A0A096NB14_PAPAN Loading...

ADAM metallopeptidase domain 21

AlphaFold DB , UniProt , Accession A0A096NB14, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 722 aa.

Structure Viewer

Loading PAE data...

(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	46.8	Very low	50.1	Low	246 Å²	246	128.1 Å²	128.1	100%	1.212	69%	0.693	S	S	*	*				0	86.2	0	-68.4	171.3	75.1	0	0	108.8
2	A	47.1	Very low	50.8	Low	95 Å²	95	123.6 Å²	123.6	79%	0.785	67%	0.672	S	S	*	*			trans	-177.2	55	168.6	0	0	0	0	0	110.1
3	V	44.8	Very low	51.7	Low	124 Å²	124	117.8 Å²	117.8	75%	0.752	65%	0.651	S	S	*	*	S	Bend	trans	-135.9	-11.6	172.7	-172.3	0	0	0	0	112.5
4	D	48.2	Very low	52.2	Low	137 Å²	137	116.6 Å²	116.6	73%	0.733	64%	0.642	S	S	*	*	H	α-helix	trans	-92	-11.7	-174	-140.4	9.4	0	0	0	114.3
5	G	45.7	Very low	52.4	Low	53 Å²	53	116.5 Å²	116.5	55%	0.546	64%	0.64	S	S	.	*	H	α-helix	trans	-85	-28.4	-177.9	0	0	0	0	0	114.8
6	T	50.4	Low	52.7	Low	96 Å²	96	116.4 Å²	116.4	59%	0.589	64%	0.638	S	S	*	*	H	α-helix	trans	-82.4	-29.7	-174.2	20.8	0	0	0	0	113.1	I10	T6-I10 WeakPolarHBondContact O-CG1 3.43Å; T6-I10 PolarHBondContact O-N 3.49Å
7	L	48	Very low	53	Low	105 Å²	105	116.6 Å²	116.6	55%	0.55	64%	0.637	S	S	.	*	H	α-helix	trans	-73.8	-32.6	178.4	-160	76	0	0	0	112.3	R11	L7-R11 PolarHBondContact O-N 3.35Å
8	V	54.9	Low	52.9	Low	87 Å²	87	119.4 Å²	119.4	53%	0.527	64%	0.637	S	S	.	*	H	α-helix	trans	-70.4	-41	176.7	179.7	0	0	0	0	110.8	I10 R11 V12	V8-I10 PolarHBondContact O-N 3.04Å; V8-R11 PolarHBondContact O-N 3.4Å; V8-V12 HydrophobicContact CG1-CG2 4.36Å; V8-V12 VanDerWaalsContact O-CG2 3.31Å; V8-V12 WeakPolarHBondContact O-CG2 3.35Å; V8-V12 PolarHBondContact O-N 2.94Å
9	Y	53.5	Low	52.7	Low	189 Å²	189	118.6 Å²	118.6	74%	0.741	63%	0.632	S	S	*	*	H	α-helix	trans	-64.9	-38.1	178.6	-116	-89.7	0	0	0	113	A13	Y9-A13 VanDerWaalsContact O-CB 3.26Å; Y9-A13 WeakPolarHBondContact O-CB 3.18Å; Y9-A13 PolarHBondContact O-N 2.62Å
10	I	56.8	Low	52.4	Low	103 Å²	103	114.4 Å²	114.4	53%	0.528	62%	0.617	S	S	.	*	H	α-helix	trans	-70	-38.9	178.2	-67.5	169.6	0	0	0	111.1	T6 V8 L14	T6-I10 WeakPolarHBondContact O-CG1 3.43Å; T6-I10 PolarHBondContact O-N 3.49Å; V8-I10 PolarHBondContact O-N 3.04Å; I10-L14 HydrophobicContact CG2-CD1 3.93Å; I10-L14 WeakPolarHBondContact O-CB 3.31Å; I10-L14 PolarHBondContact O-N 2.99Å
11	R	54.7	Low	52.4	Low	174 Å²	174	112.7 Å²	112.7	66%	0.657	61%	0.611	S	S	*	*	H	α-helix	trans	-68.1	-39	176.3	-80.2	-176	172.6	-174.8	-1.4	112.9	L7 V8 L15	L7-R11 PolarHBondContact O-N 3.35Å; V8-R11 PolarHBondContact O-N 3.4Å; R11-L15 WeakPolarHBondContact O-CB 3.32Å; R11-L15 WeakPolarHBondContact O-CG 3.22Å; R11-L15 PolarHBondContact O-N 3.21Å
12	V	59.1	Low	52.3	Low	74 Å²	74	107.1 Å²	107.1	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-70.4	-39.1	176.7	174.6	0	0	0	0	111.1	V8 L15 L16	V8-V12 HydrophobicContact CG1-CG2 4.36Å; V8-V12 VanDerWaalsContact O-CG2 3.31Å; V8-V12 WeakPolarHBondContact O-CG2 3.35Å; V8-V12 PolarHBondContact O-N 2.94Å; V12-L15 PolarHBondContact O-N 3.11Å; V12-L16 HydrophobicContact CG1-CD1 3.92Å; V12-L16 HydrophobicContact CG1-CG 4.47Å; V12-L16 WeakPolarHBondContact O-CB 3.43Å; V12-L16 WeakPolarHBondContact O-CG 3.46Å; V12-L16 PolarHBondContact O-N 3.18Å
13	A	62	Low	52	Low	48 Å²	48	108.1 Å²	108.1	40%	0.397	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-41.2	175	0	0	0	0	0	112.3	Y9 L16 L17	Y9-A13 VanDerWaalsContact O-CB 3.26Å; Y9-A13 WeakPolarHBondContact O-CB 3.18Å; Y9-A13 PolarHBondContact O-N 2.62Å; A13-L16 PolarHBondContact O-N 3.19Å; A13-L17 WeakPolarHBondContact O-CB 3.47Å; A13-L17 PolarHBondContact O-N 3.1Å
14	L	58.7	Low	51.6	Low	101 Å²	101	107.1 Å²	107.1	53%	0.529	57%	0.57	S	S	.	*	H	α-helix	trans	-66.5	-37.8	174.9	-93.1	152.6	0	0	0	112.8	I10 L17 W18	I10-L14 HydrophobicContact CG2-CD1 3.93Å; I10-L14 WeakPolarHBondContact O-CB 3.31Å; I10-L14 PolarHBondContact O-N 2.99Å; L14-L17 PolarHBondContact O-N 2.99Å; L14-W18 WeakPolarHBondContact O-CB 3.46Å; L14-W18 PolarHBondContact O-N 2.85Å
15	L	55.7	Low	51.1	Low	116 Å²	116	106.2 Å²	106.2	61%	0.607	56%	0.564	S	S	*	*	H	α-helix	trans	-68.2	-37.8	175.1	-84.6	161.4	0	0	0	112.4	R11 V12 W18 L19	R11-L15 WeakPolarHBondContact O-CB 3.32Å; R11-L15 WeakPolarHBondContact O-CG 3.22Å; R11-L15 PolarHBondContact O-N 3.21Å; V12-L15 PolarHBondContact O-N 3.11Å; L15-W18 PolarHBondContact O-N 3.23Å; L15-L19 WeakPolarHBondContact O-CB 3.36Å; L15-L19 PolarHBondContact O-N 3.46Å
16	L	57.3	Low	50.7	Low	115 Å²	115	108.3 Å²	108.3	60%	0.602	57%	0.57	S	S	*	*	H	α-helix	trans	-71.8	-34	174.9	-72.6	168.4	0	0	0	112.3	V12 A13 L19 G20	V12-L16 HydrophobicContact CG1-CD1 3.92Å; V12-L16 HydrophobicContact CG1-CG 4.47Å; V12-L16 WeakPolarHBondContact O-CB 3.43Å; V12-L16 WeakPolarHBondContact O-CG 3.46Å; V12-L16 PolarHBondContact O-N 3.18Å; A13-L16 PolarHBondContact O-N 3.19Å; L16-L19 PolarHBondContact O-N 3.4Å; L16-G20 PolarHBondContact O-N 3.32Å
17	L	57.4	Low	50	Low	119 Å²	119	106.8 Å²	106.8	62%	0.623	57%	0.574	S	S	*	*	H	α-helix	trans	-67.8	-40.4	170.8	-103.5	135.3	0	0	0	111.7	A13 L14 G20 V21	A13-L17 WeakPolarHBondContact O-CB 3.47Å; A13-L17 PolarHBondContact O-N 3.1Å; L14-L17 PolarHBondContact O-N 2.99Å; L17-G20 PolarHBondContact O-N 3.45Å; L17-V21 VanDerWaalsContact O-CG2 3.28Å; L17-V21 WeakPolarHBondContact O-CG2 3.24Å; L17-V21 PolarHBondContact O-N 3.22Å
18	W	51.6	Low	49.2	Very low	168 Å²	168	111.4 Å²	111.4	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-65.8	-41.6	172.4	-99.4	50.6	0	0	0	112.1	L14 L15 G20 V21 F22	L14-W18 WeakPolarHBondContact O-CB 3.46Å; L14-W18 PolarHBondContact O-N 2.85Å; L15-W18 PolarHBondContact O-N 3.23Å; W18-G20 VanDerWaalsContact C-N 3.31Å; W18-G20 PolarHBondContact O-N 3.33Å; W18-V21 PolarHBondContact O-N 2.99Å; W18-F22 HydrophobicContact CD2-CE2 4.4Å; W18-F22 HydrophobicContact CE3-CD2 4.29Å; W18-F22 AromaticContact CE3-CE2 3.65Å; W18-F22 HydrophobicContact CE3-CE2 3.65Å; W18-F22 AromaticContact CZ3-CE2 3.84Å; W18-F22 HydrophobicContact CZ3-CE2 3.84Å; W18-F22 WeakPolarHBondContact O-CD2 3.1Å; W18-F22 PolarHBondContact O-N 3.1Å
19	L	49.3	Very low	47.9	Very low	104 Å²	104	113.3 Å²	113.3	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-63.7	-37.3	174	-128.2	87.5	0	0	0	111.7	L15 L16 F22 L23	L15-L19 WeakPolarHBondContact O-CB 3.36Å; L15-L19 PolarHBondContact O-N 3.46Å; L16-L19 PolarHBondContact O-N 3.4Å; L19-F22 PolarHBondContact O-N 2.66Å; L19-L23 HydrophobicContact CD2-CD1 4.38Å; L19-L23 VanDerWaalsContact O-CB 3.26Å; L19-L23 WeakPolarHBondContact O-CB 3.37Å; L19-L23 WeakPolarHBondContact O-CD1 3.3Å; L19-L23 WeakPolarHBondContact O-CG 3.15Å; L19-L23 PolarHBondContact O-N 3.06Å
20	G	47.1	Very low	46.7	Very low	33 Å²	33	111.5 Å²	111.5	34%	0.34	60%	0.599	S	S	.	*	H	α-helix	trans	-66.4	-35.9	174.5	0	0	0	0	0	113.2	L16 L17 W18 S24	L16-G20 PolarHBondContact O-N 3.32Å; L17-G20 PolarHBondContact O-N 3.45Å; W18-G20 VanDerWaalsContact C-N 3.31Å; W18-G20 PolarHBondContact O-N 3.33Å; G20-S24 VanDerWaalsContact O-CB 3.31Å; G20-S24 WeakPolarHBondContact O-CB 3.48Å; G20-S24 PolarHBondContact O-N 2.04Å; G20-S24 PolarHBondContact O-OG 3.16Å
21	V	51.3	Low	45.5	Very low	79 Å²	79	110.8 Å²	110.8	48%	0.479	61%	0.609	S	S	.	*	H	α-helix	trans	-72.2	-41	173.8	171.4	0	0	0	0	111.2	L17 W18 S24 I25	L17-V21 VanDerWaalsContact O-CG2 3.28Å; L17-V21 WeakPolarHBondContact O-CG2 3.24Å; L17-V21 PolarHBondContact O-N 3.22Å; W18-V21 PolarHBondContact O-N 2.99Å; V21-S24 PolarHBondContact O-N 3.42Å; V21-I25 HydrophobicContact CG1-CD1 4.08Å; V21-I25 WeakPolarHBondContact O-CD1 3.31Å; V21-I25 VanDerWaalsContact O-CG1 3.31Å; V21-I25 WeakPolarHBondContact O-CG1 3.45Å; V21-I25 PolarHBondContact O-N 3.24Å
22	F	44.1	Very low	44.4	Very low	129 Å²	129	104.7 Å²	104.7	57%	0.566	60%	0.6	S	S	*	*	H	α-helix	trans	-69.7	-33.8	175.4	-88.3	-78	0	0	0	113.3	W18 L19 S24 I25	W18-F22 HydrophobicContact CD2-CE2 4.4Å; W18-F22 HydrophobicContact CE3-CD2 4.29Å; W18-F22 AromaticContact CE3-CE2 3.65Å; W18-F22 HydrophobicContact CE3-CE2 3.65Å; W18-F22 AromaticContact CZ3-CE2 3.84Å; W18-F22 HydrophobicContact CZ3-CE2 3.84Å; W18-F22 WeakPolarHBondContact O-CD2 3.1Å; W18-F22 PolarHBondContact O-N 3.1Å; L19-F22 PolarHBondContact O-N 2.66Å; F22-S24 VanDerWaalsContact C-N 3.33Å; F22-I25 PolarHBondContact O-N 3.45Å
23	L	41.7	Very low	43.1	Very low	117 Å²	117	106.2 Å²	106.2	61%	0.613	61%	0.612	S	S	*	*	H	α-helix	trans	-74.1	-24.1	173.2	-71.9	166.3	0	0	0	112.3	L19 S26	L19-L23 HydrophobicContact CD2-CD1 4.38Å; L19-L23 VanDerWaalsContact O-CB 3.26Å; L19-L23 WeakPolarHBondContact O-CB 3.37Å; L19-L23 WeakPolarHBondContact O-CD1 3.3Å; L19-L23 WeakPolarHBondContact O-CG 3.15Å; L19-L23 PolarHBondContact O-N 3.06Å; L23-S26 PolarHBondContact O-OG 3.3Å
24	S	36.3	Very low	41.9	Very low	102 Å²	102	107.2 Å²	107.2	71%	0.713	62%	0.616	S	S	*	*	H	α-helix	trans	-80.2	-12.1	173	-57.2	0	0	0	0	114	G20 V21 F22	G20-S24 VanDerWaalsContact O-CB 3.31Å; G20-S24 WeakPolarHBondContact O-CB 3.48Å; G20-S24 PolarHBondContact O-N 2.04Å; G20-S24 PolarHBondContact O-OG 3.16Å; V21-S24 PolarHBondContact O-N 3.42Å; F22-S24 VanDerWaalsContact C-N 3.33Å
25	I	38.1	Very low	41.2	Very low	119 Å²	119	108.6 Å²	108.6	61%	0.61	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-4.6	176.5	-65.9	163	0	0	0	112.1	V21 F22 G27	V21-I25 HydrophobicContact CG1-CD1 4.08Å; V21-I25 WeakPolarHBondContact O-CD1 3.31Å; V21-I25 VanDerWaalsContact O-CG1 3.31Å; V21-I25 WeakPolarHBondContact O-CG1 3.45Å; V21-I25 PolarHBondContact O-N 3.24Å; F22-I25 PolarHBondContact O-N 3.45Å; I25-G27 VanDerWaalsContact C-N 3.33Å; I25-G27 PolarHBondContact O-N 3.31Å
26	S	37.2	Very low	40.8	Very low	97 Å²	97	105.1 Å²	105.1	68%	0.678	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	15.3	177.8	65.8	0	0	0	0	115.4	L23	L23-S26 PolarHBondContact O-OG 3.3Å
27	G	36.1	Very low	40.5	Very low	64 Å²	64	106 Å²	106	66%	0.66	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	14.3	-175.4	0	0	0	0	0	116.2	I25	I25-G27 VanDerWaalsContact C-N 3.33Å; I25-G27 PolarHBondContact O-N 3.31Å
28	Y	31.3	Very low	40.6	Very low	202 Å²	202	102 Å²	102	79%	0.792	58%	0.579	S	S	*	*			trans	-114.8	64.5	174.5	-120.6	-99.5	0	0	0	110.4	Q30	Y28-Q30 HydrophobicContact CD1-CG 3.86Å; Y28-Q30 HydrophobicContact CE1-CG 3.98Å; Y28-Q30 PolarHBondContact O-N 3.1Å
29	C	26.4	Very low	41.6	Very low	127 Å²	127	99.6 Å²	99.6	86%	0.858	59%	0.589	S	S	*	*			trans	-64.1	97.7	146.1	-81.5	0	0	0	0	106	A31	C29-A31 PolarHBondContact O-N 3.17Å
30	Q	28.9	Very low	43.2	Very low	150 Å²	150	97.4 Å²	97.4	70%	0.701	58%	0.581	S	S	*	*			trans	-62.3	85.9	156.3	-96.4	172.1	-6.5	0	0	106.9	Y28 G32	Y28-Q30 HydrophobicContact CD1-CG 3.86Å; Y28-Q30 HydrophobicContact CE1-CG 3.98Å; Y28-Q30 PolarHBondContact O-N 3.1Å; Q30-G32 PolarHBondContact O-N 2.75Å
31	A	30.9	Very low	45.2	Very low	89 Å²	89	99.3 Å²	99.3	74%	0.736	58%	0.581	S	S	*	*			trans	-56.3	114.6	144.5	0	0	0	0	0	105.1	C29	C29-A31 PolarHBondContact O-N 3.17Å
32	G	31.9	Very low	47.1	Very low	46 Å²	46	99.5 Å²	99.5	47%	0.474	58%	0.582	S	S	.	*			trans	-52.5	141.6	167.5	0	0	0	0	0	108	Q30 S34	Q30-G32 PolarHBondContact O-N 2.75Å; G32-S34 VanDerWaalsContact C-N 3.28Å; G32-S34 PolarHBondContact O-N 2.92Å
33	P	31.4	Very low	49.3	Very low	106 Å²	106	93.5 Å²	93.5	69%	0.688	56%	0.556	S	S	*	*			trans	-71.4	90.8	179.2	28.9	-30.4	0	0	0	107.9
34	S	37.2	Very low	51.6	Low	68 Å²	68	91.5 Å²	91.5	48%	0.476	55%	0.545	S	S	.	.			trans	-86.8	115	157.2	59.3	0	0	0	0	106.9	G32 H36	G32-S34 VanDerWaalsContact C-N 3.28Å; G32-S34 PolarHBondContact O-N 2.92Å; S34-H36 VanDerWaalsContact CB-CD2 3.49Å; S34-H36 WeakPolarHBondContact CB-CD2 3.46Å; S34-H36 VanDerWaalsContact CB-NE2 3.31Å; S34-H36 WeakPolarHBondContact CB-NE2 3.03Å; S34-H36 PolarHBondContact O-N 2.04Å; S34-H36 PolarHBondContact OG-CD2 3.49Å; S34-H36 PolarHBondContact OG-NE2 3.44Å; S34-H36 VanDerWaalsContact OG-NE2 3.1Å
35	Q	44	Very low	54.1	Low	131 Å²	131	86.9 Å²	86.9	61%	0.612	51%	0.513	S	S	*	.			trans	-74.1	72.7	172.3	-74.6	-175.3	-4.1	0	0	108.9	F37	Q35-F37 HydrophobicContact CB-CD2 4.33Å; Q35-F37 HydrophobicContact CB-CE2 3.65Å; Q35-F37 HydrophobicContact CB-CZ 3.84Å; Q35-F37 HydrophobicContact CG-CZ 4.3Å; Q35-F37 VanDerWaalsContact O-CD2 3.24Å; Q35-F37 WeakPolarHBondContact O-CD2 2.95Å; Q35-F37 WeakPolarHBondContact O-CE2 3.25Å; Q35-F37 PolarHBondContact O-N 2.99Å; Q35-F37 VanDerWaalsContact OE1-CZ 3.26Å
36	H	46.7	Very low	56.4	Low	42 Å²	42	86.3 Å²	86.3	19%	0.194	51%	0.51	C	S	.	.			trans	-82.8	106.3	165.7	-62.7	-57.5	0	0	0	108.3	S34 T38 E144 Y159	S34-H36 VanDerWaalsContact CB-CD2 3.49Å; S34-H36 WeakPolarHBondContact CB-CD2 3.46Å; S34-H36 VanDerWaalsContact CB-NE2 3.31Å; S34-H36 WeakPolarHBondContact CB-NE2 3.03Å; S34-H36 PolarHBondContact O-N 2.04Å; S34-H36 PolarHBondContact OG-CD2 3.49Å; S34-H36 PolarHBondContact OG-NE2 3.44Å; S34-H36 VanDerWaalsContact OG-NE2 3.1Å; H36-T38 PolarHBondContact O-N 3.34Å; H36-E144 IonicContact CE1-OE2 3.97Å; H36-Y159 HydrophobicContact CB-CD1 3.33Å; H36-Y159 HydrophobicContact CB-CE1 3.6Å; H36-Y159 HydrophobicContact CB-CG 3.99Å; H36-Y159 AromaticContact CD2-CD1 3.6Å; H36-Y159 AromaticContact CD2-CD2 3.89Å; H36-Y159 AromaticContact CD2-CE1 3.21Å; H36-Y159 WeakPolarHBondContact CD2-CE1 3.23Å; H36-Y159 AromaticContact CD2-CE2 3.57Å; H36-Y159 AromaticContact CD2-CG 3.89Å; H36-Y159 AromaticContact CD2-CZ 3.2Å; H36-Y159 AromaticContact CE1-CD2 3.57Å; H36-Y159 AromaticContact CE1-CE2 3.78Å; H36-Y159 AromaticContact CE1-CG 3.84Å; H36-Y159 AromaticContact CG-CD1 3.28Å; H36-Y159 AromaticContact CG-CD2 3.95Å; H36-Y159 AromaticContact CG-CE1 3.41Å; H36-Y159 VanDerWaalsContact CG-CE1 3.41Å; H36-Y159 AromaticContact CG-CG 3.53Å; H36-Y159 AromaticContact CG-CZ 3.83Å; H36-Y159 AromaticContact ND1-CD1 3.78Å; H36-Y159 AromaticContact ND1-CD2 3.75Å; H36-Y159 AromaticContact ND1-CG 3.5Å; H36-Y159 AromaticContact NE2-CD2 3.7Å; H36-Y159 AromaticContact NE2-CE1 3.98Å; H36-Y159 AromaticContact NE2-CE2 3.4Å; H36-Y159 WeakPolarHBondContact NE2-CE2 3.41Å; H36-Y159 AromaticContact NE2-CZ 3.54Å
37	F	51.3	Low	58.7	Low	135 Å²	135	88.7 Å²	88.7	59%	0.592	51%	0.508	S	S	*	.			trans	-76.6	4.7	-174.9	-67.9	-83.7	0	0	0	114.2	Q35	Q35-F37 HydrophobicContact CB-CD2 4.33Å; Q35-F37 HydrophobicContact CB-CE2 3.65Å; Q35-F37 HydrophobicContact CB-CZ 3.84Å; Q35-F37 HydrophobicContact CG-CZ 4.3Å; Q35-F37 VanDerWaalsContact O-CD2 3.24Å; Q35-F37 WeakPolarHBondContact O-CD2 2.95Å; Q35-F37 WeakPolarHBondContact O-CE2 3.25Å; Q35-F37 PolarHBondContact O-N 2.99Å; Q35-F37 VanDerWaalsContact OE1-CZ 3.26Å
38	T	59.3	Low	61.1	Low	33 Å²	33	87.3 Å²	87.3	20%	0.202	49%	0.487	C	S	.	.	S	Bend	trans	-133.1	142.2	174.8	53.7	0	0	0	0	110.7	H36 K160 N162	H36-T38 PolarHBondContact O-N 3.34Å; T38-K160 PolarHBondContact OG1-N 3.31Å; T38-K160 PolarHBondContact OG1-O 3.45Å; T38-K160 VanDerWaalsContact OG1-O 3.11Å; T38-N162 VanDerWaalsContact CG2-ND2 3.31Å; T38-N162 WeakPolarHBondContact CG2-ND2 3.33Å
39	S	73.2	Confident	62.8	Low	119 Å²	119	85.5 Å²	85.5	83%	0.832	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-55.6	127.9	172.3	-54.6	0	0	0	0	110.5
40	P	82.6	Confident	64.1	Low	58 Å²	58	81.1 Å²	81.1	38%	0.377	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-66.2	144.5	179.8	21.2	-28.5	0	0	0	111.9	L157 V158 Y159	P40-L157 HydrophobicContact CB-CB 4.06Å; P40-L157 HydrophobicContact CB-CD2 3.97Å; P40-L157 HydrophobicContact CB-CG 4.5Å; P40-L157 HydrophobicContact CG-CD2 4.16Å; P40-V158 WeakPolarHBondContact CA-O 3.39Å; P40-Y159 HydrophobicContact CB-CD1 3.73Å; P40-Y159 HydrophobicContact CB-CE1 3.43Å; P40-Y159 VanDerWaalsContact CB-CE1 3.43Å; P40-Y159 HydrophobicContact CG-CD1 4.31Å; P40-Y159 HydrophobicContact CG-CE1 3.68Å
41	E	89.9	Confident	65.1	Low	73 Å²	73	85.9 Å²	85.9	34%	0.341	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130.9	164.3	-172	173.9	178.4	0	0	108.7	V43 G68 V158	E41-V43 HydrophobicContact CG-CG1 4.25Å; E41-G68 PolarHBondContact OE1-N 2.83Å; E41-G68 VanDerWaalsContact OE1-N 3.1Å; E41-G68 PolarHBondContact OE2-N 3.1Å; E41-V158 PolarHBondContact N-O 2.96Å; E41-V158 PolarHBondContact O-N 3.43Å
42	V	90.1	Very high	65.8	Low	82 Å²	82	82.9 Å²	82.9	50%	0.497	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	123.9	173.7	-178	0	0	0	0	108.6	E155 H156 L157	V42-E155 HydrophobicContact CG1-CB 4.23Å; V42-E155 HydrophobicContact CG1-CG 4.25Å; V42-H156 WeakPolarHBondContact CA-O 3.18Å; V42-L157 HydrophobicContact CG2-CD2 3.98Å
43	V	90.8	Very high	66.2	Low	4 Å²	4	93 Å²	93	2%	0.024	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.5	179.4	-51.4	0	0	0	0	110.8	E41 L65 R66 L67 I145 H156 V158	E41-V43 HydrophobicContact CG-CG1 4.25Å; V43-L65 HydrophobicContact CG2-CD2 4.33Å; V43-R66 VanDerWaalsContact CG1-O 3.23Å; V43-R66 WeakPolarHBondContact CG1-O 3.26Å; V43-L67 HydrophobicContact CG1-CD1 4.03Å; V43-I145 HydrophobicContact CG2-CD1 4.14Å; V43-H156 HydrophobicContact CG2-CB 3.81Å; V43-H156 PolarHBondContact N-O 3.37Å; V43-H156 PolarHBondContact O-N 3.04Å; V43-V158 HydrophobicContact CB-CG2 4.25Å; V43-V158 HydrophobicContact CG1-CB 4.42Å; V43-V158 HydrophobicContact CG1-CG2 3.75Å; V43-V158 HydrophobicContact CG2-CG2 3.43Å; V43-V158 VanDerWaalsContact CG2-CG2 3.43Å
44	I	88.9	Confident	66.7	Low	74 Å²	74	92 Å²	92	38%	0.379	47%	0.469	S	S	.	.			trans	-120.9	105.7	173.9	-59.2	175.4	0	0	0	107.9	L46 T153 E155	I44-L46 HydrophobicContact CG2-CD2 4.11Å; I44-L46 PolarHBondContact O-N 3.13Å; I44-T153 WeakPolarHBondContact CG2-O 3.45Å; I44-E155 HydrophobicContact CD1-CG 3.94Å; I44-E155 HydrophobicContact CG1-CG 3.71Å
45	P	89.7	Confident	66.9	Low	6 Å²	6	90 Å²	90	4%	0.039	46%	0.457	C	S	.	.			trans	-66.3	121.7	175.7	-16.4	28.1	0	0	0	111.5	Y63 L65 F132 F154 H156	P45-Y63 HydrophobicContact CB-CD1 3.99Å; P45-L65 HydrophobicContact CB-CD2 3.59Å; P45-L65 HydrophobicContact CG-CD2 3.55Å; P45-F132 HydrophobicContact CB-CD2 3.85Å; P45-F132 HydrophobicContact CB-CE2 3.69Å; P45-F132 HydrophobicContact CG-CD2 3.72Å; P45-F132 HydrophobicContact CG-CE2 4.1Å; P45-F154 HydrophobicContact CB-CD1 4.26Å; P45-F154 HydrophobicContact CB-CE1 4.1Å; P45-F154 VanDerWaalsContact CD-O 3.3Å; P45-F154 WeakPolarHBondContact CD-O 3.38Å; P45-F154 HydrophobicContact CG-CD1 4.17Å; P45-F154 HydrophobicContact CG-CE1 4.1Å; P45-H156 WeakPolarHBondContact CD-ND1 3.39Å; P45-H156 VanDerWaalsContact CG-ND1 3.27Å; P45-H156 WeakPolarHBondContact CG-ND1 3.42Å
46	L	87.5	Confident	66.8	Low	107 Å²	107	92.9 Å²	92.9	56%	0.56	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	121	179.3	-63.1	174.8	0	0	0	110.4	I44 V48 Y63 S64	I44-L46 HydrophobicContact CG2-CD2 4.11Å; I44-L46 PolarHBondContact O-N 3.13Å; L46-V48 PolarHBondContact O-N 3.43Å; L46-Y63 CarbonylContact O-C 3.58Å; L46-Y63 WeakPolarHBondContact O-CA 3.4Å; L46-S64 PolarHBondContact N-O 2.97Å; L46-S64 PolarHBondContact O-N 2.92Å
47	K	85.1	Confident	66.7	Low	146 Å²	146	93 Å²	93	64%	0.635	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	130.3	176	-168.9	173.4	-177.8	174.1	0	110.1	Y63	K47-Y63 HydrophobicContact CB-CD1 4.17Å; K47-Y63 HydrophobicContact CB-CE1 3.75Å; K47-Y63 HydrophobicContact CG-CE1 4.32Å
48	V	84.9	Confident	66.7	Low	36 Å²	36	92.3 Å²	92.3	22%	0.218	49%	0.485	C	S	.	.			trans	-123	143.7	-179.2	-69.4	0	0	0	0	111.7	L46 S62 V73	L46-V48 PolarHBondContact O-N 3.43Å; V48-S62 PolarHBondContact N-O 2.93Å; V48-V73 HydrophobicContact CG2-CG1 3.95Å
49	I	68.7	Low	66.9	Low	164 Å²	164	93.4 Å²	93.4	84%	0.841	50%	0.503	S	S	*	.			trans	-90.5	104.5	172	-55.9	173	0	0	0	107.1	R51	I49-R51 PolarHBondContact O-N 2.87Å
50	S	52.9	Low	66.8	Low	35 Å²	35	91.3 Å²	91.3	25%	0.245	48%	0.476	C	S	.	.			trans	-72.7	129	-178.5	-177.2	0	0	0	0	111.2	G52 A55	S50-G52 PolarHBondContact OG-N 2.86Å; S50-A55 VanDerWaalsContact CB-CB 3.45Å; S50-A55 WeakPolarHBondContact OG-CB 3.42Å
51	R	50.6	Low	66.8	Low	250 Å²	250	91 Å²	91	94%	0.943	47%	0.471	S	S	*	.			trans	-98	7.9	177.4	-69.1	-176.1	175.8	-176.1	-1.2	112.7	I49	I49-R51 PolarHBondContact O-N 2.87Å
52	G	44.5	Very low	66.8	Low	26 Å²	26	88 Å²	88	27%	0.268	46%	0.458	S	S	.	.	S	Bend	trans	-82	154.1	-175.7	0	0	0	0	0	114.8	S50 S54 A55	S50-G52 PolarHBondContact OG-N 2.86Å; G52-S54 PolarHBondContact O-N 3.33Å; G52-A55 PolarHBondContact O-N 2.98Å; G52-A55 VanDerWaalsContact O-N 3.13Å
53	R	41.5	Very low	66.8	Low	257 Å²	257	85.9 Å²	85.9	97%	0.97	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.3	-178.3	-78.4	-178	175.9	178	-1.4	114.2
