GPNMB_MOUSE Loading...

Transmembrane glycoprotein NMB

Could be a melanogenic enzyme.

AlphaFold DB , UniProt , Accession Q99P91, Species MOUSE (Mus musculus, Mouse), Gene Gpnmb, Length 574 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	41.4	Very low	49.4	Very low	238 Å²	238	136.2 Å²	136.2	100%	1.172	78%	0.777	S	S	*	*				0	117	0	-71.9	171.6	-163.2	0	0	106.9
2	E	41.3	Very low	49.4	Very low	194 Å²	194	136.7 Å²	136.7	91%	0.907	77%	0.774	S	S	*	*			trans	66.1	129	153.4	-55.3	-174.7	155.9	0	0	120.4
3	S	52.7	Low	49.2	Very low	120 Å²	120	137 Å²	137	84%	0.839	77%	0.772	S	S	*	*			trans	88.3	46.3	162.7	-141	0	0	0	0	119.1
4	L	51.3	Low	49.2	Very low	165 Å²	165	133.3 Å²	133.3	86%	0.864	77%	0.767	S	S	*	*	S	Bend	trans	-122.2	0.9	163.4	-100.7	150.3	0	0	0	114.2
5	C	54.9	Low	49.1	Very low	130 Å²	130	130.2 Å²	130.2	88%	0.878	76%	0.763	S	S	*	*	S	Bend	trans	-97.8	1	179.9	-75.5	0	0	0	0	115
6	G	51.6	Low	48.8	Very low	57 Å²	57	126 Å²	126	59%	0.588	76%	0.756	S	S	*	*	S	Bend	trans	-90.4	-15.1	-174.8	0	0	0	0	0	116
7	V	54	Low	48.4	Very low	109 Å²	109	127.8 Å²	127.8	66%	0.661	76%	0.76	S	S	*	*	S	Bend	trans	-100.1	-19.1	-168.8	-171.7	0	0	0	0	112.9	G9	V7-G9 VanDerWaalsContact C-N 3.34Å
8	L	50.2	Low	48.1	Very low	138 Å²	138	126.4 Å²	126.4	72%	0.723	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-12.7	174.3	-98.7	86	0	0	0	114
9	G	46.2	Very low	48	Very low	48 Å²	48	128.9 Å²	128.9	50%	0.495	76%	0.763	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	-18.7	179	0	0	0	0	0	114.9	V7	V7-G9 VanDerWaalsContact C-N 3.34Å
10	F	52.7	Low	48.5	Very low	168 Å²	168	131.8 Å²	131.8	74%	0.737	77%	0.769	S	S	*	*	S	Bend	trans	-93.7	-17.4	-178.5	-101.4	-88.6	0	0	0	113.9
11	L	47.6	Very low	49.3	Very low	131 Å²	131	129.9 Å²	129.9	69%	0.686	77%	0.768	S	S	*	*	S	Bend	trans	-84.7	-14.3	179.5	-80.9	159.6	0	0	0	113.8
12	L	48.7	Very low	51.1	Low	142 Å²	142	121 Å²	121	74%	0.743	73%	0.733	S	S	*	*	S	Bend	trans	-92.7	-10.1	176.4	-72.6	166.1	0	0	0	113.9
13	L	47.2	Very low	53.4	Low	141 Å²	141	115.3 Å²	115.3	74%	0.738	71%	0.705	S	S	*	*	S	Bend	trans	-85.7	-11.5	172.4	-82.1	161.6	0	0	0	113.4
14	A	48.8	Very low	55.2	Low	85 Å²	85	114.5 Å²	114.5	70%	0.702	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-6.5	175.7	0	0	0	0	0	113.9
15	A	48.2	Very low	57.1	Low	87 Å²	87	106.6 Å²	106.6	72%	0.719	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	9.9	-174.7	0	0	0	0	0	114.7
16	G	44.8	Very low	58.7	Low	63 Å²	63	104 Å²	104	65%	0.649	61%	0.614	S	S	*	*			trans	-119	2	-168.6	0	0	0	0	0	117.2	P18	G16-P18 WeakPolarHBondContact O-CD 3.45Å
17	L	41.9	Very low	60.4	Low	156 Å²	156	105.5 Å²	105.5	82%	0.817	61%	0.608	S	S	*	*	S	Bend	trans	-82.4	118.9	171.6	-73.2	168.2	0	0	0	108	L19	L17-L19 PolarHBondContact O-N 3.09Å
18	P	42.2	Very low	61.9	Low	104 Å²	104	101.1 Å²	101.1	68%	0.675	58%	0.582	S	S	*	*			trans	-60.5	116.5	170.4	27.2	-30.1	0	0	0	105.7	G16 Q20	G16-P18 WeakPolarHBondContact O-CD 3.45Å; P18-Q20 PolarHBondContact O-N 3.45Å
19	L	46.7	Very low	63.5	Low	174 Å²	174	94.6 Å²	94.6	91%	0.911	55%	0.548	S	S	*	.			trans	-55.2	103.5	159.7	-95.2	100.6	0	0	0	104.6	L17 A21	L17-L19 PolarHBondContact O-N 3.09Å; L19-A21 PolarHBondContact O-N 3.19Å
20	Q	57.1	Low	64.4	Low	186 Å²	186	93.4 Å²	93.4	87%	0.869	54%	0.536	S	S	*	.			trans	-57.8	110.1	174.9	-79.4	-178.6	-30.4	0	0	105.6	P18 A22	P18-Q20 PolarHBondContact O-N 3.45Å; Q20-A22 PolarHBondContact O-N 3.46Å
21	A	66.2	Low	64.7	Low	91 Å²	91	92.3 Å²	92.3	75%	0.752	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-52.7	129.8	176.4	0	0	0	0	0	107.8	L19 K23	L19-A21 PolarHBondContact O-N 3.19Å; A21-K23 PolarHBondContact O-N 3.31Å
22	A	79.6	Confident	64.9	Low	53 Å²	53	91.4 Å²	91.4	44%	0.438	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-53	130.4	177.7	0	0	0	0	0	109.1	Q20 E53	Q20-A22 PolarHBondContact O-N 3.46Å; A22-E53 HydrophobicContact CB-CG 4.21Å
23	K	88.1	Confident	65	Low	74 Å²	74	93.7 Å²	93.7	32%	0.322	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-60.6	142.7	176.7	-70.9	-175.3	-176	161.1	0	109.4	A21 V28 W54 E56 V61	A21-K23 PolarHBondContact O-N 3.31Å; K23-V28 HydrophobicContact CB-CG2 4.41Å; K23-W54 HydrophobicContact CB-CB 4.37Å; K23-W54 WeakPolarHBondContact O-CB 3.47Å; K23-W54 PolarHBondContact O-N 2.88Å; K23-E56 WeakPolarHBondContact CD-OE2 3.33Å; K23-E56 WeakPolarHBondContact CE-OE2 3.28Å; K23-E56 IonicContact NZ-OE1 2.64Å; K23-E56 PolarHBondContact NZ-OE1 3.07Å; K23-E56 IonicContact NZ-OE2 2.97Å; K23-E56 PolarHBondContact NZ-OE2 2.95Å; K23-V61 HydrophobicContact CD-CG2 4.25Å
24	R	91.1	Very high	65.1	Low	102 Å²	102	89.7 Å²	89.7	39%	0.385	51%	0.507	S	S	.	.	B	Isolated β-bridge	trans	-100.8	162.7	173.1	-63.6	-179.8	-179.1	-155.9	-5.8	110.5	R26 D27 V28 E51 N52	R24-R26 HydrophobicContact CB-CG 4.07Å; R24-R26 PolarHBondContact O-N 3.49Å; R24-D27 WeakPolarHBondContact CB-OD2 3.48Å; R24-D27 PolarHBondContact N-OD2 3.3Å; R24-D27 PolarHBondContact O-N 3.29Å; R24-V28 PolarHBondContact O-N 3.48Å; R24-E51 WeakPolarHBondContact CD-O 3.31Å; R24-E51 WeakPolarHBondContact CD-OE2 3.33Å; R24-E51 IonicContact CZ-OE2 3.95Å; R24-E51 IonicContact NE-OE2 3.7Å; R24-E51 IonicContact NH1-OE2 2.87Å; R24-E51 PolarHBondContact NH1-OE2 3.43Å; R24-N52 WeakPolarHBondContact CA-O 3.42Å
25	F	92	Very high	65.1	Low	0 Å²	0	89.3 Å²	89.3	0%	0	50%	0.497	C	S	.	.	H	α-helix	trans	-55.3	-40.3	175	-88.7	-107.6	0	0	0	112	D27 V28 L29 D50 N52 E53 W54 P157 D158 V176 Y183	F25-D27 VanDerWaalsContact C-N 3.26Å; F25-D27 PolarHBondContact O-N 3.32Å; F25-V28 PolarHBondContact O-N 3.34Å; F25-V28 VanDerWaalsContact O-N 3.13Å; F25-L29 HydrophobicContact CD1-CD1 3.74Å; F25-L29 WeakPolarHBondContact O-CB 3.21Å; F25-L29 PolarHBondContact O-N 3.28Å; F25-D50 HydrophobicContact CB-CB 4.14Å; F25-D50 WeakPolarHBondContact CB-O 3.49Å; F25-D50 PolarHBondContact N-O 2.89Å; F25-N52 HydrophobicContact CD2-CB 4.34Å; F25-N52 WeakPolarHBondContact CD2-O 3.46Å; F25-N52 PolarHBondContact N-O 3.42Å; F25-N52 VanDerWaalsContact N-O 3.13Å; F25-E53 WeakPolarHBondContact CE2-O 3.48Å; F25-W54 AromaticContact CD1-CE3 3.72Å; F25-W54 HydrophobicContact CD1-CE3 3.72Å; F25-W54 AromaticContact CD1-CZ3 3.77Å; F25-W54 HydrophobicContact CD1-CZ3 3.77Å; F25-W54 HydrophobicContact CD2-CB 4.4Å; F25-W54 AromaticContact CD2-CE3 3.92Å; F25-W54 HydrophobicContact CD2-CE3 3.92Å; F25-W54 AromaticContact CE1-CE3 3.66Å; F25-W54 HydrophobicContact CE1-CE3 3.66Å; F25-W54 AromaticContact CE1-CZ3 3.53Å; F25-W54 HydrophobicContact CE1-CZ3 3.53Å; F25-W54 AromaticContact CE2-CE3 3.87Å; F25-W54 HydrophobicContact CE2-CE3 3.87Å; F25-W54 AromaticContact CG-CE3 3.86Å; F25-W54 HydrophobicContact CG-CE3 3.86Å; F25-W54 HydrophobicContact CG-CZ3 4.38Å; F25-W54 AromaticContact CZ-CE3 3.75Å; F25-W54 HydrophobicContact CZ-CE3 3.75Å; F25-W54 AromaticContact CZ-CZ3 3.97Å; F25-W54 HydrophobicContact CZ-CZ3 3.97Å; F25-P157 HydrophobicContact CE1-CB 4.27Å; F25-P157 HydrophobicContact CE2-CB 4.45Å; F25-P157 HydrophobicContact CZ-CB 3.72Å; F25-P157 HydrophobicContact CZ-CG 4.47Å; F25-D158 HydrophobicContact CE2-CB 3.88Å; F25-D158 HydrophobicContact CZ-CB 3.84Å; F25-V176 HydrophobicContact CD1-CG1 4.45Å; F25-V176 HydrophobicContact CE1-CG1 4.1Å; F25-Y183 HydrophobicContact CB-CD1 3.89Å; F25-Y183 HydrophobicContact CB-CE1 3.97Å; F25-Y183 AromaticContact CD1-CD1 3.38Å; F25-Y183 HydrophobicContact CD1-CD1 3.38Å; F25-Y183 AromaticContact CD1-CD2 3.89Å; F25-Y183 HydrophobicContact CD1-CD2 3.89Å; F25-Y183 AromaticContact CD1-CE1 3.54Å; F25-Y183 HydrophobicContact CD1-CE1 3.54Å; F25-Y183 HydrophobicContact CD1-CE2 4.09Å; F25-Y183 AromaticContact CD1-CG 3.54Å; F25-Y183 HydrophobicContact CD1-CG 3.54Å; F25-Y183 AromaticContact CD1-CZ 3.91Å; F25-Y183 HydrophobicContact CD2-CD1 4.28Å; F25-Y183 AromaticContact CD2-CE1 3.63Å; F25-Y183 HydrophobicContact CD2-CE1 3.63Å; F25-Y183 AromaticContact CD2-CZ 3.91Å; F25-Y183 AromaticContact CE1-CD1 3.88Å; F25-Y183 HydrophobicContact CE1-CD1 3.88Å; F25-Y183 AromaticContact CE1-CD2 3.54Å; F25-Y183 HydrophobicContact CE1-CD2 3.54Å; F25-Y183 AromaticContact CE1-CE1 3.82Å; F25-Y183 HydrophobicContact CE1-CE1 3.82Å; F25-Y183 AromaticContact CE1-CE2 3.54Å; F25-Y183 HydrophobicContact CE1-CE2 3.54Å; F25-Y183 AromaticContact CE1-CG 3.72Å; F25-Y183 HydrophobicContact CE1-CG 3.72Å; F25-Y183 AromaticContact CE1-CZ 3.67Å; F25-Y183 AromaticContact CE2-CE1 3.9Å; F25-Y183 HydrophobicContact CE2-CE1 3.9Å; F25-Y183 HydrophobicContact CE2-CE2 4.24Å; F25-Y183 AromaticContact CE2-CZ 3.66Å; F25-Y183 AromaticContact CG-CD1 3.6Å; F25-Y183 HydrophobicContact CG-CD1 3.6Å; F25-Y183 AromaticContact CG-CE1 3.44Å; F25-Y183 HydrophobicContact CG-CE1 3.44Å; F25-Y183 VanDerWaalsContact CG-CE1 3.44Å; F25-Y183 HydrophobicContact CG-CG 4.24Å; F25-Y183 HydrophobicContact CZ-CD1 4.5Å; F25-Y183 HydrophobicContact CZ-CD2 4.12Å; F25-Y183 AromaticContact CZ-CE1 3.98Å; F25-Y183 HydrophobicContact CZ-CE1 3.98Å; F25-Y183 AromaticContact CZ-CE2 3.61Å; F25-Y183 HydrophobicContact CZ-CE2 3.61Å; F25-Y183 AromaticContact CZ-CZ 3.51Å
26	R	88	Confident	64.9	Low	76 Å²	76	90.3 Å²	90.3	29%	0.287	49%	0.491	S	S	.	.	H	α-helix	trans	-58.1	-36.6	176.4	77.6	-171.8	-175.8	179.1	-1.1	113	R24 V28 G30 R39 D50 E51	R24-R26 HydrophobicContact CB-CG 4.07Å; R24-R26 PolarHBondContact O-N 3.49Å; R26-V28 VanDerWaalsContact C-N 3.26Å; R26-V28 PolarHBondContact O-N 2.99Å; R26-G30 CarbonylContact O-C 3.51Å; R26-G30 WeakPolarHBondContact O-CA 3.45Å; R26-G30 PolarHBondContact O-N 3.42Å; R26-G30 VanDerWaalsContact O-O 3.07Å; R26-R39 VanDerWaalsContact NH1-NH2 3.1Å; R26-D50 HydrophobicContact CB-CB 4Å; R26-D50 VanDerWaalsContact CB-OD2 3.32Å; R26-D50 WeakPolarHBondContact CB-OD2 3.1Å; R26-D50 PolarHBondContact N-O 3.16Å; R26-E51 VanDerWaalsContact CD-OE1 3.32Å; R26-E51 WeakPolarHBondContact CD-OE1 3.44Å; R26-E51 IonicContact CZ-OE1 2.79Å; R26-E51 IonicContact CZ-OE2 3.61Å; R26-E51 IonicContact NE-OE1 3.53Å; R26-E51 IonicContact NE-OE2 2.73Å; R26-E51 IonicContact NH1-OE1 3.31Å; R26-E51 PolarHBondContact NH1-OE1 3.44Å; R26-E51 IonicContact NH1-OE2 3.83Å; R26-E51 PolarHBondContact NH1-OE2 3.44Å; R26-E51 IonicContact NH2-OE2 2.72Å
27	D	86.8	Confident	64.9	Low	87 Å²	87	96 Å²	96	47%	0.465	50%	0.5	S	S	.	.	H	α-helix	trans	-74.9	-19.9	-177.6	-50.1	-39.9	0	0	0	111.9	R24 F25	R24-D27 WeakPolarHBondContact CB-OD2 3.48Å; R24-D27 PolarHBondContact N-OD2 3.3Å; R24-D27 PolarHBondContact O-N 3.29Å; F25-D27 VanDerWaalsContact C-N 3.26Å; F25-D27 PolarHBondContact O-N 3.32Å
28	V	86.6	Confident	65.2	Low	18 Å²	18	92.3 Å²	92.3	11%	0.109	48%	0.479	C	S	.	.	H	α-helix	trans	-99.7	-41.9	-176.8	178.4	0	0	0	0	111.8	K23 R24 F25 R26 W54 V61	K23-V28 HydrophobicContact CB-CG2 4.41Å; R24-V28 PolarHBondContact O-N 3.48Å; F25-V28 PolarHBondContact O-N 3.34Å; F25-V28 VanDerWaalsContact O-N 3.13Å; R26-V28 VanDerWaalsContact C-N 3.26Å; R26-V28 PolarHBondContact O-N 2.99Å; V28-W54 HydrophobicContact CB-CD2 4.31Å; V28-W54 HydrophobicContact CB-CE3 4.44Å; V28-W54 HydrophobicContact CG1-CD2 4.2Å; V28-W54 HydrophobicContact CG1-CE3 4.39Å; V28-W54 HydrophobicContact CG1-CH2 4.15Å; V28-W54 HydrophobicContact CG1-CZ2 3.93Å; V28-W54 HydrophobicContact CG1-CZ3 4.37Å; V28-W54 HydrophobicContact CG2-CB 4.31Å; V28-W54 HydrophobicContact CG2-CD2 3.99Å; V28-W54 HydrophobicContact CG2-CG 3.86Å; V28-V61 HydrophobicContact CB-CG2 4.37Å; V28-V61 HydrophobicContact CG1-CG1 4.07Å; V28-V61 HydrophobicContact CG1-CG2 3.85Å; V28-V61 HydrophobicContact CG2-CG1 4.37Å; V28-V61 HydrophobicContact CG2-CG2 3.59Å
29	L	84	Confident	65.7	Low	1 Å²	1	93 Å²	93	1%	0.005	47%	0.468	C	S	.	.	S	Bend	trans	-92.6	-56.8	-176	-56.4	177.9	0	0	0	109.9	F25 H31 V176 H178 E209 T211 K225	F25-L29 HydrophobicContact CD1-CD1 3.74Å; F25-L29 WeakPolarHBondContact O-CB 3.21Å; F25-L29 PolarHBondContact O-N 3.28Å; L29-H31 PolarHBondContact O-N 2.9Å; L29-V176 HydrophobicContact CD1-CG1 3.6Å; L29-V176 HydrophobicContact CD2-CG1 4.47Å; L29-H178 HydrophobicContact CB-CB 4.15Å; L29-H178 HydrophobicContact CD1-CB 3.87Å; L29-E209 VanDerWaalsContact C-OE2 3.26Å; L29-E209 VanDerWaalsContact O-CD 3.3Å; L29-T211 WeakPolarHBondContact CD2-OG1 3.44Å; L29-K225 PolarHBondContact O-NZ 2.94Å
30	G	64.5	Low	65.8	Low	23 Å²	23	93.9 Å²	93.9	24%	0.237	47%	0.468	C	S	.	.			trans	-79.5	94.9	-172.8	0	0	0	0	0	114.6	R26 E32	R26-G30 CarbonylContact O-C 3.51Å; R26-G30 WeakPolarHBondContact O-CA 3.45Å; R26-G30 PolarHBondContact O-N 3.42Å; R26-G30 VanDerWaalsContact O-O 3.07Å; G30-E32 VanDerWaalsContact C-N 3.29Å
31	H	58	Low	65.9	Low	145 Å²	145	86.8 Å²	86.8	67%	0.671	44%	0.435	S	S	*	.			trans	-83.1	-5.1	167.8	-99.6	-62.2	0	0	0	114	L29	L29-H31 PolarHBondContact O-N 2.9Å
32	E	53.5	Low	65.9	Low	111 Å²	111	86.9 Å²	86.9	52%	0.519	42%	0.423	S	S	.	.	S	Bend	trans	-108.6	119	175.9	-77.6	173.1	-157.2	0	0	109.1	G30 Y34 K227	G30-E32 VanDerWaalsContact C-N 3.29Å; E32-Y34 VanDerWaalsContact C-N 3.35Å; E32-Y34 WeakPolarHBondContact O-CD2 3.29Å; E32-Y34 PolarHBondContact O-N 2.89Å; E32-K227 IonicContact OE1-NZ 3.54Å; E32-K227 PolarHBondContact OE1-NZ 3.42Å
33	Q	48.9	Very low	65.8	Low	191 Å²	191	91.4 Å²	91.4	89%	0.893	44%	0.435	S	S	*	.			trans	-70.9	93.8	176.4	-165.7	153.6	7.9	0	0	107.4
34	Y	51	Low	65.8	Low	57 Å²	57	88.3 Å²	88.3	22%	0.224	42%	0.422	C	S	.	.			trans	-54.9	130.5	166.7	-68.8	-85.9	0	0	0	107.3	E32 D36 M38	E32-Y34 VanDerWaalsContact C-N 3.35Å; E32-Y34 WeakPolarHBondContact O-CD2 3.29Å; E32-Y34 PolarHBondContact O-N 2.89Å; Y34-D36 PolarHBondContact O-N 2.95Å; Y34-M38 HydrophobicContact CD1-SD 4Å
35	P	48.6	Very low	65.6	Low	76 Å²	76	95.2 Å²	95.2	49%	0.494	45%	0.448	S	S	.	.			trans	-51.4	138.7	173.6	-22.8	31.7	0	0	0	108.9	H37 M38	P35-H37 PolarHBondContact O-N 2.73Å; P35-M38 WeakPolarHBondContact O-CA 3.39Å; P35-M38 VanDerWaalsContact O-CB 3.3Å; P35-M38 WeakPolarHBondContact O-CB 3.38Å; P35-M38 PolarHBondContact O-N 3.33Å
36	D	43.4	Very low	65.5	Low	109 Å²	109	98.1 Å²	98.1	58%	0.583	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-55.1	-24.2	179.9	-89.2	-46.4	0	0	0	112.8	Y34 M38 R39	Y34-D36 PolarHBondContact O-N 2.95Å; D36-M38 PolarHBondContact O-N 3.43Å; D36-R39 WeakPolarHBondContact O-CB 3.31Å; D36-R39 PolarHBondContact O-N 2.93Å; D36-R39 IonicContact OD1-CZ 2.68Å; D36-R39 IonicContact OD1-NE 2.88Å; D36-R39 IonicContact OD1-NH1 3.19Å; D36-R39 PolarHBondContact OD1-NH1 2.88Å
37	H	43.7	Very low	65.8	Low	182 Å²	182	94.9 Å²	94.9	84%	0.843	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-71.4	-12.2	174.5	-58.1	86.6	0	0	0	114.2	P35	P35-H37 PolarHBondContact O-N 2.73Å
38	M	49	Very low	66.1	Low	78 Å²	78	91.6 Å²	91.6	38%	0.384	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-90.9	5	174.5	-112.9	-179.1	163.3	0	0	112.1	Y34 P35 D36 H41	Y34-M38 HydrophobicContact CD1-SD 4Å; P35-M38 WeakPolarHBondContact O-CA 3.39Å; P35-M38 VanDerWaalsContact O-CB 3.3Å; P35-M38 WeakPolarHBondContact O-CB 3.38Å; P35-M38 PolarHBondContact O-N 3.33Å; D36-M38 PolarHBondContact O-N 3.43Å; M38-H41 PolarHBondContact O-CE1 3.4Å; M38-H41 PolarHBondContact O-ND1 2.91Å
39	R	52.3	Low	66.4	Low	118 Å²	118	93.2 Å²	93.2	45%	0.445	46%	0.462	S	S	.	.			trans	-85.7	-10.6	-177.6	-85.6	177.9	165.1	158.6	-7.2	115.7	R26 D36 H41 E51	R26-R39 VanDerWaalsContact NH1-NH2 3.1Å; D36-R39 WeakPolarHBondContact O-CB 3.31Å; D36-R39 PolarHBondContact O-N 2.93Å; D36-R39 IonicContact OD1-CZ 2.68Å; D36-R39 IonicContact OD1-NE 2.88Å; D36-R39 IonicContact OD1-NH1 3.19Å; D36-R39 PolarHBondContact OD1-NH1 2.88Å; R39-H41 PolarHBondContact O-N 3.19Å; R39-E51 IonicContact CZ-OE1 3.75Å; R39-E51 IonicContact NE-OE1 2.76Å; R39-E51 IonicContact NH2-OE1 3.89Å; R39-E51 PolarHBondContact NH2-OE1 3.42Å
40	E	50.3	Low	66.8	Low	194 Å²	194	93.8 Å²	93.8	91%	0.907	46%	0.464	S	S	*	.			trans	-81.3	43.3	176.1	-75.6	-170.2	153.4	0	0	113.1
41	H	59.3	Low	67.9	Low	36 Å²	36	95 Å²	95	17%	0.167	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-83.8	130.5	169	-69.7	81.2	0	0	0	109.4	M38 R39 Q43 T202	M38-H41 PolarHBondContact O-CE1 3.4Å; M38-H41 PolarHBondContact O-ND1 2.91Å; R39-H41 PolarHBondContact O-N 3.19Å; H41-Q43 PolarHBondContact O-N 3.4Å; H41-T202 PolarHBondContact NE2-OG1 3.47Å
42	N	66.2	Low	69.6	Low	93 Å²	93	91.1 Å²	91.1	50%	0.497	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-52.2	138.2	171.3	-74.7	-38.3	0	0	0	110.2	L44 Q182 N200	N42-L44 PolarHBondContact O-N 3.01Å; N42-L44 VanDerWaalsContact O-N 3.14Å; N42-Q182 PolarHBondContact O-NE2 2.82Å; N42-N200 HydrophobicContact CB-CB 3.71Å
43	Q	77	Confident	71.5	Confident	149 Å²	149	90.5 Å²	90.5	70%	0.696	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-56.9	121.7	-179.1	-174	172.4	11.8	0	0	110.3	H41 R45 W47	H41-Q43 PolarHBondContact O-N 3.4Å; Q43-R45 PolarHBondContact O-N 3.25Å; Q43-W47 PolarHBondContact NE2-O 2.98Å
44	L	88.2	Confident	73.6	Confident	9 Å²	9	81.7 Å²	81.7	5%	0.047	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-67	130.1	174.6	-73.9	178.5	0	0	0	108.5	N42 G46 W47 T179 L180 I196 L201	N42-L44 PolarHBondContact O-N 3.01Å; N42-L44 VanDerWaalsContact O-N 3.14Å; L44-G46 PolarHBondContact O-N 2.99Å; L44-W47 HydrophobicContact CB-CB 3.72Å; L44-W47 HydrophobicContact CB-CD2 4.28Å; L44-W47 HydrophobicContact CB-CG 3.55Å; L44-W47 HydrophobicContact CD1-CD2 4Å; L44-W47 HydrophobicContact CD1-CE3 4.35Å; L44-W47 HydrophobicContact CD1-CG 4.15Å; L44-W47 WeakPolarHBondContact O-CB 3.5Å; L44-W47 PolarHBondContact O-N 3.43Å; L44-T179 HydrophobicContact CD1-CG2 4.15Å; L44-L180 HydrophobicContact CD1-CD1 4.5Å; L44-I196 HydrophobicContact CD1-CD1 4.36Å; L44-I196 HydrophobicContact CD1-CG2 3.98Å; L44-I196 HydrophobicContact CD2-CG2 3.47Å; L44-I196 VanDerWaalsContact CD2-CG2 3.47Å; L44-I196 HydrophobicContact CG-CG2 4.29Å; L44-L201 HydrophobicContact CD2-CD1 4.18Å; L44-L201 HydrophobicContact CD2-CD2 3.69Å; L44-L201 HydrophobicContact CD2-CG 4.2Å
45	R	87.4	Confident	75.6	Confident	247 Å²	247	80.1 Å²	80.1	93%	0.932	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	117.5	-175.1	-168.6	-178.6	-167.8	-142.9	4.2	110.9	Q43 W47	Q43-R45 PolarHBondContact O-N 3.25Å; R45-W47 VanDerWaalsContact C-N 3.34Å
46	G	89.6	Confident	77.6	Confident	61 Å²	61	80.3 Å²	80.3	63%	0.629	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-1.4	-179.6	0	0	0	0	0	115.1	L44 F184	L44-G46 PolarHBondContact O-N 2.99Å; G46-F184 WeakPolarHBondContact O-CD2 3.25Å
47	W	93.6	Very high	79.8	Confident	8 Å²	8	83.7 Å²	83.7	3%	0.03	41%	0.406	C	S	.	.			trans	-93	154.1	174.3	-65.3	60.9	0	0	0	110.6	Q43 L44 R45 F177 T179 Q182 Y183 F184 V194 I196 M208	Q43-W47 PolarHBondContact NE2-O 2.98Å; L44-W47 HydrophobicContact CB-CB 3.72Å; L44-W47 HydrophobicContact CB-CD2 4.28Å; L44-W47 HydrophobicContact CB-CG 3.55Å; L44-W47 HydrophobicContact CD1-CD2 4Å; L44-W47 HydrophobicContact CD1-CE3 4.35Å; L44-W47 HydrophobicContact CD1-CG 4.15Å; L44-W47 WeakPolarHBondContact O-CB 3.5Å; L44-W47 PolarHBondContact O-N 3.43Å; R45-W47 VanDerWaalsContact C-N 3.34Å; W47-F177 HydrophobicContact CH2-CB 3.57Å; W47-F177 HydrophobicContact CZ2-CB 4.47Å; W47-F177 HydrophobicContact CZ3-CB 4.07Å; W47-T179 HydrophobicContact CH2-CG2 4.18Å; W47-T179 HydrophobicContact CZ3-CG2 4.01Å; W47-Q182 HydrophobicContact CB-CB 4.12Å; W47-Q182 HydrophobicContact CE3-CB 4.2Å; W47-Y183 WeakPolarHBondContact CA-O 3.36Å; W47-F184 HydrophobicContact CD2-CB 3.49Å; W47-F184 VanDerWaalsContact CD2-CB 3.49Å; W47-F184 VanDerWaalsContact CE2-CB 3.47Å; W47-F184 HydrophobicContact CE3-CB 3.67Å; W47-F184 HydrophobicContact CG-CB 4.08Å; W47-F184 HydrophobicContact CH2-CB 3.77Å; W47-F184 HydrophobicContact CZ2-CB 3.61Å; W47-F184 HydrophobicContact CZ2-CG 4.37Å; W47-F184 HydrophobicContact CZ3-CB 3.8Å; W47-V194 HydrophobicContact CZ2-CG2 3.95Å; W47-I196 HydrophobicContact CH2-CD1 3.85Å; W47-I196 HydrophobicContact CZ2-CD1 3.37Å; W47-I196 HydrophobicContact CZ2-CG1 3.69Å; W47-M208 HydrophobicContact CH2-CE 3.94Å; W47-M208 HydrophobicContact CH2-SD 4.3Å
48	S	94.1	Very high	82.1	Confident	18 Å²	18	75.5 Å²	75.5	13%	0.126	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	151.6	178.3	-63.9	0	0	0	0	110.4	Q182 Y183	S48-Q182 CarbonylContact O-C 3.59Å; S48-Q182 WeakPolarHBondContact O-CA 3.37Å; S48-Q182 WeakPolarHBondContact O-CB 3.39Å; S48-Y183 PolarHBondContact N-O 2.89Å; S48-Y183 PolarHBondContact O-N 3.44Å
49	S	92.4	Very high	84.3	Confident	52 Å²	52	71.8 Å²	71.8	36%	0.364	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	138.3	175.4	172.1	0	0	0	0	111	E51 N52 Y183	S49-E51 PolarHBondContact O-N 3.3Å; S49-E51 VanDerWaalsContact O-N 3.12Å; S49-E51 WeakPolarHBondContact OG-CB 3.31Å; S49-E51 WeakPolarHBondContact OG-CG 3.36Å; S49-E51 PolarHBondContact OG-N 3.26Å; S49-N52 PolarHBondContact O-N 3.29Å; S49-Y183 WeakPolarHBondContact O-CE1 3.48Å
50	D	91	Very high	86.1	Confident	12 Å²	12	67.6 Å²	67.6	6%	0.064	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-3.1	174.3	70.4	-8.7	0	0	0	114.5	F25 R26 N52 H178 G181	F25-D50 HydrophobicContact CB-CB 4.14Å; F25-D50 WeakPolarHBondContact CB-O 3.49Å; F25-D50 PolarHBondContact N-O 2.89Å; R26-D50 HydrophobicContact CB-CB 4Å; R26-D50 VanDerWaalsContact CB-OD2 3.32Å; R26-D50 WeakPolarHBondContact CB-OD2 3.1Å; R26-D50 PolarHBondContact N-O 3.16Å; D50-N52 VanDerWaalsContact C-N 3.27Å; D50-H178 IonicContact OD2-NE2 2.83Å; D50-G181 WeakPolarHBondContact CB-O 3.42Å; D50-G181 VanDerWaalsContact CG-C 3.47Å; D50-G181 PolarHBondContact N-O 2.84Å; D50-G181 WeakPolarHBondContact OD2-CA 3.24Å
51	E	89.5	Confident	87.8	Confident	49 Å²	49	60.1 Å²	60.1	23%	0.229	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-12	172.2	-62.3	-59.2	158.8	0	0	113.5	R24 R26 R39 S49	R24-E51 WeakPolarHBondContact CD-O 3.31Å; R24-E51 WeakPolarHBondContact CD-OE2 3.33Å; R24-E51 IonicContact CZ-OE2 3.95Å; R24-E51 IonicContact NE-OE2 3.7Å; R24-E51 IonicContact NH1-OE2 2.87Å; R24-E51 PolarHBondContact NH1-OE2 3.43Å; R26-E51 VanDerWaalsContact CD-OE1 3.32Å; R26-E51 WeakPolarHBondContact CD-OE1 3.44Å; R26-E51 IonicContact CZ-OE1 2.79Å; R26-E51 IonicContact CZ-OE2 3.61Å; R26-E51 IonicContact NE-OE1 3.53Å; R26-E51 IonicContact NE-OE2 2.73Å; R26-E51 IonicContact NH1-OE1 3.31Å; R26-E51 PolarHBondContact NH1-OE1 3.44Å; R26-E51 IonicContact NH1-OE2 3.83Å; R26-E51 PolarHBondContact NH1-OE2 3.44Å; R26-E51 IonicContact NH2-OE2 2.72Å; R39-E51 IonicContact CZ-OE1 3.75Å; R39-E51 IonicContact NE-OE1 2.76Å; R39-E51 IonicContact NH2-OE1 3.89Å; R39-E51 PolarHBondContact NH2-OE1 3.42Å; S49-E51 PolarHBondContact O-N 3.3Å; S49-E51 VanDerWaalsContact O-N 3.12Å; S49-E51 WeakPolarHBondContact OG-CB 3.31Å; S49-E51 WeakPolarHBondContact OG-CG 3.36Å; S49-E51 PolarHBondContact OG-N 3.26Å
52	N	92	Very high	89.1	Confident	64 Å²	64	59.7 Å²	59.7	34%	0.342	30%	0.302	S	S	.	.	S	Bend	trans	-62.9	151.3	174.8	-70.8	-13.3	0	0	0	111.5	R24 F25 S49 D50 Y183	R24-N52 WeakPolarHBondContact CA-O 3.42Å; F25-N52 HydrophobicContact CD2-CB 4.34Å; F25-N52 WeakPolarHBondContact CD2-O 3.46Å; F25-N52 PolarHBondContact N-O 3.42Å; F25-N52 VanDerWaalsContact N-O 3.13Å; S49-N52 PolarHBondContact O-N 3.29Å; D50-N52 VanDerWaalsContact C-N 3.27Å; N52-Y183 HydrophobicContact CB-CE1 4.11Å; N52-Y183 WeakPolarHBondContact CB-OH 3.45Å; N52-Y183 PolarHBondContact ND2-OH 3.42Å
53	E	93.1	Very high	89.7	Confident	98 Å²	98	65.1 Å²	65.1	46%	0.458	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-66	143.2	176.1	-66.1	-175.2	174.5	0	0	112.1	A22 F25 R159	A22-E53 HydrophobicContact CB-CG 4.21Å; F25-E53 WeakPolarHBondContact CE2-O 3.48Å; E53-R159 IonicContact OE2-CZ 3.3Å; E53-R159 IonicContact OE2-NH1 2.73Å; E53-R159 PolarHBondContact OE2-NH1 2.86Å; E53-R159 IonicContact OE2-NH2 2.75Å; E53-R159 PolarHBondContact OE2-NH2 3.31Å
54	W	93.7	Very high	89.6	Confident	6 Å²	6	68 Å²	68	2%	0.023	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-100	127	174	179.8	-88.2	0	0	0	110.5	K23 F25 V28 E56 Y59 P157 F213	K23-W54 HydrophobicContact CB-CB 4.37Å; K23-W54 WeakPolarHBondContact O-CB 3.47Å; K23-W54 PolarHBondContact O-N 2.88Å; F25-W54 AromaticContact CD1-CE3 3.72Å; F25-W54 HydrophobicContact CD1-CE3 3.72Å; F25-W54 AromaticContact CD1-CZ3 3.77Å; F25-W54 HydrophobicContact CD1-CZ3 3.77Å; F25-W54 HydrophobicContact CD2-CB 4.4Å; F25-W54 AromaticContact CD2-CE3 3.92Å; F25-W54 HydrophobicContact CD2-CE3 3.92Å; F25-W54 AromaticContact CE1-CE3 3.66Å; F25-W54 HydrophobicContact CE1-CE3 3.66Å; F25-W54 AromaticContact CE1-CZ3 3.53Å; F25-W54 HydrophobicContact CE1-CZ3 3.53Å; F25-W54 AromaticContact CE2-CE3 3.87Å; F25-W54 HydrophobicContact CE2-CE3 3.87Å; F25-W54 AromaticContact CG-CE3 3.86Å; F25-W54 HydrophobicContact CG-CE3 3.86Å; F25-W54 HydrophobicContact CG-CZ3 4.38Å; F25-W54 AromaticContact CZ-CE3 3.75Å; F25-W54 HydrophobicContact CZ-CE3 3.75Å; F25-W54 AromaticContact CZ-CZ3 3.97Å; F25-W54 HydrophobicContact CZ-CZ3 3.97Å; V28-W54 HydrophobicContact CB-CD2 4.31Å; V28-W54 HydrophobicContact CB-CE3 4.44Å; V28-W54 HydrophobicContact CG1-CD2 4.2Å; V28-W54 HydrophobicContact CG1-CE3 4.39Å; V28-W54 HydrophobicContact CG1-CH2 4.15Å; V28-W54 HydrophobicContact CG1-CZ2 3.93Å; V28-W54 HydrophobicContact CG1-CZ3 4.37Å; V28-W54 HydrophobicContact CG2-CB 4.31Å; V28-W54 HydrophobicContact CG2-CD2 3.99Å; V28-W54 HydrophobicContact CG2-CG 3.86Å; W54-E56 PolarHBondContact O-N 3.47Å; W54-Y59 VanDerWaalsContact CZ2-CB 3.5Å; W54-Y59 HydrophobicContact CZ2-CG 4.24Å; W54-Y59 PolarHBondContact NE1-O 2.78Å; W54-P157 HydrophobicContact CD2-CB 4.04Å; W54-P157 HydrophobicContact CE3-CB 3.64Å; W54-P157 HydrophobicContact CE3-CG 4.49Å; W54-P157 HydrophobicContact CH2-CB 3.69Å; W54-P157 HydrophobicContact CH2-CG 3.74Å; W54-P157 HydrophobicContact CZ2-CB 4.08Å; W54-P157 HydrophobicContact CZ2-CG 4.37Å; W54-P157 HydrophobicContact CZ3-CB 3.46Å; W54-P157 VanDerWaalsContact CZ3-CB 3.46Å; W54-P157 HydrophobicContact CZ3-CG 3.81Å; W54-F213 HydrophobicContact CH2-CE1 4.4Å; W54-F213 AromaticContact CH2-CE2 3.93Å; W54-F213 HydrophobicContact CH2-CE2 3.93Å; W54-F213 AromaticContact CH2-CZ 3.53Å; W54-F213 HydrophobicContact CH2-CZ 3.53Å; W54-F213 HydrophobicContact CZ2-CE1 4.14Å; W54-F213 HydrophobicContact CZ2-CE2 4.47Å; W54-F213 AromaticContact CZ2-CZ 3.68Å; W54-F213 HydrophobicContact CZ2-CZ 3.68Å
55	D	93.5	Very high	88.9	Confident	23 Å²	23	71 Å²	71	12%	0.123	35%	0.353	C	S	.	.			trans	-76.2	86.3	173.4	-166.8	-24.6	0	0	0	111.4	H57 L58 Y59 P157 R159	D55-H57 VanDerWaalsContact C-N 3.26Å; D55-H57 PolarHBondContact O-N 3.02Å; D55-H57 PolarHBondContact OD1-N 3.4Å; D55-L58 HydrophobicContact CB-CB 4.31Å; D55-L58 PolarHBondContact O-N 3.05Å; D55-L58 PolarHBondContact OD1-N 2.81Å; D55-Y59 WeakPolarHBondContact O-CA 3.39Å; D55-Y59 WeakPolarHBondContact O-CB 3.47Å; D55-Y59 PolarHBondContact O-N 3.08Å; D55-P157 WeakPolarHBondContact CB-O 3.47Å; D55-P157 PolarHBondContact N-O 2.75Å; D55-R159 HydrophobicContact CB-CG 4.21Å; D55-R159 IonicContact OD2-NE 3.98Å
56	E	91.2	Very high	88.6	Confident	80 Å²	80	61.4 Å²	61.4	37%	0.374	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.5	179.2	-178.9	163.4	-157.4	0	0	113.4	K23 W54 Y59	K23-E56 WeakPolarHBondContact CD-OE2 3.33Å; K23-E56 WeakPolarHBondContact CE-OE2 3.28Å; K23-E56 IonicContact NZ-OE1 2.64Å; K23-E56 PolarHBondContact NZ-OE1 3.07Å; K23-E56 IonicContact NZ-OE2 2.97Å; K23-E56 PolarHBondContact NZ-OE2 2.95Å; W54-E56 PolarHBondContact O-N 3.47Å; E56-Y59 CarbonylContact O-C 3.41Å
57	H	89.5	Confident	88.2	Confident	181 Å²	181	60.5 Å²	60.5	84%	0.838	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-41.5	177.7	-64.6	-60.1	0	0	0	111.3	D55	D55-H57 VanDerWaalsContact C-N 3.26Å; D55-H57 PolarHBondContact O-N 3.02Å; D55-H57 PolarHBondContact OD1-N 3.4Å
58	L	91.4	Very high	87.7	Confident	10 Å²	10	65.7 Å²	65.7	5%	0.052	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-33.3	178	-169.1	61.3	0	0	0	112.1	D55 H153 R155 R218 A219 Y220	D55-L58 HydrophobicContact CB-CB 4.31Å; D55-L58 PolarHBondContact O-N 3.05Å; D55-L58 PolarHBondContact OD1-N 2.81Å; L58-H153 HydrophobicContact CD1-CB 4.44Å; L58-R155 HydrophobicContact CD2-CB 4.02Å; L58-R218 VanDerWaalsContact CD1-O 3.27Å; L58-R218 WeakPolarHBondContact CD1-O 3.33Å; L58-A219 CarbonylContact O-C 3.57Å; L58-A219 WeakPolarHBondContact O-CA 3.35Å; L58-Y220 HydrophobicContact CD1-CD2 3.9Å; L58-Y220 HydrophobicContact CD1-CE2 3.89Å; L58-Y220 HydrophobicContact CD2-CE2 4.39Å; L58-Y220 HydrophobicContact CG-CD2 3.87Å; L58-Y220 HydrophobicContact CG-CE2 4.1Å; L58-Y220 PolarHBondContact O-N 3.27Å
59	Y	94.1	Very high	87.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	-125.8	85.1	-177.7	-69.1	-96.4	0	0	0	111.5	W54 D55 E56 V61 R155 F156 P157 V174 F213 Y220	W54-Y59 VanDerWaalsContact CZ2-CB 3.5Å; W54-Y59 HydrophobicContact CZ2-CG 4.24Å; W54-Y59 PolarHBondContact NE1-O 2.78Å; D55-Y59 WeakPolarHBondContact O-CA 3.39Å; D55-Y59 WeakPolarHBondContact O-CB 3.47Å; D55-Y59 PolarHBondContact O-N 3.08Å; E56-Y59 CarbonylContact O-C 3.41Å; Y59-V61 PolarHBondContact O-N 2.98Å; Y59-R155 WeakPolarHBondContact CE2-O 3.34Å; Y59-R155 PolarHBondContact OH-O 3.37Å; Y59-F156 VanDerWaalsContact CE2-C 3.49Å; Y59-P157 HydrophobicContact CD1-CB 4.43Å; Y59-P157 HydrophobicContact CD1-CG 3.77Å; Y59-P157 HydrophobicContact CD2-CB 3.79Å; Y59-P157 HydrophobicContact CD2-CG 3.82Å; Y59-P157 HydrophobicContact CE1-CG 3.73Å; Y59-P157 HydrophobicContact CE2-CB 4.1Å; Y59-P157 HydrophobicContact CE2-CG 3.79Å; Y59-P157 VanDerWaalsContact CE2-N 3.34Å; Y59-P157 HydrophobicContact CG-CB 3.98Å; Y59-P157 HydrophobicContact CG-CG 3.82Å; Y59-V174 HydrophobicContact CE1-CB 4.49Å; Y59-V174 HydrophobicContact CE1-CG1 4.21Å; Y59-F213 HydrophobicContact CD1-CB 4.32Å; Y59-F213 AromaticContact CD1-CD1 3.64Å; Y59-F213 HydrophobicContact CD1-CD1 3.64Å; Y59-F213 HydrophobicContact CD1-CD2 4.22Å; Y59-F213 AromaticContact CD1-CE1 3.92Å; Y59-F213 HydrophobicContact CD1-CE1 3.92Å; Y59-F213 HydrophobicContact CD1-CE2 4.47Å; Y59-F213 AromaticContact CD1-CG 3.81Å; Y59-F213 HydrophobicContact CD1-CG 3.81Å; Y59-F213 HydrophobicContact CD1-CZ 4.34Å; Y59-F213 HydrophobicContact CE1-CB 4.1Å; Y59-F213 HydrophobicContact CE1-CD1 4.27Å; Y59-F213 HydrophobicContact CE1-CD2 4.32Å; Y59-F213 AromaticContact CE1-CG 3.99Å; Y59-F213 HydrophobicContact CE1-CG 3.99Å; Y59-Y220 HydrophobicContact CD1-CG 4.3Å; Y59-Y220 HydrophobicContact CE1-CD1 4.28Å; Y59-Y220 HydrophobicContact CE1-CD2 4.11Å; Y59-Y220 AromaticContact CE1-CG 3.66Å; Y59-Y220 HydrophobicContact CE1-CG 3.66Å; Y59-Y220 HydrophobicContact CE2-CD2 4.03Å; Y59-Y220 HydrophobicContact CE2-CG 4.41Å; Y59-Y220 AromaticContact CZ-CD2 3.73Å; Y59-Y220 AromaticContact CZ-CG 3.71Å
60	P	91.2	Very high	86.4	Confident	30 Å²	30	71.7 Å²	71.7	20%	0.195	35%	0.347	C	S	.	.			trans	-61.4	137.8	179.2	24.4	-36.2	0	0	0	112.5	Y220 I221	P60-Y220 WeakPolarHBondContact CD-O 3.48Å; P60-I221 HydrophobicContact CG-CG2 4.16Å
61	V	86.7	Confident	85.9	Confident	36 Å²	36	77.6 Å²	77.6	22%	0.218	38%	0.379	C	S	.	.			trans	-91.8	121.4	-179.9	-177	0	0	0	0	110	K23 V28 Y59	K23-V61 HydrophobicContact CD-CG2 4.25Å; V28-V61 HydrophobicContact CB-CG2 4.37Å; V28-V61 HydrophobicContact CG1-CG1 4.07Å; V28-V61 HydrophobicContact CG1-CG2 3.85Å; V28-V61 HydrophobicContact CG2-CG1 4.37Å; V28-V61 HydrophobicContact CG2-CG2 3.59Å; Y59-V61 PolarHBondContact O-N 2.98Å
62	W	86.1	Confident	85.6	Confident	28 Å²	28	75.3 Å²	75.3	11%	0.106	37%	0.368	C	S	.	.			trans	-107.8	127.8	177.8	-62.9	-1.5	0	0	0	110.6	R68 W69 I221 P222	W62-R68 VanDerWaalsContact CD1-CZ 3.46Å; W62-R68 VanDerWaalsContact CD1-NH2 3.32Å; W62-R68 HydrophobicContact CD2-CB 4.16Å; W62-R68 HydrophobicContact CE3-CB 4.17Å; W62-R68 HydrophobicContact CH2-CB 4.18Å; W62-R68 HydrophobicContact CZ2-CB 4.18Å; W62-R68 HydrophobicContact CZ3-CB 4.2Å; W62-R68 WeakPolarHBondContact CZ3-O 3.27Å; W62-W69 HydrophobicContact CB-CZ2 3.99Å; W62-W69 AromaticContact CE3-CD2 3.83Å; W62-W69 HydrophobicContact CE3-CD2 3.83Å; W62-W69 AromaticContact CE3-CE2 3.98Å; W62-W69 HydrophobicContact CE3-CE3 4.15Å; W62-W69 HydrophobicContact CE3-CG 4.12Å; W62-W69 HydrophobicContact CE3-CZ2 4.45Å; W62-W69 HydrophobicContact CZ3-CD2 4.44Å; W62-W69 HydrophobicContact CZ3-CE3 4.45Å; W62-I221 HydrophobicContact CH2-CB 3.81Å; W62-I221 HydrophobicContact CH2-CD1 4.01Å; W62-I221 HydrophobicContact CH2-CG1 4.35Å; W62-I221 HydrophobicContact CH2-CG2 4.31Å; W62-I221 HydrophobicContact CZ2-CB 3.69Å; W62-I221 HydrophobicContact CZ2-CD1 4.46Å; W62-I221 HydrophobicContact CZ2-CG2 3.76Å; W62-P222 HydrophobicContact CB-CG 4.12Å; W62-P222 HydrophobicContact CD2-CG 3.61Å; W62-P222 HydrophobicContact CE3-CG 3.66Å; W62-P222 HydrophobicContact CG-CG 3.82Å; W62-P222 HydrophobicContact CZ3-CG 4.27Å; W62-P222 VanDerWaalsContact CZ3-O 3.28Å; W62-P222 WeakPolarHBondContact CZ3-O 3.47Å
63	R	79.1	Confident	85.4	Confident	206 Å²	206	72.7 Å²	72.7	78%	0.777	35%	0.354	S	S	*	.			trans	-72	156.5	178.6	-66.1	-172	-178	-155.2	0.6	110.9	G65 D66 W69	R63-G65 PolarHBondContact O-N 2.84Å; R63-D66 VanDerWaalsContact O-CB 3.22Å; R63-D66 WeakPolarHBondContact O-CB 3.28Å; R63-D66 PolarHBondContact O-N 3.33Å; R63-D66 VanDerWaalsContact O-N 3.12Å; R63-W69 PolarHBondContact O-NE1 3.11Å
64	R	73.6	Confident	84.9	Confident	210 Å²	210	72.9 Å²	72.9	79%	0.792	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	128.8	172.5	-169.9	-177.9	-66.8	-179	2	109.1
65	G	73.1	Confident	84.3	Confident	72 Å²	72	75.6 Å²	75.6	74%	0.742	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-0.5	-178	0	0	0	0	0	115	R63 G67	R63-G65 PolarHBondContact O-N 2.84Å; G65-G67 PolarHBondContact O-N 2.95Å
66	D	82.3	Confident	83.8	Confident	46 Å²	46	75.9 Å²	75.9	25%	0.246	39%	0.393	C	S	.	.			trans	-58.2	130.5	171.4	-170.6	-27.4	0	0	0	110	R63 R68 W69	R63-D66 VanDerWaalsContact O-CB 3.22Å; R63-D66 WeakPolarHBondContact O-CB 3.28Å; R63-D66 PolarHBondContact O-N 3.33Å; R63-D66 VanDerWaalsContact O-N 3.12Å; D66-R68 PolarHBondContact O-N 2.83Å; D66-R68 VanDerWaalsContact O-N 3.14Å; D66-R68 WeakPolarHBondContact OD1-CB 3.44Å; D66-R68 WeakPolarHBondContact OD1-CG 3.34Å; D66-R68 PolarHBondContact OD1-N 2.88Å; D66-R68 IonicContact OD1-NE 3.37Å; D66-R68 PolarHBondContact OD1-NE 3Å; D66-R68 IonicContact OD2-CZ 2.99Å; D66-R68 VanDerWaalsContact OD2-CZ 3.3Å; D66-R68 IonicContact OD2-NE 3.38Å; D66-R68 PolarHBondContact OD2-NE 3.1Å; D66-R68 IonicContact OD2-NH2 2.89Å; D66-R68 PolarHBondContact OD2-NH2 2.84Å; D66-W69 VanDerWaalsContact O-CD1 3.25Å; D66-W69 PolarHBondContact O-N 3.07Å; D66-W69 VanDerWaalsContact O-N 3.14Å
67	G	80.9	Confident	83.6	Confident	42 Å²	42	78.9 Å²	78.9	43%	0.433	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-56.5	-30.1	-179.7	0	0	0	0	0	112.6	G65 W69 K70	G65-G67 PolarHBondContact O-N 2.95Å; G67-W69 PolarHBondContact O-N 2.86Å; G67-K70 WeakPolarHBondContact O-CB 3.3Å; G67-K70 PolarHBondContact O-N 3.08Å
68	R	84.1	Confident	83.7	Confident	117 Å²	117	70.3 Å²	70.3	44%	0.442	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-58.2	-23	178.9	-67.5	-175.2	-69	175.6	0.7	114.1	W62 D66 K70 D71 S72	W62-R68 VanDerWaalsContact CD1-CZ 3.46Å; W62-R68 VanDerWaalsContact CD1-NH2 3.32Å; W62-R68 HydrophobicContact CD2-CB 4.16Å; W62-R68 HydrophobicContact CE3-CB 4.17Å; W62-R68 HydrophobicContact CH2-CB 4.18Å; W62-R68 HydrophobicContact CZ2-CB 4.18Å; W62-R68 HydrophobicContact CZ3-CB 4.2Å; W62-R68 WeakPolarHBondContact CZ3-O 3.27Å; D66-R68 PolarHBondContact O-N 2.83Å; D66-R68 VanDerWaalsContact O-N 3.14Å; D66-R68 WeakPolarHBondContact OD1-CB 3.44Å; D66-R68 WeakPolarHBondContact OD1-CG 3.34Å; D66-R68 PolarHBondContact OD1-N 2.88Å; D66-R68 IonicContact OD1-NE 3.37Å; D66-R68 PolarHBondContact OD1-NE 3Å; D66-R68 IonicContact OD2-CZ 2.99Å; D66-R68 VanDerWaalsContact OD2-CZ 3.3Å; D66-R68 IonicContact OD2-NE 3.38Å; D66-R68 PolarHBondContact OD2-NE 3.1Å; D66-R68 IonicContact OD2-NH2 2.89Å; D66-R68 PolarHBondContact OD2-NH2 2.84Å; R68-K70 VanDerWaalsContact C-N 3.25Å; R68-K70 PolarHBondContact O-N 3.42Å; R68-D71 PolarHBondContact O-N 2.83Å; R68-S72 PolarHBondContact O-N 3.22Å; R68-S72 VanDerWaalsContact O-N 3.11Å
