrophobicContact CG-CD2 4.37Å; L135-H160 VanDerWaalsContact CD1-CE1 3.5Å; L135-H160 WeakPolarHBondContact CD1-CE1 3.46Å; L135-H160 VanDerWaalsContact CD1-ND1 3.3Å; L135-H160 WeakPolarHBondContact CD1-ND1 2.95Å
136	L	97.5	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139	174.8	-177.1	69.6	0	0	0	108.1	P80 F82 I94 F96 V129 L130 D131 I159	P80-L136 HydrophobicContact CG-CD2 3.86Å; F82-L136 HydrophobicContact CE1-CB 4.23Å; F82-L136 HydrophobicContact CZ-CB 4.02Å; I94-L136 HydrophobicContact CD1-CD2 4.08Å; F96-L136 HydrophobicContact CE2-CD1 4.06Å; F96-L136 HydrophobicContact CE2-CD2 4Å; F96-L136 HydrophobicContact CE2-CG 3.95Å; F96-L136 HydrophobicContact CZ-CD1 4.36Å; F96-L136 HydrophobicContact CZ-CD2 3.99Å; F96-L136 HydrophobicContact CZ-CG 3.8Å; V129-L136 HydrophobicContact CG1-CD1 4.34Å; L130-L136 CarbonylContact O-C 3.59Å; L130-L136 WeakPolarHBondContact O-CA 3.23Å; L130-L136 WeakPolarHBondContact O-CD1 3.3Å; D131-L136 HydrophobicContact CB-CD1 3.81Å; L136-I159 HydrophobicContact CD2-CD1 4.46Å; L136-I159 HydrophobicContact CG-CD1 4.48Å; L136-I159 PolarHBondContact N-O 3.49Å; L136-I159 VanDerWaalsContact N-O 3.12Å; L136-I159 WeakPolarHBondContact O-CA 2.99Å; L136-I159 PolarHBondContact O-N 2.87Å
137	G	97	Very high	94.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	169.9	-178.3	0	0	0	0	0	114.6	V129 L130 T157	V129-G137 CarbonylContact C-O 3.59Å; V129-G137 VanDerWaalsContact CA-O 3.26Å; V129-G137 WeakPolarHBondContact CA-O 3.25Å; V129-G137 WeakPolarHBondContact CG1-O 3.41Å; L130-G137 PolarHBondContact N-O 2.9Å; L130-G137 PolarHBondContact O-N 2.71Å; G137-T157 CarbonylContact C-O 3.57Å; G137-T157 WeakPolarHBondContact CA-O 3.04Å
138	V	97	Very high	94.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.4	176.9	61.4	0	0	0	0	110	I72 F96 R128 V129 R140 T156 T157	I72-V138 HydrophobicContact CD1-CG2 3.79Å; F96-V138 HydrophobicContact CD1-CB 3.58Å; F96-V138 HydrophobicContact CD1-CG1 3.54Å; F96-V138 HydrophobicContact CD1-CG2 4.4Å; F96-V138 HydrophobicContact CE1-CB 3.99Å; F96-V138 HydrophobicContact CE1-CG1 3.86Å; F96-V138 HydrophobicContact CG-CB 4.3Å; R128-V138 CarbonylContact O-C 3.5Å; R128-V138 VanDerWaalsContact O-CA 3.32Å; R128-V138 WeakPolarHBondContact O-CA 3.29Å; R128-V138 WeakPolarHBondContact O-CG2 3.3Å; V129-V138 HydrophobicContact CG2-CG2 4.46Å; V138-R140 HydrophobicContact CG2-CG 4.21Å; V138-T156 CarbonylContact O-C 3.41Å; V138-T156 WeakPolarHBondContact O-CA 3.39Å; V138-T157 PolarHBondContact N-O 3.28Å; V138-T157 PolarHBondContact O-N 3.15Å
139	Q	96.3	Very high	94	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.4	168.8	-178.7	-179.5	89.4	0	0	108.9	S65 F68 S127 R128 N141 T154	S65-Q139 PolarHBondContact OG-NE2 3.27Å; F68-Q139 HydrophobicContact CB-CB 4.36Å; F68-Q139 HydrophobicContact CD1-CB 3.63Å; F68-Q139 HydrophobicContact CD2-CB 3.97Å; F68-Q139 HydrophobicContact CE1-CB 3.82Å; F68-Q139 HydrophobicContact CE2-CB 4.14Å; F68-Q139 HydrophobicContact CG-CB 3.71Å; F68-Q139 HydrophobicContact CZ-CB 4.07Å; S127-Q139 CarbonylContact C-O 3.59Å; S127-Q139 VanDerWaalsContact CA-O 3.3Å; S127-Q139 WeakPolarHBondContact CA-O 3.1Å; R128-Q139 PolarHBondContact N-O 3.14Å; R128-Q139 PolarHBondContact O-N 2.87Å; Q139-N141 PolarHBondContact OE1-ND2 3.48Å; Q139-T154 HydrophobicContact CG-CG2 3.47Å; Q139-T154 VanDerWaalsContact CG-CG2 3.47Å
140	R	95.7	Very high	93.7	Very high	3 Å²	3	47.4 Å²	47.4	1%	0.011	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.4	178	-58.2	-165.9	161.6	90.5	3.1	109.7	N97 H100 N102 S127 V138 T154 M155	N97-R140 PolarHBondContact O-NH2 3.4Å; H100-R140 PolarHBondContact O-NH1 3.34Å; H100-R140 PolarHBondContact O-NH2 2.76Å; N102-R140 PolarHBondContact OD1-NH2 3.29Å; S127-R140 WeakPolarHBondContact OG-CG 3.32Å; V138-R140 HydrophobicContact CG2-CG 4.21Å; R140-T154 CarbonylContact O-C 3.54Å; R140-T154 VanDerWaalsContact O-CA 3.29Å; R140-T154 WeakPolarHBondContact O-CA 3.42Å; R140-M155 PolarHBondContact N-O 3.31Å; R140-M155 PolarHBondContact O-N 2.02Å
141	N	95.2	Very high	93.6	Very high	31 Å²	31	49.8 Å²	49.8	17%	0.166	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	110.6	175.3	-63.7	-59.8	0	0	0	108.1	S125 E126 Q139 T152 A153 T154	S125-N141 CarbonylContact C-O 3.58Å; S125-N141 VanDerWaalsContact CA-O 3.28Å; S125-N141 WeakPolarHBondContact CA-O 3.48Å; E126-N141 PolarHBondContact N-O 3.26Å; E126-N141 PolarHBondContact O-N 3.46Å; Q139-N141 PolarHBondContact OE1-ND2 3.48Å; N141-T152 HydrophobicContact CB-CG2 3.98Å; N141-A153 CarbonylContact C-O 3.58Å; N141-A153 WeakPolarHBondContact CA-O 3.24Å; N141-T154 WeakPolarHBondContact OD1-CB 3.39Å; N141-T154 WeakPolarHBondContact OD1-CG2 3.45Å; N141-T154 PolarHBondContact OD1-OG1 3.19Å
142	C	94.3	Very high	93.6	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.014	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.8	-177.9	-64.9	0	0	0	0	109.8	I119 Y122 T152 A153	I119-C142 HydrophobicContact CD1-CB 4.37Å; Y122-C142 HydrophobicContact CG-CB 4.27Å; C142-T152 WeakPolarHBondContact O-CA 3.16Å; C142-A153 PolarHBondContact N-O 2.78Å; C142-A153 PolarHBondContact O-N 3.17Å
143	S	94.5	Very high	93.6	Very high	7 Å²	7	47.6 Å²	47.6	5%	0.049	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.3	169.5	151.8	0	0	0	0	109.5	Y122 K123 K124 E150 V151	Y122-S143 CarbonylContact C-O 3.52Å; Y122-S143 WeakPolarHBondContact CA-O 3.45Å; Y122-S143 VanDerWaalsContact CB-O 3.25Å; Y122-S143 WeakPolarHBondContact CB-O 3.47Å; K123-S143 PolarHBondContact N-O 2.68Å; K124-S143 PolarHBondContact O-N 2.86Å; S143-E150 VanDerWaalsContact CB-OE1 3.29Å; S143-E150 WeakPolarHBondContact CB-OE1 3.24Å; S143-E150 WeakPolarHBondContact OG-CG 3.39Å; S143-E150 PolarHBondContact OG-OE1 3.2Å; S143-V151 WeakPolarHBondContact CA-O 3.42Å
144	I	93	Very high	93.7	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.9	-177.1	52.3	177.6	0	0	0	110.1	I119 S121 V146 E150 V151 A153 P173 I176	I119-I144 HydrophobicContact CD1-CD1 4.44Å; I119-I144 HydrophobicContact CD1-CG2 4.49Å; I119-I144 HydrophobicContact CG2-CG2 4.13Å; S121-I144 WeakPolarHBondContact O-CG2 3.36Å; I144-V146 HydrophobicContact CD1-CG2 4.32Å; I144-V146 HydrophobicContact CG1-CG2 4.31Å; I144-E150 WeakPolarHBondContact O-CA 3.43Å; I144-V151 HydrophobicContact CG1-CB 4.33Å; I144-V151 VanDerWaalsContact CG1-O 3.22Å; I144-V151 WeakPolarHBondContact CG1-O 3.3Å; I144-V151 PolarHBondContact N-O 2.76Å; I144-V151 PolarHBondContact O-N 3.4Å; I144-A153 HydrophobicContact CD1-CB 3.84Å; I144-A153 HydrophobicContact CG1-CB 4.47Å; I144-P173 VanDerWaalsContact CD1-CD 3.41Å; I144-P173 HydrophobicContact CD1-CG 3.39Å; I144-P173 HydrophobicContact CG1-CG 4.26Å; I144-I176 HydrophobicContact CD1-CD1 3.93Å
145	D	90.4	Very high	93.8	Very high	80 Å²	80	34.6 Å²	34.6	43%	0.428	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	117.1	174.3	-165.3	-30.3	0	0	0	109.2	K123 G148	K123-D145 HydrophobicContact CD-CB 4.46Å; K123-D145 WeakPolarHBondContact CE-OD2 3.13Å; K123-D145 IonicContact NZ-OD2 2.67Å; K123-D145 PolarHBondContact NZ-OD2 2.85Å; D145-G148 WeakPolarHBondContact OD1-CA 3.35Å; D145-G148 PolarHBondContact OD1-N 2.66Å
146	V	87.4	Confident	93.9	Very high	19 Å²	19	33.6 Å²	33.6	12%	0.115	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.1	173.8	-176.5	0	0	0	0	107.7	I144 G148 S149 V151 P173 E175	I144-V146 HydrophobicContact CD1-CG2 4.32Å; I144-V146 HydrophobicContact CG1-CG2 4.31Å; V146-G148 PolarHBondContact O-N 3.2Å; V146-G148 VanDerWaalsContact O-N 3.15Å; V146-S149 PolarHBondContact N-O 2.99Å; V146-S149 PolarHBondContact O-N 3.21Å; V146-V151 HydrophobicContact CB-CG2 4.42Å; V146-V151 HydrophobicContact CG2-CG2 4.34Å; V146-P173 HydrophobicContact CG2-CB 3.85Å; V146-P173 HydrophobicContact CG2-CG 3.8Å; V146-E175 HydrophobicContact CG1-CB 3.76Å; V146-E175 HydrophobicContact CG1-CG 4.23Å
147	N	88	Confident	93.9	Very high	149 Å²	149	33.6 Å²	33.6	80%	0.797	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	37.4	177.8	-59.6	-35.4	0	0	0	113.7
148	G	87	Confident	93.9	Very high	65 Å²	65	33.7 Å²	33.7	67%	0.67	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.4	-2	-179.9	0	0	0	0	0	114.7	D145 V146	D145-G148 WeakPolarHBondContact OD1-CA 3.35Å; D145-G148 PolarHBondContact OD1-N 2.66Å; V146-G148 PolarHBondContact O-N 3.2Å; V146-G148 VanDerWaalsContact O-N 3.15Å
149	S	90.2	Very high	93.9	Very high	77 Å²	77	33.8 Å²	33.8	54%	0.538	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134.5	175.3	-61.7	0	0	0	0	111	V146	V146-S149 PolarHBondContact N-O 2.99Å; V146-S149 PolarHBondContact O-N 3.21Å
150	E	92	Very high	93.9	Very high	126 Å²	126	35.3 Å²	35.3	59%	0.589	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	117	177	-168.6	175.2	167.4	0	0	110.3	S143 I144	S143-E150 VanDerWaalsContact CB-OE1 3.29Å; S143-E150 WeakPolarHBondContact CB-OE1 3.24Å; S143-E150 WeakPolarHBondContact OG-CG 3.39Å; S143-E150 PolarHBondContact OG-OE1 3.2Å; I144-E150 WeakPolarHBondContact O-CA 3.43Å
151	V	94.3	Very high	93.8	Very high	51 Å²	51	37.6 Å²	37.6	31%	0.309	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.4	176.9	-175.7	0	0	0	0	109	S143 I144 V146 P173	S143-V151 WeakPolarHBondContact CA-O 3.42Å; I144-V151 HydrophobicContact CG1-CB 4.33Å; I144-V151 VanDerWaalsContact CG1-O 3.22Å; I144-V151 WeakPolarHBondContact CG1-O 3.3Å; I144-V151 PolarHBondContact N-O 2.76Å; I144-V151 PolarHBondContact O-N 3.4Å; V146-V151 HydrophobicContact CB-CG2 4.42Å; V146-V151 HydrophobicContact CG2-CG2 4.34Å; V151-P173 HydrophobicContact CB-CG 4.12Å; V151-P173 HydrophobicContact CG1-CG 3.86Å
152	T	95.5	Very high	93.5	Very high	72 Å²	72	41.9 Å²	41.9	44%	0.442	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	112.2	174.1	-59.1	0	0	0	0	109.7	N141 C142 N171	N141-T152 HydrophobicContact CB-CG2 3.98Å; C142-T152 WeakPolarHBondContact O-CA 3.16Å; T152-N171 VanDerWaalsContact O-CB 3.31Å; T152-N171 WeakPolarHBondContact O-CB 3.36Å
153	A	96.1	Very high	93.4	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.9	172.3	0	0	0	0	0	110.4	I119 N141 C142 I144 N171 I172	I119-A153 HydrophobicContact CD1-CB 3.4Å; I119-A153 VanDerWaalsContact CD1-CB 3.4Å; N141-A153 CarbonylContact C-O 3.58Å; N141-A153 WeakPolarHBondContact CA-O 3.24Å; C142-A153 PolarHBondContact N-O 2.78Å; C142-A153 PolarHBondContact O-N 3.17Å; I144-A153 HydrophobicContact CD1-CB 3.84Å; I144-A153 HydrophobicContact CG1-CB 4.47Å; A153-N171 WeakPolarHBondContact CA-O 3.3Å; A153-I172 HydrophobicContact CB-CD1 3.97Å
154	T	96.2	Very high	93.5	Very high	9 Å²	9	44.3 Å²	44.3	6%	0.055	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.8	-174.9	-57.3	0	0	0	0	110.6	Q139 R140 N141 D170	Q139-T154 HydrophobicContact CG-CG2 3.47Å; Q139-T154 VanDerWaalsContact CG-CG2 3.47Å; R140-T154 CarbonylContact O-C 3.54Å; R140-T154 VanDerWaalsContact O-CA 3.29Å; R140-T154 WeakPolarHBondContact O-CA 3.42Å; N141-T154 WeakPolarHBondContact OD1-CB 3.39Å; N141-T154 WeakPolarHBondContact OD1-CG2 3.45Å; N141-T154 PolarHBondContact OD1-OG1 3.19Å; T154-D170 PolarHBondContact N-O 2.8Å; T154-D170 PolarHBondContact O-N 3.38Å
155	M	96.5	Very high	93.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121.8	174.3	-64.3	-167.2	164.1	0	0	109.8	Y118 I119 R140 Y169 I172 L181 I207	Y118-M155 WeakPolarHBondContact CA-SD 3.14Å; Y118-M155 PolarHBondContact N-SD 3.43Å; I119-M155 HydrophobicContact CD1-CE 4.07Å; I119-M155 HydrophobicContact CG1-CE 3.39Å; I119-M155 HydrophobicContact CG1-SD 3.85Å; R140-M155 PolarHBondContact N-O 3.31Å; R140-M155 PolarHBondContact O-N 2.02Å; M155-Y169 HydrophobicContact CE-CD1 4.16Å; M155-Y169 HydrophobicContact CE-CE1 4.35Å; M155-Y169 HydrophobicContact CG-CD1 4.11Å; M155-Y169 HydrophobicContact SD-CD1 4.46Å; M155-Y169 HydrophobicContact SD-CE1 4.5Å; M155-I172 HydrophobicContact CE-CD1 4.07Å; M155-I172 HydrophobicContact CG-CD1 4.31Å; M155-L181 HydrophobicContact CE-CD2 3.71Å; M155-I207 HydrophobicContact CE-CG2 3.8Å
156	T	97.3	Very high	94	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.4	-178.1	-54.9	0	0	0	0	109.9	F68 N117 V138 L158 F167 Y168	F68-T156 HydrophobicContact CE1-CG2 4.04Å; F68-T156 HydrophobicContact CE2-CG2 4.28Å; F68-T156 HydrophobicContact CZ-CG2 3.46Å; F68-T156 VanDerWaalsContact CZ-CG2 3.46Å; N117-T156 PolarHBondContact ND2-O 3.25Å; V138-T156 CarbonylContact O-C 3.41Å; V138-T156 WeakPolarHBondContact O-CA 3.39Å; T156-L158 HydrophobicContact CG2-CD2 4.12Å; T156-L158 HydrophobicContact CG2-CG 4.12Å; T156-F167 CarbonylContact O-C 3.58Å; T156-F167 VanDerWaalsContact O-CA 3.27Å; T156-F167 WeakPolarHBondContact O-CA 3.44Å; T156-Y168 PolarHBondContact N-O 3.47Å; T156-Y168 PolarHBondContact O-N 3.41Å