54	S	42	Very low	66.7	Low	85 Å²	85	86.3 Å²	86.3	59%	0.594	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.5	178.3	32.9	0	0	0	0	114.3	G52	G52-S54 PolarHBondContact O-N 3.33Å
55	A	40.4	Very low	66.8	Low	27 Å²	27	83.1 Å²	83.1	22%	0.223	43%	0.428	C	S	.	.			trans	-100.7	11.1	-171.3	0	0	0	0	0	115.2	S50 G52 A57	S50-A55 VanDerWaalsContact CB-CB 3.45Å; S50-A55 WeakPolarHBondContact OG-CB 3.42Å; G52-A55 PolarHBondContact O-N 2.98Å; G52-A55 VanDerWaalsContact O-N 3.13Å; A55-A57 VanDerWaalsContact C-N 3.34Å
56	K	42.7	Very low	66.8	Low	191 Å²	191	91.4 Å²	91.4	83%	0.83	46%	0.459	S	S	*	.			trans	-91	11	176	-72.3	-171	177.5	-175.4	0	113.9
57	A	44.6	Very low	66.8	Low	45 Å²	45	86.7 Å²	86.7	37%	0.372	43%	0.434	S	S	.	.	S	Bend	trans	-79.6	123.9	175.5	0	0	0	0	0	110	A55 G59	A55-A57 VanDerWaalsContact C-N 3.34Å; A57-G59 PolarHBondContact O-N 2.93Å
58	P	51.5	Low	66.6	Low	121 Å²	121	82.6 Å²	82.6	79%	0.786	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	133.9	178.2	21.4	-30	0	0	0	111.3
59	G	62.7	Low	66.5	Low	56 Å²	56	83.8 Å²	83.8	58%	0.577	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	4.4	176	0	0	0	0	0	116.9	A57	A57-G59 PolarHBondContact O-N 2.93Å
60	W	71.9	Confident	67.3	Low	75 Å²	75	83 Å²	83	28%	0.284	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.3	173.6	-73.5	82.5	0	0	0	112.3	H75 M76 R77 Y114	W60-H75 HydrophobicContact CE3-CB 3.93Å; W60-H75 HydrophobicContact CZ3-CB 4.13Å; W60-M76 WeakPolarHBondContact CA-O 3.24Å; W60-R77 HydrophobicContact CD2-CB 3.93Å; W60-R77 HydrophobicContact CE3-CB 4.02Å; W60-R77 HydrophobicContact CG-CB 4.49Å; W60-R77 HydrophobicContact CH2-CB 4.25Å; W60-R77 HydrophobicContact CZ2-CB 4.17Å; W60-R77 HydrophobicContact CZ3-CB 4.18Å; W60-Y114 HydrophobicContact CE3-CE1 4.32Å; W60-Y114 AromaticContact CH2-CD1 3.95Å; W60-Y114 HydrophobicContact CH2-CD1 3.95Å; W60-Y114 AromaticContact CH2-CE1 3.66Å; W60-Y114 HydrophobicContact CH2-CE1 3.66Å; W60-Y114 AromaticContact CZ3-CD1 3.84Å; W60-Y114 HydrophobicContact CZ3-CD1 3.84Å; W60-Y114 AromaticContact CZ3-CE1 3.54Å; W60-Y114 HydrophobicContact CZ3-CE1 3.54Å
61	L	82.6	Confident	69.1	Low	50 Å²	50	89.3 Å²	89.3	26%	0.262	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	151.1	171.6	-62.4	175.7	0	0	0	109.8	Y63 H75 M76 Y111	L61-Y63 HydrophobicContact CB-CE2 4.35Å; L61-H75 CarbonylContact O-C 3.54Å; L61-H75 WeakPolarHBondContact O-CA 3.45Å; L61-M76 HydrophobicContact CB-CG 3.92Å; L61-M76 PolarHBondContact N-O 3.1Å; L61-M76 PolarHBondContact O-N 3.43Å; L61-Y111 HydrophobicContact CD1-CE1 3.66Å
62	S	88.3	Confident	71	Confident	10 Å²	10	78.8 Å²	78.8	7%	0.07	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	130.6	179.8	-52.3	0	0	0	0	111.1	V48 V74 H75	V48-S62 PolarHBondContact N-O 2.93Å; S62-V74 CarbonylContact C-O 3.53Å; S62-V74 VanDerWaalsContact CA-O 3.28Å; S62-V74 WeakPolarHBondContact CA-O 3.38Å; S62-H75 PolarHBondContact OG-CE1 2.6Å; S62-H75 PolarHBondContact OG-ND1 2.85Å
63	Y	90.1	Very high	73.2	Confident	38 Å²	38	78.4 Å²	78.4	15%	0.149	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.9	177.7	-77.3	-96.2	0	0	0	110.7	P45 L46 K47 L61 V73 V74 M76 F132	P45-Y63 HydrophobicContact CB-CD1 3.99Å; L46-Y63 CarbonylContact O-C 3.58Å; L46-Y63 WeakPolarHBondContact O-CA 3.4Å; K47-Y63 HydrophobicContact CB-CD1 4.17Å; K47-Y63 HydrophobicContact CB-CE1 3.75Å; K47-Y63 HydrophobicContact CG-CE1 4.32Å; L61-Y63 HydrophobicContact CB-CE2 4.35Å; Y63-V73 CarbonylContact O-C 3.52Å; Y63-V73 WeakPolarHBondContact O-CA 3.31Å; Y63-V74 PolarHBondContact N-O 2.91Å; Y63-V74 PolarHBondContact O-N 2.95Å; Y63-M76 HydrophobicContact CD2-CE 3.76Å; Y63-M76 HydrophobicContact CD2-SD 3.99Å; Y63-M76 HydrophobicContact CE2-SD 4.3Å; Y63-M76 HydrophobicContact CG-CE 4.34Å; Y63-F132 AromaticContact CD1-CE2 3.75Å; Y63-F132 HydrophobicContact CD1-CE2 3.75Å; Y63-F132 AromaticContact CD1-CZ 4Å; Y63-F132 HydrophobicContact CD1-CZ 4Å; Y63-F132 HydrophobicContact CD2-CE2 4.16Å; Y63-F132 AromaticContact CD2-CZ 3.76Å; Y63-F132 HydrophobicContact CD2-CZ 3.76Å; Y63-F132 AromaticContact CE1-CE2 3.93Å; Y63-F132 HydrophobicContact CE1-CE2 3.93Å; Y63-F132 AromaticContact CE1-CZ 3.85Å; Y63-F132 HydrophobicContact CE1-CZ 3.85Å; Y63-F132 HydrophobicContact CE2-CE2 4.33Å; Y63-F132 AromaticContact CE2-CZ 3.6Å; Y63-F132 HydrophobicContact CE2-CZ 3.6Å; Y63-F132 AromaticContact CG-CE2 3.87Å; Y63-F132 HydrophobicContact CG-CE2 3.87Å; Y63-F132 AromaticContact CG-CZ 3.95Å; Y63-F132 HydrophobicContact CG-CZ 3.95Å; Y63-F132 AromaticContact CZ-CZ 3.65Å
64	S	90.6	Very high	75.5	Confident	13 Å²	13	66.1 Å²	66.1	9%	0.091	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.5	172.2	-176.4	0	0	0	0	109.2	L46 R71 H72	L46-S64 PolarHBondContact N-O 2.97Å; L46-S64 PolarHBondContact O-N 2.92Å; S64-R71 WeakPolarHBondContact OG-CG 3.32Å; S64-R71 PolarHBondContact OG-NE 3.32Å; S64-H72 CarbonylContact C-O 3.5Å; S64-H72 WeakPolarHBondContact CA-O 3.4Å
65	L	90.8	Very high	77.6	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.037	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	144.7	174.5	-62.1	165	0	0	0	108.6	V43 P45 H72 V74 L136	V43-L65 HydrophobicContact CG2-CD2 4.33Å; P45-L65 HydrophobicContact CB-CD2 3.59Å; P45-L65 HydrophobicContact CG-CD2 3.55Å; L65-H72 PolarHBondContact N-O 3.17Å; L65-H72 PolarHBondContact O-N 3.06Å; L65-V74 HydrophobicContact CD1-CG2 3.5Å; L65-V74 HydrophobicContact CG-CG2 4.38Å; L65-L136 HydrophobicContact CD1-CD2 3.88Å
66	R	88.4	Confident	79.8	Confident	180 Å²	180	61.1 Å²	61.1	68%	0.679	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	110.1	171.9	-146.9	177.9	-169.9	177.9	1.7	107.2	V43 K70	V43-R66 VanDerWaalsContact CG1-O 3.23Å; V43-R66 WeakPolarHBondContact CG1-O 3.26Å; R66-K70 CarbonylContact C-O 3.56Å; R66-K70 VanDerWaalsContact CA-O 3.32Å; R66-K70 WeakPolarHBondContact CA-O 3.38Å
67	L	87.4	Confident	81.6	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.2	-173	-166.4	87.5	0	0	0	108.7	V43 G69 K70 I138 Y143 V158	V43-L67 HydrophobicContact CG1-CD1 4.03Å; L67-G69 PolarHBondContact O-N 3.05Å; L67-G69 VanDerWaalsContact O-N 3.17Å; L67-K70 PolarHBondContact N-O 2.88Å; L67-K70 PolarHBondContact O-N 2.99Å; L67-I138 HydrophobicContact CD2-CD1 4.13Å; L67-Y143 HydrophobicContact CD2-CD1 3.89Å; L67-Y143 HydrophobicContact CD2-CD2 4.11Å; L67-Y143 HydrophobicContact CD2-CE1 3.72Å; L67-Y143 HydrophobicContact CD2-CE2 3.97Å; L67-Y143 HydrophobicContact CD2-CG 4.07Å; L67-V158 HydrophobicContact CD1-CB 3.74Å; L67-V158 HydrophobicContact CD1-CG1 3.49Å; L67-V158 VanDerWaalsContact CD1-CG1 3.49Å; L67-V158 HydrophobicContact CD1-CG2 3.97Å
68	G	82.5	Confident	83.2	Confident	61 Å²	61	56.5 Å²	56.5	63%	0.629	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	32.8	-178.8	0	0	0	0	0	113	E41 K70	E41-G68 PolarHBondContact OE1-N 2.83Å; E41-G68 VanDerWaalsContact OE1-N 3.1Å; E41-G68 PolarHBondContact OE2-N 3.1Å; G68-K70 PolarHBondContact O-N 2.65Å
69	G	81.1	Confident	84.4	Confident	61 Å²	61	51.5 Å²	51.5	63%	0.629	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-0.4	-176.3	0	0	0	0	0	115.7	L67	L67-G69 PolarHBondContact O-N 3.05Å; L67-G69 VanDerWaalsContact O-N 3.17Å
70	K	87.1	Confident	84.7	Confident	148 Å²	148	56.7 Å²	56.7	64%	0.643	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	152.7	178.4	-69.9	-177.5	-178.4	177.6	0	111.4	R66 L67 G68	R66-K70 CarbonylContact C-O 3.56Å; R66-K70 VanDerWaalsContact CA-O 3.32Å; R66-K70 WeakPolarHBondContact CA-O 3.38Å; L67-K70 PolarHBondContact N-O 2.88Å; L67-K70 PolarHBondContact O-N 2.99Å; G68-K70 PolarHBondContact O-N 2.65Å
71	R	90.1	Very high	84.6	Confident	167 Å²	167	55 Å²	55	63%	0.63	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	125.2	174.8	-177.1	-177.7	174.1	-156.2	-6.3	109.1	S64	S64-R71 WeakPolarHBondContact OG-CG 3.32Å; S64-R71 PolarHBondContact OG-NE 3.32Å
72	H	90.8	Very high	84.3	Confident	28 Å²	28	52.7 Å²	52.7	13%	0.13	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135	175.5	-65.1	-81.7	0	0	0	109.2	S64 L65 V115	S64-H72 CarbonylContact C-O 3.5Å; S64-H72 WeakPolarHBondContact CA-O 3.4Å; L65-H72 PolarHBondContact N-O 3.17Å; L65-H72 PolarHBondContact O-N 3.06Å; H72-V115 HydrophobicContact CB-CG1 4.01Å
73	V	90.1	Very high	83.6	Confident	18 Å²	18	53.1 Å²	53.1	11%	0.109	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120	174.4	179.5	0	0	0	0	107.8	V48 Y63 V115 E116	V48-V73 HydrophobicContact CG2-CG1 3.95Å; Y63-V73 CarbonylContact O-C 3.52Å; Y63-V73 WeakPolarHBondContact O-CA 3.31Å; V73-V115 CarbonylContact O-C 3.58Å; V73-V115 WeakPolarHBondContact O-CA 3.42Å; V73-E116 HydrophobicContact CB-CB 3.98Å; V73-E116 WeakPolarHBondContact CB-OE2 3.48Å; V73-E116 HydrophobicContact CG1-CB 4.49Å; V73-E116 WeakPolarHBondContact CG1-OE2 3.42Å; V73-E116 WeakPolarHBondContact O-CB 3.48Å; V73-E116 PolarHBondContact O-N 2.96Å
74	V	90.2	Very high	82.5	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.9	178.7	-171.3	0	0	0	0	108.7	S62 Y63 L65 M76 Y114 V115 A123 F125 L136	S62-V74 CarbonylContact C-O 3.53Å; S62-V74 VanDerWaalsContact CA-O 3.28Å; S62-V74 WeakPolarHBondContact CA-O 3.38Å; Y63-V74 PolarHBondContact N-O 2.91Å; Y63-V74 PolarHBondContact O-N 2.95Å; L65-V74 HydrophobicContact CD1-CG2 3.5Å; L65-V74 HydrophobicContact CG-CG2 4.38Å; V74-M76 HydrophobicContact CB-CE 4.2Å; V74-M76 HydrophobicContact CG1-CE 3.96Å; V74-Y114 WeakPolarHBondContact CA-O 3.32Å; V74-V115 HydrophobicContact CG2-CG2 4.2Å; V74-A123 HydrophobicContact CG1-CB 3.45Å; V74-A123 VanDerWaalsContact CG1-CB 3.45Å; V74-F125 HydrophobicContact CG1-CE2 4.03Å; V74-L136 HydrophobicContact CG2-CD1 4.14Å
75	H	85.8	Confident	80.9	Confident	5 Å²	5	58.7 Å²	58.7	2%	0.023	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.8	170.9	-62	-61.8	0	0	0	108.7	W60 L61 S62 G113 Y114 E116	W60-H75 HydrophobicContact CE3-CB 3.93Å; W60-H75 HydrophobicContact CZ3-CB 4.13Å; L61-H75 CarbonylContact O-C 3.54Å; L61-H75 WeakPolarHBondContact O-CA 3.45Å; S62-H75 PolarHBondContact OG-CE1 2.6Å; S62-H75 PolarHBondContact OG-ND1 2.85Å; H75-G113 CarbonylContact O-C 3.56Å; H75-G113 WeakPolarHBondContact O-CA 3.48Å; H75-Y114 HydrophobicContact CB-CD1 4.36Å; H75-Y114 HydrophobicContact CB-CE1 3.91Å; H75-Y114 HydrophobicContact CB-CE2 4.22Å; H75-Y114 AromaticContact CD2-CE2 3.61Å; H75-Y114 AromaticContact CD2-CZ 3.81Å; H75-Y114 PolarHBondContact N-O 3.31Å; H75-Y114 PolarHBondContact O-N 3.26Å; H75-E116 IonicContact CE1-OE2 3.16Å; H75-E116 IonicContact NE2-OE2 2.67Å; H75-E116 PolarHBondContact NE2-OE2 3.26Å
76	M	85.9	Confident	79.8	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.9	-174.7	64.8	-173	70.2	0	0	111.8	W60 L61 Y63 V74 Y111 H112 F125 F132	W60-M76 WeakPolarHBondContact CA-O 3.24Å; L61-M76 HydrophobicContact CB-CG 3.92Å; L61-M76 PolarHBondContact N-O 3.1Å; L61-M76 PolarHBondContact O-N 3.43Å; Y63-M76 HydrophobicContact CD2-CE 3.76Å; Y63-M76 HydrophobicContact CD2-SD 3.99Å; Y63-M76 HydrophobicContact CE2-SD 4.3Å; Y63-M76 HydrophobicContact CG-CE 4.34Å; V74-M76 HydrophobicContact CB-CE 4.2Å; V74-M76 HydrophobicContact CG1-CE 3.96Å; M76-Y111 HydrophobicContact CB-CD1 4.23Å; M76-Y111 HydrophobicContact CG-CD1 3.94Å; M76-Y111 HydrophobicContact CG-CG 4.42Å; M76-Y111 HydrophobicContact SD-CD1 4.22Å; M76-Y111 HydrophobicContact SD-CG 4.26Å; M76-H112 CarbonylContact C-O 3.47Å; M76-H112 WeakPolarHBondContact CA-O 3.49Å; M76-F125 HydrophobicContact CE-CD2 3.62Å; M76-F125 HydrophobicContact CE-CE2 3.77Å; M76-F125 HydrophobicContact SD-CD2 4.22Å; M76-F132 HydrophobicContact CE-CZ 4.29Å; M76-F132 HydrophobicContact SD-CE1 4.12Å; M76-F132 HydrophobicContact SD-CZ 4.17Å
77	R	80.4	Confident	79.4	Confident	107 Å²	107	52.9 Å²	52.9	40%	0.404	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	142.6	179	-174.6	179	-174.9	-170.6	2.2	109.5	W60 Y111 H112	W60-R77 HydrophobicContact CD2-CB 3.93Å; W60-R77 HydrophobicContact CE3-CB 4.02Å; W60-R77 HydrophobicContact CG-CB 4.49Å; W60-R77 HydrophobicContact CH2-CB 4.25Å; W60-R77 HydrophobicContact CZ2-CB 4.17Å; W60-R77 HydrophobicContact CZ3-CB 4.18Å; R77-Y111 WeakPolarHBondContact O-CA 3.44Å; R77-H112 PolarHBondContact N-O 2.93Å; R77-H112 PolarHBondContact O-N 3.06Å; R77-H112 PolarHBondContact O-ND1 3.05Å
78	V	79.2	Confident	79.3	Confident	31 Å²	31	53.1 Å²	53.1	19%	0.188	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	136.9	177.6	173.7	0	0	0	0	111.2	D107 D108 Y110 Y111	V78-D107 WeakPolarHBondContact CG1-O 3.17Å; V78-D108 HydrophobicContact CG2-CB 4.28Å; V78-Y110 CarbonylContact C-O 3.44Å; V78-Y110 VanDerWaalsContact CA-O 3.31Å; V78-Y110 WeakPolarHBondContact CA-O 3.46Å; V78-Y111 HydrophobicContact CB-CE1 4.42Å; V78-Y111 HydrophobicContact CG2-CD1 4.01Å; V78-Y111 HydrophobicContact CG2-CE1 3.39Å
79	K	76.6	Confident	79.7	Confident	16 Å²	16	50.3 Å²	50.3	7%	0.07	24%	0.236	C	C	.	.			trans	-86	109.4	168.1	-68.8	-173.7	176.3	-160.6	0	109.8	L82 Y110 H112 N240 D243 S244	K79-L82 HydrophobicContact CB-CB 4.15Å; K79-L82 HydrophobicContact CD-CB 4.45Å; K79-L82 HydrophobicContact CD-CD1 4.4Å; K79-L82 HydrophobicContact CD-CD2 4.45Å; K79-Y110 PolarHBondContact N-O 3.33Å; K79-H112 HydrophobicContact CG-CB 4.35Å; K79-H112 WeakPolarHBondContact CG-ND1 3.48Å; K79-N240 WeakPolarHBondContact CD-OD1 3.4Å; K79-N240 WeakPolarHBondContact CE-OD1 3.31Å; K79-N240 PolarHBondContact NZ-O 3.3Å; K79-N240 PolarHBondContact NZ-OD1 2.96Å; K79-D243 WeakPolarHBondContact CD-OD2 3.21Å; K79-D243 WeakPolarHBondContact CE-OD2 3.49Å; K79-D243 IonicContact NZ-OD2 3.88Å; K79-D243 PolarHBondContact NZ-OD2 2.79Å; K79-S244 PolarHBondContact NZ-OG 2.76Å
80	K	69.7	Low	80.1	Confident	166 Å²	166	48.7 Å²	48.7	72%	0.722	21%	0.212	S	C	*	.	S	Bend	trans	-83.1	-13.9	-178	-65	-170.4	173.5	-168.3	0	114.8
81	L	69.6	Low	80.3	Confident	39 Å²	39	42.4 Å²	42.4	20%	0.204	19%	0.186	C	C	.	.	S	Bend	trans	-115.1	7.4	-171.3	-59.5	-179.4	0	0	0	113.3	F209 Y252 I254 L400	L81-F209 HydrophobicContact CD1-CE1 3.93Å; L81-Y252 HydrophobicContact CD1-CD1 4.15Å; L81-Y252 HydrophobicContact CD1-CE1 4.47Å; L81-Y252 HydrophobicContact CD1-CG 4.22Å; L81-I254 HydrophobicContact CB-CG1 4.5Å; L81-I254 WeakPolarHBondContact O-CG1 3.38Å; L81-L400 HydrophobicContact CD2-CD1 3.34Å; L81-L400 HydrophobicContact CD2-CD2 4.09Å; L81-L400 HydrophobicContact CD2-CG 4.21Å
82	L	76.2	Confident	80	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.01	16%	0.163	C	C	.	.	S	Bend	trans	-73.8	-41.2	-173	-174.3	72	0	0	0	112.5	K79 Y110 V239 N240 D243 L255	K79-L82 HydrophobicContact CB-CB 4.15Å; K79-L82 HydrophobicContact CD-CB 4.45Å; K79-L82 HydrophobicContact CD-CD1 4.4Å; K79-L82 HydrophobicContact CD-CD2 4.45Å; L82-Y110 HydrophobicContact CD2-CD1 3.73Å; L82-Y110 HydrophobicContact CD2-CD2 3.93Å; L82-Y110 HydrophobicContact CD2-CE1 4.39Å; L82-Y110 HydrophobicContact CD2-CG 3.47Å; L82-Y110 VanDerWaalsContact CD2-CG 3.47Å; L82-V239 HydrophobicContact CD1-CG1 4.1Å; L82-N240 HydrophobicContact CD1-CB 4.46Å; L82-N240 HydrophobicContact CD2-CB 3.67Å; L82-D243 HydrophobicContact CD1-CB 3.63Å; L82-L255 PolarHBondContact O-N 3.01Å
83	V	73.2	Confident	79.7	Confident	19 Å²	19	36.4 Å²	36.4	12%	0.115	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-138	141.6	-174.9	-167.4	0	0	0	0	109.1	L87 I105 Y110 F236	V83-L87 HydrophobicContact CG1-CB 4.01Å; V83-L87 HydrophobicContact CG1-CD1 4.08Å; V83-L87 HydrophobicContact CG1-CD2 3.83Å; V83-L87 HydrophobicContact CG1-CG 4.21Å; V83-I105 HydrophobicContact CG1-CD1 3.53Å; V83-Y110 HydrophobicContact CG2-CE2 4.25Å; V83-F236 HydrophobicContact CG1-CE1 4.14Å; V83-F236 HydrophobicContact CG2-CD1 4.14Å; V83-F236 HydrophobicContact CG2-CE1 4.4Å
84	S	66.1	Low	79.2	Confident	15 Å²	15	41.9 Å²	41.9	11%	0.105	19%	0.194	C	C	.	.			trans	-67.9	143.7	170.3	-179	0	0	0	0	111.4	H86 L87	S84-H86 PolarHBondContact O-N 2.82Å; S84-H86 PolarHBondContact OG-N 2.74Å; S84-L87 PolarHBondContact O-N 3.35Å
85	R	58	Low	78.7	Confident	153 Å²	153	49.4 Å²	49.4	58%	0.577	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-31.1	174.1	-79	-178.5	173.7	-168	-2.2	113.4	D107	R85-D107 VanDerWaalsContact CG-OD1 3.28Å; R85-D107 WeakPolarHBondContact CG-OD1 3.44Å; R85-D107 IonicContact CZ-OD2 2.85Å; R85-D107 IonicContact NE-OD1 3.65Å; R85-D107 IonicContact NE-OD2 2.97Å; R85-D107 PolarHBondContact NE-OD2 3.35Å; R85-D107 IonicContact NH2-OD2 3.96Å; R85-D107 PolarHBondContact NH2-OD2 2.81Å
86	H	66.4	Low	78.3	Confident	65 Å²	65	58.1 Å²	58.1	30%	0.301	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	60.4	178.5	-53.2	103.3	0	0	0	108.7	S84 P88	S84-H86 PolarHBondContact O-N 2.82Å; S84-H86 PolarHBondContact OG-N 2.74Å; H86-P88 WeakPolarHBondContact O-CD 3.05Å
87	L	80.6	Confident	77.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.282	C	S	.	.			trans	-68.7	117	177.9	-176.6	78.6	0	0	0	109.5	V83 S84 V89 I105 F236 L255 T256 I258	V83-L87 HydrophobicContact CG1-CB 4.01Å; V83-L87 HydrophobicContact CG1-CD1 4.08Å; V83-L87 HydrophobicContact CG1-CD2 3.83Å; V83-L87 HydrophobicContact CG1-CG 4.21Å; S84-L87 PolarHBondContact O-N 3.35Å; L87-V89 HydrophobicContact CD2-CG2 4.36Å; L87-I105 HydrophobicContact CB-CD1 3.93Å; L87-I105 HydrophobicContact CD2-CD1 3.87Å; L87-F236 HydrophobicContact CD2-CE1 3.39Å; L87-F236 HydrophobicContact CD2-CZ 3.63Å; L87-L255 HydrophobicContact CD1-CG 4.04Å; L87-L255 VanDerWaalsContact CD1-O 3.28Å; L87-L255 WeakPolarHBondContact CD1-O 3.47Å; L87-L255 HydrophobicContact CD2-CD2 4.22Å; L87-L255 HydrophobicContact CD2-CG 4.49Å; L87-T256 VanDerWaalsContact CD1-C 3.4Å; L87-I258 HydrophobicContact CD2-CD1 3.95Å; L87-I258 HydrophobicContact CD2-CG1 4.12Å
88	P	86.3	Confident	77.8	Confident	13 Å²	13	59.9 Å²	59.9	8%	0.084	29%	0.286	C	S	.	.			trans	-71.8	131.1	173.5	31	-34.5	0	0	0	110.4	H86 F90 E100 T256 G257 I258 L290	H86-P88 WeakPolarHBondContact O-CD 3.05Å; P88-F90 HydrophobicContact CB-CE2 3.7Å; P88-F90 HydrophobicContact CB-CZ 3.71Å; P88-F90 HydrophobicContact CG-CE2 4.05Å; P88-F90 HydrophobicContact CG-CZ 4.33Å; P88-E100 HydrophobicContact CB-CG 4.25Å; P88-T256 WeakPolarHBondContact CD-O 3.47Å; P88-T256 WeakPolarHBondContact CG-O 3.48Å; P88-G257 WeakPolarHBondContact O-CA 3.49Å; P88-I258 PolarHBondContact O-N 3.25Å; P88-L290 HydrophobicContact CG-CD1 3.83Å
89	V	89.3	Confident	78	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117	172.2	-177	0	0	0	0	109	L87 D101 P103 I258 I260	L87-V89 HydrophobicContact CD2-CG2 4.36Å; V89-D101 PolarHBondContact N-O 3.41Å; V89-D101 PolarHBondContact O-N 3.38Å; V89-P103 HydrophobicContact CG2-CG 3.83Å; V89-I258 CarbonylContact C-O 3.44Å; V89-I258 VanDerWaalsContact CA-O 3.27Å; V89-I258 WeakPolarHBondContact CA-O 3.44Å; V89-I258 HydrophobicContact CG1-CB 4.38Å; V89-I258 HydrophobicContact CG2-CB 4.32Å; V89-I260 HydrophobicContact CG1-CD1 4.17Å
90	F	89.9	Confident	78.3	Confident	28 Å²	28	67.2 Å²	67.2	12%	0.123	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	132.5	-177.7	-58.4	-79.1	0	0	0	111.5	P88 L98 L99 E100 I258 E259 I260 L290	P88-F90 HydrophobicContact CB-CE2 3.7Å; P88-F90 HydrophobicContact CB-CZ 3.71Å; P88-F90 HydrophobicContact CG-CE2 4.05Å; P88-F90 HydrophobicContact CG-CZ 4.33Å; F90-L98 HydrophobicContact CB-CD1 3.99Å; F90-L98 HydrophobicContact CB-CG 4.49Å; F90-L98 HydrophobicContact CD1-CD2 3.99Å; F90-L98 HydrophobicContact CD1-CG 4.19Å; F90-L99 CarbonylContact C-O 3.46Å; F90-L99 VanDerWaalsContact CA-O 3.28Å; F90-L99 WeakPolarHBondContact CA-O 3.48Å; F90-E100 HydrophobicContact CD1-CB 3.95Å; F90-E100 HydrophobicContact CD1-CG 4.09Å; F90-E100 HydrophobicContact CE1-CB 3.82Å; F90-E100 HydrophobicContact CE1-CG 3.65Å; F90-E100 HydrophobicContact CZ-CG 4.24Å; F90-I258 PolarHBondContact N-O 3.31Å; F90-E259 HydrophobicContact CB-CB 4.05Å; F90-E259 HydrophobicContact CB-CG 3.84Å; F90-E259 WeakPolarHBondContact O-CA 3.4Å; F90-I260 PolarHBondContact O-N 3.03Å; F90-L290 HydrophobicContact CE2-CD2 4.3Å
91	T	91	Very high	78.7	Confident	15 Å²	15	63.8 Å²	63.8	9%	0.092	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	176.4	177.4	61.3	0	0	0	0	110.3	L98 L99 I228 I260	T91-L98 CarbonylContact O-C 3.5Å; T91-L99 PolarHBondContact N-O 3.18Å; T91-L99 PolarHBondContact O-N 2.66Å; T91-I228 HydrophobicContact CG2-CD1 4Å; T91-I228 HydrophobicContact CG2-CG1 4.33Å; T91-I228 HydrophobicContact CG2-CG2 4.42Å; T91-I260 HydrophobicContact CG2-CB 4.36Å