69	W	79.9	Confident	83.8	Confident	29 Å²	29	75.6 Å²	75.6	11%	0.11	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-64.7	-29.3	173.9	-73	102	0	0	0	113.1	W62 R63 D66 G67 S72 P222	W62-W69 HydrophobicContact CB-CZ2 3.99Å; W62-W69 AromaticContact CE3-CD2 3.83Å; W62-W69 HydrophobicContact CE3-CD2 3.83Å; W62-W69 AromaticContact CE3-CE2 3.98Å; W62-W69 HydrophobicContact CE3-CE3 4.15Å; W62-W69 HydrophobicContact CE3-CG 4.12Å; W62-W69 HydrophobicContact CE3-CZ2 4.45Å; W62-W69 HydrophobicContact CZ3-CD2 4.44Å; W62-W69 HydrophobicContact CZ3-CE3 4.45Å; R63-W69 PolarHBondContact O-NE1 3.11Å; D66-W69 VanDerWaalsContact O-CD1 3.25Å; D66-W69 PolarHBondContact O-N 3.07Å; D66-W69 VanDerWaalsContact O-N 3.14Å; G67-W69 PolarHBondContact O-N 2.86Å; W69-S72 WeakPolarHBondContact O-CB 3.37Å; W69-S72 PolarHBondContact O-OG 2.71Å; W69-P222 HydrophobicContact CH2-CB 3.62Å; W69-P222 HydrophobicContact CH2-CG 3.95Å; W69-P222 HydrophobicContact CZ2-CB 4.33Å; W69-P222 HydrophobicContact CZ2-CG 4.2Å; W69-P222 HydrophobicContact CZ3-CB 4.03Å; W69-P222 HydrophobicContact CZ3-CG 4.4Å
70	K	78.3	Confident	83.9	Confident	166 Å²	166	76.2 Å²	76.2	72%	0.722	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-38.9	178.4	-68.3	-176.7	177.5	179.9	0	111.2	G67 R68 S72	G67-K70 WeakPolarHBondContact O-CB 3.3Å; G67-K70 PolarHBondContact O-N 3.08Å; R68-K70 VanDerWaalsContact C-N 3.25Å; R68-K70 PolarHBondContact O-N 3.42Å; K70-S72 VanDerWaalsContact C-N 3.31Å
71	D	79.8	Confident	84.2	Confident	137 Å²	137	77.9 Å²	77.9	73%	0.733	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	7.3	-177.6	-50.2	-39.3	0	0	0	112.6	R68 W73	R68-D71 PolarHBondContact O-N 2.83Å; D71-W73 PolarHBondContact O-N 3.29Å
72	S	83.6	Confident	84.7	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.007	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.2	-176.8	69.1	0	0	0	0	113.7	R68 W69 K70 R214	R68-S72 PolarHBondContact O-N 3.22Å; R68-S72 VanDerWaalsContact O-N 3.11Å; W69-S72 WeakPolarHBondContact O-CB 3.37Å; W69-S72 PolarHBondContact O-OG 2.71Å; K70-S72 VanDerWaalsContact C-N 3.31Å; S72-R214 VanDerWaalsContact O-CZ 3.23Å; S72-R214 PolarHBondContact O-NE 2.86Å; S72-R214 PolarHBondContact O-NH2 3.03Å
73	W	87.4	Confident	85.2	Confident	9 Å²	9	78.5 Å²	78.5	3%	0.034	41%	0.406	C	S	.	.	S	Bend	trans	-152.5	137.3	-173.9	-168	-88.6	0	0	0	111.6	D71 G76 V78 F102 I114 V132 Y133 F173 I223	D71-W73 PolarHBondContact O-N 3.29Å; W73-G76 WeakPolarHBondContact CB-O 3.39Å; W73-G76 VanDerWaalsContact CD1-O 3.26Å; W73-V78 HydrophobicContact CB-CG2 4.08Å; W73-V78 HydrophobicContact CD2-CG2 3.31Å; W73-V78 HydrophobicContact CE3-CG2 3.83Å; W73-V78 HydrophobicContact CG-CG2 3.39Å; W73-V78 HydrophobicContact CZ2-CG2 4.22Å; W73-V78 HydrophobicContact CZ3-CG2 4.46Å; W73-F102 HydrophobicContact CH2-CD1 4.28Å; W73-F102 AromaticContact CH2-CE1 3.79Å; W73-F102 HydrophobicContact CH2-CE1 3.79Å; W73-F102 AromaticContact CZ2-CD1 3.61Å; W73-F102 HydrophobicContact CZ2-CD1 3.61Å; W73-F102 AromaticContact CZ2-CE1 3.6Å; W73-F102 HydrophobicContact CZ2-CE1 3.6Å; W73-I114 HydrophobicContact CH2-CB 4.33Å; W73-I114 HydrophobicContact CH2-CG1 3.78Å; W73-I114 HydrophobicContact CZ2-CB 4.04Å; W73-I114 HydrophobicContact CZ2-CG1 3.88Å; W73-I114 HydrophobicContact CZ2-CG2 4Å; W73-V132 HydrophobicContact CZ2-CG1 3.75Å; W73-Y133 AromaticContact CH2-CD1 3.88Å; W73-Y133 HydrophobicContact CH2-CD1 3.88Å; W73-Y133 AromaticContact CH2-CG 3.99Å; W73-Y133 HydrophobicContact CH2-CG 3.99Å; W73-Y133 HydrophobicContact CZ3-CD1 4.21Å; W73-Y133 HydrophobicContact CZ3-CG 4.26Å; W73-F173 HydrophobicContact CH2-CE1 4.08Å; W73-F173 AromaticContact CH2-CZ 3.97Å; W73-F173 HydrophobicContact CH2-CZ 3.97Å; W73-F173 AromaticContact CZ3-CE1 3.91Å; W73-F173 HydrophobicContact CZ3-CE1 3.91Å; W73-F173 HydrophobicContact CZ3-CZ 4.28Å; W73-I223 HydrophobicContact CE3-CG2 4.19Å; W73-I223 HydrophobicContact CZ3-CD1 4.38Å
74	E	84.2	Confident	86.1	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	137.8	-179.2	-66.7	178.9	-169.6	0	0	111.2	G76 Q106 V132	E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 2.86Å; E74-Q106 PolarHBondContact O-NE2 3.47Å; E74-V132 HydrophobicContact CB-CG1 4.3Å
75	G	80.4	Confident	87.2	Confident	62 Å²	62	62.1 Å²	62.1	64%	0.639	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-0.2	178.2	0	0	0	0	0	115.4	P103	G75-P103 VanDerWaalsContact O-CB 3.28Å; G75-P103 WeakPolarHBondContact O-CB 3.22Å
76	G	83.9	Confident	88.2	Confident	30 Å²	30	60.2 Å²	60.2	31%	0.309	33%	0.328	S	S	.	.	S	Bend	trans	135.7	179	173.5	0	0	0	0	0	113.4	W73 E74 P103	W73-G76 WeakPolarHBondContact CB-O 3.39Å; W73-G76 VanDerWaalsContact CD1-O 3.26Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 2.86Å; G76-P103 VanDerWaalsContact C-CG 3.4Å; G76-P103 VanDerWaalsContact O-CG 3.26Å; G76-P103 WeakPolarHBondContact O-CG 3.48Å
77	R	86.7	Confident	88.9	Confident	143 Å²	143	59.9 Å²	59.9	54%	0.54	33%	0.328	S	S	.	.			trans	-76.3	130.6	-178.1	177.1	179.6	-91.6	-175.3	-6.8	111.9
78	V	91.8	Very high	89.6	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.308	C	S	.	.			trans	-76.9	131.6	167.1	179.7	0	0	0	0	110.2	W73 L100 F102 I223 S224	W73-V78 HydrophobicContact CB-CG2 4.08Å; W73-V78 HydrophobicContact CD2-CG2 3.31Å; W73-V78 HydrophobicContact CE3-CG2 3.83Å; W73-V78 HydrophobicContact CG-CG2 3.39Å; W73-V78 HydrophobicContact CZ2-CG2 4.22Å; W73-V78 HydrophobicContact CZ3-CG2 4.46Å; V78-L100 HydrophobicContact CG1-CB 4.18Å; V78-L100 HydrophobicContact CG1-CD2 4.17Å; V78-F102 HydrophobicContact CG1-CD1 4.23Å; V78-F102 HydrophobicContact CG1-CE1 4.17Å; V78-F102 HydrophobicContact CG2-CD1 3.77Å; V78-F102 HydrophobicContact CG2-CE1 4.12Å; V78-I223 HydrophobicContact CG1-CD1 4.35Å; V78-S224 PolarHBondContact O-OG 2.85Å; V78-S224 VanDerWaalsContact O-OG 3.04Å
79	Q	93.4	Very high	90	Very high	122 Å²	122	52.6 Å²	52.6	57%	0.57	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	142	176.4	-59.3	-178.6	38.8	0	0	109.9	L100 V101	Q79-L100 CarbonylContact O-C 3.5Å; Q79-L100 WeakPolarHBondContact O-CA 2.97Å; Q79-V101 HydrophobicContact CB-CB 4.36Å; Q79-V101 PolarHBondContact N-O 3Å; Q79-V101 PolarHBondContact O-N 3.49Å
80	A	95.4	Very high	90.6	Very high	12 Å²	12	52.4 Å²	52.4	10%	0.099	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	127.4	170.5	0	0	0	0	0	108.9	V98 L100 V212 S224 V226	A80-V98 HydrophobicContact CB-CG1 4.07Å; A80-L100 HydrophobicContact CB-CD2 3.98Å; A80-V212 HydrophobicContact CB-CG2 4.39Å; A80-S224 PolarHBondContact N-OG 3.02Å; A80-V226 HydrophobicContact CB-CB 4.08Å; A80-V226 HydrophobicContact CB-CG1 3.7Å; A80-V226 WeakPolarHBondContact O-CB 3.25Å; A80-V226 WeakPolarHBondContact O-CG2 3.39Å
81	V	97.2	Very high	91.1	Very high	66 Å²	66	45.3 Å²	45.3	40%	0.4	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.4	172.6	179.5	0	0	0	0	107.4	T83 V98 N99 V101	V81-T83 HydrophobicContact CG1-CG2 4.18Å; V81-V98 CarbonylContact O-C 3.58Å; V81-V98 WeakPolarHBondContact O-CA 3.44Å; V81-N99 PolarHBondContact N-O 2.81Å; V81-N99 PolarHBondContact O-N 3.45Å; V81-V101 HydrophobicContact CG2-CG2 3.69Å
82	L	97.4	Very high	91.7	Very high	11 Å²	11	39 Å²	39	6%	0.058	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.4	175.1	173.5	62.7	0	0	0	108.4	F96 V97 V98 M208 V210 V226 D228	L82-F96 HydrophobicContact CD1-CB 4.11Å; L82-F96 HydrophobicContact CD1-CD1 4.24Å; L82-V97 WeakPolarHBondContact CA-O 3.32Å; L82-V98 HydrophobicContact CD1-CG2 3.62Å; L82-M208 HydrophobicContact CD1-CG 4.43Å; L82-M208 HydrophobicContact CD2-CB 4.09Å; L82-M208 HydrophobicContact CD2-CG 3.85Å; L82-M208 WeakPolarHBondContact CD2-O 3.44Å; L82-V210 HydrophobicContact CD1-CG2 4.17Å; L82-V210 HydrophobicContact CD2-CG2 4.16Å; L82-V226 HydrophobicContact CB-CB 4.5Å; L82-V226 HydrophobicContact CB-CG1 3.78Å; L82-V226 HydrophobicContact CB-CG2 3.86Å; L82-D228 HydrophobicContact CB-CB 4.43Å; L82-D228 HydrophobicContact CD2-CB 3.66Å; L82-D228 HydrophobicContact CG-CB 3.97Å
83	T	97.3	Very high	92.3	Very high	65 Å²	65	42.2 Å²	42.2	40%	0.399	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.3	172.7	62.2	0	0	0	0	110	V81 F96 V97	V81-T83 HydrophobicContact CG1-CG2 4.18Å; T83-F96 WeakPolarHBondContact O-CA 3.43Å; T83-V97 PolarHBondContact N-O 2.88Å; T83-V97 PolarHBondContact O-N 2.56Å
84	S	97	Very high	92.7	Very high	37 Å²	37	41.8 Å²	41.8	26%	0.259	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	162.4	174.4	68.6	0	0	0	0	111.3	T95	S84-T95 VanDerWaalsContact CA-O 3.31Å; S84-T95 WeakPolarHBondContact CA-O 3.35Å
85	D	96.5	Very high	93.3	Very high	36 Å²	36	38.6 Å²	38.6	19%	0.193	23%	0.234	C	C	.	.			trans	-89.4	19.6	171.1	60	2.8	0	0	0	112.6	I94 T95 H268 P270	D85-I94 WeakPolarHBondContact OD1-CA 3.45Å; D85-I94 VanDerWaalsContact OD1-CG1 3.22Å; D85-I94 WeakPolarHBondContact OD1-CG1 3.05Å; D85-T95 VanDerWaalsContact CG-N 3.34Å; D85-T95 PolarHBondContact N-O 2.91Å; D85-T95 PolarHBondContact OD1-N 2.8Å; D85-T95 VanDerWaalsContact OD2-CB 3.28Å; D85-T95 WeakPolarHBondContact OD2-CB 3.44Å; D85-T95 PolarHBondContact OD2-N 2.83Å; D85-T95 PolarHBondContact OD2-OG1 2.84Å; D85-H268 PolarHBondContact O-NE2 2.81Å; D85-P270 HydrophobicContact CB-CB 3.77Å; D85-P270 HydrophobicContact CB-CG 3.73Å; D85-P270 WeakPolarHBondContact O-CG 3.04Å
86	S	95	Very high	94.1	Very high	32 Å²	32	35.8 Å²	35.8	22%	0.224	20%	0.204	C	C	.	.			trans	-65.3	153.2	177.8	112.3	0	0	0	0	112	V231	S86-V231 PolarHBondContact OG-N 3.3Å
87	P	96.3	Very high	94.8	Very high	38 Å²	38	36.1 Å²	36.1	25%	0.247	20%	0.201	C	C	.	.	S	Bend	cis	-75.2	143.2	3.6	29.3	-35	0	0	0	113.3	V231 T233 P237 H268	P87-V231 VanDerWaalsContact CA-O 3.3Å; P87-V231 WeakPolarHBondContact CA-O 3.47Å; P87-V231 HydrophobicContact CB-CB 4.16Å; P87-V231 HydrophobicContact CB-CG1 4.33Å; P87-T233 HydrophobicContact CB-CG2 4.02Å; P87-P237 HydrophobicContact CB-CG 4.3Å; P87-P237 HydrophobicContact CG-CB 3.91Å; P87-P237 HydrophobicContact CG-CG 3.68Å; P87-H268 PolarHBondContact O-CD2 3.19Å; P87-H268 PolarHBondContact O-NE2 2.79Å
88	A	95.4	Very high	95.3	Very high	2 Å²	2	29.3 Å²	29.3	2%	0.017	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.3	178.8	0	0	0	0	0	111.8	I94 T198 V231 I232 T233	A88-I94 HydrophobicContact CB-CB 3.72Å; A88-I94 HydrophobicContact CB-CD1 4.19Å; A88-I94 HydrophobicContact CB-CG1 4.04Å; A88-T198 HydrophobicContact CB-CG2 4.34Å; A88-V231 PolarHBondContact N-O 2.81Å; A88-I232 CarbonylContact O-C 3.54Å; A88-I232 WeakPolarHBondContact O-CA 3.46Å; A88-T233 PolarHBondContact O-N 2.8Å
89	L	93.8	Very high	95.6	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	144.3	179.4	-81.2	169	0	0	0	111.9	G91 S92 T198 T233 Q235 I236 F273 L274	L89-G91 PolarHBondContact O-N 2.91Å; L89-G91 VanDerWaalsContact O-N 3.16Å; L89-S92 PolarHBondContact N-OG 2.03Å; L89-S92 VanDerWaalsContact O-CB 3.31Å; L89-S92 WeakPolarHBondContact O-CB 3.4Å; L89-S92 PolarHBondContact O-N 3.41Å; L89-S92 PolarHBondContact O-OG 2.9Å; L89-T198 PolarHBondContact O-OG1 2.82Å; L89-T233 CarbonylContact C-O 3.32Å; L89-T233 VanDerWaalsContact CA-O 3.25Å; L89-T233 WeakPolarHBondContact CA-O 3.19Å; L89-T233 HydrophobicContact CD2-CG2 4.44Å; L89-Q235 WeakPolarHBondContact CD2-O 3.25Å; L89-I236 HydrophobicContact CD2-CG1 4.47Å; L89-F273 HydrophobicContact CB-CD1 4.27Å; L89-F273 HydrophobicContact CD1-CD1 4.11Å; L89-L274 HydrophobicContact CD1-CD1 3.83Å; L89-L274 HydrophobicContact CD1-CD2 4.04Å; L89-L274 HydrophobicContact CD1-CG 3.98Å
90	V	91.8	Very high	95.7	Very high	25 Å²	25	27.3 Å²	27.3	15%	0.152	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	117.5	168.8	175.2	0	0	0	0	109.3	A203 I232 T233 R377	V90-A203 HydrophobicContact CG2-CB 4.28Å; V90-I232 HydrophobicContact CG2-CG2 3.57Å; V90-T233 PolarHBondContact N-O 3.27Å; V90-R377 PolarHBondContact O-NH2 3.49Å
91	G	89.1	Confident	95.7	Very high	18 Å²	18	30.2 Å²	30.2	19%	0.186	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.1	-12.9	-175.4	0	0	0	0	0	114.6	L89 T198 F273	L89-G91 PolarHBondContact O-N 2.91Å; L89-G91 VanDerWaalsContact O-N 3.16Å; G91-T198 PolarHBondContact N-OG1 2.85Å; G91-F273 VanDerWaalsContact O-CE2 3.3Å; G91-F273 WeakPolarHBondContact O-CE2 3.38Å
92	S	92.7	Very high	95.4	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.028	17%	0.172	C	C	.	.	S	Bend	trans	-89.3	-161.9	-179.6	89.1	0	0	0	0	112.5	L89 T198 S271	L89-S92 PolarHBondContact N-OG 2.03Å; L89-S92 VanDerWaalsContact O-CB 3.31Å; L89-S92 WeakPolarHBondContact O-CB 3.4Å; L89-S92 PolarHBondContact O-N 3.41Å; L89-S92 PolarHBondContact O-OG 2.9Å; S92-T198 PolarHBondContact N-OG1 2.96Å; S92-T198 PolarHBondContact O-N 3.43Å; S92-T198 PolarHBondContact O-OG1 3.01Å; S92-S271 VanDerWaalsContact CB-OG 3.31Å; S92-S271 WeakPolarHBondContact CB-OG 3.48Å
93	N	94.7	Very high	95.1	Very high	69 Å²	69	29 Å²	29	37%	0.369	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.9	164.7	-64.1	-43.3	0	0	0	110.4	I196 N197 S271	N93-I196 WeakPolarHBondContact CA-O 3.19Å; N93-N197 WeakPolarHBondContact OD1-CA 3.37Å; N93-N197 PolarHBondContact OD1-ND2 2.92Å; N93-S271 WeakPolarHBondContact O-CB 3.22Å
94	I	96	Very high	94.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.8	167.3	-170.9	173.8	0	0	0	109	D85 A88 F96 S195 I196 T198 Y230	D85-I94 WeakPolarHBondContact OD1-CA 3.45Å; D85-I94 VanDerWaalsContact OD1-CG1 3.22Å; D85-I94 WeakPolarHBondContact OD1-CG1 3.05Å; A88-I94 HydrophobicContact CB-CB 3.72Å; A88-I94 HydrophobicContact CB-CD1 4.19Å; A88-I94 HydrophobicContact CB-CG1 4.04Å; I94-F96 HydrophobicContact CD1-CE1 4.37Å; I94-F96 HydrophobicContact CD1-CE2 4.3Å; I94-F96 HydrophobicContact CD1-CZ 3.79Å; I94-F96 HydrophobicContact CG1-CE2 4.19Å; I94-F96 HydrophobicContact CG1-CZ 4.15Å; I94-F96 HydrophobicContact CG2-CE2 3.79Å; I94-F96 HydrophobicContact CG2-CZ 4.24Å; I94-S195 CarbonylContact O-C 3.58Å; I94-S195 WeakPolarHBondContact O-CA 3.39Å; I94-I196 HydrophobicContact CG2-CB 3.92Å; I94-I196 PolarHBondContact N-O 2.77Å; I94-I196 PolarHBondContact O-N 3.22Å; I94-T198 HydrophobicContact CB-CG2 4.19Å; I94-T198 HydrophobicContact CG2-CG2 3.88Å; I94-Y230 HydrophobicContact CD1-CD2 3.5Å; I94-Y230 VanDerWaalsContact CD1-CD2 3.5Å; I94-Y230 HydrophobicContact CD1-CE2 4.36Å; I94-Y230 HydrophobicContact CD1-CG 3.89Å
95	T	97.3	Very high	94.2	Very high	35 Å²	35	35.2 Å²	35.2	22%	0.215	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.6	-177.7	-55.2	0	0	0	0	111.2	S84 D85 V97 S195	S84-T95 VanDerWaalsContact CA-O 3.31Å; S84-T95 WeakPolarHBondContact CA-O 3.35Å; D85-T95 VanDerWaalsContact CG-N 3.34Å; D85-T95 PolarHBondContact N-O 2.91Å; D85-T95 PolarHBondContact OD1-N 2.8Å; D85-T95 VanDerWaalsContact OD2-CB 3.28Å; D85-T95 WeakPolarHBondContact OD2-CB 3.44Å; D85-T95 PolarHBondContact OD2-N 2.83Å; D85-T95 PolarHBondContact OD2-OG1 2.84Å; T95-V97 HydrophobicContact CG2-CG2 4.49Å; T95-S195 WeakPolarHBondContact CG2-OG 3.43Å; T95-S195 PolarHBondContact OG1-OG 2.76Å
96	F	97.9	Very high	93.9	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.6	175.1	-58.9	-89.3	0	0	0	110.1	L82 T83 I94 R193 V194 I196 M208 Y230	L82-F96 HydrophobicContact CD1-CB 4.11Å; L82-F96 HydrophobicContact CD1-CD1 4.24Å; T83-F96 WeakPolarHBondContact O-CA 3.43Å; I94-F96 HydrophobicContact CD1-CE1 4.37Å; I94-F96 HydrophobicContact CD1-CE2 4.3Å; I94-F96 HydrophobicContact CD1-CZ 3.79Å; I94-F96 HydrophobicContact CG1-CE2 4.19Å; I94-F96 HydrophobicContact CG1-CZ 4.15Å; I94-F96 HydrophobicContact CG2-CE2 3.79Å; I94-F96 HydrophobicContact CG2-CZ 4.24Å; F96-R193 WeakPolarHBondContact O-CA 3.43Å; F96-V194 HydrophobicContact CB-CG1 3.99Å; F96-V194 HydrophobicContact CD2-CG1 4.22Å; F96-V194 PolarHBondContact N-O 3.39Å; F96-V194 PolarHBondContact O-N 2.99Å; F96-I196 HydrophobicContact CD2-CD1 4.26Å; F96-I196 HydrophobicContact CD2-CG1 4.44Å; F96-I196 HydrophobicContact CE2-CD1 3.71Å; F96-I196 HydrophobicContact CE2-CG1 4.13Å; F96-M208 HydrophobicContact CD1-CB 3.98Å; F96-M208 HydrophobicContact CD1-CE 4.32Å; F96-M208 HydrophobicContact CD1-CG 3.75Å; F96-M208 HydrophobicContact CD2-CE 3.85Å; F96-M208 HydrophobicContact CE1-CB 3.62Å; F96-M208 HydrophobicContact CE1-CE 4.06Å; F96-M208 HydrophobicContact CE1-CG 3.87Å; F96-M208 HydrophobicContact CE2-CE 3.56Å; F96-M208 HydrophobicContact CG-CE 4.22Å; F96-M208 HydrophobicContact CG-CG 4.22Å; F96-M208 HydrophobicContact CZ-CB 4.22Å; F96-M208 HydrophobicContact CZ-CE 3.66Å; F96-M208 HydrophobicContact CZ-CG 4.43Å; F96-Y230 AromaticContact CE1-CD1 3.6Å; F96-Y230 HydrophobicContact CE1-CD1 3.6Å; F96-Y230 HydrophobicContact CE1-CE1 4.2Å; F96-Y230 AromaticContact CE1-CG 3.8Å; F96-Y230 HydrophobicContact CE1-CG 3.8Å; F96-Y230 AromaticContact CZ-CD1 3.55Å; F96-Y230 HydrophobicContact CZ-CD1 3.55Å; F96-Y230 AromaticContact CZ-CD2 3.94Å; F96-Y230 HydrophobicContact CZ-CD2 3.94Å; F96-Y230 AromaticContact CZ-CE1 3.8Å; F96-Y230 HydrophobicContact CZ-CE1 3.8Å; F96-Y230 HydrophobicContact CZ-CE2 4.15Å; F96-Y230 AromaticContact CZ-CG 3.61Å; F96-Y230 HydrophobicContact CZ-CG 3.61Å
97	V	97.7	Very high	93.6	Very high	38 Å²	38	37.2 Å²	37.2	23%	0.23	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.7	175	-175.4	0	0	0	0	108.9	L82 T83 T95 R193	L82-V97 WeakPolarHBondContact CA-O 3.32Å; T83-V97 PolarHBondContact N-O 2.88Å; T83-V97 PolarHBondContact O-N 2.56Å; T95-V97 HydrophobicContact CG2-CG2 4.49Å; V97-R193 HydrophobicContact CG2-CB 4.21Å
98	V	97.6	Very high	93.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.1	175.7	-177.3	0	0	0	0	107.8	A80 V81 L82 Y175 F177 S191 A192 V210	A80-V98 HydrophobicContact CB-CG1 4.07Å; V81-V98 CarbonylContact O-C 3.58Å; V81-V98 WeakPolarHBondContact O-CA 3.44Å; L82-V98 HydrophobicContact CD1-CG2 3.62Å; V98-Y175 HydrophobicContact CB-CD1 4.35Å; V98-Y175 HydrophobicContact CB-CE1 4.11Å; V98-Y175 HydrophobicContact CG1-CD1 4.21Å; V98-Y175 HydrophobicContact CG1-CE1 3.8Å; V98-F177 HydrophobicContact CG2-CE1 3.65Å; V98-F177 HydrophobicContact CG2-CZ 4.01Å; V98-S191 WeakPolarHBondContact O-CA 3.47Å; V98-S191 WeakPolarHBondContact O-CB 3.08Å; V98-A192 PolarHBondContact N-O 3.26Å; V98-A192 PolarHBondContact O-N 2.78Å; V98-V210 HydrophobicContact CG2-CB 4.21Å; V98-V210 HydrophobicContact CG2-CG1 4.01Å; V98-V210 HydrophobicContact CG2-CG2 3.86Å
99	N	97.1	Very high	92.9	Very high	66 Å²	66	39.7 Å²	39.7	35%	0.353	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.2	176	-63.7	-63.1	0	0	0	109.8	V81 S191	V81-N99 PolarHBondContact N-O 2.81Å; V81-N99 PolarHBondContact O-N 3.45Å; N99-S191 WeakPolarHBondContact OD1-CB 3.39Å
100	L	95.8	Very high	92.5	Very high	14 Å²	14	43 Å²	43	7%	0.073	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	125.7	173.4	-61.8	-176.9	0	0	0	110.2	V78 Q79 A80 F102 F173 C190 V212 I223	V78-L100 HydrophobicContact CG1-CB 4.18Å; V78-L100 HydrophobicContact CG1-CD2 4.17Å; Q79-L100 CarbonylContact O-C 3.5Å; Q79-L100 WeakPolarHBondContact O-CA 2.97Å; A80-L100 HydrophobicContact CB-CD2 3.98Å; L100-F102 HydrophobicContact CB-CE1 4.44Å; L100-F102 HydrophobicContact CB-CE2 3.83Å; L100-F102 HydrophobicContact CB-CZ 3.73Å; L100-F102 HydrophobicContact CD1-CE1 4.49Å; L100-F102 HydrophobicContact CD1-CZ 3.96Å; L100-F173 HydrophobicContact CD1-CD1 4.02Å; L100-F173 HydrophobicContact CD1-CD2 3.96Å; L100-F173 HydrophobicContact CD1-CE1 4.01Å; L100-F173 HydrophobicContact CD1-CE2 3.95Å; L100-F173 HydrophobicContact CD1-CG 3.98Å; L100-F173 HydrophobicContact CD1-CZ 3.97Å; L100-C190 HydrophobicContact CB-CB 4.49Å; L100-C190 WeakPolarHBondContact CB-O 3.32Å; L100-C190 PolarHBondContact N-O 3Å; L100-V212 HydrophobicContact CD1-CG1 4.24Å; L100-V212 HydrophobicContact CD2-CB 4.44Å; L100-V212 HydrophobicContact CD2-CG1 4.19Å; L100-V212 HydrophobicContact CD2-CG2 4.15Å; L100-I223 HydrophobicContact CD1-CD1 4.23Å
101	V	95	Very high	92	Very high	73 Å²	73	46 Å²	46	44%	0.442	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	109.7	171.9	-178.3	0	0	0	0	107.5	Q79 V81	Q79-V101 HydrophobicContact CB-CB 4.36Å; Q79-V101 PolarHBondContact N-O 3Å; Q79-V101 PolarHBondContact O-N 3.49Å; V81-V101 HydrophobicContact CG2-CG2 3.69Å
102	F	92.3	Very high	91.6	Very high	33 Å²	33	45.1 Å²	45.1	15%	0.145	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-82.8	158.6	179.5	-62.4	-80.8	0	0	0	111.6	W73 V78 L100 Q106 I114 F173 C190	W73-F102 HydrophobicContact CH2-CD1 4.28Å; W73-F102 AromaticContact CH2-CE1 3.79Å; W73-F102 HydrophobicContact CH2-CE1 3.79Å; W73-F102 AromaticContact CZ2-CD1 3.61Å; W73-F102 HydrophobicContact CZ2-CD1 3.61Å; W73-F102 AromaticContact CZ2-CE1 3.6Å; W73-F102 HydrophobicContact CZ2-CE1 3.6Å; V78-F102 HydrophobicContact CG1-CD1 4.23Å; V78-F102 HydrophobicContact CG1-CE1 4.17Å; V78-F102 HydrophobicContact CG2-CD1 3.77Å; V78-F102 HydrophobicContact CG2-CE1 4.12Å; L100-F102 HydrophobicContact CB-CE1 4.44Å; L100-F102 HydrophobicContact CB-CE2 3.83Å; L100-F102 HydrophobicContact CB-CZ 3.73Å; L100-F102 HydrophobicContact CD1-CE1 4.49Å; L100-F102 HydrophobicContact CD1-CZ 3.96Å; F102-Q106 HydrophobicContact CB-CB 3.84Å; F102-I114 HydrophobicContact CD1-CG2 4.3Å; F102-I114 HydrophobicContact CE1-CD1 3.98Å; F102-I114 HydrophobicContact CE1-CG1 3.95Å; F102-I114 HydrophobicContact CE2-CD1 4.06Å; F102-I114 HydrophobicContact CZ-CD1 3.63Å; F102-I114 HydrophobicContact CZ-CG1 4.13Å; F102-F173 HydrophobicContact CE1-CZ 4.04Å; F102-F173 HydrophobicContact CZ-CE2 4.24Å; F102-F173 AromaticContact CZ-CZ 3.95Å; F102-F173 HydrophobicContact CZ-CZ 3.95Å; F102-C190 HydrophobicContact CE2-CB 3.76Å; F102-C190 WeakPolarHBondContact CE2-SG 3.36Å; F102-C190 HydrophobicContact CZ-CB 4.11Å; F102-C190 WeakPolarHBondContact CZ-SG 3.46Å
103	P	90.9	Very high	91.3	Very high	18 Å²	18	45 Å²	45	12%	0.117	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-52.4	162.7	166.7	-25.2	33.7	0	0	0	112.9	G75 G76 Q106	G75-P103 VanDerWaalsContact O-CB 3.28Å; G75-P103 WeakPolarHBondContact O-CB 3.22Å; G76-P103 VanDerWaalsContact C-CG 3.4Å; G76-P103 VanDerWaalsContact O-CG 3.26Å; G76-P103 WeakPolarHBondContact O-CG 3.48Å; P103-Q106 WeakPolarHBondContact O-CB 3.15Å; P103-Q106 PolarHBondContact O-N 2.92Å
104	R	87.5	Confident	91.1	Very high	219 Å²	219	41.8 Å²	41.8	83%	0.826	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	145.3	-179.5	-74.2	-171.9	173.1	-177.7	-1.2	111.4	Q106	R104-Q106 PolarHBondContact O-N 3.17Å
105	C	87.3	Confident	90.7	Very high	13 Å²	13	43 Å²	43	9%	0.088	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	19.1	177.9	-51.5	0	0	0	0	115.3	Y116 E117 C120 N122	C105-Y116 HydrophobicContact CB-CD1 4.5Å; C105-Y116 CarbonylContact O-C 3.51Å; C105-Y116 VanDerWaalsContact O-CA 3.25Å; C105-Y116 WeakPolarHBondContact O-CA 3.18Å; C105-E117 PolarHBondContact O-N 2.91Å; C105-C120 WeakPolarHBondContact CA-SG 3.42Å; C105-C120 HydrophobicContact CB-CB 3.38Å; C105-C120 WeakPolarHBondContact CB-SG 3.44Å; C105-C120 WeakPolarHBondContact SG-CB 3.4Å; C105-C120 CovalentContact SG-SG 2Å; C105-C120 PolarHBondContact SG-SG 2.87Å; C105-N122 WeakPolarHBondContact CB-ND2 3.47Å; C105-N122 PolarHBondContact SG-OD1 2.89Å
106	Q	90.3	Very high	90.1	Very high	19 Å²	19	42.2 Å²	42.2	9%	0.089	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137.6	175.5	-60.2	-175.7	6.2	0	0	110.6	E74 F102 P103 R104 I114 V115 Y116 V132	E74-Q106 PolarHBondContact O-NE2 3.47Å; F102-Q106 HydrophobicContact CB-CB 3.84Å; P103-Q106 WeakPolarHBondContact O-CB 3.15Å; P103-Q106 PolarHBondContact O-N 2.92Å; R104-Q106 PolarHBondContact O-N 3.17Å; Q106-I114 HydrophobicContact CB-CG2 3.99Å; Q106-V115 WeakPolarHBondContact CA-O 3.32Å; Q106-Y116 HydrophobicContact CG-CD1 3.93Å; Q106-Y116 HydrophobicContact CG-CE1 3.75Å; Q106-V132 HydrophobicContact CG-CG2 3.95Å
107	K	88.8	Confident	89.4	Confident	91 Å²	91	45.9 Å²	45.9	40%	0.396	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	158.2	177.7	65.7	-179.7	176	-170.7	0	112.2	I114 V115 E117	K107-I114 WeakPolarHBondContact O-CA 3.1Å; K107-V115 HydrophobicContact CG-CG2 4.05Å; K107-V115 PolarHBondContact N-O 2.88Å; K107-V115 PolarHBondContact O-N 2.84Å; K107-E117 HydrophobicContact CD-CB 4.31Å; K107-E117 HydrophobicContact CD-CG 4.36Å; K107-E117 IonicContact NZ-OE1 2.83Å; K107-E117 PolarHBondContact NZ-OE1 3.39Å
108	E	89.8	Confident	88.3	Confident	53 Å²	53	50.5 Å²	50.5	25%	0.248	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	133	172.2	-162.1	-179	-177.6	0	0	110.7	G112 N113 I114 R189 C190	E108-G112 VanDerWaalsContact OE1-CA 3.25Å; E108-G112 WeakPolarHBondContact OE1-CA 3.21Å; E108-N113 WeakPolarHBondContact CA-O 3.47Å; E108-I114 HydrophobicContact CB-CD1 4.09Å; E108-I114 HydrophobicContact CG-CD1 4.12Å; E108-R189 WeakPolarHBondContact OE1-CB 3.45Å; E108-R189 IonicContact OE1-CZ 2.75Å; E108-R189 IonicContact OE1-NE 2.68Å; E108-R189 PolarHBondContact OE1-NE 3.42Å; E108-R189 IonicContact OE1-NH2 3.86Å; E108-R189 PolarHBondContact OE1-NH2 2.88Å; E108-R189 IonicContact OE2-CZ 3.94Å; E108-R189 IonicContact OE2-NE 3.4Å; E108-R189 IonicContact OE2-NH2 3.91Å; E108-C190 VanDerWaalsContact CG-SG 3.57Å; E108-C190 VanDerWaalsContact OE2-CB 3.28Å; E108-C190 WeakPolarHBondContact OE2-CB 3.37Å; E108-C190 PolarHBondContact OE2-N 2.85Å; E108-C190 PolarHBondContact OE2-SG 3.42Å
109	D	86.8	Confident	87	Confident	39 Å²	39	58 Å²	58	21%	0.209	29%	0.291	C	S	.	.			trans	-85.5	-176.2	173.4	75.7	5.8	0	0	0	112.6	N111 G112 N113 V115 R189	D109-N111 PolarHBondContact O-N 2.73Å; D109-N111 VanDerWaalsContact OD1-C 3.32Å; D109-N111 VanDerWaalsContact OD1-CA 3.29Å; D109-N111 WeakPolarHBondContact OD1-CA 3.39Å; D109-N111 WeakPolarHBondContact OD1-CB 3.33Å; D109-N111 PolarHBondContact OD1-N 2.9Å; D109-G112 PolarHBondContact O-N 2.85Å; D109-G112 PolarHBondContact OD1-N 2.87Å; D109-N113 PolarHBondContact N-O 2.66Å; D109-N113 PolarHBondContact OD1-N 2.01Å; D109-V115 HydrophobicContact CB-CG1 4.47Å; D109-V115 HydrophobicContact CB-CG2 4.27Å; D109-R189 PolarHBondContact O-NH2 2.78Å
110	A	85.5	Confident	85.9	Confident	75 Å²	75	56.8 Å²	56.8	62%	0.62	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.5	178.3	0	0	0	0	0	114.3	K170	A110-K170 PolarHBondContact O-NZ 2.86Å; A110-K170 VanDerWaalsContact O-NZ 3.15Å
111	N	81.2	Confident	84.5	Confident	86 Å²	86	67.5 Å²	67.5	46%	0.46	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-10.1	-178.9	-66.2	-22.3	0	0	0	112.6	D109 K170	D109-N111 PolarHBondContact O-N 2.73Å; D109-N111 VanDerWaalsContact OD1-C 3.32Å; D109-N111 VanDerWaalsContact OD1-CA 3.29Å; D109-N111 WeakPolarHBondContact OD1-CA 3.39Å; D109-N111 WeakPolarHBondContact OD1-CB 3.33Å; D109-N111 PolarHBondContact OD1-N 2.9Å; N111-K170 VanDerWaalsContact O-CA 3.31Å; N111-K170 WeakPolarHBondContact O-CA 3.06Å; N111-K170 WeakPolarHBondContact O-CB 3.09Å; N111-K170 WeakPolarHBondContact O-CG 3.4Å
112	G	82.2	Confident	82.8	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.319	C	S	.	.	S	Bend	trans	91.2	6.7	-177.7	0	0	0	0	0	114.1	E108 D109 S172	E108-G112 VanDerWaalsContact OE1-CA 3.25Å; E108-G112 WeakPolarHBondContact OE1-CA 3.21Å; D109-G112 PolarHBondContact O-N 2.85Å; D109-G112 PolarHBondContact OD1-N 2.87Å; G112-S172 WeakPolarHBondContact O-CB 3.47Å; G112-S172 PolarHBondContact O-OG 2.7Å
113	N	86.3	Confident	81	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.016	35%	0.353	C	S	.	.			trans	-82.4	152.9	174.1	-59.9	-49.5	0	0	0	109.9	E108 D109 Y133 N134 W135 T136	E108-N113 WeakPolarHBondContact CA-O 3.47Å; D109-N113 PolarHBondContact N-O 2.66Å; D109-N113 PolarHBondContact OD1-N 2.01Å; N113-Y133 WeakPolarHBondContact CA-O 3.01Å; N113-Y133 WeakPolarHBondContact CB-O 3.28Å; N113-N134 PolarHBondContact OD1-OD1 3.33Å; N113-W135 PolarHBondContact OD1-N 2.64Å; N113-T136 PolarHBondContact ND2-OG1 3.31Å; N113-T136 PolarHBondContact OD1-OG1 3.15Å
114	I	88.9	Confident	79.3	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123	174.6	-47.1	-53.9	0	0	0	108.9	W73 F102 Q106 K107 E108 V132 Y133 F173 C190	W73-I114 HydrophobicContact CH2-CB 4.33Å; W73-I114 HydrophobicContact CH2-CG1 3.78Å; W73-I114 HydrophobicContact CZ2-CB 4.04Å; W73-I114 HydrophobicContact CZ2-CG1 3.88Å; W73-I114 HydrophobicContact CZ2-CG2 4Å; F102-I114 HydrophobicContact CD1-CG2 4.3Å; F102-I114 HydrophobicContact CE1-CD1 3.98Å; F102-I114 HydrophobicContact CE1-CG1 3.95Å; F102-I114 HydrophobicContact CE2-CD1 4.06Å; F102-I114 HydrophobicContact CZ-CD1 3.63Å; F102-I114 HydrophobicContact CZ-CG1 4.13Å; Q106-I114 HydrophobicContact CB-CG2 3.99Å; K107-I114 WeakPolarHBondContact O-CA 3.1Å; E108-I114 HydrophobicContact CB-CD1 4.09Å; E108-I114 HydrophobicContact CG-CD1 4.12Å; I114-V132 HydrophobicContact CB-CB 4.15Å; I114-V132 HydrophobicContact CG2-CB 4.03Å; I114-V132 HydrophobicContact CG2-CG1 4.46Å; I114-V132 HydrophobicContact CG2-CG2 4.23Å; I114-V132 WeakPolarHBondContact O-CB 3.38Å; I114-V132 PolarHBondContact O-N 3.1Å; I114-Y133 HydrophobicContact CG1-CD1 4.23Å; I114-Y133 PolarHBondContact N-O 2.84Å; I114-Y133 PolarHBondContact O-N 2.88Å; I114-Y133 VanDerWaalsContact O-N 3.11Å; I114-F173 HydrophobicContact CD1-CE2 4.36Å; I114-F173 HydrophobicContact CD1-CZ 4.33Å; I114-F173 HydrophobicContact CG1-CZ 4.18Å; I114-C190 WeakPolarHBondContact CD1-SG 3.42Å
115	V	87.9	Confident	77.6	Confident	27 Å²	27	71.5 Å²	71.5	16%	0.164	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.6	-177.3	-63	0	0	0	0	110.1	Q106 K107 D109	Q106-V115 WeakPolarHBondContact CA-O 3.32Å; K107-V115 HydrophobicContact CG-CG2 4.05Å; K107-V115 PolarHBondContact N-O 2.88Å; K107-V115 PolarHBondContact O-N 2.84Å; D109-V115 HydrophobicContact CB-CG1 4.47Å; D109-V115 HydrophobicContact CB-CG2 4.27Å
116	Y	85.6	Confident	76	Confident	18 Å²	18	74.7 Å²	74.7	7%	0.071	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.9	167.1	-74.5	-73.1	0	0	0	110.4	C105 Q106 L126 L130 V132	C105-Y116 HydrophobicContact CB-CD1 4.5Å; C105-Y116 CarbonylContact O-C 3.51Å; C105-Y116 VanDerWaalsContact O-CA 3.25Å; C105-Y116 WeakPolarHBondContact O-CA 3.18Å; Q106-Y116 HydrophobicContact CG-CD1 3.93Å; Q106-Y116 HydrophobicContact CG-CE1 3.75Å; Y116-L126 HydrophobicContact CE2-CD2 4.36Å; Y116-L130 HydrophobicContact CD2-CB 4.34Å; Y116-L130 WeakPolarHBondContact CD2-O 3.08Å; Y116-L130 PolarHBondContact N-O 3.02Å; Y116-V132 HydrophobicContact CD1-CG2 4.17Å; Y116-V132 HydrophobicContact CD2-CG2 3.54Å; Y116-V132 HydrophobicContact CE1-CG2 4.01Å; Y116-V132 HydrophobicContact CE2-CB 4.45Å; Y116-V132 HydrophobicContact CE2-CG2 3.37Å; Y116-V132 HydrophobicContact CG-CG2 3.95Å
117	E	83.2	Confident	74.2	Confident	78 Å²	78	78.9 Å²	78.9	36%	0.364	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-75.4	128.2	178.7	-178.9	154.4	-123.7	0	0	111.2	C105 K107 N119 C120	C105-E117 PolarHBondContact O-N 2.91Å; K107-E117 HydrophobicContact CD-CB 4.31Å; K107-E117 HydrophobicContact CD-CG 4.36Å; K107-E117 IonicContact NZ-OE1 2.83Å; K107-E117 PolarHBondContact NZ-OE1 3.39Å; E117-N119 PolarHBondContact O-N 2.86Å; E117-C120 HydrophobicContact CB-CB 4.11Å; E117-C120 HydrophobicContact CG-CB 4.42Å; E117-C120 PolarHBondContact O-N 3.23Å
118	K	73.2	Confident	72.5	Confident	135 Å²	135	76.7 Å²	76.7	59%	0.587	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	130.1	174.7	-58.7	-169.6	-178.8	-136	0	109.7	C120 D129	K118-C120 VanDerWaalsContact C-N 3.33Å; K118-C120 PolarHBondContact O-N 2.82Å; K118-D129 WeakPolarHBondContact CE-OD1 3.22Å; K118-D129 IonicContact NZ-OD1 3.22Å; K118-D129 PolarHBondContact NZ-OD1 3.26Å; K118-D129 IonicContact NZ-OD2 3.17Å
119	N	71	Confident	70.8	Confident	158 Å²	158	80 Å²	80	85%	0.845	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	10.6	180	-51.1	-22.5	0	0	0	116.5	E117 R121	E117-N119 PolarHBondContact O-N 2.86Å; N119-R121 PolarHBondContact O-N 2.9Å
120	C	74.7	Confident	70.1	Confident	41 Å²	41	82.4 Å²	82.4	28%	0.277	45%	0.45	S	S	.	.			trans	-78.3	118.9	172.2	-166.1	0	0	0	0	109.9	C105 E117 K118 N122	C105-C120 WeakPolarHBondContact CA-SG 3.42Å; C105-C120 HydrophobicContact CB-CB 3.38Å; C105-C120 WeakPolarHBondContact CB-SG 3.44Å; C105-C120 WeakPolarHBondContact SG-CB 3.4Å; C105-C120 CovalentContact SG-SG 2Å; C105-C120 PolarHBondContact SG-SG 2.87Å; E117-C120 HydrophobicContact CB-CB 4.11Å; E117-C120 HydrophobicContact CG-CB 4.42Å; E117-C120 PolarHBondContact O-N 3.23Å; K118-C120 VanDerWaalsContact C-N 3.33Å; K118-C120 PolarHBondContact O-N 2.82Å; C120-N122 PolarHBondContact O-N 3.38Å
121	R	66.5	Low	69.5	Low	239 Å²	239	83 Å²	83	90%	0.902	44%	0.44	S	S	*	.			trans	-73.9	88.1	-177.4	-167.3	175.6	-176.3	174.5	0.8	109.5	N119	N119-R121 PolarHBondContact O-N 2.9Å
122	N	59	Low	69.3	Low	51 Å²	51	79.4 Å²	79.4	27%	0.273	42%	0.421	S	S	.	.			trans	-83.8	134.6	167.6	-90.5	-23.1	0	0	0	109.5	C105 C120 L124 G125	C105-N122 WeakPolarHBondContact CB-ND2 3.47Å; C105-N122 PolarHBondContact SG-OD1 2.89Å; C120-N122 PolarHBondContact O-N 3.38Å; N122-L124 PolarHBondContact O-N 2.79Å; N122-G125 PolarHBondContact O-N 3.42Å
123	D	54.3	Low	69.3	Low	163 Å²	163	80 Å²	80	87%	0.872	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-10	176.1	-68.1	-38.7	0	0	0	113.2
124	L	56.2	Low	69.1	Low	140 Å²	140	82.6 Å²	82.6	73%	0.733	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	1.5	-176.7	-100.7	85.8	0	0	0	116.2	N122 L126	N122-L124 PolarHBondContact O-N 2.79Å; L124-L126 HydrophobicContact CB-CD1 4.33Å; L124-L126 HydrophobicContact CD2-CD1 4.46Å; L124-L126 PolarHBondContact O-N 2.77Å
125	G	51.9	Low	68.4	Low	73 Å²	73	83 Å²	83	75%	0.753	44%	0.438	S	S	*	.			trans	58.6	19.3	176.6	0	0	0	0	0	115.1	N122	N122-G125 PolarHBondContact O-N 3.42Å
126	L	53.5	Low	67.4	Low	80 Å²	80	83.6 Å²	83.6	42%	0.419	44%	0.442	S	S	.	.			trans	-74.2	131.7	-179.1	-115.3	80.1	0	0	0	110.6	Y116 L124 S128	Y116-L126 HydrophobicContact CE2-CD2 4.36Å; L124-L126 HydrophobicContact CB-CD1 4.33Å; L124-L126 HydrophobicContact CD2-CD1 4.46Å; L124-L126 PolarHBondContact O-N 2.77Å; L126-S128 PolarHBondContact O-N 3.16Å
127	T	51.6	Low	66.3	Low	106 Å²	106	84.9 Å²	84.9	65%	0.65	46%	0.457	S	S	*	.			trans	-57.2	122.1	-178.9	35.8	0	0	0	0	111.6	D129	T127-D129 PolarHBondContact O-N 2.87Å
128	S	53.8	Low	65	Low	46 Å²	46	82.4 Å²	82.4	32%	0.322	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	15.1	-171	-45.6	0	0	0	0	116.3	L126	L126-S128 PolarHBondContact O-N 3.16Å
129	D	54.4	Low	64	Low	122 Å²	122	77.2 Å²	77.2	65%	0.652	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	14.1	-178.8	-83	-34	0	0	0	113.1	K118 T127	K118-D129 WeakPolarHBondContact CE-OD1 3.22Å; K118-D129 IonicContact NZ-OD1 3.22Å; K118-D129 PolarHBondContact NZ-OD1 3.26Å; K118-D129 IonicContact NZ-OD2 3.17Å; T127-D129 PolarHBondContact O-N 2.87Å
130	L	70.6	Confident	63	Low	89 Å²	89	75.3 Å²	75.3	47%	0.466	42%	0.424	S	S	.	.			trans	-91	137.5	177.9	-149.7	73.5	0	0	0	112.3	Y116	Y116-L130 HydrophobicContact CD2-CB 4.34Å; Y116-L130 WeakPolarHBondContact CD2-O 3.08Å; Y116-L130 PolarHBondContact N-O 3.02Å
131	H	73.7	Confident	61.4	Low	89 Å²	89	80 Å²	80	41%	0.412	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.5	168.4	-68.1	70.3	0	0	0	108.7	N134	H131-N134 HydrophobicContact CB-CB 4.21Å
132	V	77.6	Confident	59.9	Low	10 Å²	10	71.5 Å²	71.5	6%	0.061	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-42	171.7	-177	0	0	0	0	109.6	W73 E74 Q106 I114 Y116	W73-V132 HydrophobicContact CZ2-CG1 3.75Å; E74-V132 HydrophobicContact CB-CG1 4.3Å; Q106-V132 HydrophobicContact CG-CG2 3.95Å; I114-V132 HydrophobicContact CB-CB 4.15Å; I114-V132 HydrophobicContact CG2-CB 4.03Å; I114-V132 HydrophobicContact CG2-CG1 4.46Å; I114-V132 HydrophobicContact CG2-CG2 4.23Å; I114-V132 WeakPolarHBondContact O-CB 3.38Å; I114-V132 PolarHBondContact O-N 3.1Å; Y116-V132 HydrophobicContact CD1-CG2 4.17Å; Y116-V132 HydrophobicContact CD2-CG2 3.54Å; Y116-V132 HydrophobicContact CE1-CG2 4.01Å; Y116-V132 HydrophobicContact CE2-CB 4.45Å; Y116-V132 HydrophobicContact CE2-CG2 3.37Å; Y116-V132 HydrophobicContact CG-CG2 3.95Å