157	T	97.8	Very high	94.6	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.1	170.3	-66.4	0	0	0	0	108.8	I115 N117 G137 V138 S166 F167	I115-T157 HydrophobicContact CG2-CG2 3.92Å; N117-T157 VanDerWaalsContact CB-OG1 3.24Å; N117-T157 WeakPolarHBondContact CB-OG1 3.24Å; N117-T157 PolarHBondContact ND2-OG1 2.01Å; G137-T157 CarbonylContact C-O 3.57Å; G137-T157 WeakPolarHBondContact CA-O 3.04Å; V138-T157 PolarHBondContact N-O 3.28Å; V138-T157 PolarHBondContact O-N 3.15Å; T157-S166 CarbonylContact C-O 3.53Å; T157-S166 WeakPolarHBondContact CA-O 3.12Å; T157-F167 HydrophobicContact CG2-CD1 4.01Å; T157-F167 HydrophobicContact CG2-CE1 3.79Å; T157-F167 WeakPolarHBondContact OG1-CD1 3.37Å
158	L	97.8	Very high	95.1	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.6	175.8	-60.1	174.1	0	0	0	110	P62 V63 F68 L130 L135 T156 L165 S166	P62-L158 HydrophobicContact CB-CD1 4.05Å; P62-L158 HydrophobicContact CG-CD1 3.72Å; V63-L158 HydrophobicContact CG2-CD1 3.75Å; V63-L158 HydrophobicContact CG2-CD2 4.21Å; F68-L158 HydrophobicContact CE1-CD2 4.27Å; F68-L158 HydrophobicContact CZ-CD2 3.9Å; L130-L158 HydrophobicContact CD2-CD2 4.34Å; L135-L158 HydrophobicContact CD1-CB 4.26Å; L135-L158 HydrophobicContact CD2-CD2 4.25Å; L135-L158 HydrophobicContact CG-CD2 4.37Å; T156-L158 HydrophobicContact CG2-CD2 4.12Å; T156-L158 HydrophobicContact CG2-CG 4.12Å; L158-L165 CarbonylContact O-C 3.49Å; L158-L165 WeakPolarHBondContact O-CA 3.02Å; L158-S166 PolarHBondContact N-O 3.22Å; L158-S166 PolarHBondContact O-N 2.9Å
159	I	97.4	Very high	95.6	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	116.3	173.3	-59	125.7	0	0	0	106.8	F82 I94 F96 L136 L165	F82-I159 HydrophobicContact CE2-CG2 4.22Å; F82-I159 HydrophobicContact CZ-CG2 4.35Å; F82-I159 WeakPolarHBondContact CZ-O 3.3Å; I94-I159 HydrophobicContact CD1-CD1 3.5Å; I94-I159 VanDerWaalsContact CD1-CD1 3.5Å; I94-I159 HydrophobicContact CD1-CG1 4.11Å; I94-I159 HydrophobicContact CD1-CG2 4.44Å; F96-I159 HydrophobicContact CE1-CD1 4.05Å; F96-I159 HydrophobicContact CZ-CD1 3.82Å; L136-I159 HydrophobicContact CD2-CD1 4.46Å; L136-I159 HydrophobicContact CG-CD1 4.48Å; L136-I159 PolarHBondContact N-O 3.49Å; L136-I159 VanDerWaalsContact N-O 3.12Å; L136-I159 WeakPolarHBondContact O-CA 2.99Å; L136-I159 PolarHBondContact O-N 2.87Å; I159-L165 HydrophobicContact CB-CD2 4.02Å; I159-L165 HydrophobicContact CG1-CD2 3.35Å; I159-L165 HydrophobicContact CG2-CD2 4.12Å
160	H	96.4	Very high	95.9	Very high	36 Å²	36	28.2 Å²	28.2	17%	0.167	15%	0.151	C	C	.	.			trans	-98.7	169.1	-178.1	-61.6	-91.2	0	0	0	110.9	F82 L135 G163 K164 S166	F82-H160 WeakPolarHBondContact CE2-O 3.15Å; L135-H160 VanDerWaalsContact CD1-CE1 3.5Å; L135-H160 WeakPolarHBondContact CD1-CE1 3.46Å; L135-H160 VanDerWaalsContact CD1-ND1 3.3Å; L135-H160 WeakPolarHBondContact CD1-ND1 2.95Å; H160-G163 PolarHBondContact O-N 2.93Å; H160-G163 VanDerWaalsContact O-N 3.14Å; H160-K164 HydrophobicContact CB-CB 4.12Å; H160-K164 WeakPolarHBondContact CB-O 3.31Å; H160-K164 PolarHBondContact CD2-O 2.75Å; H160-K164 PolarHBondContact N-O 3.12Å; H160-S166 PolarHBondContact CD2-OG 3.08Å; H160-S166 VanDerWaalsContact CD2-OG 3.27Å; H160-S166 PolarHBondContact NE2-OG 3.2Å
161	P	93.5	Very high	96.1	Very high	51 Å²	51	26.5 Å²	26.5	33%	0.331	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-52.9	151.5	167.3	-25.2	37.2	0	0	0	111.2	F82 E134 G163	F82-P161 HydrophobicContact CB-CG 4.49Å; F82-P161 HydrophobicContact CD2-CB 4.38Å; F82-P161 HydrophobicContact CD2-CG 4.37Å; F82-P161 HydrophobicContact CG-CG 4.37Å; E134-P161 VanDerWaalsContact O-CD 3.25Å; E134-P161 WeakPolarHBondContact O-CD 3.28Å; P161-G163 PolarHBondContact O-N 3.35Å; P161-G163 VanDerWaalsContact O-N 3.16Å
162	N	88.9	Confident	96.2	Very high	122 Å²	122	24.6 Å²	24.6	65%	0.652	13%	0.134	S	C	*	.	G	3₁₀ helix	trans	67.1	0.5	-173.9	-51.7	-32.4	0	0	0	114.8	S83	S83-N162 PolarHBondContact O-N 3.45Å
163	G	92.2	Very high	96.1	Very high	4 Å²	4	21.9 Å²	21.9	4%	0.041	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	84.4	15.6	177.8	0	0	0	0	0	114.8	S85 H160 P161 L165	S85-G163 WeakPolarHBondContact O-CA 3.42Å; H160-G163 PolarHBondContact O-N 2.93Å; H160-G163 VanDerWaalsContact O-N 3.14Å; P161-G163 PolarHBondContact O-N 3.35Å; P161-G163 VanDerWaalsContact O-N 3.16Å; G163-L165 PolarHBondContact O-N 2.79Å
164	K	94.8	Very high	96	Very high	56 Å²	56	30.2 Å²	30.2	24%	0.243	16%	0.158	C	C	.	.			trans	-61.9	132.6	167.4	-178.7	-176.5	75.7	157.1	0	108.9	H160 E214 F215	H160-K164 HydrophobicContact CB-CB 4.12Å; H160-K164 WeakPolarHBondContact CB-O 3.31Å; H160-K164 PolarHBondContact CD2-O 2.75Å; H160-K164 PolarHBondContact N-O 3.12Å; K164-E214 IonicContact NZ-OE1 2.65Å; K164-E214 PolarHBondContact NZ-OE1 3.06Å; K164-F215 WeakPolarHBondContact CA-O 3.45Å; K164-F215 WeakPolarHBondContact CG-O 3.46Å
165	L	97.5	Very high	95.7	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	138.8	178.1	-63.7	174	0	0	0	109.9	Y86 I115 L158 I159 G163 I185 E214 F215	Y86-L165 HydrophobicContact CD2-CD1 3.98Å; Y86-L165 HydrophobicContact CE2-CD1 3.65Å; I115-L165 HydrophobicContact CD1-CD1 3.79Å; I115-L165 HydrophobicContact CD1-CD2 3.83Å; I115-L165 HydrophobicContact CD1-CG 4.5Å; I115-L165 HydrophobicContact CG1-CD1 4.12Å; L158-L165 CarbonylContact O-C 3.49Å; L158-L165 WeakPolarHBondContact O-CA 3.02Å; I159-L165 HydrophobicContact CB-CD2 4.02Å; I159-L165 HydrophobicContact CG1-CD2 3.35Å; I159-L165 HydrophobicContact CG2-CD2 4.12Å; G163-L165 PolarHBondContact O-N 2.79Å; L165-I185 HydrophobicContact CD1-CG2 3.81Å; L165-E214 CarbonylContact O-C 3.56Å; L165-E214 VanDerWaalsContact O-CA 3.28Å; L165-E214 WeakPolarHBondContact O-CA 3.33Å; L165-F215 HydrophobicContact CB-CB 4.27Å; L165-F215 HydrophobicContact CB-CD2 4.19Å; L165-F215 PolarHBondContact N-O 3.31Å; L165-F215 PolarHBondContact O-N 2.85Å
166	S	98	Very high	95.5	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.028	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	130.8	176.1	-48.6	0	0	0	0	110.8	T157 L158 H160 V213	T157-S166 CarbonylContact C-O 3.53Å; T157-S166 WeakPolarHBondContact CA-O 3.12Å; L158-S166 PolarHBondContact N-O 3.22Å; L158-S166 PolarHBondContact O-N 2.9Å; H160-S166 PolarHBondContact CD2-OG 3.08Å; H160-S166 VanDerWaalsContact CD2-OG 3.27Å; H160-S166 PolarHBondContact NE2-OG 3.2Å; S166-V213 CarbonylContact C-O 3.56Å; S166-V213 WeakPolarHBondContact CA-O 3.34Å
167	F	98.5	Very high	95.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.3	165.8	-56.4	-19.9	0	0	0	109.5	I115 N117 T156 T157 Y169 I185 V202 L212 V213 F215	I115-F167 HydrophobicContact CG2-CE1 3.54Å; I115-F167 HydrophobicContact CG2-CZ 3.63Å; N117-F167 HydrophobicContact CB-CD1 4.22Å; N117-F167 HydrophobicContact CB-CD2 4.41Å; N117-F167 HydrophobicContact CB-CE1 4.24Å; N117-F167 HydrophobicContact CB-CE2 4.4Å; N117-F167 HydrophobicContact CB-CG 4.33Å; N117-F167 HydrophobicContact CB-CZ 4.33Å; T156-F167 CarbonylContact O-C 3.58Å; T156-F167 VanDerWaalsContact O-CA 3.27Å; T156-F167 WeakPolarHBondContact O-CA 3.44Å; T157-F167 HydrophobicContact CG2-CD1 4.01Å; T157-F167 HydrophobicContact CG2-CE1 3.79Å; T157-F167 WeakPolarHBondContact OG1-CD1 3.37Å; F167-Y169 HydrophobicContact CB-CE1 4.45Å; F167-I185 HydrophobicContact CE2-CG2 4.45Å; F167-I185 HydrophobicContact CZ-CG2 3.74Å; F167-V202 HydrophobicContact CD2-CG2 4.04Å; F167-V202 HydrophobicContact CE2-CG2 4.28Å; F167-L212 CarbonylContact O-C 3.44Å; F167-L212 WeakPolarHBondContact O-CA 3.38Å; F167-V213 HydrophobicContact CB-CB 4.23Å; F167-V213 PolarHBondContact N-O 3.22Å; F167-V213 PolarHBondContact O-N 3.35Å; F167-F215 AromaticContact CD2-CE2 3.74Å; F167-F215 HydrophobicContact CD2-CE2 3.74Å; F167-F215 HydrophobicContact CD2-CZ 4.35Å; F167-F215 HydrophobicContact CE1-CE2 4.43Å; F167-F215 AromaticContact CE2-CE2 3.51Å; F167-F215 HydrophobicContact CE2-CE2 3.51Å; F167-F215 HydrophobicContact CE2-CZ 4.01Å; F167-F215 HydrophobicContact CG-CE2 4.3Å; F167-F215 AromaticContact CZ-CE2 3.88Å; F167-F215 HydrophobicContact CZ-CE2 3.88Å
168	Y	98.5	Very high	95	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.047	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.6	173.3	-178.9	-99.8	0	0	0	110	Q59 A60 Q61 P62 T156 D170 T211 L212	Q59-Y168 HydrophobicContact CB-CE2 4.4Å; Q59-Y168 WeakPolarHBondContact O-CE2 3.44Å; Q59-Y168 PolarHBondContact O-OH 2.78Å; A60-Y168 WeakPolarHBondContact O-CE2 3.39Å; Q61-Y168 VanDerWaalsContact CA-CZ 3.48Å; Q61-Y168 HydrophobicContact CB-CD1 4.38Å; Q61-Y168 HydrophobicContact CB-CE1 3.7Å; Q61-Y168 HydrophobicContact CG-CD1 4.06Å; Q61-Y168 HydrophobicContact CG-CE1 3.79Å; Q61-Y168 PolarHBondContact N-OH 2.96Å; P62-Y168 VanDerWaalsContact CD-CG 3.47Å; P62-Y168 HydrophobicContact CG-CG 4.22Å; T156-Y168 PolarHBondContact N-O 3.47Å; T156-Y168 PolarHBondContact O-N 3.41Å; Y168-D170 HydrophobicContact CD1-CB 4.39Å; Y168-D170 HydrophobicContact CE1-CB 3.78Å; Y168-T211 WeakPolarHBondContact CA-O 3.13Å; Y168-L212 HydrophobicContact CD2-CB 4.33Å; Y168-L212 HydrophobicContact CD2-CD1 4.45Å
169	Y	98.2	Very high	94.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.8	-178	-48.7	-71	0	0	0	110.1	N117 M155 F167 S183 I207 K208 S209 G210 T211 V213	N117-Y169 WeakPolarHBondContact OD1-CE1 3.48Å; M155-Y169 HydrophobicContact CE-CD1 4.16Å; M155-Y169 HydrophobicContact CE-CE1 4.35Å; M155-Y169 HydrophobicContact CG-CD1 4.11Å; M155-Y169 HydrophobicContact SD-CD1 4.46Å; M155-Y169 HydrophobicContact SD-CE1 4.5Å; F167-Y169 HydrophobicContact CB-CE1 4.45Å; Y169-S183 WeakPolarHBondContact CE1-OG 3.48Å; Y169-S183 WeakPolarHBondContact OH-CB 3.48Å; Y169-S183 PolarHBondContact OH-OG 2.88Å; Y169-S183 VanDerWaalsContact OH-OG 3.11Å; Y169-I207 HydrophobicContact CD1-CG2 3.76Å; Y169-I207 HydrophobicContact CD2-CG2 4.41Å; Y169-I207 HydrophobicContact CE1-CB 4.5Å; Y169-I207 HydrophobicContact CE1-CG1 4.41Å; Y169-I207 HydrophobicContact CE1-CG2 3.67Å; Y169-I207 HydrophobicContact CE2-CB 4.42Å; Y169-I207 HydrophobicContact CE2-CG1 4.26Å; Y169-I207 HydrophobicContact CE2-CG2 4.34Å; Y169-I207 HydrophobicContact CG-CG2 4.13Å; Y169-K208 WeakPolarHBondContact CB-O 3.26Å; Y169-S209 CarbonylContact O-C 3.54Å; Y169-S209 WeakPolarHBondContact O-CA 3.3Å; Y169-G210 PolarHBondContact O-N 3Å; Y169-T211 HydrophobicContact CD2-CG2 4.25Å; Y169-T211 WeakPolarHBondContact CD2-O 3.08Å; Y169-T211 HydrophobicContact CE2-CG2 4.41Å; Y169-T211 PolarHBondContact N-O 3.45Å; Y169-T211 VanDerWaalsContact N-O 3.15Å; Y169-V213 HydrophobicContact CE2-CG2 3.78Å
170	D	96.9	Very high	94.6	Very high	39 Å²	39	54 Å²	54	21%	0.209	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.4	178.6	-163.9	29.7	0	0	0	110.7	T154 Y168 I172	T154-D170 PolarHBondContact N-O 2.8Å; T154-D170 PolarHBondContact O-N 3.38Å; Y168-D170 HydrophobicContact CD1-CB 4.39Å; Y168-D170 HydrophobicContact CE1-CB 3.78Å; D170-I172 PolarHBondContact O-N 2.9Å; D170-I172 VanDerWaalsContact O-N 3.08Å
171	N	95.7	Very high	94.5	Very high	90 Å²	90	52.8 Å²	52.8	48%	0.481	27%	0.271	S	S	.	.	S	Bend	trans	49.2	34.1	-179.6	-57.2	-48	0	0	0	114.9	T152 A153 P173 S209	T152-N171 VanDerWaalsContact O-CB 3.31Å; T152-N171 WeakPolarHBondContact O-CB 3.36Å; A153-N171 WeakPolarHBondContact CA-O 3.3Å; N171-P173 VanDerWaalsContact O-CD 3.29Å; N171-P173 WeakPolarHBondContact O-CD 3.14Å; N171-S209 WeakPolarHBondContact CA-OG 3.33Å; N171-S209 PolarHBondContact N-OG 3.47Å
172	I	96.1	Very high	94.6	Very high	10 Å²	10	52.4 Å²	52.4	5%	0.051	27%	0.265	C	S	.	.			trans	-70.8	117.8	168.6	-48.9	-53.2	0	0	0	108.6	A153 M155 D170 I176 L181 S209	A153-I172 HydrophobicContact CB-CD1 3.97Å; M155-I172 HydrophobicContact CE-CD1 4.07Å; M155-I172 HydrophobicContact CG-CD1 4.31Å; D170-I172 PolarHBondContact O-N 2.9Å; D170-I172 VanDerWaalsContact O-N 3.08Å; I172-I176 HydrophobicContact CG2-CG2 4.1Å; I172-L181 HydrophobicContact CG2-CD1 4.43Å; I172-L181 HydrophobicContact CG2-CD2 4.18Å; I172-S209 PolarHBondContact N-OG 2.81Å; I172-S209 PolarHBondContact O-OG 3.49Å; I172-S209 VanDerWaalsContact O-OG 3.07Å
173	P	94.2	Very high	95	Very high	16 Å²	16	46.7 Å²	46.7	10%	0.104	24%	0.235	C	C	.	.			trans	-63.8	149.9	177.9	-24.4	37.7	0	0	0	111.5	I144 V146 V151 N171 E175 I176	I144-P173 VanDerWaalsContact CD1-CD 3.41Å; I144-P173 HydrophobicContact CD1-CG 3.39Å; I144-P173 HydrophobicContact CG1-CG 4.26Å; V146-P173 HydrophobicContact CG2-CB 3.85Å; V146-P173 HydrophobicContact CG2-CG 3.8Å; V151-P173 HydrophobicContact CB-CG 4.12Å; V151-P173 HydrophobicContact CG1-CG 3.86Å; N171-P173 VanDerWaalsContact O-CD 3.29Å; N171-P173 WeakPolarHBondContact O-CD 3.14Å; P173-E175 VanDerWaalsContact C-N 3.31Å; P173-I176 WeakPolarHBondContact O-CG2 3.37Å
174	M	92.8	Very high	95.2	Very high	174 Å²	174	47.2 Å²	47.2	86%	0.857	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-24.8	-179.9	-65.1	-172.2	-63	0	0	112.2	I176	M174-I176 VanDerWaalsContact C-N 3.34Å
175	E	91.6	Very high	95.3	Very high	115 Å²	115	44.5 Å²	44.5	54%	0.537	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.5	-175.8	-55.9	78.3	-174.8	0	0	113.1	V146 P173 E177	V146-E175 HydrophobicContact CG1-CB 3.76Å; V146-E175 HydrophobicContact CG1-CG 4.23Å; P173-E175 VanDerWaalsContact C-N 3.31Å; E175-E177 PolarHBondContact O-N 3.28Å