92	Y	84.9	Confident	79.1	Confident	40 Å²	40	65.5 Å²	65.5	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.4	-175.6	-64.5	-97.3	0	0	0	112.5	A97 L98 E259 W261 N262 Q263	Y92-A97 CarbonylContact C-O 3.44Å; Y92-A97 VanDerWaalsContact CA-O 3.3Å; Y92-A97 WeakPolarHBondContact CA-O 3.13Å; Y92-L98 HydrophobicContact CD1-CD1 4.36Å; Y92-L98 HydrophobicContact CE1-CD1 3.81Å; Y92-L98 HydrophobicContact CE2-CD1 4Å; Y92-E259 HydrophobicContact CE2-CG 4.35Å; Y92-E259 PolarHBondContact OH-OE1 2.96Å; Y92-W261 AromaticContact CE2-CD1 3.83Å; Y92-N262 WeakPolarHBondContact CA-OD1 3.34Å; Y92-N262 WeakPolarHBondContact CB-OD1 3.22Å; Y92-N262 PolarHBondContact N-OD1 3.18Å; Y92-N262 PolarHBondContact O-ND2 2.96Å; Y92-N262 PolarHBondContact O-OD1 2.85Å; Y92-Q263 WeakPolarHBondContact O-CG 3.49Å; Y92-Q263 PolarHBondContact O-NE2 3.34Å
93	T	83.4	Confident	78.9	Confident	29 Å²	29	66.5 Å²	66.5	18%	0.178	32%	0.324	C	S	.	.			trans	-68.8	170.2	168.3	73.2	0	0	0	0	111.4	E95 R96 A97 L99 Q263	T93-E95 WeakPolarHBondContact CB-OE2 3.27Å; T93-E95 PolarHBondContact O-N 3.44Å; T93-E95 PolarHBondContact OG1-N 2.91Å; T93-E95 PolarHBondContact OG1-OE2 3.12Å; T93-R96 WeakPolarHBondContact O-CA 3.36Å; T93-R96 PolarHBondContact O-N 3.36Å; T93-A97 HydrophobicContact CG2-CB 4.19Å; T93-A97 PolarHBondContact N-O 3.07Å; T93-A97 PolarHBondContact OG1-N 3.22Å; T93-L99 HydrophobicContact CG2-CD1 3.52Å; T93-L99 HydrophobicContact CG2-CD2 3.92Å; T93-L99 HydrophobicContact CG2-CG 3.58Å; T93-Q263 WeakPolarHBondContact O-CG 3.35Å
94	D	80.8	Confident	78.7	Confident	133 Å²	133	74.4 Å²	74.4	71%	0.711	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.4	174.5	-62.8	-20.8	0	0	0	112.2	R96 Q263	D94-R96 PolarHBondContact O-N 3Å; D94-Q263 PolarHBondContact OD1-NE2 3.06Å
95	E	79.9	Confident	78.8	Confident	158 Å²	158	74.4 Å²	74.4	74%	0.738	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	7.3	170.7	-52.2	79.1	-169.9	0	0	113.8	T93 A97	T93-E95 WeakPolarHBondContact CB-OE2 3.27Å; T93-E95 PolarHBondContact O-N 3.44Å; T93-E95 PolarHBondContact OG1-N 2.91Å; T93-E95 PolarHBondContact OG1-OE2 3.12Å; E95-A97 PolarHBondContact O-N 3.13Å
96	R	76.7	Confident	79.2	Confident	189 Å²	189	69.1 Å²	69.1	71%	0.713	34%	0.342	S	S	*	.			trans	61	26.2	-176.6	-55.6	-176.5	175.6	-171.9	-3.7	114.6	T93 D94	T93-R96 WeakPolarHBondContact O-CA 3.36Å; T93-R96 PolarHBondContact O-N 3.36Å; D94-R96 PolarHBondContact O-N 3Å
97	A	74.9	Confident	79.1	Confident	51 Å²	51	69.5 Å²	69.5	42%	0.421	35%	0.346	S	S	.	.			trans	-77.9	139.2	169.7	0	0	0	0	0	110.1	Y92 T93 E95 L99	Y92-A97 CarbonylContact C-O 3.44Å; Y92-A97 VanDerWaalsContact CA-O 3.3Å; Y92-A97 WeakPolarHBondContact CA-O 3.13Å; T93-A97 HydrophobicContact CG2-CB 4.19Å; T93-A97 PolarHBondContact N-O 3.07Å; T93-A97 PolarHBondContact OG1-N 3.22Å; E95-A97 PolarHBondContact O-N 3.13Å; A97-L99 PolarHBondContact O-N 3.34Å
98	L	80.3	Confident	78.8	Confident	95 Å²	95	74.4 Å²	74.4	50%	0.497	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	126.9	176.4	-165.5	71.7	0	0	0	110	F90 T91 Y92	F90-L98 HydrophobicContact CB-CD1 3.99Å; F90-L98 HydrophobicContact CB-CG 4.49Å; F90-L98 HydrophobicContact CD1-CD2 3.99Å; F90-L98 HydrophobicContact CD1-CG 4.19Å; T91-L98 CarbonylContact O-C 3.5Å; Y92-L98 HydrophobicContact CD1-CD1 4.36Å; Y92-L98 HydrophobicContact CE1-CD1 3.81Å; Y92-L98 HydrophobicContact CE2-CD1 4Å
99	L	83.6	Confident	78.5	Confident	88 Å²	88	74 Å²	74	46%	0.461	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.5	172.8	-70.9	175.9	0	0	0	109.3	F90 T91 T93 A97	F90-L99 CarbonylContact C-O 3.46Å; F90-L99 VanDerWaalsContact CA-O 3.28Å; F90-L99 WeakPolarHBondContact CA-O 3.48Å; T91-L99 PolarHBondContact N-O 3.18Å; T91-L99 PolarHBondContact O-N 2.66Å; T93-L99 HydrophobicContact CG2-CD1 3.52Å; T93-L99 HydrophobicContact CG2-CD2 3.92Å; T93-L99 HydrophobicContact CG2-CG 3.58Å; A97-L99 PolarHBondContact O-N 3.34Å
100	E	84.3	Confident	78.3	Confident	112 Å²	112	74.5 Å²	74.5	52%	0.523	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.1	170.7	-174.3	-175.1	150.5	0	0	109.5	P88 F90 Q102	P88-E100 HydrophobicContact CB-CG 4.25Å; F90-E100 HydrophobicContact CD1-CB 3.95Å; F90-E100 HydrophobicContact CD1-CG 4.09Å; F90-E100 HydrophobicContact CE1-CB 3.82Å; F90-E100 HydrophobicContact CE1-CG 3.65Å; F90-E100 HydrophobicContact CZ-CG 4.24Å; E100-Q102 PolarHBondContact OE1-NE2 3.37Å
101	D	77.6	Confident	78.1	Confident	94 Å²	94	74.2 Å²	74.2	50%	0.503	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	153.9	168.3	-170.5	19.8	0	0	0	109.8	V89	V89-D101 PolarHBondContact N-O 3.41Å; V89-D101 PolarHBondContact O-N 3.38Å
102	Q	78.1	Confident	77.8	Confident	76 Å²	76	75.1 Å²	75.1	36%	0.355	37%	0.373	S	S	.	.			trans	-128.7	82	178	-68.8	-176.6	-1.2	0	0	108.6	E100 F104	E100-Q102 PolarHBondContact OE1-NE2 3.37Å; Q102-F104 PolarHBondContact O-N 3.11Å
103	P	70.9	Confident	78	Confident	23 Å²	23	73.6 Å²	73.6	15%	0.149	37%	0.369	C	S	.	.			trans	-61.9	140.3	-178	26.4	-35.2	0	0	0	110.5	V89 I105	V89-P103 HydrophobicContact CG2-CG 3.83Å; P103-I105 PolarHBondContact O-N 3.03Å
104	F	69.9	Low	78.1	Confident	185 Å²	185	75.9 Å²	75.9	81%	0.811	38%	0.375	S	S	*	.			trans	-70	116.3	172	176.6	-100.2	0	0	0	109.7	Q102 P106	Q102-F104 PolarHBondContact O-N 3.11Å; F104-P106 HydrophobicContact CE1-CG 4.14Å
105	I	67.2	Low	78.4	Confident	15 Å²	15	69.6 Å²	69.6	8%	0.077	34%	0.342	C	S	.	.			trans	-110.9	118.4	179.2	-58.5	172.5	0	0	0	108.2	V83 L87 P103 D107 Y110 F236	V83-I105 HydrophobicContact CG1-CD1 3.53Å; L87-I105 HydrophobicContact CB-CD1 3.93Å; L87-I105 HydrophobicContact CD2-CD1 3.87Å; P103-I105 PolarHBondContact O-N 3.03Å; I105-D107 PolarHBondContact O-N 3.36Å; I105-Y110 HydrophobicContact CG2-CE2 3.92Å; I105-F236 HydrophobicContact CD1-CE1 4.01Å; I105-F236 HydrophobicContact CD1-CE2 3.98Å; I105-F236 HydrophobicContact CD1-CZ 3.39Å; I105-F236 HydrophobicContact CG1-CE2 4.45Å; I105-F236 HydrophobicContact CG1-CZ 4.31Å
106	P	67.2	Low	78.7	Confident	42 Å²	42	66.6 Å²	66.6	27%	0.273	33%	0.328	S	S	.	.			trans	-62.9	128.6	176.8	-21.1	31.7	0	0	0	111.8	F104 D108 C109	F104-P106 HydrophobicContact CE1-CG 4.14Å; P106-D108 PolarHBondContact O-N 3.34Å; P106-D108 VanDerWaalsContact O-N 3.14Å; P106-C109 HydrophobicContact CB-CB 4.21Å; P106-C109 PolarHBondContact O-SG 2.74Å
107	D	65.1	Low	78.8	Confident	72 Å²	72	61.4 Å²	61.4	39%	0.385	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-14	178.6	-70	-18.8	0	0	0	113.7	V78 R85 I105	V78-D107 WeakPolarHBondContact CG1-O 3.17Å; R85-D107 VanDerWaalsContact CG-OD1 3.28Å; R85-D107 WeakPolarHBondContact CG-OD1 3.44Å; R85-D107 IonicContact CZ-OD2 2.85Å; R85-D107 IonicContact NE-OD1 3.65Å; R85-D107 IonicContact NE-OD2 2.97Å; R85-D107 PolarHBondContact NE-OD2 3.35Å; R85-D107 IonicContact NH2-OD2 3.96Å; R85-D107 PolarHBondContact NH2-OD2 2.81Å; I105-D107 PolarHBondContact O-N 3.36Å
108	D	72.7	Confident	79.1	Confident	103 Å²	103	59.9 Å²	59.9	55%	0.551	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	24.8	-169.2	69.7	-26.5	0	0	0	113.4	V78 P106 Y111	V78-D108 HydrophobicContact CG2-CB 4.28Å; P106-D108 PolarHBondContact O-N 3.34Å; P106-D108 VanDerWaalsContact O-N 3.14Å; D108-Y111 WeakPolarHBondContact O-CE2 3.06Å; D108-Y111 PolarHBondContact O-OH 3.46Å
109	C	81.1	Confident	78.8	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.041	33%	0.329	C	S	.	.	S	Bend	trans	-117.8	-10.9	-174	77.2	0	0	0	0	116.1	P106 Y111 S126 A127 C128	P106-C109 HydrophobicContact CB-CB 4.21Å; P106-C109 PolarHBondContact O-SG 2.74Å; C109-Y111 VanDerWaalsContact C-CE2 3.5Å; C109-Y111 VanDerWaalsContact O-CD2 3.32Å; C109-Y111 WeakPolarHBondContact O-CD2 3.48Å; C109-Y111 WeakPolarHBondContact O-CE2 2.89Å; C109-S126 CarbonylContact O-C 3.59Å; C109-S126 WeakPolarHBondContact O-CA 3.45Å; C109-A127 PolarHBondContact O-N 3.37Å; C109-C128 HydrophobicContact CB-CB 3.68Å; C109-C128 WeakPolarHBondContact CB-SG 3.31Å; C109-C128 WeakPolarHBondContact SG-CB 3.43Å; C109-C128 CovalentContact SG-SG 2.02Å; C109-C128 PolarHBondContact SG-SG 2.74Å
110	Y	85.8	Confident	78.4	Confident	11 Å²	11	63.7 Å²	63.7	4%	0.043	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.5	172.5	-59.5	-78.4	0	0	0	111.5	V78 K79 L82 V83 I105 F236 N240	V78-Y110 CarbonylContact C-O 3.44Å; V78-Y110 VanDerWaalsContact CA-O 3.31Å; V78-Y110 WeakPolarHBondContact CA-O 3.46Å; K79-Y110 PolarHBondContact N-O 3.33Å; L82-Y110 HydrophobicContact CD2-CD1 3.73Å; L82-Y110 HydrophobicContact CD2-CD2 3.93Å; L82-Y110 HydrophobicContact CD2-CE1 4.39Å; L82-Y110 HydrophobicContact CD2-CG 3.47Å; L82-Y110 VanDerWaalsContact CD2-CG 3.47Å; V83-Y110 HydrophobicContact CG2-CE2 4.25Å; I105-Y110 HydrophobicContact CG2-CE2 3.92Å; Y110-F236 HydrophobicContact CE1-CB 3.83Å; Y110-F236 WeakPolarHBondContact OH-CB 3.47Å; Y110-F236 WeakPolarHBondContact OH-CD2 3.27Å; Y110-F236 VanDerWaalsContact OH-CG 3.23Å; Y110-F236 WeakPolarHBondContact OH-CG 3.39Å; Y110-N240 HydrophobicContact CD1-CB 4.33Å
111	Y	85	Confident	78.4	Confident	21 Å²	21	59 Å²	59	8%	0.082	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	144.3	-168.2	-64.9	-90.4	0	0	0	112.4	L61 M76 R77 V78 D108 C109 V124 F125 A127	L61-Y111 HydrophobicContact CD1-CE1 3.66Å; M76-Y111 HydrophobicContact CB-CD1 4.23Å; M76-Y111 HydrophobicContact CG-CD1 3.94Å; M76-Y111 HydrophobicContact CG-CG 4.42Å; M76-Y111 HydrophobicContact SD-CD1 4.22Å; M76-Y111 HydrophobicContact SD-CG 4.26Å; R77-Y111 WeakPolarHBondContact O-CA 3.44Å; V78-Y111 HydrophobicContact CB-CE1 4.42Å; V78-Y111 HydrophobicContact CG2-CD1 4.01Å; V78-Y111 HydrophobicContact CG2-CE1 3.39Å; D108-Y111 WeakPolarHBondContact O-CE2 3.06Å; D108-Y111 PolarHBondContact O-OH 3.46Å; C109-Y111 VanDerWaalsContact C-CE2 3.5Å; C109-Y111 VanDerWaalsContact O-CD2 3.32Å; C109-Y111 WeakPolarHBondContact O-CD2 3.48Å; C109-Y111 WeakPolarHBondContact O-CE2 2.89Å; Y111-V124 WeakPolarHBondContact O-CA 3.31Å; Y111-F125 PolarHBondContact N-O 3.09Å; Y111-F125 PolarHBondContact O-N 3.18Å; Y111-F125 VanDerWaalsContact O-N 3.1Å; Y111-A127 HydrophobicContact CD2-CB 4.41Å; Y111-A127 HydrophobicContact CE2-CB 3.87Å
112	H	85.4	Confident	78.8	Confident	34 Å²	34	56.7 Å²	56.7	16%	0.157	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	156	158.8	65.3	-82.4	0	0	0	109.8	M76 R77 K79 A123 K247	M76-H112 CarbonylContact C-O 3.47Å; M76-H112 WeakPolarHBondContact CA-O 3.49Å; R77-H112 PolarHBondContact N-O 2.93Å; R77-H112 PolarHBondContact O-N 3.06Å; R77-H112 PolarHBondContact O-ND1 3.05Å; K79-H112 HydrophobicContact CG-CB 4.35Å; K79-H112 WeakPolarHBondContact CG-ND1 3.48Å; H112-A123 CarbonylContact C-O 3.49Å; H112-A123 VanDerWaalsContact CA-O 3.28Å; H112-A123 WeakPolarHBondContact CA-O 3.49Å; H112-K247 PolarHBondContact CD2-NZ 2.99Å; H112-K247 VanDerWaalsContact CD2-NZ 3.31Å; H112-K247 PolarHBondContact NE2-NZ 3.12Å; H112-K247 VanDerWaalsContact NE2-NZ 3.18Å
113	G	87.1	Confident	79.4	Confident	8 Å²	8	53 Å²	53	8%	0.082	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	-174.5	-173.4	0	0	0	0	0	113.7	H75 A123	H75-G113 CarbonylContact O-C 3.56Å; H75-G113 WeakPolarHBondContact O-CA 3.48Å; G113-A123 PolarHBondContact N-O 3.23Å; G113-A123 PolarHBondContact O-N 3.2Å
114	Y	86.9	Confident	80.3	Confident	78 Å²	78	52 Å²	52	31%	0.306	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.2	178.6	65.8	-88.4	0	0	0	110.2	W60 V74 H75 S121	W60-Y114 HydrophobicContact CE3-CE1 4.32Å; W60-Y114 AromaticContact CH2-CD1 3.95Å; W60-Y114 HydrophobicContact CH2-CD1 3.95Å; W60-Y114 AromaticContact CH2-CE1 3.66Å; W60-Y114 HydrophobicContact CH2-CE1 3.66Å; W60-Y114 AromaticContact CZ3-CD1 3.84Å; W60-Y114 HydrophobicContact CZ3-CD1 3.84Å; W60-Y114 AromaticContact CZ3-CE1 3.54Å; W60-Y114 HydrophobicContact CZ3-CE1 3.54Å; V74-Y114 WeakPolarHBondContact CA-O 3.32Å; H75-Y114 HydrophobicContact CB-CD1 4.36Å; H75-Y114 HydrophobicContact CB-CE1 3.91Å; H75-Y114 HydrophobicContact CB-CE2 4.22Å; H75-Y114 AromaticContact CD2-CE2 3.61Å; H75-Y114 AromaticContact CD2-CZ 3.81Å; H75-Y114 PolarHBondContact N-O 3.31Å; H75-Y114 PolarHBondContact O-N 3.26Å; Y114-S121 WeakPolarHBondContact CB-O 3.26Å
115	V	86.9	Confident	81.4	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.7	178.5	-173.3	0	0	0	0	110.3	H72 V73 V74 G117 V118 S121 L136 I138	H72-V115 HydrophobicContact CB-CG1 4.01Å; V73-V115 CarbonylContact O-C 3.58Å; V73-V115 WeakPolarHBondContact O-CA 3.42Å; V74-V115 HydrophobicContact CG2-CG2 4.2Å; V115-G117 PolarHBondContact O-N 2.98Å; V115-V118 HydrophobicContact CB-CB 4.24Å; V115-V118 HydrophobicContact CB-CG2 4.29Å; V115-V118 HydrophobicContact CG1-CB 4.49Å; V115-V118 HydrophobicContact CG1-CG2 4Å; V115-V118 PolarHBondContact O-N 3.21Å; V115-V118 VanDerWaalsContact O-N 3.14Å; V115-S121 WeakPolarHBondContact CA-OG 3.31Å; V115-S121 WeakPolarHBondContact CB-OG 3.48Å; V115-S121 PolarHBondContact N-OG 3.13Å; V115-S121 PolarHBondContact O-OG 3.09Å; V115-L136 HydrophobicContact CG2-CD1 3.65Å; V115-I138 HydrophobicContact CG2-CD1 4.41Å; V115-I138 HydrophobicContact CG2-CG1 3.97Å
116	E	85.9	Confident	82.4	Confident	95 Å²	95	43 Å²	43	44%	0.444	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	127.9	-180	-165.9	179.1	166	0	0	111.1	V73 H75 V118	V73-E116 HydrophobicContact CB-CB 3.98Å; V73-E116 WeakPolarHBondContact CB-OE2 3.48Å; V73-E116 HydrophobicContact CG1-CB 4.49Å; V73-E116 WeakPolarHBondContact CG1-OE2 3.42Å; V73-E116 WeakPolarHBondContact O-CB 3.48Å; V73-E116 PolarHBondContact O-N 2.96Å; H75-E116 IonicContact CE1-OE2 3.16Å; H75-E116 IonicContact NE2-OE2 2.67Å; H75-E116 PolarHBondContact NE2-OE2 3.26Å; E116-V118 VanDerWaalsContact C-N 3.25Å; E116-V118 PolarHBondContact O-N 3.01Å
117	G	78.3	Confident	83.2	Confident	80 Å²	80	42.4 Å²	42.4	83%	0.825	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.3	4.3	178.3	0	0	0	0	0	115.3	V115	V115-G117 PolarHBondContact O-N 2.98Å
118	V	81.2	Confident	83.8	Confident	19 Å²	19	40.4 Å²	40.4	12%	0.115	24%	0.235	C	C	.	.			trans	-115.4	105.9	176.7	-174.1	0	0	0	0	109.3	V115 E116 S121 I138 N139	V115-V118 HydrophobicContact CB-CB 4.24Å; V115-V118 HydrophobicContact CB-CG2 4.29Å; V115-V118 HydrophobicContact CG1-CB 4.49Å; V115-V118 HydrophobicContact CG1-CG2 4Å; V115-V118 PolarHBondContact O-N 3.21Å; V115-V118 VanDerWaalsContact O-N 3.14Å; E116-V118 VanDerWaalsContact C-N 3.25Å; E116-V118 PolarHBondContact O-N 3.01Å; V118-S121 WeakPolarHBondContact O-CB 3.36Å; V118-S121 PolarHBondContact O-N 3.1Å; V118-S121 PolarHBondContact O-OG 2.6Å; V118-I138 HydrophobicContact CG1-CG2 4.47Å; V118-I138 HydrophobicContact CG2-CG2 4.4Å; V118-N139 WeakPolarHBondContact CG1-OD1 3.34Å
119	P	74.8	Confident	83.9	Confident	112 Å²	112	41.3 Å²	41.3	73%	0.727	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	147.1	177.1	28	-33.5	0	0	0	110.3	S121	P119-S121 PolarHBondContact O-N 2.95Å
120	E	74.2	Confident	83.5	Confident	151 Å²	151	44.1 Å²	44.1	71%	0.706	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	19.1	180	-53.7	-174.5	-172.1	0	0	114.8	K374	E120-K374 IonicContact OE2-NZ 2.74Å; E120-K374 PolarHBondContact OE2-NZ 2.6Å
121	S	84.2	Confident	83.4	Confident	14 Å²	14	43.9 Å²	43.9	10%	0.098	27%	0.265	C	S	.	.			trans	-75.8	143.7	173.4	54.1	0	0	0	0	111.7	Y114 V115 V118 P119 Q137	Y114-S121 WeakPolarHBondContact CB-O 3.26Å; V115-S121 WeakPolarHBondContact CA-OG 3.31Å; V115-S121 WeakPolarHBondContact CB-OG 3.48Å; V115-S121 PolarHBondContact N-OG 3.13Å; V115-S121 PolarHBondContact O-OG 3.09Å; V118-S121 WeakPolarHBondContact O-CB 3.36Å; V118-S121 PolarHBondContact O-N 3.1Å; V118-S121 PolarHBondContact O-OG 2.6Å; P119-S121 PolarHBondContact O-N 2.95Å; S121-Q137 WeakPolarHBondContact CB-O 3.3Å
122	L	86.5	Confident	83.6	Confident	44 Å²	44	43.1 Å²	43.1	23%	0.23	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.1	178.9	-177.7	66.7	0	0	0	110.3	V124 Q137 E373	L122-V124 HydrophobicContact CD1-CG2 4.06Å; L122-V124 HydrophobicContact CD2-CG2 3.97Å; L122-V124 HydrophobicContact CG-CG2 3.87Å; L122-Q137 HydrophobicContact CB-CB 4.05Å; L122-Q137 PolarHBondContact N-O 2.65Å; L122-Q137 PolarHBondContact O-N 3.38Å; L122-E373 WeakPolarHBondContact CD2-OE2 3.47Å
123	A	90.4	Very high	83.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.2	168	0	0	0	0	0	109.6	V74 H112 G113 F125 L136	V74-A123 HydrophobicContact CG1-CB 3.45Å; V74-A123 VanDerWaalsContact CG1-CB 3.45Å; H112-A123 CarbonylContact C-O 3.49Å; H112-A123 VanDerWaalsContact CA-O 3.28Å; H112-A123 WeakPolarHBondContact CA-O 3.49Å; G113-A123 PolarHBondContact N-O 3.23Å; G113-A123 PolarHBondContact O-N 3.2Å; A123-F125 HydrophobicContact CB-CE2 4.08Å; A123-F125 HydrophobicContact CB-CZ 4.18Å; A123-L136 HydrophobicContact CB-CD1 3.73Å
124	V	91.2	Very high	84	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	110.3	179.6	-174.7	0	0	0	0	107.8	Y111 L122 G134 V135 N240 I241 S244	Y111-V124 WeakPolarHBondContact O-CA 3.31Å; L122-V124 HydrophobicContact CD1-CG2 4.06Å; L122-V124 HydrophobicContact CD2-CG2 3.97Å; L122-V124 HydrophobicContact CG-CG2 3.87Å; V124-G134 CarbonylContact O-C 3.51Å; V124-G134 VanDerWaalsContact O-CA 3.29Å; V124-G134 WeakPolarHBondContact O-CA 3.41Å; V124-V135 PolarHBondContact N-O 3.32Å; V124-V135 PolarHBondContact O-N 2.96Å; V124-N240 HydrophobicContact CG1-CB 4.37Å; V124-N240 WeakPolarHBondContact CG1-ND2 3.15Å; V124-N240 WeakPolarHBondContact CG1-O 3.28Å; V124-I241 HydrophobicContact CG1-CG1 4.29Å; V124-S244 WeakPolarHBondContact CG2-OG 3.46Å
125	F	91.4	Very high	84.2	Confident	1 Å²	1	39.6 Å²	39.6	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.4	-175.4	-59.4	-39.7	0	0	0	112	V74 M76 Y111 A123 F132 R133 L136 I145 N240	V74-F125 HydrophobicContact CG1-CE2 4.03Å; M76-F125 HydrophobicContact CE-CD2 3.62Å; M76-F125 HydrophobicContact CE-CE2 3.77Å; M76-F125 HydrophobicContact SD-CD2 4.22Å; Y111-F125 PolarHBondContact N-O 3.09Å; Y111-F125 PolarHBondContact O-N 3.18Å; Y111-F125 VanDerWaalsContact O-N 3.1Å; A123-F125 HydrophobicContact CB-CE2 4.08Å; A123-F125 HydrophobicContact CB-CZ 4.18Å; F125-F132 HydrophobicContact CB-CD1 4.15Å; F125-F132 HydrophobicContact CD2-CD1 4.45Å; F125-F132 HydrophobicContact CG-CD1 4.47Å; F125-R133 CarbonylContact C-O 3.43Å; F125-R133 WeakPolarHBondContact CA-O 3.45Å; F125-L136 HydrophobicContact CE1-CB 4.17Å; F125-L136 HydrophobicContact CZ-CB 4.11Å; F125-L136 HydrophobicContact CZ-CD1 4.08Å; F125-L136 HydrophobicContact CZ-CG 4.48Å; F125-I145 HydrophobicContact CD1-CG2 3.74Å; F125-I145 HydrophobicContact CE1-CG2 3.44Å; F125-I145 VanDerWaalsContact CE1-CG2 3.44Å; F125-I145 HydrophobicContact CZ-CG2 4.36Å; F125-N240 PolarHBondContact O-ND2 2.93Å
126	S	88.1	Confident	84.4	Confident	10 Å²	10	40 Å²	40	7%	0.07	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.5	158.3	175.3	0	0	0	0	108.4	C109 C128 G131 F132 R133	C109-S126 CarbonylContact O-C 3.59Å; C109-S126 WeakPolarHBondContact O-CA 3.45Å; S126-C128 PolarHBondContact OG-N 3.32Å; S126-C128 PolarHBondContact OG-SG 2.85Å; S126-G131 VanDerWaalsContact O-O 3.12Å; S126-F132 CarbonylContact O-C 3.57Å; S126-F132 WeakPolarHBondContact O-CA 3.25Å; S126-R133 PolarHBondContact N-O 2.68Å; S126-R133 PolarHBondContact O-N 2.82Å
127	A	85.9	Confident	84.4	Confident	29 Å²	29	36.1 Å²	36.1	24%	0.24	23%	0.23	C	C	.	.			trans	-117.8	10.7	174	0	0	0	0	0	112.3	C109 Y111 F129 G131 F132	C109-A127 PolarHBondContact O-N 3.37Å; Y111-A127 HydrophobicContact CD2-CB 4.41Å; Y111-A127 HydrophobicContact CE2-CB 3.87Å; A127-F129 PolarHBondContact O-N 3.11Å; A127-F129 VanDerWaalsContact O-N 3.17Å; A127-G131 WeakPolarHBondContact CA-O 3.38Å; A127-F132 HydrophobicContact CB-CD1 4.01Å; A127-F132 HydrophobicContact CB-CE1 3.97Å
128	C	77.7	Confident	84.8	Confident	30 Å²	30	32.6 Å²	32.6	20%	0.203	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22	-168.1	-46	0	0	0	0	113.5	C109 S126	C109-C128 HydrophobicContact CB-CB 3.68Å; C109-C128 WeakPolarHBondContact CB-SG 3.31Å; C109-C128 WeakPolarHBondContact SG-CB 3.43Å; C109-C128 CovalentContact SG-SG 2.02Å; C109-C128 PolarHBondContact SG-SG 2.74Å; S126-C128 PolarHBondContact OG-N 3.32Å; S126-C128 PolarHBondContact OG-SG 2.85Å
129	F	74.4	Confident	84.8	Confident	122 Å²	122	37.7 Å²	37.7	54%	0.535	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	37.2	-171.5	-58.1	-82.1	0	0	0	113.1	A127 E233	A127-F129 PolarHBondContact O-N 3.11Å; A127-F129 VanDerWaalsContact O-N 3.17Å; F129-E233 WeakPolarHBondContact CD1-OE1 3.46Å; F129-E233 HydrophobicContact CD2-CG 3.92Å; F129-E233 HydrophobicContact CE1-CG 4.06Å; F129-E233 WeakPolarHBondContact CE1-OE1 3.49Å; F129-E233 HydrophobicContact CE2-CB 4.49Å; F129-E233 HydrophobicContact CE2-CG 3.41Å; F129-E233 VanDerWaalsContact CE2-CG 3.41Å; F129-E233 HydrophobicContact CG-CG 4.47Å; F129-E233 HydrophobicContact CZ-CG 3.47Å; F129-E233 VanDerWaalsContact CZ-CG 3.47Å