133	Y	81.8	Confident	58.7	Low	12 Å²	12	75.2 Å²	75.2	5%	0.047	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	111.2	-178.7	177	-131.3	0	0	0	110	W73 N113 I114 W135 S172 F173 R214 R215	W73-Y133 AromaticContact CH2-CD1 3.88Å; W73-Y133 HydrophobicContact CH2-CD1 3.88Å; W73-Y133 AromaticContact CH2-CG 3.99Å; W73-Y133 HydrophobicContact CH2-CG 3.99Å; W73-Y133 HydrophobicContact CZ3-CD1 4.21Å; W73-Y133 HydrophobicContact CZ3-CG 4.26Å; N113-Y133 WeakPolarHBondContact CA-O 3.01Å; N113-Y133 WeakPolarHBondContact CB-O 3.28Å; I114-Y133 HydrophobicContact CG1-CD1 4.23Å; I114-Y133 PolarHBondContact N-O 2.84Å; I114-Y133 PolarHBondContact O-N 2.88Å; I114-Y133 VanDerWaalsContact O-N 3.11Å; Y133-W135 VanDerWaalsContact OH-CE3 3.25Å; Y133-S172 VanDerWaalsContact CE1-O 3.32Å; Y133-S172 WeakPolarHBondContact CE1-O 3.37Å; Y133-S172 PolarHBondContact OH-O 3Å; Y133-F173 HydrophobicContact CD1-CE1 4.08Å; Y133-F173 AromaticContact CD1-CZ 3.88Å; Y133-F173 HydrophobicContact CD1-CZ 3.88Å; Y133-F173 HydrophobicContact CE1-CD1 4.3Å; Y133-F173 AromaticContact CE1-CE1 3.78Å; Y133-F173 HydrophobicContact CE1-CE1 3.78Å; Y133-F173 HydrophobicContact CE1-CE2 4.46Å; Y133-F173 AromaticContact CE1-CZ 3.88Å; Y133-F173 HydrophobicContact CE1-CZ 3.88Å; Y133-R214 HydrophobicContact CE1-CB 4.22Å; Y133-R214 HydrophobicContact CE2-CB 4.28Å; Y133-R215 WeakPolarHBondContact CE2-O 3.35Å; Y133-R215 PolarHBondContact OH-N 2.95Å
134	N	81.5	Confident	57.8	Low	57 Å²	57	79.1 Å²	79.1	31%	0.305	46%	0.456	S	S	.	.			trans	-106.8	100.7	177.4	-170.4	-20.6	0	0	0	109.6	N113 H131 T136 A137	N113-N134 PolarHBondContact OD1-OD1 3.33Å; H131-N134 HydrophobicContact CB-CB 4.21Å; N134-T136 PolarHBondContact OD1-N 2.68Å; N134-T136 VanDerWaalsContact OD1-N 3.08Å; N134-T136 PolarHBondContact OD1-OG1 2.94Å; N134-A137 HydrophobicContact CB-CB 4.05Å; N134-A137 PolarHBondContact OD1-N 2.88Å
135	W	75.4	Confident	56.6	Low	8 Å²	8	80.5 Å²	80.5	3%	0.03	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-36.9	176.7	170.4	-103.2	0	0	0	111.6	N113 Y133 A137 G138 F162 S172 R215 Y220	N113-W135 PolarHBondContact OD1-N 2.64Å; Y133-W135 VanDerWaalsContact OH-CE3 3.25Å; W135-A137 VanDerWaalsContact C-N 3.35Å; W135-A137 PolarHBondContact O-N 3.07Å; W135-G138 PolarHBondContact O-N 2.83Å; W135-F162 HydrophobicContact CH2-CE2 4.32Å; W135-S172 WeakPolarHBondContact CB-OG 3.19Å; W135-R215 HydrophobicContact CE3-CB 3.84Å; W135-R215 HydrophobicContact CH2-CB 4.46Å; W135-R215 HydrophobicContact CZ3-CB 3.41Å; W135-R215 VanDerWaalsContact CZ3-CB 3.41Å; W135-R215 HydrophobicContact CZ3-CG 4.26Å; W135-Y220 AromaticContact CH2-CE1 3.96Å; W135-Y220 HydrophobicContact CH2-CE1 3.96Å; W135-Y220 AromaticContact CZ3-CE1 3.95Å; W135-Y220 HydrophobicContact CZ3-CE1 3.95Å
136	T	67	Low	55.8	Low	41 Å²	41	82.7 Å²	82.7	25%	0.252	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-31.8	-177.1	43.6	0	0	0	0	113.4	N113 N134 G138 A139	N113-T136 PolarHBondContact ND2-OG1 3.31Å; N113-T136 PolarHBondContact OD1-OG1 3.15Å; N134-T136 PolarHBondContact OD1-N 2.68Å; N134-T136 VanDerWaalsContact OD1-N 3.08Å; N134-T136 PolarHBondContact OD1-OG1 2.94Å; T136-G138 VanDerWaalsContact C-N 3.32Å; T136-G138 PolarHBondContact O-N 3.44Å; T136-A139 WeakPolarHBondContact O-CB 3.44Å; T136-A139 PolarHBondContact O-N 3.5Å
137	A	62.5	Low	55.1	Low	45 Å²	45	82.5 Å²	82.5	37%	0.372	47%	0.47	S	S	.	.	H	α-helix	trans	-57.5	-44.4	178.4	0	0	0	0	0	111.9	N134 W135 A139 D140 D141	N134-A137 HydrophobicContact CB-CB 4.05Å; N134-A137 PolarHBondContact OD1-N 2.88Å; W135-A137 VanDerWaalsContact C-N 3.35Å; W135-A137 PolarHBondContact O-N 3.07Å; A137-A139 PolarHBondContact O-N 2.94Å; A137-A139 VanDerWaalsContact O-N 3.11Å; A137-D140 PolarHBondContact O-N 2.9Å; A137-D141 PolarHBondContact O-N 2.99Å
138	G	54	Low	54.8	Low	26 Å²	26	81.3 Å²	81.3	27%	0.268	46%	0.463	S	S	.	.	H	α-helix	trans	-71.7	-4.9	178.7	0	0	0	0	0	114.7	W135 T136 R215	W135-G138 PolarHBondContact O-N 2.83Å; T136-G138 VanDerWaalsContact C-N 3.32Å; T136-G138 PolarHBondContact O-N 3.44Å; G138-R215 VanDerWaalsContact C-NH1 3.28Å; G138-R215 VanDerWaalsContact O-CZ 3.27Å; G138-R215 PolarHBondContact O-NH1 3.19Å; G138-R215 PolarHBondContact O-NH2 2.78Å
139	A	52.9	Low	54.3	Low	26 Å²	26	81.8 Å²	81.8	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-92.8	-22.3	175.3	0	0	0	0	0	112.8	T136 A137 R150	T136-A139 WeakPolarHBondContact O-CB 3.44Å; T136-A139 PolarHBondContact O-N 3.5Å; A137-A139 PolarHBondContact O-N 2.94Å; A137-A139 VanDerWaalsContact O-N 3.11Å; A139-R150 PolarHBondContact O-NH2 3.13Å
140	D	49.4	Very low	54.1	Low	118 Å²	118	83.1 Å²	83.1	63%	0.631	46%	0.462	S	S	*	.	H	α-helix	trans	-110.8	-1.7	-171.9	-76.8	-16.1	0	0	0	114.3	A137 G142	A137-D140 PolarHBondContact O-N 2.9Å; D140-G142 PolarHBondContact O-N 2.81Å
141	D	42.6	Very low	53.4	Low	139 Å²	139	81 Å²	81	74%	0.743	45%	0.454	S	S	*	.			trans	-66	80.8	169.4	-76.5	-20.6	0	0	0	111.6	A137 D143	A137-D141 PolarHBondContact O-N 2.99Å; D141-D143 PolarHBondContact O-N 2.05Å
142	G	34.7	Very low	52.8	Low	60 Å²	60	82.1 Å²	82.1	62%	0.619	46%	0.46	S	S	*	.				72.4	-13.2	114.7	0	0	0	0	0	121.8	D140 W144	D140-G142 PolarHBondContact O-N 2.81Å; G142-W144 PolarHBondContact O-N 3.48Å
143	D	33.9	Very low	52.6	Low	129 Å²	129	84 Å²	84	69%	0.69	47%	0.467	S	S	*	.			trans	-90.2	87.9	-178.1	-124.2	2.8	0	0	0	110.9	D141 E145	D141-D143 PolarHBondContact O-N 2.05Å; D143-E145 PolarHBondContact O-N 2.94Å
144	W	34.4	Very low	52.7	Low	245 Å²	245	84.5 Å²	84.5	93%	0.928	47%	0.471	S	S	*	.			trans	-84.3	16.7	176.2	-81	98.9	0	0	0	114	G142	G142-W144 PolarHBondContact O-N 3.48Å
145	E	31.1	Very low	53.1	Low	169 Å²	169	85.3 Å²	85.3	79%	0.79	47%	0.47	S	S	*	.	S	Bend	trans	-112.9	115.9	172.6	-71.8	-172	148.5	0	0	110.7	D143	D143-E145 PolarHBondContact O-N 2.94Å
146	D	35.7	Very low	54	Low	120 Å²	120	85.3 Å²	85.3	64%	0.642	47%	0.47	S	S	*	.			trans	73	100.4	174.9	-154.6	35.1	0	0	0	117.4	T148 S149	D146-T148 PolarHBondContact O-N 2.9Å; D146-T148 PolarHBondContact OD1-OG1 2.94Å; D146-T148 VanDerWaalsContact OD1-OG1 3.11Å; D146-T148 WeakPolarHBondContact OD2-CB 3.26Å; D146-T148 PolarHBondContact OD2-OG1 3.33Å; D146-S149 PolarHBondContact O-N 2.9Å
147	G	38.2	Very low	55.3	Low	75 Å²	75	83.4 Å²	83.4	77%	0.773	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-1.9	179.7	0	0	0	0	0	115.7
148	T	45.3	Very low	56.7	Low	82 Å²	82	82.4 Å²	82.4	50%	0.503	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-33	179.3	-28.3	0	0	0	0	112.8	D146	D146-T148 PolarHBondContact O-N 2.9Å; D146-T148 PolarHBondContact OD1-OG1 2.94Å; D146-T148 VanDerWaalsContact OD1-OG1 3.11Å; D146-T148 WeakPolarHBondContact OD2-CB 3.26Å; D146-T148 PolarHBondContact OD2-OG1 3.33Å
149	S	44.2	Very low	58.5	Low	55 Å²	55	86.6 Å²	86.6	39%	0.385	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-46.2	-173.9	161.3	0	0	0	0	113	D146 S151 Q152	D146-S149 PolarHBondContact O-N 2.9Å; S149-S151 PolarHBondContact O-N 3.35Å; S149-Q152 PolarHBondContact O-N 2.98Å
150	R	49	Very low	60.3	Low	151 Å²	151	92 Å²	92	57%	0.57	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.9	-173.9	-162.3	173.9	-177.8	-178.8	5.3	113.5	A139	A139-R150 PolarHBondContact O-NH2 3.13Å
151	S	56.2	Low	62.3	Low	43 Å²	43	90.5 Å²	90.5	30%	0.301	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.3	179.6	-177.6	0	0	0	0	114.1	S149 R155	S149-S151 PolarHBondContact O-N 3.35Å; S151-R155 PolarHBondContact O-NE 3.35Å
152	Q	62	Low	64.5	Low	114 Å²	114	84.3 Å²	84.3	53%	0.533	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-35.2	-169.4	-65.1	-172.3	4.5	0	0	112.4	S149 R155	S149-Q152 PolarHBondContact O-N 2.98Å; Q152-R155 VanDerWaalsContact O-CD 3.3Å; Q152-R155 WeakPolarHBondContact O-CD 3.44Å; Q152-R155 PolarHBondContact O-NE 3.4Å
153	H	73.3	Confident	66.9	Low	48 Å²	48	84.8 Å²	84.8	22%	0.222	43%	0.425	C	S	.	.	S	Bend	trans	-94.5	-6.7	-175	-55.2	-63.2	0	0	0	115.2	L58 R155 R218 Y220	L58-H153 HydrophobicContact CD1-CB 4.44Å; H153-R155 VanDerWaalsContact C-N 3.31Å; H153-R155 PolarHBondContact O-N 2.79Å; H153-R218 PolarHBondContact ND1-O 2.92Å; H153-Y220 WeakPolarHBondContact O-CE2 3.42Å; H153-Y220 PolarHBondContact O-OH 2.82Å
154	L	83.6	Confident	68.9	Low	23 Å²	23	87 Å²	87	12%	0.12	42%	0.423	C	S	.	.	S	Bend	trans	-96.8	58.1	180	-66.1	174.5	0	0	0	110.8	F162 W168	L154-F162 HydrophobicContact CB-CD2 3.92Å; L154-F162 HydrophobicContact CB-CE2 4.35Å; L154-F162 HydrophobicContact CD2-CD2 4.07Å; L154-F162 HydrophobicContact CD2-CE2 4.1Å; L154-F162 PolarHBondContact O-N 2.79Å; L154-W168 HydrophobicContact CD1-CH2 3.81Å; L154-W168 HydrophobicContact CD1-CZ3 4.21Å; L154-W168 HydrophobicContact CD2-CZ3 4.33Å
155	R	90.7	Very high	70.6	Confident	74 Å²	74	77.8 Å²	77.8	28%	0.279	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-134.1	151.3	-174.2	-64.2	177.2	-175.3	-100.5	2.7	110	L58 Y59 S151 Q152 H153 R159 R160 F162	L58-R155 HydrophobicContact CD2-CB 4.02Å; Y59-R155 WeakPolarHBondContact CE2-O 3.34Å; Y59-R155 PolarHBondContact OH-O 3.37Å; S151-R155 PolarHBondContact O-NE 3.35Å; Q152-R155 VanDerWaalsContact O-CD 3.3Å; Q152-R155 WeakPolarHBondContact O-CD 3.44Å; Q152-R155 PolarHBondContact O-NE 3.4Å; H153-R155 VanDerWaalsContact C-N 3.31Å; H153-R155 PolarHBondContact O-N 2.79Å; R155-R159 WeakPolarHBondContact CD-O 3.23Å; R155-R159 PolarHBondContact NH1-O 2.59Å; R155-R160 CarbonylContact C-O 3.51Å; R155-R160 VanDerWaalsContact CA-O 3.29Å; R155-R160 WeakPolarHBondContact CA-O 3.42Å; R155-F162 WeakPolarHBondContact O-CE1 3.27Å; R155-F162 VanDerWaalsContact O-CZ 3.28Å; R155-F162 WeakPolarHBondContact O-CZ 3.47Å
156	F	93.9	Very high	72.5	Confident	9 Å²	9	79.4 Å²	79.4	4%	0.039	40%	0.402	C	S	.	.			trans	-76.3	171.3	170	-72.4	-65.5	0	0	0	111.8	Y59 D158 R159 R160 F162 P163 V174 Q185 L187	Y59-F156 VanDerWaalsContact CE2-C 3.49Å; F156-D158 WeakPolarHBondContact CB-OD1 3.37Å; F156-D158 PolarHBondContact O-N 3.46Å; F156-D158 VanDerWaalsContact O-N 3.13Å; F156-R159 WeakPolarHBondContact O-CA 3.38Å; F156-R159 PolarHBondContact O-N 2.9Å; F156-R160 PolarHBondContact N-O 3.04Å; F156-F162 HydrophobicContact CB-CE1 4.32Å; F156-F162 AromaticContact CD1-CD1 3.84Å; F156-F162 HydrophobicContact CD1-CD1 3.84Å; F156-F162 AromaticContact CD1-CE1 3.52Å; F156-F162 HydrophobicContact CD1-CE1 3.52Å; F156-F162 AromaticContact CD2-CD1 3.76Å; F156-F162 HydrophobicContact CD2-CD1 3.76Å; F156-F162 HydrophobicContact CD2-CE1 4.2Å; F156-F162 AromaticContact CE1-CD1 3.85Å; F156-F162 HydrophobicContact CE1-CD1 3.85Å; F156-F162 AromaticContact CE1-CE1 3.81Å; F156-F162 HydrophobicContact CE1-CE1 3.81Å; F156-F162 AromaticContact CE2-CD1 3.83Å; F156-F162 HydrophobicContact CE2-CD1 3.83Å; F156-F162 HydrophobicContact CE2-CE1 4.49Å; F156-F162 AromaticContact CG-CD1 3.78Å; F156-F162 HydrophobicContact CG-CD1 3.78Å; F156-F162 AromaticContact CG-CE1 3.72Å; F156-F162 HydrophobicContact CG-CE1 3.72Å; F156-F162 AromaticContact CZ-CD1 3.85Å; F156-F162 HydrophobicContact CZ-CD1 3.85Å; F156-F162 HydrophobicContact CZ-CE1 4.29Å; F156-P163 HydrophobicContact CE2-CG 4.44Å; F156-V174 HydrophobicContact CD1-CG1 3.82Å; F156-V174 HydrophobicContact CE1-CG1 4.08Å; F156-Q185 HydrophobicContact CB-CG 4.16Å; F156-Q185 HydrophobicContact CD1-CB 3.96Å; F156-Q185 HydrophobicContact CD1-CG 3.89Å; F156-Q185 HydrophobicContact CD2-CG 4.01Å; F156-Q185 HydrophobicContact CE1-CB 4.25Å; F156-Q185 HydrophobicContact CE1-CG 4.23Å; F156-Q185 HydrophobicContact CE2-CG 4.27Å; F156-Q185 HydrophobicContact CG-CB 4.34Å; F156-Q185 VanDerWaalsContact CG-CD 3.42Å; F156-Q185 HydrophobicContact CG-CG 3.79Å; F156-Q185 HydrophobicContact CZ-CG 4.41Å; F156-L187 HydrophobicContact CE1-CD2 4.49Å; F156-L187 HydrophobicContact CE1-CG 4.1Å; F156-L187 HydrophobicContact CZ-CG 4.07Å
157	P	93.9	Very high	74.2	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.1	-178.6	-17.1	27.3	0	0	0	114.5	F25 W54 D55 Y59 R159 V176	F25-P157 HydrophobicContact CE1-CB 4.27Å; F25-P157 HydrophobicContact CE2-CB 4.45Å; F25-P157 HydrophobicContact CZ-CB 3.72Å; F25-P157 HydrophobicContact CZ-CG 4.47Å; W54-P157 HydrophobicContact CD2-CB 4.04Å; W54-P157 HydrophobicContact CE3-CB 3.64Å; W54-P157 HydrophobicContact CE3-CG 4.49Å; W54-P157 HydrophobicContact CH2-CB 3.69Å; W54-P157 HydrophobicContact CH2-CG 3.74Å; W54-P157 HydrophobicContact CZ2-CB 4.08Å; W54-P157 HydrophobicContact CZ2-CG 4.37Å; W54-P157 HydrophobicContact CZ3-CB 3.46Å; W54-P157 VanDerWaalsContact CZ3-CB 3.46Å; W54-P157 HydrophobicContact CZ3-CG 3.81Å; D55-P157 WeakPolarHBondContact CB-O 3.47Å; D55-P157 PolarHBondContact N-O 2.75Å; Y59-P157 HydrophobicContact CD1-CB 4.43Å; Y59-P157 HydrophobicContact CD1-CG 3.77Å; Y59-P157 HydrophobicContact CD2-CB 3.79Å; Y59-P157 HydrophobicContact CD2-CG 3.82Å; Y59-P157 HydrophobicContact CE1-CG 3.73Å; Y59-P157 HydrophobicContact CE2-CB 4.1Å; Y59-P157 HydrophobicContact CE2-CG 3.79Å; Y59-P157 VanDerWaalsContact CE2-N 3.34Å; Y59-P157 HydrophobicContact CG-CB 3.98Å; Y59-P157 HydrophobicContact CG-CG 3.82Å; P157-R159 VanDerWaalsContact C-N 3.28Å; P157-V176 HydrophobicContact CG-CG2 4.08Å
158	D	92.8	Very high	75.7	Confident	24 Å²	24	74.3 Å²	74.3	13%	0.128	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	11.1	173.3	75.8	-13.4	0	0	0	113.6	F25 F156 R160 Y183 Q185	F25-D158 HydrophobicContact CE2-CB 3.88Å; F25-D158 HydrophobicContact CZ-CB 3.84Å; F156-D158 WeakPolarHBondContact CB-OD1 3.37Å; F156-D158 PolarHBondContact O-N 3.46Å; F156-D158 VanDerWaalsContact O-N 3.13Å; D158-R160 PolarHBondContact O-N 2.93Å; D158-R160 VanDerWaalsContact OD1-CB 3.24Å; D158-R160 WeakPolarHBondContact OD1-CB 3.23Å; D158-R160 WeakPolarHBondContact OD1-CG 3.49Å; D158-R160 PolarHBondContact OD1-N 2.9Å; D158-R160 WeakPolarHBondContact OD2-CD 3.25Å; D158-R160 VanDerWaalsContact OD2-CG 3.28Å; D158-R160 WeakPolarHBondContact OD2-CG 3.14Å; D158-R160 IonicContact OD2-NE 3.24Å; D158-R160 PolarHBondContact OD2-NE 2.8Å; D158-Y183 HydrophobicContact CB-CE2 4.29Å; D158-Y183 WeakPolarHBondContact CB-OH 3.33Å; D158-Q185 PolarHBondContact OD1-NE2 3.06Å; D158-Q185 PolarHBondContact OD1-OE1 2.87Å; D158-Q185 PolarHBondContact OD2-NE2 3.17Å; D158-Q185 VanDerWaalsContact OD2-NE2 3.08Å
159	R	91.4	Very high	76.9	Confident	114 Å²	114	75.2 Å²	75.2	43%	0.43	36%	0.36	S	S	.	.	S	Bend	trans	68.1	2.1	-178.2	-50.1	178.6	-177.6	125	0.2	115.4	E53 D55 R155 F156 P157	E53-R159 IonicContact OE2-CZ 3.3Å; E53-R159 IonicContact OE2-NH1 2.73Å; E53-R159 PolarHBondContact OE2-NH1 2.86Å; E53-R159 IonicContact OE2-NH2 2.75Å; E53-R159 PolarHBondContact OE2-NH2 3.31Å; D55-R159 HydrophobicContact CB-CG 4.21Å; D55-R159 IonicContact OD2-NE 3.98Å; R155-R159 WeakPolarHBondContact CD-O 3.23Å; R155-R159 PolarHBondContact NH1-O 2.59Å; F156-R159 WeakPolarHBondContact O-CA 3.38Å; F156-R159 PolarHBondContact O-N 2.9Å; P157-R159 VanDerWaalsContact C-N 3.28Å
160	R	91.2	Very high	78.3	Confident	139 Å²	139	76.8 Å²	76.8	53%	0.525	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-66.2	138.8	172.4	-66.4	-178	-162	-124	0.9	110.1	R155 F156 D158	R155-R160 CarbonylContact C-O 3.51Å; R155-R160 VanDerWaalsContact CA-O 3.29Å; R155-R160 WeakPolarHBondContact CA-O 3.42Å; F156-R160 PolarHBondContact N-O 3.04Å; D158-R160 PolarHBondContact O-N 2.93Å; D158-R160 VanDerWaalsContact OD1-CB 3.24Å; D158-R160 WeakPolarHBondContact OD1-CB 3.23Å; D158-R160 WeakPolarHBondContact OD1-CG 3.49Å; D158-R160 PolarHBondContact OD1-N 2.9Å; D158-R160 WeakPolarHBondContact OD2-CD 3.25Å; D158-R160 VanDerWaalsContact OD2-CG 3.28Å; D158-R160 WeakPolarHBondContact OD2-CG 3.14Å; D158-R160 IonicContact OD2-NE 3.24Å; D158-R160 PolarHBondContact OD2-NE 2.8Å
161	P	90.1	Very high	79.7	Confident	87 Å²	87	72.8 Å²	72.8	57%	0.565	35%	0.345	S	S	*	.	B	Isolated β-bridge	trans	-66.5	148.8	178.3	29	-34.7	0	0	0	110.9
162	F	89	Confident	81	Confident	9 Å²	9	70.8 Å²	70.8	4%	0.039	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-62.1	134.4	172.6	-67.3	-21.7	0	0	0	111.6	W135 L154 R155 F156 R164 V174 L187 Y220	W135-F162 HydrophobicContact CH2-CE2 4.32Å; L154-F162 HydrophobicContact CB-CD2 3.92Å; L154-F162 HydrophobicContact CB-CE2 4.35Å; L154-F162 HydrophobicContact CD2-CD2 4.07Å; L154-F162 HydrophobicContact CD2-CE2 4.1Å; L154-F162 PolarHBondContact O-N 2.79Å; R155-F162 WeakPolarHBondContact O-CE1 3.27Å; R155-F162 VanDerWaalsContact O-CZ 3.28Å; R155-F162 WeakPolarHBondContact O-CZ 3.47Å; F156-F162 HydrophobicContact CB-CE1 4.32Å; F156-F162 AromaticContact CD1-CD1 3.84Å; F156-F162 HydrophobicContact CD1-CD1 3.84Å; F156-F162 AromaticContact CD1-CE1 3.52Å; F156-F162 HydrophobicContact CD1-CE1 3.52Å; F156-F162 AromaticContact CD2-CD1 3.76Å; F156-F162 HydrophobicContact CD2-CD1 3.76Å; F156-F162 HydrophobicContact CD2-CE1 4.2Å; F156-F162 AromaticContact CE1-CD1 3.85Å; F156-F162 HydrophobicContact CE1-CD1 3.85Å; F156-F162 AromaticContact CE1-CE1 3.81Å; F156-F162 HydrophobicContact CE1-CE1 3.81Å; F156-F162 AromaticContact CE2-CD1 3.83Å; F156-F162 HydrophobicContact CE2-CD1 3.83Å; F156-F162 HydrophobicContact CE2-CE1 4.49Å; F156-F162 AromaticContact CG-CD1 3.78Å; F156-F162 HydrophobicContact CG-CD1 3.78Å; F156-F162 AromaticContact CG-CE1 3.72Å; F156-F162 HydrophobicContact CG-CE1 3.72Å; F156-F162 AromaticContact CZ-CD1 3.85Å; F156-F162 HydrophobicContact CZ-CD1 3.85Å; F156-F162 HydrophobicContact CZ-CE1 4.29Å; F162-R164 PolarHBondContact O-N 2.8Å; F162-V174 HydrophobicContact CE1-CG2 4.11Å; F162-V174 HydrophobicContact CZ-CG2 3.79Å; F162-L187 HydrophobicContact CB-CD1 3.75Å; F162-L187 HydrophobicContact CD1-CD1 4.12Å; F162-L187 HydrophobicContact CD1-CD2 4.37Å; F162-L187 HydrophobicContact CD1-CG 4.25Å; F162-L187 HydrophobicContact CD2-CD1 3.89Å; F162-L187 HydrophobicContact CD2-CD2 4.35Å; F162-L187 HydrophobicContact CE1-CD2 4.19Å; F162-L187 HydrophobicContact CE2-CD2 4.17Å; F162-L187 HydrophobicContact CG-CD1 3.67Å; F162-L187 HydrophobicContact CG-CD2 4.46Å; F162-L187 HydrophobicContact CG-CG 4.29Å; F162-L187 HydrophobicContact CZ-CD2 4.11Å; F162-Y220 HydrophobicContact CE2-CE1 4.29Å; F162-Y220 AromaticContact CE2-CZ 3.96Å; F162-Y220 VanDerWaalsContact CE2-OH 3.26Å; F162-Y220 WeakPolarHBondContact CE2-OH 3.36Å; F162-Y220 HydrophobicContact CZ-CE1 4.05Å; F162-Y220 AromaticContact CZ-CZ 3.82Å
163	P	84.7	Confident	82.5	Confident	71 Å²	71	65.4 Å²	65.4	46%	0.461	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-54.5	139.1	167.4	-24.1	31.7	0	0	0	109.7	F156 P165	F156-P163 HydrophobicContact CE2-CG 4.44Å; P163-P165 WeakPolarHBondContact O-CD 3.48Å
164	R	76.6	Confident	83.5	Confident	174 Å²	174	63.1 Å²	63.1	66%	0.657	30%	0.296	S	S	*	.			trans	-109.9	54	177.5	-60.8	-177.5	-177	179.9	0.9	112.8	F162	F162-R164 PolarHBondContact O-N 2.8Å
165	P	70.1	Confident	84.2	Confident	52 Å²	52	62 Å²	62	34%	0.338	29%	0.29	S	S	.	.			trans	-67.9	160.2	172.8	30.5	-33.9	0	0	0	110.8	P163 G167 W168 W171	P163-P165 WeakPolarHBondContact O-CD 3.48Å; P165-G167 PolarHBondContact O-N 2.91Å; P165-W168 HydrophobicContact CG-CB 4.29Å; P165-W168 WeakPolarHBondContact O-CB 3.26Å; P165-W168 VanDerWaalsContact O-CD1 3.24Å; P165-W168 PolarHBondContact O-N 3.26Å; P165-W171 HydrophobicContact CG-CH2 3.41Å; P165-W171 VanDerWaalsContact CG-CH2 3.41Å; P165-W171 HydrophobicContact CG-CZ2 4.31Å; P165-W171 HydrophobicContact CG-CZ3 3.55Å
166	H	70.3	Confident	84.5	Confident	203 Å²	203	58.5 Å²	58.5	94%	0.94	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	126	173	-69.9	-69.4	0	0	0	110.6
167	G	71.5	Confident	84.6	Confident	40 Å²	40	58.1 Å²	58.1	41%	0.412	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	3.9	-178.5	0	0	0	0	0	116.2	P165 K169 K170	P165-G167 PolarHBondContact O-N 2.91Å; G167-K169 PolarHBondContact O-N 2.99Å; G167-K170 WeakPolarHBondContact O-CB 3.43Å; G167-K170 PolarHBondContact O-N 2.69Å
168	W	70.8	Confident	84.6	Confident	49 Å²	49	58.2 Å²	58.2	19%	0.186	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-54.6	-27.9	176.4	75.4	-76.1	0	0	0	113.8	L154 P165 K170 W171	L154-W168 HydrophobicContact CD1-CH2 3.81Å; L154-W168 HydrophobicContact CD1-CZ3 4.21Å; L154-W168 HydrophobicContact CD2-CZ3 4.33Å; P165-W168 HydrophobicContact CG-CB 4.29Å; P165-W168 WeakPolarHBondContact O-CB 3.26Å; P165-W168 VanDerWaalsContact O-CD1 3.24Å; P165-W168 PolarHBondContact O-N 3.26Å; W168-K170 PolarHBondContact O-N 3.04Å; W168-W171 HydrophobicContact CB-CE3 4.25Å; W168-W171 WeakPolarHBondContact O-CB 3.36Å; W168-W171 PolarHBondContact O-N 2.96Å
169	K	70	Confident	84.7	Confident	101 Å²	101	57.1 Å²	57.1	44%	0.439	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-59.3	-12.4	173.6	-68.1	-168	177	-167.2	0	113.9	G167	G167-K169 PolarHBondContact O-N 2.99Å
170	K	74.1	Confident	84.6	Confident	88 Å²	88	52.3 Å²	52.3	38%	0.383	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-94.1	-2.7	176	-56.5	-170.3	175.9	-161	0	113.9	A110 N111 G167 W168 S172	A110-K170 PolarHBondContact O-NZ 2.86Å; A110-K170 VanDerWaalsContact O-NZ 3.15Å; N111-K170 VanDerWaalsContact O-CA 3.31Å; N111-K170 WeakPolarHBondContact O-CA 3.06Å; N111-K170 WeakPolarHBondContact O-CB 3.09Å; N111-K170 WeakPolarHBondContact O-CG 3.4Å; G167-K170 WeakPolarHBondContact O-CB 3.43Å; G167-K170 PolarHBondContact O-N 2.69Å; W168-K170 PolarHBondContact O-N 3.04Å; K170-S172 PolarHBondContact O-N 3.02Å
171	W	78.3	Confident	84.5	Confident	67 Å²	67	46.5 Å²	46.5	25%	0.254	24%	0.235	S	C	.	.			trans	-96.4	92.9	-175.2	-62.3	-15.2	0	0	0	110.5	P165 W168 L187 G188	P165-W171 HydrophobicContact CG-CH2 3.41Å; P165-W171 VanDerWaalsContact CG-CH2 3.41Å; P165-W171 HydrophobicContact CG-CZ2 4.31Å; P165-W171 HydrophobicContact CG-CZ3 3.55Å; W168-W171 HydrophobicContact CB-CE3 4.25Å; W168-W171 WeakPolarHBondContact O-CB 3.36Å; W168-W171 PolarHBondContact O-N 2.96Å; W171-L187 HydrophobicContact CB-CB 3.86Å; W171-L187 HydrophobicContact CD2-CB 4.07Å; W171-L187 HydrophobicContact CE3-CB 3.4Å; W171-L187 HydrophobicContact CE3-CD1 4.06Å; W171-L187 HydrophobicContact CE3-CG 4.41Å; W171-L187 HydrophobicContact CG-CB 4.32Å; W171-L187 HydrophobicContact CZ3-CB 4.17Å; W171-G188 CarbonylContact C-O 3.58Å; W171-G188 VanDerWaalsContact C-O 3.32Å; W171-G188 VanDerWaalsContact CA-O 3.29Å; W171-G188 WeakPolarHBondContact CA-O 3.37Å
172	S	83.9	Confident	84.6	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.			trans	-83.2	-10.6	-167.8	-50.3	0	0	0	0	114.1	G112 Y133 W135 K170 G188	G112-S172 WeakPolarHBondContact O-CB 3.47Å; G112-S172 PolarHBondContact O-OG 2.7Å; Y133-S172 VanDerWaalsContact CE1-O 3.32Å; Y133-S172 WeakPolarHBondContact CE1-O 3.37Å; Y133-S172 PolarHBondContact OH-O 3Å; W135-S172 WeakPolarHBondContact CB-OG 3.19Å; K170-S172 PolarHBondContact O-N 3.02Å; S172-G188 PolarHBondContact N-O 2.85Å; S172-G188 VanDerWaalsContact N-O 3.14Å
173	F	93	Very high	84.9	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.5	-173.7	-57	-81.8	0	0	0	112.5	W73 L100 F102 I114 Y133 Y175 L187 G188 R189 V212 F213 R214 I223	W73-F173 HydrophobicContact CH2-CE1 4.08Å; W73-F173 AromaticContact CH2-CZ 3.97Å; W73-F173 HydrophobicContact CH2-CZ 3.97Å; W73-F173 AromaticContact CZ3-CE1 3.91Å; W73-F173 HydrophobicContact CZ3-CE1 3.91Å; W73-F173 HydrophobicContact CZ3-CZ 4.28Å; L100-F173 HydrophobicContact CD1-CD1 4.02Å; L100-F173 HydrophobicContact CD1-CD2 3.96Å; L100-F173 HydrophobicContact CD1-CE1 4.01Å; L100-F173 HydrophobicContact CD1-CE2 3.95Å; L100-F173 HydrophobicContact CD1-CG 3.98Å; L100-F173 HydrophobicContact CD1-CZ 3.97Å; F102-F173 HydrophobicContact CE1-CZ 4.04Å; F102-F173 HydrophobicContact CZ-CE2 4.24Å; F102-F173 AromaticContact CZ-CZ 3.95Å; F102-F173 HydrophobicContact CZ-CZ 3.95Å; I114-F173 HydrophobicContact CD1-CE2 4.36Å; I114-F173 HydrophobicContact CD1-CZ 4.33Å; I114-F173 HydrophobicContact CG1-CZ 4.18Å; Y133-F173 HydrophobicContact CD1-CE1 4.08Å; Y133-F173 AromaticContact CD1-CZ 3.88Å; Y133-F173 HydrophobicContact CD1-CZ 3.88Å; Y133-F173 HydrophobicContact CE1-CD1 4.3Å; Y133-F173 AromaticContact CE1-CE1 3.78Å; Y133-F173 HydrophobicContact CE1-CE1 3.78Å; Y133-F173 HydrophobicContact CE1-CE2 4.46Å; Y133-F173 AromaticContact CE1-CZ 3.88Å; Y133-F173 HydrophobicContact CE1-CZ 3.88Å; F173-Y175 HydrophobicContact CB-CD2 4.35Å; F173-Y175 HydrophobicContact CB-CE2 3.71Å; F173-L187 WeakPolarHBondContact O-CA 3.4Å; F173-G188 PolarHBondContact N-O 2.96Å; F173-G188 PolarHBondContact O-N 3.32Å; F173-R189 VanDerWaalsContact CD2-O 3.29Å; F173-R189 WeakPolarHBondContact CD2-O 3.49Å; F173-V212 HydrophobicContact CB-CG1 4.08Å; F173-V212 HydrophobicContact CD1-CG1 4.35Å; F173-V212 HydrophobicContact CG-CG1 4.49Å; F173-F213 WeakPolarHBondContact CA-O 3.34Å; F173-R214 HydrophobicContact CD1-CB 4.16Å; F173-R214 HydrophobicContact CE1-CB 4.2Å; F173-I223 HydrophobicContact CD1-CD1 3.57Å; F173-I223 HydrophobicContact CE1-CD1 3.48Å; F173-I223 VanDerWaalsContact CE1-CD1 3.48Å
174	V	94.8	Very high	85.4	Confident	1 Å²	1	42 Å²	42	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.3	172.1	175.8	0	0	0	0	108.1	Y59 F156 F162 V176 L187 V212 F213 Y220	Y59-V174 HydrophobicContact CE1-CB 4.49Å; Y59-V174 HydrophobicContact CE1-CG1 4.21Å; F156-V174 HydrophobicContact CD1-CG1 3.82Å; F156-V174 HydrophobicContact CE1-CG1 4.08Å; F162-V174 HydrophobicContact CE1-CG2 4.11Å; F162-V174 HydrophobicContact CZ-CG2 3.79Å; V174-V176 HydrophobicContact CG1-CG2 4.4Å; V174-L187 HydrophobicContact CG2-CD2 3.57Å; V174-V212 WeakPolarHBondContact O-CA 3.21Å; V174-F213 HydrophobicContact CB-CB 4.27Å; V174-F213 PolarHBondContact N-O 2.75Å; V174-F213 PolarHBondContact O-N 3.48Å; V174-Y220 HydrophobicContact CG2-CD1 4.09Å; V174-Y220 HydrophobicContact CG2-CE1 4.11Å
175	Y	96.6	Very high	86.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.1	176.6	-66.5	-98	0	0	0	109.4	V98 F173 Q185 K186 R189 C190 A192 V210 V212	V98-Y175 HydrophobicContact CB-CD1 4.35Å; V98-Y175 HydrophobicContact CB-CE1 4.11Å; V98-Y175 HydrophobicContact CG1-CD1 4.21Å; V98-Y175 HydrophobicContact CG1-CE1 3.8Å; F173-Y175 HydrophobicContact CB-CD2 4.35Å; F173-Y175 HydrophobicContact CB-CE2 3.71Å; Y175-Q185 CarbonylContact O-C 3.59Å; Y175-Q185 VanDerWaalsContact O-CA 3.27Å; Y175-Q185 WeakPolarHBondContact O-CA 3.43Å; Y175-K186 PolarHBondContact N-O 3.21Å; Y175-K186 PolarHBondContact O-N 3.4Å; Y175-R189 WeakPolarHBondContact CE2-O 3.3Å; Y175-R189 PolarHBondContact OH-O 2.78Å; Y175-C190 PolarHBondContact OH-O 2.94Å; Y175-A192 HydrophobicContact CD1-CB 3.82Å; Y175-A192 HydrophobicContact CD2-CB 3.57Å; Y175-A192 HydrophobicContact CE1-CB 3.93Å; Y175-A192 HydrophobicContact CE2-CB 3.67Å; Y175-A192 HydrophobicContact CG-CB 3.64Å; Y175-V210 HydrophobicContact CD1-CG1 4.24Å; Y175-V212 HydrophobicContact CD1-CB 4.49Å; Y175-V212 HydrophobicContact CD1-CG1 4.18Å; Y175-V212 HydrophobicContact CD1-CG2 3.66Å; Y175-V212 HydrophobicContact CE1-CB 4.46Å; Y175-V212 HydrophobicContact CE1-CG1 3.91Å; Y175-V212 HydrophobicContact CE1-CG2 3.67Å
176	V	96.8	Very high	87.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	107.3	172.9	-172.5	0	0	0	0	108	F25 L29 P157 V174 V210 T211 F213	F25-V176 HydrophobicContact CD1-CG1 4.45Å; F25-V176 HydrophobicContact CE1-CG1 4.1Å; L29-V176 HydrophobicContact CD1-CG1 3.6Å; L29-V176 HydrophobicContact CD2-CG1 4.47Å; P157-V176 HydrophobicContact CG-CG2 4.08Å; V174-V176 HydrophobicContact CG1-CG2 4.4Å; V176-V210 WeakPolarHBondContact O-CA 3.34Å; V176-T211 PolarHBondContact N-O 2.98Å; V176-T211 PolarHBondContact O-N 2.92Å; V176-F213 HydrophobicContact CG2-CD2 4.21Å; V176-F213 HydrophobicContact CG2-CE2 3.9Å
177	F	96.7	Very high	88.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	140.7	174.3	-61.5	-100.2	0	0	0	109.2	W47 V98 Y183 F184 A192 V194 M208 E209 V210	W47-F177 HydrophobicContact CH2-CB 3.57Å; W47-F177 HydrophobicContact CZ2-CB 4.47Å; W47-F177 HydrophobicContact CZ3-CB 4.07Å; V98-F177 HydrophobicContact CG2-CE1 3.65Å; V98-F177 HydrophobicContact CG2-CZ 4.01Å; F177-Y183 CarbonylContact O-C 3.49Å; F177-Y183 WeakPolarHBondContact O-CA 3.25Å; F177-Y183 WeakPolarHBondContact O-CB 3.39Å; F177-F184 HydrophobicContact CB-CB 4.47Å; F177-F184 HydrophobicContact CD2-CD1 4.28Å; F177-F184 PolarHBondContact N-O 2.87Å; F177-F184 PolarHBondContact O-N 3.48Å; F177-A192 HydrophobicContact CZ-CB 4.27Å; F177-V194 HydrophobicContact CD1-CG1 3.44Å; F177-V194 VanDerWaalsContact CD1-CG1 3.44Å; F177-V194 HydrophobicContact CD2-CG1 4.26Å; F177-V194 HydrophobicContact CE1-CB 4.38Å; F177-V194 HydrophobicContact CE1-CG1 3.49Å; F177-V194 VanDerWaalsContact CE1-CG1 3.49Å; F177-V194 HydrophobicContact CE2-CB 4.46Å; F177-V194 HydrophobicContact CE2-CG1 4.3Å; F177-V194 HydrophobicContact CG-CG1 3.85Å; F177-V194 HydrophobicContact CZ-CB 4.36Å; F177-V194 HydrophobicContact CZ-CG1 3.95Å; F177-M208 HydrophobicContact CB-SD 4.08Å; F177-M208 HydrophobicContact CD1-SD 4.2Å; F177-E209 CarbonylContact C-O 3.59Å; F177-E209 WeakPolarHBondContact CA-O 3.37Å; F177-V210 HydrophobicContact CD1-CG1 4.35Å; F177-V210 HydrophobicContact CD1-CG2 3.4Å; F177-V210 VanDerWaalsContact CD1-CG2 3.4Å; F177-V210 HydrophobicContact CE1-CG1 4.36Å; F177-V210 HydrophobicContact CE1-CG2 3.76Å; F177-V210 HydrophobicContact CG-CG2 4.12Å
178	H	95	Very high	89.5	Confident	3 Å²	3	25 Å²	25	1%	0.014	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	125.2	-175.8	177.4	-118	0	0	0	110.7	L29 D50 Q182 E209	L29-H178 HydrophobicContact CB-CB 4.15Å; L29-H178 HydrophobicContact CD1-CB 3.87Å; D50-H178 IonicContact OD2-NE2 2.83Å; H178-Q182 WeakPolarHBondContact CA-O 3.48Å; H178-Q182 PolarHBondContact CD2-O 2.86Å; H178-Q182 VanDerWaalsContact CD2-O 3.25Å; H178-E209 HydrophobicContact CB-CB 4.4Å; H178-E209 PolarHBondContact N-O 2.88Å; H178-E209 IonicContact ND1-OE2 2.7Å; H178-E209 PolarHBondContact ND1-OE2 3.41Å; H178-E209 PolarHBondContact O-N 2.87Å
179	T	93.3	Very high	90.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	152.1	176.1	-164.6	0	0	0	0	109.3	L44 W47 G181 Q182 I196 V207 M208 Y230	L44-T179 HydrophobicContact CD1-CG2 4.15Å; W47-T179 HydrophobicContact CH2-CG2 4.18Å; W47-T179 HydrophobicContact CZ3-CG2 4.01Å; T179-G181 VanDerWaalsContact C-N 3.26Å; T179-G181 PolarHBondContact O-N 3.34Å; T179-G181 VanDerWaalsContact O-N 3.14Å; T179-Q182 PolarHBondContact N-O 3.12Å; T179-Q182 PolarHBondContact O-N 2.93Å; T179-I196 HydrophobicContact CG2-CD1 4.05Å; T179-V207 WeakPolarHBondContact CB-O 3.36Å; T179-V207 PolarHBondContact OG1-O 2.85Å; T179-M208 HydrophobicContact CG2-CE 3.52Å; T179-M208 HydrophobicContact CG2-SD 4.44Å; T179-Y230 WeakPolarHBondContact OG1-CE1 3.46Å; T179-Y230 PolarHBondContact OG1-OH 2.9Å
180	L	89.6	Confident	91.6	Very high	13 Å²	13	22.4 Å²	22.4	7%	0.068	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	39.5	173	-59.4	172.3	0	0	0	114.5	L44 Q182 L201 Q206	L44-L180 HydrophobicContact CD1-CD1 4.5Å; L180-Q182 PolarHBondContact O-N 2.85Å; L180-L201 HydrophobicContact CD1-CD1 4.28Å; L180-L201 HydrophobicContact CD1-CD2 3.36Å; L180-L201 HydrophobicContact CD1-CG 4.4Å; L180-Q206 HydrophobicContact CD2-CG 4.36Å; L180-Q206 VanDerWaalsContact CD2-OE1 3.22Å
181	G	89.1	Confident	92.6	Very high	17 Å²	17	20.8 Å²	20.8	18%	0.175	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	19.5	-178.2	0	0	0	0	0	114.7	D50 T179	D50-G181 WeakPolarHBondContact CB-O 3.42Å; D50-G181 VanDerWaalsContact CG-C 3.47Å; D50-G181 PolarHBondContact N-O 2.84Å; D50-G181 WeakPolarHBondContact OD2-CA 3.24Å; T179-G181 VanDerWaalsContact C-N 3.26Å; T179-G181 PolarHBondContact O-N 3.34Å; T179-G181 VanDerWaalsContact O-N 3.14Å
182	Q	93.2	Very high	93.4	Very high	15 Å²	15	18 Å²	18	7%	0.07	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.2	-177.9	-65.8	177.2	79.3	0	0	110.2	N42 W47 S48 H178 T179 L180	N42-Q182 PolarHBondContact O-NE2 2.82Å; W47-Q182 HydrophobicContact CB-CB 4.12Å; W47-Q182 HydrophobicContact CE3-CB 4.2Å; S48-Q182 CarbonylContact O-C 3.59Å; S48-Q182 WeakPolarHBondContact O-CA 3.37Å; S48-Q182 WeakPolarHBondContact O-CB 3.39Å; H178-Q182 WeakPolarHBondContact CA-O 3.48Å; H178-Q182 PolarHBondContact CD2-O 2.86Å; H178-Q182 VanDerWaalsContact CD2-O 3.25Å; T179-Q182 PolarHBondContact N-O 3.12Å; T179-Q182 PolarHBondContact O-N 2.93Å; L180-Q182 PolarHBondContact O-N 2.85Å
183	Y	94.9	Very high	94	Very high	1 Å²	1	26.1 Å²	26.1	0%	0.004	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.4	175.8	69.9	-94.5	0	0	0	113.6	F25 W47 S48 S49 N52 D158 F177	F25-Y183 HydrophobicContact CB-CD1 3.89Å; F25-Y183 HydrophobicContact CB-CE1 3.97Å; F25-Y183 AromaticContact CD1-CD1 3.38Å; F25-Y183 HydrophobicContact CD1-CD1 3.38Å; F25-Y183 AromaticContact CD1-CD2 3.89Å; F25-Y183 HydrophobicContact CD1-CD2 3.89Å; F25-Y183 AromaticContact CD1-CE1 3.54Å; F25-Y183 HydrophobicContact CD1-CE1 3.54Å; F25-Y183 HydrophobicContact CD1-CE2 4.09Å; F25-Y183 AromaticContact CD1-CG 3.54Å; F25-Y183 HydrophobicContact CD1-CG 3.54Å; F25-Y183 AromaticContact CD1-CZ 3.91Å; F25-Y183 HydrophobicContact CD2-CD1 4.28Å; F25-Y183 AromaticContact CD2-CE1 3.63Å; F25-Y183 HydrophobicContact CD2-CE1 3.63Å; F25-Y183 AromaticContact CD2-CZ 3.91Å; F25-Y183 AromaticContact CE1-CD1 3.88Å; F25-Y183 HydrophobicContact CE1-CD1 3.88Å; F25-Y183 AromaticContact CE1-CD2 3.54Å; F25-Y183 HydrophobicContact CE1-CD2 3.54Å; F25-Y183 AromaticContact CE1-CE1 3.82Å; F25-Y183 HydrophobicContact CE1-CE1 3.82Å; F25-Y183 AromaticContact CE1-CE2 3.54Å; F25-Y183 HydrophobicContact CE1-CE2 3.54Å; F25-Y183 AromaticContact CE1-CG 3.72Å; F25-Y183 HydrophobicContact CE1-CG 3.72Å; F25-Y183 AromaticContact CE1-CZ 3.67Å; F25-Y183 AromaticContact CE2-CE1 3.9Å; F25-Y183 HydrophobicContact CE2-CE1 3.9Å; F25-Y183 HydrophobicContact CE2-CE2 4.24Å; F25-Y183 AromaticContact CE2-CZ 3.66Å; F25-Y183 AromaticContact CG-CD1 3.6Å; F25-Y183 HydrophobicContact CG-CD1 3.6Å; F25-Y183 AromaticContact CG-CE1 3.44Å; F25-Y183 HydrophobicContact CG-CE1 3.44Å; F25-Y183 VanDerWaalsContact CG-CE1 3.44Å; F25-Y183 HydrophobicContact CG-CG 4.24Å; F25-Y183 HydrophobicContact CZ-CD1 4.5Å; F25-Y183 HydrophobicContact CZ-CD2 4.12Å; F25-Y183 AromaticContact CZ-CE1 3.98Å; F25-Y183 HydrophobicContact CZ-CE1 3.98Å; F25-Y183 AromaticContact CZ-CE2 3.61Å; F25-Y183 HydrophobicContact CZ-CE2 3.61Å; F25-Y183 AromaticContact CZ-CZ 3.51Å; W47-Y183 WeakPolarHBondContact CA-O 3.36Å; S48-Y183 PolarHBondContact N-O 2.89Å; S48-Y183 PolarHBondContact O-N 3.44Å; S49-Y183 WeakPolarHBondContact O-CE1 3.48Å; N52-Y183 HydrophobicContact CB-CE1 4.11Å; N52-Y183 WeakPolarHBondContact CB-OH 3.45Å; N52-Y183 PolarHBondContact ND2-OH 3.42Å; D158-Y183 HydrophobicContact CB-CE2 4.29Å; D158-Y183 WeakPolarHBondContact CB-OH 3.33Å; F177-Y183 CarbonylContact O-C 3.49Å; F177-Y183 WeakPolarHBondContact O-CA 3.25Å; F177-Y183 WeakPolarHBondContact O-CB 3.39Å
184	F	95.8	Very high	94.2	Very high	57 Å²	57	26.6 Å²	26.6	25%	0.25	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.2	170.7	-178.3	-94.9	0	0	0	109.5	G46 W47 F177 K186 V194	G46-F184 WeakPolarHBondContact O-CD2 3.25Å; W47-F184 HydrophobicContact CD2-CB 3.49Å; W47-F184 VanDerWaalsContact CD2-CB 3.49Å; W47-F184 VanDerWaalsContact CE2-CB 3.47Å; W47-F184 HydrophobicContact CE3-CB 3.67Å; W47-F184 HydrophobicContact CG-CB 4.08Å; W47-F184 HydrophobicContact CH2-CB 3.77Å; W47-F184 HydrophobicContact CZ2-CB 3.61Å; W47-F184 HydrophobicContact CZ2-CG 4.37Å; W47-F184 HydrophobicContact CZ3-CB 3.8Å; F177-F184 HydrophobicContact CB-CB 4.47Å; F177-F184 HydrophobicContact CD2-CD1 4.28Å; F177-F184 PolarHBondContact N-O 2.87Å; F177-F184 PolarHBondContact O-N 3.48Å; F184-K186 HydrophobicContact CD1-CB 4.43Å; F184-K186 HydrophobicContact CE1-CB 3.81Å; F184-K186 HydrophobicContact CE1-CD 4.1Å; F184-V194 HydrophobicContact CD1-CB 4.41Å; F184-V194 HydrophobicContact CD1-CG2 3.73Å; F184-V194 HydrophobicContact CE1-CG2 3.95Å; F184-V194 HydrophobicContact CG-CG2 4.28Å
185	Q	95.8	Very high	94.2	Very high	23 Å²	23	29.8 Å²	29.8	11%	0.107	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.1	-175.4	64	-169.2	23.9	0	0	110.4	F156 D158 Y175	F156-Q185 HydrophobicContact CB-CG 4.16Å; F156-Q185 HydrophobicContact CD1-CB 3.96Å; F156-Q185 HydrophobicContact CD1-CG 3.89Å; F156-Q185 HydrophobicContact CD2-CG 4.01Å; F156-Q185 HydrophobicContact CE1-CB 4.25Å; F156-Q185 HydrophobicContact CE1-CG 4.23Å; F156-Q185 HydrophobicContact CE2-CG 4.27Å; F156-Q185 HydrophobicContact CG-CB 4.34Å; F156-Q185 VanDerWaalsContact CG-CD 3.42Å; F156-Q185 HydrophobicContact CG-CG 3.79Å; F156-Q185 HydrophobicContact CZ-CG 4.41Å; D158-Q185 PolarHBondContact OD1-NE2 3.06Å; D158-Q185 PolarHBondContact OD1-OE1 2.87Å; D158-Q185 PolarHBondContact OD2-NE2 3.17Å; D158-Q185 VanDerWaalsContact OD2-NE2 3.08Å; Y175-Q185 CarbonylContact O-C 3.59Å; Y175-Q185 VanDerWaalsContact O-CA 3.27Å; Y175-Q185 WeakPolarHBondContact O-CA 3.43Å