176	I	92.1	Very high	95.1	Very high	32 Å²	32	47.5 Å²	47.5	16%	0.164	24%	0.236	C	C	.	.	S	Bend	trans	-63.9	136.2	178.5	-167.7	164.1	0	0	0	110.4	I119 I144 I172 P173 M174 E178 Q180 L181	I119-I176 HydrophobicContact CD1-CD1 4.25Å; I119-I176 HydrophobicContact CG2-CD1 3.91Å; I144-I176 HydrophobicContact CD1-CD1 3.93Å; I172-I176 HydrophobicContact CG2-CG2 4.1Å; P173-I176 WeakPolarHBondContact O-CG2 3.37Å; M174-I176 VanDerWaalsContact C-N 3.34Å; I176-E178 PolarHBondContact O-N 3.29Å; I176-Q180 HydrophobicContact CD1-CB 4.22Å; I176-Q180 HydrophobicContact CG1-CB 4.11Å; I176-L181 HydrophobicContact CD1-CD2 3.91Å; I176-L181 HydrophobicContact CD1-CG 4.44Å; I176-L181 HydrophobicContact CG2-CD1 3.82Å; I176-L181 HydrophobicContact CG2-CD2 4.29Å; I176-L181 HydrophobicContact CG2-CG 4.19Å
177	E	92	Very high	94.9	Very high	129 Å²	129	47.3 Å²	47.3	60%	0.603	24%	0.235	S	C	*	.			trans	-64.7	131.8	174.9	-65.9	-179.3	-177.6	0	0	110.8	E175 S179 Q180	E175-E177 PolarHBondContact O-N 3.28Å; E177-S179 PolarHBondContact O-N 3.44Å; E177-S179 PolarHBondContact OE2-OG 2.92Å; E177-Q180 HydrophobicContact CB-CG 4.03Å; E177-Q180 VanDerWaalsContact O-CB 3.32Å; E177-Q180 WeakPolarHBondContact O-CB 3.36Å; E177-Q180 PolarHBondContact O-N 3.33Å
178	E	92.9	Very high	94.4	Very high	128 Å²	128	50.7 Å²	50.7	60%	0.598	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-54.7	-30.7	178.3	-69.4	-167.2	171	0	0	112.8	I176 Q180 L181 V204	I176-E178 PolarHBondContact O-N 3.29Å; E178-Q180 PolarHBondContact O-N 3.13Å; E178-Q180 VanDerWaalsContact O-N 3.15Å; E178-L181 PolarHBondContact O-N 3.27Å; E178-V204 HydrophobicContact CB-CB 4.44Å; E178-V204 HydrophobicContact CB-CG1 3.59Å; E178-V204 HydrophobicContact CG-CG1 3.82Å
179	S	92.9	Very high	93.8	Very high	67 Å²	67	50.8 Å²	50.8	47%	0.469	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-59.4	-25.2	177.6	68.8	0	0	0	0	113.7	K120 E177	K120-S179 WeakPolarHBondContact CD-O 3.18Å; K120-S179 PolarHBondContact NZ-O 3.18Å; E177-S179 PolarHBondContact O-N 3.44Å; E177-S179 PolarHBondContact OE2-OG 2.92Å
180	Q	92.7	Very high	92.9	Very high	45 Å²	45	59.7 Å²	59.7	21%	0.21	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-84.7	-17.5	-177.1	-57.8	-60.7	-37	0	0	113.1	I119 K120 I176 E177 E178	I119-Q180 CarbonylContact C-O 3.52Å; I119-Q180 WeakPolarHBondContact CA-O 3.35Å; I119-Q180 HydrophobicContact CG2-CB 4.4Å; K120-Q180 PolarHBondContact N-O 2.87Å; I176-Q180 HydrophobicContact CD1-CB 4.22Å; I176-Q180 HydrophobicContact CG1-CB 4.11Å; E177-Q180 HydrophobicContact CB-CG 4.03Å; E177-Q180 VanDerWaalsContact O-CB 3.32Å; E177-Q180 WeakPolarHBondContact O-CB 3.36Å; E177-Q180 PolarHBondContact O-N 3.33Å; E178-Q180 PolarHBondContact O-N 3.13Å; E178-Q180 VanDerWaalsContact O-N 3.15Å
181	L	95.4	Very high	92	Very high	11 Å²	11	58.6 Å²	58.6	6%	0.058	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.8	-176.4	-62.7	175.7	0	0	0	109.6	I119 M155 I172 I176 E178 V204 I207	I119-L181 HydrophobicContact CD1-CD2 4.5Å; I119-L181 HydrophobicContact CG1-CD2 4.13Å; M155-L181 HydrophobicContact CE-CD2 3.71Å; I172-L181 HydrophobicContact CG2-CD1 4.43Å; I172-L181 HydrophobicContact CG2-CD2 4.18Å; I176-L181 HydrophobicContact CD1-CD2 3.91Å; I176-L181 HydrophobicContact CD1-CG 4.44Å; I176-L181 HydrophobicContact CG2-CD1 3.82Å; I176-L181 HydrophobicContact CG2-CD2 4.29Å; I176-L181 HydrophobicContact CG2-CG 4.19Å; E178-L181 PolarHBondContact O-N 3.27Å; L181-V204 HydrophobicContact CB-CG1 3.9Å; L181-V204 HydrophobicContact CD1-CG1 4.01Å; L181-I207 HydrophobicContact CB-CB 4.43Å; L181-I207 HydrophobicContact CB-CD1 4.08Å; L181-I207 HydrophobicContact CB-CG2 4.17Å; L181-I207 HydrophobicContact CD1-CB 4.14Å; L181-I207 HydrophobicContact CD1-CG2 4.05Å; L181-I207 HydrophobicContact CD2-CG2 3.99Å; L181-I207 HydrophobicContact CG-CG2 4.3Å
182	Q	95.3	Very high	91.1	Very high	44 Å²	44	57.2 Å²	57.2	21%	0.206	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	122.7	175	-171.6	170.3	-13.2	0	0	111.5	Y118 K120 E184	Y118-Q182 HydrophobicContact CE1-CB 3.98Å; Y118-Q182 HydrophobicContact CE1-CG 4.22Å; Y118-Q182 PolarHBondContact N-O 2.9Å; Y118-Q182 PolarHBondContact O-N 3.2Å; Y118-Q182 PolarHBondContact OH-OE1 2.73Å; K120-Q182 VanDerWaalsContact NZ-OE1 3.08Å; Q182-E184 PolarHBondContact NE2-OE2 2.97Å
183	S	97.4	Very high	90.3	Very high	1 Å²	1	66.3 Å²	66.3	1%	0.007	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	126.3	174.6	-56.8	0	0	0	0	109.4	F116 N117 Y169 V202	F116-S183 CarbonylContact O-C 3.6Å; F116-S183 VanDerWaalsContact O-CA 3.26Å; F116-S183 WeakPolarHBondContact O-CA 3.18Å; N117-S183 PolarHBondContact OD1-OG 3.21Å; Y169-S183 WeakPolarHBondContact CE1-OG 3.48Å; Y169-S183 WeakPolarHBondContact OH-CB 3.48Å; Y169-S183 PolarHBondContact OH-OG 2.88Å; Y169-S183 VanDerWaalsContact OH-OG 3.11Å; S183-V202 WeakPolarHBondContact O-CB 3.48Å; S183-V202 PolarHBondContact O-N 2.84Å
184	E	96.1	Very high	89.8	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.07	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	159.9	-175.3	59	-178.5	-133.2	0	0	111.7	F116 Q182 I200 L201	F116-E184 HydrophobicContact CB-CG 3.66Å; F116-E184 HydrophobicContact CD2-CG 3.69Å; F116-E184 VanDerWaalsContact CD2-OE1 3.24Å; F116-E184 WeakPolarHBondContact CD2-OE1 3.23Å; F116-E184 HydrophobicContact CG-CG 4.07Å; F116-E184 PolarHBondContact N-O 3.09Å; F116-E184 PolarHBondContact O-N 3.43Å; F116-E184 VanDerWaalsContact O-O 3.06Å; Q182-E184 PolarHBondContact NE2-OE2 2.97Å; E184-I200 WeakPolarHBondContact CA-O 3.21Å; E184-I200 VanDerWaalsContact CB-O 3.3Å; E184-I200 WeakPolarHBondContact CB-O 3.37Å; E184-L201 HydrophobicContact CB-CD2 3.99Å; E184-L201 HydrophobicContact CB-CG 4.5Å; E184-L201 WeakPolarHBondContact OE2-CD2 3.42Å
185	I	96.1	Very high	89.4	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.2	164.9	60.9	169.2	0	0	0	109.4	Y51 Y86 Y87 I115 L165 F167 E199 I200 F215	Y51-I185 HydrophobicContact CD1-CD1 4.11Å; Y51-I185 HydrophobicContact CE1-CD1 4.2Å; Y51-I185 HydrophobicContact CG-CD1 4.29Å; Y86-I185 HydrophobicContact CE2-CB 4.43Å; Y87-I185 HydrophobicContact CE2-CD1 4.48Å; Y87-I185 PolarHBondContact OH-O 3.2Å; I115-I185 HydrophobicContact CG1-CG2 4.31Å; I115-I185 HydrophobicContact CG2-CG2 4.32Å; L165-I185 HydrophobicContact CD1-CG2 3.81Å; F167-I185 HydrophobicContact CE2-CG2 4.45Å; F167-I185 HydrophobicContact CZ-CG2 3.74Å; I185-E199 WeakPolarHBondContact O-CA 3.31Å; I185-I200 HydrophobicContact CD1-CB 4.49Å; I185-I200 HydrophobicContact CD1-CD1 3.91Å; I185-I200 HydrophobicContact CG1-CB 3.78Å; I185-I200 HydrophobicContact CG1-CD1 4.05Å; I185-I200 HydrophobicContact CG1-CG1 4.25Å; I185-I200 PolarHBondContact N-O 3.14Å; I185-I200 PolarHBondContact O-N 3.16Å; I185-F215 HydrophobicContact CD1-CB 3.88Å; I185-F215 HydrophobicContact CD1-CD1 3.64Å; I185-F215 HydrophobicContact CD1-CD2 4.4Å; I185-F215 HydrophobicContact CD1-CE1 4.24Å; I185-F215 HydrophobicContact CD1-CG 3.71Å; I185-F215 HydrophobicContact CG1-CD1 4.07Å; I185-F215 HydrophobicContact CG1-CE1 4.16Å; I185-F215 HydrophobicContact CG1-CG 4.38Å; I185-F215 HydrophobicContact CG2-CD2 4.22Å; I185-F215 HydrophobicContact CG2-CE2 4.21Å
186	Y	94.8	Very high	89.2	Confident	66 Å²	66	64.4 Å²	64.4	26%	0.259	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.1	179.5	177.7	-91.7	0	0	0	110.3	Y86 G113 T114 F188 G197 H198 E199	Y86-Y186 WeakPolarHBondContact CE1-O 3.1Å; Y86-Y186 VanDerWaalsContact OH-C 3.31Å; Y86-Y186 PolarHBondContact OH-N 3.24Å; Y86-Y186 PolarHBondContact OH-O 3.43Å; G113-Y186 CarbonylContact C-O 3.56Å; G113-Y186 VanDerWaalsContact CA-O 3.27Å; G113-Y186 WeakPolarHBondContact CA-O 3.45Å; T114-Y186 PolarHBondContact N-O 3.15Å; T114-Y186 PolarHBondContact O-N 3.42Å; Y186-F188 AromaticContact CE1-CE1 3.99Å; Y186-F188 HydrophobicContact CE1-CE1 3.99Å; Y186-F188 HydrophobicContact CE1-CE2 4.45Å; Y186-F188 AromaticContact CE1-CZ 3.94Å; Y186-F188 HydrophobicContact CE1-CZ 3.94Å; Y186-G197 VanDerWaalsContact OH-CA 3.3Å; Y186-G197 WeakPolarHBondContact OH-CA 3.5Å; Y186-H198 CarbonylContact C-O 3.5Å; Y186-H198 VanDerWaalsContact CA-O 3.32Å; Y186-H198 WeakPolarHBondContact CA-O 3.38Å; Y186-E199 HydrophobicContact CD2-CB 4.18Å
187	G	92.5	Very high	89	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	170.2	176.6	0	0	0	0	0	112.7	H198	G187-H198 PolarHBondContact N-O 3.26Å; G187-H198 PolarHBondContact O-N 2.81Å
188	F	88.6	Confident	89	Confident	71 Å²	71	58.6 Å²	58.6	31%	0.311	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.2	178.8	-61.7	-73	0	0	0	111.3	I112 Y186 I195	I112-F188 WeakPolarHBondContact O-CD2 3.49Å; I112-F188 PolarHBondContact O-N 2.9Å; Y186-F188 AromaticContact CE1-CE1 3.99Å; Y186-F188 HydrophobicContact CE1-CE1 3.99Å; Y186-F188 HydrophobicContact CE1-CE2 4.45Å; Y186-F188 AromaticContact CE1-CZ 3.94Å; Y186-F188 HydrophobicContact CE1-CZ 3.94Å; F188-I195 HydrophobicContact CB-CG2 3.84Å; F188-I195 HydrophobicContact CD1-CG2 4.11Å; F188-I195 HydrophobicContact CG-CG2 4.3Å
189	I	85	Confident	88.9	Confident	14 Å²	14	56.9 Å²	56.9	7%	0.072	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	152	174.1	63.5	170.3	0	0	0	110.6	Y49 Y87 I195 T196 H198	Y49-I189 HydrophobicContact CD1-CG2 3.91Å; Y49-I189 HydrophobicContact CD2-CD1 4.49Å; Y49-I189 HydrophobicContact CE1-CB 4.11Å; Y49-I189 HydrophobicContact CE1-CD1 4.44Å; Y49-I189 HydrophobicContact CE1-CG2 3.5Å; Y49-I189 VanDerWaalsContact CE1-CG2 3.5Å; Y49-I189 HydrophobicContact CE2-CD1 4.31Å; Y87-I189 HydrophobicContact CD1-CG2 3.67Å; Y87-I189 HydrophobicContact CE1-CG2 3.9Å; I189-I195 WeakPolarHBondContact O-CA 3.4Å; I189-T196 WeakPolarHBondContact CG1-O 3.47Å; I189-T196 PolarHBondContact N-O 2.98Å; I189-T196 PolarHBondContact O-N 2.81Å; I189-H198 HydrophobicContact CD1-CB 3.92Å; I189-H198 HydrophobicContact CG1-CB 3.97Å; I189-H198 HydrophobicContact CG2-CB 3.82Å
190	R	79.6	Confident	89	Confident	187 Å²	187	53.8 Å²	53.8	71%	0.706	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.1	172	-176.6	178.2	-71.2	179.2	-2.3	109.5	D192	R190-D192 WeakPolarHBondContact CG-O 3.33Å
191	C	79.1	Confident	89.2	Confident	15 Å²	15	55.7 Å²	55.7	10%	0.101	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	102.1	173.1	-79.9	0	0	0	0	109	C30 Y193 V194	C30-C191 HydrophobicContact CB-CB 4.02Å; C30-C191 WeakPolarHBondContact CB-SG 3.48Å; C30-C191 WeakPolarHBondContact SG-CA 3.45Å; C30-C191 WeakPolarHBondContact SG-CB 3.41Å; C30-C191 CovalentContact SG-SG 2.03Å; C30-C191 PolarHBondContact SG-SG 3.47Å; C191-Y193 PolarHBondContact O-N 3.2Å; C191-V194 PolarHBondContact N-O 3.43Å; C191-V194 PolarHBondContact O-N 2.72Å; C191-V194 VanDerWaalsContact O-O 3.12Å
192	D	76.8	Confident	89.3	Confident	61 Å²	61	55.3 Å²	55.3	33%	0.326	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	-105	-171.2	-66.8	-26.2	0	0	0	112	R190	R190-D192 WeakPolarHBondContact CG-O 3.33Å
193	Y	78.7	Confident	89.3	Confident	201 Å²	201	54.6 Å²	54.6	79%	0.788	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	0.7	179.4	-59.6	-77.6	0	0	0	113.3	C191	C191-Y193 PolarHBondContact O-N 3.2Å
194	V	83.7	Confident	89.3	Confident	90 Å²	90	56.7 Å²	56.7	55%	0.545	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.9	-177.2	-175.9	0	0	0	0	109.5	C191	C191-V194 PolarHBondContact N-O 3.43Å; C191-V194 PolarHBondContact O-N 2.72Å; C191-V194 VanDerWaalsContact O-O 3.12Å
195	I	84	Confident	89.3	Confident	116 Å²	116	61 Å²	61	60%	0.595	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.1	167.3	-60.6	175	0	0	0	106.8	F188 I189	F188-I195 HydrophobicContact CB-CG2 3.84Å; F188-I195 HydrophobicContact CD1-CG2 4.11Å; F188-I195 HydrophobicContact CG-CG2 4.3Å; I189-I195 WeakPolarHBondContact O-CA 3.4Å
196	T	87.1	Confident	89.3	Confident	60 Å²	60	61.4 Å²	61.4	37%	0.368	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.7	-177.8	-51	0	0	0	0	109.6	I189	I189-T196 WeakPolarHBondContact CG1-O 3.47Å; I189-T196 PolarHBondContact N-O 2.98Å; I189-T196 PolarHBondContact O-N 2.81Å
197	G	89	Confident	89.5	Confident	33 Å²	33	58.4 Å²	58.4	34%	0.34	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.7	168.5	0	0	0	0	0	111	Y186	Y186-G197 VanDerWaalsContact OH-CA 3.3Å; Y186-G197 WeakPolarHBondContact OH-CA 3.5Å
198	H	90.3	Very high	89.7	Confident	5 Å²	5	63.1 Å²	63.1	2%	0.023	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.2	175.9	-178.8	-85.6	0	0	0	108.8	N32 Y49 Y87 Y186 G187 I189 I200	N32-H198 PolarHBondContact OD1-NE2 3.05Å; N32-H198 VanDerWaalsContact OD1-NE2 3.09Å; Y49-H198 VanDerWaalsContact CB-NE2 3.25Å; Y49-H198 WeakPolarHBondContact CB-NE2 3.03Å; Y87-H198 HydrophobicContact CE1-CB 3.89Å; Y87-H198 AromaticContact CE1-CG 3.97Å; Y87-H198 AromaticContact CE1-ND1 3.54Å; Y87-H198 AromaticContact CZ-ND1 3.72Å; Y87-H198 PolarHBondContact OH-ND1 3.37Å; Y87-H198 PolarHBondContact OH-O 3.08Å; Y186-H198 CarbonylContact C-O 3.5Å; Y186-H198 VanDerWaalsContact CA-O 3.32Å; Y186-H198 WeakPolarHBondContact CA-O 3.38Å; G187-H198 PolarHBondContact N-O 3.26Å; G187-H198 PolarHBondContact O-N 2.81Å; I189-H198 HydrophobicContact CD1-CB 3.92Å; I189-H198 HydrophobicContact CG1-CB 3.97Å; I189-H198 HydrophobicContact CG2-CB 3.82Å; H198-I200 WeakPolarHBondContact CE1-CG1 3.32Å