130	G	72.4	Confident	84.8	Confident	65 Å²	65	35.3 Å²	35.3	67%	0.67	22%	0.215	S	C	*	.	S	Bend	trans	81.6	17.7	170.6	0	0	0	0	0	115.5	F154	G130-F154 WeakPolarHBondContact O-CE2 3.31Å
131	G	83.1	Confident	85.2	Confident	5 Å²	5	30.9 Å²	30.9	5%	0.052	20%	0.195	C	C	.	.	S	Bend	trans	-178	168.4	173.8	0	0	0	0	0	112.3	S126 A127	S126-G131 VanDerWaalsContact O-O 3.12Å; A127-G131 WeakPolarHBondContact CA-O 3.38Å
132	F	88.9	Confident	85.2	Confident	6 Å²	6	31.2 Å²	31.2	3%	0.026	20%	0.197	C	C	.	.			trans	-77.3	123.3	177.2	-63.4	-46.9	0	0	0	112.3	P45 Y63 M76 F125 S126 A127 I145 P147 F154 H156	P45-F132 HydrophobicContact CB-CD2 3.85Å; P45-F132 HydrophobicContact CB-CE2 3.69Å; P45-F132 HydrophobicContact CG-CD2 3.72Å; P45-F132 HydrophobicContact CG-CE2 4.1Å; Y63-F132 AromaticContact CD1-CE2 3.75Å; Y63-F132 HydrophobicContact CD1-CE2 3.75Å; Y63-F132 AromaticContact CD1-CZ 4Å; Y63-F132 HydrophobicContact CD1-CZ 4Å; Y63-F132 HydrophobicContact CD2-CE2 4.16Å; Y63-F132 AromaticContact CD2-CZ 3.76Å; Y63-F132 HydrophobicContact CD2-CZ 3.76Å; Y63-F132 AromaticContact CE1-CE2 3.93Å; Y63-F132 HydrophobicContact CE1-CE2 3.93Å; Y63-F132 AromaticContact CE1-CZ 3.85Å; Y63-F132 HydrophobicContact CE1-CZ 3.85Å; Y63-F132 HydrophobicContact CE2-CE2 4.33Å; Y63-F132 AromaticContact CE2-CZ 3.6Å; Y63-F132 HydrophobicContact CE2-CZ 3.6Å; Y63-F132 AromaticContact CG-CE2 3.87Å; Y63-F132 HydrophobicContact CG-CE2 3.87Å; Y63-F132 AromaticContact CG-CZ 3.95Å; Y63-F132 HydrophobicContact CG-CZ 3.95Å; Y63-F132 AromaticContact CZ-CZ 3.65Å; M76-F132 HydrophobicContact CE-CZ 4.29Å; M76-F132 HydrophobicContact SD-CE1 4.12Å; M76-F132 HydrophobicContact SD-CZ 4.17Å; F125-F132 HydrophobicContact CB-CD1 4.15Å; F125-F132 HydrophobicContact CD2-CD1 4.45Å; F125-F132 HydrophobicContact CG-CD1 4.47Å; S126-F132 CarbonylContact O-C 3.57Å; S126-F132 WeakPolarHBondContact O-CA 3.25Å; A127-F132 HydrophobicContact CB-CD1 4.01Å; A127-F132 HydrophobicContact CB-CE1 3.97Å; F132-I145 HydrophobicContact CB-CD1 4.28Å; F132-P147 WeakPolarHBondContact O-CD 3.27Å; F132-F154 HydrophobicContact CD2-CE1 4.18Å; F132-F154 HydrophobicContact CE2-CE1 4.01Å; F132-F154 HydrophobicContact CE2-CZ 4.43Å; F132-H156 PolarHBondContact N-NE2 2.82Å; F132-H156 PolarHBondContact O-CD2 3.31Å
133	R	90.1	Very high	85.3	Confident	35 Å²	35	30.9 Å²	30.9	13%	0.132	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.3	167	-170.2	176.7	179.5	-153.4	-6	109.3	F125 S126 I145 E233 D234 L237	F125-R133 CarbonylContact C-O 3.43Å; F125-R133 WeakPolarHBondContact CA-O 3.45Å; S126-R133 PolarHBondContact N-O 2.68Å; S126-R133 PolarHBondContact O-N 2.82Å; R133-I145 CarbonylContact C-O 3.36Å; R133-I145 VanDerWaalsContact CA-O 3.28Å; R133-I145 WeakPolarHBondContact CA-O 3.45Å; R133-E233 IonicContact NH1-OE2 3.28Å; R133-D234 IonicContact CZ-OD1 2.85Å; R133-D234 VanDerWaalsContact CZ-OD1 3.24Å; R133-D234 IonicContact NH1-OD1 3.13Å; R133-D234 PolarHBondContact NH1-OD1 3.37Å; R133-D234 IonicContact NH2-OD1 2.65Å; R133-D234 PolarHBondContact NH2-OD1 3.34Å; R133-L237 HydrophobicContact CG-CD2 4.09Å
134	G	91.4	Very high	85.3	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-153	177.5	0	0	0	0	0	114.5	V124 E144 I145	V124-G134 CarbonylContact O-C 3.51Å; V124-G134 VanDerWaalsContact O-CA 3.29Å; V124-G134 WeakPolarHBondContact O-CA 3.41Å; G134-E144 WeakPolarHBondContact O-CA 3.44Å; G134-I145 PolarHBondContact N-O 3Å; G134-I145 PolarHBondContact O-N 3.08Å
135	V	91.6	Very high	85.3	Confident	10 Å²	10	31.2 Å²	31.2	6%	0.061	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.7	-169.8	-176.7	0	0	0	0	110.6	V124 T142 Y143 I241	V124-V135 PolarHBondContact N-O 3.32Å; V124-V135 PolarHBondContact O-N 2.96Å; V135-T142 HydrophobicContact CG1-CG2 3.41Å; V135-T142 VanDerWaalsContact CG1-CG2 3.41Å; V135-Y143 CarbonylContact C-O 3.58Å; V135-Y143 WeakPolarHBondContact CA-O 3.22Å; V135-I241 HydrophobicContact CG2-CD1 3.69Å; V135-I241 HydrophobicContact CG2-CG1 4.11Å
136	L	90.9	Very high	85.2	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.042	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.4	176.7	-178.7	64.1	0	0	0	109.4	L65 V74 V115 A123 F125 I138 Y143	L65-L136 HydrophobicContact CD1-CD2 3.88Å; V74-L136 HydrophobicContact CG2-CD1 4.14Å; V115-L136 HydrophobicContact CG2-CD1 3.65Å; A123-L136 HydrophobicContact CB-CD1 3.73Å; F125-L136 HydrophobicContact CE1-CB 4.17Å; F125-L136 HydrophobicContact CZ-CB 4.11Å; F125-L136 HydrophobicContact CZ-CD1 4.08Å; F125-L136 HydrophobicContact CZ-CG 4.48Å; L136-I138 HydrophobicContact CD1-CG1 4.44Å; L136-I138 HydrophobicContact CD2-CD1 3.73Å; L136-I138 HydrophobicContact CD2-CG1 4.41Å; L136-I138 HydrophobicContact CG-CD1 3.94Å; L136-I138 HydrophobicContact CG-CG1 4.05Å; L136-Y143 PolarHBondContact N-O 2.85Å; L136-Y143 WeakPolarHBondContact O-CB 3.23Å; L136-Y143 WeakPolarHBondContact O-CD2 3.46Å; L136-Y143 PolarHBondContact O-N 2.95Å
137	Q	85.9	Confident	85.2	Confident	14 Å²	14	35.2 Å²	35.2	7%	0.065	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.1	179.5	-157.9	-160.9	28.1	0	0	110.3	S121 L122 L141 E373	S121-Q137 WeakPolarHBondContact CB-O 3.3Å; L122-Q137 HydrophobicContact CB-CB 4.05Å; L122-Q137 PolarHBondContact N-O 2.65Å; L122-Q137 PolarHBondContact O-N 3.38Å; Q137-L141 WeakPolarHBondContact CA-O 3.12Å; Q137-E373 VanDerWaalsContact CD-CD 3.42Å; Q137-E373 PolarHBondContact NE2-OE1 3.13Å; Q137-E373 PolarHBondContact NE2-OE2 2.89Å; Q137-E373 PolarHBondContact OE1-OE2 3.2Å; Q137-E373 VanDerWaalsContact OE1-OE2 3.05Å
138	I	86.6	Confident	85.1	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.036	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	120.1	-178.3	-59.2	170.8	0	0	0	108.7	L67 V115 V118 L136 G140 L141 Y143	L67-I138 HydrophobicContact CD2-CD1 4.13Å; V115-I138 HydrophobicContact CG2-CD1 4.41Å; V115-I138 HydrophobicContact CG2-CG1 3.97Å; V118-I138 HydrophobicContact CG1-CG2 4.47Å; V118-I138 HydrophobicContact CG2-CG2 4.4Å; L136-I138 HydrophobicContact CD1-CG1 4.44Å; L136-I138 HydrophobicContact CD2-CD1 3.73Å; L136-I138 HydrophobicContact CD2-CG1 4.41Å; L136-I138 HydrophobicContact CG-CD1 3.94Å; L136-I138 HydrophobicContact CG-CG1 4.05Å; I138-G140 VanDerWaalsContact C-N 3.3Å; I138-G140 PolarHBondContact O-N 3.46Å; I138-L141 PolarHBondContact N-O 3.48Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 2.88Å; I138-Y143 HydrophobicContact CB-CE2 4.27Å
139	N	80.8	Confident	85	Confident	126 Å²	126	44.3 Å²	44.3	67%	0.674	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	42.4	177.4	-58.8	-36.3	0	0	0	113.6	V118 L141	V118-N139 WeakPolarHBondContact CG1-OD1 3.34Å; N139-L141 PolarHBondContact O-N 3.24Å
140	G	74.5	Confident	84.8	Confident	62 Å²	62	47.6 Å²	47.6	64%	0.639	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	12.7	-179.1	0	0	0	0	0	114.9	I138	I138-G140 VanDerWaalsContact C-N 3.3Å; I138-G140 PolarHBondContact O-N 3.46Å
141	L	82.3	Confident	84.8	Confident	57 Å²	57	46 Å²	46	30%	0.298	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.1	170.5	-62.5	174.7	0	0	0	109.5	Q137 I138 N139 Y143	Q137-L141 WeakPolarHBondContact CA-O 3.12Å; I138-L141 PolarHBondContact N-O 3.48Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 2.88Å; N139-L141 PolarHBondContact O-N 3.24Å; L141-Y143 HydrophobicContact CB-CD2 4.49Å; L141-Y143 HydrophobicContact CB-CE2 3.67Å; L141-Y143 WeakPolarHBondContact O-CD2 3.35Å
142	T	85.3	Confident	84.3	Confident	21 Å²	21	50.8 Å²	50.8	13%	0.129	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.9	177.9	-49.4	0	0	0	0	110.1	V135 I161 E373	V135-T142 HydrophobicContact CG1-CG2 3.41Å; V135-T142 VanDerWaalsContact CG1-CG2 3.41Å; T142-I161 HydrophobicContact CG2-CD1 3.96Å; T142-I161 PolarHBondContact O-N 3.25Å; T142-E373 PolarHBondContact OG1-OE1 3.39Å
143	Y	88.9	Confident	83.8	Confident	38 Å²	38	54.1 Å²	54.1	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.3	179	-60.5	-91.5	0	0	0	109.8	L67 V135 L136 I138 L141 V158 Y159 K160	L67-Y143 HydrophobicContact CD2-CD1 3.89Å; L67-Y143 HydrophobicContact CD2-CD2 4.11Å; L67-Y143 HydrophobicContact CD2-CE1 3.72Å; L67-Y143 HydrophobicContact CD2-CE2 3.97Å; L67-Y143 HydrophobicContact CD2-CG 4.07Å; V135-Y143 CarbonylContact C-O 3.58Å; V135-Y143 WeakPolarHBondContact CA-O 3.22Å; L136-Y143 PolarHBondContact N-O 2.85Å; L136-Y143 WeakPolarHBondContact O-CB 3.23Å; L136-Y143 WeakPolarHBondContact O-CD2 3.46Å; L136-Y143 PolarHBondContact O-N 2.95Å; I138-Y143 HydrophobicContact CB-CE2 4.27Å; L141-Y143 HydrophobicContact CB-CD2 4.49Å; L141-Y143 HydrophobicContact CB-CE2 3.67Å; L141-Y143 WeakPolarHBondContact O-CD2 3.35Å; Y143-V158 HydrophobicContact CD1-CG1 3.98Å; Y143-V158 HydrophobicContact CG-CG1 4.26Å; Y143-Y159 CarbonylContact C-O 3.57Å; Y143-Y159 VanDerWaalsContact CA-O 3.24Å; Y143-Y159 WeakPolarHBondContact CA-O 3.36Å; Y143-K160 HydrophobicContact CD1-CB 4.09Å; Y143-K160 HydrophobicContact CD1-CG 4.32Å; Y143-K160 HydrophobicContact CE1-CB 3.99Å; Y143-K160 HydrophobicContact CE1-CD 4.41Å; Y143-K160 HydrophobicContact CE1-CG 3.95Å
144	E	89.8	Confident	83.5	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.023	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.8	171.2	-169	169.3	-173.5	0	0	109	H36 G134 V158 Y159 I161 T331	H36-E144 IonicContact CE1-OE2 3.97Å; G134-E144 WeakPolarHBondContact O-CA 3.44Å; E144-V158 CarbonylContact O-C 3.51Å; E144-V158 VanDerWaalsContact O-CA 3.32Å; E144-V158 WeakPolarHBondContact O-CA 3.44Å; E144-Y159 PolarHBondContact N-O 2.84Å; E144-Y159 PolarHBondContact O-N 3.28Å; E144-I161 HydrophobicContact CB-CD1 4.31Å; E144-T331 VanDerWaalsContact OE2-CB 3.32Å; E144-T331 WeakPolarHBondContact OE2-CB 3.35Å; E144-T331 WeakPolarHBondContact OE2-CG2 3.38Å
145	I	91.2	Very high	83.3	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135	176.8	-172.5	169.1	0	0	0	109.4	V43 F125 F132 R133 G134 H156 L157 V158	V43-I145 HydrophobicContact CG2-CD1 4.14Å; F125-I145 HydrophobicContact CD1-CG2 3.74Å; F125-I145 HydrophobicContact CE1-CG2 3.44Å; F125-I145 VanDerWaalsContact CE1-CG2 3.44Å; F125-I145 HydrophobicContact CZ-CG2 4.36Å; F132-I145 HydrophobicContact CB-CD1 4.28Å; R133-I145 CarbonylContact C-O 3.36Å; R133-I145 VanDerWaalsContact CA-O 3.28Å; R133-I145 WeakPolarHBondContact CA-O 3.45Å; G134-I145 PolarHBondContact N-O 3Å; G134-I145 PolarHBondContact O-N 3.08Å; I145-H156 HydrophobicContact CD1-CB 3.75Å; I145-H156 HydrophobicContact CG1-CB 3.65Å; I145-L157 WeakPolarHBondContact CA-O 3.34Å; I145-V158 HydrophobicContact CB-CG2 4.2Å; I145-V158 HydrophobicContact CD1-CG2 4.09Å; I145-V158 HydrophobicContact CG1-CG2 3.91Å
146	E	89.6	Confident	83.3	Confident	52 Å²	52	58.4 Å²	58.4	24%	0.243	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.9	172.2	69.1	179.4	-179.5	0	0	111.6	H156 L157 Y159	E146-H156 CarbonylContact O-C 3.55Å; E146-H156 WeakPolarHBondContact O-CA 3.21Å; E146-H156 WeakPolarHBondContact O-CB 3.26Å; E146-L157 HydrophobicContact CG-CB 4.04Å; E146-L157 PolarHBondContact N-O 2.88Å; E146-L157 PolarHBondContact O-N 2.84Å; E146-Y159 HydrophobicContact CG-CE2 3.83Å; E146-Y159 WeakPolarHBondContact OE1-CE2 3.32Å; E146-Y159 VanDerWaalsContact OE1-CZ 3.3Å; E146-Y159 PolarHBondContact OE1-OH 3.39Å
147	P	87.9	Confident	83.3	Confident	43 Å²	43	59.8 Å²	59.8	28%	0.279	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	140.1	178.1	31.2	-33	0	0	0	111.5	F132 R149 H156	F132-P147 WeakPolarHBondContact O-CD 3.27Å; P147-R149 PolarHBondContact O-N 3.45Å; P147-H156 VanDerWaalsContact CA-CD2 3.44Å; P147-H156 WeakPolarHBondContact CA-CD2 3.42Å
148	I	83.6	Confident	83.5	Confident	59 Å²	59	59.6 Å²	59.6	30%	0.303	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-70.6	123.1	167.8	-62.2	-177.3	0	0	0	108.2	H150 S151 E155 L157	I148-H150 PolarHBondContact O-N 3.36Å; I148-S151 PolarHBondContact O-N 2.88Å; I148-S151 VanDerWaalsContact O-N 3.17Å; I148-E155 HydrophobicContact CD1-CB 3.73Å; I148-E155 HydrophobicContact CG1-CB 4.3Å; I148-E155 PolarHBondContact N-O 2.96Å; I148-L157 HydrophobicContact CD1-CD2 4.01Å; I148-L157 HydrophobicContact CD1-CG 4.13Å; I148-L157 HydrophobicContact CG1-CD1 4.31Å; I148-L157 HydrophobicContact CG1-CD2 4.26Å; I148-L157 HydrophobicContact CG1-CG 3.81Å
149	R	75.5	Confident	83.6	Confident	191 Å²	191	60.1 Å²	60.1	72%	0.721	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	126.4	178.5	-70.3	-170.1	-176.2	-171.8	1.2	110.1	P147 S151	P147-R149 PolarHBondContact O-N 3.45Å; R149-S151 VanDerWaalsContact C-N 3.3Å; R149-S151 PolarHBondContact O-N 3.49Å
150	H	70.9	Confident	83.8	Confident	190 Å²	190	58.1 Å²	58.1	88%	0.88	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	26.9	178.8	-47.5	-67.3	0	0	0	115.6	I148 A152	I148-H150 PolarHBondContact O-N 3.36Å; H150-A152 PolarHBondContact O-N 2.94Å
151	S	72.9	Confident	83.9	Confident	33 Å²	33	56.2 Å²	56.2	23%	0.231	29%	0.287	C	S	.	.			trans	-63.3	128.5	172.7	175.7	0	0	0	0	111.4	I148 R149 T153 F154 E155	I148-S151 PolarHBondContact O-N 2.88Å; I148-S151 VanDerWaalsContact O-N 3.17Å; R149-S151 VanDerWaalsContact C-N 3.3Å; R149-S151 PolarHBondContact O-N 3.49Å; S151-T153 VanDerWaalsContact C-N 3.28Å; S151-T153 PolarHBondContact OG-N 3.46Å; S151-F154 PolarHBondContact OG-N 3.48Å; S151-E155 WeakPolarHBondContact OG-CB 3.46Å; S151-E155 PolarHBondContact OG-N 2.98Å; S151-E155 PolarHBondContact OG-OE2 3.23Å
152	A	71.9	Confident	83.1	Confident	105 Å²	105	56.1 Å²	56.1	87%	0.868	29%	0.287	S	S	*	.	S	Bend	trans	-77.6	-13.8	174.6	0	0	0	0	0	113.1	H150	H150-A152 PolarHBondContact O-N 2.94Å
153	T	79.1	Confident	81.6	Confident	76 Å²	76	58 Å²	58	47%	0.466	30%	0.3	S	S	.	.	S	Bend	trans	-119.1	12.3	-173	66	0	0	0	0	113.6	I44 S151 E155	I44-T153 WeakPolarHBondContact CG2-O 3.45Å; S151-T153 VanDerWaalsContact C-N 3.28Å; S151-T153 PolarHBondContact OG-N 3.46Å; T153-E155 WeakPolarHBondContact OG1-CG 3.49Å; T153-E155 PolarHBondContact OG1-OE2 2.84Å; T153-E155 VanDerWaalsContact OG1-OE2 3.12Å
154	F	82.8	Confident	79.6	Confident	72 Å²	72	60.9 Å²	60.9	32%	0.316	32%	0.319	S	S	.	.			trans	61.6	45.2	-179.4	-156.3	-110.7	0	0	0	111.9	P45 G130 F132 S151 H156	P45-F154 HydrophobicContact CB-CD1 4.26Å; P45-F154 HydrophobicContact CB-CE1 4.1Å; P45-F154 VanDerWaalsContact CD-O 3.3Å; P45-F154 WeakPolarHBondContact CD-O 3.38Å; P45-F154 HydrophobicContact CG-CD1 4.17Å; P45-F154 HydrophobicContact CG-CE1 4.1Å; G130-F154 WeakPolarHBondContact O-CE2 3.31Å; F132-F154 HydrophobicContact CD2-CE1 4.18Å; F132-F154 HydrophobicContact CE2-CE1 4.01Å; F132-F154 HydrophobicContact CE2-CZ 4.43Å; S151-F154 PolarHBondContact OG-N 3.48Å; F154-H156 AromaticContact CD1-CE1 3.55Å; F154-H156 AromaticContact CE1-CE1 3.61Å; F154-H156 AromaticContact CG-CE1 3.88Å; F154-H156 PolarHBondContact O-CE1 2.99Å; F154-H156 VanDerWaalsContact O-CE1 3.23Å; F154-H156 PolarHBondContact O-ND1 3.38Å; F154-H156 VanDerWaalsContact O-ND1 3.08Å
155	E	87.2	Confident	77.4	Confident	63 Å²	63	68.6 Å²	68.6	29%	0.294	36%	0.355	S	S	.	.			trans	-81.7	144.8	177.1	-68.7	153.2	131.6	0	0	112.4	V42 I44 I148 S151 T153	V42-E155 HydrophobicContact CG1-CB 4.23Å; V42-E155 HydrophobicContact CG1-CG 4.25Å; I44-E155 HydrophobicContact CD1-CG 3.94Å; I44-E155 HydrophobicContact CG1-CG 3.71Å; I148-E155 HydrophobicContact CD1-CB 3.73Å; I148-E155 HydrophobicContact CG1-CB 4.3Å; I148-E155 PolarHBondContact N-O 2.96Å; S151-E155 WeakPolarHBondContact OG-CB 3.46Å; S151-E155 PolarHBondContact OG-N 2.98Å; S151-E155 PolarHBondContact OG-OE2 3.23Å; T153-E155 WeakPolarHBondContact OG1-CG 3.49Å; T153-E155 PolarHBondContact OG1-OE2 2.84Å; T153-E155 VanDerWaalsContact OG1-OE2 3.12Å
156	H	91.8	Very high	75	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.9	178.7	-59.9	75.3	0	0	0	110.3	V42 V43 P45 F132 I145 E146 P147 F154	V42-H156 WeakPolarHBondContact CA-O 3.18Å; V43-H156 HydrophobicContact CG2-CB 3.81Å; V43-H156 PolarHBondContact N-O 3.37Å; V43-H156 PolarHBondContact O-N 3.04Å; P45-H156 WeakPolarHBondContact CD-ND1 3.39Å; P45-H156 VanDerWaalsContact CG-ND1 3.27Å; P45-H156 WeakPolarHBondContact CG-ND1 3.42Å; F132-H156 PolarHBondContact N-NE2 2.82Å; F132-H156 PolarHBondContact O-CD2 3.31Å; I145-H156 HydrophobicContact CD1-CB 3.75Å; I145-H156 HydrophobicContact CG1-CB 3.65Å; E146-H156 CarbonylContact O-C 3.55Å; E146-H156 WeakPolarHBondContact O-CA 3.21Å; E146-H156 WeakPolarHBondContact O-CB 3.26Å; P147-H156 VanDerWaalsContact CA-CD2 3.44Å; P147-H156 WeakPolarHBondContact CA-CD2 3.42Å; F154-H156 AromaticContact CD1-CE1 3.55Å; F154-H156 AromaticContact CE1-CE1 3.61Å; F154-H156 AromaticContact CG-CE1 3.88Å; F154-H156 PolarHBondContact O-CE1 2.99Å; F154-H156 VanDerWaalsContact O-CE1 3.23Å; F154-H156 PolarHBondContact O-ND1 3.38Å; F154-H156 VanDerWaalsContact O-ND1 3.08Å
157	L	90.8	Very high	72.7	Confident	37 Å²	37	79.4 Å²	79.4	19%	0.194	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.7	168.3	-61.3	172.3	0	0	0	108	P40 V42 I145 E146 I148 Y159	P40-L157 HydrophobicContact CB-CB 4.06Å; P40-L157 HydrophobicContact CB-CD2 3.97Å; P40-L157 HydrophobicContact CB-CG 4.5Å; P40-L157 HydrophobicContact CG-CD2 4.16Å; V42-L157 HydrophobicContact CG2-CD2 3.98Å; I145-L157 WeakPolarHBondContact CA-O 3.34Å; E146-L157 HydrophobicContact CG-CB 4.04Å; E146-L157 PolarHBondContact N-O 2.88Å; E146-L157 PolarHBondContact O-N 2.84Å; I148-L157 HydrophobicContact CD1-CD2 4.01Å; I148-L157 HydrophobicContact CD1-CG 4.13Å; I148-L157 HydrophobicContact CG1-CD1 4.31Å; I148-L157 HydrophobicContact CG1-CD2 4.26Å; I148-L157 HydrophobicContact CG1-CG 3.81Å; L157-Y159 HydrophobicContact CB-CE2 3.92Å; L157-Y159 WeakPolarHBondContact CD1-OH 3.39Å
158	V	90.6	Very high	70.9	Confident	10 Å²	10	81.2 Å²	81.2	6%	0.061	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122	173.5	-173.6	0	0	0	0	109.8	P40 E41 V43 L67 Y143 E144 I145	P40-V158 WeakPolarHBondContact CA-O 3.39Å; E41-V158 PolarHBondContact N-O 2.96Å; E41-V158 PolarHBondContact O-N 3.43Å; V43-V158 HydrophobicContact CB-CG2 4.25Å; V43-V158 HydrophobicContact CG1-CB 4.42Å; V43-V158 HydrophobicContact CG1-CG2 3.75Å; V43-V158 HydrophobicContact CG2-CG2 3.43Å; V43-V158 VanDerWaalsContact CG2-CG2 3.43Å; L67-V158 HydrophobicContact CD1-CB 3.74Å; L67-V158 HydrophobicContact CD1-CG1 3.49Å; L67-V158 VanDerWaalsContact CD1-CG1 3.49Å; L67-V158 HydrophobicContact CD1-CG2 3.97Å; Y143-V158 HydrophobicContact CD1-CG1 3.98Å; Y143-V158 HydrophobicContact CG-CG1 4.26Å; E144-V158 CarbonylContact O-C 3.51Å; E144-V158 VanDerWaalsContact O-CA 3.32Å; E144-V158 WeakPolarHBondContact O-CA 3.44Å; I145-V158 HydrophobicContact CB-CG2 4.2Å; I145-V158 HydrophobicContact CD1-CG2 4.09Å; I145-V158 HydrophobicContact CG1-CG2 3.91Å
159	Y	87.6	Confident	69.1	Low	18 Å²	18	82.1 Å²	82.1	7%	0.071	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.9	176.9	-52.7	-83.3	0	0	0	109.8	H36 P40 Y143 E144 E146 L157	H36-Y159 HydrophobicContact CB-CD1 3.33Å; H36-Y159 HydrophobicContact CB-CE1 3.6Å; H36-Y159 HydrophobicContact CB-CG 3.99Å; H36-Y159 AromaticContact CD2-CD1 3.6Å; H36-Y159 AromaticContact CD2-CD2 3.89Å; H36-Y159 AromaticContact CD2-CE1 3.21Å; H36-Y159 WeakPolarHBondContact CD2-CE1 3.23Å; H36-Y159 AromaticContact CD2-CE2 3.57Å; H36-Y159 AromaticContact CD2-CG 3.89Å; H36-Y159 AromaticContact CD2-CZ 3.2Å; H36-Y159 AromaticContact CE1-CD2 3.57Å; H36-Y159 AromaticContact CE1-CE2 3.78Å; H36-Y159 AromaticContact CE1-CG 3.84Å; H36-Y159 AromaticContact CG-CD1 3.28Å; H36-Y159 AromaticContact CG-CD2 3.95Å; H36-Y159 AromaticContact CG-CE1 3.41Å; H36-Y159 VanDerWaalsContact CG-CE1 3.41Å; H36-Y159 AromaticContact CG-CG 3.53Å; H36-Y159 AromaticContact CG-CZ 3.83Å; H36-Y159 AromaticContact ND1-CD1 3.78Å; H36-Y159 AromaticContact ND1-CD2 3.75Å; H36-Y159 AromaticContact ND1-CG 3.5Å; H36-Y159 AromaticContact NE2-CD2 3.7Å; H36-Y159 AromaticContact NE2-CE1 3.98Å; H36-Y159 AromaticContact NE2-CE2 3.4Å; H36-Y159 WeakPolarHBondContact NE2-CE2 3.41Å; H36-Y159 AromaticContact NE2-CZ 3.54Å; P40-Y159 HydrophobicContact CB-CD1 3.73Å; P40-Y159 HydrophobicContact CB-CE1 3.43Å; P40-Y159 VanDerWaalsContact CB-CE1 3.43Å; P40-Y159 HydrophobicContact CG-CD1 4.31Å; P40-Y159 HydrophobicContact CG-CE1 3.68Å; Y143-Y159 CarbonylContact C-O 3.57Å; Y143-Y159 VanDerWaalsContact CA-O 3.24Å; Y143-Y159 WeakPolarHBondContact CA-O 3.36Å; E144-Y159 PolarHBondContact N-O 2.84Å; E144-Y159 PolarHBondContact O-N 3.28Å; E146-Y159 HydrophobicContact CG-CE2 3.83Å; E146-Y159 WeakPolarHBondContact OE1-CE2 3.32Å; E146-Y159 VanDerWaalsContact OE1-CZ 3.3Å; E146-Y159 PolarHBondContact OE1-OH 3.39Å; L157-Y159 HydrophobicContact CB-CE2 3.92Å; L157-Y159 WeakPolarHBondContact CD1-OH 3.39Å