186	K	94.2	Very high	94.1	Very high	79 Å²	79	30 Å²	30	34%	0.343	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	148	-178.2	-178.6	169.8	174.8	-177.6	0	111.6	Y175 F184	Y175-K186 PolarHBondContact N-O 3.21Å; Y175-K186 PolarHBondContact O-N 3.4Å; F184-K186 HydrophobicContact CD1-CB 4.43Å; F184-K186 HydrophobicContact CE1-CB 3.81Å; F184-K186 HydrophobicContact CE1-CD 4.1Å
187	L	92.8	Very high	94	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	137.5	168.4	-74.7	176.6	0	0	0	110.6	F156 F162 W171 F173 V174	F156-L187 HydrophobicContact CE1-CD2 4.49Å; F156-L187 HydrophobicContact CE1-CG 4.1Å; F156-L187 HydrophobicContact CZ-CG 4.07Å; F162-L187 HydrophobicContact CB-CD1 3.75Å; F162-L187 HydrophobicContact CD1-CD1 4.12Å; F162-L187 HydrophobicContact CD1-CD2 4.37Å; F162-L187 HydrophobicContact CD1-CG 4.25Å; F162-L187 HydrophobicContact CD2-CD1 3.89Å; F162-L187 HydrophobicContact CD2-CD2 4.35Å; F162-L187 HydrophobicContact CE1-CD2 4.19Å; F162-L187 HydrophobicContact CE2-CD2 4.17Å; F162-L187 HydrophobicContact CG-CD1 3.67Å; F162-L187 HydrophobicContact CG-CD2 4.46Å; F162-L187 HydrophobicContact CG-CG 4.29Å; F162-L187 HydrophobicContact CZ-CD2 4.11Å; W171-L187 HydrophobicContact CB-CB 3.86Å; W171-L187 HydrophobicContact CD2-CB 4.07Å; W171-L187 HydrophobicContact CE3-CB 3.4Å; W171-L187 HydrophobicContact CE3-CD1 4.06Å; W171-L187 HydrophobicContact CE3-CG 4.41Å; W171-L187 HydrophobicContact CG-CB 4.32Å; W171-L187 HydrophobicContact CZ3-CB 4.17Å; F173-L187 WeakPolarHBondContact O-CA 3.4Å; V174-L187 HydrophobicContact CG2-CD2 3.57Å
188	G	91.5	Very high	93.8	Very high	6 Å²	6	33.8 Å²	33.8	6%	0.062	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	172.1	-179.2	0	0	0	0	0	113.1	W171 S172 F173	W171-G188 CarbonylContact C-O 3.58Å; W171-G188 VanDerWaalsContact C-O 3.32Å; W171-G188 VanDerWaalsContact CA-O 3.29Å; W171-G188 WeakPolarHBondContact CA-O 3.37Å; S172-G188 PolarHBondContact N-O 2.85Å; S172-G188 VanDerWaalsContact N-O 3.14Å; F173-G188 PolarHBondContact N-O 2.96Å; F173-G188 PolarHBondContact O-N 3.32Å
189	R	91.5	Very high	93.4	Very high	82 Å²	82	36.3 Å²	36.3	31%	0.309	19%	0.187	S	C	.	.	S	Bend	trans	-84.2	-148.2	169.2	-69.1	-165.1	71	177.8	1.8	108.6	E108 D109 F173 Y175 S191	E108-R189 WeakPolarHBondContact OE1-CB 3.45Å; E108-R189 IonicContact OE1-CZ 2.75Å; E108-R189 IonicContact OE1-NE 2.68Å; E108-R189 PolarHBondContact OE1-NE 3.42Å; E108-R189 IonicContact OE1-NH2 3.86Å; E108-R189 PolarHBondContact OE1-NH2 2.88Å; E108-R189 IonicContact OE2-CZ 3.94Å; E108-R189 IonicContact OE2-NE 3.4Å; E108-R189 IonicContact OE2-NH2 3.91Å; D109-R189 PolarHBondContact O-NH2 2.78Å; F173-R189 VanDerWaalsContact CD2-O 3.29Å; F173-R189 WeakPolarHBondContact CD2-O 3.49Å; Y175-R189 WeakPolarHBondContact CE2-O 3.3Å; Y175-R189 PolarHBondContact OH-O 2.78Å; R189-S191 PolarHBondContact N-O 3.35Å; R189-S191 PolarHBondContact O-N 3.21Å; R189-S191 VanDerWaalsContact O-N 3.17Å
190	C	93.3	Very high	92.9	Very high	14 Å²	14	40.8 Å²	40.8	10%	0.095	21%	0.211	C	C	.	.	S	Bend	trans	-67.7	-5.6	167.9	-62.7	0	0	0	0	113.9	L100 F102 E108 I114 Y175	L100-C190 HydrophobicContact CB-CB 4.49Å; L100-C190 WeakPolarHBondContact CB-O 3.32Å; L100-C190 PolarHBondContact N-O 3Å; F102-C190 HydrophobicContact CE2-CB 3.76Å; F102-C190 WeakPolarHBondContact CE2-SG 3.36Å; F102-C190 HydrophobicContact CZ-CB 4.11Å; F102-C190 WeakPolarHBondContact CZ-SG 3.46Å; E108-C190 VanDerWaalsContact CG-SG 3.57Å; E108-C190 VanDerWaalsContact OE2-CB 3.28Å; E108-C190 WeakPolarHBondContact OE2-CB 3.37Å; E108-C190 PolarHBondContact OE2-N 2.85Å; E108-C190 PolarHBondContact OE2-SG 3.42Å; I114-C190 WeakPolarHBondContact CD1-SG 3.42Å; Y175-C190 PolarHBondContact OH-O 2.94Å
191	S	94.7	Very high	92.8	Very high	55 Å²	55	40.6 Å²	40.6	39%	0.385	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.4	169.3	62	0	0	0	0	111.8	V98 N99 R189	V98-S191 WeakPolarHBondContact O-CA 3.47Å; V98-S191 WeakPolarHBondContact O-CB 3.08Å; N99-S191 WeakPolarHBondContact OD1-CB 3.39Å; R189-S191 PolarHBondContact N-O 3.35Å; R189-S191 PolarHBondContact O-N 3.21Å; R189-S191 VanDerWaalsContact O-N 3.17Å
192	A	95.6	Very high	92.7	Very high	9 Å²	9	43.1 Å²	43.1	7%	0.074	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.5	171.9	0	0	0	0	0	110.1	V98 Y175 F177	V98-A192 PolarHBondContact N-O 3.26Å; V98-A192 PolarHBondContact O-N 2.78Å; Y175-A192 HydrophobicContact CD1-CB 3.82Å; Y175-A192 HydrophobicContact CD2-CB 3.57Å; Y175-A192 HydrophobicContact CE1-CB 3.93Å; Y175-A192 HydrophobicContact CE2-CB 3.67Å; Y175-A192 HydrophobicContact CG-CB 3.64Å; F177-A192 HydrophobicContact CZ-CB 4.27Å
193	R	96.2	Very high	92.6	Very high	169 Å²	169	45 Å²	45	64%	0.638	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	146.9	176.2	70	-179.4	70	176.5	-0.7	111.6	F96 V97	F96-R193 WeakPolarHBondContact O-CA 3.43Å; V97-R193 HydrophobicContact CG2-CB 4.21Å
194	V	96.2	Very high	92.5	Very high	11 Å²	11	46 Å²	46	7%	0.067	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.1	173	66.1	0	0	0	0	108.9	W47 F96 F177 F184	W47-V194 HydrophobicContact CZ2-CG2 3.95Å; F96-V194 HydrophobicContact CB-CG1 3.99Å; F96-V194 HydrophobicContact CD2-CG1 4.22Å; F96-V194 PolarHBondContact N-O 3.39Å; F96-V194 PolarHBondContact O-N 2.99Å; F177-V194 HydrophobicContact CD1-CG1 3.44Å; F177-V194 VanDerWaalsContact CD1-CG1 3.44Å; F177-V194 HydrophobicContact CD2-CG1 4.26Å; F177-V194 HydrophobicContact CE1-CB 4.38Å; F177-V194 HydrophobicContact CE1-CG1 3.49Å; F177-V194 VanDerWaalsContact CE1-CG1 3.49Å; F177-V194 HydrophobicContact CE2-CB 4.46Å; F177-V194 HydrophobicContact CE2-CG1 4.3Å; F177-V194 HydrophobicContact CG-CG1 3.85Å; F177-V194 HydrophobicContact CZ-CB 4.36Å; F177-V194 HydrophobicContact CZ-CG1 3.95Å; F184-V194 HydrophobicContact CD1-CB 4.41Å; F184-V194 HydrophobicContact CD1-CG2 3.73Å; F184-V194 HydrophobicContact CE1-CG2 3.95Å; F184-V194 HydrophobicContact CG-CG2 4.28Å
195	S	96	Very high	92.5	Very high	69 Å²	69	47.7 Å²	47.7	48%	0.483	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139	174	-57.1	0	0	0	0	109.3	I94 T95	I94-S195 CarbonylContact O-C 3.58Å; I94-S195 WeakPolarHBondContact O-CA 3.39Å; T95-S195 WeakPolarHBondContact CG2-OG 3.43Å; T95-S195 PolarHBondContact OG1-OG 2.76Å
196	I	94.7	Very high	92.3	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132	-178.9	-53.2	-178.9	0	0	0	107.9	L44 W47 N93 I94 F96 T179 L201 M208	L44-I196 HydrophobicContact CD1-CD1 4.36Å; L44-I196 HydrophobicContact CD1-CG2 3.98Å; L44-I196 HydrophobicContact CD2-CG2 3.47Å; L44-I196 VanDerWaalsContact CD2-CG2 3.47Å; L44-I196 HydrophobicContact CG-CG2 4.29Å; W47-I196 HydrophobicContact CH2-CD1 3.85Å; W47-I196 HydrophobicContact CZ2-CD1 3.37Å; W47-I196 HydrophobicContact CZ2-CG1 3.69Å; N93-I196 WeakPolarHBondContact CA-O 3.19Å; I94-I196 HydrophobicContact CG2-CB 3.92Å; I94-I196 PolarHBondContact N-O 2.77Å; I94-I196 PolarHBondContact O-N 3.22Å; F96-I196 HydrophobicContact CD2-CD1 4.26Å; F96-I196 HydrophobicContact CD2-CG1 4.44Å; F96-I196 HydrophobicContact CE2-CD1 3.71Å; F96-I196 HydrophobicContact CE2-CG1 4.13Å; T179-I196 HydrophobicContact CG2-CD1 4.05Å; I196-L201 HydrophobicContact CG2-CD1 4.04Å; I196-M208 HydrophobicContact CD1-CE 3.62Å
197	N	93.3	Very high	92.3	Very high	79 Å²	79	45 Å²	45	42%	0.422	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	132.6	172.5	-179.3	-72.2	0	0	0	109.8	N93 V199	N93-N197 WeakPolarHBondContact OD1-CA 3.37Å; N93-N197 PolarHBondContact OD1-ND2 2.92Å; N197-V199 WeakPolarHBondContact OD1-CB 3.46Å; N197-V199 WeakPolarHBondContact OD1-CG2 3.33Å; N197-V199 PolarHBondContact OD1-N 2.82Å
198	T	92.1	Very high	92.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.258	C	S	.	.			trans	-99.7	6.9	-171.2	64.2	0	0	0	0	114	A88 L89 G91 S92 I94 N200 L201 I232	A88-T198 HydrophobicContact CB-CG2 4.34Å; L89-T198 PolarHBondContact O-OG1 2.82Å; G91-T198 PolarHBondContact N-OG1 2.85Å; S92-T198 PolarHBondContact N-OG1 2.96Å; S92-T198 PolarHBondContact O-N 3.43Å; S92-T198 PolarHBondContact O-OG1 3.01Å; I94-T198 HydrophobicContact CB-CG2 4.19Å; I94-T198 HydrophobicContact CG2-CG2 3.88Å; T198-N200 PolarHBondContact O-N 2.86Å; T198-L201 HydrophobicContact CG2-CD1 4.31Å; T198-L201 PolarHBondContact O-N 3.02Å; T198-I232 HydrophobicContact CG2-CD1 4.27Å; T198-I232 HydrophobicContact CG2-CG1 4.49Å
199	V	87.2	Confident	92.5	Very high	56 Å²	56	45.7 Å²	45.7	34%	0.339	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-39.7	-177	171.9	0	0	0	0	112.2	N197	N197-V199 WeakPolarHBondContact OD1-CB 3.46Å; N197-V199 WeakPolarHBondContact OD1-CG2 3.33Å; N197-V199 PolarHBondContact OD1-N 2.82Å
200	N	83.1	Confident	92.7	Very high	94 Å²	94	41.8 Å²	41.8	50%	0.503	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	16.8	-174.7	-70.3	-20.8	0	0	0	113.3	N42 T198	N42-N200 HydrophobicContact CB-CB 3.71Å; T198-N200 PolarHBondContact O-N 2.86Å
201	L	87.4	Confident	92.8	Very high	9 Å²	9	41.5 Å²	41.5	5%	0.047	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-101.3	143.1	-177.9	-63.8	-173.1	0	0	0	111.2	L44 L180 I196 T198 I232	L44-L201 HydrophobicContact CD2-CD1 4.18Å; L44-L201 HydrophobicContact CD2-CD2 3.69Å; L44-L201 HydrophobicContact CD2-CG 4.2Å; L180-L201 HydrophobicContact CD1-CD1 4.28Å; L180-L201 HydrophobicContact CD1-CD2 3.36Å; L180-L201 HydrophobicContact CD1-CG 4.4Å; I196-L201 HydrophobicContact CG2-CD1 4.04Å; T198-L201 HydrophobicContact CG2-CD1 4.31Å; T198-L201 PolarHBondContact O-N 3.02Å; L201-I232 HydrophobicContact CB-CD1 3.4Å; L201-I232 VanDerWaalsContact CB-CD1 3.4Å; L201-I232 HydrophobicContact CD1-CD1 3.38Å; L201-I232 HydrophobicContact CG-CD1 4.02Å
202	T	87.4	Confident	92.9	Very high	71 Å²	71	38.9 Å²	38.9	44%	0.436	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-73.3	136.9	177.8	47.9	0	0	0	0	110.1	H41 Q206	H41-T202 PolarHBondContact NE2-OG1 3.47Å; T202-Q206 PolarHBondContact OG1-NE2 3.32Å
203	A	91.6	Very high	92.8	Very high	54 Å²	54	38.7 Å²	38.7	45%	0.446	22%	0.222	S	C	.	.	S	Bend	trans	-65.6	139.6	173.1	0	0	0	0	0	110	V90 I232	V90-A203 HydrophobicContact CG2-CB 4.28Å; A203-I232 CarbonylContact C-O 3.56Å; A203-I232 WeakPolarHBondContact CA-O 3.28Å
204	G	93	Very high	92.6	Very high	21 Å²	21	31.7 Å²	31.7	22%	0.216	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.1	176.2	-177.1	0	0	0	0	0	113.2	I232	G204-I232 PolarHBondContact N-O 3.32Å; G204-I232 PolarHBondContact O-N 2.99Å
205	P	94.3	Very high	92.2	Very high	94 Å²	94	33.6 Å²	33.6	61%	0.61	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73	139.6	172.5	31.1	-33.5	0	0	0	110.9	V229 Y230 V231	P205-V229 HydrophobicContact CB-CG1 3.97Å; P205-Y230 CarbonylContact C-O 3.59Å; P205-Y230 WeakPolarHBondContact CA-O 3.27Å; P205-V231 HydrophobicContact CB-CG2 4.49Å
206	Q	92.3	Very high	91.7	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	160.1	179.4	-61.7	-64.1	-9.9	0	0	109.6	L180 T202 V229 Y230	L180-Q206 HydrophobicContact CD2-CG 4.36Å; L180-Q206 VanDerWaalsContact CD2-OE1 3.22Å; T202-Q206 PolarHBondContact OG1-NE2 3.32Å; Q206-V229 CarbonylContact O-C 3.51Å; Q206-V229 WeakPolarHBondContact O-CA 3.31Å; Q206-Y230 HydrophobicContact CB-CD1 4.11Å; Q206-Y230 HydrophobicContact CB-CD2 4.01Å; Q206-Y230 HydrophobicContact CB-CE1 3.59Å; Q206-Y230 HydrophobicContact CB-CE2 3.48Å; Q206-Y230 VanDerWaalsContact CB-CE2 3.48Å; Q206-Y230 HydrophobicContact CB-CG 4.32Å; Q206-Y230 WeakPolarHBondContact CB-OH 3.42Å; Q206-Y230 HydrophobicContact CG-CE2 4.02Å; Q206-Y230 PolarHBondContact N-O 3.06Å; Q206-Y230 WeakPolarHBondContact O-CD1 3.5Å; Q206-Y230 PolarHBondContact O-N 2.96Å
207	V	93.1	Very high	91.1	Very high	36 Å²	36	40 Å²	40	22%	0.218	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.9	-177.8	-178.4	0	0	0	0	110.4	T179 K227 V229	T179-V207 WeakPolarHBondContact CB-O 3.36Å; T179-V207 PolarHBondContact OG1-O 2.85Å; V207-K227 HydrophobicContact CG1-CB 4.37Å; V207-V229 HydrophobicContact CG2-CG2 4.45Å
208	M	95	Very high	90.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.6	167.9	179.6	59	64.5	0	0	108.8	W47 L82 F96 F177 T179 I196 V210 K227 D228 Y230	W47-M208 HydrophobicContact CH2-CE 3.94Å; W47-M208 HydrophobicContact CH2-SD 4.3Å; L82-M208 HydrophobicContact CD1-CG 4.43Å; L82-M208 HydrophobicContact CD2-CB 4.09Å; L82-M208 HydrophobicContact CD2-CG 3.85Å; L82-M208 WeakPolarHBondContact CD2-O 3.44Å; F96-M208 HydrophobicContact CD1-CB 3.98Å; F96-M208 HydrophobicContact CD1-CE 4.32Å; F96-M208 HydrophobicContact CD1-CG 3.75Å; F96-M208 HydrophobicContact CD2-CE 3.85Å; F96-M208 HydrophobicContact CE1-CB 3.62Å; F96-M208 HydrophobicContact CE1-CE 4.06Å; F96-M208 HydrophobicContact CE1-CG 3.87Å; F96-M208 HydrophobicContact CE2-CE 3.56Å; F96-M208 HydrophobicContact CG-CE 4.22Å; F96-M208 HydrophobicContact CG-CG 4.22Å; F96-M208 HydrophobicContact CZ-CB 4.22Å; F96-M208 HydrophobicContact CZ-CE 3.66Å; F96-M208 HydrophobicContact CZ-CG 4.43Å; F177-M208 HydrophobicContact CB-SD 4.08Å; F177-M208 HydrophobicContact CD1-SD 4.2Å; T179-M208 HydrophobicContact CG2-CE 3.52Å; T179-M208 HydrophobicContact CG2-SD 4.44Å; I196-M208 HydrophobicContact CD1-CE 3.62Å; M208-V210 HydrophobicContact CG-CG2 4.26Å; M208-K227 CarbonylContact O-C 3.42Å; M208-K227 VanDerWaalsContact O-CA 3.25Å; M208-K227 WeakPolarHBondContact O-CA 3.29Å; M208-D228 PolarHBondContact N-O 2.87Å; M208-D228 PolarHBondContact O-N 3.17Å; M208-Y230 HydrophobicContact CB-CD1 3.84Å; M208-Y230 HydrophobicContact CB-CE1 3.86Å; M208-Y230 HydrophobicContact CE-CE1 4.38Å
209	E	95.2	Very high	90.5	Very high	23 Å²	23	46.2 Å²	46.2	11%	0.107	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136	176.6	-174.7	174.8	-141.7	0	0	109.9	L29 F177 H178 K225 K227	L29-E209 VanDerWaalsContact C-OE2 3.26Å; L29-E209 VanDerWaalsContact O-CD 3.3Å; F177-E209 CarbonylContact C-O 3.59Å; F177-E209 WeakPolarHBondContact CA-O 3.37Å; H178-E209 HydrophobicContact CB-CB 4.4Å; H178-E209 PolarHBondContact N-O 2.88Å; H178-E209 IonicContact ND1-OE2 2.7Å; H178-E209 PolarHBondContact ND1-OE2 3.41Å; H178-E209 PolarHBondContact O-N 2.87Å; E209-K225 WeakPolarHBondContact OE1-CE 3.49Å; E209-K225 IonicContact OE1-NZ 3.99Å; E209-K225 PolarHBondContact OE1-NZ 2.85Å; E209-K227 HydrophobicContact CB-CB 4.44Å; E209-K227 HydrophobicContact CG-CB 4.45Å
210	V	95.8	Very high	90.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.8	179.5	-172.7	0	0	0	0	110.1	L82 V98 Y175 V176 F177 M208 V212 K225 V226	L82-V210 HydrophobicContact CD1-CG2 4.17Å; L82-V210 HydrophobicContact CD2-CG2 4.16Å; V98-V210 HydrophobicContact CG2-CB 4.21Å; V98-V210 HydrophobicContact CG2-CG1 4.01Å; V98-V210 HydrophobicContact CG2-CG2 3.86Å; Y175-V210 HydrophobicContact CD1-CG1 4.24Å; V176-V210 WeakPolarHBondContact O-CA 3.34Å; F177-V210 HydrophobicContact CD1-CG1 4.35Å; F177-V210 HydrophobicContact CD1-CG2 3.4Å; F177-V210 VanDerWaalsContact CD1-CG2 3.4Å; F177-V210 HydrophobicContact CE1-CG1 4.36Å; F177-V210 HydrophobicContact CE1-CG2 3.76Å; F177-V210 HydrophobicContact CG-CG2 4.12Å; M208-V210 HydrophobicContact CG-CG2 4.26Å; V210-V212 HydrophobicContact CG1-CG2 4.29Å; V210-K225 WeakPolarHBondContact O-CA 3.37Å; V210-V226 HydrophobicContact CB-CG1 4.05Å; V210-V226 PolarHBondContact N-O 2.97Å; V210-V226 PolarHBondContact O-N 2.04Å
211	T	95	Very high	91.1	Very high	8 Å²	8	39.9 Å²	39.9	5%	0.049	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.5	170.1	-51.9	0	0	0	0	109.6	L29 V176 F213 P222	L29-T211 WeakPolarHBondContact CD2-OG1 3.44Å; V176-T211 PolarHBondContact N-O 2.98Å; V176-T211 PolarHBondContact O-N 2.92Å; T211-F213 HydrophobicContact CG2-CD2 4.21Å; T211-F213 HydrophobicContact CG2-CE1 4.35Å; T211-F213 HydrophobicContact CG2-CE2 3.44Å; T211-F213 VanDerWaalsContact CG2-CE2 3.44Å; T211-F213 HydrophobicContact CG2-CZ 3.52Å; T211-P222 HydrophobicContact CG2-CB 4.34Å
212	V	95.4	Very high	91.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.9	-177.9	-169	0	0	0	0	109.5	A80 L100 F173 V174 Y175 V210 P222 I223 S224	A80-V212 HydrophobicContact CB-CG2 4.39Å; L100-V212 HydrophobicContact CD1-CG1 4.24Å; L100-V212 HydrophobicContact CD2-CB 4.44Å; L100-V212 HydrophobicContact CD2-CG1 4.19Å; L100-V212 HydrophobicContact CD2-CG2 4.15Å; F173-V212 HydrophobicContact CB-CG1 4.08Å; F173-V212 HydrophobicContact CD1-CG1 4.35Å; F173-V212 HydrophobicContact CG-CG1 4.49Å; V174-V212 WeakPolarHBondContact O-CA 3.21Å; Y175-V212 HydrophobicContact CD1-CB 4.49Å; Y175-V212 HydrophobicContact CD1-CG1 4.18Å; Y175-V212 HydrophobicContact CD1-CG2 3.66Å; Y175-V212 HydrophobicContact CE1-CB 4.46Å; Y175-V212 HydrophobicContact CE1-CG1 3.91Å; Y175-V212 HydrophobicContact CE1-CG2 3.67Å; V210-V212 HydrophobicContact CG1-CG2 4.29Å; V212-P222 WeakPolarHBondContact O-CA 3.43Å; V212-I223 HydrophobicContact CB-CG1 4.1Å; V212-I223 HydrophobicContact CG1-CD1 3.99Å; V212-I223 HydrophobicContact CG1-CG1 4.05Å; V212-I223 WeakPolarHBondContact O-CG1 3.43Å; V212-I223 PolarHBondContact O-N 3.01Å; V212-S224 PolarHBondContact N-O 3.37Å
213	F	94.1	Very high	91.6	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.018	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.8	179.9	-59.4	-98.6	0	0	0	111.2	W54 Y59 F173 V174 V176 T211 I221 P222	W54-F213 HydrophobicContact CH2-CE1 4.4Å; W54-F213 AromaticContact CH2-CE2 3.93Å; W54-F213 HydrophobicContact CH2-CE2 3.93Å; W54-F213 AromaticContact CH2-CZ 3.53Å; W54-F213 HydrophobicContact CH2-CZ 3.53Å; W54-F213 HydrophobicContact CZ2-CE1 4.14Å; W54-F213 HydrophobicContact CZ2-CE2 4.47Å; W54-F213 AromaticContact CZ2-CZ 3.68Å; W54-F213 HydrophobicContact CZ2-CZ 3.68Å; Y59-F213 HydrophobicContact CD1-CB 4.32Å; Y59-F213 AromaticContact CD1-CD1 3.64Å; Y59-F213 HydrophobicContact CD1-CD1 3.64Å; Y59-F213 HydrophobicContact CD1-CD2 4.22Å; Y59-F213 AromaticContact CD1-CE1 3.92Å; Y59-F213 HydrophobicContact CD1-CE1 3.92Å; Y59-F213 HydrophobicContact CD1-CE2 4.47Å; Y59-F213 AromaticContact CD1-CG 3.81Å; Y59-F213 HydrophobicContact CD1-CG 3.81Å; Y59-F213 HydrophobicContact CD1-CZ 4.34Å; Y59-F213 HydrophobicContact CE1-CB 4.1Å; Y59-F213 HydrophobicContact CE1-CD1 4.27Å; Y59-F213 HydrophobicContact CE1-CD2 4.32Å; Y59-F213 AromaticContact CE1-CG 3.99Å; Y59-F213 HydrophobicContact CE1-CG 3.99Å; F173-F213 WeakPolarHBondContact CA-O 3.34Å; V174-F213 HydrophobicContact CB-CB 4.27Å; V174-F213 PolarHBondContact N-O 2.75Å; V174-F213 PolarHBondContact O-N 3.48Å; V176-F213 HydrophobicContact CG2-CD2 4.21Å; V176-F213 HydrophobicContact CG2-CE2 3.9Å; T211-F213 HydrophobicContact CG2-CD2 4.21Å; T211-F213 HydrophobicContact CG2-CE1 4.35Å; T211-F213 HydrophobicContact CG2-CE2 3.44Å; T211-F213 VanDerWaalsContact CG2-CE2 3.44Å; T211-F213 HydrophobicContact CG2-CZ 3.52Å; F213-I221 WeakPolarHBondContact CA-O 3.29Å; F213-P222 HydrophobicContact CD1-CB 3.84Å; F213-P222 HydrophobicContact CE1-CB 3.67Å; F213-P222 HydrophobicContact CE1-CG 4.23Å; F213-P222 HydrophobicContact CZ-CB 4.35Å
214	R	91.6	Very high	91.6	Very high	23 Å²	23	34.3 Å²	34.3	9%	0.087	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	156.3	168	79.3	174.3	175.8	123.9	-4.4	109.9	S72 Y133 F173 Y220 I221 I223	S72-R214 VanDerWaalsContact O-CZ 3.23Å; S72-R214 PolarHBondContact O-NE 2.86Å; S72-R214 PolarHBondContact O-NH2 3.03Å; Y133-R214 HydrophobicContact CE1-CB 4.22Å; Y133-R214 HydrophobicContact CE2-CB 4.28Å; F173-R214 HydrophobicContact CD1-CB 4.16Å; F173-R214 HydrophobicContact CE1-CB 4.2Å; R214-Y220 CarbonylContact O-C 3.5Å; R214-Y220 WeakPolarHBondContact O-CA 3.33Å; R214-I221 HydrophobicContact CG-CD1 4.36Å; R214-I221 HydrophobicContact CG-CG1 3.78Å; R214-I221 PolarHBondContact N-O 3.15Å; R214-I221 PolarHBondContact O-N 2.88Å; R214-I223 HydrophobicContact CB-CD1 4.48Å; R214-I223 HydrophobicContact CB-CG2 3.86Å; R214-I223 HydrophobicContact CG-CG2 3.48Å; R214-I223 VanDerWaalsContact CG-CG2 3.48Å
215	R	88.4	Confident	91.6	Very high	50 Å²	50	36.9 Å²	36.9	19%	0.189	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.8	170.7	178.5	172.4	-177.4	-162.4	-1.9	110.8	Y133 W135 G138 G217 Y220	Y133-R215 WeakPolarHBondContact CE2-O 3.35Å; Y133-R215 PolarHBondContact OH-N 2.95Å; W135-R215 HydrophobicContact CE3-CB 3.84Å; W135-R215 HydrophobicContact CH2-CB 4.46Å; W135-R215 HydrophobicContact CZ3-CB 3.41Å; W135-R215 VanDerWaalsContact CZ3-CB 3.41Å; W135-R215 HydrophobicContact CZ3-CG 4.26Å; G138-R215 VanDerWaalsContact C-NH1 3.28Å; G138-R215 VanDerWaalsContact O-CZ 3.27Å; G138-R215 PolarHBondContact O-NH1 3.19Å; G138-R215 PolarHBondContact O-NH2 2.78Å; R215-G217 PolarHBondContact NE-O 2.82Å; R215-Y220 HydrophobicContact CB-CD1 4.04Å; R215-Y220 HydrophobicContact CB-CE1 3.84Å; R215-Y220 HydrophobicContact CG-CE1 4.41Å
216	Y	85.1	Confident	91.6	Very high	149 Å²	149	33.7 Å²	33.7	58%	0.584	17%	0.167	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	101.2	174.9	-175.5	-101.1	0	0	0	108.2	R218 A219 I221	Y216-R218 PolarHBondContact O-N 3.22Å; Y216-A219 CarbonylContact C-O 3.55Å; Y216-A219 PolarHBondContact N-O 3.28Å; Y216-A219 PolarHBondContact O-N 3.22Å; Y216-I221 HydrophobicContact CD1-CD1 4.49Å; Y216-I221 HydrophobicContact CD1-CG2 4.44Å; Y216-I221 HydrophobicContact CD2-CD1 4.23Å; Y216-I221 HydrophobicContact CG-CD1 3.92Å; Y216-I221 HydrophobicContact CG-CG1 4.5Å
217	G	83	Confident	91.6	Very high	58 Å²	58	38.6 Å²	38.6	60%	0.598	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	-119	-170.4	0	0	0	0	0	112.4	R215	R215-G217 PolarHBondContact NE-O 2.82Å
218	R	82.9	Confident	91.7	Very high	185 Å²	185	40 Å²	40	70%	0.698	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	0.3	179.7	-62.7	-174.6	-175.8	-171.6	-0.6	113.9	L58 H153 Y216	L58-R218 VanDerWaalsContact CD1-O 3.27Å; L58-R218 WeakPolarHBondContact CD1-O 3.33Å; H153-R218 PolarHBondContact ND1-O 2.92Å; Y216-R218 PolarHBondContact O-N 3.22Å
219	A	88.8	Confident	91.8	Very high	25 Å²	25	44 Å²	44	21%	0.207	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	172.8	-179	0	0	0	0	0	111.7	L58 Y216	L58-A219 CarbonylContact O-C 3.57Å; L58-A219 WeakPolarHBondContact O-CA 3.35Å; Y216-A219 CarbonylContact C-O 3.55Å; Y216-A219 PolarHBondContact N-O 3.28Å; Y216-A219 PolarHBondContact O-N 3.22Å
220	Y	91.9	Very high	91.8	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	109.5	177	-65.8	-98.3	0	0	0	110.2	L58 Y59 P60 W135 H153 F162 V174 R214 R215	L58-Y220 HydrophobicContact CD1-CD2 3.9Å; L58-Y220 HydrophobicContact CD1-CE2 3.89Å; L58-Y220 HydrophobicContact CD2-CE2 4.39Å; L58-Y220 HydrophobicContact CG-CD2 3.87Å; L58-Y220 HydrophobicContact CG-CE2 4.1Å; L58-Y220 PolarHBondContact O-N 3.27Å; Y59-Y220 HydrophobicContact CD1-CG 4.3Å; Y59-Y220 HydrophobicContact CE1-CD1 4.28Å; Y59-Y220 HydrophobicContact CE1-CD2 4.11Å; Y59-Y220 AromaticContact CE1-CG 3.66Å; Y59-Y220 HydrophobicContact CE1-CG 3.66Å; Y59-Y220 HydrophobicContact CE2-CD2 4.03Å; Y59-Y220 HydrophobicContact CE2-CG 4.41Å; Y59-Y220 AromaticContact CZ-CD2 3.73Å; Y59-Y220 AromaticContact CZ-CG 3.71Å; P60-Y220 WeakPolarHBondContact CD-O 3.48Å; W135-Y220 AromaticContact CH2-CE1 3.96Å; W135-Y220 HydrophobicContact CH2-CE1 3.96Å; W135-Y220 AromaticContact CZ3-CE1 3.95Å; W135-Y220 HydrophobicContact CZ3-CE1 3.95Å; H153-Y220 WeakPolarHBondContact O-CE2 3.42Å; H153-Y220 PolarHBondContact O-OH 2.82Å; F162-Y220 HydrophobicContact CE2-CE1 4.29Å; F162-Y220 AromaticContact CE2-CZ 3.96Å; F162-Y220 VanDerWaalsContact CE2-OH 3.26Å; F162-Y220 WeakPolarHBondContact CE2-OH 3.36Å; F162-Y220 HydrophobicContact CZ-CE1 4.05Å; F162-Y220 AromaticContact CZ-CZ 3.82Å; V174-Y220 HydrophobicContact CG2-CD1 4.09Å; V174-Y220 HydrophobicContact CG2-CE1 4.11Å; R214-Y220 CarbonylContact O-C 3.5Å; R214-Y220 WeakPolarHBondContact O-CA 3.33Å; R215-Y220 HydrophobicContact CB-CD1 4.04Å; R215-Y220 HydrophobicContact CB-CE1 3.84Å; R215-Y220 HydrophobicContact CG-CE1 4.41Å
221	I	91.6	Very high	91.8	Very high	16 Å²	16	45.6 Å²	45.6	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	141.5	-178.5	62.3	174.9	0	0	0	110.5	P60 W62 F213 R214 Y216	P60-I221 HydrophobicContact CG-CG2 4.16Å; W62-I221 HydrophobicContact CH2-CB 3.81Å; W62-I221 HydrophobicContact CH2-CD1 4.01Å; W62-I221 HydrophobicContact CH2-CG1 4.35Å; W62-I221 HydrophobicContact CH2-CG2 4.31Å; W62-I221 HydrophobicContact CZ2-CB 3.69Å; W62-I221 HydrophobicContact CZ2-CD1 4.46Å; W62-I221 HydrophobicContact CZ2-CG2 3.76Å; F213-I221 WeakPolarHBondContact CA-O 3.29Å; R214-I221 HydrophobicContact CG-CD1 4.36Å; R214-I221 HydrophobicContact CG-CG1 3.78Å; R214-I221 PolarHBondContact N-O 3.15Å; R214-I221 PolarHBondContact O-N 2.88Å; Y216-I221 HydrophobicContact CD1-CD1 4.49Å; Y216-I221 HydrophobicContact CD1-CG2 4.44Å; Y216-I221 HydrophobicContact CD2-CD1 4.23Å; Y216-I221 HydrophobicContact CG-CD1 3.92Å; Y216-I221 HydrophobicContact CG-CG1 4.5Å
222	P	92.8	Very high	91.8	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	135.4	176.4	30.4	-34	0	0	0	110.1	W62 W69 T211 V212 F213	W62-P222 HydrophobicContact CB-CG 4.12Å; W62-P222 HydrophobicContact CD2-CG 3.61Å; W62-P222 HydrophobicContact CE3-CG 3.66Å; W62-P222 HydrophobicContact CG-CG 3.82Å; W62-P222 HydrophobicContact CZ3-CG 4.27Å; W62-P222 VanDerWaalsContact CZ3-O 3.28Å; W62-P222 WeakPolarHBondContact CZ3-O 3.47Å; W69-P222 HydrophobicContact CH2-CB 3.62Å; W69-P222 HydrophobicContact CH2-CG 3.95Å; W69-P222 HydrophobicContact CZ2-CB 4.33Å; W69-P222 HydrophobicContact CZ2-CG 4.2Å; W69-P222 HydrophobicContact CZ3-CB 4.03Å; W69-P222 HydrophobicContact CZ3-CG 4.4Å; T211-P222 HydrophobicContact CG2-CB 4.34Å; V212-P222 WeakPolarHBondContact O-CA 3.43Å; F213-P222 HydrophobicContact CD1-CB 3.84Å; F213-P222 HydrophobicContact CE1-CB 3.67Å; F213-P222 HydrophobicContact CE1-CG 4.23Å; F213-P222 HydrophobicContact CZ-CB 4.35Å
223	I	92.4	Very high	91.7	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-27	-179.5	58.7	168.5	0	0	0	112.9	W73 V78 L100 F173 V212 R214	W73-I223 HydrophobicContact CE3-CG2 4.19Å; W73-I223 HydrophobicContact CZ3-CD1 4.38Å; V78-I223 HydrophobicContact CG1-CD1 4.35Å; L100-I223 HydrophobicContact CD1-CD1 4.23Å; F173-I223 HydrophobicContact CD1-CD1 3.57Å; F173-I223 HydrophobicContact CE1-CD1 3.48Å; F173-I223 VanDerWaalsContact CE1-CD1 3.48Å; V212-I223 HydrophobicContact CB-CG1 4.1Å; V212-I223 HydrophobicContact CG1-CD1 3.99Å; V212-I223 HydrophobicContact CG1-CG1 4.05Å; V212-I223 WeakPolarHBondContact O-CG1 3.43Å; V212-I223 PolarHBondContact O-N 3.01Å; R214-I223 HydrophobicContact CB-CD1 4.48Å; R214-I223 HydrophobicContact CB-CG2 3.86Å; R214-I223 HydrophobicContact CG-CG2 3.48Å; R214-I223 VanDerWaalsContact CG-CG2 3.48Å
224	S	92.5	Very high	91.6	Very high	13 Å²	13	50 Å²	50	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	151.4	178.8	-145.8	0	0	0	0	111	V78 A80 V212	V78-S224 PolarHBondContact O-OG 2.85Å; V78-S224 VanDerWaalsContact O-OG 3.04Å; A80-S224 PolarHBondContact N-OG 3.02Å; V212-S224 PolarHBondContact N-O 3.37Å
225	K	92.1	Very high	91.8	Very high	74 Å²	74	53.5 Å²	53.5	32%	0.322	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	127.6	175.4	-173.2	169.4	-177.3	-179.6	0	108.1	L29 E209 V210	L29-K225 PolarHBondContact O-NZ 2.94Å; E209-K225 WeakPolarHBondContact OE1-CE 3.49Å; E209-K225 IonicContact OE1-NZ 3.99Å; E209-K225 PolarHBondContact OE1-NZ 2.85Å; V210-K225 WeakPolarHBondContact O-CA 3.37Å
226	V	93.9	Very high	92.1	Very high	28 Å²	28	51.3 Å²	51.3	17%	0.17	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.8	-177.5	62.2	0	0	0	0	109.7	A80 L82 V210	A80-V226 HydrophobicContact CB-CB 4.08Å; A80-V226 HydrophobicContact CB-CG1 3.7Å; A80-V226 WeakPolarHBondContact O-CB 3.25Å; A80-V226 WeakPolarHBondContact O-CG2 3.39Å; L82-V226 HydrophobicContact CB-CB 4.5Å; L82-V226 HydrophobicContact CB-CG1 3.78Å; L82-V226 HydrophobicContact CB-CG2 3.86Å; V210-V226 HydrophobicContact CB-CG1 4.05Å; V210-V226 PolarHBondContact N-O 2.97Å; V210-V226 PolarHBondContact O-N 2.04Å
227	K	94	Very high	92.7	Very high	113 Å²	113	45.1 Å²	45.1	49%	0.491	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.2	171.7	65.9	174.4	-172.1	165.2	0	110.1	E32 V207 M208 E209	E32-K227 IonicContact OE1-NZ 3.54Å; E32-K227 PolarHBondContact OE1-NZ 3.42Å; V207-K227 HydrophobicContact CG1-CB 4.37Å; M208-K227 CarbonylContact O-C 3.42Å; M208-K227 VanDerWaalsContact O-CA 3.25Å; M208-K227 WeakPolarHBondContact O-CA 3.29Å; E209-K227 HydrophobicContact CB-CB 4.44Å; E209-K227 HydrophobicContact CG-CB 4.45Å
228	D	95	Very high	93.3	Very high	66 Å²	66	43 Å²	43	35%	0.353	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	156.6	176	-163.9	16.1	0	0	0	110.4	L82 M208	L82-D228 HydrophobicContact CB-CB 4.43Å; L82-D228 HydrophobicContact CD2-CB 3.66Å; L82-D228 HydrophobicContact CG-CB 3.97Å; M208-D228 PolarHBondContact N-O 2.87Å; M208-D228 PolarHBondContact O-N 3.17Å
229	V	95.3	Very high	93.9	Very high	82 Å²	82	39.6 Å²	39.6	50%	0.497	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.4	179	-179.3	0	0	0	0	108.9	P205 Q206 V207	P205-V229 HydrophobicContact CB-CG1 3.97Å; Q206-V229 CarbonylContact O-C 3.51Å; Q206-V229 WeakPolarHBondContact O-CA 3.31Å; V207-V229 HydrophobicContact CG2-CG2 4.45Å
230	Y	95.8	Very high	94.3	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	149.8	173.8	66	-87.2	0	0	0	110.5	I94 F96 T179 P205 Q206 M208 I232	I94-Y230 HydrophobicContact CD1-CD2 3.5Å; I94-Y230 VanDerWaalsContact CD1-CD2 3.5Å; I94-Y230 HydrophobicContact CD1-CE2 4.36Å; I94-Y230 HydrophobicContact CD1-CG 3.89Å; F96-Y230 AromaticContact CE1-CD1 3.6Å; F96-Y230 HydrophobicContact CE1-CD1 3.6Å; F96-Y230 HydrophobicContact CE1-CE1 4.2Å; F96-Y230 AromaticContact CE1-CG 3.8Å; F96-Y230 HydrophobicContact CE1-CG 3.8Å; F96-Y230 AromaticContact CZ-CD1 3.55Å; F96-Y230 HydrophobicContact CZ-CD1 3.55Å; F96-Y230 AromaticContact CZ-CD2 3.94Å; F96-Y230 HydrophobicContact CZ-CD2 3.94Å; F96-Y230 AromaticContact CZ-CE1 3.8Å; F96-Y230 HydrophobicContact CZ-CE1 3.8Å; F96-Y230 HydrophobicContact CZ-CE2 4.15Å; F96-Y230 AromaticContact CZ-CG 3.61Å; F96-Y230 HydrophobicContact CZ-CG 3.61Å; T179-Y230 WeakPolarHBondContact OG1-CE1 3.46Å; T179-Y230 PolarHBondContact OG1-OH 2.9Å; P205-Y230 CarbonylContact C-O 3.59Å; P205-Y230 WeakPolarHBondContact CA-O 3.27Å; Q206-Y230 HydrophobicContact CB-CD1 4.11Å; Q206-Y230 HydrophobicContact CB-CD2 4.01Å; Q206-Y230 HydrophobicContact CB-CE1 3.59Å; Q206-Y230 HydrophobicContact CB-CE2 3.48Å; Q206-Y230 VanDerWaalsContact CB-CE2 3.48Å; Q206-Y230 HydrophobicContact CB-CG 4.32Å; Q206-Y230 WeakPolarHBondContact CB-OH 3.42Å; Q206-Y230 HydrophobicContact CG-CE2 4.02Å; Q206-Y230 PolarHBondContact N-O 3.06Å; Q206-Y230 WeakPolarHBondContact O-CD1 3.5Å; Q206-Y230 PolarHBondContact O-N 2.96Å; M208-Y230 HydrophobicContact CB-CD1 3.84Å; M208-Y230 HydrophobicContact CB-CE1 3.86Å; M208-Y230 HydrophobicContact CE-CE1 4.38Å; Y230-I232 HydrophobicContact CD2-CG1 4.19Å; Y230-I232 HydrophobicContact CE2-CD1 3.95Å; Y230-I232 HydrophobicContact CE2-CG1 4.09Å
231	V	96	Very high	94.5	Very high	56 Å²	56	43 Å²	43	34%	0.339	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.3	-178.2	-179.5	0	0	0	0	110.4	S86 P87 A88 P205	S86-V231 PolarHBondContact OG-N 3.3Å; P87-V231 VanDerWaalsContact CA-O 3.3Å; P87-V231 WeakPolarHBondContact CA-O 3.47Å; P87-V231 HydrophobicContact CB-CB 4.16Å; P87-V231 HydrophobicContact CB-CG1 4.33Å; A88-V231 PolarHBondContact N-O 2.81Å; P205-V231 HydrophobicContact CB-CG2 4.49Å
232	I	94.5	Very high	94.7	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.9	166.8	-60.2	178.3	0	0	0	107.6	A88 V90 T198 L201 A203 G204 Y230	A88-I232 CarbonylContact O-C 3.54Å; A88-I232 WeakPolarHBondContact O-CA 3.46Å; V90-I232 HydrophobicContact CG2-CG2 3.57Å; T198-I232 HydrophobicContact CG2-CD1 4.27Å; T198-I232 HydrophobicContact CG2-CG1 4.49Å; L201-I232 HydrophobicContact CB-CD1 3.4Å; L201-I232 VanDerWaalsContact CB-CD1 3.4Å; L201-I232 HydrophobicContact CD1-CD1 3.38Å; L201-I232 HydrophobicContact CG-CD1 4.02Å; A203-I232 CarbonylContact C-O 3.56Å; A203-I232 WeakPolarHBondContact CA-O 3.28Å; G204-I232 PolarHBondContact N-O 3.32Å; G204-I232 PolarHBondContact O-N 2.99Å; Y230-I232 HydrophobicContact CD2-CG1 4.19Å; Y230-I232 HydrophobicContact CE2-CD1 3.95Å; Y230-I232 HydrophobicContact CE2-CG1 4.09Å
233	T	94.5	Very high	94.8	Very high	24 Å²	24	45.8 Å²	45.8	15%	0.147	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.6	-174.2	176.6	0	0	0	0	111	P87 A88 L89 V90 Q235 P237	P87-T233 HydrophobicContact CB-CG2 4.02Å; A88-T233 PolarHBondContact O-N 2.8Å; L89-T233 CarbonylContact C-O 3.32Å; L89-T233 VanDerWaalsContact CA-O 3.25Å; L89-T233 WeakPolarHBondContact CA-O 3.19Å; L89-T233 HydrophobicContact CD2-CG2 4.44Å; V90-T233 PolarHBondContact N-O 3.27Å; T233-Q235 WeakPolarHBondContact CG2-O 3.44Å; T233-Q235 PolarHBondContact OG1-N 3.16Å; T233-Q235 PolarHBondContact OG1-O 3.31Å; T233-P237 HydrophobicContact CG2-CG 4.15Å
234	D	91.8	Very high	95	Very high	81 Å²	81	46.5 Å²	46.5	43%	0.433	25%	0.247	S	C	.	.	S	Bend	trans	-89.5	-8.9	169.3	64.7	-19.7	0	0	0	112.6	R377	D234-R377 VanDerWaalsContact CB-NH1 3.33Å; D234-R377 WeakPolarHBondContact O-CD 3.34Å; D234-R377 PolarHBondContact O-NH1 3.25Å
235	Q	94.7	Very high	95.1	Very high	95 Å²	95	51.7 Å²	51.7	44%	0.444	27%	0.268	S	S	.	.	S	Bend	trans	-99.9	138.7	176.4	-65.2	177.1	47.6	0	0	111.6	L89 T233 P237 Y378	L89-Q235 WeakPolarHBondContact CD2-O 3.25Å; T233-Q235 WeakPolarHBondContact CG2-O 3.44Å; T233-Q235 PolarHBondContact OG1-N 3.16Å; T233-Q235 PolarHBondContact OG1-O 3.31Å; Q235-P237 VanDerWaalsContact O-CD 3.31Å; Q235-P237 WeakPolarHBondContact O-CD 3.14Å; Q235-Y378 CarbonylContact C-O 3.56Å; Q235-Y378 WeakPolarHBondContact CA-O 3.34Å
236	I	96.3	Very high	95.2	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.021	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-66.1	119.2	175.5	-52.5	168.4	0	0	0	107.6	L89 V238 I267 L274 V315 T317 R377 Y378 G379	L89-I236 HydrophobicContact CD2-CG1 4.47Å; I236-V238 HydrophobicContact CB-CG2 4.35Å; I236-V238 HydrophobicContact CG2-CG2 4.01Å; I236-V238 WeakPolarHBondContact O-CG2 3.37Å; I236-V238 PolarHBondContact O-N 3.36Å; I236-I267 HydrophobicContact CG2-CG1 4.49Å; I236-I267 HydrophobicContact CG2-CG2 3.63Å; I236-L274 HydrophobicContact CD1-CD1 4.45Å; I236-L274 HydrophobicContact CG1-CD1 4.37Å; I236-L274 HydrophobicContact CG2-CD1 3.99Å; I236-V315 HydrophobicContact CD1-CG1 4.18Å; I236-T317 HydrophobicContact CD1-CG2 3.54Å; I236-R377 HydrophobicContact CD1-CB 4.05Å; I236-R377 HydrophobicContact CG1-CB 4Å; I236-Y378 PolarHBondContact N-O 3.14Å; I236-G379 VanDerWaalsContact O-CA 3.26Å; I236-G379 WeakPolarHBondContact O-CA 3.29Å
237	P	96.4	Very high	95.3	Very high	19 Å²	19	48.8 Å²	48.8	12%	0.123	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-73.2	119.7	174.1	-1	15.6	0	0	0	109.3	P87 T233 Q235 H268	P87-P237 HydrophobicContact CB-CG 4.3Å; P87-P237 HydrophobicContact CG-CB 3.91Å; P87-P237 HydrophobicContact CG-CG 3.68Å; T233-P237 HydrophobicContact CG2-CG 4.15Å; Q235-P237 VanDerWaalsContact O-CD 3.31Å; Q235-P237 WeakPolarHBondContact O-CD 3.14Å; P237-H268 HydrophobicContact CB-CB 4.04Å; P237-H268 HydrophobicContact CG-CB 4.3Å; P237-H268 PolarHBondContact O-N 3.03Å
238	V	96.8	Very high	95.2	Very high	14 Å²	14	48.8 Å²	48.8	9%	0.085	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.9	-172.3	177.4	0	0	0	0	109.4	I236 V240 V265 L313 V315 F381	I236-V238 HydrophobicContact CB-CG2 4.35Å; I236-V238 HydrophobicContact CG2-CG2 4.01Å; I236-V238 WeakPolarHBondContact O-CG2 3.37Å; I236-V238 PolarHBondContact O-N 3.36Å; V238-V240 HydrophobicContact CG1-CG2 4.36Å; V238-V265 HydrophobicContact CG1-CG1 3.64Å; V238-L313 HydrophobicContact CG1-CD2 4.03Å; V238-V315 HydrophobicContact CB-CG2 4.41Å; V238-V315 HydrophobicContact CG1-CG2 3.92Å; V238-V315 HydrophobicContact CG2-CB 3.99Å; V238-V315 HydrophobicContact CG2-CG2 3.6Å; V238-F381 HydrophobicContact CG1-CB 4.17Å
239	F	95.8	Very high	95.1	Very high	113 Å²	113	48.9 Å²	48.9	50%	0.496	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.9	171.3	-57.6	-86.1	0	0	0	108.6	L266 H268	F239-L266 HydrophobicContact CB-CB 4.3Å; F239-L266 PolarHBondContact N-O 2.87Å; F239-L266 PolarHBondContact O-N 3.05Å; F239-H268 HydrophobicContact CD2-CB 4.46Å; F239-H268 HydrophobicContact CE2-CB 3.94Å