199	E	92.5	Very high	90.1	Very high	93 Å²	93	61.9 Å²	61.9	44%	0.435	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.5	-179.1	66.1	-171.3	-178.2	0	0	110.1	N32 I185 Y186	N32-E199 PolarHBondContact ND2-O 3.37Å; I185-E199 WeakPolarHBondContact O-CA 3.31Å; Y186-E199 HydrophobicContact CD2-CB 4.18Å
200	I	94.9	Very high	90.7	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	106.7	171.3	-56	172	0	0	0	106.9	H48 Y51 E184 I185 H198 F215	H48-I200 HydrophobicContact CB-CD1 3.63Å; H48-I200 HydrophobicContact CB-CG1 3.83Å; H48-I200 HydrophobicContact CB-CG2 4.16Å; Y51-I200 HydrophobicContact CD2-CD1 3.91Å; Y51-I200 HydrophobicContact CG-CD1 3.88Å; E184-I200 WeakPolarHBondContact CA-O 3.21Å; E184-I200 VanDerWaalsContact CB-O 3.3Å; E184-I200 WeakPolarHBondContact CB-O 3.37Å; I185-I200 HydrophobicContact CD1-CB 4.49Å; I185-I200 HydrophobicContact CD1-CD1 3.91Å; I185-I200 HydrophobicContact CG1-CB 3.78Å; I185-I200 HydrophobicContact CG1-CD1 4.05Å; I185-I200 HydrophobicContact CG1-CG1 4.25Å; I185-I200 PolarHBondContact N-O 3.14Å; I185-I200 PolarHBondContact O-N 3.16Å; H198-I200 WeakPolarHBondContact CE1-CG1 3.32Å; I200-F215 HydrophobicContact CB-CE1 4.34Å; I200-F215 HydrophobicContact CG2-CD1 4.18Å; I200-F215 HydrophobicContact CG2-CE1 3.65Å
201	L	95.7	Very high	91.6	Very high	85 Å²	85	52.9 Å²	52.9	45%	0.445	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	134.2	-179.8	-71.3	157.6	0	0	0	110.3	E184 P203	E184-L201 HydrophobicContact CB-CD2 3.99Å; E184-L201 HydrophobicContact CB-CG 4.5Å; E184-L201 WeakPolarHBondContact OE2-CD2 3.42Å; L201-P203 WeakPolarHBondContact O-CD 3.37Å
202	V	97.5	Very high	92.5	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.024	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-74.1	123.3	162.7	-177.5	0	0	0	0	107.5	M53 I55 F167 S183 V204 W206 I207 V213 F215	M53-V202 HydrophobicContact SD-CG2 4.3Å; I55-V202 HydrophobicContact CD1-CG1 4.32Å; F167-V202 HydrophobicContact CD2-CG2 4.04Å; F167-V202 HydrophobicContact CE2-CG2 4.28Å; S183-V202 WeakPolarHBondContact O-CB 3.48Å; S183-V202 PolarHBondContact O-N 2.84Å; V202-V204 PolarHBondContact O-N 3.44Å; V202-W206 HydrophobicContact CG1-CB 4.41Å; V202-I207 HydrophobicContact CB-CD1 4.46Å; V202-I207 HydrophobicContact CB-CG1 4.42Å; V202-I207 HydrophobicContact CG1-CD1 4.46Å; V202-I207 HydrophobicContact CG1-CG1 3.9Å; V202-V213 HydrophobicContact CG1-CG2 3.89Å; V202-V213 HydrophobicContact CG2-CG1 3.94Å; V202-V213 HydrophobicContact CG2-CG2 4.31Å; V202-F215 HydrophobicContact CG2-CE2 4.41Å; V202-F215 HydrophobicContact CG2-CZ 3.71Å
203	P	96.8	Very high	93.5	Very high	29 Å²	29	50.3 Å²	50.3	19%	0.188	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-62.7	127.4	178.7	-10.6	20	0	0	0	109.8	R44 L201 K205 W206	R44-P203 VanDerWaalsContact CZ-CG 3.44Å; L201-P203 WeakPolarHBondContact O-CD 3.37Å; P203-K205 HydrophobicContact CB-CG 4.5Å; P203-K205 PolarHBondContact O-N 3.32Å; P203-W206 WeakPolarHBondContact O-CB 3.48Å; P203-W206 PolarHBondContact O-N 3.14Å
204	V	96.6	Very high	94.4	Very high	44 Å²	44	41.5 Å²	41.5	27%	0.267	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-55.3	-34.1	-167.6	-179.1	0	0	0	0	113.3	E178 L181 V202 W206 I207	E178-V204 HydrophobicContact CB-CB 4.44Å; E178-V204 HydrophobicContact CB-CG1 3.59Å; E178-V204 HydrophobicContact CG-CG1 3.82Å; L181-V204 HydrophobicContact CB-CG1 3.9Å; L181-V204 HydrophobicContact CD1-CG1 4.01Å; V202-V204 PolarHBondContact O-N 3.44Å; V204-W206 PolarHBondContact O-N 3.29Å; V204-I207 WeakPolarHBondContact O-CB 3.28Å; V204-I207 PolarHBondContact O-N 2.98Å
205	K	95.5	Very high	95.1	Very high	105 Å²	105	37.2 Å²	37.2	46%	0.457	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-56	-20.2	176.1	72.1	178.7	-173.1	174.4	0	114.9	E39 P203 K208	E39-K205 WeakPolarHBondContact OE1-CE 3.46Å; E39-K205 IonicContact OE1-NZ 3.36Å; E39-K205 PolarHBondContact OE1-NZ 3.36Å; P203-K205 HydrophobicContact CB-CG 4.5Å; P203-K205 PolarHBondContact O-N 3.32Å; K205-K208 WeakPolarHBondContact O-CD 3.19Å; K205-K208 WeakPolarHBondContact O-CE 3.21Å
206	W	97.3	Very high	95.5	Very high	10 Å²	10	33.4 Å²	33.4	4%	0.038	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-93	-15.7	177.7	-70.6	100.1	0	0	0	113.7	E39 N40 R44 I55 R57 V202 P203 V204 K208 T211	E39-W206 HydrophobicContact CG-CZ2 4.1Å; N40-W206 WeakPolarHBondContact O-CH2 3.27Å; N40-W206 WeakPolarHBondContact O-CZ2 3.35Å; R44-W206 HydrophobicContact CB-CH2 4.06Å; R44-W206 HydrophobicContact CB-CZ2 3.62Å; I55-W206 HydrophobicContact CB-CD2 4.37Å; I55-W206 HydrophobicContact CB-CE3 4.17Å; I55-W206 HydrophobicContact CD1-CB 4.01Å; I55-W206 HydrophobicContact CD1-CD2 4.21Å; I55-W206 HydrophobicContact CD1-CG 3.8Å; I55-W206 HydrophobicContact CG2-CB 4.03Å; I55-W206 HydrophobicContact CG2-CD2 3.73Å; I55-W206 HydrophobicContact CG2-CE3 3.31Å; I55-W206 HydrophobicContact CG2-CG 4.04Å; I55-W206 HydrophobicContact CG2-CZ3 3.98Å; R57-W206 HydrophobicContact CG-CE3 3.96Å; R57-W206 HydrophobicContact CG-CZ3 3.75Å; V202-W206 HydrophobicContact CG1-CB 4.41Å; P203-W206 WeakPolarHBondContact O-CB 3.48Å; P203-W206 PolarHBondContact O-N 3.14Å; V204-W206 PolarHBondContact O-N 3.29Å; W206-K208 PolarHBondContact O-N 2.91Å; W206-T211 VanDerWaalsContact O-CB 3.3Å; W206-T211 WeakPolarHBondContact O-CB 3.24Å; W206-T211 VanDerWaalsContact O-CG2 3.24Å; W206-T211 WeakPolarHBondContact O-CG2 3.49Å; W206-T211 PolarHBondContact O-OG1 2.93Å; W206-T211 VanDerWaalsContact O-OG1 3.06Å
207	I	97.5	Very high	95.6	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.015	18%	0.183	C	C	.	.			trans	-76.3	79	177.9	-55	178.1	0	0	0	108.6	M155 Y169 L181 V202 V204	M155-I207 HydrophobicContact CE-CG2 3.8Å; Y169-I207 HydrophobicContact CD1-CG2 3.76Å; Y169-I207 HydrophobicContact CD2-CG2 4.41Å; Y169-I207 HydrophobicContact CE1-CB 4.5Å; Y169-I207 HydrophobicContact CE1-CG1 4.41Å; Y169-I207 HydrophobicContact CE1-CG2 3.67Å; Y169-I207 HydrophobicContact CE2-CB 4.42Å; Y169-I207 HydrophobicContact CE2-CG1 4.26Å; Y169-I207 HydrophobicContact CE2-CG2 4.34Å; Y169-I207 HydrophobicContact CG-CG2 4.13Å; L181-I207 HydrophobicContact CB-CB 4.43Å; L181-I207 HydrophobicContact CB-CD1 4.08Å; L181-I207 HydrophobicContact CB-CG2 4.17Å; L181-I207 HydrophobicContact CD1-CB 4.14Å; L181-I207 HydrophobicContact CD1-CG2 4.05Å; L181-I207 HydrophobicContact CD2-CG2 3.99Å; L181-I207 HydrophobicContact CG-CG2 4.3Å; V202-I207 HydrophobicContact CB-CD1 4.46Å; V202-I207 HydrophobicContact CB-CG1 4.42Å; V202-I207 HydrophobicContact CG1-CD1 4.46Å; V202-I207 HydrophobicContact CG1-CG1 3.9Å; V204-I207 WeakPolarHBondContact O-CB 3.28Å; V204-I207 PolarHBondContact O-N 2.98Å
208	K	96.6	Very high	95.3	Very high	98 Å²	98	32.1 Å²	32.1	43%	0.426	17%	0.173	S	C	.	.	S	Bend	trans	-138.8	155	-175.9	-67	-177.8	176.2	173.2	0	109.9	Y169 K205 W206 G210 T211	Y169-K208 WeakPolarHBondContact CB-O 3.26Å; K205-K208 WeakPolarHBondContact O-CD 3.19Å; K205-K208 WeakPolarHBondContact O-CE 3.21Å; W206-K208 PolarHBondContact O-N 2.91Å; K208-G210 PolarHBondContact O-N 3.41Å; K208-T211 VanDerWaalsContact O-CB 3.28Å; K208-T211 WeakPolarHBondContact O-CB 3.41Å; K208-T211 PolarHBondContact O-N 3.48Å; K208-T211 VanDerWaalsContact O-N 3.11Å; K208-T211 PolarHBondContact O-OG1 2.93Å
209	S	97.3	Very high	94.5	Very high	46 Å²	46	32.8 Å²	32.8	32%	0.322	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	133.9	176.3	-55.7	0	0	0	0	112.4	Y169 N171 I172 T211	Y169-S209 CarbonylContact O-C 3.54Å; Y169-S209 WeakPolarHBondContact O-CA 3.3Å; N171-S209 WeakPolarHBondContact CA-OG 3.33Å; N171-S209 PolarHBondContact N-OG 3.47Å; I172-S209 PolarHBondContact N-OG 2.81Å; I172-S209 PolarHBondContact O-OG 3.49Å; I172-S209 VanDerWaalsContact O-OG 3.07Å; S209-T211 VanDerWaalsContact C-N 3.32Å
210	G	97.6	Very high	93.5	Very high	12 Å²	12	34.4 Å²	34.4	12%	0.124	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	16.2	-179	0	0	0	0	0	114.2	R57 N58 Q59 Y169 K208	R57-G210 CarbonylContact C-O 3.57Å; N58-G210 PolarHBondContact N-O 2.93Å; Q59-G210 PolarHBondContact N-O 3.01Å; Y169-G210 PolarHBondContact O-N 3Å; K208-G210 PolarHBondContact O-N 3.41Å
211	T	98.4	Very high	92.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.1	173	-59.7	0	0	0	0	111	I55 Q56 Y168 Y169 W206 K208 S209 V213	I55-T211 HydrophobicContact CG2-CG2 3.43Å; I55-T211 VanDerWaalsContact CG2-CG2 3.43Å; Q56-T211 CarbonylContact O-C 3.41Å; Q56-T211 WeakPolarHBondContact O-CA 3.47Å; Y168-T211 WeakPolarHBondContact CA-O 3.13Å; Y169-T211 HydrophobicContact CD2-CG2 4.25Å; Y169-T211 WeakPolarHBondContact CD2-O 3.08Å; Y169-T211 HydrophobicContact CE2-CG2 4.41Å; Y169-T211 PolarHBondContact N-O 3.45Å; Y169-T211 VanDerWaalsContact N-O 3.15Å; W206-T211 VanDerWaalsContact O-CB 3.3Å; W206-T211 WeakPolarHBondContact O-CB 3.24Å; W206-T211 VanDerWaalsContact O-CG2 3.24Å; W206-T211 WeakPolarHBondContact O-CG2 3.49Å; W206-T211 PolarHBondContact O-OG1 2.93Å; W206-T211 VanDerWaalsContact O-OG1 3.06Å; K208-T211 VanDerWaalsContact O-CB 3.28Å; K208-T211 WeakPolarHBondContact O-CB 3.41Å; K208-T211 PolarHBondContact O-N 3.48Å; K208-T211 VanDerWaalsContact O-N 3.11Å; K208-T211 PolarHBondContact O-OG1 2.93Å; S209-T211 VanDerWaalsContact C-N 3.32Å; T211-V213 HydrophobicContact CG2-CG2 4.25Å
212	L	98.5	Very high	91.6	Very high	21 Å²	21	34.2 Å²	34.2	11%	0.11	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.2	169.4	-179.6	64.7	0	0	0	109.2	I55 Q56 Q59 F167 Y168 E214	I55-L212 CarbonylContact C-O 3.49Å; I55-L212 WeakPolarHBondContact CA-O 3.5Å; Q56-L212 PolarHBondContact N-O 3.43Å; Q56-L212 PolarHBondContact O-N 2.9Å; Q59-L212 HydrophobicContact CB-CB 3.97Å; Q59-L212 HydrophobicContact CG-CB 3.82Å; F167-L212 CarbonylContact O-C 3.44Å; F167-L212 WeakPolarHBondContact O-CA 3.38Å; Y168-L212 HydrophobicContact CD2-CB 4.33Å; Y168-L212 HydrophobicContact CD2-CD1 4.45Å; L212-E214 HydrophobicContact CD1-CG 4.49Å; L212-E214 HydrophobicContact CD2-CG 4.41Å; L212-E214 HydrophobicContact CG-CG 4.2Å
213	V	98.5	Very high	90.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.9	172.2	-178.2	0	0	0	0	108	M53 R54 I55 S166 F167 Y169 V202 T211 F215	M53-V213 HydrophobicContact CG-CG1 3.81Å; M53-V213 HydrophobicContact SD-CG1 4.04Å; R54-V213 CarbonylContact O-C 3.57Å; R54-V213 VanDerWaalsContact O-CA 3.32Å; R54-V213 WeakPolarHBondContact O-CA 3.07Å; I55-V213 HydrophobicContact CD1-CG2 4.42Å; I55-V213 HydrophobicContact CG1-CG1 4.19Å; I55-V213 HydrophobicContact CG1-CG2 4.11Å; I55-V213 HydrophobicContact CG2-CG2 4.06Å; S166-V213 CarbonylContact C-O 3.56Å; S166-V213 WeakPolarHBondContact CA-O 3.34Å; F167-V213 HydrophobicContact CB-CB 4.23Å; F167-V213 PolarHBondContact N-O 3.22Å; F167-V213 PolarHBondContact O-N 3.35Å; Y169-V213 HydrophobicContact CE2-CG2 3.78Å; V202-V213 HydrophobicContact CG1-CG2 3.89Å; V202-V213 HydrophobicContact CG2-CG1 3.94Å; V202-V213 HydrophobicContact CG2-CG2 4.31Å; T211-V213 HydrophobicContact CG2-CG2 4.25Å; V213-F215 HydrophobicContact CG1-CD2 4.37Å; V213-F215 HydrophobicContact CG1-CE1 4.4Å; V213-F215 HydrophobicContact CG1-CE2 3.69Å; V213-F215 HydrophobicContact CG1-CZ 3.73Å
214	E	97.9	Very high	89.5	Confident	17 Å²	17	38.6 Å²	38.6	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.2	177.1	-71.9	173	108.6	0	0	110.8	M53 R54 K164 L165 L212	M53-E214 CarbonylContact C-O 3.54Å; M53-E214 WeakPolarHBondContact CA-O 3.18Å; R54-E214 IonicContact CZ-OE2 2.82Å; R54-E214 PolarHBondContact N-O 2.84Å; R54-E214 IonicContact NE-OE2 3.2Å; R54-E214 PolarHBondContact NE-OE2 3.05Å; R54-E214 IonicContact NH2-OE1 2.9Å; R54-E214 IonicContact NH2-OE2 3.54Å; R54-E214 PolarHBondContact NH2-OE2 2.83Å; R54-E214 PolarHBondContact O-N 3.03Å; K164-E214 IonicContact NZ-OE1 2.65Å; K164-E214 PolarHBondContact NZ-OE1 3.06Å; L165-E214 CarbonylContact O-C 3.56Å; L165-E214 VanDerWaalsContact O-CA 3.28Å; L165-E214 WeakPolarHBondContact O-CA 3.33Å; L212-E214 HydrophobicContact CD1-CG 4.49Å; L212-E214 HydrophobicContact CD2-CG 4.41Å; L212-E214 HydrophobicContact CG-CG 4.2Å