160	K	85.7	Confident	68.2	Low	83 Å²	83	76.8 Å²	76.8	36%	0.361	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.7	169.7	-174.4	-178.3	177.6	-175.9	0	108.5	T38 Y143 N162	T38-K160 PolarHBondContact OG1-N 3.31Å; T38-K160 PolarHBondContact OG1-O 3.45Å; T38-K160 VanDerWaalsContact OG1-O 3.11Å; Y143-K160 HydrophobicContact CD1-CB 4.09Å; Y143-K160 HydrophobicContact CD1-CG 4.32Å; Y143-K160 HydrophobicContact CE1-CB 3.99Å; Y143-K160 HydrophobicContact CE1-CD 4.41Å; Y143-K160 HydrophobicContact CE1-CG 3.95Å; K160-N162 PolarHBondContact O-N 2.88Å
161	I	77.5	Confident	68.1	Low	22 Å²	22	70.4 Å²	70.4	11%	0.113	40%	0.397	C	S	.	.			trans	-80.3	107.7	175.7	-52	-173	0	0	0	107.3	T142 E144 S333	T142-I161 HydrophobicContact CG2-CD1 3.96Å; T142-I161 PolarHBondContact O-N 3.25Å; E144-I161 HydrophobicContact CB-CD1 4.31Å; I161-S333 WeakPolarHBondContact CD1-OG 3.28Å
162	N	64.1	Low	68.5	Low	56 Å²	56	74.1 Å²	74.1	30%	0.299	41%	0.406	S	S	.	.			trans	-75.4	129.4	-179.1	-88.5	-13	0	0	0	111	T38 K160 N164 F168	T38-N162 VanDerWaalsContact CG2-ND2 3.31Å; T38-N162 WeakPolarHBondContact CG2-ND2 3.33Å; K160-N162 PolarHBondContact O-N 2.88Å; N162-N164 VanDerWaalsContact C-N 3.35Å; N162-N164 PolarHBondContact O-N 2.94Å; N162-F168 WeakPolarHBondContact O-CE2 3.4Å; N162-F168 WeakPolarHBondContact O-CZ 3.39Å
163	S	53.7	Low	69	Low	59 Å²	59	69.6 Å²	69.6	41%	0.413	37%	0.368	S	S	.	.			trans	-93.3	27.7	176.1	70	0	0	0	0	113.1	E165	S163-E165 PolarHBondContact O-N 3.45Å
164	N	48.2	Very low	69.1	Low	100 Å²	100	66.1 Å²	66.1	54%	0.535	35%	0.348	S	S	.	.			trans	-71.9	107.3	-177.9	-81.8	0.5	0	0	0	109.4	N162 T166 Q167	N162-N164 VanDerWaalsContact C-N 3.35Å; N162-N164 PolarHBondContact O-N 2.94Å; N164-T166 PolarHBondContact O-N 3.36Å; N164-Q167 PolarHBondContact O-N 2.88Å
165	E	43.8	Very low	69	Low	167 Å²	167	62.9 Å²	62.9	78%	0.78	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-17.5	-176.6	-68.2	175.5	175.5	0	0	114.8	S163	S163-E165 PolarHBondContact O-N 3.45Å
166	T	39.2	Very low	68.8	Low	131 Å²	131	62.7 Å²	62.7	80%	0.804	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.7	-172.9	48.5	0	0	0	0	115.2	N164	N164-T166 PolarHBondContact O-N 3.36Å
167	Q	42	Very low	68	Low	151 Å²	151	71 Å²	71	71%	0.706	38%	0.376	S	S	*	.	S	Bend	trans	-131.6	-9.7	-167.7	-124.5	170.4	8.3	0	0	116.8	N164 S169	N164-Q167 PolarHBondContact O-N 2.88Å; Q167-S169 PolarHBondContact O-N 3.33Å
168	F	49.5	Very low	67.4	Low	82 Å²	82	77.6 Å²	77.6	36%	0.36	40%	0.403	S	S	.	.	S	Bend	trans	-80	110.1	164.7	-59.6	-73.4	0	0	0	106.9	N162 A170 L334	N162-F168 WeakPolarHBondContact O-CE2 3.4Å; N162-F168 WeakPolarHBondContact O-CZ 3.39Å; F168-A170 PolarHBondContact O-N 3.36Å; F168-L334 HydrophobicContact CE1-CD1 4.06Å
169	S	47.4	Very low	66.8	Low	77 Å²	77	78.1 Å²	78.1	54%	0.538	41%	0.405	S	S	.	.			trans	-48.4	129.7	163.8	50.6	0	0	0	0	107.1	Q167 M171	Q167-S169 PolarHBondContact O-N 3.33Å; S169-M171 WeakPolarHBondContact O-CG 3.44Å; S169-M171 PolarHBondContact O-N 2.79Å; S169-M171 VanDerWaalsContact OG-CE 3.22Å; S169-M171 WeakPolarHBondContact OG-CE 3.31Å
170	A	56.3	Low	66.2	Low	80 Å²	80	78.5 Å²	78.5	66%	0.661	41%	0.409	S	S	*	.			trans	-63.4	73.5	-175.4	0	0	0	0	0	111.1	F168 F368	F168-A170 PolarHBondContact O-N 3.36Å; A170-F368 HydrophobicContact CB-CD1 3.92Å; A170-F368 HydrophobicContact CB-CE1 4.02Å
171	M	67.4	Low	65.6	Low	55 Å²	55	76.6 Å²	76.6	27%	0.271	41%	0.409	S	S	.	.			trans	-77.2	128.4	176.5	-67.6	178.5	-171.5	0	0	106.8	S169 L307 Q328 R369	S169-M171 WeakPolarHBondContact O-CG 3.44Å; S169-M171 PolarHBondContact O-N 2.79Å; S169-M171 VanDerWaalsContact OG-CE 3.22Å; S169-M171 WeakPolarHBondContact OG-CE 3.31Å; M171-L307 HydrophobicContact CB-CD1 3.54Å; M171-L307 HydrophobicContact CB-CD2 4.03Å; M171-L307 HydrophobicContact CB-CG 3.7Å; M171-L307 HydrophobicContact CG-CD2 4.48Å; M171-L307 HydrophobicContact SD-CD2 3.76Å; M171-L307 HydrophobicContact SD-CG 4.47Å; M171-Q328 HydrophobicContact CE-CG 4.46Å; M171-Q328 HydrophobicContact SD-CB 4.46Å; M171-Q328 HydrophobicContact SD-CG 4.01Å; M171-R369 PolarHBondContact O-N 2.92Å
172	R	81.2	Confident	65.6	Low	111 Å²	111	81.1 Å²	81.1	42%	0.419	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-117.9	151.2	-165.4	-163.5	-170.7	171.2	164.9	-0.1	110.1	L307 T367 F368	R172-L307 PolarHBondContact O-N 3.49Å; R172-T367 WeakPolarHBondContact CG-O 3.39Å; R172-F368 HydrophobicContact CB-CD1 4.24Å; R172-F368 HydrophobicContact CB-CE1 4.31Å; R172-F368 HydrophobicContact CG-CD1 4.19Å; R172-F368 HydrophobicContact CG-CE1 4.12Å
173	C	83.9	Confident	66.4	Low	10 Å²	10	79.3 Å²	79.3	7%	0.068	41%	0.414	C	S	.	.			trans	-57.5	144.9	161.6	178.1	0	0	0	0	110.3	L175 E342 T367	C173-L175 PolarHBondContact O-N 2.97Å; C173-L175 VanDerWaalsContact SG-CB 3.53Å; C173-L175 PolarHBondContact SG-N 2.87Å; C173-L175 VanDerWaalsContact SG-N 3.37Å; C173-E342 PolarHBondContact SG-OE1 2.99Å; C173-T367 PolarHBondContact N-O 3.33Å
174	G	79.8	Confident	67.4	Low	4 Å²	4	81.2 Å²	81.2	4%	0.041	42%	0.416	C	S	.	.	S	Bend	trans	-74.6	-12.9	179.1	0	0	0	0	0	113.9	T176 G308 L309	G174-T176 PolarHBondContact O-N 3.02Å; G174-G308 PolarHBondContact N-O 2.89Å; G174-L309 VanDerWaalsContact C-CD1 3.44Å
175	L	81.7	Confident	68.5	Low	3 Å²	3	81.3 Å²	81.3	2%	0.016	42%	0.416	C	S	.	.			trans	-74.4	97.8	-176.8	-168.6	73.4	0	0	0	110.4	C173 E179 V180 L309 I312 H345 H351	C173-L175 PolarHBondContact O-N 2.97Å; C173-L175 VanDerWaalsContact SG-CB 3.53Å; C173-L175 PolarHBondContact SG-N 2.87Å; C173-L175 VanDerWaalsContact SG-N 3.37Å; L175-E179 HydrophobicContact CD1-CG 4.29Å; L175-V180 HydrophobicContact CD1-CG2 4.05Å; L175-V180 HydrophobicContact CD2-CG2 4.22Å; L175-V180 HydrophobicContact CG-CG2 3.83Å; L175-L309 HydrophobicContact CB-CD1 4.1Å; L175-L309 HydrophobicContact CD1-CD1 4.24Å; L175-I312 HydrophobicContact CD1-CD1 4.09Å; L175-I312 HydrophobicContact CD1-CG1 4.05Å; L175-I312 HydrophobicContact CD2-CD1 3.61Å; L175-I312 HydrophobicContact CD2-CG1 3.74Å; L175-I312 HydrophobicContact CG-CD1 4.29Å; L175-H345 WeakPolarHBondContact CD2-CE1 3.26Å; L175-H345 WeakPolarHBondContact CD2-NE2 3.39Å; L175-H351 PolarHBondContact O-CE1 2.88Å
176	T	81.8	Confident	69.4	Low	60 Å²	60	75.8 Å²	75.8	37%	0.368	40%	0.4	S	S	.	.			trans	-95.8	158.6	176.3	64.1	0	0	0	0	111.2	G174 K178 E179 V180	G174-T176 PolarHBondContact O-N 3.02Å; T176-K178 PolarHBondContact O-N 2.81Å; T176-K178 VanDerWaalsContact O-N 3.13Å; T176-E179 CarbonylContact O-C 3.58Å; T176-E179 WeakPolarHBondContact O-CA 3.48Å; T176-E179 WeakPolarHBondContact O-CB 3.47Å; T176-E179 PolarHBondContact O-N 3.4Å; T176-E179 PolarHBondContact OG1-N 3.14Å; T176-V180 WeakPolarHBondContact O-CG2 3.48Å; T176-V180 PolarHBondContact O-N 3.25Å
177	E	76.6	Confident	70.5	Confident	175 Å²	175	72.3 Å²	72.3	82%	0.818	37%	0.373	S	S	*	.	H	α-helix	trans	-52.3	-37.1	175.1	-68.3	178.7	-179.1	0	0	112.9	E179 V180 A181	E177-E179 VanDerWaalsContact C-N 3.33Å; E177-V180 PolarHBondContact O-N 2.75Å; E177-A181 WeakPolarHBondContact O-CB 3.33Å; E177-A181 PolarHBondContact O-N 3.24Å
178	K	76.7	Confident	71.3	Confident	176 Å²	176	70.5 Å²	70.5	77%	0.765	37%	0.365	S	S	*	.	H	α-helix	trans	-64	-40	175.3	-177.4	-179.2	175.7	-173.2	0	111.9	T176 R182	T176-K178 PolarHBondContact O-N 2.81Å; T176-K178 VanDerWaalsContact O-N 3.13Å; K178-R182 WeakPolarHBondContact O-CB 3.45Å; K178-R182 PolarHBondContact O-N 3.46Å
179	E	79.4	Confident	71.8	Confident	20 Å²	20	73.9 Å²	73.9	9%	0.093	38%	0.382	C	S	.	.	H	α-helix	trans	-71.7	-40	178.1	-174.3	54.4	-154.3	0	0	111.2	L175 T176 E177 A181 R182 Q183 L309	L175-E179 HydrophobicContact CD1-CG 4.29Å; T176-E179 CarbonylContact O-C 3.58Å; T176-E179 WeakPolarHBondContact O-CA 3.48Å; T176-E179 WeakPolarHBondContact O-CB 3.47Å; T176-E179 PolarHBondContact O-N 3.4Å; T176-E179 PolarHBondContact OG1-N 3.14Å; E177-E179 VanDerWaalsContact C-N 3.33Å; E179-A181 PolarHBondContact O-N 3.46Å; E179-R182 WeakPolarHBondContact O-CB 3.44Å; E179-R182 PolarHBondContact O-N 2.88Å; E179-R182 IonicContact OE1-CZ 3.78Å; E179-R182 VanDerWaalsContact OE1-CZ 3.28Å; E179-R182 IonicContact OE1-NE 2.91Å; E179-R182 PolarHBondContact OE1-NE 2.8Å; E179-R182 VanDerWaalsContact OE1-NE 3.13Å; E179-R182 IonicContact OE1-NH2 3.51Å; E179-R182 PolarHBondContact OE1-NH2 2.78Å; E179-R182 IonicContact OE2-CZ 2.61Å; E179-R182 IonicContact OE2-NE 3.67Å; E179-R182 PolarHBondContact OE2-NE 2.84Å; E179-R182 IonicContact OE2-NH2 2.68Å; E179-Q183 WeakPolarHBondContact O-CG 3.36Å; E179-Q183 PolarHBondContact O-N 3.21Å; E179-Q183 PolarHBondContact OE1-NE2 2.84Å; E179-L309 HydrophobicContact CG-CD1 4.44Å
180	V	75	Confident	72.1	Confident	26 Å²	26	73 Å²	73	16%	0.158	38%	0.38	C	S	.	.	H	α-helix	trans	-56.9	-49.5	171.1	179.5	0	0	0	0	110.9	L175 T176 E177 R182 Q183 Q184 I312	L175-V180 HydrophobicContact CD1-CG2 4.05Å; L175-V180 HydrophobicContact CD2-CG2 4.22Å; L175-V180 HydrophobicContact CG-CG2 3.83Å; T176-V180 WeakPolarHBondContact O-CG2 3.48Å; T176-V180 PolarHBondContact O-N 3.25Å; E177-V180 PolarHBondContact O-N 2.75Å; V180-R182 VanDerWaalsContact C-N 3.3Å; V180-R182 PolarHBondContact O-N 2.97Å; V180-Q183 PolarHBondContact O-N 3.42Å; V180-Q184 HydrophobicContact CG1-CG 4.43Å; V180-Q184 WeakPolarHBondContact O-CB 3.46Å; V180-Q184 WeakPolarHBondContact O-CG 3.45Å; V180-Q184 PolarHBondContact O-N 3.45Å; V180-I312 HydrophobicContact CB-CD1 4.34Å; V180-I312 HydrophobicContact CG1-CD1 3.95Å; V180-I312 HydrophobicContact CG2-CD1 3.78Å
181	A	72.7	Confident	71.8	Confident	43 Å²	43	74.3 Å²	74.3	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-38.4	177.7	0	0	0	0	0	112.1	E177 E179 Q184 L185	E177-A181 WeakPolarHBondContact O-CB 3.33Å; E177-A181 PolarHBondContact O-N 3.24Å; E179-A181 PolarHBondContact O-N 3.46Å; A181-Q184 PolarHBondContact O-N 3.16Å; A181-L185 WeakPolarHBondContact O-CB 3.32Å; A181-L185 VanDerWaalsContact O-CG 3.27Å; A181-L185 WeakPolarHBondContact O-CG 3.47Å; A181-L185 PolarHBondContact O-N 2.84Å
182	R	77.6	Confident	70.8	Confident	117 Å²	117	78.5 Å²	78.5	44%	0.442	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-44.8	175.7	-169.4	-172.4	74.9	82.9	-3.4	111.7	K178 E179 V180 A186	K178-R182 WeakPolarHBondContact O-CB 3.45Å; K178-R182 PolarHBondContact O-N 3.46Å; E179-R182 WeakPolarHBondContact O-CB 3.44Å; E179-R182 PolarHBondContact O-N 2.88Å; E179-R182 IonicContact OE1-CZ 3.78Å; E179-R182 VanDerWaalsContact OE1-CZ 3.28Å; E179-R182 IonicContact OE1-NE 2.91Å; E179-R182 PolarHBondContact OE1-NE 2.8Å; E179-R182 VanDerWaalsContact OE1-NE 3.13Å; E179-R182 IonicContact OE1-NH2 3.51Å; E179-R182 PolarHBondContact OE1-NH2 2.78Å; E179-R182 IonicContact OE2-CZ 2.61Å; E179-R182 IonicContact OE2-NE 3.67Å; E179-R182 PolarHBondContact OE2-NE 2.84Å; E179-R182 IonicContact OE2-NH2 2.68Å; V180-R182 VanDerWaalsContact C-N 3.3Å; V180-R182 PolarHBondContact O-N 2.97Å; R182-A186 WeakPolarHBondContact O-CB 3.37Å; R182-A186 PolarHBondContact O-N 3.21Å; R182-A186 VanDerWaalsContact O-N 3.08Å
183	Q	80.9	Confident	68.9	Low	19 Å²	19	77.8 Å²	77.8	9%	0.089	41%	0.407	C	S	.	.	H	α-helix	trans	-65	-42.8	177.3	-69.6	-178.9	17.8	0	0	111.1	E179 V180 A186 F187 Y311	E179-Q183 WeakPolarHBondContact O-CG 3.36Å; E179-Q183 PolarHBondContact O-N 3.21Å; E179-Q183 PolarHBondContact OE1-NE2 2.84Å; V180-Q183 PolarHBondContact O-N 3.42Å; Q183-A186 PolarHBondContact O-N 2.88Å; Q183-F187 VanDerWaalsContact O-CB 3.25Å; Q183-F187 WeakPolarHBondContact O-CB 3.32Å; Q183-F187 PolarHBondContact O-N 3Å; Q183-Y311 HydrophobicContact CG-CD1 4.11Å; Q183-Y311 HydrophobicContact CG-CE1 4.48Å
184	Q	74.6	Confident	66.7	Low	98 Å²	98	82.8 Å²	82.8	46%	0.458	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-44.1	176.3	-76.1	166.1	-14.6	0	0	112.5	V180 A181 F187 E188	V180-Q184 HydrophobicContact CG1-CG 4.43Å; V180-Q184 WeakPolarHBondContact O-CB 3.46Å; V180-Q184 WeakPolarHBondContact O-CG 3.45Å; V180-Q184 PolarHBondContact O-N 3.45Å; A181-Q184 PolarHBondContact O-N 3.16Å; Q184-F187 WeakPolarHBondContact O-CA 3.39Å; Q184-F187 WeakPolarHBondContact O-CB 3.45Å; Q184-F187 PolarHBondContact O-N 3.06Å; Q184-F187 VanDerWaalsContact O-N 3.12Å; Q184-E188 WeakPolarHBondContact O-CG 3.32Å; Q184-E188 PolarHBondContact O-N 2.85Å
185	L	70.9	Confident	64.5	Low	102 Å²	102	90.6 Å²	90.6	53%	0.534	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-44.7	175.8	-74.4	167.8	0	0	0	111.9	A181 F187 E188 E189	A181-L185 WeakPolarHBondContact O-CB 3.32Å; A181-L185 VanDerWaalsContact O-CG 3.27Å; A181-L185 WeakPolarHBondContact O-CG 3.47Å; A181-L185 PolarHBondContact O-N 2.84Å; L185-F187 PolarHBondContact O-N 3.36Å; L185-E188 PolarHBondContact O-N 3.36Å; L185-E189 WeakPolarHBondContact O-CG 3.15Å; L185-E189 PolarHBondContact O-N 3Å
186	A	63.5	Low	61.9	Low	52 Å²	52	98 Å²	98	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-31.2	175	0	0	0	0	0	112.1	R182 Q183 A190	R182-A186 WeakPolarHBondContact O-CB 3.37Å; R182-A186 PolarHBondContact O-N 3.21Å; R182-A186 VanDerWaalsContact O-N 3.08Å; Q183-A186 PolarHBondContact O-N 2.88Å; A186-A190 PolarHBondContact O-N 2.73Å
187	F	60.6	Low	59.4	Low	58 Å²	58	101.2 Å²	101.2	25%	0.254	53%	0.533	S	S	.	.	H	α-helix	trans	-72.8	-45.2	177.8	-165.5	-93.9	0	0	0	112.2	Q183 Q184 L185 E189 A190 E191 I320	Q183-F187 VanDerWaalsContact O-CB 3.25Å; Q183-F187 WeakPolarHBondContact O-CB 3.32Å; Q183-F187 PolarHBondContact O-N 3Å; Q184-F187 WeakPolarHBondContact O-CA 3.39Å; Q184-F187 WeakPolarHBondContact O-CB 3.45Å; Q184-F187 PolarHBondContact O-N 3.06Å; Q184-F187 VanDerWaalsContact O-N 3.12Å; L185-F187 PolarHBondContact O-N 3.36Å; F187-E189 VanDerWaalsContact C-N 3.33Å; F187-E189 PolarHBondContact O-N 3.49Å; F187-A190 PolarHBondContact O-N 3.04Å; F187-A190 VanDerWaalsContact O-N 3.15Å; F187-E191 HydrophobicContact CD1-CG 4.34Å; F187-E191 HydrophobicContact CE1-CG 3.74Å; F187-E191 VanDerWaalsContact CE1-OE1 3.31Å; F187-E191 WeakPolarHBondContact CE1-OE1 3.5Å; F187-E191 HydrophobicContact CZ-CG 4.05Å; F187-E191 PolarHBondContact O-N 3.4Å; F187-I320 HydrophobicContact CD2-CD1 4.42Å
188	E	60.3	Low	57.3	Low	113 Å²	113	101.9 Å²	101.9	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-37.4	174.8	-72.4	178.1	176.3	0	0	112.2	Q184 L185 A190 N192	Q184-E188 WeakPolarHBondContact O-CG 3.32Å; Q184-E188 PolarHBondContact O-N 2.85Å; L185-E188 PolarHBondContact O-N 3.36Å; E188-A190 VanDerWaalsContact C-N 3.32Å; E188-A190 PolarHBondContact O-N 3.46Å; E188-N192 PolarHBondContact O-N 2.98Å; E188-N192 PolarHBondContact O-ND2 2.81Å
189	E	58.8	Low	55	Low	153 Å²	153	98.9 Å²	98.9	72%	0.715	54%	0.535	S	S	*	.	H	α-helix	trans	-65	-34.4	174.1	-74.6	179.9	174.6	0	0	112.4	L185 F187	L185-E189 WeakPolarHBondContact O-CG 3.15Å; L185-E189 PolarHBondContact O-N 3Å; F187-E189 VanDerWaalsContact C-N 3.33Å; F187-E189 PolarHBondContact O-N 3.49Å
190	A	53.5	Low	53	Low	59 Å²	59	102.5 Å²	102.5	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-77.1	-38.7	178.1	0	0	0	0	0	113.2	A186 F187 E188 N192 S193	A186-A190 PolarHBondContact O-N 2.73Å; F187-A190 PolarHBondContact O-N 3.04Å; F187-A190 VanDerWaalsContact O-N 3.15Å; E188-A190 VanDerWaalsContact C-N 3.32Å; E188-A190 PolarHBondContact O-N 3.46Å; A190-N192 VanDerWaalsContact C-N 3.32Å; A190-N192 PolarHBondContact O-N 3.13Å; A190-S193 PolarHBondContact O-N 2.91Å; A190-S193 PolarHBondContact O-OG 3.35Å
191	E	51.6	Low	50.8	Low	107 Å²	107	103.7 Å²	103.7	50%	0.5	59%	0.586	S	S	.	*	H	α-helix	trans	-67.4	-28	178.8	-85.7	-165.8	154.5	0	0	113.7	F187 S193 V194	F187-E191 HydrophobicContact CD1-CG 4.34Å; F187-E191 HydrophobicContact CE1-CG 3.74Å; F187-E191 VanDerWaalsContact CE1-OE1 3.31Å; F187-E191 WeakPolarHBondContact CE1-OE1 3.5Å; F187-E191 HydrophobicContact CZ-CG 4.05Å; F187-E191 PolarHBondContact O-N 3.4Å; E191-S193 PolarHBondContact O-N 2.94Å; E191-V194 PolarHBondContact O-N 2.94Å
192	N	45.6	Very low	48.9	Very low	142 Å²	142	104.4 Å²	104.4	76%	0.759	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-3	176.3	-79.6	-45.5	0	0	0	114.3	E188 A190	E188-N192 PolarHBondContact O-N 2.98Å; E188-N192 PolarHBondContact O-ND2 2.81Å; A190-N192 VanDerWaalsContact C-N 3.32Å; A190-N192 PolarHBondContact O-N 3.13Å
193	S	40.7	Very low	47.1	Very low	97 Å²	97	106.6 Å²	106.6	68%	0.678	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-9.2	178	71.2	0	0	0	0	115.4	A190 E191	A190-S193 PolarHBondContact O-N 2.91Å; A190-S193 PolarHBondContact O-OG 3.35Å; E191-S193 PolarHBondContact O-N 2.94Å
194	V	38.7	Very low	45.1	Very low	115 Å²	115	109.4 Å²	109.4	70%	0.697	60%	0.602	S	S	*	*			trans	-142	94.6	179.7	-176.5	0	0	0	0	110.4	E191	E191-V194 PolarHBondContact O-N 2.94Å
195	L	33.8	Very low	43.6	Very low	167 Å²	167	105.7 Å²	105.7	87%	0.874	59%	0.586	S	S	*	*			trans	-91.2	100.8	169	-85.7	160	0	0	0	109.8
196	E	27.1	Very low	42.6	Very low	159 Å²	159	102.8 Å²	102.8	74%	0.743	57%	0.57	S	S	*	*			trans	-140.2	124.5	143.4	-81.3	-143.6	161.4	0	0	110.7	K198	E196-K198 PolarHBondContact O-N 2.85Å
197	P	29.6	Very low	42.7	Very low	127 Å²	127	100.9 Å²	100.9	83%	0.825	55%	0.554	S	S	*	*			trans	-74.2	99.6	172.5	29.7	-29.4	0	0	0	108.5	S199	P197-S199 PolarHBondContact O-N 3.06Å
198	K	31.1	Very low	43.5	Very low	189 Å²	189	98.3 Å²	98.3	82%	0.822	54%	0.542	S	S	*	.			trans	-70.6	117.1	170.4	-72.8	-175.7	180	175.8	0	108.9	E196 A200	E196-K198 PolarHBondContact O-N 2.85Å; K198-A200 PolarHBondContact O-N 3Å
199	S	28.5	Very low	44.6	Very low	113 Å²	113	93.3 Å²	93.3	79%	0.79	52%	0.519	S	S	*	.			trans	-42.8	118.5	175	167.2	0	0	0	0	111.9	P197 G201	P197-S199 PolarHBondContact O-N 3.06Å; S199-G201 PolarHBondContact O-N 2.98Å
200	A	37.5	Very low	46.1	Very low	96 Å²	96	86 Å²	86	79%	0.793	49%	0.485	S	S	*	.			trans	-61	95.3	168	0	0	0	0	0	110.2	K198	K198-A200 PolarHBondContact O-N 3Å
201	G	29.4	Very low	47.9	Very low	52 Å²	52	83.7 Å²	83.7	54%	0.536	46%	0.464	S	S	.	.			trans	-109.1	67.2	173.7	0	0	0	0	0	110.1	S199	S199-G201 PolarHBondContact O-N 2.98Å
202	D	33.3	Very low	49.9	Very low	57 Å²	57	78.6 Å²	78.6	31%	0.305	44%	0.44	S	S	.	.			trans	-60.9	145.9	178.1	-164.3	10.2	0	0	0	108.6	L388	D202-L388 WeakPolarHBondContact OD1-CD1 3.4Å
203	W	38.4	Very low	52.3	Low	163 Å²	163	71.9 Å²	71.9	62%	0.617	40%	0.404	S	S	*	.				180	117.5	76.3	-86.9	76.6	0	0	0	109.5
204	W	40.3	Very low	55	Low	79 Å²	79	67.3 Å²	67.3	30%	0.299	37%	0.372	S	S	.	.			trans	65.7	94.7	158.5	-44.2	94.3	0	0	0	122.2	Y380 M384	W204-Y380 HydrophobicContact CZ3-CE1 4.35Å; W204-Y380 WeakPolarHBondContact CZ3-OH 3.44Å; W204-M384 HydrophobicContact CD2-CE 4.23Å; W204-M384 HydrophobicContact CE3-CE 3.44Å; W204-M384 VanDerWaalsContact CE3-CE 3.44Å; W204-M384 HydrophobicContact CE3-SD 4.22Å; W204-M384 HydrophobicContact CH2-CE 3.92Å; W204-M384 HydrophobicContact CZ3-CE 3.26Å; W204-M384 HydrophobicContact CZ3-CG 4.19Å; W204-M384 HydrophobicContact CZ3-SD 3.78Å
205	T	42.1	Very low	57.8	Low	19 Å²	19	61.8 Å²	61.8	12%	0.117	34%	0.339	C	S	.	.			trans	-78.7	136	153.6	33.9	0	0	0	0	111.4	A207 W208 H395 R598	T205-A207 VanDerWaalsContact C-N 3.34Å; T205-W208 WeakPolarHBondContact OG1-CH2 3.19Å; T205-W208 WeakPolarHBondContact OG1-CZ2 3.5Å; T205-W208 WeakPolarHBondContact OG1-CZ3 3.48Å; T205-H395 WeakPolarHBondContact CG2-ND1 3.49Å; T205-R598 HydrophobicContact CG2-CB 3.69Å; T205-R598 HydrophobicContact CG2-CG 4.21Å
206	H	50.3	Low	60.8	Low	42 Å²	42	53.9 Å²	53.9	19%	0.194	30%	0.297	C	S	.	.	S	Bend	trans	-82.8	-13	-179.7	-74.9	53.4	0	0	0	114	H596	H206-H596 WeakPolarHBondContact CE1-CB 3.38Å; H206-H596 AromaticContact CE1-CD2 3.54Å; H206-H596 AromaticContact CE1-CG 3.28Å; H206-H596 AromaticContact CE1-ND1 3.94Å; H206-H596 AromaticContact NE2-CD2 3.52Å; H206-H596 AromaticContact NE2-CG 3.77Å