240	V	96.4	Very high	94.8	Very high	16 Å²	16	50 Å²	50	10%	0.097	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.1	176.6	-176.3	0	0	0	0	108.2	V238 M242 F263 D264 V265 W283 L313 F381	V238-V240 HydrophobicContact CG1-CG2 4.36Å; V240-M242 HydrophobicContact CG1-CG 4.25Å; V240-F263 HydrophobicContact CG1-CB 4.21Å; V240-F263 HydrophobicContact CG1-CD1 4.29Å; V240-D264 WeakPolarHBondContact CA-O 3.28Å; V240-V265 HydrophobicContact CG2-CG2 4.16Å; V240-W283 HydrophobicContact CG1-CH2 4.24Å; V240-W283 HydrophobicContact CG1-CZ3 4.49Å; V240-L313 HydrophobicContact CG2-CD2 3.59Å; V240-F381 HydrophobicContact CB-CD1 3.89Å; V240-F381 HydrophobicContact CB-CD2 4.31Å; V240-F381 HydrophobicContact CB-CE1 3.69Å; V240-F381 HydrophobicContact CB-CE2 4.13Å; V240-F381 HydrophobicContact CB-CG 4.2Å; V240-F381 HydrophobicContact CB-CZ 3.82Å; V240-F381 HydrophobicContact CG1-CE1 4.44Å; V240-F381 HydrophobicContact CG2-CB 4.04Å; V240-F381 HydrophobicContact CG2-CD1 3.49Å; V240-F381 VanDerWaalsContact CG2-CD1 3.49Å; V240-F381 HydrophobicContact CG2-CD2 3.97Å; V240-F381 HydrophobicContact CG2-CE1 3.86Å; V240-F381 HydrophobicContact CG2-CE2 4.31Å; V240-F381 HydrophobicContact CG2-CG 3.55Å; V240-F381 HydrophobicContact CG2-CZ 4.26Å
241	T	96.1	Very high	94.5	Very high	83 Å²	83	55 Å²	55	51%	0.509	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.9	168.5	61.8	0	0	0	0	108.5	D264	T241-D264 PolarHBondContact N-O 3.26Å; T241-D264 PolarHBondContact O-N 2.82Å; T241-D264 WeakPolarHBondContact OG1-CB 3.43Å; T241-D264 PolarHBondContact OG1-O 2.76Å
242	M	95.7	Very high	94.4	Very high	27 Å²	27	54.9 Å²	54.9	13%	0.133	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.3	-177.1	-62.5	173.6	-72.7	0	0	107.7	V240 F255 I261 V262 F263 L311 A383 I385	V240-M242 HydrophobicContact CG1-CG 4.25Å; M242-F255 HydrophobicContact CB-CE1 4.17Å; M242-F255 HydrophobicContact CB-CE2 4.44Å; M242-F255 HydrophobicContact CB-CZ 3.55Å; M242-F255 HydrophobicContact SD-CE2 4.49Å; M242-F255 HydrophobicContact SD-CZ 4.47Å; M242-I261 HydrophobicContact CB-CG2 4.36Å; M242-V262 WeakPolarHBondContact CA-O 3.31Å; M242-F263 HydrophobicContact CG-CD1 3.64Å; M242-F263 HydrophobicContact CG-CE1 3.79Å; M242-F263 HydrophobicContact SD-CD1 4.12Å; M242-F263 HydrophobicContact SD-CE1 3.79Å; M242-L311 HydrophobicContact SD-CD2 4.39Å; M242-A383 HydrophobicContact CE-CB 4.4Å; M242-I385 HydrophobicContact SD-CD1 3.95Å; M242-I385 HydrophobicContact SD-CG1 4.47Å
243	S	95.9	Very high	94.3	Very high	51 Å²	51	58.7 Å²	58.7	36%	0.357	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	147.7	178.3	59.7	0	0	0	0	110.8	V262	S243-V262 PolarHBondContact N-O 2.97Å; S243-V262 PolarHBondContact O-N 2.91Å
244	Q	96.1	Very high	94.4	Very high	15 Å²	15	60 Å²	60	7%	0.07	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	147.1	179.8	-166.7	-173.3	46.6	0	0	110.2	D247 F255 L256 L259 I261	Q244-D247 HydrophobicContact CB-CB 4.22Å; Q244-F255 HydrophobicContact CB-CD1 3.68Å; Q244-F255 HydrophobicContact CB-CE1 4.24Å; Q244-L256 PolarHBondContact NE2-O 2.89Å; Q244-L259 HydrophobicContact CG-CB 4.1Å; Q244-L259 PolarHBondContact NE2-O 2.87Å; Q244-I261 HydrophobicContact CB-CG1 4.3Å; Q244-I261 HydrophobicContact CG-CG1 4.11Å
245	K	93.9	Very high	94.6	Very high	122 Å²	122	56.2 Å²	56.2	53%	0.53	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	143.7	172.5	-162.5	-172.1	165.9	147.3	0	109.6	D247 L259 E562	K245-D247 PolarHBondContact O-N 3.22Å; K245-D247 VanDerWaalsContact O-N 3.15Å; K245-L259 WeakPolarHBondContact O-CD1 2.88Å; K245-E562 IonicContact NZ-OE1 3.44Å; K245-E562 PolarHBondContact NZ-OE1 2.79Å
246	N	94.8	Very high	94.7	Very high	23 Å²	23	51.8 Å²	51.8	12%	0.123	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	0.6	-179.4	-57.3	8.5	0	0	0	115.6	R248 L256 L259 I391 L392 S479 L480	N246-R248 PolarHBondContact O-N 2.95Å; N246-L256 HydrophobicContact CB-CD1 3.77Å; N246-L259 HydrophobicContact CB-CD1 4.26Å; N246-I391 PolarHBondContact ND2-O 3.15Å; N246-L392 PolarHBondContact ND2-O 2.99Å; N246-S479 CarbonylContact O-C 3.55Å; N246-S479 VanDerWaalsContact O-CA 3.27Å; N246-S479 WeakPolarHBondContact O-CA 3.39Å; N246-L480 WeakPolarHBondContact CA-O 3.22Å; N246-L480 VanDerWaalsContact CB-O 3.25Å; N246-L480 WeakPolarHBondContact CB-O 3.42Å; N246-L480 PolarHBondContact O-N 3.37Å
247	D	94.7	Very high	94.7	Very high	19 Å²	19	54.7 Å²	54.7	10%	0.102	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-68.1	132.1	170	171.5	30.8	0	0	0	109.7	Q244 K245 N249 L250	Q244-D247 HydrophobicContact CB-CB 4.22Å; K245-D247 PolarHBondContact O-N 3.22Å; K245-D247 VanDerWaalsContact O-N 3.15Å; D247-N249 PolarHBondContact OD1-N 2.76Å; D247-N249 VanDerWaalsContact OD2-C 3.24Å; D247-L250 WeakPolarHBondContact OD2-CA 3.3Å; D247-L250 PolarHBondContact OD2-N 3.47Å
248	R	93.4	Very high	94.6	Very high	112 Å²	112	57.2 Å²	57.2	42%	0.423	29%	0.293	S	S	.	.	S	Bend	trans	-76	-32.5	179.2	-173.1	-176.8	-175.5	96	-4.1	111.5	N246 E427 D476 A478 L480	N246-R248 PolarHBondContact O-N 2.95Å; R248-E427 IonicContact CZ-OE1 2.76Å; R248-E427 VanDerWaalsContact CZ-OE1 3.24Å; R248-E427 IonicContact NH1-OE1 2.73Å; R248-E427 PolarHBondContact NH1-OE1 3.07Å; R248-E427 IonicContact NH2-OE1 3.13Å; R248-E427 PolarHBondContact NH2-OE1 2.86Å; R248-D476 WeakPolarHBondContact CD-O 3.34Å; R248-D476 PolarHBondContact NH1-O 3.38Å; R248-A478 WeakPolarHBondContact CB-O 3.28Å; R248-A478 PolarHBondContact N-O 3.23Å; R248-L480 HydrophobicContact CB-CB 4.45Å
249	N	92.5	Very high	94.6	Very high	69 Å²	69	58 Å²	58	37%	0.369	30%	0.297	S	S	.	.			trans	-144.6	94.2	-167.8	179.3	19.1	0	0	0	112.8	D247 S251 D252	D247-N249 PolarHBondContact OD1-N 2.76Å; D247-N249 VanDerWaalsContact OD2-C 3.24Å; N249-S251 PolarHBondContact O-N 3.01Å; N249-S251 PolarHBondContact OD1-N 2.95Å; N249-D252 WeakPolarHBondContact CB-OD2 3.17Å; N249-D252 WeakPolarHBondContact ND2-CB 3.26Å; N249-D252 PolarHBondContact ND2-OD2 3.43Å; N249-D252 PolarHBondContact O-N 3.34Å
250	L	88.7	Confident	94.6	Very high	105 Å²	105	55.5 Å²	55.5	55%	0.55	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-7.6	-179.4	-59.9	171.2	0	0	0	116.2	D247	D247-L250 WeakPolarHBondContact OD2-CA 3.3Å; D247-L250 PolarHBondContact OD2-N 3.47Å
251	S	90.1	Very high	94.6	Very high	106 Å²	106	54.7 Å²	54.7	74%	0.741	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-4.4	-173.7	-56.6	0	0	0	0	115.2	N249	N249-S251 PolarHBondContact O-N 3.01Å; N249-S251 PolarHBondContact OD1-N 2.95Å
252	D	92.8	Very high	94.7	Very high	54 Å²	54	53 Å²	53	29%	0.289	28%	0.277	S	S	.	.	S	Bend	trans	-94.8	-1	-178.3	61.6	19.8	0	0	0	115	N249 I254	N249-D252 WeakPolarHBondContact CB-OD2 3.17Å; N249-D252 WeakPolarHBondContact ND2-CB 3.26Å; N249-D252 PolarHBondContact ND2-OD2 3.43Å; N249-D252 PolarHBondContact O-N 3.34Å; D252-I254 HydrophobicContact CB-CD1 4.43Å; D252-I254 HydrophobicContact CB-CG1 4.38Å; D252-I254 PolarHBondContact O-N 3.04Å; D252-I254 WeakPolarHBondContact OD1-CB 3.31Å; D252-I254 PolarHBondContact OD1-N 3.05Å
253	E	93	Very high	94.7	Very high	81 Å²	81	51.7 Å²	51.7	38%	0.379	27%	0.27	S	S	.	.			trans	61	18.9	-178	-51.6	-178.1	163.9	0	0	113.7	T386	E253-T386 PolarHBondContact O-N 2.93Å
254	I	96.2	Very high	94.8	Very high	52 Å²	52	52 Å²	52	27%	0.267	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	127.3	172.9	-56.5	175.4	0	0	0	108.3	D252 T386 V388 A478	D252-I254 HydrophobicContact CB-CD1 4.43Å; D252-I254 HydrophobicContact CB-CG1 4.38Å; D252-I254 PolarHBondContact O-N 3.04Å; D252-I254 WeakPolarHBondContact OD1-CB 3.31Å; D252-I254 PolarHBondContact OD1-N 3.05Å; I254-T386 CarbonylContact C-O 3.6Å; I254-T386 WeakPolarHBondContact CA-O 3.47Å; I254-V388 HydrophobicContact CG2-CG1 4.13Å; I254-V388 HydrophobicContact CG2-CG2 3.66Å; I254-A478 HydrophobicContact CG2-CB 4.11Å
255	F	96.8	Very high	94.9	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	164	-179.9	-61	-88.3	0	0	0	110.9	M242 Q244 I261 I385 T386 I387 V388	M242-F255 HydrophobicContact CB-CE1 4.17Å; M242-F255 HydrophobicContact CB-CE2 4.44Å; M242-F255 HydrophobicContact CB-CZ 3.55Å; M242-F255 HydrophobicContact SD-CE2 4.49Å; M242-F255 HydrophobicContact SD-CZ 4.47Å; Q244-F255 HydrophobicContact CB-CD1 3.68Å; Q244-F255 HydrophobicContact CB-CE1 4.24Å; F255-I261 HydrophobicContact CB-CD1 3.5Å; F255-I261 HydrophobicContact CB-CG1 4Å; F255-I261 HydrophobicContact CD1-CD1 3.96Å; F255-I261 HydrophobicContact CD1-CG1 3.91Å; F255-I261 HydrophobicContact CD1-CG2 4.1Å; F255-I261 HydrophobicContact CD2-CD1 3.98Å; F255-I261 HydrophobicContact CE1-CG2 3.97Å; F255-I261 HydrophobicContact CG-CD1 3.54Å; F255-I261 HydrophobicContact CG-CG1 3.99Å; F255-I261 HydrophobicContact CZ-CG2 4.37Å; F255-I385 HydrophobicContact CD2-CG2 3.44Å; F255-I385 VanDerWaalsContact CD2-CG2 3.44Å; F255-I385 HydrophobicContact CE2-CG2 3.94Å; F255-I385 HydrophobicContact CG-CG2 4.42Å; F255-T386 PolarHBondContact N-O 2.93Å; F255-I387 HydrophobicContact CB-CD1 3.84Å; F255-I387 CarbonylContact O-C 3.57Å; F255-I387 VanDerWaalsContact O-CA 3.29Å; F255-I387 WeakPolarHBondContact O-CA 3.5Å; F255-V388 PolarHBondContact O-N 2.65Å
256	L	96.4	Very high	95	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135.5	-171.7	-48.4	-176	0	0	0	110.6	Q244 N246 L259 V388 A478	Q244-L256 PolarHBondContact NE2-O 2.89Å; N246-L256 HydrophobicContact CB-CD1 3.77Å; L256-L259 HydrophobicContact CB-CD1 4.11Å; L256-L259 HydrophobicContact CD1-CD1 3.96Å; L256-V388 CarbonylContact C-O 3.58Å; L256-V388 WeakPolarHBondContact CA-O 3.5Å; L256-V388 HydrophobicContact CD2-CG2 4.09Å; L256-A478 HydrophobicContact CD2-CB 4.37Å
257	R	96.1	Very high	95	Very high	65 Å²	65	51.7 Å²	51.7	25%	0.245	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	147.5	172.8	-165.1	-169.8	56.5	-148.1	1.3	110.3	L259 Y303 V304 N306 I387 V388 E389	R257-L259 PolarHBondContact O-N 2.85Å; R257-Y303 WeakPolarHBondContact CG-O 3.4Å; R257-V304 VanDerWaalsContact CD-O 3.23Å; R257-V304 WeakPolarHBondContact CD-O 2.98Å; R257-N306 VanDerWaalsContact CD-OD1 3.23Å; R257-N306 WeakPolarHBondContact CD-OD1 3.31Å; R257-N306 PolarHBondContact NH1-ND2 3.2Å; R257-N306 PolarHBondContact NH1-OD1 2.95Å; R257-I387 HydrophobicContact CB-CG2 3.89Å; R257-I387 HydrophobicContact CG-CG2 4.35Å; R257-V388 PolarHBondContact N-O 2.64Å; R257-E389 IonicContact CZ-OE1 3.62Å; R257-E389 IonicContact NH1-OE1 2.69Å; R257-E389 PolarHBondContact NH1-OE1 3.14Å; R257-E389 IonicContact NH2-OE1 2.84Å; R257-E389 PolarHBondContact NH2-OE1 3.16Å
258	D	94.8	Very high	95.1	Very high	72 Å²	72	53.4 Å²	53.4	39%	0.385	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	5.1	171.8	-52.5	-47.7	0	0	0	115.3	T302 Y303	D258-T302 VanDerWaalsContact C-CG2 3.5Å; D258-Y303 PolarHBondContact N-O 2.86Å
259	L	95.3	Very high	95.2	Very high	31 Å²	31	49.3 Å²	49.3	16%	0.162	27%	0.266	C	S	.	.	S	Bend	trans	-110	139.1	172.6	-67.7	178.8	0	0	0	111.2	Q244 K245 N246 L256 R257 I261 L392	Q244-L259 HydrophobicContact CG-CB 4.1Å; Q244-L259 PolarHBondContact NE2-O 2.87Å; K245-L259 WeakPolarHBondContact O-CD1 2.88Å; N246-L259 HydrophobicContact CB-CD1 4.26Å; L256-L259 HydrophobicContact CB-CD1 4.11Å; L256-L259 HydrophobicContact CD1-CD1 3.96Å; R257-L259 PolarHBondContact O-N 2.85Å; L259-I261 PolarHBondContact O-N 2.81Å; L259-L392 HydrophobicContact CD1-CD2 3.74Å; L259-L392 HydrophobicContact CD2-CD2 4.15Å; L259-L392 HydrophobicContact CG-CD2 3.73Å
260	P	96.5	Very high	95.3	Very high	60 Å²	60	48.3 Å²	48.3	39%	0.39	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-69.5	123.2	179.7	28.2	-33.7	0	0	0	111.3	N300 T302	P260-N300 HydrophobicContact CB-CB 4.48Å; P260-T302 WeakPolarHBondContact CA-OG1 3.4Å
261	I	97	Very high	95.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.3	166.5	-53.4	169.4	0	0	0	107.3	M242 Q244 F255 L259 F263 N300 H301 Y303 I385 I387	M242-I261 HydrophobicContact CB-CG2 4.36Å; Q244-I261 HydrophobicContact CB-CG1 4.3Å; Q244-I261 HydrophobicContact CG-CG1 4.11Å; F255-I261 HydrophobicContact CB-CD1 3.5Å; F255-I261 HydrophobicContact CB-CG1 4Å; F255-I261 HydrophobicContact CD1-CD1 3.96Å; F255-I261 HydrophobicContact CD1-CG1 3.91Å; F255-I261 HydrophobicContact CD1-CG2 4.1Å; F255-I261 HydrophobicContact CD2-CD1 3.98Å; F255-I261 HydrophobicContact CE1-CG2 3.97Å; F255-I261 HydrophobicContact CG-CD1 3.54Å; F255-I261 HydrophobicContact CG-CG1 3.99Å; F255-I261 HydrophobicContact CZ-CG2 4.37Å; L259-I261 PolarHBondContact O-N 2.81Å; I261-F263 HydrophobicContact CB-CD2 4.41Å; I261-F263 HydrophobicContact CB-CE2 3.59Å; I261-F263 HydrophobicContact CB-CZ 3.78Å; I261-F263 HydrophobicContact CD1-CZ 4.2Å; I261-F263 HydrophobicContact CG2-CD2 4.21Å; I261-F263 HydrophobicContact CG2-CE1 3.99Å; I261-F263 HydrophobicContact CG2-CE2 3.61Å; I261-F263 HydrophobicContact CG2-CZ 3.49Å; I261-F263 VanDerWaalsContact CG2-CZ 3.49Å; I261-F263 WeakPolarHBondContact O-CD2 3.37Å; I261-F263 WeakPolarHBondContact O-CE2 3.18Å; I261-N300 WeakPolarHBondContact O-CA 3.28Å; I261-H301 PolarHBondContact N-O 3Å; I261-H301 PolarHBondContact O-N 3.06Å; I261-Y303 HydrophobicContact CD1-CD2 3.71Å; I261-Y303 HydrophobicContact CD1-CE2 3.83Å; I261-I385 HydrophobicContact CD1-CG2 4.48Å; I261-I387 HydrophobicContact CD1-CD1 4.06Å
262	V	97	Very high	95.7	Very high	47 Å²	47	46.3 Å²	46.3	29%	0.285	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117	174	-176.2	0	0	0	0	108.1	M242 S243 T298	M242-V262 WeakPolarHBondContact CA-O 3.31Å; S243-V262 PolarHBondContact N-O 2.97Å; S243-V262 PolarHBondContact O-N 2.91Å; V262-T298 HydrophobicContact CG1-CG2 3.67Å
263	F	97.1	Very high	95.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.5	174.7	-59.7	-91.9	0	0	0	108.8	V240 M242 I261 W283 F285 T298 L299 H301 Y303 L311 I385	V240-F263 HydrophobicContact CG1-CB 4.21Å; V240-F263 HydrophobicContact CG1-CD1 4.29Å; M242-F263 HydrophobicContact CG-CD1 3.64Å; M242-F263 HydrophobicContact CG-CE1 3.79Å; M242-F263 HydrophobicContact SD-CD1 4.12Å; M242-F263 HydrophobicContact SD-CE1 3.79Å; I261-F263 HydrophobicContact CB-CD2 4.41Å; I261-F263 HydrophobicContact CB-CE2 3.59Å; I261-F263 HydrophobicContact CB-CZ 3.78Å; I261-F263 HydrophobicContact CD1-CZ 4.2Å; I261-F263 HydrophobicContact CG2-CD2 4.21Å; I261-F263 HydrophobicContact CG2-CE1 3.99Å; I261-F263 HydrophobicContact CG2-CE2 3.61Å; I261-F263 HydrophobicContact CG2-CZ 3.49Å; I261-F263 VanDerWaalsContact CG2-CZ 3.49Å; I261-F263 WeakPolarHBondContact O-CD2 3.37Å; I261-F263 WeakPolarHBondContact O-CE2 3.18Å; F263-W283 HydrophobicContact CB-CH2 3.65Å; F263-W283 HydrophobicContact CB-CZ2 4.46Å; F263-W283 HydrophobicContact CB-CZ3 3.87Å; F263-W283 HydrophobicContact CD1-CZ3 4.25Å; F263-W283 HydrophobicContact CG-CH2 4.43Å; F263-W283 HydrophobicContact CG-CZ3 4.16Å; F263-F285 AromaticContact CD2-CE1 3.91Å; F263-F285 HydrophobicContact CD2-CE1 3.91Å; F263-F285 HydrophobicContact CD2-CZ 4.47Å; F263-F285 HydrophobicContact CE1-CE1 4.46Å; F263-F285 HydrophobicContact CE2-CD1 4.32Å; F263-F285 AromaticContact CE2-CE1 3.63Å; F263-F285 HydrophobicContact CE2-CE1 3.63Å; F263-F285 HydrophobicContact CE2-CZ 4.47Å; F263-F285 HydrophobicContact CG-CE1 4.45Å; F263-F285 HydrophobicContact CZ-CD1 4.28Å; F263-F285 AromaticContact CZ-CE1 3.93Å; F263-F285 HydrophobicContact CZ-CE1 3.93Å; F263-T298 CarbonylContact O-C 3.53Å; F263-T298 VanDerWaalsContact O-CA 3.24Å; F263-T298 WeakPolarHBondContact O-CA 3.48Å; F263-T298 WeakPolarHBondContact O-CG2 3.29Å; F263-L299 WeakPolarHBondContact CD2-O 3.25Å; F263-L299 PolarHBondContact N-O 2.78Å; F263-L299 PolarHBondContact O-N 3.43Å; F263-H301 HydrophobicContact CD2-CB 4.39Å; F263-H301 HydrophobicContact CE2-CB 3.82Å; F263-Y303 HydrophobicContact CZ-CE2 4.47Å; F263-L311 HydrophobicContact CD1-CD2 3.92Å; F263-L311 HydrophobicContact CE1-CD2 3.66Å; F263-I385 HydrophobicContact CE1-CD1 3.82Å; F263-I385 HydrophobicContact CZ-CD1 4.11Å
264	D	97.3	Very high	95.7	Very high	58 Å²	58	42.7 Å²	42.7	31%	0.31	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.3	179.7	-171.4	40.8	0	0	0	111	V240 T241 H297 T298	V240-D264 WeakPolarHBondContact CA-O 3.28Å; T241-D264 PolarHBondContact N-O 3.26Å; T241-D264 PolarHBondContact O-N 2.82Å; T241-D264 WeakPolarHBondContact OG1-CB 3.43Å; T241-D264 PolarHBondContact OG1-O 2.76Å; D264-H297 IonicContact OD1-CD2 3.59Å; D264-H297 PolarHBondContact OD1-CD2 2.96Å; D264-H297 IonicContact OD1-NE2 3.62Å; D264-T298 HydrophobicContact CB-CG2 4.38Å; D264-T298 PolarHBondContact OD1-OG1 3.21Å
265	V	97.5	Very high	95.4	Very high	8 Å²	8	45.9 Å²	45.9	5%	0.048	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.9	-172.1	-174.4	0	0	0	0	111	V238 V240 I267 Y281 W283 H297 L313 V315	V238-V265 HydrophobicContact CG1-CG1 3.64Å; V240-V265 HydrophobicContact CG2-CG2 4.16Å; V265-I267 HydrophobicContact CG1-CG1 4.46Å; V265-Y281 HydrophobicContact CB-CD1 4.23Å; V265-Y281 HydrophobicContact CB-CE1 3.89Å; V265-Y281 HydrophobicContact CG1-CD1 4.09Å; V265-Y281 HydrophobicContact CG1-CE1 3.65Å; V265-Y281 HydrophobicContact CG2-CD1 4.07Å; V265-Y281 HydrophobicContact CG2-CE1 4.25Å; V265-W283 HydrophobicContact CG2-CH2 3.35Å; V265-W283 HydrophobicContact CG2-CZ2 3.31Å; V265-H297 HydrophobicContact CB-CB 4.39Å; V265-H297 WeakPolarHBondContact CB-O 3.34Å; V265-H297 VanDerWaalsContact CG2-O 3.31Å; V265-H297 WeakPolarHBondContact CG2-O 3.41Å; V265-H297 PolarHBondContact N-O 2.95Å; V265-L313 HydrophobicContact CG1-CD2 4.11Å; V265-L313 HydrophobicContact CG2-CD2 3.63Å; V265-V315 HydrophobicContact CG1-CG2 4.45Å
266	L	96.6	Very high	95	Very high	109 Å²	109	53 Å²	53	57%	0.571	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.8	172.3	-177.7	69.4	0	0	0	110.4	F239	F239-L266 HydrophobicContact CB-CB 4.3Å; F239-L266 PolarHBondContact N-O 2.87Å; F239-L266 PolarHBondContact O-N 3.05Å
267	I	95.8	Very high	94.7	Very high	35 Å²	35	53.7 Å²	53.7	18%	0.179	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.2	175	-66.3	170.5	0	0	0	109.1	I236 V265 D269 L274 I279 Y281 V315	I236-I267 HydrophobicContact CG2-CG1 4.49Å; I236-I267 HydrophobicContact CG2-CG2 3.63Å; V265-I267 HydrophobicContact CG1-CG1 4.46Å; I267-D269 HydrophobicContact CG2-CB 4.27Å; I267-D269 PolarHBondContact O-N 2.87Å; I267-L274 HydrophobicContact CG2-CD1 3.99Å; I267-I279 HydrophobicContact CD1-CD1 3.77Å; I267-I279 HydrophobicContact CD1-CG2 4.05Å; I267-Y281 HydrophobicContact CD1-CE1 4.21Å; I267-V315 HydrophobicContact CD1-CG1 4.13Å
268	H	95.8	Very high	94.5	Very high	56 Å²	56	54.9 Å²	54.9	26%	0.259	31%	0.307	S	S	.	.			trans	-85.1	94.4	174.1	-179	79.6	0	0	0	110.5	D85 P87 P237 F239	D85-H268 PolarHBondContact O-NE2 2.81Å; P87-H268 PolarHBondContact O-CD2 3.19Å; P87-H268 PolarHBondContact O-NE2 2.79Å; P237-H268 HydrophobicContact CB-CB 4.04Å; P237-H268 HydrophobicContact CG-CB 4.3Å; P237-H268 PolarHBondContact O-N 3.03Å; F239-H268 HydrophobicContact CD2-CB 4.46Å; F239-H268 HydrophobicContact CE2-CB 3.94Å
269	D	95.4	Very high	94.6	Very high	26 Å²	26	53.3 Å²	53.3	14%	0.139	30%	0.298	C	S	.	.			trans	-133.9	77.5	175.1	176.1	25.5	0	0	0	111.3	I267 S271 H272 F273 L274	I267-D269 HydrophobicContact CG2-CB 4.27Å; I267-D269 PolarHBondContact O-N 2.87Å; D269-S271 PolarHBondContact O-N 3.04Å; D269-S271 PolarHBondContact OD1-OG 3.38Å; D269-H272 PolarHBondContact O-N 3.43Å; D269-H272 PolarHBondContact OD1-N 2.91Å; D269-H272 VanDerWaalsContact OD2-CA 3.25Å; D269-H272 WeakPolarHBondContact OD2-CA 3.37Å; D269-F273 VanDerWaalsContact CG-N 3.29Å; D269-F273 PolarHBondContact OD1-N 3.06Å; D269-F273 PolarHBondContact OD2-N 2.68Å; D269-L274 WeakPolarHBondContact OD2-CB 3.36Å; D269-L274 PolarHBondContact OD2-N 3.43Å
270	P	95.6	Very high	94.6	Very high	48 Å²	48	53 Å²	53	31%	0.312	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.9	-176.4	26.4	-35	0	0	0	113.6	D85 H272	D85-P270 HydrophobicContact CB-CB 3.77Å; D85-P270 HydrophobicContact CB-CG 3.73Å; D85-P270 WeakPolarHBondContact O-CG 3.04Å; P270-H272 VanDerWaalsContact C-N 3.34Å
271	S	93.5	Very high	94.7	Very high	33 Å²	33	50.8 Å²	50.8	23%	0.231	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.2	179	67.3	0	0	0	0	113.9	S92 N93 D269 F273	S92-S271 VanDerWaalsContact CB-OG 3.31Å; S92-S271 WeakPolarHBondContact CB-OG 3.48Å; N93-S271 WeakPolarHBondContact O-CB 3.22Å; D269-S271 PolarHBondContact O-N 3.04Å; D269-S271 PolarHBondContact OD1-OG 3.38Å; S271-F273 PolarHBondContact O-N 3.17Å; S271-F273 WeakPolarHBondContact OG-CB 3.25Å
272	H	94	Very high	94.7	Very high	136 Å²	136	54.1 Å²	54.1	63%	0.63	30%	0.297	S	S	*	.			trans	57.3	31.5	-173.8	-54.8	-64.4	0	0	0	113.4	D269 P270 L274 N275	D269-H272 PolarHBondContact O-N 3.43Å; D269-H272 PolarHBondContact OD1-N 2.91Å; D269-H272 VanDerWaalsContact OD2-CA 3.25Å; D269-H272 WeakPolarHBondContact OD2-CA 3.37Å; P270-H272 VanDerWaalsContact C-N 3.34Å; H272-L274 VanDerWaalsContact C-N 3.26Å; H272-L274 PolarHBondContact O-N 3.03Å; H272-N275 HydrophobicContact CB-CB 4.11Å; H272-N275 WeakPolarHBondContact O-CB 3.44Å; H272-N275 PolarHBondContact O-N 2.81Å
273	F	92.5	Very high	94.7	Very high	52 Å²	52	51.9 Å²	51.9	23%	0.228	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.5	179.9	176.6	-113.4	0	0	0	113	L89 G91 D269 S271 V319	L89-F273 HydrophobicContact CB-CD1 4.27Å; L89-F273 HydrophobicContact CD1-CD1 4.11Å; G91-F273 VanDerWaalsContact O-CE2 3.3Å; G91-F273 WeakPolarHBondContact O-CE2 3.38Å; D269-F273 VanDerWaalsContact CG-N 3.29Å; D269-F273 PolarHBondContact OD1-N 3.06Å; D269-F273 PolarHBondContact OD2-N 2.68Å; S271-F273 PolarHBondContact O-N 3.17Å; S271-F273 WeakPolarHBondContact OG-CB 3.25Å; F273-V319 HydrophobicContact CD1-CG1 4.48Å; F273-V319 HydrophobicContact CE1-CB 3.99Å; F273-V319 HydrophobicContact CE1-CG1 3.83Å; F273-V319 HydrophobicContact CE1-CG2 4.01Å; F273-V319 HydrophobicContact CZ-CB 3.95Å; F273-V319 HydrophobicContact CZ-CG1 4.28Å; F273-V319 HydrophobicContact CZ-CG2 4Å
274	L	93	Very high	94.7	Very high	6 Å²	6	55 Å²	55	3%	0.031	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-0.4	-179.1	-57.4	-176.6	0	0	0	113.4	L89 I236 I267 D269 H272 D276 S277 T317 V319	L89-L274 HydrophobicContact CD1-CD1 3.83Å; L89-L274 HydrophobicContact CD1-CD2 4.04Å; L89-L274 HydrophobicContact CD1-CG 3.98Å; I236-L274 HydrophobicContact CD1-CD1 4.45Å; I236-L274 HydrophobicContact CG1-CD1 4.37Å; I236-L274 HydrophobicContact CG2-CD1 3.99Å; I267-L274 HydrophobicContact CG2-CD1 3.99Å; D269-L274 WeakPolarHBondContact OD2-CB 3.36Å; D269-L274 PolarHBondContact OD2-N 3.43Å; H272-L274 VanDerWaalsContact C-N 3.26Å; H272-L274 PolarHBondContact O-N 3.03Å; L274-D276 VanDerWaalsContact C-N 3.29Å; L274-D276 PolarHBondContact O-N 3.27Å; L274-S277 WeakPolarHBondContact O-CB 3.3Å; L274-S277 PolarHBondContact O-N 2.78Å; L274-T317 HydrophobicContact CD1-CG2 4.49Å; L274-T317 HydrophobicContact CD2-CG2 3.88Å; L274-V319 HydrophobicContact CD2-CG1 3.37Å
275	N	90.2	Very high	94.7	Very high	119 Å²	119	52.3 Å²	52.3	64%	0.636	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-37.3	-170	-170.4	55.5	0	0	0	113.8	H272	H272-N275 HydrophobicContact CB-CB 4.11Å; H272-N275 WeakPolarHBondContact O-CB 3.44Å; H272-N275 PolarHBondContact O-N 2.81Å
276	D	86.9	Confident	94.6	Very high	152 Å²	152	53.4 Å²	53.4	81%	0.813	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	7.7	179	-58	-37.2	0	0	0	113	L274	L274-D276 VanDerWaalsContact C-N 3.29Å; L274-D276 PolarHBondContact O-N 3.27Å
277	S	89.9	Confident	94.6	Very high	15 Å²	15	49.2 Å²	49.2	11%	0.105	28%	0.277	C	S	.	.	S	Bend	trans	-98.4	135	-176	-56.7	0	0	0	0	111.5	L274 I279 T317	L274-S277 WeakPolarHBondContact O-CB 3.3Å; L274-S277 PolarHBondContact O-N 2.78Å; S277-I279 PolarHBondContact O-N 2.87Å; S277-T317 WeakPolarHBondContact CB-OG1 3.48Å
278	A	93.4	Very high	94.5	Very high	89 Å²	89	55.3 Å²	55.3	74%	0.736	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-73.3	118	173.2	0	0	0	0	0	110.2	T317	A278-T317 PolarHBondContact O-OG1 2.62Å; A278-T317 VanDerWaalsContact O-OG1 3.12Å
279	I	95.4	Very high	94.4	Very high	39 Å²	39	56 Å²	56	20%	0.2	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.1	-177.7	-60.6	157.5	0	0	0	109.7	I267 S277 Y281 V315	I267-I279 HydrophobicContact CD1-CD1 3.77Å; I267-I279 HydrophobicContact CD1-CG2 4.05Å; S277-I279 PolarHBondContact O-N 2.87Å; I279-Y281 HydrophobicContact CB-CE2 4.44Å; I279-Y281 HydrophobicContact CG2-CD2 4.47Å; I279-Y281 HydrophobicContact CG2-CE1 3.92Å; I279-Y281 HydrophobicContact CG2-CE2 3.84Å; I279-V315 HydrophobicContact CG2-CG1 3.55Å
280	S	96.8	Very high	94.2	Very high	24 Å²	24	56.6 Å²	56.6	17%	0.168	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.2	175.3	-176.5	0	0	0	0	110.4	V293 Q316	S280-V293 WeakPolarHBondContact OG-CG1 3.31Å; S280-Q316 PolarHBondContact N-O 2.82Å; S280-Q316 PolarHBondContact O-N 2.84Å
281	Y	97.6	Very high	94.1	Very high	15 Å²	15	59.8 Å²	59.8	6%	0.059	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.9	-179.3	-54.2	-88.5	0	0	0	109.3	V265 I267 I279 V293 S294 N296 H297 L313 V315	V265-Y281 HydrophobicContact CB-CD1 4.23Å; V265-Y281 HydrophobicContact CB-CE1 3.89Å; V265-Y281 HydrophobicContact CG1-CD1 4.09Å; V265-Y281 HydrophobicContact CG1-CE1 3.65Å; V265-Y281 HydrophobicContact CG2-CD1 4.07Å; V265-Y281 HydrophobicContact CG2-CE1 4.25Å; I267-Y281 HydrophobicContact CD1-CE1 4.21Å; I279-Y281 HydrophobicContact CB-CE2 4.44Å; I279-Y281 HydrophobicContact CG2-CD2 4.47Å; I279-Y281 HydrophobicContact CG2-CE1 3.92Å; I279-Y281 HydrophobicContact CG2-CE2 3.84Å; Y281-V293 WeakPolarHBondContact O-CA 3.39Å; Y281-S294 PolarHBondContact N-O 2.97Å; Y281-S294 PolarHBondContact O-N 3.13Å; Y281-N296 VanDerWaalsContact CD2-O 3.25Å; Y281-N296 WeakPolarHBondContact CD2-O 3.32Å; Y281-H297 HydrophobicContact CE2-CB 4.19Å; Y281-L313 HydrophobicContact CD1-CD1 4.44Å; Y281-V315 HydrophobicContact CD1-CG1 4.3Å; Y281-V315 HydrophobicContact CD1-CG2 3.82Å; Y281-V315 HydrophobicContact CE1-CG1 4.12Å; Y281-V315 HydrophobicContact CE1-CG2 4.1Å
282	K	97.1	Very high	94.2	Very high	69 Å²	69	62.2 Å²	62.2	30%	0.3	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.5	178.6	-62.4	177.7	173.8	168.5	0	109.5	F292 V293 L313 T314	K282-F292 CarbonylContact C-O 3.53Å; K282-F292 WeakPolarHBondContact CA-O 3.4Å; K282-V293 HydrophobicContact CG-CG1 4.26Å; K282-V293 HydrophobicContact CG-CG2 4.1Å; K282-L313 WeakPolarHBondContact O-CA 3.41Å; K282-T314 PolarHBondContact N-O 2.85Å; K282-T314 PolarHBondContact O-N 3.36Å
283	W	97.4	Very high	94.2	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.5	-173.6	-59.1	87.4	0	0	0	111.2	V240 F263 V265 F285 L291 F292 L299 L311 L313	V240-W283 HydrophobicContact CG1-CH2 4.24Å; V240-W283 HydrophobicContact CG1-CZ3 4.49Å; F263-W283 HydrophobicContact CB-CH2 3.65Å; F263-W283 HydrophobicContact CB-CZ2 4.46Å; F263-W283 HydrophobicContact CB-CZ3 3.87Å; F263-W283 HydrophobicContact CD1-CZ3 4.25Å; F263-W283 HydrophobicContact CG-CH2 4.43Å; F263-W283 HydrophobicContact CG-CZ3 4.16Å; V265-W283 HydrophobicContact CG2-CH2 3.35Å; V265-W283 HydrophobicContact CG2-CZ2 3.31Å; W283-F285 HydrophobicContact CB-CE2 3.93Å; W283-F285 HydrophobicContact CB-CZ 4.02Å; W283-F285 HydrophobicContact CD2-CZ 4.4Å; W283-F285 HydrophobicContact CE3-CE1 4.25Å; W283-F285 HydrophobicContact CE3-CZ 4.24Å; W283-F285 HydrophobicContact CG-CZ 4.36Å; W283-L291 WeakPolarHBondContact O-CA 3.1Å; W283-L291 WeakPolarHBondContact O-CD1 3.37Å; W283-F292 HydrophobicContact CB-CB 4.25Å; W283-F292 PolarHBondContact N-O 3.38Å; W283-F292 PolarHBondContact O-N 3.38Å; W283-L299 HydrophobicContact CB-CD2 4.11Å; W283-L299 VanDerWaalsContact CD1-CD2 3.44Å; W283-L299 HydrophobicContact CD2-CD2 3.92Å; W283-L299 HydrophobicContact CG-CD2 3.57Å; W283-L299 HydrophobicContact CZ2-CB 4.33Å; W283-L311 HydrophobicContact CE3-CD1 4.14Å; W283-L313 HydrophobicContact CD2-CD1 3.72Å; W283-L313 HydrophobicContact CE3-CB 4.1Å; W283-L313 HydrophobicContact CE3-CD1 3.99Å; W283-L313 HydrophobicContact CE3-CG 4.44Å; W283-L313 HydrophobicContact CG-CD1 4.21Å; W283-L313 HydrophobicContact CH2-CD1 4.24Å; W283-L313 HydrophobicContact CH2-CD2 3.84Å; W283-L313 HydrophobicContact CH2-CG 4.5Å; W283-L313 HydrophobicContact CZ2-CD1 3.97Å; W283-L313 HydrophobicContact CZ2-CD2 4.2Å; W283-L313 HydrophobicContact CZ3-CB 4.16Å; W283-L313 HydrophobicContact CZ3-CD1 4.24Å; W283-L313 HydrophobicContact CZ3-CD2 4.03Å; W283-L313 HydrophobicContact CZ3-CG 4.37Å
284	N	97.2	Very high	94.3	Very high	66 Å²	66	58.7 Å²	58.7	35%	0.353	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	111.5	166.1	177.4	-4.5	0	0	0	108.1	G286 L291 N312	N284-G286 VanDerWaalsContact C-N 3.32Å; N284-G286 PolarHBondContact O-N 3.21Å; N284-G286 PolarHBondContact OD1-N 2.91Å; N284-L291 HydrophobicContact CB-CD1 4.19Å; N284-N312 HydrophobicContact CB-CB 4.41Å; N284-N312 PolarHBondContact N-O 2.8Å; N284-N312 PolarHBondContact O-N 2.89Å
285	F	97	Very high	94.4	Very high	1 Å²	1	64.8 Å²	64.8	0%	0.004	38%	0.377	C	S	.	.			trans	-81.3	-7.5	-174.6	-68.2	-74	0	0	0	114.3	F263 W283 D287 F292 L299 H301 Y303 L311	F263-F285 AromaticContact CD2-CE1 3.91Å; F263-F285 HydrophobicContact CD2-CE1 3.91Å; F263-F285 HydrophobicContact CD2-CZ 4.47Å; F263-F285 HydrophobicContact CE1-CE1 4.46Å; F263-F285 HydrophobicContact CE2-CD1 4.32Å; F263-F285 AromaticContact CE2-CE1 3.63Å; F263-F285 HydrophobicContact CE2-CE1 3.63Å; F263-F285 HydrophobicContact CE2-CZ 4.47Å; F263-F285 HydrophobicContact CG-CE1 4.45Å; F263-F285 HydrophobicContact CZ-CD1 4.28Å; F263-F285 AromaticContact CZ-CE1 3.93Å; F263-F285 HydrophobicContact CZ-CE1 3.93Å; W283-F285 HydrophobicContact CB-CE2 3.93Å; W283-F285 HydrophobicContact CB-CZ 4.02Å; W283-F285 HydrophobicContact CD2-CZ 4.4Å; W283-F285 HydrophobicContact CE3-CE1 4.25Å; W283-F285 HydrophobicContact CE3-CZ 4.24Å; W283-F285 HydrophobicContact CG-CZ 4.36Å; F285-D287 VanDerWaalsContact C-N 3.28Å; F285-D287 PolarHBondContact O-N 2.99Å; F285-F292 AromaticContact CD2-CD2 3.84Å; F285-F292 HydrophobicContact CD2-CD2 3.84Å; F285-F292 HydrophobicContact CD2-CE2 4Å; F285-F292 AromaticContact CE2-CD2 3.7Å; F285-F292 HydrophobicContact CE2-CD2 3.7Å; F285-F292 HydrophobicContact CE2-CE2 4.14Å; F285-F292 HydrophobicContact CE2-CG 4.38Å; F285-L299 HydrophobicContact CE2-CD2 3.97Å; F285-L299 HydrophobicContact CZ-CD2 3.64Å; F285-L299 HydrophobicContact CZ-CG 4.39Å; F285-H301 HydrophobicContact CD1-CB 3.88Å; F285-H301 AromaticContact CD1-CD2 3.5Å; F285-H301 AromaticContact CD1-CG 3.67Å; F285-H301 HydrophobicContact CD2-CB 4.18Å; F285-H301 AromaticContact CD2-CD2 3.79Å; F285-H301 AromaticContact CD2-CE1 3.64Å; F285-H301 AromaticContact CD2-CG 3.54Å; F285-H301 AromaticContact CD2-ND1 3.49Å; F285-H301 WeakPolarHBondContact CD2-ND1 3.31Å; F285-H301 AromaticContact CD2-NE2 3.84Å; F285-H301 HydrophobicContact CE1-CB 3.47Å; F285-H301 VanDerWaalsContact CE1-CB 3.47Å; F285-H301 AromaticContact CE1-CG 3.77Å; F285-H301 HydrophobicContact CE2-CB 3.77Å; F285-H301 AromaticContact CE2-CG 3.62Å; F285-H301 AromaticContact CE2-ND1 3.64Å; F285-H301 HydrophobicContact CG-CB 4.23Å; F285-H301 AromaticContact CG-CD2 3.37Å; F285-H301 WeakPolarHBondContact CG-CD2 3.21Å; F285-H301 AromaticContact CG-CE1 3.89Å; F285-H301 AromaticContact CG-CG 3.57Å; F285-H301 AromaticContact CG-ND1 3.93Å; F285-H301 AromaticContact CG-NE2 3.59Å; F285-H301 HydrophobicContact CZ-CB 3.41Å; F285-H301 VanDerWaalsContact CZ-CB 3.41Å; F285-H301 AromaticContact CZ-CG 3.74Å; F285-Y303 HydrophobicContact CB-CE1 4.2Å; F285-Y303 WeakPolarHBondContact O-CE1 3.41Å; F285-Y303 PolarHBondContact O-OH 2.87Å; F285-L311 HydrophobicContact CD1-CD1 3.55Å; F285-L311 HydrophobicContact CE1-CD1 3.87Å; F285-L311 HydrophobicContact CG-CD1 4.35Å
286	G	95.8	Very high	94.6	Very high	32 Å²	32	63.1 Å²	63.1	33%	0.33	37%	0.368	S	S	.	.	S	Bend	trans	79.1	1.6	177.4	0	0	0	0	0	115.4	N284	N284-G286 VanDerWaalsContact C-N 3.32Å; N284-G286 PolarHBondContact O-N 3.21Å; N284-G286 PolarHBondContact OD1-N 2.91Å
287	D	95.7	Very high	95	Very high	21 Å²	21	60.1 Å²	60.1	11%	0.112	35%	0.349	C	S	.	.	S	Bend	trans	-102.7	12.5	-177.2	65.4	-9.4	0	0	0	114.1	F285 T289 H301 Y303 F309	F285-D287 VanDerWaalsContact C-N 3.28Å; F285-D287 PolarHBondContact O-N 2.99Å; D287-T289 VanDerWaalsContact C-N 3.25Å; D287-T289 VanDerWaalsContact CG-CG2 3.44Å; D287-T289 PolarHBondContact O-N 2Å; D287-T289 WeakPolarHBondContact OD1-CB 3.22Å; D287-T289 VanDerWaalsContact OD1-CG2 3.3Å; D287-T289 WeakPolarHBondContact OD1-CG2 3.2Å; D287-T289 PolarHBondContact OD1-N 2.73Å; D287-T289 VanDerWaalsContact OD1-N 3.13Å; D287-T289 PolarHBondContact OD1-OG1 2.93Å; D287-T289 WeakPolarHBondContact OD2-CG2 3.41Å; D287-H301 IonicContact OD1-NE2 3.99Å; D287-H301 IonicContact OD2-CD2 2.66Å; D287-H301 IonicContact OD2-CE1 3.52Å; D287-H301 PolarHBondContact OD2-CE1 3.24Å; D287-H301 IonicContact OD2-NE2 3.7Å; D287-H301 PolarHBondContact OD2-NE2 2.79Å; D287-Y303 HydrophobicContact CB-CD1 3.83Å; D287-Y303 HydrophobicContact CB-CE1 3.84Å; D287-F309 HydrophobicContact CB-CD1 3.66Å; D287-F309 HydrophobicContact CB-CE1 3.66Å; D287-F309 HydrophobicContact CB-CG 4.42Å; D287-F309 HydrophobicContact CB-CZ 4.43Å
288	N	93.7	Very high	95.3	Very high	162 Å²	162	61.3 Å²	61.3	87%	0.866	36%	0.356	S	S	*	.	S	Bend	trans	65.3	16.5	-176.7	-52	-52.6	0	0	0	115.6	G290	N288-G290 PolarHBondContact O-N 3.27Å
289	T	94.1	Very high	95.5	Very high	70 Å²	70	58.9 Å²	58.9	43%	0.429	33%	0.33	S	S	.	.	S	Bend	trans	-71.3	-12.8	173.6	54.4	0	0	0	0	114	D287 H301	D287-T289 VanDerWaalsContact C-N 3.25Å; D287-T289 VanDerWaalsContact CG-CG2 3.44Å; D287-T289 PolarHBondContact O-N 2Å; D287-T289 WeakPolarHBondContact OD1-CB 3.22Å; D287-T289 VanDerWaalsContact OD1-CG2 3.3Å; D287-T289 WeakPolarHBondContact OD1-CG2 3.2Å; D287-T289 PolarHBondContact OD1-N 2.73Å; D287-T289 VanDerWaalsContact OD1-N 3.13Å; D287-T289 PolarHBondContact OD1-OG1 2.93Å; D287-T289 WeakPolarHBondContact OD2-CG2 3.41Å; T289-H301 PolarHBondContact OG1-CE1 2.8Å
290	G	91.7	Very high	95.5	Very high	39 Å²	39	61.6 Å²	61.6	40%	0.402	35%	0.345	S	S	.	.			trans	111	-168.3	177	0	0	0	0	0	113	N288	N288-G290 PolarHBondContact O-N 3.27Å
291	L	93.4	Very high	95.5	Very high	116 Å²	116	61.2 Å²	61.2	61%	0.607	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.3	177.5	-173.4	79.9	0	0	0	109.3	W283 N284 V293	W283-L291 WeakPolarHBondContact O-CA 3.1Å; W283-L291 WeakPolarHBondContact O-CD1 3.37Å; N284-L291 HydrophobicContact CB-CD1 4.19Å; L291-V293 HydrophobicContact CD2-CG2 4.42Å
292	F	94.8	Very high	95.5	Very high	83 Å²	83	63 Å²	63	36%	0.364	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.5	175	-62.2	-93.7	0	0	0	110.1	K282 W283 F285 L299	K282-F292 CarbonylContact C-O 3.53Å; K282-F292 WeakPolarHBondContact CA-O 3.4Å; W283-F292 HydrophobicContact CB-CB 4.25Å; W283-F292 PolarHBondContact N-O 3.38Å; W283-F292 PolarHBondContact O-N 3.38Å; F285-F292 AromaticContact CD2-CD2 3.84Å; F285-F292 HydrophobicContact CD2-CD2 3.84Å; F285-F292 HydrophobicContact CD2-CE2 4Å; F285-F292 AromaticContact CE2-CD2 3.7Å; F285-F292 HydrophobicContact CE2-CD2 3.7Å; F285-F292 HydrophobicContact CE2-CE2 4.14Å; F285-F292 HydrophobicContact CE2-CG 4.38Å; F292-L299 HydrophobicContact CB-CD2 4.33Å
293	V	94.9	Very high	95.5	Very high	88 Å²	88	59.8 Å²	59.8	53%	0.533	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125.4	175.3	-172.8	0	0	0	0	108.5	S280 Y281 K282 L291	S280-V293 WeakPolarHBondContact OG-CG1 3.31Å; Y281-V293 WeakPolarHBondContact O-CA 3.39Å; K282-V293 HydrophobicContact CG-CG1 4.26Å; K282-V293 HydrophobicContact CG-CG2 4.1Å; L291-V293 HydrophobicContact CD2-CG2 4.42Å
294	S	94.8	Very high	95.4	Very high	27 Å²	27	64.3 Å²	64.3	19%	0.189	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	153.6	-178.6	-177.5	0	0	0	0	110.6	Y281 N296	Y281-S294 PolarHBondContact N-O 2.97Å; Y281-S294 PolarHBondContact O-N 3.13Å; S294-N296 PolarHBondContact OG-N 3.15Å; S294-N296 PolarHBondContact OG-O 3.03Å
295	N	94.1	Very high	95.4	Very high	133 Å²	133	66.8 Å²	66.8	71%	0.711	38%	0.379	S	S	*	.	S	Bend	trans	-101	-4.1	167.3	-63.6	-15.5	0	0	0	111.7