215	F	96.5	Very high	88.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.6	171.3	-53.6	-90	0	0	0	109.5	Y51 S52 M53 K164 L165 F167 I185 I200 V202 V213	Y51-F215 HydrophobicContact CD1-CB 4.16Å; S52-F215 VanDerWaalsContact O-CA 3.31Å; S52-F215 WeakPolarHBondContact O-CA 3.42Å; M53-F215 HydrophobicContact CB-CD1 4.04Å; M53-F215 HydrophobicContact CB-CE1 4.05Å; M53-F215 HydrophobicContact CG-CD1 4.16Å; M53-F215 HydrophobicContact CG-CE1 3.79Å; M53-F215 HydrophobicContact CG-CZ 4.37Å; M53-F215 HydrophobicContact SD-CE1 3.65Å; M53-F215 HydrophobicContact SD-CZ 4.03Å; K164-F215 WeakPolarHBondContact CA-O 3.45Å; K164-F215 WeakPolarHBondContact CG-O 3.46Å; L165-F215 HydrophobicContact CB-CB 4.27Å; L165-F215 HydrophobicContact CB-CD2 4.19Å; L165-F215 PolarHBondContact N-O 3.31Å; L165-F215 PolarHBondContact O-N 2.85Å; F167-F215 AromaticContact CD2-CE2 3.74Å; F167-F215 HydrophobicContact CD2-CE2 3.74Å; F167-F215 HydrophobicContact CD2-CZ 4.35Å; F167-F215 HydrophobicContact CE1-CE2 4.43Å; F167-F215 AromaticContact CE2-CE2 3.51Å; F167-F215 HydrophobicContact CE2-CE2 3.51Å; F167-F215 HydrophobicContact CE2-CZ 4.01Å; F167-F215 HydrophobicContact CG-CE2 4.3Å; F167-F215 AromaticContact CZ-CE2 3.88Å; F167-F215 HydrophobicContact CZ-CE2 3.88Å; I185-F215 HydrophobicContact CD1-CB 3.88Å; I185-F215 HydrophobicContact CD1-CD1 3.64Å; I185-F215 HydrophobicContact CD1-CD2 4.4Å; I185-F215 HydrophobicContact CD1-CE1 4.24Å; I185-F215 HydrophobicContact CD1-CG 3.71Å; I185-F215 HydrophobicContact CG1-CD1 4.07Å; I185-F215 HydrophobicContact CG1-CE1 4.16Å; I185-F215 HydrophobicContact CG1-CG 4.38Å; I185-F215 HydrophobicContact CG2-CD2 4.22Å; I185-F215 HydrophobicContact CG2-CE2 4.21Å; I200-F215 HydrophobicContact CB-CE1 4.34Å; I200-F215 HydrophobicContact CG2-CD1 4.18Å; I200-F215 HydrophobicContact CG2-CE1 3.65Å; V202-F215 HydrophobicContact CG2-CE2 4.41Å; V202-F215 HydrophobicContact CG2-CZ 3.71Å; V213-F215 HydrophobicContact CG1-CD2 4.37Å; V213-F215 HydrophobicContact CG1-CE1 4.4Å; V213-F215 HydrophobicContact CG1-CE2 3.69Å; V213-F215 HydrophobicContact CG1-CZ 3.73Å
216	E	93.1	Very high	88	Confident	36 Å²	36	40 Å²	40	17%	0.168	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.3	177.9	-171.1	174.5	-139.9	0	0	109.5	Y51 S52 V218 I254 K262	Y51-E216 CarbonylContact C-O 3.56Å; Y51-E216 WeakPolarHBondContact CA-O 3.21Å; S52-E216 PolarHBondContact N-O 2.89Å; S52-E216 PolarHBondContact O-N 2.86Å; S52-E216 PolarHBondContact OG-O 2.87Å; E216-V218 PolarHBondContact O-N 3.32Å; E216-I254 HydrophobicContact CG-CD1 4.09Å; E216-K262 IonicContact OE2-NZ 2.8Å
217	A	88.8	Confident	87.5	Confident	45 Å²	45	42.7 Å²	42.7	37%	0.372	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	129	174.7	0	0	0	0	0	109.8	K50 Y51 I254	K50-A217 CarbonylContact O-C 3.57Å; K50-A217 VanDerWaalsContact O-CA 3.3Å; K50-A217 WeakPolarHBondContact O-CA 3.12Å; Y51-A217 HydrophobicContact CE1-CB 4.43Å; A217-I254 WeakPolarHBondContact O-CD1 3.44Å
218	V	82.5	Confident	86.9	Confident	21 Å²	21	44.8 Å²	44.8	13%	0.127	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-85.6	126.6	175.7	-178.1	0	0	0	0	107.9	L47 K50 E216 I251	L47-V218 HydrophobicContact CD2-CG2 4.1Å; K50-V218 PolarHBondContact O-N 2.86Å; E216-V218 PolarHBondContact O-N 3.32Å; V218-I251 HydrophobicContact CG1-CB 4.32Å; V218-I251 HydrophobicContact CG1-CG2 4.26Å
219	G	75.4	Confident	86.5	Confident	18 Å²	18	46.8 Å²	46.8	19%	0.186	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-67.9	150.7	176.5	0	0	0	0	0	112.6	S223 E252	G219-S223 PolarHBondContact O-OG 3.23Å; G219-E252 VanDerWaalsContact CA-OE1 3.24Å; G219-E252 WeakPolarHBondContact CA-OE1 3.26Å; G219-E252 WeakPolarHBondContact CA-OE2 3.38Å
220	E	70.8	Confident	86	Confident	127 Å²	127	47.3 Å²	47.3	59%	0.593	25%	0.25	S	S	*	.	H	α-helix	trans	-85.3	-18.4	-170.8	-60.5	-174.4	168.8	0	0	113.8	K50 E252	K50-E220 WeakPolarHBondContact CE-OE1 3.32Å; K50-E220 IonicContact NZ-OE1 2.62Å; K50-E220 PolarHBondContact NZ-OE1 2.87Å; E220-E252 PolarHBondContact N-OE1 3.17Å; E220-E252 VanDerWaalsContact N-OE1 3.15Å
221	I	72.1	Confident	85.5	Confident	82 Å²	82	46.8 Å²	46.8	42%	0.421	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-47.5	-172	-56.1	173	0	0	0	110	Q224 Y225 T239 E252	I221-Q224 VanDerWaalsContact O-CG 3.25Å; I221-Q224 WeakPolarHBondContact O-CG 3.45Å; I221-Q224 PolarHBondContact O-NE2 3.27Å; I221-Y225 WeakPolarHBondContact O-CE2 3.45Å; I221-T239 HydrophobicContact CB-CG2 4.31Å; I221-T239 HydrophobicContact CD1-CG2 4.31Å; I221-T239 HydrophobicContact CG2-CG2 4.32Å; I221-E252 WeakPolarHBondContact CA-OE1 3.43Å; I221-E252 WeakPolarHBondContact CB-OE1 3.42Å; I221-E252 WeakPolarHBondContact CG1-OE1 3.42Å; I221-E252 PolarHBondContact N-OE1 3.06Å
222	C	78.8	Confident	84.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-79.6	-31.6	-179	-61.5	0	0	0	0	112.4	Q224 Y225 C241 C250 E252	C222-Q224 PolarHBondContact O-N 3Å; C222-Y225 VanDerWaalsContact O-CD2 3.29Å; C222-Y225 WeakPolarHBondContact O-CD2 3.31Å; C222-Y225 PolarHBondContact O-N 3.3Å; C222-C241 HydrophobicContact CB-CB 3.81Å; C222-C241 WeakPolarHBondContact CB-SG 3.5Å; C222-C241 WeakPolarHBondContact SG-CA 3.42Å; C222-C241 WeakPolarHBondContact SG-CB 3.13Å; C222-C241 CovalentContact SG-SG 2.02Å; C222-C241 PolarHBondContact SG-SG 2.8Å; C222-C250 CarbonylContact C-O 3.53Å; C222-C250 VanDerWaalsContact O-CB 3.23Å; C222-C250 WeakPolarHBondContact O-CB 3.41Å; C222-C250 PolarHBondContact O-SG 2.85Å; C222-E252 HydrophobicContact CB-CG 3.68Å; C222-E252 PolarHBondContact N-OE1 2.97Å; C222-E252 WeakPolarHBondContact SG-CG 3.16Å
223	S	75	Confident	84.2	Confident	34 Å²	34	57.1 Å²	57.1	24%	0.238	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-12.2	-176.2	-60.3	0	0	0	0	114.9	G219 Y225 C250	G219-S223 PolarHBondContact O-OG 3.23Å; S223-Y225 VanDerWaalsContact C-N 3.34Å; S223-C250 VanDerWaalsContact CA-O 3.28Å; S223-C250 WeakPolarHBondContact CA-O 3.49Å; S223-C250 PolarHBondContact N-O 3.03Å; S223-C250 PolarHBondContact OG-O 3.31Å
224	Q	74.4	Confident	83.5	Confident	91 Å²	91	57.6 Å²	57.6	43%	0.425	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-20.6	173.3	75.3	-167.9	-38.6	0	0	113.8	I221 C222	I221-Q224 VanDerWaalsContact O-CG 3.25Å; I221-Q224 WeakPolarHBondContact O-CG 3.45Å; I221-Q224 PolarHBondContact O-NE2 3.27Å; C222-Q224 PolarHBondContact O-N 3Å
225	Y	80.9	Confident	82.7	Confident	71 Å²	71	59.7 Å²	59.7	28%	0.278	31%	0.314	S	S	.	.			trans	-87.3	123.2	-176.4	-57	-73.6	0	0	0	111.1	I221 C222 S223 A234 C250	I221-Y225 WeakPolarHBondContact O-CE2 3.45Å; C222-Y225 VanDerWaalsContact O-CD2 3.29Å; C222-Y225 WeakPolarHBondContact O-CD2 3.31Å; C222-Y225 PolarHBondContact O-N 3.3Å; S223-Y225 VanDerWaalsContact C-N 3.34Å; Y225-A234 HydrophobicContact CD1-CB 4.25Å; Y225-A234 HydrophobicContact CD2-CB 3.44Å; Y225-A234 VanDerWaalsContact CD2-CB 3.44Å; Y225-A234 HydrophobicContact CE1-CB 3.87Å; Y225-A234 HydrophobicContact CE2-CB 3.03Å; Y225-A234 HydrophobicContact CG-CB 4.05Å; Y225-C250 VanDerWaalsContact O-CB 3.3Å; Y225-C250 WeakPolarHBondContact O-CB 3.3Å
226	K	81	Confident	81.8	Confident	108 Å²	108	63.6 Å²	63.6	47%	0.47	34%	0.338	S	S	.	.			trans	-104.6	4.8	-171.4	-59.2	-169.5	-179.5	-171.9	0	114.1	N25 W243	N25-K226 PolarHBondContact OD1-NZ 3.01Å; K226-W243 VanDerWaalsContact C-CH2 3.42Å; K226-W243 VanDerWaalsContact O-CH2 3.27Å; K226-W243 WeakPolarHBondContact O-CH2 3.47Å
227	T	84.9	Confident	80.8	Confident	66 Å²	66	67.6 Å²	67.6	41%	0.405	37%	0.37	S	S	.	.	S	Bend	trans	-133.7	150.6	176.1	69.9	0	0	0	0	110.2	E229 T230 C231 W243	T227-E229 VanDerWaalsContact C-N 3.3Å; T227-E229 PolarHBondContact O-N 2.65Å; T227-T230 PolarHBondContact N-OG1 3.43Å; T227-T230 PolarHBondContact O-N 3.36Å; T227-T230 PolarHBondContact O-OG1 3.05Å; T227-T230 VanDerWaalsContact O-OG1 3.06Å; T227-T230 WeakPolarHBondContact OG1-CB 3.36Å; T227-T230 VanDerWaalsContact OG1-CG2 3.31Å; T227-T230 WeakPolarHBondContact OG1-CG2 3.4Å; T227-T230 PolarHBondContact OG1-N 2.9Å; T227-T230 PolarHBondContact OG1-OG1 3.31Å; T227-C231 VanDerWaalsContact O-CB 3.3Å; T227-C231 WeakPolarHBondContact O-CB 3.34Å; T227-C231 PolarHBondContact O-N 3.26Å; T227-W243 VanDerWaalsContact C-CZ3 3.46Å
228	N	86.3	Confident	80.1	Confident	48 Å²	48	72.4 Å²	72.4	26%	0.257	39%	0.389	S	S	.	.	H	α-helix	trans	-51.5	-50.1	176.2	-169.7	-8	0	0	0	111.7	T230 C231 Q232 W243 E245	N228-T230 PolarHBondContact O-N 3.13Å; N228-C231 WeakPolarHBondContact O-CB 3.4Å; N228-C231 PolarHBondContact O-N 2.7Å; N228-Q232 WeakPolarHBondContact O-CG 3.19Å; N228-Q232 PolarHBondContact O-N 2.71Å; N228-Q232 WeakPolarHBondContact OD1-CG 3.32Å; N228-Q232 PolarHBondContact OD1-NE2 3.38Å; N228-W243 HydrophobicContact CB-CB 4.29Å; N228-W243 VanDerWaalsContact CB-CD1 3.45Å; N228-W243 HydrophobicContact CB-CD2 3.84Å; N228-W243 HydrophobicContact CB-CG 3.61Å; N228-W243 WeakPolarHBondContact OD1-CB 3.35Å; N228-E245 PolarHBondContact ND2-OE1 3.31Å
229	E	87.1	Confident	79.8	Confident	140 Å²	140	72.4 Å²	72.4	65%	0.654	39%	0.39	S	S	*	.	H	α-helix	trans	-58.9	-46.8	179.6	-174.5	-178.1	-175.1	0	0	112.7	T227 C231 N233	T227-E229 VanDerWaalsContact C-N 3.3Å; T227-E229 PolarHBondContact O-N 2.65Å; E229-C231 VanDerWaalsContact C-N 3.33Å; E229-C231 PolarHBondContact O-N 3.23Å; E229-N233 WeakPolarHBondContact O-CB 3.08Å; E229-N233 PolarHBondContact O-N 3.49Å; E229-N233 VanDerWaalsContact O-N 3.08Å; E229-N233 PolarHBondContact O-ND2 2.88Å; E229-N233 VanDerWaalsContact O-ND2 3.12Å
230	T	88.6	Confident	80.2	Confident	57 Å²	57	73.7 Å²	73.7	35%	0.35	39%	0.394	S	S	.	.	H	α-helix	trans	-69.8	-33.7	180	55.8	0	0	0	0	112.1	T227 N228 A234	T227-T230 PolarHBondContact N-OG1 3.43Å; T227-T230 PolarHBondContact O-N 3.36Å; T227-T230 PolarHBondContact O-OG1 3.05Å; T227-T230 VanDerWaalsContact O-OG1 3.06Å; T227-T230 WeakPolarHBondContact OG1-CB 3.36Å; T227-T230 VanDerWaalsContact OG1-CG2 3.31Å; T227-T230 WeakPolarHBondContact OG1-CG2 3.4Å; T227-T230 PolarHBondContact OG1-N 2.9Å; T227-T230 PolarHBondContact OG1-OG1 3.31Å; N228-T230 PolarHBondContact O-N 3.13Å; T230-A234 WeakPolarHBondContact O-CB 3.46Å; T230-A234 PolarHBondContact O-N 2.93Å
231	C	86	Confident	80.8	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-64.2	-50.7	175	-178.1	0	0	0	0	111.8	T227 N228 E229 N233 A234 C241 I242 W243 C250	T227-C231 VanDerWaalsContact O-CB 3.3Å; T227-C231 WeakPolarHBondContact O-CB 3.34Å; T227-C231 PolarHBondContact O-N 3.26Å; N228-C231 WeakPolarHBondContact O-CB 3.4Å; N228-C231 PolarHBondContact O-N 2.7Å; E229-C231 VanDerWaalsContact C-N 3.33Å; E229-C231 PolarHBondContact O-N 3.23Å; C231-N233 VanDerWaalsContact C-N 3.34Å; C231-N233 PolarHBondContact O-N 2.84Å; C231-A234 WeakPolarHBondContact O-CB 3.25Å; C231-A234 PolarHBondContact O-N 2.85Å; C231-C241 WeakPolarHBondContact O-CB 3.36Å; C231-I242 PolarHBondContact SG-O 2.78Å; C231-W243 HydrophobicContact CB-CB 4.21Å; C231-W243 HydrophobicContact CB-CD2 4.48Å; C231-W243 HydrophobicContact CB-CE3 3.7Å; C231-W243 HydrophobicContact CB-CZ3 4.49Å; C231-W243 PolarHBondContact SG-N 3.12Å; C231-W243 VanDerWaalsContact SG-N 3.45Å; C231-C250 WeakPolarHBondContact CA-SG 3.29Å; C231-C250 HydrophobicContact CB-CB 3.58Å; C231-C250 WeakPolarHBondContact CB-SG 3.5Å; C231-C250 WeakPolarHBondContact SG-CB 3.28Å; C231-C250 CovalentContact SG-SG 2.01Å; C231-C250 PolarHBondContact SG-SG 3.38Å
232	Q	84.5	Confident	81.3	Confident	117 Å²	117	65 Å²	65	55%	0.547	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-43.2	179.5	-70.1	-178	-5.2	0	0	111.5	N228 A234 T235	N228-Q232 WeakPolarHBondContact O-CG 3.19Å; N228-Q232 PolarHBondContact O-N 2.71Å; N228-Q232 WeakPolarHBondContact OD1-CG 3.32Å; N228-Q232 PolarHBondContact OD1-NE2 3.38Å; Q232-A234 PolarHBondContact O-N 2.87Å; Q232-T235 PolarHBondContact O-N 2.82Å; Q232-T235 PolarHBondContact O-OG1 2.98Å
233	N	86.2	Confident	81.5	Confident	122 Å²	122	66.2 Å²	66.2	65%	0.652	36%	0.357	S	S	*	.	H	α-helix	trans	-69.2	-15.5	179.2	-71.8	-25.7	0	0	0	114.2	E229 C231 T235	E229-N233 WeakPolarHBondContact O-CB 3.08Å; E229-N233 PolarHBondContact O-N 3.49Å; E229-N233 VanDerWaalsContact O-N 3.08Å; E229-N233 PolarHBondContact O-ND2 2.88Å; E229-N233 VanDerWaalsContact O-ND2 3.12Å; C231-N233 VanDerWaalsContact C-N 3.34Å; C231-N233 PolarHBondContact O-N 2.84Å; N233-T235 VanDerWaalsContact C-N 3.29Å
234	A	83.8	Confident	81.6	Confident	10 Å²	10	64.8 Å²	64.8	8%	0.083	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-9.8	178.3	0	0	0	0	0	114.1	Y225 T230 C231 Q232 T236 C241	Y225-A234 HydrophobicContact CD1-CB 4.25Å; Y225-A234 HydrophobicContact CD2-CB 3.44Å; Y225-A234 VanDerWaalsContact CD2-CB 3.44Å; Y225-A234 HydrophobicContact CE1-CB 3.87Å; Y225-A234 HydrophobicContact CE2-CB 3.03Å; Y225-A234 HydrophobicContact CG-CB 4.05Å; T230-A234 WeakPolarHBondContact O-CB 3.46Å; T230-A234 PolarHBondContact O-N 2.93Å; C231-A234 WeakPolarHBondContact O-CB 3.25Å; C231-A234 PolarHBondContact O-N 2.85Å; Q232-A234 PolarHBondContact O-N 2.87Å; A234-T236 WeakPolarHBondContact O-CG2 3.26Å; A234-T236 PolarHBondContact O-N 3.27Å; A234-C241 HydrophobicContact CB-CB 4.39Å
235	T	80.5	Confident	81.9	Confident	61 Å²	61	66.1 Å²	66.1	37%	0.374	35%	0.353	S	S	.	.			trans	-60.7	124.1	177.2	-66.3	0	0	0	0	110.2	Q232 N233 T239 T240 C241	Q232-T235 PolarHBondContact O-N 2.82Å; Q232-T235 PolarHBondContact O-OG1 2.98Å; N233-T235 VanDerWaalsContact C-N 3.29Å; T235-T239 CarbonylContact C-O 3.56Å; T235-T239 WeakPolarHBondContact CA-O 3.22Å; T235-T240 HydrophobicContact CG2-CG2 4.24Å; T235-C241 PolarHBondContact OG1-N 2.76Å; T235-C241 PolarHBondContact OG1-O 3.43Å