207	A	64.8	Low	64.1	Low	12 Å²	12	46.3 Å²	46.3	10%	0.099	26%	0.262	C	S	.	.			trans	-141.2	121.4	179.7	0	0	0	0	0	107.6	T205 F209 G250 Y252	T205-A207 VanDerWaalsContact C-N 3.34Å; A207-F209 HydrophobicContact CB-CE1 4.45Å; A207-F209 HydrophobicContact CB-CE2 3.94Å; A207-F209 HydrophobicContact CB-CZ 3.78Å; A207-G250 CarbonylContact C-O 3.49Å; A207-G250 WeakPolarHBondContact CA-O 3.39Å; A207-Y252 HydrophobicContact CB-CD2 4.12Å; A207-Y252 HydrophobicContact CB-CE2 3.79Å
208	W	78.1	Confident	67.3	Low	3 Å²	3	42.3 Å²	42.3	1%	0.011	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	137.9	165.7	-56.1	96.4	0	0	0	107.3	T205 G250 S251 Y252 F383 T387 L394 H395	T205-W208 WeakPolarHBondContact OG1-CH2 3.19Å; T205-W208 WeakPolarHBondContact OG1-CZ2 3.5Å; T205-W208 WeakPolarHBondContact OG1-CZ3 3.48Å; W208-G250 PolarHBondContact N-O 3.07Å; W208-S251 CarbonylContact O-C 3.58Å; W208-S251 WeakPolarHBondContact O-CA 3.26Å; W208-Y252 PolarHBondContact O-N 3.33Å; W208-F383 AromaticContact CD1-CE1 3.98Å; W208-F383 AromaticContact CD1-CZ 3.67Å; W208-F383 HydrophobicContact CG-CZ 4.03Å; W208-F383 AromaticContact NE1-CE1 3.87Å; W208-F383 AromaticContact NE1-CZ 3.91Å; W208-T387 HydrophobicContact CD2-CG2 3.67Å; W208-T387 HydrophobicContact CE3-CG2 3.3Å; W208-T387 HydrophobicContact CH2-CG2 3.26Å; W208-T387 HydrophobicContact CZ2-CG2 3.66Å; W208-T387 HydrophobicContact CZ3-CG2 3.06Å; W208-L394 WeakPolarHBondContact CA-O 3.3Å; W208-L394 HydrophobicContact CB-CB 4.42Å; W208-L394 HydrophobicContact CE3-CB 3.77Å; W208-L394 HydrophobicContact CZ3-CB 4.46Å; W208-H395 AromaticContact CE3-CE1 3.88Å; W208-H395 AromaticContact CE3-ND1 3.73Å; W208-H395 AromaticContact CH2-CE1 3.39Å; W208-H395 WeakPolarHBondContact CH2-CE1 3.43Å; W208-H395 AromaticContact CZ3-CE1 2.96Å; W208-H395 WeakPolarHBondContact CZ3-CE1 3.08Å; W208-H395 AromaticContact CZ3-ND1 3.28Å; W208-H395 VanDerWaalsContact CZ3-ND1 3.28Å; W208-H395 WeakPolarHBondContact CZ3-ND1 3.41Å; W208-H395 AromaticContact CZ3-NE2 3.72Å
209	F	84.5	Confident	70.3	Confident	8 Å²	8	36.4 Å²	36.4	4%	0.035	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.9	179	-60.4	-78.4	0	0	0	106.9	L81 A207 Y252 I254 L394 N396 P397 N600	L81-F209 HydrophobicContact CD1-CE1 3.93Å; A207-F209 HydrophobicContact CB-CE1 4.45Å; A207-F209 HydrophobicContact CB-CE2 3.94Å; A207-F209 HydrophobicContact CB-CZ 3.78Å; F209-Y252 HydrophobicContact CD1-CD2 4.14Å; F209-Y252 HydrophobicContact CD1-CG 4.45Å; F209-Y252 AromaticContact CE1-CD2 3.86Å; F209-Y252 HydrophobicContact CE1-CD2 3.86Å; F209-Y252 HydrophobicContact CE1-CG 4.4Å; F209-I254 HydrophobicContact CB-CD1 3.77Å; F209-I254 HydrophobicContact CD1-CD1 3.98Å; F209-I254 HydrophobicContact CG-CD1 4.36Å; F209-L394 PolarHBondContact N-O 2.94Å; F209-L394 VanDerWaalsContact O-CA 3.24Å; F209-L394 WeakPolarHBondContact O-CA 3.36Å; F209-L394 WeakPolarHBondContact O-CD2 3.38Å; F209-N396 WeakPolarHBondContact CB-O 3.27Å; F209-P397 VanDerWaalsContact CD2-CA 3.41Å; F209-P397 HydrophobicContact CD2-CB 4.02Å; F209-P397 HydrophobicContact CE1-CB 4.31Å; F209-P397 HydrophobicContact CE2-CB 3.64Å; F209-P397 HydrophobicContact CE2-CG 4.4Å; F209-P397 HydrophobicContact CG-CB 4.49Å; F209-P397 HydrophobicContact CZ-CB 3.79Å; F209-N600 WeakPolarHBondContact CZ-ND2 3.43Å
210	L	90.1	Very high	73.5	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	106.2	-179.3	-170.3	160.1	0	0	0	108.4	L212 Y252 V253 I254 A294 L343 L347 L394	L210-L212 HydrophobicContact CD2-CB 3.82Å; L210-L212 HydrophobicContact CD2-CD1 4.44Å; L210-L212 PolarHBondContact O-N 2.92Å; L210-Y252 PolarHBondContact N-O 3.04Å; L210-V253 HydrophobicContact CD2-CG1 4.45Å; L210-I254 PolarHBondContact O-N 3.26Å; L210-A294 HydrophobicContact CD2-CB 4.21Å; L210-L343 HydrophobicContact CD1-CD1 3.92Å; L210-L343 HydrophobicContact CD1-CD2 4.13Å; L210-L343 HydrophobicContact CD1-CG 4.19Å; L210-L343 HydrophobicContact CD2-CD1 4.26Å; L210-L347 HydrophobicContact CD1-CD1 3.92Å; L210-L347 HydrophobicContact CD1-CD2 4.09Å; L210-L347 HydrophobicContact CD1-CG 4.29Å; L210-L394 HydrophobicContact CB-CD2 3.81Å; L210-L394 HydrophobicContact CD1-CD2 4.38Å; L210-L394 HydrophobicContact CG-CD2 3.91Å
211	E	91	Very high	76.3	Confident	11 Å²	11	27.2 Å²	27.2	5%	0.051	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	103.7	174.1	-65.1	176.3	170.8	0	0	109.3	T256 Q291 D293 A294 N396	E211-T256 HydrophobicContact CB-CG2 3.68Å; E211-T256 HydrophobicContact CG-CG2 3.91Å; E211-Q291 PolarHBondContact OE2-NE2 3Å; E211-D293 HydrophobicContact CB-CB 4.38Å; E211-D293 WeakPolarHBondContact CB-OD2 3.24Å; E211-D293 PolarHBondContact N-OD2 2.69Å; E211-D293 PolarHBondContact O-N 3.25Å; E211-A294 PolarHBondContact O-N 3.29Å; E211-N396 PolarHBondContact OE1-ND2 2.81Å
212	L	93.9	Very high	79.4	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.2	-175.9	-179	66	0	0	0	111.5	L210 V214 V239 V253 I254 L255 T256 A294 H296	L210-L212 HydrophobicContact CD2-CB 3.82Å; L210-L212 HydrophobicContact CD2-CD1 4.44Å; L210-L212 PolarHBondContact O-N 2.92Å; L212-V214 HydrophobicContact CD2-CG2 4.09Å; L212-V214 HydrophobicContact CG-CG2 4.19Å; L212-V239 HydrophobicContact CD2-CG2 4.23Å; L212-V253 HydrophobicContact CB-CG1 4.2Å; L212-V253 HydrophobicContact CD2-CG1 3.92Å; L212-I254 PolarHBondContact N-O 3.38Å; L212-L255 WeakPolarHBondContact O-CA 3.5Å; L212-T256 PolarHBondContact O-N 3.07Å; L212-T256 PolarHBondContact O-OG1 3.18Å; L212-A294 WeakPolarHBondContact CA-O 3.27Å; L212-A294 HydrophobicContact CD1-CB 4.39Å; L212-H296 HydrophobicContact CD1-CB 4.3Å
213	V	94.3	Very high	82.3	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.9	166.6	175.7	0	0	0	0	109.9	T256 L287 L290 H292 A294 A295 H296	V213-T256 WeakPolarHBondContact CG2-OG1 3.47Å; V213-L287 HydrophobicContact CB-CD1 4.46Å; V213-L287 HydrophobicContact CG1-CD1 3.74Å; V213-L287 HydrophobicContact CG1-CD2 4.35Å; V213-L290 HydrophobicContact CB-CD2 4.33Å; V213-L290 HydrophobicContact CG1-CD2 3.93Å; V213-L290 HydrophobicContact CG2-CD2 3.39Å; V213-L290 HydrophobicContact CG2-CG 4.05Å; V213-H292 HydrophobicContact CB-CB 4.39Å; V213-H292 HydrophobicContact CG2-CB 3.46Å; V213-H292 VanDerWaalsContact CG2-CB 3.46Å; V213-A294 PolarHBondContact N-O 2.98Å; V213-A295 HydrophobicContact CB-CB 4.27Å; V213-A295 CarbonylContact O-C 3.59Å; V213-A295 VanDerWaalsContact O-CA 3.25Å; V213-A295 WeakPolarHBondContact O-CA 3.46Å; V213-H296 PolarHBondContact O-N 2.99Å
214	V	97.3	Very high	84.9	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.7	178.6	176.6	0	0	0	0	110.5	L212 V216 V235 V239 L255 G257 I258 E259 H296 F298	L212-V214 HydrophobicContact CD2-CG2 4.09Å; L212-V214 HydrophobicContact CG-CG2 4.19Å; V214-V216 HydrophobicContact CG1-CG2 4.1Å; V214-V235 HydrophobicContact CB-CG1 4.02Å; V214-V235 HydrophobicContact CG1-CG1 3.95Å; V214-V235 HydrophobicContact CG1-CG2 4.08Å; V214-V235 HydrophobicContact CG2-CG1 4.12Å; V214-V239 HydrophobicContact CG2-CG2 4.36Å; V214-L255 HydrophobicContact CB-CD1 4.23Å; V214-L255 HydrophobicContact CG2-CD1 3.73Å; V214-G257 PolarHBondContact N-O 3.45Å; V214-I258 CarbonylContact O-C 3.56Å; V214-I258 VanDerWaalsContact O-CA 3.27Å; V214-I258 WeakPolarHBondContact O-CA 3.3Å; V214-E259 PolarHBondContact O-N 3.22Å; V214-H296 WeakPolarHBondContact CA-O 3.38Å; V214-F298 HydrophobicContact CG1-CD1 4.15Å; V214-F298 HydrophobicContact CG1-CD2 3.58Å; V214-F298 HydrophobicContact CG1-CE1 4.19Å; V214-F298 HydrophobicContact CG1-CE2 3.65Å; V214-F298 HydrophobicContact CG1-CG 3.84Å; V214-F298 HydrophobicContact CG1-CZ 3.95Å; V214-F298 HydrophobicContact CG2-CE2 4.4Å; V214-F298 HydrophobicContact CG2-CZ 4.1Å
215	V	97.4	Very high	87.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.9	175.1	-176.1	0	0	0	0	109.3	E259 W261 F279 W282 L287 H296 M297 F298	V215-E259 CarbonylContact C-O 3.5Å; V215-E259 WeakPolarHBondContact CA-O 3.47Å; V215-E259 HydrophobicContact CG1-CB 4.42Å; V215-E259 HydrophobicContact CG2-CB 4.3Å; V215-W261 HydrophobicContact CG1-CZ2 4.03Å; V215-F279 HydrophobicContact CB-CE2 3.88Å; V215-F279 HydrophobicContact CB-CZ 4.21Å; V215-F279 HydrophobicContact CG1-CE2 4.31Å; V215-F279 HydrophobicContact CG2-CE2 3.79Å; V215-F279 HydrophobicContact CG2-CZ 4.01Å; V215-W282 HydrophobicContact CG1-CH2 4.26Å; V215-W282 HydrophobicContact CG1-CZ3 4.31Å; V215-W282 HydrophobicContact CG2-CH2 4.26Å; V215-W282 HydrophobicContact CG2-CZ3 3.98Å; V215-L287 HydrophobicContact CG2-CD1 4.09Å; V215-H296 PolarHBondContact N-O 3.16Å; V215-M297 HydrophobicContact CB-CG 4.47Å; V215-M297 CarbonylContact O-C 3.39Å; V215-M297 VanDerWaalsContact O-CA 3.25Å; V215-M297 WeakPolarHBondContact O-CA 3.34Å; V215-F298 PolarHBondContact O-N 2.76Å
216	V	97.9	Very high	89.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.6	-174.5	-176.5	0	0	0	0	110	V214 F220 V231 V235 E259 I260 W261 F298	V214-V216 HydrophobicContact CG1-CG2 4.1Å; V216-F220 HydrophobicContact CG1-CB 3.7Å; V216-F220 HydrophobicContact CG1-CD1 3.46Å; V216-F220 VanDerWaalsContact CG1-CD1 3.46Å; V216-F220 HydrophobicContact CG1-CE1 4.31Å; V216-F220 HydrophobicContact CG1-CG 3.73Å; V216-V231 HydrophobicContact CB-CG1 4.08Å; V216-V231 HydrophobicContact CG1-CG1 3.84Å; V216-V231 HydrophobicContact CG2-CG1 3.79Å; V216-V235 HydrophobicContact CG2-CG2 3.86Å; V216-E259 PolarHBondContact N-O 3.13Å; V216-I260 HydrophobicContact CB-CG1 4.46Å; V216-W261 PolarHBondContact O-N 3.29Å; V216-F298 HydrophobicContact CG2-CB 4.44Å
217	N	96.1	Very high	91.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.			trans	-73.4	164.5	-179.5	97.7	-41.7	0	0	0	112.7	D219 F220 F221 W261 N265 M269 M297 F298 I299 K300	N217-D219 VanDerWaalsContact C-N 3.35Å; N217-D219 PolarHBondContact ND2-OD2 3.44Å; N217-D219 PolarHBondContact O-N 3.18Å; N217-D219 PolarHBondContact OD1-N 2.88Å; N217-F220 PolarHBondContact O-N 3.25Å; N217-F220 WeakPolarHBondContact OD1-CB 3.5Å; N217-F220 PolarHBondContact OD1-N 3.28Å; N217-F221 PolarHBondContact O-N 2.86Å; N217-F221 VanDerWaalsContact O-N 3.12Å; N217-W261 HydrophobicContact CB-CE3 4.44Å; N217-N265 WeakPolarHBondContact CB-OD1 3.46Å; N217-M269 HydrophobicContact CB-CE 4.04Å; N217-M297 HydrophobicContact CB-CE 3.82Å; N217-F298 PolarHBondContact N-O 3.35Å; N217-I299 HydrophobicContact CB-CB 4.34Å; N217-I299 HydrophobicContact CB-CG2 4.05Å; N217-I299 WeakPolarHBondContact OD1-CA 3.09Å; N217-K300 PolarHBondContact OD1-N 3.43Å
218	H	96.1	Very high	93	Very high	44 Å²	44	30.2 Å²	30.2	20%	0.204	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-40.8	-176.5	-171.7	65	0	0	0	112.7	F220 F221 I222 W261 N262 G264 N265	H218-F220 VanDerWaalsContact C-N 3.29Å; H218-F220 PolarHBondContact O-N 2.95Å; H218-F221 WeakPolarHBondContact O-CA 3.33Å; H218-F221 WeakPolarHBondContact O-CB 3.32Å; H218-F221 PolarHBondContact O-N 2.81Å; H218-F221 VanDerWaalsContact O-N 3.09Å; H218-I222 WeakPolarHBondContact O-CG1 3.44Å; H218-I222 PolarHBondContact O-N 2.92Å; H218-W261 VanDerWaalsContact CA-O 3.27Å; H218-W261 WeakPolarHBondContact CA-O 3.31Å; H218-W261 VanDerWaalsContact CB-O 3.28Å; H218-W261 WeakPolarHBondContact CB-O 3.18Å; H218-W261 PolarHBondContact ND1-O 3.11Å; H218-N262 PolarHBondContact CE1-O 3.48Å; H218-N262 PolarHBondContact ND1-O 2.98Å; H218-G264 PolarHBondContact ND1-N 2.94Å; H218-N265 VanDerWaalsContact CB-OD1 3.24Å; H218-N265 WeakPolarHBondContact CB-OD1 3.49Å; H218-N265 PolarHBondContact N-OD1 3.09Å
219	D	95	Very high	93.5	Very high	64 Å²	64	33.2 Å²	33.2	34%	0.342	17%	0.174	S	C	.	.	H	α-helix	trans	-65	-34.7	-178.6	-56.5	-63.6	0	0	0	112.1	N217 I222 Y223 N265 K300	N217-D219 VanDerWaalsContact C-N 3.35Å; N217-D219 PolarHBondContact ND2-OD2 3.44Å; N217-D219 PolarHBondContact O-N 3.18Å; N217-D219 PolarHBondContact OD1-N 2.88Å; D219-I222 PolarHBondContact O-N 3.33Å; D219-Y223 PolarHBondContact O-N 2.98Å; D219-N265 PolarHBondContact OD2-ND2 3.33Å; D219-K300 HydrophobicContact CB-CB 4.37Å; D219-K300 WeakPolarHBondContact CB-O 3.21Å
220	F	95.6	Very high	93.7	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-67.9	-40.2	172.4	-167.3	-69.3	0	0	0	111.3	V216 N217 H218 Y223 S224 K300 F327 W332 F335	V216-F220 HydrophobicContact CG1-CB 3.7Å; V216-F220 HydrophobicContact CG1-CD1 3.46Å; V216-F220 VanDerWaalsContact CG1-CD1 3.46Å; V216-F220 HydrophobicContact CG1-CE1 4.31Å; V216-F220 HydrophobicContact CG1-CG 3.73Å; N217-F220 PolarHBondContact O-N 3.25Å; N217-F220 WeakPolarHBondContact OD1-CB 3.5Å; N217-F220 PolarHBondContact OD1-N 3.28Å; H218-F220 VanDerWaalsContact C-N 3.29Å; H218-F220 PolarHBondContact O-N 2.95Å; F220-Y223 WeakPolarHBondContact O-CB 3.45Å; F220-Y223 PolarHBondContact O-N 2.95Å; F220-S224 WeakPolarHBondContact O-CB 3.32Å; F220-S224 PolarHBondContact O-N 3.46Å; F220-S224 PolarHBondContact O-OG 3.34Å; F220-K300 HydrophobicContact CB-CB 3.98Å; F220-K300 HydrophobicContact CD2-CB 4.2Å; F220-K300 HydrophobicContact CG-CB 4.49Å; F220-F327 HydrophobicContact CD2-CB 4.02Å; F220-F327 HydrophobicContact CD2-CD1 4.3Å; F220-F327 HydrophobicContact CE2-CB 3.71Å; F220-F327 AromaticContact CE2-CD1 3.81Å; F220-F327 HydrophobicContact CE2-CD1 3.81Å; F220-F327 AromaticContact CE2-CG 3.91Å; F220-F327 HydrophobicContact CE2-CG 3.91Å; F220-W332 HydrophobicContact CZ-CH2 4.03Å; F220-W332 AromaticContact CZ-CZ3 3.97Å; F220-W332 HydrophobicContact CZ-CZ3 3.97Å; F220-F335 HydrophobicContact CE2-CE1 4.43Å
221	F	96.1	Very high	93.9	Very high	16 Å²	16	34.8 Å²	34.8	7%	0.07	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-43.7	173.7	171.6	-108.3	0	0	0	112.1	N217 H218 S224 S226 I228 V231 I260 N262	N217-F221 PolarHBondContact O-N 2.86Å; N217-F221 VanDerWaalsContact O-N 3.12Å; H218-F221 WeakPolarHBondContact O-CA 3.33Å; H218-F221 WeakPolarHBondContact O-CB 3.32Å; H218-F221 PolarHBondContact O-N 2.81Å; H218-F221 VanDerWaalsContact O-N 3.09Å; F221-S224 CarbonylContact O-C 3.54Å; F221-S224 WeakPolarHBondContact O-CA 3.24Å; F221-S224 WeakPolarHBondContact O-CB 3.46Å; F221-S224 PolarHBondContact O-N 2.93Å; F221-S224 VanDerWaalsContact O-N 3.13Å; F221-S226 VanDerWaalsContact CZ-CA 3.42Å; F221-S226 VanDerWaalsContact CZ-O 3.25Å; F221-S226 WeakPolarHBondContact CZ-O 3.25Å; F221-S226 WeakPolarHBondContact O-CA 3.48Å; F221-S226 PolarHBondContact O-N 3.39Å; F221-I228 HydrophobicContact CE2-CG1 3.99Å; F221-V231 HydrophobicContact CD2-CG2 4.01Å; F221-I260 HydrophobicContact CB-CG2 4.18Å; F221-I260 HydrophobicContact CD2-CG2 3.9Å; F221-I260 HydrophobicContact CG-CG2 4.24Å; F221-N262 HydrophobicContact CD1-CB 4.1Å; F221-N262 HydrophobicContact CD2-CB 4.5Å; F221-N262 HydrophobicContact CE1-CB 3.77Å; F221-N262 HydrophobicContact CE2-CB 4.21Å; F221-N262 HydrophobicContact CG-CB 4.44Å; F221-N262 HydrophobicContact CZ-CB 3.82Å
222	I	95.3	Very high	93.9	Very high	84 Å²	84	35 Å²	35	43%	0.431	18%	0.182	S	C	.	.	H	α-helix	trans	-62.3	-43.4	174.9	-64.4	-56.5	0	0	0	111.3	H218 D219 S224 Q225 S226	H218-I222 WeakPolarHBondContact O-CG1 3.44Å; H218-I222 PolarHBondContact O-N 2.92Å; D219-I222 PolarHBondContact O-N 3.33Å; I222-S224 PolarHBondContact O-N 2.95Å; I222-Q225 PolarHBondContact O-N 2.84Å; I222-S226 WeakPolarHBondContact CD1-OG 3.32Å
223	Y	93.4	Very high	93.6	Very high	85 Å²	85	37.1 Å²	37.1	33%	0.333	19%	0.192	S	C	.	.	H	α-helix	trans	-59.4	-35.5	174.4	174	-93.1	0	0	0	112.6	D219 F220 Q225 K300 F327	D219-Y223 PolarHBondContact O-N 2.98Å; F220-Y223 WeakPolarHBondContact O-CB 3.45Å; F220-Y223 PolarHBondContact O-N 2.95Å; Y223-Q225 PolarHBondContact O-N 3.2Å; Y223-K300 VanDerWaalsContact CB-CD 3.46Å; Y223-K300 HydrophobicContact CD1-CD 4.31Å; Y223-K300 HydrophobicContact CD2-CD 3.72Å; Y223-K300 HydrophobicContact CG-CD 3.55Å; Y223-F327 HydrophobicContact CD1-CE1 4.11Å; Y223-F327 HydrophobicContact CE1-CD1 4.31Å; Y223-F327 AromaticContact CE1-CE1 3.5Å; Y223-F327 HydrophobicContact CE1-CE1 3.5Å; Y223-F327 HydrophobicContact CE1-CZ 4.4Å; Y223-F327 AromaticContact CZ-CE1 3.75Å
224	S	93.1	Very high	93.4	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	26	175.5	-52.3	0	0	0	0	113	F220 F221 I222 S226 N227 V231	F220-S224 WeakPolarHBondContact O-CB 3.32Å; F220-S224 PolarHBondContact O-N 3.46Å; F220-S224 PolarHBondContact O-OG 3.34Å; F221-S224 CarbonylContact O-C 3.54Å; F221-S224 WeakPolarHBondContact O-CA 3.24Å; F221-S224 WeakPolarHBondContact O-CB 3.46Å; F221-S224 PolarHBondContact O-N 2.93Å; F221-S224 VanDerWaalsContact O-N 3.13Å; I222-S224 PolarHBondContact O-N 2.95Å; S224-S226 PolarHBondContact O-N 3.39Å; S224-N227 WeakPolarHBondContact O-CB 3.25Å; S224-N227 PolarHBondContact O-N 2.8Å; S224-V231 VanDerWaalsContact CB-CG2 3.46Å
225	Q	93.1	Very high	93.3	Very high	118 Å²	118	37.2 Å²	37.2	55%	0.551	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	29.8	177.9	-53.8	178.6	-20.2	0	0	113.2	I222 Y223 N227	I222-Q225 PolarHBondContact O-N 2.84Å; Y223-Q225 PolarHBondContact O-N 3.2Å; Q225-N227 PolarHBondContact O-N 3.41Å
226	S	93.4	Very high	93	Very high	65 Å²	65	37.6 Å²	37.6	46%	0.455	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	35.3	-176.2	-52.6	0	0	0	0	112.9	F221 I222 S224	F221-S226 VanDerWaalsContact CZ-CA 3.42Å; F221-S226 VanDerWaalsContact CZ-O 3.25Å; F221-S226 WeakPolarHBondContact CZ-O 3.25Å; F221-S226 WeakPolarHBondContact O-CA 3.48Å; F221-S226 PolarHBondContact O-N 3.39Å; I222-S226 WeakPolarHBondContact CD1-OG 3.32Å; S224-S226 PolarHBondContact O-N 3.39Å
227	N	91.6	Very high	92.6	Very high	73 Å²	73	37.8 Å²	37.8	39%	0.39	20%	0.195	S	C	.	.			trans	-115.6	114.6	-176.4	-175.7	-32.8	0	0	0	110.6	S224 Q225 S229 K230 V231	S224-N227 WeakPolarHBondContact O-CB 3.25Å; S224-N227 PolarHBondContact O-N 2.8Å; Q225-N227 PolarHBondContact O-N 3.41Å; N227-S229 PolarHBondContact O-N 2.9Å; N227-S229 WeakPolarHBondContact OD1-CB 3.49Å; N227-S229 PolarHBondContact OD1-N 3.46Å; N227-K230 HydrophobicContact CB-CB 3.79Å; N227-K230 WeakPolarHBondContact O-CB 3.44Å; N227-K230 PolarHBondContact O-N 2.62Å; N227-K230 PolarHBondContact OD1-N 3.43Å; N227-K230 VanDerWaalsContact OD1-N 3.12Å; N227-V231 PolarHBondContact O-N 3.25Å; N227-V231 VanDerWaalsContact O-N 3.12Å
228	I	90.6	Very high	92.6	Very high	58 Å²	58	37.8 Å²	37.8	30%	0.297	20%	0.195	S	C	.	.	H	α-helix	trans	-59.8	-46.3	-178.8	-68	163.1	0	0	0	111.2	T91 F221 K230 V231 Q232 I260	T91-I228 HydrophobicContact CG2-CD1 4Å; T91-I228 HydrophobicContact CG2-CG1 4.33Å; T91-I228 HydrophobicContact CG2-CG2 4.42Å; F221-I228 HydrophobicContact CE2-CG1 3.99Å; I228-K230 VanDerWaalsContact C-N 3.26Å; I228-K230 PolarHBondContact O-N 3.37Å; I228-V231 PolarHBondContact O-N 2.9Å; I228-Q232 WeakPolarHBondContact O-CG 3.3Å; I228-Q232 PolarHBondContact O-N 2.91Å; I228-I260 HydrophobicContact CG2-CD1 3.94Å
229	S	87.6	Confident	92.4	Very high	66 Å²	66	35.7 Å²	35.7	46%	0.462	19%	0.185	S	C	.	.	H	α-helix	trans	-63.1	-35.1	179.1	-53.7	0	0	0	0	111.9	N227 Q232 E233	N227-S229 PolarHBondContact O-N 2.9Å; N227-S229 WeakPolarHBondContact OD1-CB 3.49Å; N227-S229 PolarHBondContact OD1-N 3.46Å; S229-Q232 PolarHBondContact O-N 3.32Å; S229-E233 WeakPolarHBondContact O-CG 3.48Å; S229-E233 PolarHBondContact O-N 3.12Å
230	K	89.3	Confident	92.3	Very high	41 Å²	41	32.7 Å²	32.7	18%	0.178	17%	0.169	C	C	.	.	H	α-helix	trans	-65.6	-42.4	176	-172.3	68.5	-143.9	149	0	111.8	N227 I228 E233 D234	N227-K230 HydrophobicContact CB-CB 3.79Å; N227-K230 WeakPolarHBondContact O-CB 3.44Å; N227-K230 PolarHBondContact O-N 2.62Å; N227-K230 PolarHBondContact OD1-N 3.43Å; N227-K230 VanDerWaalsContact OD1-N 3.12Å; I228-K230 VanDerWaalsContact C-N 3.26Å; I228-K230 PolarHBondContact O-N 3.37Å; K230-E233 IonicContact NZ-OE2 3.74Å; K230-E233 PolarHBondContact NZ-OE2 3.15Å; K230-E233 WeakPolarHBondContact O-CB 3.46Å; K230-E233 PolarHBondContact O-N 3.36Å; K230-D234 WeakPolarHBondContact CE-OD1 3.43Å; K230-D234 VanDerWaalsContact CE-OD2 3.3Å; K230-D234 WeakPolarHBondContact CE-OD2 3.2Å; K230-D234 IonicContact NZ-OD1 3.73Å; K230-D234 PolarHBondContact NZ-OD1 3.13Å; K230-D234 VanDerWaalsContact O-CG 3.27Å; K230-D234 PolarHBondContact O-N 3.45Å; K230-D234 VanDerWaalsContact O-N 3.09Å
231	V	93.8	Very high	92.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-46.4	174.1	173.5	0	0	0	0	110.9	V216 F221 S224 N227 I228 E233 D234 V235 I260	V216-V231 HydrophobicContact CB-CG1 4.08Å; V216-V231 HydrophobicContact CG1-CG1 3.84Å; V216-V231 HydrophobicContact CG2-CG1 3.79Å; F221-V231 HydrophobicContact CD2-CG2 4.01Å; S224-V231 VanDerWaalsContact CB-CG2 3.46Å; N227-V231 PolarHBondContact O-N 3.25Å; N227-V231 VanDerWaalsContact O-N 3.12Å; I228-V231 PolarHBondContact O-N 2.9Å; V231-E233 PolarHBondContact O-N 3.04Å; V231-D234 PolarHBondContact O-N 3.37Å; V231-V235 HydrophobicContact CG1-CG2 4.27Å; V231-V235 WeakPolarHBondContact O-CG2 3.43Å; V231-V235 PolarHBondContact O-N 3.37Å; V231-I260 HydrophobicContact CB-CD1 4.03Å; V231-I260 HydrophobicContact CG1-CD1 3.75Å; V231-I260 HydrophobicContact CG1-CG1 4.01Å