296	N	95	Very high	95.3	Very high	85 Å²	85	70.3 Å²	70.3	46%	0.455	40%	0.398	S	S	.	.	S	Bend	trans	-89.4	139.9	173.1	-164.4	9	0	0	0	110	Y281 S294 T298	Y281-N296 VanDerWaalsContact CD2-O 3.25Å; Y281-N296 WeakPolarHBondContact CD2-O 3.32Å; S294-N296 PolarHBondContact OG-N 3.15Å; S294-N296 PolarHBondContact OG-O 3.03Å; N296-T298 PolarHBondContact O-N 3.07Å
297	H	94.8	Very high	95.3	Very high	89 Å²	89	70.3 Å²	70.3	41%	0.412	40%	0.398	S	S	.	.	S	Bend	trans	-74.8	-16.8	179.1	57	-77.7	0	0	0	112.5	D264 V265 Y281	D264-H297 IonicContact OD1-CD2 3.59Å; D264-H297 PolarHBondContact OD1-CD2 2.96Å; D264-H297 IonicContact OD1-NE2 3.62Å; V265-H297 HydrophobicContact CB-CB 4.39Å; V265-H297 WeakPolarHBondContact CB-O 3.34Å; V265-H297 VanDerWaalsContact CG2-O 3.31Å; V265-H297 WeakPolarHBondContact CG2-O 3.41Å; V265-H297 PolarHBondContact N-O 2.95Å; Y281-H297 HydrophobicContact CE2-CB 4.19Å
298	T	96.7	Very high	95.4	Very high	40 Å²	40	73.4 Å²	73.4	25%	0.245	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.9	174.6	-39.6	0	0	0	0	111.2	V262 F263 D264 N296	V262-T298 HydrophobicContact CG1-CG2 3.67Å; F263-T298 CarbonylContact O-C 3.53Å; F263-T298 VanDerWaalsContact O-CA 3.24Å; F263-T298 WeakPolarHBondContact O-CA 3.48Å; F263-T298 WeakPolarHBondContact O-CG2 3.29Å; D264-T298 HydrophobicContact CB-CG2 4.38Å; D264-T298 PolarHBondContact OD1-OG1 3.21Å; N296-T298 PolarHBondContact O-N 3.07Å
299	L	96.6	Very high	95.6	Very high	38 Å²	38	66.9 Å²	66.9	20%	0.199	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	142.1	175.9	-176.7	66.1	0	0	0	110.4	F263 W283 F285 F292	F263-L299 WeakPolarHBondContact CD2-O 3.25Å; F263-L299 PolarHBondContact N-O 2.78Å; F263-L299 PolarHBondContact O-N 3.43Å; W283-L299 HydrophobicContact CB-CD2 4.11Å; W283-L299 VanDerWaalsContact CD1-CD2 3.44Å; W283-L299 HydrophobicContact CD2-CD2 3.92Å; W283-L299 HydrophobicContact CG-CD2 3.57Å; W283-L299 HydrophobicContact CZ2-CB 4.33Å; F285-L299 HydrophobicContact CE2-CD2 3.97Å; F285-L299 HydrophobicContact CZ-CD2 3.64Å; F285-L299 HydrophobicContact CZ-CG 4.39Å; F292-L299 HydrophobicContact CB-CD2 4.33Å
300	N	96.7	Very high	95.7	Very high	96 Å²	96	68 Å²	68	51%	0.513	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136.4	173.6	-64.7	-0.7	0	0	0	109.8	P260 I261	P260-N300 HydrophobicContact CB-CB 4.48Å; I261-N300 WeakPolarHBondContact O-CA 3.28Å
301	H	97	Very high	96	Very high	16 Å²	16	66.2 Å²	66.2	7%	0.074	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.1	174.2	-174.3	68.2	0	0	0	111.4	I261 F263 F285 D287 T289 Y303	I261-H301 PolarHBondContact N-O 3Å; I261-H301 PolarHBondContact O-N 3.06Å; F263-H301 HydrophobicContact CD2-CB 4.39Å; F263-H301 HydrophobicContact CE2-CB 3.82Å; F285-H301 HydrophobicContact CD1-CB 3.88Å; F285-H301 AromaticContact CD1-CD2 3.5Å; F285-H301 AromaticContact CD1-CG 3.67Å; F285-H301 HydrophobicContact CD2-CB 4.18Å; F285-H301 AromaticContact CD2-CD2 3.79Å; F285-H301 AromaticContact CD2-CE1 3.64Å; F285-H301 AromaticContact CD2-CG 3.54Å; F285-H301 AromaticContact CD2-ND1 3.49Å; F285-H301 WeakPolarHBondContact CD2-ND1 3.31Å; F285-H301 AromaticContact CD2-NE2 3.84Å; F285-H301 HydrophobicContact CE1-CB 3.47Å; F285-H301 VanDerWaalsContact CE1-CB 3.47Å; F285-H301 AromaticContact CE1-CG 3.77Å; F285-H301 HydrophobicContact CE2-CB 3.77Å; F285-H301 AromaticContact CE2-CG 3.62Å; F285-H301 AromaticContact CE2-ND1 3.64Å; F285-H301 HydrophobicContact CG-CB 4.23Å; F285-H301 AromaticContact CG-CD2 3.37Å; F285-H301 WeakPolarHBondContact CG-CD2 3.21Å; F285-H301 AromaticContact CG-CE1 3.89Å; F285-H301 AromaticContact CG-CG 3.57Å; F285-H301 AromaticContact CG-ND1 3.93Å; F285-H301 AromaticContact CG-NE2 3.59Å; F285-H301 HydrophobicContact CZ-CB 3.41Å; F285-H301 VanDerWaalsContact CZ-CB 3.41Å; F285-H301 AromaticContact CZ-CG 3.74Å; D287-H301 IonicContact OD1-NE2 3.99Å; D287-H301 IonicContact OD2-CD2 2.66Å; D287-H301 IonicContact OD2-CE1 3.52Å; D287-H301 PolarHBondContact OD2-CE1 3.24Å; D287-H301 IonicContact OD2-NE2 3.7Å; D287-H301 PolarHBondContact OD2-NE2 2.79Å; T289-H301 PolarHBondContact OG1-CE1 2.8Å; H301-Y303 AromaticContact CD2-CD2 3.9Å; H301-Y303 AromaticContact CD2-CE2 3.69Å; H301-Y303 AromaticContact CD2-CZ 3.86Å
302	T	97.2	Very high	96.2	Very high	52 Å²	52	63.1 Å²	63.1	32%	0.319	35%	0.351	S	S	.	.			trans	-123.8	118.4	-177.6	-59.2	0	0	0	0	109.4	D258 P260	D258-T302 VanDerWaalsContact C-CG2 3.5Å; P260-T302 WeakPolarHBondContact CA-OG1 3.4Å
303	Y	96.9	Very high	96.3	Very high	1 Å²	1	59.2 Å²	59.2	0%	0.004	33%	0.334	C	S	.	.			trans	-83	125.6	173.4	-70.1	-88.9	0	0	0	110.2	R257 D258 I261 F263 F285 D287 H301 F309 I385 I387	R257-Y303 WeakPolarHBondContact CG-O 3.4Å; D258-Y303 PolarHBondContact N-O 2.86Å; I261-Y303 HydrophobicContact CD1-CD2 3.71Å; I261-Y303 HydrophobicContact CD1-CE2 3.83Å; F263-Y303 HydrophobicContact CZ-CE2 4.47Å; F285-Y303 HydrophobicContact CB-CE1 4.2Å; F285-Y303 WeakPolarHBondContact O-CE1 3.41Å; F285-Y303 PolarHBondContact O-OH 2.87Å; D287-Y303 HydrophobicContact CB-CD1 3.83Å; D287-Y303 HydrophobicContact CB-CE1 3.84Å; H301-Y303 AromaticContact CD2-CD2 3.9Å; H301-Y303 AromaticContact CD2-CE2 3.69Å; H301-Y303 AromaticContact CD2-CZ 3.86Å; Y303-F309 HydrophobicContact CD1-CB 4.47Å; Y303-F309 HydrophobicContact CD1-CD1 4.35Å; Y303-F309 AromaticContact CD1-CD2 3.6Å; Y303-F309 HydrophobicContact CD1-CD2 3.6Å; Y303-F309 AromaticContact CD1-CE2 3.83Å; Y303-F309 HydrophobicContact CD1-CE2 3.83Å; Y303-F309 AromaticContact CD1-CG 3.88Å; Y303-F309 HydrophobicContact CD1-CG 3.88Å; Y303-F309 HydrophobicContact CD1-CZ 4.31Å; Y303-F309 HydrophobicContact CE1-CB 3.71Å; Y303-F309 HydrophobicContact CE1-CD1 4.18Å; Y303-F309 AromaticContact CE1-CD2 3.7Å; Y303-F309 HydrophobicContact CE1-CD2 3.7Å; Y303-F309 HydrophobicContact CE1-CE2 4.38Å; Y303-F309 AromaticContact CE1-CG 3.58Å; Y303-F309 HydrophobicContact CE1-CG 3.58Å; Y303-F309 HydrophobicContact CG-CD2 4.43Å; Y303-I385 HydrophobicContact CE2-CG2 4.48Å; Y303-I387 HydrophobicContact CD1-CG1 4.08Å; Y303-I387 HydrophobicContact CD2-CD1 3.49Å; Y303-I387 VanDerWaalsContact CD2-CD1 3.49Å; Y303-I387 HydrophobicContact CD2-CG1 3.96Å; Y303-I387 HydrophobicContact CE2-CD1 4.11Å; Y303-I387 HydrophobicContact CG-CD1 3.72Å; Y303-I387 HydrophobicContact CG-CG1 3.64Å
304	V	95.5	Very high	96.4	Very high	96 Å²	96	57 Å²	57	58%	0.582	32%	0.32	S	S	*	.			trans	-98.5	-9.9	-177.4	-173.8	0	0	0	0	111.9	R257	R257-V304 VanDerWaalsContact CD-O 3.23Å; R257-V304 WeakPolarHBondContact CD-O 2.98Å
305	L	96.1	Very high	96.6	Very high	117 Å²	117	55.7 Å²	55.7	61%	0.613	31%	0.311	S	S	*	.	S	Bend	trans	-118.3	143.7	179.3	-64.4	177.4	0	0	0	109.7	F309 I387	L305-F309 HydrophobicContact CB-CZ 4.04Å; L305-F309 WeakPolarHBondContact O-CE2 3.38Å; L305-I387 WeakPolarHBondContact O-CG2 3.15Å
306	N	95.7	Very high	96.6	Very high	75 Å²	75	51.4 Å²	51.4	40%	0.401	29%	0.287	S	S	.	.			trans	-74.5	151.5	169.7	-61.7	-10.7	0	0	0	109.7	R257 I387 E389	R257-N306 VanDerWaalsContact CD-OD1 3.23Å; R257-N306 WeakPolarHBondContact CD-OD1 3.31Å; R257-N306 PolarHBondContact NH1-ND2 3.2Å; R257-N306 PolarHBondContact NH1-OD1 2.95Å; N306-I387 WeakPolarHBondContact CA-O 3.36Å; N306-E389 VanDerWaalsContact ND2-CG 3.32Å; N306-E389 WeakPolarHBondContact ND2-CG 3.45Å
307	G	96.4	Very high	96.6	Very high	32 Å²	32	47.4 Å²	47.4	33%	0.33	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	131.7	-170.5	175.7	0	0	0	0	0	112.7	F309 I387	G307-F309 WeakPolarHBondContact O-CE2 3.39Å; G307-I387 PolarHBondContact N-O 2.93Å; G307-I387 PolarHBondContact O-N 2.75Å
308	T	97.5	Very high	96.5	Very high	87 Å²	87	44.4 Å²	44.4	53%	0.534	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.5	-177.1	-55.1	0	0	0	0	110.2	T384 I385	T308-T384 HydrophobicContact CG2-CG2 3.3Å; T308-I385 CarbonylContact C-O 3.6Å; T308-I385 WeakPolarHBondContact CA-O 3.45Å
309	F	97.4	Very high	96	Very high	24 Å²	24	42.5 Å²	42.5	11%	0.105	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.4	-177.3	-57.1	-84	0	0	0	111.2	D287 Y303 L305 G307 I385 I387	D287-F309 HydrophobicContact CB-CD1 3.66Å; D287-F309 HydrophobicContact CB-CE1 3.66Å; D287-F309 HydrophobicContact CB-CG 4.42Å; D287-F309 HydrophobicContact CB-CZ 4.43Å; Y303-F309 HydrophobicContact CD1-CB 4.47Å; Y303-F309 HydrophobicContact CD1-CD1 4.35Å; Y303-F309 AromaticContact CD1-CD2 3.6Å; Y303-F309 HydrophobicContact CD1-CD2 3.6Å; Y303-F309 AromaticContact CD1-CE2 3.83Å; Y303-F309 HydrophobicContact CD1-CE2 3.83Å; Y303-F309 AromaticContact CD1-CG 3.88Å; Y303-F309 HydrophobicContact CD1-CG 3.88Å; Y303-F309 HydrophobicContact CD1-CZ 4.31Å; Y303-F309 HydrophobicContact CE1-CB 3.71Å; Y303-F309 HydrophobicContact CE1-CD1 4.18Å; Y303-F309 AromaticContact CE1-CD2 3.7Å; Y303-F309 HydrophobicContact CE1-CD2 3.7Å; Y303-F309 HydrophobicContact CE1-CE2 4.38Å; Y303-F309 AromaticContact CE1-CG 3.58Å; Y303-F309 HydrophobicContact CE1-CG 3.58Å; Y303-F309 HydrophobicContact CG-CD2 4.43Å; L305-F309 HydrophobicContact CB-CZ 4.04Å; L305-F309 WeakPolarHBondContact O-CE2 3.38Å; G307-F309 WeakPolarHBondContact O-CE2 3.39Å; F309-I385 PolarHBondContact N-O 2.87Å; F309-I385 PolarHBondContact O-N 3Å; F309-I387 HydrophobicContact CD2-CB 4.37Å; F309-I387 HydrophobicContact CD2-CG1 3.61Å; F309-I387 HydrophobicContact CE2-CB 4Å; F309-I387 HydrophobicContact CE2-CG1 3.66Å
310	N	97.1	Very high	95.3	Very high	95 Å²	95	44.9 Å²	44.9	51%	0.508	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	103.3	177.5	-67.6	-47.3	0	0	0	109.8
311	L	96.6	Very high	94.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.2	173	174.6	65.2	0	0	0	109.7	M242 F263 W283 F285 F381 R382 A383 I385	M242-L311 HydrophobicContact SD-CD2 4.39Å; F263-L311 HydrophobicContact CD1-CD2 3.92Å; F263-L311 HydrophobicContact CE1-CD2 3.66Å; W283-L311 HydrophobicContact CE3-CD1 4.14Å; F285-L311 HydrophobicContact CD1-CD1 3.55Å; F285-L311 HydrophobicContact CE1-CD1 3.87Å; F285-L311 HydrophobicContact CG-CD1 4.35Å; L311-F381 HydrophobicContact CD2-CD1 4.5Å; L311-F381 HydrophobicContact CD2-CE1 4.21Å; L311-R382 VanDerWaalsContact O-CA 3.28Å; L311-R382 WeakPolarHBondContact O-CA 3.44Å; L311-A383 HydrophobicContact CB-CB 4.44Å; L311-A383 HydrophobicContact CD2-CB 4.47Å; L311-A383 PolarHBondContact N-O 3.37Å; L311-A383 PolarHBondContact O-N 3.37Å; L311-A383 VanDerWaalsContact O-N 3.15Å; L311-I385 HydrophobicContact CB-CD1 3.9Å; L311-I385 HydrophobicContact CB-CG1 4.37Å; L311-I385 HydrophobicContact CD2-CD1 3.9Å; L311-I385 HydrophobicContact CG-CD1 4.47Å
312	N	97.4	Very high	92.7	Very high	52 Å²	52	45 Å²	45	28%	0.278	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	118.5	171.3	-67.2	-63.4	0	0	0	110.2	N284 R382	N284-N312 HydrophobicContact CB-CB 4.41Å; N284-N312 PolarHBondContact N-O 2.8Å; N284-N312 PolarHBondContact O-N 2.89Å; N312-R382 VanDerWaalsContact OD1-CD 3.29Å; N312-R382 WeakPolarHBondContact OD1-CD 3.45Å; N312-R382 VanDerWaalsContact OD1-CG 3.27Å; N312-R382 WeakPolarHBondContact OD1-CG 3.5Å; N312-R382 PolarHBondContact OD1-NE 3.19Å
313	L	97.8	Very high	91	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.8	171.5	167.2	65.7	0	0	0	109.4	V238 V240 V265 Y281 K282 W283 V315 Y380 F381	V238-L313 HydrophobicContact CG1-CD2 4.03Å; V240-L313 HydrophobicContact CG2-CD2 3.59Å; V265-L313 HydrophobicContact CG1-CD2 4.11Å; V265-L313 HydrophobicContact CG2-CD2 3.63Å; Y281-L313 HydrophobicContact CD1-CD1 4.44Å; K282-L313 WeakPolarHBondContact O-CA 3.41Å; W283-L313 HydrophobicContact CD2-CD1 3.72Å; W283-L313 HydrophobicContact CE3-CB 4.1Å; W283-L313 HydrophobicContact CE3-CD1 3.99Å; W283-L313 HydrophobicContact CE3-CG 4.44Å; W283-L313 HydrophobicContact CG-CD1 4.21Å; W283-L313 HydrophobicContact CH2-CD1 4.24Å; W283-L313 HydrophobicContact CH2-CD2 3.84Å; W283-L313 HydrophobicContact CH2-CG 4.5Å; W283-L313 HydrophobicContact CZ2-CD1 3.97Å; W283-L313 HydrophobicContact CZ2-CD2 4.2Å; W283-L313 HydrophobicContact CZ3-CB 4.16Å; W283-L313 HydrophobicContact CZ3-CD1 4.24Å; W283-L313 HydrophobicContact CZ3-CD2 4.03Å; W283-L313 HydrophobicContact CZ3-CG 4.37Å; L313-V315 HydrophobicContact CD1-CG2 4.27Å; L313-V315 HydrophobicContact CD2-CG2 4.06Å; L313-V315 HydrophobicContact CG-CG2 4.05Å; L313-Y380 WeakPolarHBondContact O-CA 3.15Å; L313-F381 HydrophobicContact CB-CB 4.18Å; L313-F381 HydrophobicContact CD2-CB 4.25Å; L313-F381 PolarHBondContact N-O 3.14Å; L313-F381 PolarHBondContact O-N 3.5Å
314	T	97.6	Very high	89.5	Confident	41 Å²	41	50.2 Å²	50.2	25%	0.252	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.5	167	-58	0	0	0	0	109.5	K282 Y378 G379 Y380	K282-T314 PolarHBondContact N-O 2.85Å; K282-T314 PolarHBondContact O-N 3.36Å; T314-Y378 HydrophobicContact CG2-CD1 4.26Å; T314-G379 CarbonylContact C-O 3.55Å; T314-G379 WeakPolarHBondContact CA-O 3.47Å; T314-Y380 HydrophobicContact CG2-CD1 4.05Å; T314-Y380 HydrophobicContact CG2-CE1 3.7Å
315	V	97.5	Very high	87.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.5	172.1	-176.3	0	0	0	0	108	I236 V238 V265 I267 I279 Y281 L313 Y378 G379	I236-V315 HydrophobicContact CD1-CG1 4.18Å; V238-V315 HydrophobicContact CB-CG2 4.41Å; V238-V315 HydrophobicContact CG1-CG2 3.92Å; V238-V315 HydrophobicContact CG2-CB 3.99Å; V238-V315 HydrophobicContact CG2-CG2 3.6Å; V265-V315 HydrophobicContact CG1-CG2 4.45Å; I267-V315 HydrophobicContact CD1-CG1 4.13Å; I279-V315 HydrophobicContact CG2-CG1 3.55Å; Y281-V315 HydrophobicContact CD1-CG1 4.3Å; Y281-V315 HydrophobicContact CD1-CG2 3.82Å; Y281-V315 HydrophobicContact CE1-CG1 4.12Å; Y281-V315 HydrophobicContact CE1-CG2 4.1Å; L313-V315 HydrophobicContact CD1-CG2 4.27Å; L313-V315 HydrophobicContact CD2-CG2 4.06Å; L313-V315 HydrophobicContact CG-CG2 4.05Å; V315-Y378 CarbonylContact O-C 3.54Å; V315-Y378 VanDerWaalsContact O-CA 3.25Å; V315-Y378 WeakPolarHBondContact O-CA 3.37Å; V315-G379 PolarHBondContact N-O 3.43Å; V315-G379 PolarHBondContact O-N 2.82Å
316	Q	96	Very high	86	Confident	42 Å²	42	51.2 Å²	51.2	20%	0.196	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136	179.5	179.8	178.2	-2.2	0	0	110.2	S280 R377 Y378	S280-Q316 PolarHBondContact N-O 2.82Å; S280-Q316 PolarHBondContact O-N 2.84Å; Q316-R377 WeakPolarHBondContact CA-O 3.43Å; Q316-Y378 HydrophobicContact CB-CD1 4.05Å; Q316-Y378 HydrophobicContact CB-CE1 4.05Å; Q316-Y378 HydrophobicContact CG-CD1 4Å; Q316-Y378 HydrophobicContact CG-CE1 3.56Å; Q316-Y378 PolarHBondContact NE2-OH 2.77Å
317	T	94.7	Very high	84.1	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	157	173.7	-169.2	0	0	0	0	111.1	I236 L274 S277 A278 V319 N376 R377	I236-T317 HydrophobicContact CD1-CG2 3.54Å; L274-T317 HydrophobicContact CD1-CG2 4.49Å; L274-T317 HydrophobicContact CD2-CG2 3.88Å; S277-T317 WeakPolarHBondContact CB-OG1 3.48Å; A278-T317 PolarHBondContact O-OG1 2.62Å; A278-T317 VanDerWaalsContact O-OG1 3.12Å; T317-V319 HydrophobicContact CG2-CG1 4.16Å; T317-N376 WeakPolarHBondContact O-CA 3.48Å; T317-R377 HydrophobicContact CG2-CB 4Å; T317-R377 PolarHBondContact N-O 3.43Å; T317-R377 PolarHBondContact O-N 3.08Å
318	A	91.4	Very high	82.2	Confident	25 Å²	25	57 Å²	57	21%	0.207	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	106.7	-180	0	0	0	0	0	110.4	R374 I375	A318-R374 HydrophobicContact CB-CB 4.28Å; A318-R374 PolarHBondContact O-NE 2.98Å; A318-R374 PolarHBondContact O-NH2 3.4Å; A318-I375 WeakPolarHBondContact CA-O 3.45Å
319	V	87.6	Confident	79.9	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	148.1	-176.9	-59.5	0	0	0	0	111.5	F273 L274 T317 R374 I375 R377	F273-V319 HydrophobicContact CD1-CG1 4.48Å; F273-V319 HydrophobicContact CE1-CB 3.99Å; F273-V319 HydrophobicContact CE1-CG1 3.83Å; F273-V319 HydrophobicContact CE1-CG2 4.01Å; F273-V319 HydrophobicContact CZ-CB 3.95Å; F273-V319 HydrophobicContact CZ-CG1 4.28Å; F273-V319 HydrophobicContact CZ-CG2 4Å; L274-V319 HydrophobicContact CD2-CG1 3.37Å; T317-V319 HydrophobicContact CG2-CG1 4.16Å; V319-R374 CarbonylContact O-C 3.5Å; V319-R374 WeakPolarHBondContact O-CA 3.45Å; V319-I375 HydrophobicContact CG2-CB 4.3Å; V319-I375 PolarHBondContact N-O 3.13Å; V319-I375 PolarHBondContact O-N 2.98Å; V319-R377 HydrophobicContact CG1-CG 4.34Å; V319-R377 HydrophobicContact CG2-CG 3.67Å
320	P	81.2	Confident	77.6	Confident	87 Å²	87	63.1 Å²	63.1	57%	0.565	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.2	167.9	-19.8	32.9	0	0	0	110.8
321	G	72.7	Confident	75.7	Confident	23 Å²	23	63.6 Å²	63.6	24%	0.237	42%	0.416	C	S	.	.			trans	-165.3	167.9	174.8	0	0	0	0	0	113.2	C323 C373	G321-C323 PolarHBondContact O-N 3.35Å; G321-C373 PolarHBondContact N-O 2.99Å; G321-C373 VanDerWaalsContact N-O 3.17Å; G321-C373 VanDerWaalsContact O-CB 3.22Å; G321-C373 WeakPolarHBondContact O-CB 3.29Å
322	P	67.5	Low	73.8	Confident	91 Å²	91	69 Å²	69	59%	0.591	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-66	128	177.9	26.2	-31.5	0	0	0	109.9
323	C	60.1	Low	71.9	Confident	57 Å²	57	71.8 Å²	71.8	39%	0.385	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-61.3	140.3	172.6	-74.7	0	0	0	0	109.6	G321 C373	G321-C323 PolarHBondContact O-N 3.35Å; C323-C373 WeakPolarHBondContact CA-SG 3.46Å; C323-C373 HydrophobicContact CB-CB 4.04Å; C323-C373 WeakPolarHBondContact CB-SG 3.44Å; C323-C373 WeakPolarHBondContact SG-CB 3.29Å; C323-C373 CovalentContact SG-SG 2.04Å; C323-C373 PolarHBondContact SG-SG 2.91Å
324	P	65.1	Low	70	Confident	106 Å²	106	77.7 Å²	77.7	69%	0.688	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.1	141.4	163.8	24.8	-30.8	0	0	0	108.6
325	P	59.2	Low	67.8	Low	110 Å²	110	81.1 Å²	81.1	71%	0.714	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-55.6	143	174.8	23.1	-31.6	0	0	0	109	S327	P325-S327 PolarHBondContact O-N 2.68Å
326	P	59.3	Low	65.6	Low	124 Å²	124	87.3 Å²	87.3	81%	0.805	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-55.2	121.6	179.4	21.8	-31.4	0	0	0	108.8
327	S	56.5	Low	63.9	Low	108 Å²	108	90.7 Å²	90.7	76%	0.755	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-51.7	131.9	170.7	-61.3	0	0	0	0	108	P325 S329	P325-S327 PolarHBondContact O-N 2.68Å; S327-S329 PolarHBondContact O-N 3.49Å
328	P	56.3	Low	62.1	Low	120 Å²	120	96.3 Å²	96.3	78%	0.779	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-57.2	116	175.4	22.2	-30.2	0	0	0	107.4	T330	P328-T330 PolarHBondContact O-N 3.21Å
329	S	49.6	Very low	60	Low	114 Å²	114	100.4 Å²	100.4	80%	0.797	66%	0.663	S	S	*	*			trans	-61.3	105.6	172.8	31.1	0	0	0	0	107.1	S327	S327-S329 PolarHBondContact O-N 3.49Å
330	T	49	Very low	58.6	Low	127 Å²	127	106 Å²	106	78%	0.779	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-54.2	127.2	163.9	-18.5	0	0	0	0	106.2	P328	P328-T330 PolarHBondContact O-N 3.21Å
331	P	55.8	Low	57.5	Low	105 Å²	105	107.4 Å²	107.4	68%	0.682	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-55.5	140.8	176.5	-18.2	28.9	0	0	0	108.3
332	P	57.6	Low	56.7	Low	113 Å²	113	112.6 Å²	112.6	73%	0.734	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-53.2	139.8	170.1	23.5	-31.6	0	0	0	108.3
333	P	57.9	Low	55.9	Low	111 Å²	111	113 Å²	113	72%	0.721	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-54.6	141.4	174.1	23.9	-31.7	0	0	0	108.2	S335	P333-S335 PolarHBondContact O-N 3.37Å
334	P	57.4	Low	55.5	Low	125 Å²	125	115.9 Å²	115.9	81%	0.812	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-57.2	117.5	-179	16	-21.4	0	0	0	108.3	T336	P334-T336 PolarHBondContact O-N 2.89Å; P334-T336 VanDerWaalsContact O-N 3.13Å
335	S	51.7	Low	54.8	Low	112 Å²	112	118.1 Å²	118.1	78%	0.783	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-59.1	117.7	170.6	14.3	0	0	0	0	106.9	P333	P333-S335 PolarHBondContact O-N 3.37Å
336	T	52	Low	54.1	Low	131 Å²	131	117.9 Å²	117.9	80%	0.804	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-52.9	124.8	170.5	26.8	0	0	0	0	108.6	P334	P334-T336 PolarHBondContact O-N 2.89Å; P334-T336 VanDerWaalsContact O-N 3.13Å
337	P	58.9	Low	53.2	Low	112 Å²	112	118.8 Å²	118.8	73%	0.727	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-66.1	147.5	179.8	26.5	-31.6	0	0	0	110
338	P	57.5	Low	52.6	Low	121 Å²	121	121.2 Å²	121.2	79%	0.786	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64	139.8	-180	27.1	-32.3	0	0	0	110.1
339	S	47.4	Very low	52	Low	111 Å²	111	120.8 Å²	120.8	78%	0.776	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-48.6	130.6	174.2	26.7	0	0	0	0	111.8
340	P	58.7	Low	51.8	Low	118 Å²	118	121 Å²	121	77%	0.766	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-77.9	143.4	178	30.1	-32	0	0	0	111.2
341	P	58.2	Low	51.7	Low	116 Å²	116	120.2 Å²	120.2	75%	0.753	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-73.9	159.5	165.8	31.8	-31.4	0	0	0	110.8
342	P	55.3	Low	51	Low	132 Å²	132	120.6 Å²	120.6	86%	0.857	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-73.7	140.9	-167.1	23.1	-23.6	0	0	0	114.1
343	S	50.9	Low	50.4	Low	101 Å²	101	121 Å²	121	71%	0.706	77%	0.773	S	S	*	*			trans	-30.7	155.4	166.2	-109.3	0	0	0	0	116.7
344	P	51	Low	49.7	Very low	117 Å²	117	120.6 Å²	120.6	76%	0.76	77%	0.773	S	S	*	*				-145	132.4	71.1	30	-7.9	0	0	0	118.2
345	L	50.5	Low	48.9	Very low	153 Å²	153	122.7 Å²	122.7	80%	0.801	78%	0.777	S	S	*	*				63.7	151.7	126.1	-82.2	114.8	0	0	0	122.4
346	P	44.8	Very low	48.1	Very low	105 Å²	105	125.3 Å²	125.3	68%	0.682	78%	0.779	S	S	*	*				-135.3	177.1	-125.8	40.1	-20.7	0	0	0	114.9
347	T	39.7	Very low	47.5	Very low	143 Å²	143	125 Å²	125	88%	0.877	78%	0.779	S	S	*	*			trans	-167.1	107.9	159.1	14.4	0	0	0	0	106.8
348	L	44.6	Very low	46.4	Very low	158 Å²	158	125.1 Å²	125.1	83%	0.827	78%	0.778	S	S	*	*				86.6	96.7	58.3	-161	84.8	0	0	0	114.1
349	S	42.6	Very low	45.3	Very low	112 Å²	112	122.8 Å²	122.8	78%	0.783	78%	0.775	S	S	*	*			trans	163.8	98.4	150	51.1	0	0	0	0	108.1
350	T	46.9	Very low	44.9	Very low	119 Å²	119	128 Å²	128	73%	0.73	78%	0.78	S	S	*	*				65.1	149.5	55.2	-2.2	0	0	0	0	114.7
351	P	46	Very low	43.8	Very low	110 Å²	110	132.2 Å²	132.2	71%	0.714	79%	0.786	S	S	*	*				-133.7	-169.3	-89.5	44.5	-28.4	0	0	0	112.9
352	S	41.7	Very low	42.8	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	79%	0.79	S	S	*	*			trans	138.1	150.5	131.3	-99	0	0	0	0	116.7
353	P	45.7	Very low	41.8	Very low	120 Å²	120	135 Å²	135	78%	0.779	79%	0.793	S	S	*	*			trans	-118.6	169.3	-145	41.5	-29.5	0	0	0	114.3
354	S	41.7	Very low	41	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	80%	0.798	S	S	*	*			trans	-162.8	127.2	154.4	61.7	0	0	0	0	114.3
355	L	40.9	Very low	40.3	Very low	168 Å²	168	140.4 Å²	140.4	88%	0.88	80%	0.801	S	S	*	*			trans	80.2	104	140.2	-67.1	154.5	0	0	0	120.3
356	M	36.2	Very low	39.5	Very low	168 Å²	168	136.8 Å²	136.8	83%	0.828	79%	0.788	S	S	*	*			trans	-63	158.5	154.3	-68.6	-76.5	-140.5	0	0	111.1
357	P	39	Very low	39.1	Very low	123 Å²	123	139.4 Å²	139.4	80%	0.799	80%	0.797	S	S	*	*				-137.6	149.1	97.4	22.8	-2.8	0	0	0	115
358	T	35.2	Very low	39	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	79%	0.789	S	S	*	*			trans	-45.9	132.8	169.6	41.1	0	0	0	0	115.1	Y360	T358-Y360 HydrophobicContact CG2-CE2 4.32Å
359	G	33.9	Very low	38.7	Very low	72 Å²	72	136.3 Å²	136.3	74%	0.742	78%	0.782	S	S	*	*			trans	-153.8	79.4	165.8	0	0	0	0	0	110.6	K361	G359-K361 PolarHBondContact O-N 2.97Å; G359-K361 VanDerWaalsContact O-N 3.13Å
360	Y	39	Very low	38.9	Very low	221 Å²	221	137.1 Å²	137.1	87%	0.867	78%	0.778	S	S	*	*			trans	-70.8	100.8	169.6	-64.2	-84.1	0	0	0	108.5	T358	T358-Y360 HydrophobicContact CG2-CE2 4.32Å
361	K	36.8	Very low	39.2	Very low	207 Å²	207	139.7 Å²	139.7	90%	0.9	78%	0.781	S	S	*	*			trans	-97.2	119	159.3	-96.8	-172.3	174.1	-175.8	0	108.2	G359 M363	G359-K361 PolarHBondContact O-N 2.97Å; G359-K361 VanDerWaalsContact O-N 3.13Å; K361-M363 PolarHBondContact O-N 2.92Å
362	S	35.8	Very low	40.1	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	78%	0.784	S	S	*	*			trans	-42.9	127.2	172.8	-160.4	0	0	0	0	110.9	E364	S362-E364 PolarHBondContact O-N 2.83Å; S362-E364 VanDerWaalsContact O-N 3.15Å
363	M	34.5	Very low	41.7	Very low	186 Å²	186	137.6 Å²	137.6	92%	0.916	76%	0.758	S	S	*	*			trans	-64.9	110.6	171.6	-123.8	169.8	178.2	0	0	107.8	K361 L365	K361-M363 PolarHBondContact O-N 2.92Å; M363-L365 PolarHBondContact O-N 3.11Å
364	E	33.7	Very low	43.6	Very low	174 Å²	174	139 Å²	139	81%	0.813	75%	0.747	S	S	*	*			trans	-57.4	97.6	163.4	-168.2	170.1	149.9	0	0	108.1	S362 S366	S362-E364 PolarHBondContact O-N 2.83Å; S362-E364 VanDerWaalsContact O-N 3.15Å; E364-S366 PolarHBondContact O-N 3.32Å
365	L	36.7	Very low	45.7	Very low	159 Å²	159	136.4 Å²	136.4	83%	0.832	73%	0.725	S	S	*	*			trans	-80.6	76.1	162.9	-170.5	68.6	0	0	0	107	M363	M363-L365 PolarHBondContact O-N 3.11Å
366	S	35.3	Very low	48.1	Very low	76 Å²	76	132.3 Å²	132.3	53%	0.531	70%	0.704	S	S	.	*			trans	-55.1	127.2	163.5	41.6	0	0	0	0	110.4	E364	E364-S366 PolarHBondContact O-N 3.32Å
367	D	35	Very low	50.8	Low	161 Å²	161	125.8 Å²	125.8	86%	0.861	67%	0.67	S	S	*	*			trans	52.7	74.4	131.9	-121.5	-6.9	0	0	0	116.4
368	I	37.4	Very low	53.6	Low	139 Å²	139	123.8 Å²	123.8	71%	0.713	65%	0.647	S	S	*	*			trans	-101.2	103	152.2	-59.5	175.8	0	0	0	106.1	N370	I368-N370 PolarHBondContact O-N 3.4Å
369	S	38.9	Very low	56.5	Low	97 Å²	97	118.3 Å²	118.3	68%	0.678	61%	0.613	S	S	*	*			trans	-44.1	105	170.9	54.3	0	0	0	0	110.7	E371	S369-E371 PolarHBondContact O-N 3.32Å
370	N	45.9	Very low	59.5	Low	129 Å²	129	120.2 Å²	120.2	69%	0.69	60%	0.599	S	S	*	*			trans	-81.5	30.7	-174.1	-146.4	6.9	0	0	0	112.2	I368	I368-N370 PolarHBondContact O-N 3.4Å
371	E	54.5	Low	62.3	Low	173 Å²	173	111.6 Å²	111.6	81%	0.808	57%	0.566	S	S	*	*			trans	-94.1	-8.3	-163.5	-73.1	-134.6	145	0	0	116.1	S369	S369-E371 PolarHBondContact O-N 3.32Å
372	N	63.9	Low	65.2	Low	145 Å²	145	111 Å²	111	78%	0.775	56%	0.558	S	S	*	*			trans	-133.2	19.7	-168.3	-82.8	57.7	0	0	0	117	R374	N372-R374 PolarHBondContact O-N 3.34Å
373	C	76.9	Confident	68.1	Low	34 Å²	34	105.8 Å²	105.8	23%	0.23	52%	0.522	C	S	.	.			trans	-66.4	123.3	173.2	-132	0	0	0	0	110.9	G321 C323	G321-C373 PolarHBondContact N-O 2.99Å; G321-C373 VanDerWaalsContact N-O 3.17Å; G321-C373 VanDerWaalsContact O-CB 3.22Å; G321-C373 WeakPolarHBondContact O-CB 3.29Å; C323-C373 WeakPolarHBondContact CA-SG 3.46Å; C323-C373 HydrophobicContact CB-CB 4.04Å; C323-C373 WeakPolarHBondContact CB-SG 3.44Å; C323-C373 WeakPolarHBondContact SG-CB 3.29Å; C323-C373 CovalentContact SG-SG 2.04Å; C323-C373 PolarHBondContact SG-SG 2.91Å
374	R	84.7	Confident	71	Confident	148 Å²	148	100.2 Å²	100.2	56%	0.558	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.7	170.1	-55.2	-168.9	80.9	99.3	1.4	109.2	A318 V319 N372	A318-R374 HydrophobicContact CB-CB 4.28Å; A318-R374 PolarHBondContact O-NE 2.98Å; A318-R374 PolarHBondContact O-NH2 3.4Å; V319-R374 CarbonylContact O-C 3.5Å; V319-R374 WeakPolarHBondContact O-CA 3.45Å; N372-R374 PolarHBondContact O-N 3.34Å
375	I	86.1	Confident	74	Confident	50 Å²	50	91.9 Å²	91.9	26%	0.256	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.5	176.1	-56.6	179.8	0	0	0	107.9	A318 V319	A318-I375 WeakPolarHBondContact CA-O 3.45Å; V319-I375 HydrophobicContact CG2-CB 4.3Å; V319-I375 PolarHBondContact N-O 3.13Å; V319-I375 PolarHBondContact O-N 2.98Å
376	N	90.9	Very high	76.9	Confident	83 Å²	83	86.6 Å²	86.6	44%	0.444	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	126	172.9	-68.7	-44.4	0	0	0	109.8	T317 Y378	T317-N376 WeakPolarHBondContact O-CA 3.48Å; N376-Y378 HydrophobicContact CB-CE2 3.7Å
377	R	93	Very high	79.9	Confident	31 Å²	31	83 Å²	83	12%	0.117	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.8	172.6	-65.3	-69.1	-172.4	-170	-0.2	109.1	V90 D234 I236 Q316 T317 V319	V90-R377 PolarHBondContact O-NH2 3.49Å; D234-R377 VanDerWaalsContact CB-NH1 3.33Å; D234-R377 WeakPolarHBondContact O-CD 3.34Å; D234-R377 PolarHBondContact O-NH1 3.25Å; I236-R377 HydrophobicContact CD1-CB 4.05Å; I236-R377 HydrophobicContact CG1-CB 4Å; Q316-R377 WeakPolarHBondContact CA-O 3.43Å; T317-R377 HydrophobicContact CG2-CB 4Å; T317-R377 PolarHBondContact N-O 3.43Å; T317-R377 PolarHBondContact O-N 3.08Å; V319-R377 HydrophobicContact CG1-CG 4.34Å; V319-R377 HydrophobicContact CG2-CG 3.67Å
378	Y	96.5	Very high	82.8	Confident	80 Å²	80	77.5 Å²	77.5	31%	0.314	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.3	-177.5	-60.5	-87.6	0	0	0	110.4	Q235 I236 T314 V315 Q316 N376 Y380	Q235-Y378 CarbonylContact C-O 3.56Å; Q235-Y378 WeakPolarHBondContact CA-O 3.34Å; I236-Y378 PolarHBondContact N-O 3.14Å; T314-Y378 HydrophobicContact CG2-CD1 4.26Å; V315-Y378 CarbonylContact O-C 3.54Å; V315-Y378 VanDerWaalsContact O-CA 3.25Å; V315-Y378 WeakPolarHBondContact O-CA 3.37Å; Q316-Y378 HydrophobicContact CB-CD1 4.05Å; Q316-Y378 HydrophobicContact CB-CE1 4.05Å; Q316-Y378 HydrophobicContact CG-CD1 4Å; Q316-Y378 HydrophobicContact CG-CE1 3.56Å; Q316-Y378 PolarHBondContact NE2-OH 2.77Å; N376-Y378 HydrophobicContact CB-CE2 3.7Å; Y378-Y380 WeakPolarHBondContact CB-OH 3.45Å
379	G	97.4	Very high	85.5	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.9	168.4	0	0	0	0	0	109.6	I236 T314 V315	I236-G379 VanDerWaalsContact O-CA 3.26Å; I236-G379 WeakPolarHBondContact O-CA 3.29Å; T314-G379 CarbonylContact C-O 3.55Å; T314-G379 WeakPolarHBondContact CA-O 3.47Å; V315-G379 PolarHBondContact N-O 3.43Å; V315-G379 PolarHBondContact O-N 2.82Å
380	Y	97.5	Very high	88.1	Confident	112 Å²	112	71 Å²	71	44%	0.439	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.5	-176.5	-53	-81.1	0	0	0	110.1	L313 T314 Y378	L313-Y380 WeakPolarHBondContact O-CA 3.15Å; T314-Y380 HydrophobicContact CG2-CD1 4.05Å; T314-Y380 HydrophobicContact CG2-CE1 3.7Å; Y378-Y380 WeakPolarHBondContact CB-OH 3.45Å
381	F	97.6	Very high	90.4	Very high	40 Å²	40	64.8 Å²	64.8	18%	0.175	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.6	170.2	176.4	-89.9	0	0	0	108.7	V238 V240 L311 L313 A383	V238-F381 HydrophobicContact CG1-CB 4.17Å; V240-F381 HydrophobicContact CB-CD1 3.89Å; V240-F381 HydrophobicContact CB-CD2 4.31Å; V240-F381 HydrophobicContact CB-CE1 3.69Å; V240-F381 HydrophobicContact CB-CE2 4.13Å; V240-F381 HydrophobicContact CB-CG 4.2Å; V240-F381 HydrophobicContact CB-CZ 3.82Å; V240-F381 HydrophobicContact CG1-CE1 4.44Å; V240-F381 HydrophobicContact CG2-CB 4.04Å; V240-F381 HydrophobicContact CG2-CD1 3.49Å; V240-F381 VanDerWaalsContact CG2-CD1 3.49Å; V240-F381 HydrophobicContact CG2-CD2 3.97Å; V240-F381 HydrophobicContact CG2-CE1 3.86Å; V240-F381 HydrophobicContact CG2-CE2 4.31Å; V240-F381 HydrophobicContact CG2-CG 3.55Å; V240-F381 HydrophobicContact CG2-CZ 4.26Å; L311-F381 HydrophobicContact CD2-CD1 4.5Å; L311-F381 HydrophobicContact CD2-CE1 4.21Å; L313-F381 HydrophobicContact CB-CB 4.18Å; L313-F381 HydrophobicContact CD2-CB 4.25Å; L313-F381 PolarHBondContact N-O 3.14Å; L313-F381 PolarHBondContact O-N 3.5Å; F381-A383 HydrophobicContact CE1-CB 3.71Å; F381-A383 HydrophobicContact CZ-CB 4.01Å
382	R	97.1	Very high	92.2	Very high	196 Å²	196	59.6 Å²	59.6	74%	0.74	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.5	178.1	-55.6	-169.1	179.6	-173.6	-1.5	109.3	L311 N312	L311-R382 VanDerWaalsContact O-CA 3.28Å; L311-R382 WeakPolarHBondContact O-CA 3.44Å; N312-R382 VanDerWaalsContact OD1-CD 3.29Å; N312-R382 WeakPolarHBondContact OD1-CD 3.45Å; N312-R382 VanDerWaalsContact OD1-CG 3.27Å; N312-R382 WeakPolarHBondContact OD1-CG 3.5Å; N312-R382 PolarHBondContact OD1-NE 3.19Å
383	A	95.9	Very high	93.6	Very high	8 Å²	8	56.9 Å²	56.9	7%	0.066	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.7	175.8	0	0	0	0	0	110.4	M242 L311 F381 I385	M242-A383 HydrophobicContact CE-CB 4.4Å; L311-A383 HydrophobicContact CB-CB 4.44Å; L311-A383 HydrophobicContact CD2-CB 4.47Å; L311-A383 PolarHBondContact N-O 3.37Å; L311-A383 PolarHBondContact O-N 3.37Å; L311-A383 VanDerWaalsContact O-N 3.15Å; F381-A383 HydrophobicContact CE1-CB 3.71Å; F381-A383 HydrophobicContact CZ-CB 4.01Å; A383-I385 HydrophobicContact CB-CG1 4.48Å
384	T	97	Very high	94.4	Very high	69 Å²	69	55.6 Å²	55.6	42%	0.423	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	103.4	178.5	-59.1	0	0	0	0	108.3	T308	T308-T384 HydrophobicContact CG2-CG2 3.3Å
385	I	96.2	Very high	94.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.2	-171.2	-57.7	-176.4	0	0	0	109	M242 F255 I261 F263 Y303 T308 F309 L311 A383 I387	M242-I385 HydrophobicContact SD-CD1 3.95Å; M242-I385 HydrophobicContact SD-CG1 4.47Å; F255-I385 HydrophobicContact CD2-CG2 3.44Å; F255-I385 VanDerWaalsContact CD2-CG2 3.44Å; F255-I385 HydrophobicContact CE2-CG2 3.94Å; F255-I385 HydrophobicContact CG-CG2 4.42Å; I261-I385 HydrophobicContact CD1-CG2 4.48Å; F263-I385 HydrophobicContact CE1-CD1 3.82Å; F263-I385 HydrophobicContact CZ-CD1 4.11Å; Y303-I385 HydrophobicContact CE2-CG2 4.48Å; T308-I385 CarbonylContact C-O 3.6Å; T308-I385 WeakPolarHBondContact CA-O 3.45Å; F309-I385 PolarHBondContact N-O 2.87Å; F309-I385 PolarHBondContact O-N 3Å; L311-I385 HydrophobicContact CB-CD1 3.9Å; L311-I385 HydrophobicContact CB-CG1 4.37Å; L311-I385 HydrophobicContact CD2-CD1 3.9Å; L311-I385 HydrophobicContact CG-CD1 4.47Å; A383-I385 HydrophobicContact CB-CG1 4.48Å; I385-I387 HydrophobicContact CG2-CD1 3.67Å; I385-I387 HydrophobicContact CG2-CG1 4.44Å
386	T	97.6	Very high	95.1	Very high	47 Å²	47	50.1 Å²	50.1	29%	0.288	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.1	175.5	-59.5	0	0	0	0	110.3	E253 I254 F255 V388	E253-T386 PolarHBondContact O-N 2.93Å; I254-T386 CarbonylContact C-O 3.6Å; I254-T386 WeakPolarHBondContact CA-O 3.47Å; F255-T386 PolarHBondContact N-O 2.93Å; T386-V388 HydrophobicContact CG2-CG1 4.22Å
387	I	97.3	Very high	95.1	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.8	-178.6	-52.2	-61.4	0	0	0	109.8	F255 R257 I261 Y303 L305 N306 G307 F309 I385	F255-I387 HydrophobicContact CB-CD1 3.84Å; F255-I387 CarbonylContact O-C 3.57Å; F255-I387 VanDerWaalsContact O-CA 3.29Å; F255-I387 WeakPolarHBondContact O-CA 3.5Å; R257-I387 HydrophobicContact CB-CG2 3.89Å; R257-I387 HydrophobicContact CG-CG2 4.35Å; I261-I387 HydrophobicContact CD1-CD1 4.06Å; Y303-I387 HydrophobicContact CD1-CG1 4.08Å; Y303-I387 HydrophobicContact CD2-CD1 3.49Å; Y303-I387 VanDerWaalsContact CD2-CD1 3.49Å; Y303-I387 HydrophobicContact CD2-CG1 3.96Å; Y303-I387 HydrophobicContact CE2-CD1 4.11Å; Y303-I387 HydrophobicContact CG-CD1 3.72Å; Y303-I387 HydrophobicContact CG-CG1 3.64Å; L305-I387 WeakPolarHBondContact O-CG2 3.15Å; N306-I387 WeakPolarHBondContact CA-O 3.36Å; G307-I387 PolarHBondContact N-O 2.93Å; G307-I387 PolarHBondContact O-N 2.75Å; F309-I387 HydrophobicContact CD2-CB 4.37Å; F309-I387 HydrophobicContact CD2-CG1 3.61Å; F309-I387 HydrophobicContact CE2-CB 4Å; F309-I387 HydrophobicContact CE2-CG1 3.66Å; I385-I387 HydrophobicContact CG2-CD1 3.67Å; I385-I387 HydrophobicContact CG2-CG1 4.44Å
388	V	96.4	Very high	95	Very high	44 Å²	44	56.1 Å²	56.1	27%	0.267	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	162.1	-179.5	-60.4	0	0	0	0	110.9	I254 F255 L256 R257 T386 A478	I254-V388 HydrophobicContact CG2-CG1 4.13Å; I254-V388 HydrophobicContact CG2-CG2 3.66Å; F255-V388 PolarHBondContact O-N 2.65Å; L256-V388 CarbonylContact C-O 3.58Å; L256-V388 WeakPolarHBondContact CA-O 3.5Å; L256-V388 HydrophobicContact CD2-CG2 4.09Å; R257-V388 PolarHBondContact N-O 2.64Å; T386-V388 HydrophobicContact CG2-CG1 4.22Å; V388-A478 HydrophobicContact CG2-CB 3.8Å
389	E	95	Very high	94.7	Very high	96 Å²	96	55.3 Å²	55.3	45%	0.449	27%	0.269	S	S	.	.			trans	-71.7	140.8	167.1	-57.5	-169.1	151.9	0	0	109.3	R257 N306	R257-E389 IonicContact CZ-OE1 3.62Å; R257-E389 IonicContact NH1-OE1 2.69Å; R257-E389 PolarHBondContact NH1-OE1 3.14Å; R257-E389 IonicContact NH2-OE1 2.84Å; R257-E389 PolarHBondContact NH2-OE1 3.16Å; N306-E389 VanDerWaalsContact ND2-CG 3.32Å; N306-E389 WeakPolarHBondContact ND2-CG 3.45Å
390	G	93.4	Very high	94.3	Very high	3 Å²	3	57 Å²	57	3%	0.031	28%	0.283	C	S	.	.			trans	-135.8	175.1	177.7	0	0	0	0	0	112.8	L392 G422 A423	G390-L392 PolarHBondContact O-N 2.77Å; G390-G422 WeakPolarHBondContact O-CA 3.25Å; G390-A423 PolarHBondContact O-N 2.92Å
391	I	94	Very high	93.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	115.3	174	-52.4	158	0	0	0	108.2	N246 V394 C420 A423 P425 L474 S479 A481	N246-I391 PolarHBondContact ND2-O 3.15Å; I391-V394 HydrophobicContact CG2-CG2 3.88Å; I391-C420 HydrophobicContact CG2-CB 4.18Å; I391-A423 HydrophobicContact CG1-CB 4.43Å; I391-P425 HydrophobicContact CD1-CB 3.78Å; I391-L474 HydrophobicContact CD1-CB 4.37Å; I391-S479 WeakPolarHBondContact CG1-OG 3.25Å; I391-S479 PolarHBondContact N-OG 2.89Å; I391-A481 HydrophobicContact CB-CB 4.13Å; I391-A481 HydrophobicContact CG2-CB 3.6Å