236	T	77.5	Confident	81.5	Confident	81 Å²	81	69.9 Å²	69.9	50%	0.497	37%	0.371	S	S	.	.			trans	-116.5	177	176.5	67.6	0	0	0	0	110.2	A234 N238 T239	A234-T236 WeakPolarHBondContact O-CG2 3.26Å; A234-T236 PolarHBondContact O-N 3.27Å; T236-N238 PolarHBondContact O-N 3.28Å; T236-N238 VanDerWaalsContact O-N 3.15Å; T236-N238 PolarHBondContact OG1-N 3.32Å; T236-T239 PolarHBondContact N-O 3.39Å; T236-T239 PolarHBondContact O-N 3.05Å; T236-T239 PolarHBondContact OG1-N 3.03Å
237	S	70.9	Confident	81	Confident	120 Å²	120	65.3 Å²	65.3	84%	0.839	35%	0.354	S	S	*	.	S	Bend	trans	-59.2	-24.4	175.4	60.6	0	0	0	0	114
238	N	74	Confident	80.6	Confident	146 Å²	146	66.9 Å²	66.9	78%	0.781	36%	0.36	S	S	*	.	S	Bend	trans	-109.5	-12.7	-174.2	-62.2	-0.2	0	0	0	112.9	T236	T236-N238 PolarHBondContact O-N 3.28Å; T236-N238 VanDerWaalsContact O-N 3.15Å; T236-N238 PolarHBondContact OG1-N 3.32Å
239	T	78.1	Confident	80.2	Confident	22 Å²	22	65.5 Å²	65.5	14%	0.135	36%	0.355	C	S	.	.			trans	-144.2	116.8	-172.3	-53.2	0	0	0	0	109.3	I221 T235 T236 E252	I221-T239 HydrophobicContact CB-CG2 4.31Å; I221-T239 HydrophobicContact CD1-CG2 4.31Å; I221-T239 HydrophobicContact CG2-CG2 4.32Å; T235-T239 CarbonylContact C-O 3.56Å; T235-T239 WeakPolarHBondContact CA-O 3.22Å; T236-T239 PolarHBondContact N-O 3.39Å; T236-T239 PolarHBondContact O-N 3.05Å; T236-T239 PolarHBondContact OG1-N 3.03Å; T239-E252 HydrophobicContact CG2-CG 3.75Å
240	T	82	Confident	79.9	Confident	45 Å²	45	59 Å²	59	28%	0.276	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.3	174.8	-58.2	0	0	0	0	109.8	T235 S253	T235-T240 HydrophobicContact CG2-CG2 4.24Å; T240-S253 PolarHBondContact O-N 2.62Å
241	C	83.4	Confident	79.5	Confident	7 Å²	7	56.5 Å²	56.5	5%	0.047	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134	178.5	-65.4	0	0	0	0	110.8	C222 C231 A234 T235 I251	C222-C241 HydrophobicContact CB-CB 3.81Å; C222-C241 WeakPolarHBondContact CB-SG 3.5Å; C222-C241 WeakPolarHBondContact SG-CA 3.42Å; C222-C241 WeakPolarHBondContact SG-CB 3.13Å; C222-C241 CovalentContact SG-SG 2.02Å; C222-C241 PolarHBondContact SG-SG 2.8Å; C231-C241 WeakPolarHBondContact O-CB 3.36Å; A234-C241 HydrophobicContact CB-CB 4.39Å; T235-C241 PolarHBondContact OG1-N 2.76Å; T235-C241 PolarHBondContact OG1-O 3.43Å; C241-I251 WeakPolarHBondContact CA-O 3.42Å
242	I	82.7	Confident	79.1	Confident	19 Å²	19	57.9 Å²	57.9	10%	0.097	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.1	179.4	-58.1	176.4	0	0	0	109.4	C231 Y244 C250 I251 K262 V263 C266	C231-I242 PolarHBondContact SG-O 2.78Å; I242-Y244 HydrophobicContact CB-CE2 4.24Å; I242-Y244 HydrophobicContact CG2-CD2 4.41Å; I242-Y244 HydrophobicContact CG2-CE2 3.9Å; I242-C250 WeakPolarHBondContact O-CA 3.3Å; I242-I251 PolarHBondContact N-O 2.95Å; I242-I251 PolarHBondContact O-N 3.15Å; I242-K262 HydrophobicContact CD1-CB 4.39Å; I242-V263 HydrophobicContact CD1-CG2 3.89Å; I242-C266 WeakPolarHBondContact CG2-SG 3.24Å
243	W	83.9	Confident	78.5	Confident	25 Å²	25	53 Å²	53	10%	0.095	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.4	175.6	-176.3	-104.5	0	0	0	111.4	K226 T227 N228 C231 E245 N248 C250	K226-W243 VanDerWaalsContact C-CH2 3.42Å; K226-W243 VanDerWaalsContact O-CH2 3.27Å; K226-W243 WeakPolarHBondContact O-CH2 3.47Å; T227-W243 VanDerWaalsContact C-CZ3 3.46Å; N228-W243 HydrophobicContact CB-CB 4.29Å; N228-W243 VanDerWaalsContact CB-CD1 3.45Å; N228-W243 HydrophobicContact CB-CD2 3.84Å; N228-W243 HydrophobicContact CB-CG 3.61Å; N228-W243 WeakPolarHBondContact OD1-CB 3.35Å; C231-W243 HydrophobicContact CB-CB 4.21Å; C231-W243 HydrophobicContact CB-CD2 4.48Å; C231-W243 HydrophobicContact CB-CE3 3.7Å; C231-W243 HydrophobicContact CB-CZ3 4.49Å; C231-W243 PolarHBondContact SG-N 3.12Å; C231-W243 VanDerWaalsContact SG-N 3.45Å; W243-E245 VanDerWaalsContact CD1-CD 3.5Å; W243-E245 VanDerWaalsContact NE1-CD 3.3Å; W243-E245 PolarHBondContact NE1-OE1 2.72Å; W243-E245 PolarHBondContact NE1-OE2 3.35Å; W243-E245 VanDerWaalsContact NE1-OE2 3.13Å; W243-N248 WeakPolarHBondContact CH2-O 3.3Å; W243-N248 HydrophobicContact CZ2-CB 4.32Å; W243-C250 HydrophobicContact CE3-CB 3.9Å; W243-C250 HydrophobicContact CZ3-CB 4.14Å
244	Y	76.9	Confident	77.1	Confident	5 Å²	5	50.4 Å²	50.4	2%	0.02	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	108.3	174.4	-74.6	-93.6	0	0	0	110.3	I37 I242 K246 G247 N248 A249 I251 K262 C266	I37-Y244 HydrophobicContact CG2-CD1 3.24Å; I37-Y244 HydrophobicContact CG2-CE1 3.69Å; I37-Y244 HydrophobicContact CG2-CG 4.09Å; I242-Y244 HydrophobicContact CB-CE2 4.24Å; I242-Y244 HydrophobicContact CG2-CD2 4.41Å; I242-Y244 HydrophobicContact CG2-CE2 3.9Å; Y244-K246 PolarHBondContact O-N 2.74Å; Y244-G247 PolarHBondContact O-N 3.11Å; Y244-N248 WeakPolarHBondContact O-CA 3.38Å; Y244-N248 PolarHBondContact O-N 3.41Å; Y244-A249 PolarHBondContact N-O 2.89Å; Y244-A249 PolarHBondContact O-N 3.19Å; Y244-I251 HydrophobicContact CD2-CD1 3.91Å; Y244-I251 HydrophobicContact CD2-CG1 3.8Å; Y244-I251 HydrophobicContact CE2-CD1 3.14Å; Y244-I251 HydrophobicContact CE2-CG1 3.29Å; Y244-K262 PolarHBondContact OH-O 2.88Å; Y244-C266 VanDerWaalsContact CD1-SG 3.57Å; Y244-C266 HydrophobicContact CE1-CB 4.44Å; Y244-C266 WeakPolarHBondContact CE1-SG 3.45Å
245	E	80	Confident	75.6	Confident	119 Å²	119	53 Å²	53	56%	0.556	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-47.8	-176.5	-69.4	-65.7	172.5	0	0	112.4	N228 W243 G247 N248	N228-E245 PolarHBondContact ND2-OE1 3.31Å; W243-E245 VanDerWaalsContact CD1-CD 3.5Å; W243-E245 VanDerWaalsContact NE1-CD 3.3Å; W243-E245 PolarHBondContact NE1-OE1 2.72Å; W243-E245 PolarHBondContact NE1-OE2 3.35Å; W243-E245 VanDerWaalsContact NE1-OE2 3.13Å; E245-G247 VanDerWaalsContact C-N 3.3Å; E245-G247 PolarHBondContact O-N 3.46Å; E245-N248 PolarHBondContact O-N 3.2Å; E245-N248 PolarHBondContact O-OD1 2.86Å
246	K	72.7	Confident	73.9	Confident	149 Å²	149	54.5 Å²	54.5	65%	0.648	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-33.9	-177.7	-178.3	163.9	161	-161.9	0	113.3	I37 Y244	I37-K246 WeakPolarHBondContact O-CD 3.49Å; I37-K246 WeakPolarHBondContact O-CE 3.4Å; I37-K246 PolarHBondContact O-NZ 3.29Å; Y244-K246 PolarHBondContact O-N 2.74Å
247	G	70.5	Confident	72.4	Confident	12 Å²	12	58.3 Å²	58.3	12%	0.124	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-11.5	177.7	0	0	0	0	0	114.4	Y244 E245 A249	Y244-G247 PolarHBondContact O-N 3.11Å; E245-G247 VanDerWaalsContact C-N 3.3Å; E245-G247 PolarHBondContact O-N 3.46Å; G247-A249 PolarHBondContact O-N 2.94Å
248	N	76.7	Confident	71.3	Confident	99 Å²	99	53.8 Å²	53.8	53%	0.529	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	42.2	-166.8	-66.5	-62.9	0	0	0	112.8	W243 Y244 E245	W243-N248 WeakPolarHBondContact CH2-O 3.3Å; W243-N248 HydrophobicContact CZ2-CB 4.32Å; Y244-N248 WeakPolarHBondContact O-CA 3.38Å; Y244-N248 PolarHBondContact O-N 3.41Å; E245-N248 PolarHBondContact O-N 3.2Å; E245-N248 PolarHBondContact O-OD1 2.86Å
249	A	79.1	Confident	70	Confident	19 Å²	19	50.5 Å²	50.5	16%	0.157	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	142.4	-171.7	0	0	0	0	0	111.7	L47 Y244 G247	L47-A249 HydrophobicContact CD1-CB 4.1Å; Y244-A249 PolarHBondContact N-O 2.89Å; Y244-A249 PolarHBondContact O-N 3.19Å; G247-A249 PolarHBondContact O-N 2.94Å
250	C	80.5	Confident	68.3	Low	4 Å²	4	51.5 Å²	51.5	3%	0.027	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.5	171.7	-173	0	0	0	0	109.7	C222 S223 Y225 C231 I242 W243	C222-C250 CarbonylContact C-O 3.53Å; C222-C250 VanDerWaalsContact O-CB 3.23Å; C222-C250 WeakPolarHBondContact O-CB 3.41Å; C222-C250 PolarHBondContact O-SG 2.85Å; S223-C250 VanDerWaalsContact CA-O 3.28Å; S223-C250 WeakPolarHBondContact CA-O 3.49Å; S223-C250 PolarHBondContact N-O 3.03Å; S223-C250 PolarHBondContact OG-O 3.31Å; Y225-C250 VanDerWaalsContact O-CB 3.3Å; Y225-C250 WeakPolarHBondContact O-CB 3.3Å; C231-C250 WeakPolarHBondContact CA-SG 3.29Å; C231-C250 HydrophobicContact CB-CB 3.58Å; C231-C250 WeakPolarHBondContact CB-SG 3.5Å; C231-C250 WeakPolarHBondContact SG-CB 3.28Å; C231-C250 CovalentContact SG-SG 2.01Å; C231-C250 PolarHBondContact SG-SG 3.38Å; I242-C250 WeakPolarHBondContact O-CA 3.3Å; W243-C250 HydrophobicContact CE3-CB 3.9Å; W243-C250 HydrophobicContact CZ3-CB 4.14Å
251	I	79.7	Confident	66.8	Low	4 Å²	4	52.8 Å²	52.8	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	158.3	179.2	68.4	172.3	0	0	0	111.9	Y45 L47 V218 C241 I242 Y244	Y45-I251 HydrophobicContact CE1-CD1 4.16Å; Y45-I251 WeakPolarHBondContact OH-CD1 3.36Å; L47-I251 HydrophobicContact CD1-CG2 3.74Å; L47-I251 HydrophobicContact CD2-CG2 4.2Å; V218-I251 HydrophobicContact CG1-CB 4.32Å; V218-I251 HydrophobicContact CG1-CG2 4.26Å; C241-I251 WeakPolarHBondContact CA-O 3.42Å; I242-I251 PolarHBondContact N-O 2.95Å; I242-I251 PolarHBondContact O-N 3.15Å; Y244-I251 HydrophobicContact CD2-CD1 3.91Å; Y244-I251 HydrophobicContact CD2-CG1 3.8Å; Y244-I251 HydrophobicContact CE2-CD1 3.14Å; Y244-I251 HydrophobicContact CE2-CG1 3.29Å
252	E	78.3	Confident	65.2	Low	29 Å²	29	52.9 Å²	52.9	14%	0.136	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	132.4	172.6	-73.1	178.1	-145.7	0	0	111.2	G219 E220 I221 C222 T239 I254	G219-E252 VanDerWaalsContact CA-OE1 3.24Å; G219-E252 WeakPolarHBondContact CA-OE1 3.26Å; G219-E252 WeakPolarHBondContact CA-OE2 3.38Å; E220-E252 PolarHBondContact N-OE1 3.17Å; E220-E252 VanDerWaalsContact N-OE1 3.15Å; I221-E252 WeakPolarHBondContact CA-OE1 3.43Å; I221-E252 WeakPolarHBondContact CB-OE1 3.42Å; I221-E252 WeakPolarHBondContact CG1-OE1 3.42Å; I221-E252 PolarHBondContact N-OE1 3.06Å; C222-E252 HydrophobicContact CB-CG 3.68Å; C222-E252 PolarHBondContact N-OE1 2.97Å; C222-E252 WeakPolarHBondContact SG-CG 3.16Å; T239-E252 HydrophobicContact CG2-CG 3.75Å; E252-I254 HydrophobicContact CB-CG1 4.19Å; E252-I254 PolarHBondContact O-N 2.88Å
253	S	70.1	Confident	63.6	Low	15 Å²	15	54.5 Å²	54.5	11%	0.105	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	91.7	163.8	174.7	0	0	0	0	108.7	T240 N255	T240-S253 PolarHBondContact O-N 2.62Å; S253-N255 VanDerWaalsContact C-N 3.33Å; S253-N255 PolarHBondContact O-N 3.28Å
254	I	58.2	Low	61.9	Low	67 Å²	67	58.1 Å²	58.1	34%	0.344	33%	0.327	S	S	.	.			trans	-67.6	-28.1	-172.3	-61.5	167.3	0	0	0	113	E216 A217 E252	E216-I254 HydrophobicContact CG-CD1 4.09Å; A217-I254 WeakPolarHBondContact O-CD1 3.44Å; E252-I254 HydrophobicContact CB-CG1 4.19Å; E252-I254 PolarHBondContact O-N 2.88Å
255	N	50.9	Low	60.6	Low	66 Å²	66	59.1 Å²	59.1	35%	0.353	33%	0.332	S	S	.	.			trans	-128.1	132.2	179.9	-61.9	-49.2	0	0	0	112.5	S253 D257 T258 H259	S253-N255 VanDerWaalsContact C-N 3.33Å; S253-N255 PolarHBondContact O-N 3.28Å; N255-D257 PolarHBondContact O-N 3.3Å; N255-T258 HydrophobicContact CB-CG2 4.14Å; N255-T258 WeakPolarHBondContact CB-OG1 3.32Å; N255-T258 CarbonylContact O-C 3.55Å; N255-T258 PolarHBondContact O-N 2.88Å; N255-T258 PolarHBondContact O-OG1 3.14Å; N255-H259 PolarHBondContact O-N 2.79Å
256	A	45.8	Very low	59.2	Low	92 Å²	92	55.7 Å²	55.7	76%	0.76	32%	0.321	S	S	*	.	H	α-helix	trans	-54.5	-35.9	170.1	0	0	0	0	0	111.9	T258 H259	A256-T258 VanDerWaalsContact C-N 3.34Å; A256-T258 PolarHBondContact O-N 3.44Å; A256-H259 VanDerWaalsContact O-CB 3.3Å; A256-H259 WeakPolarHBondContact O-CB 3.49Å; A256-H259 PolarHBondContact O-N 3.47Å
257	D	46.2	Very low	57.9	Low	161 Å²	161	51.9 Å²	51.9	86%	0.861	31%	0.313	S	S	*	.	H	α-helix	trans	-71.2	-26.2	177.4	-63	-31.1	0	0	0	113.4	N255	N255-D257 PolarHBondContact O-N 3.3Å
258	T	47.8	Very low	56.5	Low	24 Å²	24	55.9 Å²	55.9	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-92.3	-6.5	174.6	60.8	0	0	0	0	113.2	N255 A256 G260 L261 K262	N255-T258 HydrophobicContact CB-CG2 4.14Å; N255-T258 WeakPolarHBondContact CB-OG1 3.32Å; N255-T258 CarbonylContact O-C 3.55Å; N255-T258 PolarHBondContact O-N 2.88Å; N255-T258 PolarHBondContact O-OG1 3.14Å; A256-T258 VanDerWaalsContact C-N 3.34Å; A256-T258 PolarHBondContact O-N 3.44Å; T258-G260 VanDerWaalsContact C-N 3.3Å; T258-G260 PolarHBondContact O-N 3.15Å; T258-L261 PolarHBondContact O-N 2.89Å; T258-L261 VanDerWaalsContact O-N 3.1Å; T258-K262 WeakPolarHBondContact O-CB 3.47Å; T258-K262 PolarHBondContact O-N 2.83Å
259	H	45.6	Very low	54.4	Low	78 Å²	78	59 Å²	59	36%	0.361	35%	0.346	S	S	.	.	H	α-helix	trans	-58.5	-45.3	-178.2	-174	-84.6	0	0	0	110.7	N255 A256 L261 V263	N255-H259 PolarHBondContact O-N 2.79Å; A256-H259 VanDerWaalsContact O-CB 3.3Å; A256-H259 WeakPolarHBondContact O-CB 3.49Å; A256-H259 PolarHBondContact O-N 3.47Å; H259-L261 VanDerWaalsContact C-N 3.35Å; H259-L261 PolarHBondContact O-N 2.84Å; H259-V263 VanDerWaalsContact O-CB 3.26Å; H259-V263 WeakPolarHBondContact O-CB 3.41Å; H259-V263 WeakPolarHBondContact O-CG2 3.5Å; H259-V263 PolarHBondContact O-N 2.8Å
260	G	44.2	Very low	52.2	Low	42 Å²	42	65.2 Å²	65.2	43%	0.433	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-40.4	175.5	0	0	0	0	0	112.9	T258 N264	T258-G260 VanDerWaalsContact C-N 3.3Å; T258-G260 PolarHBondContact O-N 3.15Å; G260-N264 VanDerWaalsContact O-CB 3.3Å; G260-N264 WeakPolarHBondContact O-CB 3.5Å; G260-N264 PolarHBondContact O-N 2.86Å; G260-N264 PolarHBondContact O-ND2 3.27Å; G260-N264 PolarHBondContact O-OD1 2.75Å