232	Q	90.5	Very high	92.1	Very high	17 Å²	17	32.2 Å²	32.2	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-56.8	-49.2	176.9	-70.1	169	-16.4	0	0	111.5	I228 S229 D234 V235 F236 I258	I228-Q232 WeakPolarHBondContact O-CG 3.3Å; I228-Q232 PolarHBondContact O-N 2.91Å; S229-Q232 PolarHBondContact O-N 3.32Å; Q232-D234 VanDerWaalsContact C-N 3.3Å; Q232-D234 PolarHBondContact O-N 2.86Å; Q232-V235 PolarHBondContact O-N 3.12Å; Q232-F236 HydrophobicContact CB-CD2 4.42Å; Q232-F236 HydrophobicContact CB-CE2 3.85Å; Q232-F236 HydrophobicContact CB-CZ 4.22Å; Q232-F236 WeakPolarHBondContact O-CB 3.44Å; Q232-F236 WeakPolarHBondContact O-CD2 3.06Å; Q232-F236 WeakPolarHBondContact O-CG 3.36Å; Q232-F236 PolarHBondContact O-N 2.89Å; Q232-I258 HydrophobicContact CG-CD1 4.38Å
233	E	87.6	Confident	91.9	Very high	43 Å²	43	28.8 Å²	28.8	20%	0.201	15%	0.15	C	C	.	.	H	α-helix	trans	-54.1	-45.1	176.2	-79.3	177.7	-164.5	0	0	113.1	F129 R133 S229 K230 V231 L237	F129-E233 WeakPolarHBondContact CD1-OE1 3.46Å; F129-E233 HydrophobicContact CD2-CG 3.92Å; F129-E233 HydrophobicContact CE1-CG 4.06Å; F129-E233 WeakPolarHBondContact CE1-OE1 3.49Å; F129-E233 HydrophobicContact CE2-CB 4.49Å; F129-E233 HydrophobicContact CE2-CG 3.41Å; F129-E233 VanDerWaalsContact CE2-CG 3.41Å; F129-E233 HydrophobicContact CG-CG 4.47Å; F129-E233 HydrophobicContact CZ-CG 3.47Å; F129-E233 VanDerWaalsContact CZ-CG 3.47Å; R133-E233 IonicContact NH1-OE2 3.28Å; S229-E233 WeakPolarHBondContact O-CG 3.48Å; S229-E233 PolarHBondContact O-N 3.12Å; K230-E233 IonicContact NZ-OE2 3.74Å; K230-E233 PolarHBondContact NZ-OE2 3.15Å; K230-E233 WeakPolarHBondContact O-CB 3.46Å; K230-E233 PolarHBondContact O-N 3.36Å; V231-E233 PolarHBondContact O-N 3.04Å; E233-L237 WeakPolarHBondContact O-CB 3.44Å; E233-L237 PolarHBondContact O-N 2.8Å
234	D	91.6	Very high	91.7	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-72.3	-39.7	-176.6	-67.3	-21.3	0	0	0	110.9	R133 K230 V231 Q232 L237 V238 W332	R133-D234 IonicContact CZ-OD1 2.85Å; R133-D234 VanDerWaalsContact CZ-OD1 3.24Å; R133-D234 IonicContact NH1-OD1 3.13Å; R133-D234 PolarHBondContact NH1-OD1 3.37Å; R133-D234 IonicContact NH2-OD1 2.65Å; R133-D234 PolarHBondContact NH2-OD1 3.34Å; K230-D234 WeakPolarHBondContact CE-OD1 3.43Å; K230-D234 VanDerWaalsContact CE-OD2 3.3Å; K230-D234 WeakPolarHBondContact CE-OD2 3.2Å; K230-D234 IonicContact NZ-OD1 3.73Å; K230-D234 PolarHBondContact NZ-OD1 3.13Å; K230-D234 VanDerWaalsContact O-CG 3.27Å; K230-D234 PolarHBondContact O-N 3.45Å; K230-D234 VanDerWaalsContact O-N 3.09Å; V231-D234 PolarHBondContact O-N 3.37Å; Q232-D234 VanDerWaalsContact C-N 3.3Å; Q232-D234 PolarHBondContact O-N 2.86Å; D234-L237 PolarHBondContact O-N 2.91Å; D234-V238 VanDerWaalsContact O-CG2 3.26Å; D234-V238 WeakPolarHBondContact O-CG2 3.28Å; D234-V238 PolarHBondContact O-N 3.36Å; D234-W332 HydrophobicContact CB-CH2 3.63Å; D234-W332 HydrophobicContact CB-CZ2 4.07Å; D234-W332 HydrophobicContact CB-CZ3 3.94Å; D234-W332 VanDerWaalsContact CG-CZ2 3.49Å; D234-W332 WeakPolarHBondContact OD2-CH2 3.45Å; D234-W332 WeakPolarHBondContact OD2-CZ2 3.37Å
235	V	93.9	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.1	-47.7	171.7	172.2	0	0	0	0	111	V214 V216 V231 Q232 L237 V238 V239 L255 I258 F298	V214-V235 HydrophobicContact CB-CG1 4.02Å; V214-V235 HydrophobicContact CG1-CG1 3.95Å; V214-V235 HydrophobicContact CG1-CG2 4.08Å; V214-V235 HydrophobicContact CG2-CG1 4.12Å; V216-V235 HydrophobicContact CG2-CG2 3.86Å; V231-V235 HydrophobicContact CG1-CG2 4.27Å; V231-V235 WeakPolarHBondContact O-CG2 3.43Å; V231-V235 PolarHBondContact O-N 3.37Å; Q232-V235 PolarHBondContact O-N 3.12Å; V235-L237 VanDerWaalsContact C-N 3.31Å; V235-L237 PolarHBondContact O-N 2.94Å; V235-V238 PolarHBondContact O-N 3.05Å; V235-V239 HydrophobicContact CG1-CG2 4.3Å; V235-V239 WeakPolarHBondContact O-CG2 3.22Å; V235-V239 PolarHBondContact O-N 3.23Å; V235-L255 HydrophobicContact CG1-CD2 3.96Å; V235-I258 HydrophobicContact CB-CD1 4.2Å; V235-I258 HydrophobicContact CG1-CD1 3.88Å; V235-I258 HydrophobicContact CG1-CG1 4.19Å; V235-F298 HydrophobicContact CG1-CE2 4.46Å; V235-F298 HydrophobicContact CG2-CD2 4.1Å; V235-F298 HydrophobicContact CG2-CE2 4.23Å
236	F	90.9	Very high	91.5	Very high	7 Å²	7	20 Å²	20	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-61.2	-40.2	178.4	-63.2	-35.1	0	0	0	112.5	V83 L87 I105 Y110 Q232 N240 L255 I258	V83-F236 HydrophobicContact CG1-CE1 4.14Å; V83-F236 HydrophobicContact CG2-CD1 4.14Å; V83-F236 HydrophobicContact CG2-CE1 4.4Å; L87-F236 HydrophobicContact CD2-CE1 3.39Å; L87-F236 HydrophobicContact CD2-CZ 3.63Å; I105-F236 HydrophobicContact CD1-CE1 4.01Å; I105-F236 HydrophobicContact CD1-CE2 3.98Å; I105-F236 HydrophobicContact CD1-CZ 3.39Å; I105-F236 HydrophobicContact CG1-CE2 4.45Å; I105-F236 HydrophobicContact CG1-CZ 4.31Å; Y110-F236 HydrophobicContact CE1-CB 3.83Å; Y110-F236 WeakPolarHBondContact OH-CB 3.47Å; Y110-F236 WeakPolarHBondContact OH-CD2 3.27Å; Y110-F236 VanDerWaalsContact OH-CG 3.23Å; Y110-F236 WeakPolarHBondContact OH-CG 3.39Å; Q232-F236 HydrophobicContact CB-CD2 4.42Å; Q232-F236 HydrophobicContact CB-CE2 3.85Å; Q232-F236 HydrophobicContact CB-CZ 4.22Å; Q232-F236 WeakPolarHBondContact O-CB 3.44Å; Q232-F236 WeakPolarHBondContact O-CD2 3.06Å; Q232-F236 WeakPolarHBondContact O-CG 3.36Å; Q232-F236 PolarHBondContact O-N 2.89Å; F236-N240 WeakPolarHBondContact O-CB 3.36Å; F236-N240 PolarHBondContact O-N 3.08Å; F236-L255 HydrophobicContact CD1-CD2 3.49Å; F236-L255 VanDerWaalsContact CD1-CD2 3.49Å; F236-L255 HydrophobicContact CE1-CD2 3.52Å; F236-I258 HydrophobicContact CD1-CD1 4.46Å; F236-I258 HydrophobicContact CE1-CD1 3.74Å; F236-I258 HydrophobicContact CZ-CD1 4.07Å
237	L	90.5	Very high	91	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-61.8	-47.7	176.7	175.8	61.5	0	0	0	111.4	R133 E233 D234 V235 N240 I241 W332	R133-L237 HydrophobicContact CG-CD2 4.09Å; E233-L237 WeakPolarHBondContact O-CB 3.44Å; E233-L237 PolarHBondContact O-N 2.8Å; D234-L237 PolarHBondContact O-N 2.91Å; V235-L237 VanDerWaalsContact C-N 3.31Å; V235-L237 PolarHBondContact O-N 2.94Å; L237-N240 WeakPolarHBondContact O-CB 3.38Å; L237-N240 PolarHBondContact O-N 2.75Å; L237-I241 HydrophobicContact CD1-CD1 4.16Å; L237-I241 HydrophobicContact CG-CD1 4.23Å; L237-I241 WeakPolarHBondContact O-CG1 3.45Å; L237-I241 PolarHBondContact O-N 2.77Å; L237-I241 VanDerWaalsContact O-N 3.12Å; L237-W332 HydrophobicContact CD2-CB 3.93Å; L237-W332 HydrophobicContact CD2-CG 3.85Å
238	V	94.8	Very high	90.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.7	-50.8	179.9	171	0	0	0	0	110.4	D234 V235 N240 I241 V242 F298 W332 F335 A336 V339	D234-V238 VanDerWaalsContact O-CG2 3.26Å; D234-V238 WeakPolarHBondContact O-CG2 3.28Å; D234-V238 PolarHBondContact O-N 3.36Å; V235-V238 PolarHBondContact O-N 3.05Å; V238-N240 VanDerWaalsContact C-N 3.28Å; V238-N240 PolarHBondContact O-N 2.73Å; V238-I241 PolarHBondContact O-N 2.99Å; V238-V242 HydrophobicContact CG1-CG2 4.34Å; V238-V242 WeakPolarHBondContact O-CG2 3.29Å; V238-V242 PolarHBondContact O-N 2.86Å; V238-F298 HydrophobicContact CB-CE2 4.37Å; V238-F298 HydrophobicContact CG1-CE2 4.04Å; V238-F298 HydrophobicContact CG1-CZ 3.94Å; V238-W332 HydrophobicContact CG2-CE3 3.91Å; V238-W332 HydrophobicContact CG2-CZ3 4.45Å; V238-F335 HydrophobicContact CG1-CD1 4.2Å; V238-F335 HydrophobicContact CG1-CE1 4.33Å; V238-F335 HydrophobicContact CG2-CD1 3.69Å; V238-F335 HydrophobicContact CG2-CE1 4.18Å; V238-A336 HydrophobicContact CG1-CB 4.21Å; V238-V339 HydrophobicContact CG1-CB 4.33Å; V238-V339 HydrophobicContact CG1-CG2 3.89Å
239	V	93.8	Very high	90.2	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	10%	0.098	C	C	.	.	H	α-helix	trans	-63.7	-34.6	179.4	-179.9	0	0	0	0	111.5	L82 L212 V214 V235 I241 V242 D243 V253 L255	L82-V239 HydrophobicContact CD1-CG1 4.1Å; L212-V239 HydrophobicContact CD2-CG2 4.23Å; V214-V239 HydrophobicContact CG2-CG2 4.36Å; V235-V239 HydrophobicContact CG1-CG2 4.3Å; V235-V239 WeakPolarHBondContact O-CG2 3.22Å; V235-V239 PolarHBondContact O-N 3.23Å; V239-I241 VanDerWaalsContact C-N 3.31Å; V239-I241 PolarHBondContact O-N 3.19Å; V239-V242 PolarHBondContact O-N 2.91Å; V239-D243 WeakPolarHBondContact O-CB 3.49Å; V239-D243 PolarHBondContact O-N 2.94Å; V239-V253 HydrophobicContact CG1-CG1 4.05Å; V239-L255 HydrophobicContact CG1-CB 4.26Å; V239-L255 HydrophobicContact CG2-CD1 4.4Å; V239-L255 HydrophobicContact CG2-CD2 4.49Å
240	N	91.9	Very high	89.6	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.8	-39.3	173.5	-171	22.6	0	0	0	112.6	K79 L82 Y110 V124 F125 F236 L237 V238 S244	K79-N240 WeakPolarHBondContact CD-OD1 3.4Å; K79-N240 WeakPolarHBondContact CE-OD1 3.31Å; K79-N240 PolarHBondContact NZ-O 3.3Å; K79-N240 PolarHBondContact NZ-OD1 2.96Å; L82-N240 HydrophobicContact CD1-CB 4.46Å; L82-N240 HydrophobicContact CD2-CB 3.67Å; Y110-N240 HydrophobicContact CD1-CB 4.33Å; V124-N240 HydrophobicContact CG1-CB 4.37Å; V124-N240 WeakPolarHBondContact CG1-ND2 3.15Å; V124-N240 WeakPolarHBondContact CG1-O 3.28Å; F125-N240 PolarHBondContact O-ND2 2.93Å; F236-N240 WeakPolarHBondContact O-CB 3.36Å; F236-N240 PolarHBondContact O-N 3.08Å; L237-N240 WeakPolarHBondContact O-CB 3.38Å; L237-N240 PolarHBondContact O-N 2.75Å; V238-N240 VanDerWaalsContact C-N 3.28Å; V238-N240 PolarHBondContact O-N 2.73Å; N240-S244 PolarHBondContact O-N 3.37Å; N240-S244 PolarHBondContact O-OG 3.1Å
241	I	92.6	Very high	89.4	Confident	8 Å²	8	15.1 Å²	15.1	4%	0.041	8%	0.077	C	C	.	.	H	α-helix	trans	-70.2	-48.4	176.3	-63.8	163.5	0	0	0	109.7	V124 V135 L237 V238 V239 D243 S244 M245 A336	V124-I241 HydrophobicContact CG1-CG1 4.29Å; V135-I241 HydrophobicContact CG2-CD1 3.69Å; V135-I241 HydrophobicContact CG2-CG1 4.11Å; L237-I241 HydrophobicContact CD1-CD1 4.16Å; L237-I241 HydrophobicContact CG-CD1 4.23Å; L237-I241 WeakPolarHBondContact O-CG1 3.45Å; L237-I241 PolarHBondContact O-N 2.77Å; L237-I241 VanDerWaalsContact O-N 3.12Å; V238-I241 PolarHBondContact O-N 2.99Å; V239-I241 VanDerWaalsContact C-N 3.31Å; V239-I241 PolarHBondContact O-N 3.19Å; I241-D243 PolarHBondContact O-N 3.03Å; I241-S244 WeakPolarHBondContact O-CB 3.3Å; I241-S244 PolarHBondContact O-N 3.35Å; I241-M245 HydrophobicContact CG2-CE 3.51Å; I241-M245 HydrophobicContact CG2-SD 4.38Å; I241-M245 PolarHBondContact O-N 3.22Å; I241-A336 HydrophobicContact CB-CB 3.74Å; I241-A336 HydrophobicContact CD1-CB 4.23Å; I241-A336 HydrophobicContact CG2-CB 3.54Å
242	V	95.3	Very high	89	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.5	-48	179.3	174.6	0	0	0	0	111.7	V238 V239 S244 M245 Y246 V253 A336 V339 A340 L343	V238-V242 HydrophobicContact CG1-CG2 4.34Å; V238-V242 WeakPolarHBondContact O-CG2 3.29Å; V238-V242 PolarHBondContact O-N 2.86Å; V239-V242 PolarHBondContact O-N 2.91Å; V242-S244 PolarHBondContact O-N 2.89Å; V242-M245 WeakPolarHBondContact O-CA 3.35Å; V242-M245 WeakPolarHBondContact O-CB 3.33Å; V242-M245 PolarHBondContact O-N 2.75Å; V242-Y246 HydrophobicContact CG1-CD2 3.69Å; V242-Y246 HydrophobicContact CG1-CE2 3.86Å; V242-Y246 WeakPolarHBondContact O-CD2 3.28Å; V242-Y246 PolarHBondContact O-N 3.25Å; V242-V253 HydrophobicContact CG1-CG2 4.37Å; V242-A336 HydrophobicContact CG2-CB 4.15Å; V242-V339 HydrophobicContact CG2-CB 4Å; V242-V339 HydrophobicContact CG2-CG1 3.92Å; V242-A340 HydrophobicContact CG1-CB 4.36Å; V242-A340 HydrophobicContact CG2-CB 4.37Å; V242-L343 HydrophobicContact CG1-CD2 4.15Å
243	D	91.8	Very high	89	Confident	11 Å²	11	18 Å²	18	6%	0.059	9%	0.087	C	C	.	.	H	α-helix	trans	-55.4	-36.9	176.3	171.9	68.9	0	0	0	112.1	K79 L82 V239 I241 M245 Y246 K247 V253	K79-D243 WeakPolarHBondContact CD-OD2 3.21Å; K79-D243 WeakPolarHBondContact CE-OD2 3.49Å; K79-D243 IonicContact NZ-OD2 3.88Å; K79-D243 PolarHBondContact NZ-OD2 2.79Å; L82-D243 HydrophobicContact CD1-CB 3.63Å; V239-D243 WeakPolarHBondContact O-CB 3.49Å; V239-D243 PolarHBondContact O-N 2.94Å; I241-D243 PolarHBondContact O-N 3.03Å; D243-M245 VanDerWaalsContact C-N 3.35Å; D243-M245 PolarHBondContact O-N 2.84Å; D243-Y246 PolarHBondContact O-N 2.77Å; D243-K247 PolarHBondContact O-N 2.8Å; D243-V253 HydrophobicContact CB-CB 4.1Å; D243-V253 PolarHBondContact OD1-N 2.88Å
244	S	88.6	Confident	89	Confident	14 Å²	14	16.2 Å²	16.2	10%	0.098	8%	0.079	C	C	.	.	H	α-helix	trans	-67.9	-34.6	177	-50.1	0	0	0	0	112.7	K79 V124 N240 I241 V242	K79-S244 PolarHBondContact NZ-OG 2.76Å; V124-S244 WeakPolarHBondContact CG2-OG 3.46Å; N240-S244 PolarHBondContact O-N 3.37Å; N240-S244 PolarHBondContact O-OG 3.1Å; I241-S244 WeakPolarHBondContact O-CB 3.3Å; I241-S244 PolarHBondContact O-N 3.35Å; V242-S244 PolarHBondContact O-N 2.89Å
245	M	90.2	Very high	89	Confident	9 Å²	9	16 Å²	16	4%	0.044	8%	0.078	C	C	.	.	H	α-helix	trans	-70.6	-38.6	175.2	-64.9	166.6	178.3	0	0	111.5	I241 V242 D243 K247 Q248 N337 A340 I364	I241-M245 HydrophobicContact CG2-CE 3.51Å; I241-M245 HydrophobicContact CG2-SD 4.38Å; I241-M245 PolarHBondContact O-N 3.22Å; V242-M245 WeakPolarHBondContact O-CA 3.35Å; V242-M245 WeakPolarHBondContact O-CB 3.33Å; V242-M245 PolarHBondContact O-N 2.75Å; D243-M245 VanDerWaalsContact C-N 3.35Å; D243-M245 PolarHBondContact O-N 2.84Å; M245-K247 VanDerWaalsContact C-N 3.34Å; M245-Q248 VanDerWaalsContact O-CD 3.27Å; M245-Q248 WeakPolarHBondContact O-CG 3.37Å; M245-Q248 PolarHBondContact O-NE2 3.48Å; M245-N337 WeakPolarHBondContact CE-OD1 3.41Å; M245-A340 HydrophobicContact SD-CB 3.7Å; M245-I364 HydrophobicContact CB-CD1 4.04Å; M245-I364 HydrophobicContact CG-CD1 4.28Å; M245-I364 HydrophobicContact SD-CD1 4.35Å
246	Y	90.9	Very high	88.7	Confident	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-76.4	-20.7	-180	-87.3	-87.9	0	0	0	114.1	V242 D243 Q248 L249 S251 V253 A340 L343 G344 L347 M349 F375	V242-Y246 HydrophobicContact CG1-CD2 3.69Å; V242-Y246 HydrophobicContact CG1-CE2 3.86Å; V242-Y246 WeakPolarHBondContact O-CD2 3.28Å; V242-Y246 PolarHBondContact O-N 3.25Å; D243-Y246 PolarHBondContact O-N 2.77Å; Y246-Q248 PolarHBondContact O-N 2.73Å; Y246-Q248 VanDerWaalsContact O-N 3.11Å; Y246-L249 HydrophobicContact CD1-CD1 3.98Å; Y246-L249 HydrophobicContact CE1-CD1 4.07Å; Y246-L249 WeakPolarHBondContact O-CB 3.44Å; Y246-L249 PolarHBondContact O-N 3.12Å; Y246-S251 CarbonylContact C-O 3.56Å; Y246-S251 VanDerWaalsContact C-O 3.23Å; Y246-S251 PolarHBondContact O-N 2.76Å; Y246-V253 HydrophobicContact CD2-CG2 4.07Å; Y246-V253 HydrophobicContact CG-CG2 3.87Å; Y246-A340 HydrophobicContact CE2-CB 3.98Å; Y246-A340 PolarHBondContact OH-O 2.84Å; Y246-L343 HydrophobicContact CD2-CD2 4.38Å; Y246-L343 HydrophobicContact CE2-CB 4.38Å; Y246-L343 HydrophobicContact CE2-CD2 3.83Å; Y246-L343 HydrophobicContact CE2-CG 4.34Å; Y246-L343 VanDerWaalsContact OH-C 3.23Å; Y246-G344 VanDerWaalsContact OH-CA 3.22Å; Y246-G344 WeakPolarHBondContact OH-CA 3.45Å; Y246-G344 PolarHBondContact OH-N 2.95Å; Y246-L347 HydrophobicContact CD1-CD1 4.09Å; Y246-L347 HydrophobicContact CE1-CD1 3.3Å; Y246-M349 HydrophobicContact CE1-CE 4.24Å; Y246-F375 HydrophobicContact CD1-CE2 4.43Å; Y246-F375 HydrophobicContact CE1-CE2 4.25Å; Y246-F375 HydrophobicContact CE1-CZ 4.11Å; Y246-F375 HydrophobicContact CE2-CE2 4.37Å; Y246-F375 AromaticContact CE2-CZ 4Å; Y246-F375 HydrophobicContact CE2-CZ 4Å; Y246-F375 AromaticContact CZ-CZ 3.75Å
247	K	82.9	Confident	88.6	Confident	93 Å²	93	16.6 Å²	16.6	40%	0.404	8%	0.082	S	C	.	.	G	3₁₀ helix	trans	-54.9	-30.5	174.4	-168.7	177.2	-179.1	-176.2	0	113	H112 D243 M245 L249 G250 S251	H112-K247 PolarHBondContact CD2-NZ 2.99Å; H112-K247 VanDerWaalsContact CD2-NZ 3.31Å; H112-K247 PolarHBondContact NE2-NZ 3.12Å; H112-K247 VanDerWaalsContact NE2-NZ 3.18Å; D243-K247 PolarHBondContact O-N 2.8Å; M245-K247 VanDerWaalsContact C-N 3.34Å; K247-L249 PolarHBondContact O-N 3.04Å; K247-G250 PolarHBondContact O-N 3.44Å; K247-S251 PolarHBondContact N-O 3.21Å
248	Q	83.8	Confident	88.8	Confident	77 Å²	77	16.4 Å²	16.4	36%	0.36	8%	0.081	S	C	.	.	G	3₁₀ helix	trans	-67.3	-18.9	177.1	78.6	-163.1	-30.4	0	0	113.8	M245 Y246 E373 F375	M245-Q248 VanDerWaalsContact O-CD 3.27Å; M245-Q248 WeakPolarHBondContact O-CG 3.37Å; M245-Q248 PolarHBondContact O-NE2 3.48Å; Y246-Q248 PolarHBondContact O-N 2.73Å; Y246-Q248 VanDerWaalsContact O-N 3.11Å; Q248-E373 PolarHBondContact NE2-O 3.05Å; Q248-E373 VanDerWaalsContact NE2-O 3.16Å; Q248-F375 HydrophobicContact CG-CD2 3.97Å; Q248-F375 VanDerWaalsContact NE2-N 3.1Å
249	L	82.4	Confident	88.8	Confident	11 Å²	11	16.6 Å²	16.6	6%	0.058	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-94.8	4.3	174.1	-54.8	178.6	0	0	0	112.2	Y246 K247 S251 M349 F375 Y380 F383	Y246-L249 HydrophobicContact CD1-CD1 3.98Å; Y246-L249 HydrophobicContact CE1-CD1 4.07Å; Y246-L249 WeakPolarHBondContact O-CB 3.44Å; Y246-L249 PolarHBondContact O-N 3.12Å; K247-L249 PolarHBondContact O-N 3.04Å; L249-S251 PolarHBondContact O-N 3.41Å; L249-M349 HydrophobicContact CD1-CE 3.25Å; L249-F375 HydrophobicContact CD1-CD2 3.57Å; L249-F375 HydrophobicContact CD1-CE2 3.65Å; L249-F375 HydrophobicContact CD1-CG 4.32Å; L249-F375 HydrophobicContact CD1-CZ 4.4Å; L249-F375 HydrophobicContact CD2-CB 4.3Å; L249-F375 HydrophobicContact CD2-CD2 3.94Å; L249-F375 HydrophobicContact CD2-CG 4.38Å; L249-F375 HydrophobicContact CG-CD2 3.74Å; L249-F375 HydrophobicContact CG-CE2 4.17Å; L249-Y380 HydrophobicContact CD2-CD2 3.63Å; L249-Y380 HydrophobicContact CD2-CE2 4.36Å; L249-F383 HydrophobicContact CB-CD1 4.38Å; L249-F383 HydrophobicContact CB-CE1 4.09Å; L249-F383 HydrophobicContact CB-CZ 4.4Å; L249-F383 HydrophobicContact CD1-CD1 4.5Å; L249-F383 HydrophobicContact CD1-CD2 4.38Å; L249-F383 HydrophobicContact CD1-CG 4.3Å
250	G	74.8	Confident	88.9	Confident	18 Å²	18	16.6 Å²	16.6	19%	0.186	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	25.9	-169.4	0	0	0	0	0	112.5	A207 W208 K247	A207-G250 CarbonylContact C-O 3.49Å; A207-G250 WeakPolarHBondContact CA-O 3.39Å; W208-G250 PolarHBondContact N-O 3.07Å; K247-G250 PolarHBondContact O-N 3.44Å
251	S	84.6	Confident	89.1	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.3	177.4	-169.8	0	0	0	0	111	W208 Y246 K247 L249	W208-S251 CarbonylContact O-C 3.58Å; W208-S251 WeakPolarHBondContact O-CA 3.26Å; Y246-S251 CarbonylContact C-O 3.56Å; Y246-S251 VanDerWaalsContact C-O 3.23Å; Y246-S251 PolarHBondContact O-N 2.76Å; K247-S251 PolarHBondContact N-O 3.21Å; L249-S251 PolarHBondContact O-N 3.41Å
252	Y	85.4	Confident	89.1	Confident	78 Å²	78	17.4 Å²	17.4	31%	0.306	9%	0.087	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.4	175.4	-65.4	-83.7	0	0	0	108.8	L81 A207 W208 F209 L210	L81-Y252 HydrophobicContact CD1-CD1 4.15Å; L81-Y252 HydrophobicContact CD1-CE1 4.47Å; L81-Y252 HydrophobicContact CD1-CG 4.22Å; A207-Y252 HydrophobicContact CB-CD2 4.12Å; A207-Y252 HydrophobicContact CB-CE2 3.79Å; W208-Y252 PolarHBondContact O-N 3.33Å; F209-Y252 HydrophobicContact CD1-CD2 4.14Å; F209-Y252 HydrophobicContact CD1-CG 4.45Å; F209-Y252 AromaticContact CE1-CD2 3.86Å; F209-Y252 HydrophobicContact CE1-CD2 3.86Å; F209-Y252 HydrophobicContact CE1-CG 4.4Å; L210-Y252 PolarHBondContact N-O 3.04Å
253	V	90.8	Very high	89	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116	177.5	179.9	0	0	0	0	108.1	L210 L212 V239 V242 D243 Y246 L343	L210-V253 HydrophobicContact CD2-CG1 4.45Å; L212-V253 HydrophobicContact CB-CG1 4.2Å; L212-V253 HydrophobicContact CD2-CG1 3.92Å; V239-V253 HydrophobicContact CG1-CG1 4.05Å; V242-V253 HydrophobicContact CG1-CG2 4.37Å; D243-V253 HydrophobicContact CB-CB 4.1Å; D243-V253 PolarHBondContact OD1-N 2.88Å; Y246-V253 HydrophobicContact CD2-CG2 4.07Å; Y246-V253 HydrophobicContact CG-CG2 3.87Å; V253-L343 HydrophobicContact CG2-CD2 4.23Å
254	I	87.9	Confident	89	Confident	6 Å²	6	21.6 Å²	21.6	3%	0.031	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.7	-174.4	-56.8	137.9	0	0	0	108	L81 F209 L210 L212 T256 P398	L81-I254 HydrophobicContact CB-CG1 4.5Å; L81-I254 WeakPolarHBondContact O-CG1 3.38Å; F209-I254 HydrophobicContact CB-CD1 3.77Å; F209-I254 HydrophobicContact CD1-CD1 3.98Å; F209-I254 HydrophobicContact CG-CD1 4.36Å; L210-I254 PolarHBondContact O-N 3.26Å; L212-I254 PolarHBondContact N-O 3.38Å; I254-T256 HydrophobicContact CG2-CG2 4.17Å; I254-T256 PolarHBondContact O-N 2.87Å; I254-P398 HydrophobicContact CD1-CB 4.26Å; I254-P398 HydrophobicContact CD1-CG 3.55Å; I254-P398 HydrophobicContact CG1-CG 4.22Å