392	L	92.7	Very high	92.8	Very high	63 Å²	63	56 Å²	56	33%	0.33	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-43.3	-174.2	-59.5	179.2	0	0	0	112.2	N246 L259 G390 K421	N246-L392 PolarHBondContact ND2-O 2.99Å; L259-L392 HydrophobicContact CD1-CD2 3.74Å; L259-L392 HydrophobicContact CD2-CD2 4.15Å; L259-L392 HydrophobicContact CG-CD2 3.73Å; G390-L392 PolarHBondContact O-N 2.77Å; L392-K421 PolarHBondContact N-O 3.04Å
393	E	92.6	Very high	91.6	Very high	88 Å²	88	52.7 Å²	52.7	41%	0.411	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145.9	-174.5	-170.3	-179.3	-175.8	0	0	110.1	C420 K421	E393-C420 CarbonylContact O-C 3.58Å; E393-C420 VanDerWaalsContact O-CA 3.22Å; E393-C420 WeakPolarHBondContact O-CA 2.95Å; E393-K421 HydrophobicContact CB-CB 4.25Å; E393-K421 HydrophobicContact CB-CD 4.34Å; E393-K421 HydrophobicContact CB-CG 4.48Å; E393-K421 PolarHBondContact O-N 3.02Å; E393-K421 WeakPolarHBondContact OE2-CD 3.46Å; E393-K421 WeakPolarHBondContact OE2-CE 3.33Å; E393-K421 IonicContact OE2-NZ 2.71Å; E393-K421 PolarHBondContact OE2-NZ 2.74Å
394	V	93.3	Very high	90.1	Very high	8 Å²	8	55.7 Å²	55.7	5%	0.048	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.7	175.2	-177.4	0	0	0	0	108.6	I391 V418 T419 C420 L474 A481 T483	I391-V394 HydrophobicContact CG2-CG2 3.88Å; V394-V418 HydrophobicContact CG1-CG1 3.36Å; V394-T419 WeakPolarHBondContact CA-O 3.4Å; V394-C420 HydrophobicContact CG2-CB 4.29Å; V394-L474 HydrophobicContact CB-CD1 4.35Å; V394-L474 HydrophobicContact CG1-CD1 3.53Å; V394-L474 HydrophobicContact CG1-CG 3.82Å; V394-L474 HydrophobicContact CG2-CB 3.98Å; V394-L474 HydrophobicContact CG2-CD1 3.81Å; V394-L474 HydrophobicContact CG2-CG 3.98Å; V394-A481 HydrophobicContact CG2-CB 3.51Å; V394-T483 HydrophobicContact CB-CG2 4.19Å; V394-T483 HydrophobicContact CG1-CG2 3.62Å; V394-T483 WeakPolarHBondContact O-CB 3.43Å; V394-T483 PolarHBondContact O-OG1 3.19Å
395	S	93.6	Very high	88.4	Confident	43 Å²	43	57.5 Å²	57.5	30%	0.301	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.2	-179.4	-68.6	0	0	0	0	111	V418 T419	S395-V418 CarbonylContact O-C 3.53Å; S395-V418 WeakPolarHBondContact O-CA 3.46Å; S395-V418 WeakPolarHBondContact O-CG1 3.27Å; S395-T419 PolarHBondContact N-O 2.97Å; S395-T419 PolarHBondContact O-N 2.89Å
396	I	92.9	Very high	86.6	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.205	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	117.1	174.3	-55.9	167.8	0	0	0	107.3	I399 F472 T483 T485	I396-I399 HydrophobicContact CG2-CG1 4.06Å; I396-F472 HydrophobicContact CD1-CD2 3.75Å; I396-F472 HydrophobicContact CD1-CE2 4.15Å; I396-F472 HydrophobicContact CG1-CD2 4.19Å; I396-T483 HydrophobicContact CD1-CG2 4.07Å; I396-T483 HydrophobicContact CG1-CG2 3.73Å; I396-T485 HydrophobicContact CD1-CG2 3.42Å; I396-T485 VanDerWaalsContact CD1-CG2 3.42Å
397	M	90.6	Very high	84.7	Confident	119 Å²	119	66.9 Å²	66.9	59%	0.586	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	-44.5	-179.5	-67.8	-171.6	63.6	0	0	112.4	T417 T419 L455	M397-T417 HydrophobicContact CB-CG2 4.34Å; M397-T417 PolarHBondContact N-O 2.9Å; M397-T419 HydrophobicContact CG-CG2 3.56Å; M397-T419 HydrophobicContact SD-CG2 3.81Å; M397-L455 HydrophobicContact SD-CD2 3.42Å; M397-L455 WeakPolarHBondContact SD-CD2 3.41Å
398	Q	90.5	Very high	82.8	Confident	121 Å²	121	72.6 Å²	72.6	57%	0.565	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.9	148.3	-174	-172.2	172.6	-11.1	0	0	111.1	T417	Q398-T417 PolarHBondContact N-O 3.47Å; Q398-T417 PolarHBondContact O-N 3.04Å
399	I	91.1	Very high	81.1	Confident	62 Å²	62	73.7 Å²	73.7	32%	0.318	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126	170.8	-53.2	176.7	0	0	0	105.8	I396 D415 F416 T485 I487	I396-I399 HydrophobicContact CG2-CG1 4.06Å; I399-D415 WeakPolarHBondContact CA-O 3.46Å; I399-F416 HydrophobicContact CD1-CD1 4.22Å; I399-F416 HydrophobicContact CD1-CE1 3.97Å; I399-F416 HydrophobicContact CG1-CD1 3.81Å; I399-F416 HydrophobicContact CG1-CE1 3.99Å; I399-F416 HydrophobicContact CG2-CD1 4.21Å; I399-F416 HydrophobicContact CG2-CE1 3.94Å; I399-F416 HydrophobicContact CG2-CZ 4.36Å; I399-T485 HydrophobicContact CD1-CG2 4.07Å; I399-I487 HydrophobicContact CG2-CD1 3.52Å; I399-I487 HydrophobicContact CG2-CG1 4.39Å
400	A	88.9	Confident	79.5	Confident	36 Å²	36	73.7 Å²	73.7	30%	0.298	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.6	-178.3	0	0	0	0	0	111.2	D415	A400-D415 PolarHBondContact N-O 2.95Å; A400-D415 PolarHBondContact O-N 2.84Å
401	D	83.5	Confident	78.5	Confident	107 Å²	107	76.5 Å²	76.5	57%	0.572	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	134.6	172.1	-60.8	-4	0	0	0	109.2	P403 M414	D401-P403 VanDerWaalsContact O-CD 3.3Å; D401-P403 WeakPolarHBondContact O-CD 3.49Å; D401-M414 HydrophobicContact CB-SD 4.13Å; D401-M414 WeakPolarHBondContact OD1-CE 3.47Å
402	V	80.6	Confident	77.9	Confident	25 Å²	25	78.7 Å²	78.7	15%	0.152	46%	0.459	C	S	.	.			trans	-88.4	113.6	175.7	-175.7	0	0	0	0	108.9	M404 L413 D415	V402-M404 HydrophobicContact CG1-SD 4.06Å; V402-M404 PolarHBondContact O-N 2.73Å; V402-M404 VanDerWaalsContact O-N 3.08Å; V402-L413 HydrophobicContact CB-CB 4.04Å; V402-L413 HydrophobicContact CG2-CB 4.28Å; V402-L413 PolarHBondContact N-O 2.91Å; V402-D415 HydrophobicContact CG2-CB 4Å; V402-D415 WeakPolarHBondContact CG2-OD1 3.07Å; V402-D415 WeakPolarHBondContact CG2-OD2 3.32Å
403	P	70.5	Confident	77.6	Confident	125 Å²	125	77.5 Å²	77.5	81%	0.812	45%	0.453	S	S	*	.			trans	-65.4	113.7	176	-16.3	30.7	0	0	0	109.2	D401	D401-P403 VanDerWaalsContact O-CD 3.3Å; D401-P403 WeakPolarHBondContact O-CD 3.49Å
404	M	64.3	Low	77.5	Confident	71 Å²	71	73.5 Å²	73.5	35%	0.35	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-100	136.9	177	-68	-60.8	-72.9	0	0	110.5	V402 T406 L413	V402-M404 HydrophobicContact CG1-SD 4.06Å; V402-M404 PolarHBondContact O-N 2.73Å; V402-M404 VanDerWaalsContact O-N 3.08Å; M404-T406 PolarHBondContact O-N 2.93Å; M404-L413 HydrophobicContact CE-CD1 3.91Å; M404-L413 HydrophobicContact CG-CD1 4.01Å; M404-L413 HydrophobicContact SD-CD1 3.69Å
405	P	62.1	Low	77.4	Confident	107 Å²	107	74.8 Å²	74.8	70%	0.695	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-59.3	134.3	173.1	-15.8	27.2	0	0	0	110.3
406	T	58.6	Low	77.3	Confident	121 Å²	121	72.8 Å²	72.8	74%	0.742	43%	0.427	S	S	*	.	S	Bend	trans	-64.4	139	172.1	40.3	0	0	0	0	111	M404	M404-T406 PolarHBondContact O-N 2.93Å
407	P	57.3	Low	77.3	Confident	124 Å²	124	72.5 Å²	72.5	81%	0.805	43%	0.427	S	S	*	.	S	Bend	cis	-78.3	125.6	9.9	29.7	-31.5	0	0	0	112.8
408	Q	57.2	Low	77.4	Confident	121 Å²	121	66.9 Å²	66.9	57%	0.565	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-60	127.1	179.2	-93.6	167.8	-21.2	0	0	110.3
409	P	59.9	Low	77.5	Confident	68 Å²	68	63 Å²	63	44%	0.442	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-60.9	161	172.7	24.5	-31.1	0	0	0	110.9	N411	P409-N411 PolarHBondContact O-N 2.8Å
410	A	61.7	Low	77.5	Confident	96 Å²	96	60.6 Å²	60.6	79%	0.793	37%	0.373	S	S	*	.	S	Bend	trans	-58.5	-19.7	-178.6	0	0	0	0	0	114
411	N	73.1	Confident	77.7	Confident	61 Å²	61	64.9 Å²	64.9	33%	0.326	38%	0.384	S	S	.	.	S	Bend	trans	-107.9	132.1	-175.8	-64.1	-2.9	0	0	0	111.3	P409 A461 F462 N463	P409-N411 PolarHBondContact O-N 2.8Å; N411-A461 HydrophobicContact CB-CB 4.18Å; N411-F462 CarbonylContact C-O 3.6Å; N411-F462 WeakPolarHBondContact CA-O 3.21Å; N411-F462 WeakPolarHBondContact CB-O 3.45Å; N411-N463 PolarHBondContact ND2-OD1 2.83Å
412	S	80.8	Confident	78	Confident	46 Å²	46	62.3 Å²	62.3	32%	0.322	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	131.3	171.3	-63.5	0	0	0	0	110.1	A461 F462	S412-A461 CarbonylContact O-C 3.48Å; S412-A461 WeakPolarHBondContact O-CA 3.24Å; S412-F462 PolarHBondContact N-O 2.95Å; S412-F462 VanDerWaalsContact N-O 3.11Å; S412-F462 PolarHBondContact O-N 2.91Å
413	L	87.4	Confident	78.5	Confident	38 Å²	38	61.9 Å²	61.9	20%	0.199	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.7	178.6	-71.3	172	0	0	0	110.5	V402 M404 R459 R460 A461	V402-L413 HydrophobicContact CB-CB 4.04Å; V402-L413 HydrophobicContact CG2-CB 4.28Å; V402-L413 PolarHBondContact N-O 2.91Å; M404-L413 HydrophobicContact CE-CD1 3.91Å; M404-L413 HydrophobicContact CG-CD1 4.01Å; M404-L413 HydrophobicContact SD-CD1 3.69Å; L413-R459 HydrophobicContact CD2-CG 4.24Å; L413-R460 WeakPolarHBondContact CA-O 3.28Å; L413-A461 HydrophobicContact CD2-CB 3.7Å
414	M	89.5	Confident	79.4	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.025	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.7	176.1	-55.2	-55	-166.8	0	0	110	D401 F416 R459 R460 F462 I487 I489	D401-M414 HydrophobicContact CB-SD 4.13Å; D401-M414 WeakPolarHBondContact OD1-CE 3.47Å; M414-F416 HydrophobicContact CB-CD2 4.39Å; M414-F416 HydrophobicContact CB-CE2 3.72Å; M414-F416 HydrophobicContact CB-CZ 4.18Å; M414-R459 WeakPolarHBondContact O-CA 3.34Å; M414-R460 PolarHBondContact N-O 3Å; M414-R460 PolarHBondContact O-N 2.8Å; M414-F462 HydrophobicContact CB-CD2 4.43Å; M414-F462 HydrophobicContact CB-CE2 3.91Å; M414-F462 HydrophobicContact CG-CD2 3.86Å; M414-F462 HydrophobicContact CG-CE2 3.7Å; M414-I487 HydrophobicContact CB-CD1 4.26Å; M414-I487 HydrophobicContact CG-CD1 3.84Å; M414-I489 HydrophobicContact CE-CD1 3.36Å; M414-I489 HydrophobicContact CE-CG2 4.34Å; M414-I489 HydrophobicContact CG-CD1 3.77Å; M414-I489 HydrophobicContact SD-CD1 4.37Å
415	D	90.9	Very high	80.8	Confident	35 Å²	35	56 Å²	56	19%	0.187	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124.3	171.8	-79.1	-9.9	0	0	0	109.3	I399 A400 V402 R459	I399-D415 WeakPolarHBondContact CA-O 3.46Å; A400-D415 PolarHBondContact N-O 2.95Å; A400-D415 PolarHBondContact O-N 2.84Å; V402-D415 HydrophobicContact CG2-CB 4Å; V402-D415 WeakPolarHBondContact CG2-OD1 3.07Å; V402-D415 WeakPolarHBondContact CG2-OD2 3.32Å; D415-R459 WeakPolarHBondContact OD1-CA 3.38Å; D415-R459 WeakPolarHBondContact OD1-CB 3.33Å; D415-R459 WeakPolarHBondContact OD1-CG 3.13Å; D415-R459 IonicContact OD1-CZ 3.7Å; D415-R459 IonicContact OD1-NE 3.61Å; D415-R459 PolarHBondContact OD1-NE 2.85Å; D415-R459 IonicContact OD1-NH2 3.33Å; D415-R459 IonicContact OD2-CZ 2.8Å; D415-R459 IonicContact OD2-NE 3.91Å; D415-R459 IonicContact OD2-NH2 3.97Å; D415-R459 PolarHBondContact OD2-NH2 2.85Å
416	F	92.8	Very high	82.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.5	176.4	-63.8	-99.3	0	0	0	109.2	I399 M414 V418 S457 V458 R460 F462 V470 F472 T485 I487	I399-F416 HydrophobicContact CD1-CD1 4.22Å; I399-F416 HydrophobicContact CD1-CE1 3.97Å; I399-F416 HydrophobicContact CG1-CD1 3.81Å; I399-F416 HydrophobicContact CG1-CE1 3.99Å; I399-F416 HydrophobicContact CG2-CD1 4.21Å; I399-F416 HydrophobicContact CG2-CE1 3.94Å; I399-F416 HydrophobicContact CG2-CZ 4.36Å; M414-F416 HydrophobicContact CB-CD2 4.39Å; M414-F416 HydrophobicContact CB-CE2 3.72Å; M414-F416 HydrophobicContact CB-CZ 4.18Å; F416-V418 HydrophobicContact CB-CG2 4.34Å; F416-S457 CarbonylContact O-C 3.53Å; F416-S457 WeakPolarHBondContact O-CA 3.33Å; F416-V458 PolarHBondContact N-O 3.13Å; F416-V458 PolarHBondContact O-N 3.36Å; F416-R460 HydrophobicContact CD2-CG 4.41Å; F416-R460 HydrophobicContact CE2-CB 4.15Å; F416-R460 HydrophobicContact CE2-CG 4.4Å; F416-F462 HydrophobicContact CE2-CE2 4.06Å; F416-F462 HydrophobicContact CE2-CZ 4.18Å; F416-F462 HydrophobicContact CZ-CE2 4.15Å; F416-F462 AromaticContact CZ-CZ 3.92Å; F416-F462 HydrophobicContact CZ-CZ 3.92Å; F416-V470 HydrophobicContact CE1-CG1 4.45Å; F416-V470 HydrophobicContact CZ-CG1 4.34Å; F416-V470 HydrophobicContact CZ-CG2 4.31Å; F416-F472 HydrophobicContact CB-CE1 4.13Å; F416-F472 HydrophobicContact CB-CE2 4.09Å; F416-F472 HydrophobicContact CB-CZ 3.49Å; F416-F472 VanDerWaalsContact CB-CZ 3.49Å; F416-F472 AromaticContact CD1-CE2 3.54Å; F416-F472 HydrophobicContact CD1-CE2 3.54Å; F416-F472 AromaticContact CD1-CZ 3.64Å; F416-F472 HydrophobicContact CD1-CZ 3.64Å; F416-F472 HydrophobicContact CD2-CE2 4.36Å; F416-F472 AromaticContact CD2-CZ 3.66Å; F416-F472 HydrophobicContact CD2-CZ 3.66Å; F416-F472 AromaticContact CE1-CE2 4Å; F416-F472 HydrophobicContact CE1-CE2 4Å; F416-F472 HydrophobicContact CE1-CZ 4.24Å; F416-F472 HydrophobicContact CE2-CZ 4.25Å; F416-F472 HydrophobicContact CG-CE1 4.35Å; F416-F472 AromaticContact CG-CE2 3.76Å; F416-F472 HydrophobicContact CG-CE2 3.76Å; F416-F472 AromaticContact CG-CZ 3.31Å; F416-F472 HydrophobicContact CG-CZ 3.31Å; F416-T485 HydrophobicContact CE1-CG2 4.49Å; F416-I487 HydrophobicContact CE1-CD1 4.11Å; F416-I487 HydrophobicContact CZ-CD1 3.73Å
417	T	92	Very high	83.9	Confident	35 Å²	35	53.2 Å²	53.2	22%	0.215	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	110.6	170.5	-54	0	0	0	0	108.5	M397 Q398 L456	M397-T417 HydrophobicContact CB-CG2 4.34Å; M397-T417 PolarHBondContact N-O 2.9Å; Q398-T417 PolarHBondContact N-O 3.47Å; Q398-T417 PolarHBondContact O-N 3.04Å; T417-L456 CarbonylContact C-O 3.56Å; T417-L456 VanDerWaalsContact CA-O 3.32Å; T417-L456 WeakPolarHBondContact CA-O 3.4Å
418	V	92.4	Very high	85.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.5	-179.1	-171.3	0	0	0	0	108.8	V394 S395 F416 L456 F472 L474	V394-V418 HydrophobicContact CG1-CG1 3.36Å; S395-V418 CarbonylContact O-C 3.53Å; S395-V418 WeakPolarHBondContact O-CA 3.46Å; S395-V418 WeakPolarHBondContact O-CG1 3.27Å; F416-V418 HydrophobicContact CB-CG2 4.34Å; V418-L456 PolarHBondContact N-O 2.89Å; V418-L456 PolarHBondContact O-N 2.96Å; V418-F472 HydrophobicContact CG2-CD1 3.93Å; V418-F472 HydrophobicContact CG2-CE1 4.14Å; V418-F472 HydrophobicContact CG2-CG 4.17Å; V418-L474 HydrophobicContact CG1-CD1 3.91Å
419	T	92.8	Very high	87.4	Confident	39 Å²	39	41.8 Å²	41.8	24%	0.239	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	154.4	173.2	-168.7	0	0	0	0	111.1	V394 S395 M397 C454	V394-T419 WeakPolarHBondContact CA-O 3.4Å; S395-T419 PolarHBondContact N-O 2.97Å; S395-T419 PolarHBondContact O-N 2.89Å; M397-T419 HydrophobicContact CG-CG2 3.56Å; M397-T419 HydrophobicContact SD-CG2 3.81Å; T419-C454 WeakPolarHBondContact CA-O 3.3Å; T419-C454 WeakPolarHBondContact CB-O 3.49Å; T419-C454 PolarHBondContact OG1-O 3.01Å
420	C	92.1	Very high	89.1	Confident	13 Å²	13	38.6 Å²	38.6	9%	0.088	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.2	175.8	81	0	0	0	0	112.8	I391 E393 V394 P425 C454 L474	I391-C420 HydrophobicContact CG2-CB 4.18Å; E393-C420 CarbonylContact O-C 3.58Å; E393-C420 VanDerWaalsContact O-CA 3.22Å; E393-C420 WeakPolarHBondContact O-CA 2.95Å; V394-C420 HydrophobicContact CG2-CB 4.29Å; C420-P425 VanDerWaalsContact SG-CD 3.53Å; C420-C454 HydrophobicContact CB-CB 4.15Å; C420-C454 WeakPolarHBondContact CB-SG 3.21Å; C420-C454 PolarHBondContact N-O 2.89Å; C420-C454 PolarHBondContact N-SG 2.67Å; C420-C454 WeakPolarHBondContact SG-CB 3.28Å; C420-C454 CovalentContact SG-SG 2.01Å; C420-C454 PolarHBondContact SG-SG 2.95Å; C420-L474 HydrophobicContact CB-CD1 3.98Å
421	K	91.7	Very high	90.6	Very high	125 Å²	125	36 Å²	36	54%	0.543	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144	170.3	-64.3	-176.9	-172.7	156.9	0	110	L392 E393	L392-K421 PolarHBondContact N-O 3.04Å; E393-K421 HydrophobicContact CB-CB 4.25Å; E393-K421 HydrophobicContact CB-CD 4.34Å; E393-K421 HydrophobicContact CB-CG 4.48Å; E393-K421 PolarHBondContact O-N 3.02Å; E393-K421 WeakPolarHBondContact OE2-CD 3.46Å; E393-K421 WeakPolarHBondContact OE2-CE 3.33Å; E393-K421 IonicContact OE2-NZ 2.71Å; E393-K421 PolarHBondContact OE2-NZ 2.74Å
422	G	90.1	Very high	91.6	Very high	53 Å²	53	33.5 Å²	33.5	55%	0.546	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	97.5	-136.6	-178	0	0	0	0	0	111.6	G390	G390-G422 WeakPolarHBondContact O-CA 3.25Å
423	A	90.6	Very high	92.2	Very high	16 Å²	16	31.6 Å²	31.6	13%	0.132	18%	0.18	C	C	.	.	S	Bend	trans	-66.6	153.2	179.1	0	0	0	0	0	112.5	G390 I391	G390-A423 PolarHBondContact O-N 2.92Å; I391-A423 HydrophobicContact CG1-CB 4.43Å
424	T	90.5	Very high	92.4	Very high	71 Å²	71	31 Å²	31	44%	0.436	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-79.9	124.9	174.3	51.6	0	0	0	0	110.1	V450	T424-V450 HydrophobicContact CG2-CB 4.34Å; T424-V450 HydrophobicContact CG2-CG1 4.34Å
425	P	93.2	Very high	92.5	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.019	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-70.4	151.8	-177.7	29.7	-37	0	0	0	112.2	I391 C420 V450 L456 L474	I391-P425 HydrophobicContact CD1-CB 3.78Å; C420-P425 VanDerWaalsContact SG-CD 3.53Å; P425-V450 HydrophobicContact CG-CG2 4.3Å; P425-L456 HydrophobicContact CG-CD1 3.72Å; P425-L474 HydrophobicContact CB-CB 3.93Å; P425-L474 HydrophobicContact CG-CB 4.27Å; P425-L474 HydrophobicContact CG-CD1 4.18Å
426	M	92.1	Very high	92.6	Very high	113 Å²	113	36.5 Å²	36.5	56%	0.557	21%	0.214	S	C	*	.	S	Bend	trans	-101.7	-22.2	174.3	-61.3	-170.4	-174.6	0	0	112.5	P447 V448 G475 D476	M426-P447 WeakPolarHBondContact O-CA 3.26Å; M426-V448 PolarHBondContact O-N 2.89Å; M426-G475 PolarHBondContact N-O 2.78Å; M426-D476 HydrophobicContact CG-CB 4.2Å
427	E	93.4	Very high	92.4	Very high	56 Å²	56	39.4 Å²	39.4	26%	0.262	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	144.8	176.8	62.3	173.3	-166.4	0	0	112.4	R248 L474 G475	R248-E427 IonicContact CZ-OE1 2.76Å; R248-E427 VanDerWaalsContact CZ-OE1 3.24Å; R248-E427 IonicContact NH1-OE1 2.73Å; R248-E427 PolarHBondContact NH1-OE1 3.07Å; R248-E427 IonicContact NH2-OE1 3.13Å; R248-E427 PolarHBondContact NH2-OE1 2.86Å; E427-L474 WeakPolarHBondContact O-CA 3.2Å; E427-G475 WeakPolarHBondContact CG-O 3.33Å; E427-G475 PolarHBondContact N-O 2.77Å; E427-G475 PolarHBondContact O-N 2.98Å
428	A	94.1	Very high	92.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	112.4	169.9	0	0	0	0	0	109.7	C445 S446 V448 V458 R460 L474	A428-C445 WeakPolarHBondContact O-CA 3.49Å; A428-S446 PolarHBondContact N-O 3.04Å; A428-S446 PolarHBondContact O-N 2.87Å; A428-V448 HydrophobicContact CB-CG2 3.49Å; A428-V448 VanDerWaalsContact CB-CG2 3.49Å; A428-V458 HydrophobicContact CB-CG2 4.31Å; A428-R460 PolarHBondContact O-NH2 3.11Å; A428-L474 HydrophobicContact CB-CD2 3.47Å; A428-L474 VanDerWaalsContact CB-CD2 3.47Å
429	C	94.9	Very high	92.4	Very high	3 Å²	3	51 Å²	51	2%	0.02	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	139.4	172.8	-69.8	0	0	0	0	110.5	V444 C445 T473	C429-V444 CarbonylContact C-O 3.59Å; C429-V444 WeakPolarHBondContact CA-O 3.28Å; C429-C445 HydrophobicContact CB-CB 4.14Å; C429-C445 WeakPolarHBondContact CB-SG 3.26Å; C429-C445 WeakPolarHBondContact SG-CB 3.18Å; C429-C445 CovalentContact SG-SG 2.05Å; C429-C445 PolarHBondContact SG-SG 3.01Å; C429-T473 PolarHBondContact N-O 3.24Å; C429-T473 PolarHBondContact O-N 3.44Å
430	T	94.7	Very high	92.3	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.9	173.7	-48.1	0	0	0	0	109.4	I432 R443 V444 R460 V470 N471 F472	T430-I432 HydrophobicContact CG2-CG1 4.46Å; T430-R443 CarbonylContact O-C 3.52Å; T430-R443 WeakPolarHBondContact O-CA 3.46Å; T430-V444 PolarHBondContact N-O 2.88Å; T430-V444 PolarHBondContact O-N 3.49Å; T430-R460 VanDerWaalsContact CB-NE 3.32Å; T430-R460 HydrophobicContact CG2-CG 4.17Å; T430-R460 PolarHBondContact OG1-NE 3.25Å; T430-R460 PolarHBondContact OG1-NH2 3.48Å; T430-V470 HydrophobicContact CG2-CG1 3.39Å; T430-N471 CarbonylContact C-O 3.6Å; T430-N471 VanDerWaalsContact CA-O 3.26Å; T430-N471 WeakPolarHBondContact CA-O 2.7Å; T430-F472 HydrophobicContact CG2-CD1 4.23Å; T430-F472 HydrophobicContact CG2-CE1 3.86Å; T430-F472 HydrophobicContact CG2-CE2 4.27Å; T430-F472 HydrophobicContact CG2-CZ 3.86Å; T430-F472 WeakPolarHBondContact OG1-CD1 3.3Å; T430-F472 WeakPolarHBondContact OG1-CE1 3.49Å
431	I	94.4	Very high	92	Very high	41 Å²	41	56.8 Å²	56.8	21%	0.21	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117.9	172.5	-56.7	173.5	0	0	0	107.7	A440 N442 R443 V470 N471	I431-A440 HydrophobicContact CG2-CB 3.74Å; I431-N442 WeakPolarHBondContact CA-O 3.38Å; I431-R443 HydrophobicContact CG1-CB 4.29Å; I431-R443 HydrophobicContact CG1-CG 3.96Å; I431-V470 WeakPolarHBondContact O-CA 3.46Å; I431-N471 HydrophobicContact CB-CB 4.35Å; I431-N471 PolarHBondContact N-O 2.87Å; I431-N471 PolarHBondContact O-N 2.97Å
432	I	93.8	Very high	91.8	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.051	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.4	173.7	-60.3	171.1	0	0	0	107	T430 Q441 N442 R460 F462 Y468	T430-I432 HydrophobicContact CG2-CG1 4.46Å; I432-Q441 WeakPolarHBondContact O-CA 3.35Å; I432-Q441 WeakPolarHBondContact O-CB 3.46Å; I432-Q441 PolarHBondContact O-N 3.03Å; I432-N442 PolarHBondContact N-O 3.24Å; I432-N442 PolarHBondContact O-N 3.46Å; I432-N442 VanDerWaalsContact O-N 3.16Å; I432-R460 HydrophobicContact CD1-CB 4.44Å; I432-F462 HydrophobicContact CD1-CD1 4.35Å; I432-F462 HydrophobicContact CD1-CE1 3.99Å; I432-F462 HydrophobicContact CD1-CZ 4.17Å; I432-F462 HydrophobicContact CG1-CE1 4.26Å; I432-F462 HydrophobicContact CG2-CD1 4.2Å; I432-F462 HydrophobicContact CG2-CE1 3.9Å; I432-Y468 HydrophobicContact CG2-CD1 3.78Å; I432-Y468 HydrophobicContact CG2-CG 4.19Å
433	S	93.7	Very high	92	Very high	5 Å²	5	60 Å²	60	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	171.8	-178.2	-53.6	0	0	0	0	111.1	I439 C469	S433-I439 CarbonylContact C-O 3.59Å; S433-I439 WeakPolarHBondContact CA-O 3.44Å; S433-I439 WeakPolarHBondContact CB-O 3.32Å; S433-C469 PolarHBondContact N-O 2.84Å; S433-C469 PolarHBondContact O-N 2.8Å; S433-C469 VanDerWaalsContact O-N 3.1Å
434	D	91.7	Very high	92.1	Very high	26 Å²	26	61.6 Å²	61.6	14%	0.139	33%	0.328	C	S	.	.			trans	-58.5	166.2	168	81.4	-55.8	0	0	0	112.4	T436 C437 Q438 I439 C469	D434-T436 PolarHBondContact O-N 3.46Å; D434-T436 PolarHBondContact OD1-OG1 3.41Å; D434-T436 WeakPolarHBondContact OD2-CB 3.34Å; D434-T436 PolarHBondContact OD2-N 3.24Å; D434-T436 PolarHBondContact OD2-OG1 2.75Å; D434-C437 PolarHBondContact O-N 2.98Å; D434-C437 PolarHBondContact OD1-N 2.99Å; D434-Q438 PolarHBondContact OD1-N 3.04Å; D434-I439 HydrophobicContact CB-CB 4.35Å; D434-I439 PolarHBondContact N-O 2.96Å; D434-I439 PolarHBondContact OD1-N 2.76Å; D434-C469 VanDerWaalsContact O-CB 3.22Å; D434-C469 WeakPolarHBondContact O-CB 3.44Å
435	P	91.2	Very high	92.3	Very high	74 Å²	74	61 Å²	61	48%	0.481	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-20.4	-179.4	-18.1	23	0	0	0	114.8	T467	P435-T467 HydrophobicContact CB-CG2 4.4Å; P435-T467 WeakPolarHBondContact CD-O 3.29Å; P435-T467 VanDerWaalsContact CG-O 3.27Å; P435-T467 WeakPolarHBondContact CG-O 3.38Å
436	T	91.8	Very high	92.2	Very high	82 Å²	82	62.9 Å²	62.9	50%	0.503	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.1	178.7	75.1	0	0	0	0	113.8	D434 Q438	D434-T436 PolarHBondContact O-N 3.46Å; D434-T436 PolarHBondContact OD1-OG1 3.41Å; D434-T436 WeakPolarHBondContact OD2-CB 3.34Å; D434-T436 PolarHBondContact OD2-N 3.24Å; D434-T436 PolarHBondContact OD2-OG1 2.75Å; T436-Q438 PolarHBondContact O-N 2.66Å; T436-Q438 WeakPolarHBondContact OG1-CG 3.43Å
437	C	90	Very high	92.2	Very high	61 Å²	61	63.2 Å²	63.2	41%	0.412	35%	0.35	S	S	.	.	S	Bend	trans	58.7	22.8	-175.6	-48.1	0	0	0	0	114.3	D434 C469	D434-C437 PolarHBondContact O-N 2.98Å; D434-C437 PolarHBondContact OD1-N 2.99Å; C437-C469 HydrophobicContact CB-CB 3.83Å; C437-C469 WeakPolarHBondContact CB-SG 3.42Å; C437-C469 WeakPolarHBondContact SG-CB 3.47Å; C437-C469 CovalentContact SG-SG 2.03Å; C437-C469 PolarHBondContact SG-SG 2.9Å
438	Q	92	Very high	91.9	Very high	163 Å²	163	62.1 Å²	62.1	76%	0.762	35%	0.347	S	S	*	.			trans	-102.5	-34.7	-176.1	-66.5	-176.5	8.4	0	0	112.7	D434 T436	D434-Q438 PolarHBondContact OD1-N 3.04Å; T436-Q438 PolarHBondContact O-N 2.66Å; T436-Q438 WeakPolarHBondContact OG1-CG 3.43Å
439	I	91.7	Very high	91.1	Very high	114 Å²	114	66.9 Å²	66.9	59%	0.585	39%	0.387	S	S	*	.	S	Bend	trans	-113.6	104	-174	-55	176.3	0	0	0	108.6	S433 D434 Q441	S433-I439 CarbonylContact C-O 3.59Å; S433-I439 WeakPolarHBondContact CA-O 3.44Å; S433-I439 WeakPolarHBondContact CB-O 3.32Å; D434-I439 HydrophobicContact CB-CB 4.35Å; D434-I439 PolarHBondContact N-O 2.96Å; D434-I439 PolarHBondContact OD1-N 2.76Å; I439-Q441 PolarHBondContact O-N 2.82Å
440	A	90.5	Very high	89.9	Confident	67 Å²	67	68.2 Å²	68.2	55%	0.554	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	124	174.4	0	0	0	0	0	110.6	I431	I431-A440 HydrophobicContact CG2-CB 3.74Å
441	Q	86.7	Confident	88.6	Confident	108 Å²	108	75.7 Å²	75.7	51%	0.505	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-41.4	176.3	-60.1	-176.8	11.9	0	0	111.7	I432 I439	I432-Q441 WeakPolarHBondContact O-CA 3.35Å; I432-Q441 WeakPolarHBondContact O-CB 3.46Å; I432-Q441 PolarHBondContact O-N 3.03Å; I439-Q441 PolarHBondContact O-N 2.82Å
442	N	87.7	Confident	87.5	Confident	77 Å²	77	77.1 Å²	77.1	41%	0.412	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	144.1	-177.9	-168.2	11.4	0	0	0	111.1	I431 I432	I431-N442 WeakPolarHBondContact CA-O 3.38Å; I432-N442 PolarHBondContact N-O 3.24Å; I432-N442 PolarHBondContact O-N 3.46Å; I432-N442 VanDerWaalsContact O-N 3.16Å
443	R	93	Very high	86.6	Confident	168 Å²	168	83.2 Å²	83.2	63%	0.634	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.7	172	179.6	176.4	-176.7	-176.2	3	109	T430 I431	T430-R443 CarbonylContact O-C 3.52Å; T430-R443 WeakPolarHBondContact O-CA 3.46Å; I431-R443 HydrophobicContact CG1-CB 4.29Å; I431-R443 HydrophobicContact CG1-CG 3.96Å
444	V	92.8	Very high	86.3	Confident	49 Å²	49	83.8 Å²	83.8	30%	0.297	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.7	179.1	-176.3	0	0	0	0	109.1	C429 T430 R460	C429-V444 CarbonylContact C-O 3.59Å; C429-V444 WeakPolarHBondContact CA-O 3.28Å; T430-V444 PolarHBondContact N-O 2.88Å; T430-V444 PolarHBondContact O-N 3.49Å; V444-R460 PolarHBondContact O-NH2 3.29Å
445	C	94.2	Very high	86.1	Confident	60 Å²	60	86.9 Å²	86.9	41%	0.405	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.5	172.5	-59.1	0	0	0	0	109.7	A428 C429	A428-C445 WeakPolarHBondContact O-CA 3.49Å; C429-C445 HydrophobicContact CB-CB 4.14Å; C429-C445 WeakPolarHBondContact CB-SG 3.26Å; C429-C445 WeakPolarHBondContact SG-CB 3.18Å; C429-C445 CovalentContact SG-SG 2.05Å; C429-C445 PolarHBondContact SG-SG 3.01Å
446	S	91.5	Very high	86	Confident	41 Å²	41	83.7 Å²	83.7	29%	0.287	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.9	178.2	-51.3	0	0	0	0	109	A428	A428-S446 PolarHBondContact N-O 3.04Å; A428-S446 PolarHBondContact O-N 2.87Å
447	P	92	Very high	85.9	Confident	121 Å²	121	84.2 Å²	84.2	79%	0.786	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	147.8	170.6	29.3	-34	0	0	0	109.3	M426	M426-P447 WeakPolarHBondContact O-CA 3.26Å
448	V	87.6	Confident	86	Confident	33 Å²	33	81.8 Å²	81.8	20%	0.2	48%	0.48	C	S	.	.			trans	-129.4	130	-177.6	-168.9	0	0	0	0	109.6	M426 A428 V450 L456	M426-V448 PolarHBondContact O-N 2.89Å; A428-V448 HydrophobicContact CB-CG2 3.49Å; A428-V448 VanDerWaalsContact CB-CG2 3.49Å; V448-V450 HydrophobicContact CG1-CG2 3.95Å; V448-L456 HydrophobicContact CG1-CD1 4.02Å; V448-L456 HydrophobicContact CG1-CD2 3.35Å; V448-L456 HydrophobicContact CG1-CG 4.15Å
449	A	76.9	Confident	85.9	Confident	101 Å²	101	80.3 Å²	80.3	84%	0.835	47%	0.468	S	S	*	.			trans	-104.9	122.1	167.8	0	0	0	0	0	107.7
450	V	70.2	Confident	85.9	Confident	30 Å²	30	75.9 Å²	75.9	18%	0.182	44%	0.444	C	S	.	.			trans	-110.5	125.2	-171.2	-165.9	0	0	0	0	110.6	T424 P425 V448 G452 C454 L456	T424-V450 HydrophobicContact CG2-CB 4.34Å; T424-V450 HydrophobicContact CG2-CG1 4.34Å; P425-V450 HydrophobicContact CG-CG2 4.3Å; V448-V450 HydrophobicContact CG1-CG2 3.95Å; V450-G452 PolarHBondContact O-N 3.08Å; V450-G452 VanDerWaalsContact O-N 3.1Å; V450-C454 HydrophobicContact CG1-CB 4.41Å; V450-L456 HydrophobicContact CB-CD2 4.19Å; V450-L456 HydrophobicContact CG1-CD2 3.84Å; V450-L456 HydrophobicContact CG2-CD2 3.56Å
451	D	68.1	Low	85.8	Confident	159 Å²	159	74.5 Å²	74.5	85%	0.85	43%	0.432	S	S	*	.			trans	-81.9	76.2	174.4	-75.7	-20.7	0	0	0	110.9	L453	D451-L453 PolarHBondContact O-N 3.25Å
452	G	69.8	Low	85.9	Confident	71 Å²	71	69.5 Å²	69.5	73%	0.732	41%	0.409	S	S	*	.	S	Bend	trans	61.5	-46.9	165.2	0	0	0	0	0	118.7	V450	V450-G452 PolarHBondContact O-N 3.08Å; V450-G452 VanDerWaalsContact O-N 3.1Å
453	L	75.3	Confident	85.7	Confident	138 Å²	138	71.7 Å²	71.7	72%	0.723	42%	0.421	S	S	*	.	S	Bend	trans	-89	108.1	168.6	-63.4	165.8	0	0	0	106.5	D451 L455	D451-L453 PolarHBondContact O-N 3.25Å; L453-L455 HydrophobicContact CB-CD1 4.3Å; L453-L455 PolarHBondContact O-N 3.37Å
454	C	86.6	Confident	85.2	Confident	16 Å²	16	64.9 Å²	64.9	11%	0.108	40%	0.403	C	S	.	.			trans	-61.8	82.5	-177.5	-171.6	0	0	0	0	113	T419 C420 V450	T419-C454 WeakPolarHBondContact CA-O 3.3Å; T419-C454 WeakPolarHBondContact CB-O 3.49Å; T419-C454 PolarHBondContact OG1-O 3.01Å; C420-C454 HydrophobicContact CB-CB 4.15Å; C420-C454 WeakPolarHBondContact CB-SG 3.21Å; C420-C454 PolarHBondContact N-O 2.89Å; C420-C454 PolarHBondContact N-SG 2.67Å; C420-C454 WeakPolarHBondContact SG-CB 3.28Å; C420-C454 CovalentContact SG-SG 2.01Å; C420-C454 PolarHBondContact SG-SG 2.95Å; V450-C454 HydrophobicContact CG1-CB 4.41Å
455	L	89.2	Confident	85	Confident	92 Å²	92	66.1 Å²	66.1	48%	0.482	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	110.1	-177.5	-71.1	174.5	0	0	0	107.9	M397 L453	M397-L455 HydrophobicContact SD-CD2 3.42Å; M397-L455 WeakPolarHBondContact SD-CD2 3.41Å; L453-L455 HydrophobicContact CB-CD1 4.3Å; L453-L455 PolarHBondContact O-N 3.37Å
456	L	89.2	Confident	84.8	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.8	-169.8	-50.7	179.4	0	0	0	109.5	T417 V418 P425 V448 V450 V458 L474	T417-L456 CarbonylContact C-O 3.56Å; T417-L456 VanDerWaalsContact CA-O 3.32Å; T417-L456 WeakPolarHBondContact CA-O 3.4Å; V418-L456 PolarHBondContact N-O 2.89Å; V418-L456 PolarHBondContact O-N 2.96Å; P425-L456 HydrophobicContact CG-CD1 3.72Å; V448-L456 HydrophobicContact CG1-CD1 4.02Å; V448-L456 HydrophobicContact CG1-CD2 3.35Å; V448-L456 HydrophobicContact CG1-CG 4.15Å; V450-L456 HydrophobicContact CB-CD2 4.19Å; V450-L456 HydrophobicContact CG1-CD2 3.84Å; V450-L456 HydrophobicContact CG2-CD2 3.56Å; L456-V458 HydrophobicContact CB-CG2 4.44Å; L456-L474 HydrophobicContact CD1-CD1 3.84Å; L456-L474 HydrophobicContact CD1-CD2 3.94Å
457	S	89.7	Confident	84.8	Confident	94 Å²	94	65.6 Å²	65.6	66%	0.657	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	110.4	171.2	-69.4	0	0	0	0	109.6	F416	F416-S457 CarbonylContact O-C 3.53Å; F416-S457 WeakPolarHBondContact O-CA 3.33Å
458	V	90.8	Very high	84.9	Confident	10 Å²	10	60.8 Å²	60.8	6%	0.061	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.9	-177.2	-175.3	0	0	0	0	109.5	F416 A428 L456 R460 F472	F416-V458 PolarHBondContact N-O 3.13Å; F416-V458 PolarHBondContact O-N 3.36Å; A428-V458 HydrophobicContact CB-CG2 4.31Å; L456-V458 HydrophobicContact CB-CG2 4.44Å; V458-R460 HydrophobicContact CG1-CG 4.27Å; V458-F472 HydrophobicContact CB-CE1 3.94Å; V458-F472 HydrophobicContact CG1-CE1 3.87Å; V458-F472 HydrophobicContact CG2-CE1 4.39Å
459	R	91.1	Very high	85.2	Confident	131 Å²	131	59.3 Å²	59.3	49%	0.494	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.5	177	-173.5	167.1	-66.6	171.7	0.8	111.4	L413 M414 D415	L413-R459 HydrophobicContact CD2-CG 4.24Å; M414-R459 WeakPolarHBondContact O-CA 3.34Å; D415-R459 WeakPolarHBondContact OD1-CA 3.38Å; D415-R459 WeakPolarHBondContact OD1-CB 3.33Å; D415-R459 WeakPolarHBondContact OD1-CG 3.13Å; D415-R459 IonicContact OD1-CZ 3.7Å; D415-R459 IonicContact OD1-NE 3.61Å; D415-R459 PolarHBondContact OD1-NE 2.85Å; D415-R459 IonicContact OD1-NH2 3.33Å; D415-R459 IonicContact OD2-CZ 2.8Å; D415-R459 IonicContact OD2-NE 3.91Å; D415-R459 IonicContact OD2-NH2 3.97Å; D415-R459 PolarHBondContact OD2-NH2 2.85Å
460	R	91.1	Very high	86	Confident	22 Å²	22	54.5 Å²	54.5	8%	0.083	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147.4	177.2	-59.7	-64.9	176.2	-123.1	14.1	112	L413 M414 F416 A428 T430 I432 V444 V458 F462	L413-R460 WeakPolarHBondContact CA-O 3.28Å; M414-R460 PolarHBondContact N-O 3Å; M414-R460 PolarHBondContact O-N 2.8Å; F416-R460 HydrophobicContact CD2-CG 4.41Å; F416-R460 HydrophobicContact CE2-CB 4.15Å; F416-R460 HydrophobicContact CE2-CG 4.4Å; A428-R460 PolarHBondContact O-NH2 3.11Å; T430-R460 VanDerWaalsContact CB-NE 3.32Å; T430-R460 HydrophobicContact CG2-CG 4.17Å; T430-R460 PolarHBondContact OG1-NE 3.25Å; T430-R460 PolarHBondContact OG1-NH2 3.48Å; I432-R460 HydrophobicContact CD1-CB 4.44Å; V444-R460 PolarHBondContact O-NH2 3.29Å; V458-R460 HydrophobicContact CG1-CG 4.27Å; R460-F462 HydrophobicContact CB-CE2 4.37Å
461	A	88.5	Confident	87.2	Confident	38 Å²	38	54.5 Å²	54.5	31%	0.314	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	138.4	179.9	0	0	0	0	0	110.7	N411 S412 L413	N411-A461 HydrophobicContact CB-CB 4.18Å; S412-A461 CarbonylContact O-C 3.48Å; S412-A461 WeakPolarHBondContact O-CA 3.24Å; L413-A461 HydrophobicContact CD2-CB 3.7Å
462	F	89.2	Confident	88.4	Confident	3 Å²	3	47 Å²	47	1%	0.013	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.3	177.1	-65.8	-95.4	0	0	0	110.1	N411 S412 M414 F416 I432 R460 G464 Y468 V470 I487 I489	N411-F462 CarbonylContact C-O 3.6Å; N411-F462 WeakPolarHBondContact CA-O 3.21Å; N411-F462 WeakPolarHBondContact CB-O 3.45Å; S412-F462 PolarHBondContact N-O 2.95Å; S412-F462 VanDerWaalsContact N-O 3.11Å; S412-F462 PolarHBondContact O-N 2.91Å; M414-F462 HydrophobicContact CB-CD2 4.43Å; M414-F462 HydrophobicContact CB-CE2 3.91Å; M414-F462 HydrophobicContact CG-CD2 3.86Å; M414-F462 HydrophobicContact CG-CE2 3.7Å; F416-F462 HydrophobicContact CE2-CE2 4.06Å; F416-F462 HydrophobicContact CE2-CZ 4.18Å; F416-F462 HydrophobicContact CZ-CE2 4.15Å; F416-F462 AromaticContact CZ-CZ 3.92Å; F416-F462 HydrophobicContact CZ-CZ 3.92Å; I432-F462 HydrophobicContact CD1-CD1 4.35Å; I432-F462 HydrophobicContact CD1-CE1 3.99Å; I432-F462 HydrophobicContact CD1-CZ 4.17Å; I432-F462 HydrophobicContact CG1-CE1 4.26Å; I432-F462 HydrophobicContact CG2-CD1 4.2Å; I432-F462 HydrophobicContact CG2-CE1 3.9Å; R460-F462 HydrophobicContact CB-CE2 4.37Å; F462-G464 PolarHBondContact O-N 2.9Å; F462-Y468 HydrophobicContact CB-CE2 4.4Å; F462-Y468 HydrophobicContact CD1-CD1 4.22Å; F462-Y468 AromaticContact CD1-CD2 3.54Å; F462-Y468 HydrophobicContact CD1-CD2 3.54Å; F462-Y468 HydrophobicContact CD1-CE1 4.5Å; F462-Y468 AromaticContact CD1-CE2 3.87Å; F462-Y468 HydrophobicContact CD1-CE2 3.87Å; F462-Y468 AromaticContact CD1-CG 3.73Å; F462-Y468 HydrophobicContact CD1-CG 3.73Å; F462-Y468 AromaticContact CE1-CD2 3.99Å; F462-Y468 HydrophobicContact CE1-CD2 3.99Å; F462-Y468 AromaticContact CE1-CG 3.91Å; F462-Y468 HydrophobicContact CE1-CG 3.91Å; F462-V470 HydrophobicContact CE1-CG2 4.03Å; F462-V470 HydrophobicContact CZ-CG2 3.92Å; F462-I487 HydrophobicContact CE1-CG2 3.88Å; F462-I487 HydrophobicContact CZ-CG2 3.88Å; F462-I489 HydrophobicContact CB-CD1 4.29Å; F462-I489 HydrophobicContact CB-CG1 3.98Å; F462-I489 HydrophobicContact CD1-CD1 4.16Å; F462-I489 HydrophobicContact CD1-CG1 3.99Å; F462-I489 HydrophobicContact CD2-CD1 3.74Å; F462-I489 HydrophobicContact CD2-CG1 4.3Å; F462-I489 HydrophobicContact CE1-CD1 4.46Å; F462-I489 HydrophobicContact CE2-CD1 4.1Å; F462-I489 HydrophobicContact CG-CD1 3.79Å; F462-I489 HydrophobicContact CG-CG1 3.82Å; F462-I489 HydrophobicContact CZ-CD1 4.45Å
463	N	83.5	Confident	89.6	Confident	123 Å²	123	44.4 Å²	44.4	66%	0.658	26%	0.259	S	S	*	.	S	Bend	trans	-79.7	9.4	-171.9	-72.1	-9.4	0	0	0	114.6	N411	N411-N463 PolarHBondContact ND2-OD1 2.83Å
464	G	83.1	Confident	90.6	Very high	25 Å²	25	37.8 Å²	37.8	26%	0.258	23%	0.225	S	C	.	.	S	Bend	trans	163.5	175.1	179.8	0	0	0	0	0	112.3	F462 Y468	F462-G464 PolarHBondContact O-N 2.9Å; G464-Y468 WeakPolarHBondContact O-CE2 3.47Å; G464-Y468 PolarHBondContact O-OH 3.01Å