261	L	49.2	Very low	49.7	Very low	72 Å²	72	73.8 Å²	73.8	38%	0.377	42%	0.419	S	S	.	.	H	α-helix	trans	-70.4	-46.6	-179.9	-153.3	93	0	0	0	111.8	T258 H259 N264 D265	T258-L261 PolarHBondContact O-N 2.89Å; T258-L261 VanDerWaalsContact O-N 3.1Å; H259-L261 VanDerWaalsContact C-N 3.35Å; H259-L261 PolarHBondContact O-N 2.84Å; L261-N264 PolarHBondContact O-N 2.89Å; L261-D265 PolarHBondContact O-N 3.27Å
262	K	50.4	Low	47.3	Very low	10 Å²	10	79.9 Å²	79.9	4%	0.043	46%	0.456	C	S	.	.	H	α-helix	trans	-68.2	-37.7	179.4	-77.9	-176.2	176.4	174	0	112.2	E216 I242 Y244 T258 D265 C266	E216-K262 IonicContact OE2-NZ 2.8Å; I242-K262 HydrophobicContact CD1-CB 4.39Å; Y244-K262 PolarHBondContact OH-O 2.88Å; T258-K262 WeakPolarHBondContact O-CB 3.47Å; T258-K262 PolarHBondContact O-N 2.83Å; K262-D265 WeakPolarHBondContact O-CB 3.25Å; K262-D265 PolarHBondContact O-N 3.06Å; K262-C266 PolarHBondContact O-N 2.8Å; K262-C266 VanDerWaalsContact O-N 3.12Å; K262-C266 PolarHBondContact O-SG 2.88Å
263	V	49.4	Very low	44.8	Very low	52 Å²	52	84.8 Å²	84.8	32%	0.315	49%	0.489	S	S	.	.	H	α-helix	trans	-65.8	-40.8	173.2	172.1	0	0	0	0	110.7	I242 H259 D265 C266 S267	I242-V263 HydrophobicContact CD1-CG2 3.89Å; H259-V263 VanDerWaalsContact O-CB 3.26Å; H259-V263 WeakPolarHBondContact O-CB 3.41Å; H259-V263 WeakPolarHBondContact O-CG2 3.5Å; H259-V263 PolarHBondContact O-N 2.8Å; V263-D265 VanDerWaalsContact C-N 3.31Å; V263-D265 PolarHBondContact O-N 2.91Å; V263-C266 WeakPolarHBondContact O-CA 3.41Å; V263-C266 VanDerWaalsContact O-CB 3.31Å; V263-C266 WeakPolarHBondContact O-CB 3.49Å; V263-C266 PolarHBondContact O-N 3.47Å; V263-S267 PolarHBondContact O-N 2.87Å; V263-S267 PolarHBondContact O-OG 2.8Å
264	N	47.6	Very low	42.8	Very low	102 Å²	102	91.6 Å²	91.6	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-34.9	174.1	-72	-12.1	0	0	0	112.4	G260 L261 C266 S267 V268	G260-N264 VanDerWaalsContact O-CB 3.3Å; G260-N264 WeakPolarHBondContact O-CB 3.5Å; G260-N264 PolarHBondContact O-N 2.86Å; G260-N264 PolarHBondContact O-ND2 3.27Å; G260-N264 PolarHBondContact O-OD1 2.75Å; L261-N264 PolarHBondContact O-N 2.89Å; N264-C266 PolarHBondContact O-N 3.01Å; N264-S267 WeakPolarHBondContact CA-OG 3.24Å; N264-S267 PolarHBondContact O-N 2.88Å; N264-S267 PolarHBondContact O-OG 2.85Å; N264-V268 WeakPolarHBondContact O-CG2 3.38Å
265	D	50.3	Low	41.3	Very low	25 Å²	25	95.4 Å²	95.4	13%	0.134	55%	0.549	C	S	.	.	H	α-helix	trans	-64.8	-28.5	172.1	-65.7	-24.3	0	0	0	112.1	Y43 L261 K262 V263	Y43-D265 WeakPolarHBondContact CE1-OD1 3.23Å; Y43-D265 PolarHBondContact OH-OD2 3.4Å; L261-D265 PolarHBondContact O-N 3.27Å; K262-D265 WeakPolarHBondContact O-CB 3.25Å; K262-D265 PolarHBondContact O-N 3.06Å; V263-D265 VanDerWaalsContact C-N 3.31Å; V263-D265 PolarHBondContact O-N 2.91Å
266	C	50.3	Low	40.4	Very low	48 Å²	48	98.4 Å²	98.4	32%	0.324	57%	0.57	S	S	.	*	H	α-helix	trans	-78.1	-35.7	174.8	-63.3	0	0	0	0	113.4	I242 Y244 K262 V263 N264 V268	I242-C266 WeakPolarHBondContact CG2-SG 3.24Å; Y244-C266 VanDerWaalsContact CD1-SG 3.57Å; Y244-C266 HydrophobicContact CE1-CB 4.44Å; Y244-C266 WeakPolarHBondContact CE1-SG 3.45Å; K262-C266 PolarHBondContact O-N 2.8Å; K262-C266 VanDerWaalsContact O-N 3.12Å; K262-C266 PolarHBondContact O-SG 2.88Å; V263-C266 WeakPolarHBondContact O-CA 3.41Å; V263-C266 VanDerWaalsContact O-CB 3.31Å; V263-C266 WeakPolarHBondContact O-CB 3.49Å; V263-C266 PolarHBondContact O-N 3.47Å; N264-C266 PolarHBondContact O-N 3.01Å; C266-V268 VanDerWaalsContact C-N 3.35Å; C266-V268 PolarHBondContact O-N 2.89Å
267	S	45.4	Very low	39.7	Very low	68 Å²	68	103 Å²	103	48%	0.476	58%	0.576	S	S	.	*			trans	-91.3	12.8	-170.3	53.2	0	0	0	0	114.4	V263 N264 E269	V263-S267 PolarHBondContact O-N 2.87Å; V263-S267 PolarHBondContact O-OG 2.8Å; N264-S267 WeakPolarHBondContact CA-OG 3.24Å; N264-S267 PolarHBondContact O-N 2.88Å; N264-S267 PolarHBondContact O-OG 2.85Å; S267-E269 PolarHBondContact O-N 2.8Å
268	V	41.6	Very low	39.1	Very low	96 Å²	96	103.1 Å²	103.1	58%	0.582	57%	0.571	S	S	*	*			trans	-70	73.6	167	-169.1	0	0	0	0	109.4	I38 N264 C266	I38-V268 HydrophobicContact CD1-CB 4.12Å; I38-V268 HydrophobicContact CD1-CG2 3.85Å; N264-V268 WeakPolarHBondContact O-CG2 3.38Å; C266-V268 VanDerWaalsContact C-N 3.35Å; C266-V268 PolarHBondContact O-N 2.89Å
269	E	32.6	Very low	38.9	Very low	164 Å²	164	107.2 Å²	107.2	77%	0.766	59%	0.592	S	S	*	*			trans	-63.7	136.4	163.9	-76.3	-176.4	150.9	0	0	109.2	S267	S267-E269 PolarHBondContact O-N 2.8Å
270	N	31.6	Very low	38.5	Very low	150 Å²	150	112.2 Å²	112.2	80%	0.802	61%	0.613	S	S	*	*			trans	72.8	76.6	163.3	-57.7	-29.6	0	0	0	118.2
271	M	28.2	Very low	38.2	Very low	185 Å²	185	116.6 Å²	116.6	91%	0.911	62%	0.622	S	S	*	*			trans	-131.2	109.8	137.1	-89.6	-157.4	-172.6	0	0	111.7
272	T	29.7	Very low	38	Very low	131 Å²	131	117.4 Å²	117.4	80%	0.804	62%	0.624	S	S	*	*			trans	41.5	109.8	153.9	-30.3	0	0	0	0	118.9	L274	T272-L274 PolarHBondContact O-N 2.62Å
273	T	25.4	Very low	37.9	Very low	133 Å²	133	124.8 Å²	124.8	82%	0.816	66%	0.656	S	S	*	*			trans	-43.3	116.5	169.6	43.4	0	0	0	0	114.8
274	L	28	Very low	38.2	Very low	158 Å²	158	125.3 Å²	125.3	83%	0.827	66%	0.662	S	S	*	*			trans	-126.1	105	148.8	-87.3	162.6	0	0	0	107.7	T272 T276	T272-L274 PolarHBondContact O-N 2.62Å; L274-T276 PolarHBondContact O-N 2.98Å
275	T	26.8	Very low	38.2	Very low	146 Å²	146	123.9 Å²	123.9	90%	0.896	65%	0.652	S	S	*	*			trans	-54.9	117.1	171.4	34.7	0	0	0	0	110
276	T	31.4	Very low	38.6	Very low	129 Å²	129	130.3 Å²	130.3	79%	0.791	67%	0.674	S	S	*	*			trans	-112.4	134.4	168	-47.5	0	0	0	0	108.4	L274 E278	L274-T276 PolarHBondContact O-N 2.98Å; T276-E278 PolarHBondContact O-N 2.79Å
277	E	31.8	Very low	39.4	Very low	188 Å²	188	135.3 Å²	135.3	88%	0.879	69%	0.688	S	S	*	*			trans	-53.2	121.6	-174.8	-72.4	178.1	121.6	0	0	112.9	N279	E277-N279 PolarHBondContact O-N 3.1Å
278	E	34.7	Very low	40.4	Very low	165 Å²	165	136.5 Å²	136.5	77%	0.771	69%	0.688	S	S	*	*			trans	-63.5	125.1	174	-71.9	-175.2	144.5	0	0	112.3	T276 K280	T276-E278 PolarHBondContact O-N 2.79Å; E278-K280 PolarHBondContact O-N 3.45Å
279	N	42	Very low	41.7	Very low	110 Å²	110	138.2 Å²	138.2	59%	0.588	69%	0.685	S	S	*	*				40.1	29.7	126.2	-74.4	-27.6	0	0	0	120.1	E277 Q281	E277-N279 PolarHBondContact O-N 3.1Å; N279-Q281 PolarHBondContact O-N 3.37Å
280	K	38.2	Very low	43.6	Very low	183 Å²	183	132.2 Å²	132.2	80%	0.796	66%	0.66	S	S	*	*	H	α-helix	trans	-59.8	-31.5	170.1	-90.8	179.5	178.8	168.3	0	112.4	E278 S284	E278-K280 PolarHBondContact O-N 3.45Å; K280-S284 WeakPolarHBondContact O-CB 3.28Å; K280-S284 PolarHBondContact O-N 2.79Å
281	Q	38	Very low	45.5	Very low	133 Å²	133	127 Å²	127	62%	0.621	63%	0.633	S	S	*	*	H	α-helix	trans	-74.6	-41.5	-173.7	-161.6	163.8	-2.7	0	0	112.8	N279 S284 H285	N279-Q281 PolarHBondContact O-N 3.37Å; Q281-S284 WeakPolarHBondContact O-CB 3.3Å; Q281-S284 PolarHBondContact O-N 2.92Å; Q281-H285 PolarHBondContact O-CD2 2.86Å; Q281-H285 VanDerWaalsContact O-CD2 3.29Å; Q281-H285 PolarHBondContact O-N 2.9Å; Q281-H285 VanDerWaalsContact O-N 3.15Å
282	H	45.3	Very low	47.9	Very low	90 Å²	90	122.6 Å²	122.6	42%	0.417	61%	0.612	S	S	.	*	H	α-helix	trans	-66.7	-42.9	-177.8	-150.8	-79.7	0	0	0	112.4	D28 S284 H285 W286	D28-H282 IonicContact OD2-CD2 3.66Å; D28-H282 IonicContact OD2-CE1 3.57Å; D28-H282 IonicContact OD2-NE2 2.76Å; D28-H282 PolarHBondContact OD2-NE2 2.85Å; H282-S284 VanDerWaalsContact C-N 3.32Å; H282-S284 PolarHBondContact O-N 2.79Å; H282-H285 PolarHBondContact O-N 3.15Å; H282-W286 PolarHBondContact O-N 2.86Å; H282-W286 VanDerWaalsContact O-N 3.08Å
283	K	48.3	Very low	50.2	Low	164 Å²	164	119.7 Å²	119.7	71%	0.713	60%	0.596	S	S	*	*	H	α-helix	trans	-61	-38.9	173.6	-78.9	-179.7	179.6	170.1	0	112.3	Y287	K283-Y287 PolarHBondContact O-N 2.96Å
284	S	55	Low	52.8	Low	64 Å²	64	116.8 Å²	116.8	45%	0.448	58%	0.575	S	S	.	*	H	α-helix	trans	-62.9	-46.4	178.8	178.7	0	0	0	0	111.9	K280 Q281 H282 Y287 L288	K280-S284 WeakPolarHBondContact O-CB 3.28Å; K280-S284 PolarHBondContact O-N 2.79Å; Q281-S284 WeakPolarHBondContact O-CB 3.3Å; Q281-S284 PolarHBondContact O-N 2.92Å; H282-S284 VanDerWaalsContact C-N 3.32Å; H282-S284 PolarHBondContact O-N 2.79Å; S284-Y287 PolarHBondContact O-N 2.77Å; S284-L288 PolarHBondContact O-N 2.9Å
285	H	48.5	Very low	55.4	Low	72 Å²	72	112.7 Å²	112.7	33%	0.333	56%	0.556	S	S	.	*	H	α-helix	trans	-69.7	-41.7	-179.4	-80.3	-93.2	0	0	0	112.8	Q281 H282 Y287 L288 Y289	Q281-H285 PolarHBondContact O-CD2 2.86Å; Q281-H285 VanDerWaalsContact O-CD2 3.29Å; Q281-H285 PolarHBondContact O-N 2.9Å; Q281-H285 VanDerWaalsContact O-N 3.15Å; H282-H285 PolarHBondContact O-N 3.15Å; H285-Y287 VanDerWaalsContact C-N 3.27Å; H285-Y287 PolarHBondContact O-N 2.59Å; H285-L288 PolarHBondContact O-N 3.47Å; H285-Y289 AromaticContact ND1-CE2 3.69Å; H285-Y289 WeakPolarHBondContact O-CD2 3.47Å; H285-Y289 PolarHBondContact O-N 3.3Å
286	W	58.4	Low	58	Low	159 Å²	159	107.8 Å²	107.8	60%	0.602	53%	0.531	S	S	*	.	H	α-helix	trans	-53.5	-46.6	173.3	169.2	-74.5	0	0	0	111.5	H282 L288 V290	H282-W286 PolarHBondContact O-N 2.86Å; H282-W286 VanDerWaalsContact O-N 3.08Å; W286-L288 PolarHBondContact O-N 3.12Å; W286-V290 WeakPolarHBondContact O-CB 3.39Å; W286-V290 PolarHBondContact O-N 3.48Å
287	Y	66	Low	60.4	Low	154 Å²	154	104 Å²	104	60%	0.604	51%	0.509	S	S	*	.	I	π-helix	trans	-64.7	-42.6	-177	-143.7	-90.3	0	0	0	111.5	K283 S284 H285 V291 I292	K283-Y287 PolarHBondContact O-N 2.96Å; S284-Y287 PolarHBondContact O-N 2.77Å; H285-Y287 VanDerWaalsContact C-N 3.27Å; H285-Y287 PolarHBondContact O-N 2.59Å; Y287-V291 HydrophobicContact CD2-CG2 4.23Å; Y287-V291 HydrophobicContact CE1-CG1 4.4Å; Y287-V291 HydrophobicContact CG-CB 4.46Å; Y287-V291 HydrophobicContact CG-CG2 4.44Å; Y287-V291 WeakPolarHBondContact O-CB 3.14Å; Y287-V291 PolarHBondContact O-N 3.01Å; Y287-I292 PolarHBondContact O-N 3.33Å
288	L	67.5	Low	62.9	Low	93 Å²	93	99.9 Å²	99.9	49%	0.487	49%	0.493	S	S	.	.	I	π-helix	trans	-71.3	-35.7	-173.1	-138.2	133.1	0	0	0	113.1	S284 H285 W286 I292	S284-L288 PolarHBondContact O-N 2.9Å; H285-L288 PolarHBondContact O-N 3.47Å; W286-L288 PolarHBondContact O-N 3.12Å; L288-I292 HydrophobicContact CG-CD1 4.27Å
289	Y	68.6	Low	65.3	Low	131 Å²	131	96.9 Å²	96.9	51%	0.514	48%	0.482	S	S	.	.	I	π-helix	trans	-109.1	-19	-171.6	-64.2	-77.5	0	0	0	115.3	F24 H285 P293	F24-Y289 HydrophobicContact CE1-CG 4.34Å; H285-Y289 AromaticContact ND1-CE2 3.69Å; H285-Y289 WeakPolarHBondContact O-CD2 3.47Å; H285-Y289 PolarHBondContact O-N 3.3Å; Y289-P293 WeakPolarHBondContact O-CD 3.19Å; Y289-P293 VanDerWaalsContact O-CG 3.28Å; Y289-P293 WeakPolarHBondContact O-CG 3.34Å
290	V	71.7	Confident	67.5	Low	39 Å²	39	97.5 Å²	97.5	24%	0.236	48%	0.484	C	S	.	.	I	π-helix	trans	-106.8	-50.2	179.1	-176.9	0	0	0	0	110.6	F24 W286 L294	F24-V290 HydrophobicContact CD2-CG2 4.39Å; F24-V290 HydrophobicContact CE1-CG2 4.33Å; F24-V290 HydrophobicContact CE2-CG2 3.66Å; F24-V290 HydrophobicContact CZ-CG2 3.62Å; W286-V290 WeakPolarHBondContact O-CB 3.39Å; W286-V290 PolarHBondContact O-N 3.48Å; V290-L294 HydrophobicContact CG1-CD1 3.93Å; V290-L294 WeakPolarHBondContact O-CB 3.15Å; V290-L294 WeakPolarHBondContact O-CD1 3.38Å; V290-L294 WeakPolarHBondContact O-CG 3.39Å; V290-L294 PolarHBondContact O-N 3.37Å
291	V	72.5	Confident	69.8	Low	39 Å²	39	93.9 Å²	93.9	24%	0.236	47%	0.472	C	S	.	.	I	π-helix	trans	-71.7	-46.2	-174.6	-176.4	0	0	0	0	111.3	Y287 L294 V295	Y287-V291 HydrophobicContact CD2-CG2 4.23Å; Y287-V291 HydrophobicContact CE1-CG1 4.4Å; Y287-V291 HydrophobicContact CG-CB 4.46Å; Y287-V291 HydrophobicContact CG-CG2 4.44Å; Y287-V291 WeakPolarHBondContact O-CB 3.14Å; Y287-V291 PolarHBondContact O-N 3.01Å; V291-L294 PolarHBondContact O-N 3.02Å; V291-V295 HydrophobicContact CG1-CG2 4.2Å; V291-V295 WeakPolarHBondContact O-CB 3.08Å; V291-V295 VanDerWaalsContact O-CG2 3.27Å; V291-V295 WeakPolarHBondContact O-CG2 3.37Å; V291-V295 PolarHBondContact O-N 3.07Å
292	I	78.2	Confident	72.1	Confident	94 Å²	94	90.9 Å²	90.9	48%	0.482	47%	0.465	S	S	.	.	H	α-helix	trans	-60.5	-49.3	-178.9	-64.3	175.2	0	0	0	112.2	Y287 L288 L294 V295 A296	Y287-I292 PolarHBondContact O-N 3.33Å; L288-I292 HydrophobicContact CG-CD1 4.27Å; I292-L294 PolarHBondContact O-N 3.41Å; I292-V295 PolarHBondContact O-N 2.8Å; I292-A296 WeakPolarHBondContact O-CB 3.45Å; I292-A296 PolarHBondContact O-N 2.86Å
293	P	78.4	Confident	74.1	Confident	70 Å²	70	90.8 Å²	90.8	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-66.3	-35.9	178.7	-25.6	38.7	0	0	0	113.5	Y289 A296 S297	Y289-P293 WeakPolarHBondContact O-CD 3.19Å; Y289-P293 VanDerWaalsContact O-CG 3.28Å; Y289-P293 WeakPolarHBondContact O-CG 3.34Å; P293-A296 PolarHBondContact O-N 2.91Å; P293-S297 WeakPolarHBondContact O-CB 3.21Å; P293-S297 PolarHBondContact O-N 2.84Å; P293-S297 PolarHBondContact O-OG 3.43Å
294	L	80.5	Confident	75.9	Confident	72 Å²	72	84.8 Å²	84.8	38%	0.377	45%	0.451	S	S	.	.	H	α-helix	trans	-60.7	-48.7	173.8	-88.3	164.8	0	0	0	111	F17 V290 V291 I292 A296 S297 L298	F17-L294 HydrophobicContact CZ-CD2 4.41Å; V290-L294 HydrophobicContact CG1-CD1 3.93Å; V290-L294 WeakPolarHBondContact O-CB 3.15Å; V290-L294 WeakPolarHBondContact O-CD1 3.38Å; V290-L294 WeakPolarHBondContact O-CG 3.39Å; V290-L294 PolarHBondContact O-N 3.37Å; V291-L294 PolarHBondContact O-N 3.02Å; I292-L294 PolarHBondContact O-N 3.41Å; L294-A296 PolarHBondContact O-N 3.06Å; L294-S297 PolarHBondContact O-N 2.74Å; L294-S297 PolarHBondContact O-OG 3.3Å; L294-L298 WeakPolarHBondContact O-CG 3.47Å; L294-L298 PolarHBondContact O-N 3.49Å
295	V	82.4	Confident	77.3	Confident	71 Å²	71	85 Å²	85	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-43.6	177.1	174	0	0	0	0	110.9	V291 I292 S297 L298 L299	V291-V295 HydrophobicContact CG1-CG2 4.2Å; V291-V295 WeakPolarHBondContact O-CB 3.08Å; V291-V295 VanDerWaalsContact O-CG2 3.27Å; V291-V295 WeakPolarHBondContact O-CG2 3.37Å; V291-V295 PolarHBondContact O-N 3.07Å; I292-V295 PolarHBondContact O-N 2.8Å; V295-S297 PolarHBondContact O-N 3.49Å; V295-L298 PolarHBondContact O-N 3.38Å; V295-L299 HydrophobicContact CG1-CD1 4.03Å; V295-L299 HydrophobicContact CG1-CG 4.42Å; V295-L299 WeakPolarHBondContact O-CB 3.42Å; V295-L299 VanDerWaalsContact O-CG 3.27Å; V295-L299 WeakPolarHBondContact O-CG 3.24Å; V295-L299 PolarHBondContact O-N 3.38Å
296	A	80.9	Confident	79.1	Confident	44 Å²	44	87 Å²	87	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-42.4	176.6	0	0	0	0	0	112.2	I292 P293 L294 L299 L300	I292-A296 WeakPolarHBondContact O-CB 3.45Å; I292-A296 PolarHBondContact O-N 2.86Å; P293-A296 PolarHBondContact O-N 2.91Å; L294-A296 PolarHBondContact O-N 3.06Å; A296-L299 PolarHBondContact O-N 3.42Å; A296-L300 WeakPolarHBondContact O-CG 3.29Å; A296-L300 PolarHBondContact O-N 3.41Å
297	S	81.6	Confident	80.4	Confident	49 Å²	49	83.8 Å²	83.8	34%	0.343	46%	0.458	S	S	.	.	H	α-helix	trans	-65.8	-41.1	177.5	70.9	0	0	0	0	112.3	P293 L294 V295 L299 L300 I301	P293-S297 WeakPolarHBondContact O-CB 3.21Å; P293-S297 PolarHBondContact O-N 2.84Å; P293-S297 PolarHBondContact O-OG 3.43Å; L294-S297 PolarHBondContact O-N 2.74Å; L294-S297 PolarHBondContact O-OG 3.3Å; V295-S297 PolarHBondContact O-N 3.49Å; S297-L299 VanDerWaalsContact C-N 3.35Å; S297-L299 PolarHBondContact O-N 3.35Å; S297-L300 PolarHBondContact O-N 3.08Å; S297-I301 VanDerWaalsContact O-CG1 3.27Å; S297-I301 WeakPolarHBondContact O-CG1 3.43Å; S297-I301 PolarHBondContact O-N 3.38Å
298	L	84	Confident	81.2	Confident	102 Å²	102	84.4 Å²	84.4	53%	0.534	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-41.9	174	-77.7	164.2	0	0	0	111.4	L294 V295 I301 C302	L294-L298 WeakPolarHBondContact O-CG 3.47Å; L294-L298 PolarHBondContact O-N 3.49Å; V295-L298 PolarHBondContact O-N 3.38Å; L298-I301 PolarHBondContact O-N 2.82Å; L298-C302 WeakPolarHBondContact O-CB 3.44Å; L298-C302 PolarHBondContact O-N 3.06Å; L298-C302 PolarHBondContact O-SG 3.2Å
299	L	86.1	Confident	81.9	Confident	102 Å²	102	89 Å²	89	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-62.9	-43.3	175.7	-71.8	171.4	0	0	0	111.6	V295 A296 S297 I301 C302 I303	V295-L299 HydrophobicContact CG1-CD1 4.03Å; V295-L299 HydrophobicContact CG1-CG 4.42Å; V295-L299 WeakPolarHBondContact O-CB 3.42Å; V295-L299 VanDerWaalsContact O-CG 3.27Å; V295-L299 WeakPolarHBondContact O-CG 3.24Å; V295-L299 PolarHBondContact O-N 3.38Å; A296-L299 PolarHBondContact O-N 3.42Å; S297-L299 VanDerWaalsContact C-N 3.35Å; S297-L299 PolarHBondContact O-N 3.35Å; L299-I301 PolarHBondContact O-N 2.9Å; L299-C302 PolarHBondContact O-N 2.93Å; L299-I303 WeakPolarHBondContact O-CB 3.31Å; L299-I303 WeakPolarHBondContact O-CD1 3.3Å; L299-I303 WeakPolarHBondContact O-CG1 3.45Å; L299-I303 PolarHBondContact O-N 3.13Å
300	L	87	Confident	82.6	Confident	122 Å²	122	90 Å²	90	64%	0.639	47%	0.473	S	S	*	.	H	α-helix	trans	-62.8	-40.7	176	-72	171	0	0	0	112.2	A296 S297 I303 G304	A296-L300 WeakPolarHBondContact O-CG 3.29Å; A296-L300 PolarHBondContact O-N 3.41Å; S297-L300 PolarHBondContact O-N 3.08Å; L300-I303 PolarHBondContact O-N 2.84Å; L300-G304 PolarHBondContact O-N 3.47Å
301	I	87.1	Confident	83.1	Confident	107 Å²	107	92.4 Å²	92.4	55%	0.549	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-44.2	175	-68.1	164.5	0	0	0	110.4	S297 L298 L299 G304 C305	S297-I301 VanDerWaalsContact O-CG1 3.27Å; S297-I301 WeakPolarHBondContact O-CG1 3.43Å; S297-I301 PolarHBondContact O-N 3.38Å; L298-I301 PolarHBondContact O-N 2.82Å; L299-I301 PolarHBondContact O-N 2.9Å; I301-G304 PolarHBondContact O-N 3.32Å; I301-C305 WeakPolarHBondContact O-CB 3.47Å; I301-C305 PolarHBondContact O-N 2.49Å; I301-C305 PolarHBondContact O-SG 3.11Å
302	C	86.2	Confident	83.4	Confident	70 Å²	70	94.9 Å²	94.9	47%	0.473	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-45.2	176.8	-75.5	0	0	0	0	111.8	L298 L299 C305 I306	L298-C302 WeakPolarHBondContact O-CB 3.44Å; L298-C302 PolarHBondContact O-N 3.06Å; L298-C302 PolarHBondContact O-SG 3.2Å; L299-C302 PolarHBondContact O-N 2.93Å; C302-C305 WeakPolarHBondContact O-CB 3.48Å; C302-C305 PolarHBondContact O-N 2.84Å; C302-I306 VanDerWaalsContact O-CG1 3.25Å; C302-I306 WeakPolarHBondContact O-CG1 3.08Å; C302-I306 PolarHBondContact O-N 2.85Å
303	I	87.8	Confident	83.4	Confident	89 Å²	89	100.3 Å²	100.3	46%	0.456	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-46	176	-68	163.9	0	0	0	110.1	L299 L300 C305 I306 I307	L299-I303 WeakPolarHBondContact O-CB 3.31Å; L299-I303 WeakPolarHBondContact O-CD1 3.3Å; L299-I303 WeakPolarHBondContact O-CG1 3.45Å; L299-I303 PolarHBondContact O-N 3.13Å; L300-I303 PolarHBondContact O-N 2.84Å; I303-C305 VanDerWaalsContact C-N 3.34Å; I303-C305 PolarHBondContact O-N 3.26Å; I303-I306 PolarHBondContact O-N 3.35Å; I303-I307 HydrophobicContact CG2-CD1 3.67Å; I303-I307 HydrophobicContact CG2-CG1 4.35Å; I303-I307 VanDerWaalsContact O-CG1 3.29Å; I303-I307 WeakPolarHBondContact O-CG1 3.43Å; I303-I307 PolarHBondContact O-N 2.68Å
304	G	84.7	Confident	83.4	Confident	37 Å²	37	104.2 Å²	104.2	38%	0.381	52%	0.515	S	S	.	.	H	α-helix	trans	-58.5	-43	175	0	0	0	0	0	112.7	L300 I301 I306 I307 W308	L300-G304 PolarHBondContact O-N 3.47Å; I301-G304 PolarHBondContact O-N 3.32Å; G304-I306 PolarHBondContact O-N 3.24Å; G304-I307 PolarHBondContact O-N 3.06Å; G304-W308 VanDerWaalsContact O-CB 3.23Å; G304-W308 WeakPolarHBondContact O-CB 3.29Å; G304-W308 PolarHBondContact O-N 3.15Å
305	C	84.9	Confident	83.1	Confident	68 Å²	68	109.1 Å²	109.1	46%	0.459	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-39.9	176.1	-71.1	0	0	0	0	112.4	I301 C302 I303 R309	I301-C305 WeakPolarHBondContact O-CB 3.47Å; I301-C305 PolarHBondContact O-N 2.49Å; I301-C305 PolarHBondContact O-SG 3.11Å; C302-C305 WeakPolarHBondContact O-CB 3.48Å; C302-C305 PolarHBondContact O-N 2.84Å; I303-C305 VanDerWaalsContact C-N 3.34Å; I303-C305 PolarHBondContact O-N 3.26Å; C305-R309 WeakPolarHBondContact O-CB 3.36Å; C305-R309 WeakPolarHBondContact O-CG 3.46Å; C305-R309 PolarHBondContact O-N 3.08Å
306	I	86.7	Confident	82.6	Confident	115 Å²	115	116.3 Å²	116.3	59%	0.59	55%	0.553	S	S	*	*	H	α-helix	trans	-67.3	-48.4	178	-68.7	165.1	0	0	0	110.1	C302 I303 G304 W308 R309 W310	C302-I306 VanDerWaalsContact O-CG1 3.25Å; C302-I306 WeakPolarHBondContact O-CG1 3.08Å; C302-I306 PolarHBondContact O-N 2.85Å; I303-I306 PolarHBondContact O-N 3.35Å; G304-I306 PolarHBondContact O-N 3.24Å; I306-W308 VanDerWaalsContact C-N 3.31Å; I306-W308 PolarHBondContact O-N 2.89Å; I306-R309 PolarHBondContact O-N 3.27Å; I306-W310 WeakPolarHBondContact O-CB 3.21Å; I306-W310 PolarHBondContact O-N 2.83Å
307	I	85.3	Confident	81.9	Confident	91 Å²	91	118.8 Å²	118.8	47%	0.467	57%	0.568	S	S	.	*	H	α-helix	trans	-59.4	-44.4	177.3	-66.6	167.8	0	0	0	110.2	I303 G304 W310 L311	I303-I307 HydrophobicContact CG2-CD1 3.67Å; I303-I307 HydrophobicContact CG2-CG1 4.35Å; I303-I307 VanDerWaalsContact O-CG1 3.29Å; I303-I307 WeakPolarHBondContact O-CG1 3.43Å; I303-I307 PolarHBondContact O-N 2.68Å; G304-I307 PolarHBondContact O-N 3.06Å; I307-W310 WeakPolarHBondContact O-CB 3.22Å; I307-W310 PolarHBondContact O-N 3.42Å; I307-L311 HydrophobicContact CG2-CD1 3.98Å; I307-L311 HydrophobicContact CG2-CG 4.42Å; I307-L311 WeakPolarHBondContact O-CG 3.14Å; I307-L311 PolarHBondContact O-N 2.87Å
308	W	83.4	Confident	80.9	Confident	167 Å²	167	123.5 Å²	123.5	63%	0.633	59%	0.59	S	S	*	*	H	α-helix	trans	-62	-46.9	177.4	-175.8	-82.3	0	0	0	112.5	G304 I306 W310 L311 L312	G304-W308 VanDerWaalsContact O-CB 3.23Å; G304-W308 WeakPolarHBondContact O-CB 3.29Å; G304-W308 PolarHBondContact O-N 3.15Å; I306-W308 VanDerWaalsContact C-N 3.31Å; I306-W308 PolarHBondContact O-N 2.89Å; W308-W310 VanDerWaalsContact C-N 3.26Å; W308-W310 PolarHBondContact O-N 2.9Å; W308-L311 PolarHBondContact O-N 3.07Å; W308-L312 VanDerWaalsContact CD1-CD1 3.41Å; W308-L312 WeakPolarHBondContact O-CB 3.43Å; W308-L312 PolarHBondContact O-N 2.9Å
309	R	82.9	Confident	79.5	Confident	191 Å²	191	124.6 Å²	124.6	72%	0.721	63%	0.625	S	S	*	*	H	α-helix	trans	-61.5	-37.2	175.5	-78.9	-176.1	177	-150.7	1.1	111.8	C305 I306 R313	C305-R309 WeakPolarHBondContact O-CB 3.36Å; C305-R309 WeakPolarHBondContact O-CG 3.46Å; C305-R309 PolarHBondContact O-N 3.08Å; I306-R309 PolarHBondContact O-N 3.27Å; R309-R313 PolarHBondContact O-N 2.81Å
310	W	82.9	Confident	79.2	Confident	150 Å²	150	125.7 Å²	125.7	57%	0.568	63%	0.63	S	S	*	*	H	α-helix	trans	-66.8	-44.9	177	-167.7	80.3	0	0	0	111.6	I306 I307 W308 L312 R313 R314	I306-W310 WeakPolarHBondContact O-CB 3.21Å; I306-W310 PolarHBondContact O-N 2.83Å; I307-W310 WeakPolarHBondContact O-CB 3.22Å; I307-W310 PolarHBondContact O-N 3.42Å; W308-W310 VanDerWaalsContact C-N 3.26Å; W308-W310 PolarHBondContact O-N 2.9Å; W310-L312 PolarHBondContact O-N 2.76Å; W310-R313 PolarHBondContact O-N 2.73Å; W310-R314 PolarHBondContact O-N 3.31Å
311	L	81.6	Confident	78.7	Confident	91 Å²	91	125.9 Å²	125.9	48%	0.476	63%	0.629	S	S	.	*	H	α-helix	trans	-62.6	-40.2	174.5	-72	170.6	0	0	0	112.6	I307 W308 R314 K315	I307-L311 HydrophobicContact CG2-CD1 3.98Å; I307-L311 HydrophobicContact CG2-CG 4.42Å; I307-L311 WeakPolarHBondContact O-CG 3.14Å; I307-L311 PolarHBondContact O-N 2.87Å; W308-L311 PolarHBondContact O-N 3.07Å; L311-R314 PolarHBondContact O-N 2.92Å; L311-K315 PolarHBondContact O-N 2.85Å; L311-K315 VanDerWaalsContact O-N 3.08Å
312	L	78	Confident	78.3	Confident	91 Å²	91	126.9 Å²	126.9	48%	0.476	63%	0.634	S	S	.	*	H	α-helix	trans	-63.1	-41.6	174.8	-87.5	169.8	0	0	0	112.6	W308 W310 R314 R316	W308-L312 VanDerWaalsContact CD1-CD1 3.41Å; W308-L312 WeakPolarHBondContact O-CB 3.43Å; W308-L312 PolarHBondContact O-N 2.9Å; W310-L312 PolarHBondContact O-N 2.76Å; L312-R314 VanDerWaalsContact C-N 3.32Å; L312-R316 PolarHBondContact O-N 3.17Å
313	R	79.9	Confident	77.8	Confident	208 Å²	208	130.3 Å²	130.3	79%	0.785	64%	0.643	S	S	*	*	H	α-helix	trans	-62.9	-40.8	174.2	-84.1	-172.3	-176.8	176.1	1.4	111.4	R309 W310 K315 R316 S317	R309-R313 PolarHBondContact O-N 2.81Å; W310-R313 PolarHBondContact O-N 2.73Å; R313-K315 PolarHBondContact O-N 2.95Å; R313-R316 PolarHBondContact O-N 3.15Å; R313-S317 PolarHBondContact O-N 3.28Å
314	R	76.5	Confident	77.2	Confident	151 Å²	151	132.9 Å²	132.9	57%	0.57	66%	0.655	S	S	*	*	H	α-helix	trans	-65	-38.7	-179.5	-146.7	175	-168	-177.5	3	112.5	W310 L311 L312 R316 S317	W310-R314 PolarHBondContact O-N 3.31Å; L311-R314 PolarHBondContact O-N 2.92Å; L312-R314 VanDerWaalsContact C-N 3.32Å; R314-R316 VanDerWaalsContact C-N 3.3Å; R314-R316 PolarHBondContact O-N 2.67Å; R314-S317 PolarHBondContact O-N 2.86Å
315	K	74.5	Confident	76.7	Confident	176 Å²	176	139.3 Å²	139.3	77%	0.765	67%	0.673	S	S	*	*	H	α-helix	trans	-63.7	-31.3	173.9	-79.2	-168.7	176.5	-175.1	0	113.6	L311 R313	L311-K315 PolarHBondContact O-N 2.85Å; L311-K315 VanDerWaalsContact O-N 3.08Å; R313-K315 PolarHBondContact O-N 2.95Å
316	R	72.3	Confident	76.1	Confident	221 Å²	221	144.4 Å²	144.4	83%	0.834	69%	0.688	S	S	*	*	H	α-helix	trans	-76.1	-18	177.6	-80.1	-172.9	-179.9	177.4	-1	114.6	L312 R313 R314	L312-R316 PolarHBondContact O-N 3.17Å; R313-R316 PolarHBondContact O-N 3.15Å; R314-R316 VanDerWaalsContact C-N 3.3Å; R314-R316 PolarHBondContact O-N 2.67Å
317	S	67.4	Low	75.3	Confident	97 Å²	97	146.6 Å²	146.6	68%	0.678	70%	0.696	S	S	*	*	H	α-helix	trans	-90.9	-11.6	179.6	-166.9	0	0	0	0	113.4	R313 R314	R313-S317 PolarHBondContact O-N 3.28Å; R314-S317 PolarHBondContact O-N 2.86Å
318	N	60.5	Low	74.5	Confident	148 Å²	148	151.3 Å²	151.3	79%	0.791	72%	0.715	S	S	*	*			trans	-107.1	13.5	-178.2	-80.1	12.2	0	0	0	113.2
319	G	53.6	Low	73.6	Confident	124 Å²	124	149.8 Å²	149.8	100%	1.278	72%	0.722	S	S	*	*			trans	-125.9	0	170.9	0	0	0	0	0	109.3

Retrieved 319 of 319 residues in 360.8 ms (Link to these results)

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