465	S	87.9	Confident	90.9	Very high	74 Å²	74	37.1 Å²	37.1	52%	0.517	22%	0.22	S	C	.	.	S	Bend	trans	-70.3	151	172.8	56.1	0	0	0	0	111.8	I489 P490	S465-I489 VanDerWaalsContact CA-O 3.31Å; S465-I489 WeakPolarHBondContact CA-O 3.34Å; S465-I489 VanDerWaalsContact CB-O 3.31Å; S465-I489 WeakPolarHBondContact CB-O 3.38Å; S465-P490 WeakPolarHBondContact CB-O 3.45Å
466	G	89.3	Confident	91.1	Very high	32 Å²	32	33.5 Å²	33.5	33%	0.33	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	146.4	174.8	-175.3	0	0	0	0	0	111.8	S488 I489	G466-S488 WeakPolarHBondContact O-CA 3.48Å; G466-I489 PolarHBondContact N-O 3.13Å; G466-I489 VanDerWaalsContact N-O 3.08Å; G466-I489 PolarHBondContact O-N 3.3Å
467	T	91.6	Very high	91.2	Very high	58 Å²	58	39.7 Å²	39.7	36%	0.356	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	135.2	172.4	-58.7	0	0	0	0	109	P435 L486 I487 S488	P435-T467 HydrophobicContact CB-CG2 4.4Å; P435-T467 WeakPolarHBondContact CD-O 3.29Å; P435-T467 VanDerWaalsContact CG-O 3.27Å; P435-T467 WeakPolarHBondContact CG-O 3.38Å; T467-L486 HydrophobicContact CG2-CD2 4.23Å; T467-I487 CarbonylContact C-O 3.44Å; T467-I487 VanDerWaalsContact CA-O 3.28Å; T467-I487 WeakPolarHBondContact CA-O 3.35Å; T467-S488 PolarHBondContact OG1-OG 3.27Å; T467-S488 VanDerWaalsContact OG1-OG 3.05Å
468	Y	93.5	Very high	91.4	Very high	20 Å²	20	35.9 Å²	35.9	8%	0.078	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.4	-178.9	-60	-91.2	0	0	0	109.5	I432 F462 G464 L486 I487 I489	I432-Y468 HydrophobicContact CG2-CD1 3.78Å; I432-Y468 HydrophobicContact CG2-CG 4.19Å; F462-Y468 HydrophobicContact CB-CE2 4.4Å; F462-Y468 HydrophobicContact CD1-CD1 4.22Å; F462-Y468 AromaticContact CD1-CD2 3.54Å; F462-Y468 HydrophobicContact CD1-CD2 3.54Å; F462-Y468 HydrophobicContact CD1-CE1 4.5Å; F462-Y468 AromaticContact CD1-CE2 3.87Å; F462-Y468 HydrophobicContact CD1-CE2 3.87Å; F462-Y468 AromaticContact CD1-CG 3.73Å; F462-Y468 HydrophobicContact CD1-CG 3.73Å; F462-Y468 AromaticContact CE1-CD2 3.99Å; F462-Y468 HydrophobicContact CE1-CD2 3.99Å; F462-Y468 AromaticContact CE1-CG 3.91Å; F462-Y468 HydrophobicContact CE1-CG 3.91Å; G464-Y468 WeakPolarHBondContact O-CE2 3.47Å; G464-Y468 PolarHBondContact O-OH 3.01Å; Y468-L486 WeakPolarHBondContact O-CA 3.48Å; Y468-I487 PolarHBondContact N-O 3.29Å; Y468-I487 PolarHBondContact O-N 2.95Å; Y468-I489 HydrophobicContact CD2-CG1 3.77Å; Y468-I489 HydrophobicContact CE2-CB 4.3Å; Y468-I489 HydrophobicContact CE2-CG1 3.74Å
469	C	94.9	Very high	91.6	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.014	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.2	167.6	-179.1	0	0	0	0	109	S433 D434 C437 L486	S433-C469 PolarHBondContact N-O 2.84Å; S433-C469 PolarHBondContact O-N 2.8Å; S433-C469 VanDerWaalsContact O-N 3.1Å; D434-C469 VanDerWaalsContact O-CB 3.22Å; D434-C469 WeakPolarHBondContact O-CB 3.44Å; C437-C469 HydrophobicContact CB-CB 3.83Å; C437-C469 WeakPolarHBondContact CB-SG 3.42Å; C437-C469 WeakPolarHBondContact SG-CB 3.47Å; C437-C469 CovalentContact SG-SG 2.03Å; C437-C469 PolarHBondContact SG-SG 2.9Å; C469-L486 HydrophobicContact CB-CD2 3.94Å
470	V	94.7	Very high	91.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.9	-176	-170.6	0	0	0	0	108.7	F416 T430 I431 F462 F472 S484 T485 I487	F416-V470 HydrophobicContact CE1-CG1 4.45Å; F416-V470 HydrophobicContact CZ-CG1 4.34Å; F416-V470 HydrophobicContact CZ-CG2 4.31Å; T430-V470 HydrophobicContact CG2-CG1 3.39Å; I431-V470 WeakPolarHBondContact O-CA 3.46Å; F462-V470 HydrophobicContact CE1-CG2 4.03Å; F462-V470 HydrophobicContact CZ-CG2 3.92Å; V470-F472 HydrophobicContact CB-CE2 4.33Å; V470-F472 HydrophobicContact CG1-CD2 3.99Å; V470-F472 HydrophobicContact CG1-CE2 3.38Å; V470-F472 HydrophobicContact CG1-CZ 3.9Å; V470-S484 WeakPolarHBondContact O-CA 3.12Å; V470-T485 HydrophobicContact CB-CG2 4.38Å; V470-T485 PolarHBondContact N-O 3.24Å; V470-T485 PolarHBondContact O-N 3.13Å; V470-I487 HydrophobicContact CG2-CG2 3.62Å
471	N	94.3	Very high	91.9	Very high	31 Å²	31	31.2 Å²	31.2	17%	0.166	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.3	174.3	-65.7	-4.9	0	0	0	109.1	T430 I431 T483 S484	T430-N471 CarbonylContact C-O 3.6Å; T430-N471 VanDerWaalsContact CA-O 3.26Å; T430-N471 WeakPolarHBondContact CA-O 2.7Å; I431-N471 HydrophobicContact CB-CB 4.35Å; I431-N471 PolarHBondContact N-O 2.87Å; I431-N471 PolarHBondContact O-N 2.97Å; N471-T483 CarbonylContact C-O 3.6Å; N471-T483 WeakPolarHBondContact CA-O 3.44Å; N471-S484 WeakPolarHBondContact OD1-CB 3.32Å
472	F	94.4	Very high	92.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.5	170.2	-75.5	-88.6	0	0	0	109.6	I396 F416 V418 T430 V458 V470 L482 T483	I396-F472 HydrophobicContact CD1-CD2 3.75Å; I396-F472 HydrophobicContact CD1-CE2 4.15Å; I396-F472 HydrophobicContact CG1-CD2 4.19Å; F416-F472 HydrophobicContact CB-CE1 4.13Å; F416-F472 HydrophobicContact CB-CE2 4.09Å; F416-F472 HydrophobicContact CB-CZ 3.49Å; F416-F472 VanDerWaalsContact CB-CZ 3.49Å; F416-F472 AromaticContact CD1-CE2 3.54Å; F416-F472 HydrophobicContact CD1-CE2 3.54Å; F416-F472 AromaticContact CD1-CZ 3.64Å; F416-F472 HydrophobicContact CD1-CZ 3.64Å; F416-F472 HydrophobicContact CD2-CE2 4.36Å; F416-F472 AromaticContact CD2-CZ 3.66Å; F416-F472 HydrophobicContact CD2-CZ 3.66Å; F416-F472 AromaticContact CE1-CE2 4Å; F416-F472 HydrophobicContact CE1-CE2 4Å; F416-F472 HydrophobicContact CE1-CZ 4.24Å; F416-F472 HydrophobicContact CE2-CZ 4.25Å; F416-F472 HydrophobicContact CG-CE1 4.35Å; F416-F472 AromaticContact CG-CE2 3.76Å; F416-F472 HydrophobicContact CG-CE2 3.76Å; F416-F472 AromaticContact CG-CZ 3.31Å; F416-F472 HydrophobicContact CG-CZ 3.31Å; V418-F472 HydrophobicContact CG2-CD1 3.93Å; V418-F472 HydrophobicContact CG2-CE1 4.14Å; V418-F472 HydrophobicContact CG2-CG 4.17Å; T430-F472 HydrophobicContact CG2-CD1 4.23Å; T430-F472 HydrophobicContact CG2-CE1 3.86Å; T430-F472 HydrophobicContact CG2-CE2 4.27Å; T430-F472 HydrophobicContact CG2-CZ 3.86Å; T430-F472 WeakPolarHBondContact OG1-CD1 3.3Å; T430-F472 WeakPolarHBondContact OG1-CE1 3.49Å; V458-F472 HydrophobicContact CB-CE1 3.94Å; V458-F472 HydrophobicContact CG1-CE1 3.87Å; V458-F472 HydrophobicContact CG2-CE1 4.39Å; V470-F472 HydrophobicContact CB-CE2 4.33Å; V470-F472 HydrophobicContact CG1-CD2 3.99Å; V470-F472 HydrophobicContact CG1-CE2 3.38Å; V470-F472 HydrophobicContact CG1-CZ 3.9Å; F472-L482 CarbonylContact O-C 3.49Å; F472-L482 VanDerWaalsContact O-CA 3.28Å; F472-L482 WeakPolarHBondContact O-CA 3.48Å; F472-T483 HydrophobicContact CB-CG2 3.81Å; F472-T483 PolarHBondContact N-O 2.98Å; F472-T483 PolarHBondContact O-N 3.12Å
473	T	94.9	Very high	92.4	Very high	17 Å²	17	35.1 Å²	35.1	10%	0.104	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.3	174.4	-52.9	0	0	0	0	107.5	C429 L480 A481	C429-T473 PolarHBondContact N-O 3.24Å; C429-T473 PolarHBondContact O-N 3.44Å; T473-L480 HydrophobicContact CG2-CD1 3.66Å; T473-L480 HydrophobicContact CG2-CD2 3.46Å; T473-L480 VanDerWaalsContact CG2-CD2 3.46Å; T473-L480 HydrophobicContact CG2-CG 3.38Å; T473-A481 CarbonylContact C-O 3.59Å; T473-A481 WeakPolarHBondContact CA-O 3.48Å
474	L	94.4	Very high	92.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.4	172.2	-56.8	-174.1	0	0	0	107.9	I391 V394 V418 C420 P425 E427 A428 L456 L480 A481	I391-L474 HydrophobicContact CD1-CB 4.37Å; V394-L474 HydrophobicContact CB-CD1 4.35Å; V394-L474 HydrophobicContact CG1-CD1 3.53Å; V394-L474 HydrophobicContact CG1-CG 3.82Å; V394-L474 HydrophobicContact CG2-CB 3.98Å; V394-L474 HydrophobicContact CG2-CD1 3.81Å; V394-L474 HydrophobicContact CG2-CG 3.98Å; V418-L474 HydrophobicContact CG1-CD1 3.91Å; C420-L474 HydrophobicContact CB-CD1 3.98Å; P425-L474 HydrophobicContact CB-CB 3.93Å; P425-L474 HydrophobicContact CG-CB 4.27Å; P425-L474 HydrophobicContact CG-CD1 4.18Å; E427-L474 WeakPolarHBondContact O-CA 3.2Å; A428-L474 HydrophobicContact CB-CD2 3.47Å; A428-L474 VanDerWaalsContact CB-CD2 3.47Å; L456-L474 HydrophobicContact CD1-CD1 3.84Å; L456-L474 HydrophobicContact CD1-CD2 3.94Å; L474-L480 WeakPolarHBondContact O-CA 3.4Å; L474-A481 PolarHBondContact N-O 3.23Å; L474-A481 PolarHBondContact O-N 3.22Å
475	G	93.5	Very high	93.4	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	158.1	-177	0	0	0	0	0	113.1	M426 E427 S479	M426-G475 PolarHBondContact N-O 2.78Å; E427-G475 WeakPolarHBondContact CG-O 3.33Å; E427-G475 PolarHBondContact N-O 2.77Å; E427-G475 PolarHBondContact O-N 2.98Å; G475-S479 VanDerWaalsContact CA-O 3.26Å; G475-S479 WeakPolarHBondContact CA-O 3.19Å
476	D	92.8	Very high	93.7	Very high	17 Å²	17	34.8 Å²	34.8	9%	0.091	20%	0.204	C	C	.	.			trans	-130.8	-163	164.1	60	30.1	0	0	0	108.9	R248 M426 A478 S479	R248-D476 WeakPolarHBondContact CD-O 3.34Å; R248-D476 PolarHBondContact NH1-O 3.38Å; M426-D476 HydrophobicContact CG-CB 4.2Å; D476-A478 VanDerWaalsContact C-N 3.26Å; D476-A478 PolarHBondContact O-N 2.95Å; D476-A478 PolarHBondContact OD1-N 3.21Å; D476-S479 PolarHBondContact N-O 3.33Å; D476-S479 WeakPolarHBondContact OD1-CA 3.48Å; D476-S479 PolarHBondContact OD1-N 3.26Å; D476-S479 PolarHBondContact OD1-OG 2.95Å; D476-S479 PolarHBondContact OD2-OG 2.77Å
477	D	91.9	Very high	93.8	Very high	135 Å²	135	33.9 Å²	33.9	72%	0.722	19%	0.192	S	C	*	.	S	Bend	trans	-66.5	-26.2	-178.2	-68.5	-27.7	0	0	0	113.2
478	A	93.6	Very high	93.8	Very high	14 Å²	14	35 Å²	35	12%	0.116	20%	0.203	C	C	.	.	S	Bend	trans	-113.9	-28.8	-173.5	0	0	0	0	0	113.8	R248 I254 L256 V388 D476	R248-A478 WeakPolarHBondContact CB-O 3.28Å; R248-A478 PolarHBondContact N-O 3.23Å; I254-A478 HydrophobicContact CG2-CB 4.11Å; L256-A478 HydrophobicContact CD2-CB 4.37Å; V388-A478 HydrophobicContact CG2-CB 3.8Å; D476-A478 VanDerWaalsContact C-N 3.26Å; D476-A478 PolarHBondContact O-N 2.95Å; D476-A478 PolarHBondContact OD1-N 3.21Å
479	S	95.4	Very high	93.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-128.2	152.9	-167.5	72.4	0	0	0	0	112.9	N246 I391 G475 D476	N246-S479 CarbonylContact O-C 3.55Å; N246-S479 VanDerWaalsContact O-CA 3.27Å; N246-S479 WeakPolarHBondContact O-CA 3.39Å; I391-S479 WeakPolarHBondContact CG1-OG 3.25Å; I391-S479 PolarHBondContact N-OG 2.89Å; G475-S479 VanDerWaalsContact CA-O 3.26Å; G475-S479 WeakPolarHBondContact CA-O 3.19Å; D476-S479 PolarHBondContact N-O 3.33Å; D476-S479 WeakPolarHBondContact OD1-CA 3.48Å; D476-S479 PolarHBondContact OD1-N 3.26Å; D476-S479 PolarHBondContact OD1-OG 2.95Å; D476-S479 PolarHBondContact OD2-OG 2.77Å
480	L	94.5	Very high	92.9	Very high	62 Å²	62	38.5 Å²	38.5	33%	0.325	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	123.5	179.1	-175.3	147.9	0	0	0	109.3	N246 R248 T473 L474	N246-L480 WeakPolarHBondContact CA-O 3.22Å; N246-L480 VanDerWaalsContact CB-O 3.25Å; N246-L480 WeakPolarHBondContact CB-O 3.42Å; N246-L480 PolarHBondContact O-N 3.37Å; R248-L480 HydrophobicContact CB-CB 4.45Å; T473-L480 HydrophobicContact CG2-CD1 3.66Å; T473-L480 HydrophobicContact CG2-CD2 3.46Å; T473-L480 VanDerWaalsContact CG2-CD2 3.46Å; T473-L480 HydrophobicContact CG2-CG 3.38Å; L474-L480 WeakPolarHBondContact O-CA 3.4Å
481	A	95	Very high	91.6	Very high	3 Å²	3	40.4 Å²	40.4	3%	0.025	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.5	177.8	0	0	0	0	0	110.9	I391 V394 T473 L474	I391-A481 HydrophobicContact CB-CB 4.13Å; I391-A481 HydrophobicContact CG2-CB 3.6Å; V394-A481 HydrophobicContact CG2-CB 3.51Å; T473-A481 CarbonylContact C-O 3.59Å; T473-A481 WeakPolarHBondContact CA-O 3.48Å; L474-A481 PolarHBondContact N-O 3.23Å; L474-A481 PolarHBondContact O-N 3.22Å
482	L	93.9	Very high	90	Very high	95 Å²	95	47.4 Å²	47.4	50%	0.497	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.5	-170.7	-177.6	145.6	0	0	0	112	F472	F472-L482 CarbonylContact O-C 3.49Å; F472-L482 VanDerWaalsContact O-CA 3.28Å; F472-L482 WeakPolarHBondContact O-CA 3.48Å
483	T	94.5	Very high	87.9	Confident	28 Å²	28	54.2 Å²	54.2	17%	0.172	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	155.3	169.5	-168.7	0	0	0	0	109.8	V394 I396 N471 F472	V394-T483 HydrophobicContact CB-CG2 4.19Å; V394-T483 HydrophobicContact CG1-CG2 3.62Å; V394-T483 WeakPolarHBondContact O-CB 3.43Å; V394-T483 PolarHBondContact O-OG1 3.19Å; I396-T483 HydrophobicContact CD1-CG2 4.07Å; I396-T483 HydrophobicContact CG1-CG2 3.73Å; N471-T483 CarbonylContact C-O 3.6Å; N471-T483 WeakPolarHBondContact CA-O 3.44Å; F472-T483 HydrophobicContact CB-CG2 3.81Å; F472-T483 PolarHBondContact N-O 2.98Å; F472-T483 PolarHBondContact O-N 3.12Å
484	S	93.1	Very high	85.4	Confident	72 Å²	72	58.4 Å²	58.4	50%	0.503	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.1	-177.7	62	0	0	0	0	112.2	V470 N471	V470-S484 WeakPolarHBondContact O-CA 3.12Å; N471-S484 WeakPolarHBondContact OD1-CB 3.32Å
485	T	94.2	Very high	82.7	Confident	40 Å²	40	65.8 Å²	65.8	25%	0.245	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	159.5	173.5	-168.3	0	0	0	0	111.7	I396 I399 F416 V470	I396-T485 HydrophobicContact CD1-CG2 3.42Å; I396-T485 VanDerWaalsContact CD1-CG2 3.42Å; I399-T485 HydrophobicContact CD1-CG2 4.07Å; F416-T485 HydrophobicContact CE1-CG2 4.49Å; V470-T485 HydrophobicContact CB-CG2 4.38Å; V470-T485 PolarHBondContact N-O 3.24Å; V470-T485 PolarHBondContact O-N 3.13Å
486	L	93.9	Very high	79.9	Confident	103 Å²	103	70.4 Å²	70.4	54%	0.539	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.4	170.8	-73.2	165.8	0	0	0	109.3	T467 Y468 C469	T467-L486 HydrophobicContact CG2-CD2 4.23Å; Y468-L486 WeakPolarHBondContact O-CA 3.48Å; C469-L486 HydrophobicContact CB-CD2 3.94Å
487	I	91.9	Very high	77.3	Confident	13 Å²	13	75.2 Å²	75.2	7%	0.067	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.4	176.4	-169.3	175	0	0	0	110.1	I399 M414 F416 F462 T467 Y468 V470 I489	I399-I487 HydrophobicContact CG2-CD1 3.52Å; I399-I487 HydrophobicContact CG2-CG1 4.39Å; M414-I487 HydrophobicContact CB-CD1 4.26Å; M414-I487 HydrophobicContact CG-CD1 3.84Å; F416-I487 HydrophobicContact CE1-CD1 4.11Å; F416-I487 HydrophobicContact CZ-CD1 3.73Å; F462-I487 HydrophobicContact CE1-CG2 3.88Å; F462-I487 HydrophobicContact CZ-CG2 3.88Å; T467-I487 CarbonylContact C-O 3.44Å; T467-I487 VanDerWaalsContact CA-O 3.28Å; T467-I487 WeakPolarHBondContact CA-O 3.35Å; Y468-I487 PolarHBondContact N-O 3.29Å; Y468-I487 PolarHBondContact O-N 2.95Å; V470-I487 HydrophobicContact CG2-CG2 3.62Å; I487-I489 HydrophobicContact CD1-CD1 3.87Å; I487-I489 HydrophobicContact CG1-CD1 4.07Å; I487-I489 HydrophobicContact CG2-CD1 4.42Å
488	S	91	Very high	74.8	Confident	83 Å²	83	76.7 Å²	76.7	58%	0.58	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	116.2	174.3	-61.1	0	0	0	0	109.8	G466 T467	G466-S488 WeakPolarHBondContact O-CA 3.48Å; T467-S488 PolarHBondContact OG1-OG 3.27Å; T467-S488 VanDerWaalsContact OG1-OG 3.05Å
489	I	88.1	Confident	72.2	Confident	6 Å²	6	86.9 Å²	86.9	3%	0.031	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.7	178.2	-50.1	-61.9	0	0	0	108.4	M414 F462 S465 G466 Y468 I487	M414-I489 HydrophobicContact CE-CD1 3.36Å; M414-I489 HydrophobicContact CE-CG2 4.34Å; M414-I489 HydrophobicContact CG-CD1 3.77Å; M414-I489 HydrophobicContact SD-CD1 4.37Å; F462-I489 HydrophobicContact CB-CD1 4.29Å; F462-I489 HydrophobicContact CB-CG1 3.98Å; F462-I489 HydrophobicContact CD1-CD1 4.16Å; F462-I489 HydrophobicContact CD1-CG1 3.99Å; F462-I489 HydrophobicContact CD2-CD1 3.74Å; F462-I489 HydrophobicContact CD2-CG1 4.3Å; F462-I489 HydrophobicContact CE1-CD1 4.46Å; F462-I489 HydrophobicContact CE2-CD1 4.1Å; F462-I489 HydrophobicContact CG-CD1 3.79Å; F462-I489 HydrophobicContact CG-CG1 3.82Å; F462-I489 HydrophobicContact CZ-CD1 4.45Å; S465-I489 VanDerWaalsContact CA-O 3.31Å; S465-I489 WeakPolarHBondContact CA-O 3.34Å; S465-I489 VanDerWaalsContact CB-O 3.31Å; S465-I489 WeakPolarHBondContact CB-O 3.38Å; G466-I489 PolarHBondContact N-O 3.13Å; G466-I489 VanDerWaalsContact N-O 3.08Å; G466-I489 PolarHBondContact O-N 3.3Å; Y468-I489 HydrophobicContact CD2-CG1 3.77Å; Y468-I489 HydrophobicContact CE2-CB 4.3Å; Y468-I489 HydrophobicContact CE2-CG1 3.74Å; I487-I489 HydrophobicContact CD1-CD1 3.87Å; I487-I489 HydrophobicContact CG1-CD1 4.07Å; I487-I489 HydrophobicContact CG2-CD1 4.42Å
490	P	80.4	Confident	69.4	Low	88 Å²	88	91 Å²	91	57%	0.571	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-66.5	146.9	-177.4	25.4	-32.5	0	0	0	112.5	S465	S465-P490 WeakPolarHBondContact CB-O 3.45Å
491	G	67.3	Low	66.8	Low	41 Å²	41	94.6 Å²	94.6	42%	0.423	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-68.8	146.9	172.7	0	0	0	0	0	112.4	D493	G491-D493 VanDerWaalsContact C-N 3.27Å; G491-D493 PolarHBondContact O-N 2.86Å
492	K	60.4	Low	64.3	Low	178 Å²	178	102.2 Å²	102.2	77%	0.774	59%	0.585	S	S	*	*			trans	-72.5	84.3	169.1	-169.8	176.4	-173.3	170.8	0	108.4	P494	K492-P494 WeakPolarHBondContact O-CD 3.33Å
493	D	51.3	Low	62	Low	142 Å²	142	100.6 Å²	100.6	76%	0.759	59%	0.591	S	S	*	*			trans	-67.1	121.5	168.3	-84.3	-26.9	0	0	0	108.4	G491 D495	G491-D493 VanDerWaalsContact C-N 3.27Å; G491-D493 PolarHBondContact O-N 2.86Å; D493-D495 PolarHBondContact O-N 2.99Å
494	P	43.2	Very low	60	Low	106 Å²	106	105.8 Å²	105.8	69%	0.688	62%	0.623	S	S	*	*			trans	-73.3	121	168.9	30.6	-28.3	0	0	0	107.8	K492	K492-P494 WeakPolarHBondContact O-CD 3.33Å
495	D	36.7	Very low	58.3	Low	155 Å²	155	109 Å²	109	83%	0.829	63%	0.633	S	S	*	*			trans	53.9	91.9	159.9	-54.6	-35.3	0	0	0	117.3	D493	D493-D495 PolarHBondContact O-N 2.99Å
496	S	34.5	Very low	56.7	Low	97 Å²	97	114 Å²	114	68%	0.678	66%	0.657	S	S	*	*			trans	-127.9	99.6	144.2	59.2	0	0	0	0	110.6	L498	S496-L498 VanDerWaalsContact C-N 3.26Å; S496-L498 PolarHBondContact O-N 3.39Å
497	P	38.8	Very low	55.1	Low	118 Å²	118	112.8 Å²	112.8	77%	0.766	66%	0.657	S	S	*	*			trans	-83.9	75.8	171.3	34.8	-29.9	0	0	0	107.9	R499	P497-R499 PolarHBondContact O-N 3.21Å
498	L	38.9	Very low	54	Low	167 Å²	167	118 Å²	118	87%	0.874	68%	0.684	S	S	*	*			trans	-84.3	76.8	164.8	-83.2	167.2	0	0	0	109.5	S496 A500	S496-L498 VanDerWaalsContact C-N 3.26Å; S496-L498 PolarHBondContact O-N 3.39Å; L498-A500 PolarHBondContact O-N 3.33Å
499	R	38.9	Very low	52.9	Low	227 Å²	227	116.1 Å²	116.1	86%	0.857	68%	0.678	S	S	*	*			trans	-48.6	118.4	160.8	-162.1	178.7	-157.2	164.3	4.3	109.2	P497 V501	P497-R499 PolarHBondContact O-N 3.21Å; R499-V501 PolarHBondContact O-N 2.94Å
500	A	36.1	Very low	52.4	Low	88 Å²	88	119.2 Å²	119.2	73%	0.727	70%	0.699	S	S	*	*			trans	16.7	98	151.3	0	0	0	0	0	116.8	L498	L498-A500 PolarHBondContact O-N 3.33Å
501	V	41.2	Very low	52.3	Low	137 Å²	137	120.3 Å²	120.3	83%	0.83	70%	0.7	S	S	*	*			trans	-128.6	99	144.8	-179.4	0	0	0	0	107.1	R499	R499-V501 PolarHBondContact O-N 2.94Å
502	N	42.3	Very low	52.9	Low	162 Å²	162	121.1 Å²	121.1	87%	0.866	70%	0.703	S	S	*	*			trans	-63	136.3	167.5	-80.6	-28.1	0	0	0	109.8
503	G	45	Very low	54	Low	62 Å²	62	117 Å²	117	64%	0.639	69%	0.692	S	S	*	*	S	Bend	trans	99	130.4	155.2	0	0	0	0	0	114.9
504	V	52.8	Low	55.5	Low	136 Å²	136	115.6 Å²	115.6	82%	0.824	68%	0.684	S	S	*	*			trans	87.4	59.2	164.3	-158.1	0	0	0	0	116.6
505	L	57	Low	57.6	Low	140 Å²	140	114.7 Å²	114.7	73%	0.733	68%	0.677	S	S	*	*			trans	-141.5	1.9	155.4	-81.6	-179.8	0	0	0	115.9	S507	L505-S507 VanDerWaalsContact C-N 3.28Å; L505-S507 PolarHBondContact O-N 2.98Å
506	I	60.4	Low	59.9	Low	145 Å²	145	111 Å²	111	74%	0.744	66%	0.659	S	S	*	*	H	α-helix	trans	-73.2	-15.9	-176.2	-60.4	176.4	0	0	0	113.1	C510	I506-C510 PolarHBondContact O-N 3.11Å
507	S	61.4	Low	62.4	Low	78 Å²	78	111.3 Å²	111.3	55%	0.545	65%	0.652	S	S	.	*	H	α-helix	trans	-76.5	-30.4	-176.3	62.7	0	0	0	0	114.5	L505 L511	L505-S507 VanDerWaalsContact C-N 3.28Å; L505-S507 PolarHBondContact O-N 2.98Å; S507-L511 PolarHBondContact O-N 2.8Å
508	I	68.6	Low	64.6	Low	121 Å²	121	109.3 Å²	109.3	62%	0.621	64%	0.637	S	S	*	*	H	α-helix	trans	-79.4	-39.2	-176.1	-64.1	172.1	0	0	0	111.1	L511 A512	I508-L511 PolarHBondContact O-N 2.83Å; I508-A512 PolarHBondContact O-N 3.01Å
509	G	68.1	Low	66.8	Low	45 Å²	45	105.3 Å²	105.3	46%	0.464	62%	0.62	S	S	.	*	H	α-helix	trans	-67.1	-40.8	176.3	0	0	0	0	0	113	L511 A512 V513	G509-L511 VanDerWaalsContact C-N 3.33Å; G509-L511 PolarHBondContact O-N 3.39Å; G509-A512 PolarHBondContact O-N 3.37Å; G509-V513 WeakPolarHBondContact O-CG2 3.35Å; G509-V513 PolarHBondContact O-N 2.81Å; G509-V513 VanDerWaalsContact O-N 3.16Å
510	C	76.4	Confident	69	Low	70 Å²	70	98.9 Å²	98.9	47%	0.473	60%	0.602	S	S	.	*	H	α-helix	trans	-64.1	-36.7	175.8	-84.9	0	0	0	0	112.5	I506 V513 L514	I506-C510 PolarHBondContact O-N 3.11Å; C510-V513 PolarHBondContact O-N 3.49Å; C510-L514 WeakPolarHBondContact O-CB 3.4Å; C510-L514 WeakPolarHBondContact O-CG 3.44Å; C510-L514 PolarHBondContact O-N 3.29Å
511	L	78.3	Confident	71.3	Confident	111 Å²	111	99.9 Å²	99.9	58%	0.581	59%	0.594	S	S	*	*	H	α-helix	trans	-64.3	-40.7	175.9	-95.9	161.3	0	0	0	112	S507 I508 G509 L514 V515	S507-L511 PolarHBondContact O-N 2.8Å; I508-L511 PolarHBondContact O-N 2.83Å; G509-L511 VanDerWaalsContact C-N 3.33Å; G509-L511 PolarHBondContact O-N 3.39Å; L511-L514 PolarHBondContact O-N 2.81Å; L511-V515 WeakPolarHBondContact O-CB 3.5Å; L511-V515 WeakPolarHBondContact O-CG2 3.45Å; L511-V515 PolarHBondContact O-N 3.21Å
512	A	81.1	Confident	73.3	Confident	59 Å²	59	97.9 Å²	97.9	49%	0.488	58%	0.578	S	S	.	*	H	α-helix	trans	-65.3	-41.7	177	0	0	0	0	0	112.4	I508 G509 V515 T516	I508-A512 PolarHBondContact O-N 3.01Å; G509-A512 PolarHBondContact O-N 3.37Å; A512-V515 PolarHBondContact O-N 2.97Å; A512-T516 WeakPolarHBondContact O-CG2 3.38Å; A512-T516 PolarHBondContact O-N 3.38Å; A512-T516 PolarHBondContact O-OG1 2.93Å
513	V	83	Confident	75.1	Confident	91 Å²	91	97.4 Å²	97.4	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-68.7	-38.3	176.9	177.5	0	0	0	0	111.6	G509 C510 T516 M517	G509-V513 WeakPolarHBondContact O-CG2 3.35Å; G509-V513 PolarHBondContact O-N 2.81Å; G509-V513 VanDerWaalsContact O-N 3.16Å; C510-V513 PolarHBondContact O-N 3.49Å; V513-T516 WeakPolarHBondContact CA-OG1 3.43Å; V513-T516 PolarHBondContact O-OG1 3.06Å; V513-M517 WeakPolarHBondContact O-CB 3.37Å; V513-M517 WeakPolarHBondContact O-CG 3.47Å; V513-M517 PolarHBondContact O-N 3.14Å
514	L	83.3	Confident	76.7	Confident	112 Å²	112	102.4 Å²	102.4	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-65.1	-43.5	174.2	-81.3	165.3	0	0	0	111.4	C510 L511 M517 V518	C510-L514 WeakPolarHBondContact O-CB 3.4Å; C510-L514 WeakPolarHBondContact O-CG 3.44Å; C510-L514 PolarHBondContact O-N 3.29Å; L511-L514 PolarHBondContact O-N 2.81Å; L514-M517 PolarHBondContact O-N 3.36Å; L514-V518 WeakPolarHBondContact O-CB 3.32Å; L514-V518 VanDerWaalsContact O-CG2 3.28Å; L514-V518 WeakPolarHBondContact O-CG2 3.46Å; L514-V518 PolarHBondContact O-N 2.69Å
515	V	86.8	Confident	77.9	Confident	88 Å²	88	104.6 Å²	104.6	53%	0.533	57%	0.568	S	S	.	*	H	α-helix	trans	-60.7	-49.1	176.2	171.1	0	0	0	0	110.2	L511 A512 M517 V518 T519	L511-V515 WeakPolarHBondContact O-CB 3.5Å; L511-V515 WeakPolarHBondContact O-CG2 3.45Å; L511-V515 PolarHBondContact O-N 3.21Å; A512-V515 PolarHBondContact O-N 2.97Å; V515-M517 PolarHBondContact O-N 3.28Å; V515-V518 PolarHBondContact O-N 2.66Å; V515-T519 PolarHBondContact O-N 2.73Å; V515-T519 PolarHBondContact O-OG1 3.31Å
516	T	84.4	Confident	78.3	Confident	76 Å²	76	105.3 Å²	105.3	47%	0.466	57%	0.567	S	S	.	*	H	α-helix	trans	-63.1	-38.8	179.6	56.3	0	0	0	0	112.9	A512 V513 T519 I520	A512-T516 WeakPolarHBondContact O-CG2 3.38Å; A512-T516 PolarHBondContact O-N 3.38Å; A512-T516 PolarHBondContact O-OG1 2.93Å; V513-T516 WeakPolarHBondContact CA-OG1 3.43Å; V513-T516 PolarHBondContact O-OG1 3.06Å; T516-T519 PolarHBondContact O-N 2.79Å; T516-I520 VanDerWaalsContact O-CG1 3.25Å; T516-I520 WeakPolarHBondContact O-CG1 3.27Å; T516-I520 PolarHBondContact O-N 2.87Å
517	M	86.8	Confident	78	Confident	104 Å²	104	103.9 Å²	103.9	51%	0.512	56%	0.556	S	S	.	*	H	α-helix	trans	-64.4	-41.4	174.3	-78.5	-64.7	-72.1	0	0	112.3	V513 L514 V515 I520 L521	V513-M517 WeakPolarHBondContact O-CB 3.37Å; V513-M517 WeakPolarHBondContact O-CG 3.47Å; V513-M517 PolarHBondContact O-N 3.14Å; L514-M517 PolarHBondContact O-N 3.36Å; V515-M517 PolarHBondContact O-N 3.28Å; M517-I520 PolarHBondContact O-N 3.11Å; M517-L521 WeakPolarHBondContact O-CB 3.35Å; M517-L521 VanDerWaalsContact O-CG 3.31Å; M517-L521 WeakPolarHBondContact O-CG 3.22Å; M517-L521 PolarHBondContact O-N 2.78Å
518	V	86.5	Confident	77.6	Confident	77 Å²	77	104.9 Å²	104.9	47%	0.467	57%	0.568	S	S	.	*	H	α-helix	trans	-64.1	-42.1	174.2	172.2	0	0	0	0	110.7	L514 V515 I520 L521 L522	L514-V518 WeakPolarHBondContact O-CB 3.32Å; L514-V518 VanDerWaalsContact O-CG2 3.28Å; L514-V518 WeakPolarHBondContact O-CG2 3.46Å; L514-V518 PolarHBondContact O-N 2.69Å; V515-V518 PolarHBondContact O-N 2.66Å; V518-I520 PolarHBondContact O-N 2.83Å; V518-L521 PolarHBondContact O-N 2.72Å; V518-L522 HydrophobicContact CG1-CD1 3.93Å; V518-L522 HydrophobicContact CG1-CG 4.3Å; V518-L522 WeakPolarHBondContact O-CB 3.22Å; V518-L522 WeakPolarHBondContact O-CG 3.4Å; V518-L522 PolarHBondContact O-N 3.05Å
519	T	84.8	Confident	77	Confident	82 Å²	82	108.8 Å²	108.8	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-63.9	-41.4	177.3	-28.3	0	0	0	0	111.9	V515 T516 L522 Y523	V515-T519 PolarHBondContact O-N 2.73Å; V515-T519 PolarHBondContact O-OG1 3.31Å; T516-T519 PolarHBondContact O-N 2.79Å; T519-L522 PolarHBondContact O-N 3.43Å; T519-Y523 VanDerWaalsContact O-CB 3.29Å; T519-Y523 WeakPolarHBondContact O-CB 3.44Å; T519-Y523 PolarHBondContact O-N 2.99Å
520	I	84.5	Confident	76.3	Confident	93 Å²	93	116.1 Å²	116.1	48%	0.477	60%	0.596	S	S	.	*	H	α-helix	trans	-65.4	-40.7	176.6	-68.4	165.2	0	0	0	110.8	T516 M517 V518 Y523 K524	T516-I520 VanDerWaalsContact O-CG1 3.25Å; T516-I520 WeakPolarHBondContact O-CG1 3.27Å; T516-I520 PolarHBondContact O-N 2.87Å; M517-I520 PolarHBondContact O-N 3.11Å; V518-I520 PolarHBondContact O-N 2.83Å; I520-Y523 PolarHBondContact O-N 3.2Å; I520-K524 WeakPolarHBondContact O-CB 3.39Å; I520-K524 PolarHBondContact O-N 2.75Å
521	L	85	Confident	75.5	Confident	109 Å²	109	118.7 Å²	118.7	57%	0.571	61%	0.611	S	S	*	*	H	α-helix	trans	-66	-42.8	177.1	-77.7	166.8	0	0	0	112	M517 V518 K524 K525	M517-L521 WeakPolarHBondContact O-CB 3.35Å; M517-L521 VanDerWaalsContact O-CG 3.31Å; M517-L521 WeakPolarHBondContact O-CG 3.22Å; M517-L521 PolarHBondContact O-N 2.78Å; V518-L521 PolarHBondContact O-N 2.72Å; L521-K524 PolarHBondContact O-N 2.99Å; L521-K525 WeakPolarHBondContact O-CB 3.12Å; L521-K525 PolarHBondContact O-N 3.12Å
522	L	82.7	Confident	74	Confident	95 Å²	95	121.5 Å²	121.5	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-65.1	-40.2	174.7	-70.5	174.6	0	0	0	111.6	V518 T519 K525 H526	V518-L522 HydrophobicContact CG1-CD1 3.93Å; V518-L522 HydrophobicContact CG1-CG 4.3Å; V518-L522 WeakPolarHBondContact O-CB 3.22Å; V518-L522 WeakPolarHBondContact O-CG 3.4Å; V518-L522 PolarHBondContact O-N 3.05Å; T519-L522 PolarHBondContact O-N 3.43Å; L522-K525 PolarHBondContact O-N 3.32Å; L522-H526 PolarHBondContact O-CD2 3.37Å; L522-H526 VanDerWaalsContact O-CD2 3.31Å; L522-H526 PolarHBondContact O-N 3.38Å
523	Y	80.9	Confident	72.6	Confident	152 Å²	152	121.8 Å²	121.8	60%	0.596	63%	0.634	S	S	*	*	H	α-helix	trans	-65.4	-41.1	176.7	-166.7	-95.4	0	0	0	112.1	T519 I520 K525 H526 K527	T519-Y523 VanDerWaalsContact O-CB 3.29Å; T519-Y523 WeakPolarHBondContact O-CB 3.44Å; T519-Y523 PolarHBondContact O-N 2.99Å; I520-Y523 PolarHBondContact O-N 3.2Å; Y523-K525 VanDerWaalsContact C-N 3.35Å; Y523-H526 PolarHBondContact O-N 3.05Å; Y523-K527 HydrophobicContact CE1-CD 4.26Å; Y523-K527 PolarHBondContact O-N 3.23Å
524	K	78.9	Confident	70.5	Confident	167 Å²	167	125.6 Å²	125.6	73%	0.726	65%	0.651	S	S	*	*	H	α-helix	trans	-65.5	-35.2	174	-86.2	-171.9	167.4	-179.3	0	112.6	I520 L521 H526	I520-K524 WeakPolarHBondContact O-CB 3.39Å; I520-K524 PolarHBondContact O-N 2.75Å; L521-K524 PolarHBondContact O-N 2.99Å; K524-H526 VanDerWaalsContact C-N 3.35Å
525	K	76.2	Confident	68.8	Low	182 Å²	182	126.1 Å²	126.1	79%	0.791	66%	0.663	S	S	*	*	H	α-helix	trans	-73.1	-24.7	-179.9	-157	-179.5	-179.6	-177.8	0	113.2	L521 L522 Y523	L521-K525 WeakPolarHBondContact O-CB 3.12Å; L521-K525 PolarHBondContact O-N 3.12Å; L522-K525 PolarHBondContact O-N 3.32Å; Y523-K525 VanDerWaalsContact C-N 3.35Å
526	H	66.9	Low	66.6	Low	155 Å²	155	127.8 Å²	127.8	72%	0.718	68%	0.676	S	S	*	*	H	α-helix	trans	-93.4	-10	-178.8	-79.2	-61.3	0	0	0	115.8	L522 Y523 K524 A528	L522-H526 PolarHBondContact O-CD2 3.37Å; L522-H526 VanDerWaalsContact O-CD2 3.31Å; L522-H526 PolarHBondContact O-N 3.38Å; Y523-H526 PolarHBondContact O-N 3.05Å; K524-H526 VanDerWaalsContact C-N 3.35Å; H526-A528 PolarHBondContact O-N 3.14Å; H526-A528 VanDerWaalsContact O-N 3.09Å
527	K	53.8	Low	64.3	Low	115 Å²	115	135.1 Å²	135.1	50%	0.5	70%	0.695	S	S	.	*			trans	-83.6	83.7	171.9	-99.3	-173.4	178.2	179.3	0	111.1	Y523 Y529	Y523-K527 HydrophobicContact CE1-CD 4.26Å; Y523-K527 PolarHBondContact O-N 3.23Å; K527-Y529 PolarHBondContact O-N 3.26Å
528	A	53.3	Low	62.1	Low	98 Å²	98	137.5 Å²	137.5	81%	0.81	71%	0.71	S	S	*	*			trans	-69.4	108.3	157.7	0	0	0	0	0	108.5	H526 K530	H526-A528 PolarHBondContact O-N 3.14Å; H526-A528 VanDerWaalsContact O-N 3.09Å; A528-K530 PolarHBondContact O-N 2.97Å
529	Y	54.4	Low	59.8	Low	204 Å²	204	140 Å²	140	80%	0.8	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-68.5	118.6	173.4	-74	-90.2	0	0	0	109.4	K527	K527-Y529 PolarHBondContact O-N 3.26Å
530	K	53.4	Low	57.8	Low	198 Å²	198	143.1 Å²	143.1	86%	0.861	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-81.8	128.1	166.9	-107.6	-176.5	177.2	-179.1	0	108.9	A528	A528-K530 PolarHBondContact O-N 2.97Å
531	P	60.1	Low	55.6	Low	124 Å²	124	148.6 Å²	148.6	81%	0.805	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-67.5	134.3	174	25.9	-31.1	0	0	0	110.8	G533	P531-G533 PolarHBondContact O-N 2.64Å
532	I	47.6	Very low	53.3	Low	171 Å²	171	146.7 Å²	146.7	88%	0.877	77%	0.771	S	S	*	*			trans	-76.3	115.9	174.4	-67.7	170.1	0	0	0	108
533	G	51.5	Low	51.2	Low	64 Å²	64	152.3 Å²	152.3	66%	0.66	79%	0.791	S	S	*	*			trans	-74.8	144.1	172.1	0	0	0	0	0	112.1	P531 C535	P531-G533 PolarHBondContact O-N 2.64Å; G533-C535 PolarHBondContact O-N 2.9Å
534	N	39.2	Very low	48.9	Very low	171 Å²	171	148.9 Å²	148.9	91%	0.914	80%	0.802	S	S	*	*			trans	-56.8	129.1	171.8	-84.4	-6.3	0	0	0	111.4
535	C	47.2	Very low	46.9	Very low	124 Å²	124	148.7 Å²	148.7	84%	0.838	81%	0.808	S	S	*	*			trans	-129.2	146.2	159	-90.7	0	0	0	0	110.2	G533	G533-C535 PolarHBondContact O-N 2.9Å
536	P	40.1	Very low	45	Very low	123 Å²	123	144.9 Å²	144.9	80%	0.799	80%	0.804	S	S	*	*			trans	-89.8	158.2	-158.2	29.8	-21.3	0	0	0	114.1
537	R	37.6	Very low	43.5	Very low	229 Å²	229	144.1 Å²	144.1	86%	0.864	81%	0.81	S	S	*	*			trans	-48.8	122.1	171.6	-178.3	175.5	174.5	156.8	-3.2	112.2
538	N	39.3	Very low	42.6	Very low	155 Å²	155	146.2 Å²	146.2	83%	0.829	83%	0.826	S	S	*	*			trans	-160.2	136.9	136.2	-95.1	-18.2	0	0	0	112.6
539	T	39.4	Very low	41.9	Very low	129 Å²	129	149.9 Å²	149.9	79%	0.791	83%	0.831	S	S	*	*			trans	-61.7	133.5	-175.8	31.9	0	0	0	0	115.2
540	V	42	Very low	41.1	Very low	148 Å²	148	144 Å²	144	90%	0.897	82%	0.82	S	S	*	*			trans	-144.2	126.3	144.6	-178	0	0	0	0	109.8
541	K	37.6	Very low	40.4	Very low	207 Å²	207	143.4 Å²	143.4	90%	0.9	82%	0.82	S	S	*	*			trans	-65.7	142.5	174.4	-80.1	171.8	169.7	174	0	111.6
542	G	38.1	Very low	39.4	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	81%	0.813	S	S	*	*			trans	-173.6	104.8	165.5	0	0	0	0	0	115.4
543	K	38.4	Very low	38.8	Very low	214 Å²	214	143 Å²	143	93%	0.93	81%	0.814	S	S	*	*			trans	68.1	105.3	147.2	-68.2	173	176.8	178.2	0	118.4
544	G	31.5	Very low	38	Very low	79 Å²	79	144.6 Å²	144.6	81%	0.814	82%	0.821	S	S	*	*			trans	-75.3	149.1	165.7	0	0	0	0	0	112.6
545	L	38.5	Very low	37.9	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	81%	0.811	S	S	*	*			trans	-134.4	126.8	166.1	-114.8	138.7	0	0	0	107.7
546	S	34.8	Very low	37.1	Very low	102 Å²	102	145 Å²	145	71%	0.713	81%	0.812	S	S	*	*			trans	-18.4	127.7	175.1	52.8	0	0	0	0	118.8
547	V	34.9	Very low	36.9	Very low	139 Å²	139	148.7 Å²	148.7	84%	0.842	82%	0.816	S	S	*	*			trans	-125.5	116.7	145.5	177.3	0	0	0	0	106.2
548	L	36.5	Very low	36.7	Very low	159 Å²	159	150.2 Å²	150.2	83%	0.832	82%	0.821	S	S	*	*			trans	-140.5	100.6	174.6	-121.2	160	0	0	0	107.3
549	L	38.6	Very low	36.5	Very low	175 Å²	175	145.8 Å²	145.8	92%	0.916	81%	0.812	S	S	*	*			trans	-114.6	103.7	166.2	-111.2	151.8	0	0	0	106.3
550	S	36	Very low	36.4	Very low	81 Å²	81	147.5 Å²	147.5	57%	0.566	82%	0.816	S	S	*	*			trans	-99.9	135.5	168.2	47.6	0	0	0	0	108.7
551	H	39.1	Very low	36.3	Very low	186 Å²	186	149.1 Å²	149.1	86%	0.861	81%	0.814	S	S	*	*			trans	168.7	106.5	143.8	-91.7	-68.2	0	0	0	106.9
552	A	39.6	Very low	36.3	Very low	80 Å²	80	146.5 Å²	146.5	66%	0.661	81%	0.805	S	S	*	*				85.5	108.7	73.1	0	0	0	0	0	114.3
553	K	35.8	Very low	36.4	Very low	207 Å²	207	152.1 Å²	152.1	90%	0.9	81%	0.81	S	S	*	*			trans	72.6	118.1	142.1	-71.2	-178.5	176.5	177.9	0	121.4
554	A	34.3	Very low	36.6	Very low	97 Å²	97	148.5 Å²	148.5	80%	0.802	80%	0.801	S	S	*	*				117.4	134.4	121.9	0	0	0	0	0	116.1
555	P	35.9	Very low	36.8	Very low	109 Å²	109	150.3 Å²	150.3	71%	0.708	80%	0.798	S	S	*	*			trans	-106.8	128.6	-161.8	35.4	-21.7	0	0	0	112.2
556	F	31.9	Very low	36.6	Very low	194 Å²	194	149.6 Å²	149.6	85%	0.851	79%	0.794	S	S	*	*			trans	-156.2	140.1	156.1	-84.2	-74.2	0	0	0	109.4
557	F	35.1	Very low	36.7	Very low	201 Å²	201	152.9 Å²	152.9	88%	0.882	80%	0.803	S	S	*	*			trans	86.6	107.5	173.7	-58	-75.6	0	0	0	118.3
558	R	32.7	Very low	36.9	Very low	260 Å²	260	156 Å²	156	98%	0.981	81%	0.808	S	S	*	*			trans	-80.5	115.8	163.9	-164.7	-179.4	-159.5	177.8	3	106.1
559	G	36.4	Very low	37.1	Very low	62 Å²	62	155.5 Å²	155.5	64%	0.639	81%	0.807	S	S	*	*			trans	-159	109.2	-179.5	0	0	0	0	0	110
560	D	36.5	Very low	37.1	Very low	165 Å²	165	155.8 Å²	155.8	88%	0.882	80%	0.801	S	S	*	*			trans	14.3	110	154.2	-50.4	-34.5	0	0	0	117.9
561	Q	38.9	Very low	37.4	Very low	183 Å²	183	158 Å²	158	86%	0.855	81%	0.813	S	S	*	*			trans	-114.8	98.6	150.8	-88.4	-165.4	-6.4	0	0	109	K563	Q561-K563 PolarHBondContact O-N 2.98Å
562	E	38.7	Very low	37.4	Very low	151 Å²	151	161 Å²	161	71%	0.706	82%	0.817	S	S	*	*			trans	-58.2	120.5	157.8	-174.7	166.6	-166.9	0	0	108.5	K245	K245-E562 IonicContact NZ-OE1 3.44Å; K245-E562 PolarHBondContact NZ-OE1 2.79Å
563	K	40.7	Very low	37.5	Very low	187 Å²	187	163.7 Å²	163.7	81%	0.813	83%	0.825	S	S	*	*			trans	-91.3	112.9	169	-79.9	-177.5	178.2	175.4	0	108.4	Q561 P565	Q561-K563 PolarHBondContact O-N 2.98Å; K563-P565 WeakPolarHBondContact O-CD 3.5Å
564	D	41.4	Very low	37.7	Very low	139 Å²	139	165.2 Å²	165.2	74%	0.743	84%	0.842	S	S	*	*			trans	-55.2	124.8	167.4	-148.9	-9.5	0	0	0	111.1
565	P	37	Very low	37.9	Very low	116 Å²	116	168.7 Å²	168.7	75%	0.753	84%	0.844	S	S	*	*			trans	-117.5	71.2	167.5	35.8	-19.6	0	0	0	109.9	K563	K563-P565 WeakPolarHBondContact O-CD 3.5Å
566	L	34.2	Very low	38	Very low	148 Å²	148	171.8 Å²	171.8	78%	0.775	85%	0.851	S	S	*	*			trans	-118.4	91.9	163	-74.3	174.2	0	0	0	109.2
567	L	36.8	Very low	38.3	Very low	172 Å²	172	170.6 Å²	170.6	90%	0.901	85%	0.851	S	S	*	*			trans	148.1	85	152.8	-81.8	159.9	0	0	0	109.7
568	Q	39.1	Very low	38.5	Very low	203 Å²	203	168.8 Å²	168.8	95%	0.949	85%	0.85	S	S	*	*			trans	-139.2	132.6	140.2	-78.4	-158.3	-7	0	0	111.1
569	D	40.8	Very low	38.9	Very low	149 Å²	149	163.1 Å²	163.1	80%	0.797	84%	0.841	S	S	*	*			trans	-74.4	148.6	-162.7	-126.6	-32.9	0	0	0	113.8
570	K	38.3	Very low	39	Very low	181 Å²	181	169.8 Å²	169.8	79%	0.787	86%	0.855	S	S	*	*			trans	22.2	134.8	149.9	-92.3	170.1	173.6	168.8	0	121.4
571	P	41.7	Very low	39.2	Very low	127 Å²	127	170.1 Å²	170.1	83%	0.825	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-77.8	132.6	162.7	32.7	-28.9	0	0	0	110.6
572	R	40.1	Very low	39.3	Very low	249 Å²	249	169.2 Å²	169.2	94%	0.94	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-96	119.4	161.2	-104.5	-173.8	-173.1	173	3.3	109.2
573	T	41.2	Very low	39.3	Very low	137 Å²	137	170.7 Å²	170.7	84%	0.84	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-56.2	128.1	160.8	-18.8	0	0	0	0	111
574	L	40.3	Very low	39.2	Very low	240 Å²	240	169.2 Å²	169.2	100%	1.257	87%	0.87	S	S	*	*			trans	-157.5	0	138.7	-117.3	164.8	0	0	0	108.3

Retrieved 574 of 574 residues in 1115.3 ms (Link to these results)

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