255	L	90.4	Very high	89.2	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118	173.5	-173.1	61.3	0	0	0	110	L82 L87 L212 V214 V235 F236 V239 I258	L82-L255 PolarHBondContact O-N 3.01Å; L87-L255 HydrophobicContact CD1-CG 4.04Å; L87-L255 VanDerWaalsContact CD1-O 3.28Å; L87-L255 WeakPolarHBondContact CD1-O 3.47Å; L87-L255 HydrophobicContact CD2-CD2 4.22Å; L87-L255 HydrophobicContact CD2-CG 4.49Å; L212-L255 WeakPolarHBondContact O-CA 3.5Å; V214-L255 HydrophobicContact CB-CD1 4.23Å; V214-L255 HydrophobicContact CG2-CD1 3.73Å; V235-L255 HydrophobicContact CG1-CD2 3.96Å; F236-L255 HydrophobicContact CD1-CD2 3.49Å; F236-L255 VanDerWaalsContact CD1-CD2 3.49Å; F236-L255 HydrophobicContact CE1-CD2 3.52Å; V239-L255 HydrophobicContact CG1-CB 4.26Å; V239-L255 HydrophobicContact CG2-CD1 4.4Å; V239-L255 HydrophobicContact CG2-CD2 4.49Å; L255-I258 HydrophobicContact CD1-CG1 4.39Å; L255-I258 HydrophobicContact CD2-CD1 4.07Å; L255-I258 HydrophobicContact CD2-CG1 4.1Å; L255-I258 HydrophobicContact CG-CG1 4.47Å
256	T	87.6	Confident	89.2	Confident	19 Å²	19	26.6 Å²	26.6	12%	0.117	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-13.7	-176.9	58.9	0	0	0	0	114.3	L87 P88 E211 L212 V213 I254	L87-T256 VanDerWaalsContact CD1-C 3.4Å; P88-T256 WeakPolarHBondContact CD-O 3.47Å; P88-T256 WeakPolarHBondContact CG-O 3.48Å; E211-T256 HydrophobicContact CB-CG2 3.68Å; E211-T256 HydrophobicContact CG-CG2 3.91Å; L212-T256 PolarHBondContact O-N 3.07Å; L212-T256 PolarHBondContact O-OG1 3.18Å; V213-T256 WeakPolarHBondContact CG2-OG1 3.47Å; I254-T256 HydrophobicContact CG2-CG2 4.17Å; I254-T256 PolarHBondContact O-N 2.87Å
257	G	89.9	Confident	89.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	160.1	168.9	0	0	0	0	0	113.6	P88 V214	P88-G257 WeakPolarHBondContact O-CA 3.49Å; V214-G257 PolarHBondContact N-O 3.45Å
258	I	93.9	Very high	89.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135	173	-55.8	174.2	0	0	0	108.9	L87 P88 V89 F90 V214 Q232 V235 F236 L255 I260	L87-I258 HydrophobicContact CD2-CD1 3.95Å; L87-I258 HydrophobicContact CD2-CG1 4.12Å; P88-I258 PolarHBondContact O-N 3.25Å; V89-I258 CarbonylContact C-O 3.44Å; V89-I258 VanDerWaalsContact CA-O 3.27Å; V89-I258 WeakPolarHBondContact CA-O 3.44Å; V89-I258 HydrophobicContact CG1-CB 4.38Å; V89-I258 HydrophobicContact CG2-CB 4.32Å; F90-I258 PolarHBondContact N-O 3.31Å; V214-I258 CarbonylContact O-C 3.56Å; V214-I258 VanDerWaalsContact O-CA 3.27Å; V214-I258 WeakPolarHBondContact O-CA 3.3Å; Q232-I258 HydrophobicContact CG-CD1 4.38Å; V235-I258 HydrophobicContact CB-CD1 4.2Å; V235-I258 HydrophobicContact CG1-CD1 3.88Å; V235-I258 HydrophobicContact CG1-CG1 4.19Å; F236-I258 HydrophobicContact CD1-CD1 4.46Å; F236-I258 HydrophobicContact CE1-CD1 3.74Å; F236-I258 HydrophobicContact CZ-CD1 4.07Å; L255-I258 HydrophobicContact CD1-CG1 4.39Å; L255-I258 HydrophobicContact CD2-CD1 4.07Å; L255-I258 HydrophobicContact CD2-CG1 4.1Å; L255-I258 HydrophobicContact CG-CG1 4.47Å; I258-I260 HydrophobicContact CG2-CD1 4.3Å; I258-I260 HydrophobicContact CG2-CG1 3.83Å
259	E	94.6	Very high	89.9	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.019	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.6	166.2	-177.3	172.1	149.3	0	0	110.7	F90 Y92 V214 V215 V216 W261 W282	F90-E259 HydrophobicContact CB-CB 4.05Å; F90-E259 HydrophobicContact CB-CG 3.84Å; F90-E259 WeakPolarHBondContact O-CA 3.4Å; Y92-E259 HydrophobicContact CE2-CG 4.35Å; Y92-E259 PolarHBondContact OH-OE1 2.96Å; V214-E259 PolarHBondContact O-N 3.22Å; V215-E259 CarbonylContact C-O 3.5Å; V215-E259 WeakPolarHBondContact CA-O 3.47Å; V215-E259 HydrophobicContact CG1-CB 4.42Å; V215-E259 HydrophobicContact CG2-CB 4.3Å; V216-E259 PolarHBondContact N-O 3.13Å; E259-W261 PolarHBondContact OE1-NE1 3.03Å; E259-W282 WeakPolarHBondContact OE1-CH2 3.34Å; E259-W282 WeakPolarHBondContact OE1-CZ2 3.4Å; E259-W282 WeakPolarHBondContact OE2-CH2 3.48Å
260	I	96.3	Very high	90.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.1	-175.7	-53.1	170.9	0	0	0	109.4	V89 F90 T91 V216 F221 I228 V231 I258 N262	V89-I260 HydrophobicContact CG1-CD1 4.17Å; F90-I260 PolarHBondContact O-N 3.03Å; T91-I260 HydrophobicContact CG2-CB 4.36Å; V216-I260 HydrophobicContact CB-CG1 4.46Å; F221-I260 HydrophobicContact CB-CG2 4.18Å; F221-I260 HydrophobicContact CD2-CG2 3.9Å; F221-I260 HydrophobicContact CG-CG2 4.24Å; I228-I260 HydrophobicContact CG2-CD1 3.94Å; V231-I260 HydrophobicContact CB-CD1 4.03Å; V231-I260 HydrophobicContact CG1-CD1 3.75Å; V231-I260 HydrophobicContact CG1-CG1 4.01Å; I258-I260 HydrophobicContact CG2-CD1 4.3Å; I258-I260 HydrophobicContact CG2-CG1 3.83Å; I260-N262 HydrophobicContact CG2-CB 4.5Å; I260-N262 PolarHBondContact O-N 3.38Å; I260-N262 PolarHBondContact O-OD1 2.94Å
261	W	95.4	Very high	91	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	17%	0.168	C	C	.	.			trans	-81.7	67.5	177.3	-65.3	-4.9	0	0	0	111.7	Y92 V215 V216 N217 H218 E259 Q263 N265 V266 F267 M269 W282 M297	Y92-W261 AromaticContact CE2-CD1 3.83Å; V215-W261 HydrophobicContact CG1-CZ2 4.03Å; V216-W261 PolarHBondContact O-N 3.29Å; N217-W261 HydrophobicContact CB-CE3 4.44Å; H218-W261 VanDerWaalsContact CA-O 3.27Å; H218-W261 WeakPolarHBondContact CA-O 3.31Å; H218-W261 VanDerWaalsContact CB-O 3.28Å; H218-W261 WeakPolarHBondContact CB-O 3.18Å; H218-W261 PolarHBondContact ND1-O 3.11Å; E259-W261 PolarHBondContact OE1-NE1 3.03Å; W261-Q263 VanDerWaalsContact C-N 3.3Å; W261-Q263 PolarHBondContact O-N 3.37Å; W261-N265 HydrophobicContact CE3-CB 4.17Å; W261-N265 HydrophobicContact CZ3-CB 4.32Å; W261-V266 HydrophobicContact CD2-CG2 3.86Å; W261-V266 HydrophobicContact CE3-CB 4.45Å; W261-V266 HydrophobicContact CE3-CG2 4.26Å; W261-V266 HydrophobicContact CG-CG2 4.38Å; W261-V266 HydrophobicContact CH2-CB 3.8Å; W261-V266 HydrophobicContact CH2-CG2 4.06Å; W261-V266 HydrophobicContact CZ2-CB 3.88Å; W261-V266 HydrophobicContact CZ2-CG2 3.69Å; W261-V266 HydrophobicContact CZ3-CB 4.08Å; W261-V266 HydrophobicContact CZ3-CG2 4.32Å; W261-F267 AromaticContact CH2-CD1 4Å; W261-F267 HydrophobicContact CH2-CD1 4Å; W261-F267 AromaticContact CH2-CE1 3.48Å; W261-F267 HydrophobicContact CH2-CE1 3.48Å; W261-F267 VanDerWaalsContact CH2-CE1 3.48Å; W261-F267 HydrophobicContact CH2-CE2 4.07Å; W261-F267 AromaticContact CH2-CZ 3.51Å; W261-F267 HydrophobicContact CH2-CZ 3.51Å; W261-F267 HydrophobicContact CZ2-CE1 4.3Å; W261-F267 HydrophobicContact CZ3-CE1 4.36Å; W261-F267 HydrophobicContact CZ3-CE2 4.26Å; W261-F267 HydrophobicContact CZ3-CZ 4.15Å; W261-M269 HydrophobicContact CE3-CE 4.45Å; W261-M269 HydrophobicContact CZ3-CE 3.84Å; W261-W282 HydrophobicContact CZ2-CD2 4.24Å; W261-W282 HydrophobicContact CZ2-CE3 4.46Å; W261-W282 HydrophobicContact CZ2-CH2 4.36Å; W261-W282 HydrophobicContact CZ2-CZ2 4.1Å; W261-W282 AromaticContact NE1-CZ2 3.92Å; W261-M297 HydrophobicContact CE3-CE 3.83Å; W261-M297 HydrophobicContact CH2-CE 3.43Å; W261-M297 VanDerWaalsContact CH2-CE 3.43Å; W261-M297 HydrophobicContact CH2-SD 4.48Å; W261-M297 HydrophobicContact CZ2-CE 4.22Å; W261-M297 HydrophobicContact CZ3-CE 3.23Å
262	N	93.9	Very high	91.3	Very high	25 Å²	25	29.4 Å²	29.4	13%	0.134	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.5	-175.7	65.4	-44.1	0	0	0	114.6	Y92 H218 F221 I260	Y92-N262 WeakPolarHBondContact CA-OD1 3.34Å; Y92-N262 WeakPolarHBondContact CB-OD1 3.22Å; Y92-N262 PolarHBondContact N-OD1 3.18Å; Y92-N262 PolarHBondContact O-ND2 2.96Å; Y92-N262 PolarHBondContact O-OD1 2.85Å; H218-N262 PolarHBondContact CE1-O 3.48Å; H218-N262 PolarHBondContact ND1-O 2.98Å; F221-N262 HydrophobicContact CD1-CB 4.1Å; F221-N262 HydrophobicContact CD2-CB 4.5Å; F221-N262 HydrophobicContact CE1-CB 3.77Å; F221-N262 HydrophobicContact CE2-CB 4.21Å; F221-N262 HydrophobicContact CG-CB 4.44Å; F221-N262 HydrophobicContact CZ-CB 3.82Å; I260-N262 HydrophobicContact CG2-CB 4.5Å; I260-N262 PolarHBondContact O-N 3.38Å; I260-N262 PolarHBondContact O-OD1 2.94Å
263	Q	92.6	Very high	91.7	Very high	72 Å²	72	29.3 Å²	29.3	34%	0.336	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-14.1	-178.5	-65.5	-67.6	-17.2	0	0	114.3	Y92 T93 D94 W261	Y92-Q263 WeakPolarHBondContact O-CG 3.49Å; Y92-Q263 PolarHBondContact O-NE2 3.34Å; T93-Q263 WeakPolarHBondContact O-CG 3.35Å; D94-Q263 PolarHBondContact OD1-NE2 3.06Å; W261-Q263 VanDerWaalsContact C-N 3.3Å; W261-Q263 PolarHBondContact O-N 3.37Å
264	G	92.5	Very high	91.7	Very high	27 Å²	27	33.3 Å²	33.3	28%	0.278	19%	0.189	S	C	.	.			trans	146.7	159	-177.7	0	0	0	0	0	111.9	H218	H218-G264 PolarHBondContact ND1-N 2.94Å
265	N	92.3	Very high	92.1	Very high	52 Å²	52	33 Å²	33	28%	0.278	19%	0.188	S	C	.	.			trans	-68	136.3	177.6	-66.3	-38.2	0	0	0	110.9	N217 H218 D219 W261 F267 M269	N217-N265 WeakPolarHBondContact CB-OD1 3.46Å; H218-N265 VanDerWaalsContact CB-OD1 3.24Å; H218-N265 WeakPolarHBondContact CB-OD1 3.49Å; H218-N265 PolarHBondContact N-OD1 3.09Å; D219-N265 PolarHBondContact OD2-ND2 3.33Å; W261-N265 HydrophobicContact CE3-CB 4.17Å; W261-N265 HydrophobicContact CZ3-CB 4.32Å; N265-F267 VanDerWaalsContact C-N 3.32Å; N265-F267 WeakPolarHBondContact CB-O 3.4Å; N265-M269 HydrophobicContact CB-CE 3.91Å
266	V	90.8	Very high	92.3	Very high	76 Å²	76	33.1 Å²	33.1	46%	0.461	19%	0.188	S	C	.	.	S	Bend	trans	-69.3	-33.2	179.5	178.2	0	0	0	0	111.6	W261	W261-V266 HydrophobicContact CD2-CG2 3.86Å; W261-V266 HydrophobicContact CE3-CB 4.45Å; W261-V266 HydrophobicContact CE3-CG2 4.26Å; W261-V266 HydrophobicContact CG-CG2 4.38Å; W261-V266 HydrophobicContact CH2-CB 3.8Å; W261-V266 HydrophobicContact CH2-CG2 4.06Å; W261-V266 HydrophobicContact CZ2-CB 3.88Å; W261-V266 HydrophobicContact CZ2-CG2 3.69Å; W261-V266 HydrophobicContact CZ3-CB 4.08Å; W261-V266 HydrophobicContact CZ3-CG2 4.32Å
267	F	92.6	Very high	92.6	Very high	23 Å²	23	35 Å²	35	10%	0.101	20%	0.197	C	C	.	.	S	Bend	trans	-134.9	161.8	175.6	49.1	-111.1	0	0	0	112	W261 N265 M269 V275 D278 F279 W282 M297	W261-F267 AromaticContact CH2-CD1 4Å; W261-F267 HydrophobicContact CH2-CD1 4Å; W261-F267 AromaticContact CH2-CE1 3.48Å; W261-F267 HydrophobicContact CH2-CE1 3.48Å; W261-F267 VanDerWaalsContact CH2-CE1 3.48Å; W261-F267 HydrophobicContact CH2-CE2 4.07Å; W261-F267 AromaticContact CH2-CZ 3.51Å; W261-F267 HydrophobicContact CH2-CZ 3.51Å; W261-F267 HydrophobicContact CZ2-CE1 4.3Å; W261-F267 HydrophobicContact CZ3-CE1 4.36Å; W261-F267 HydrophobicContact CZ3-CE2 4.26Å; W261-F267 HydrophobicContact CZ3-CZ 4.15Å; N265-F267 VanDerWaalsContact C-N 3.32Å; N265-F267 WeakPolarHBondContact CB-O 3.4Å; F267-M269 HydrophobicContact CD2-CE 4.26Å; F267-M269 HydrophobicContact CE2-CE 4.01Å; F267-V275 HydrophobicContact CE2-CG1 4.13Å; F267-D278 HydrophobicContact CB-CB 4.42Å; F267-D278 HydrophobicContact CD1-CB 3.96Å; F267-D278 HydrophobicContact CD2-CB 4.02Å; F267-D278 HydrophobicContact CE1-CB 4.13Å; F267-D278 HydrophobicContact CE2-CB 4.24Å; F267-D278 HydrophobicContact CG-CB 3.88Å; F267-D278 HydrophobicContact CZ-CB 4.27Å; F267-F279 HydrophobicContact CE1-CB 4.49Å; F267-F279 HydrophobicContact CZ-CB 3.89Å; F267-F279 HydrophobicContact CZ-CD2 4.49Å; F267-W282 HydrophobicContact CE1-CB 4.11Å; F267-W282 HydrophobicContact CE1-CG 4.37Å; F267-M297 HydrophobicContact CE2-CE 4.22Å; F267-M297 HydrophobicContact CE2-SD 4.27Å; F267-M297 HydrophobicContact CZ-CE 4.12Å; F267-M297 HydrophobicContact CZ-SD 3.96Å
268	P	90.4	Very high	92.9	Very high	83 Å²	83	36.7 Å²	36.7	54%	0.539	21%	0.207	S	C	.	.			trans	-66.7	143.2	-177.3	-21.1	34.4	0	0	0	114.2	T270	P268-T270 HydrophobicContact CB-CG2 4.11Å; P268-T270 PolarHBondContact O-N 3.3Å
269	M	89.8	Confident	93	Very high	28 Å²	28	36.7 Å²	36.7	14%	0.138	21%	0.207	C	C	.	.			trans	-96	67.5	177.6	-59.9	-65.7	161.1	0	0	111.5	N217 W261 N265 F267 V275 M297 N301	N217-M269 HydrophobicContact CB-CE 4.04Å; W261-M269 HydrophobicContact CE3-CE 4.45Å; W261-M269 HydrophobicContact CZ3-CE 3.84Å; N265-M269 HydrophobicContact CB-CE 3.91Å; F267-M269 HydrophobicContact CD2-CE 4.26Å; F267-M269 HydrophobicContact CE2-CE 4.01Å; M269-V275 HydrophobicContact SD-CG1 4.22Å; M269-V275 HydrophobicContact SD-CG2 3.75Å; M269-M297 HydrophobicContact CE-CE 3.62Å; M269-N301 PolarHBondContact O-ND2 3.48Å
270	T	87.6	Confident	92.9	Very high	81 Å²	81	36.7 Å²	36.7	50%	0.497	21%	0.207	S	C	.	.	S	Bend	trans	-85.2	-59.4	-173.3	46.1	0	0	0	0	113.4	P268 Q274	P268-T270 HydrophobicContact CB-CG2 4.11Å; P268-T270 PolarHBondContact O-N 3.3Å; T270-Q274 PolarHBondContact OG1-OE1 2.9Å
271	S	91.3	Very high	92.7	Very high	42 Å²	42	41.9 Å²	41.9	29%	0.294	23%	0.231	S	C	.	.			trans	-139.6	157.7	174.8	90.8	0	0	0	0	109.4	E273 Q274 V275	S271-E273 VanDerWaalsContact C-N 3.27Å; S271-E273 VanDerWaalsContact CB-OE2 3.23Å; S271-E273 WeakPolarHBondContact CB-OE2 3.22Å; S271-E273 PolarHBondContact O-N 3.31Å; S271-E273 PolarHBondContact OG-OE2 2.82Å; S271-Q274 PolarHBondContact O-N 3.09Å; S271-Q274 PolarHBondContact OG-N 3.36Å; S271-V275 WeakPolarHBondContact O-CB 2.99Å; S271-V275 VanDerWaalsContact O-CG2 3.22Å; S271-V275 WeakPolarHBondContact O-CG2 3.45Å; S271-V275 PolarHBondContact O-N 3.12Å
272	I	91.8	Very high	92.6	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-67.1	-31.6	-176.3	-158.4	170.3	0	0	0	112.1	V275 L276 I304 I306 L309 V324	I272-V275 PolarHBondContact O-N 2.9Å; I272-L276 WeakPolarHBondContact O-CB 3.28Å; I272-L276 PolarHBondContact O-N 2.9Å; I272-I304 HydrophobicContact CB-CG2 4.04Å; I272-I306 HydrophobicContact CD1-CB 4.18Å; I272-I306 HydrophobicContact CD1-CG2 3.71Å; I272-I306 HydrophobicContact CG2-CB 4.02Å; I272-I306 HydrophobicContact CG2-CD1 3.61Å; I272-I306 HydrophobicContact CG2-CG1 4.41Å; I272-I306 HydrophobicContact CG2-CG2 3.91Å; I272-L309 HydrophobicContact CD1-CB 4.04Å; I272-L309 HydrophobicContact CG1-CB 4.06Å; I272-L309 HydrophobicContact CG2-CB 4.23Å; I272-L309 HydrophobicContact CG2-CD2 4.21Å; I272-V324 HydrophobicContact CG1-CB 4.4Å; I272-V324 HydrophobicContact CG1-CG1 4.18Å
273	E	92.3	Very high	92.5	Very high	76 Å²	76	42.2 Å²	42.2	36%	0.355	23%	0.231	S	C	.	.	H	α-helix	trans	-66.5	-43.7	176.4	-53.7	83.5	171.9	0	0	111.5	S271 N277 L309	S271-E273 VanDerWaalsContact C-N 3.27Å; S271-E273 VanDerWaalsContact CB-OE2 3.23Å; S271-E273 WeakPolarHBondContact CB-OE2 3.22Å; S271-E273 PolarHBondContact O-N 3.31Å; S271-E273 PolarHBondContact OG-OE2 2.82Å; E273-N277 PolarHBondContact O-N 2.73Å; E273-N277 VanDerWaalsContact O-N 3.13Å; E273-L309 HydrophobicContact CB-CD2 4.28Å; E273-L309 HydrophobicContact CG-CD2 3.99Å
274	Q	92.6	Very high	92.1	Very high	84 Å²	84	43.5 Å²	43.5	39%	0.393	24%	0.237	S	C	.	.	H	α-helix	trans	-66.5	-43	175.6	-176.2	173.5	-4.7	0	0	110.8	T270 S271 L276 N277 D278	T270-Q274 PolarHBondContact OG1-OE1 2.9Å; S271-Q274 PolarHBondContact O-N 3.09Å; S271-Q274 PolarHBondContact OG-N 3.36Å; Q274-L276 PolarHBondContact O-N 3.23Å; Q274-N277 PolarHBondContact O-N 2.76Å; Q274-D278 WeakPolarHBondContact O-CB 3.48Å; Q274-D278 VanDerWaalsContact O-CG 3.31Å; Q274-D278 PolarHBondContact O-N 2.91Å
275	V	95	Very high	91.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-44.2	177.7	169.1	0	0	0	0	111.3	F267 M269 S271 I272 D278 F279 M297 V324	F267-V275 HydrophobicContact CE2-CG1 4.13Å; M269-V275 HydrophobicContact SD-CG1 4.22Å; M269-V275 HydrophobicContact SD-CG2 3.75Å; S271-V275 WeakPolarHBondContact O-CB 2.99Å; S271-V275 VanDerWaalsContact O-CG2 3.22Å; S271-V275 WeakPolarHBondContact O-CG2 3.45Å; S271-V275 PolarHBondContact O-N 3.12Å; I272-V275 PolarHBondContact O-N 2.9Å; V275-D278 PolarHBondContact O-N 3.42Å; V275-F279 WeakPolarHBondContact O-CB 3.27Å; V275-F279 PolarHBondContact O-N 3.08Å; V275-M297 HydrophobicContact CG1-SD 4.1Å; V275-V324 HydrophobicContact CG1-CG1 3.81Å; V275-V324 HydrophobicContact CG1-CG2 4Å
276	L	95.4	Very high	91.1	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-61.5	-45	176	176.7	63.7	0	0	0	111.7	I272 Q274 F279 S280 L309 Y311 V324	I272-L276 WeakPolarHBondContact O-CB 3.28Å; I272-L276 PolarHBondContact O-N 2.9Å; Q274-L276 PolarHBondContact O-N 3.23Å; L276-F279 PolarHBondContact O-N 2.88Å; L276-S280 WeakPolarHBondContact O-CB 3.24Å; L276-S280 PolarHBondContact O-N 3.29Å; L276-L309 HydrophobicContact CB-CD2 4.31Å; L276-L309 HydrophobicContact CD2-CB 4.39Å; L276-L309 HydrophobicContact CD2-CD2 3.72Å; L276-L309 HydrophobicContact CD2-CG 3.67Å; L276-Y311 HydrophobicContact CD1-CD2 3.99Å; L276-Y311 HydrophobicContact CD1-CE2 3.8Å; L276-Y311 HydrophobicContact CD2-CD2 4.01Å; L276-Y311 HydrophobicContact CD2-CE2 3.83Å; L276-Y311 HydrophobicContact CD2-CG 4.45Å; L276-Y311 HydrophobicContact CG-CD2 4.11Å; L276-Y311 HydrophobicContact CG-CE2 3.6Å; L276-V324 HydrophobicContact CB-CG2 3.96Å; L276-V324 HydrophobicContact CD1-CG2 3.97Å
277	N	94	Very high	90.8	Very high	58 Å²	58	45.1 Å²	45.1	31%	0.31	24%	0.239	S	C	.	.	H	α-helix	trans	-61.3	-49.5	177.9	178.9	77.4	0	0	0	111.6	E273 Q274 F279 S280 Q281	E273-N277 PolarHBondContact O-N 2.73Å; E273-N277 VanDerWaalsContact O-N 3.13Å; Q274-N277 PolarHBondContact O-N 2.76Å; N277-F279 VanDerWaalsContact C-N 3.34Å; N277-F279 PolarHBondContact O-N 3.29Å; N277-S280 PolarHBondContact O-N 2.96Å; N277-S280 PolarHBondContact O-OG 3.46Å; N277-Q281 PolarHBondContact ND2-NE2 3.49Å; N277-Q281 PolarHBondContact O-N 2.99Å
278	D	95.2	Very high	90.1	Very high	36 Å²	36	47.6 Å²	47.6	19%	0.193	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-37.7	-178.8	-65.9	-10.7	0	0	0	111.3	F267 Q274 V275 Q281 W282	F267-D278 HydrophobicContact CB-CB 4.42Å; F267-D278 HydrophobicContact CD1-CB 3.96Å; F267-D278 HydrophobicContact CD2-CB 4.02Å; F267-D278 HydrophobicContact CE1-CB 4.13Å; F267-D278 HydrophobicContact CE2-CB 4.24Å; F267-D278 HydrophobicContact CG-CB 3.88Å; F267-D278 HydrophobicContact CZ-CB 4.27Å; Q274-D278 WeakPolarHBondContact O-CB 3.48Å; Q274-D278 VanDerWaalsContact O-CG 3.31Å; Q274-D278 PolarHBondContact O-N 2.91Å; V275-D278 PolarHBondContact O-N 3.42Å; D278-Q281 PolarHBondContact O-N 3.4Å; D278-W282 VanDerWaalsContact O-CB 3.32Å; D278-W282 WeakPolarHBondContact O-CB 3.4Å; D278-W282 PolarHBondContact O-N 2.82Å
279	F	96	Very high	89.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-46.3	174.7	-178.6	-125.5	0	0	0	112.3	V215 F267 V275 L276 N277 Q281 W282 K283 A295 M297 C322 V324	V215-F279 HydrophobicContact CB-CE2 3.88Å; V215-F279 HydrophobicContact CB-CZ 4.21Å; V215-F279 HydrophobicContact CG1-CE2 4.31Å; V215-F279 HydrophobicContact CG2-CE2 3.79Å; V215-F279 HydrophobicContact CG2-CZ 4.01Å; F267-F279 HydrophobicContact CE1-CB 4.49Å; F267-F279 HydrophobicContact CZ-CB 3.89Å; F267-F279 HydrophobicContact CZ-CD2 4.49Å; V275-F279 WeakPolarHBondContact O-CB 3.27Å; V275-F279 PolarHBondContact O-N 3.08Å; L276-F279 PolarHBondContact O-N 2.88Å; N277-F279 VanDerWaalsContact C-N 3.34Å; N277-F279 PolarHBondContact O-N 3.29Å; F279-Q281 VanDerWaalsContact C-N 3.28Å; F279-Q281 PolarHBondContact O-N 2.89Å; F279-W282 AromaticContact CD2-CE3 3.97Å; F279-W282 HydrophobicContact CD2-CE3 3.97Å; F279-W282 HydrophobicContact CD2-CZ3 4.36Å; F279-W282 AromaticContact CE2-CE3 3.95Å; F279-W282 HydrophobicContact CE2-CE3 3.95Å; F279-W282 AromaticContact CE2-CZ3 3.89Å; F279-W282 HydrophobicContact CE2-CZ3 3.89Å; F279-W282 PolarHBondContact O-N 3.11Å; F279-K283 VanDerWaalsContact O-CB 3.26Å; F279-K283 WeakPolarHBondContact O-CB 3.14Å; F279-K283 PolarHBondContact O-N 3.01Å; F279-A295 HydrophobicContact CE1-CB 4.39Å; F279-A295 HydrophobicContact CZ-CB 4.12Å; F279-M297 HydrophobicContact CB-SD 4.28Å; F279-M297 HydrophobicContact CD1-CB 3.94Å; F279-M297 HydrophobicContact CD2-CB 4.12Å; F279-M297 HydrophobicContact CD2-CG 4.36Å; F279-M297 HydrophobicContact CD2-SD 3.89Å; F279-M297 HydrophobicContact CE1-CB 3.79Å; F279-M297 HydrophobicContact CE2-CB 3.99Å; F279-M297 HydrophobicContact CE2-CG 4.37Å; F279-M297 HydrophobicContact CE2-SD 4.45Å; F279-M297 HydrophobicContact CG-CB 4.11Å; F279-M297 HydrophobicContact CG-SD 4.09Å; F279-M297 HydrophobicContact CZ-CB 3.83Å; F279-C322 HydrophobicContact CD1-CB 4.01Å; F279-C322 HydrophobicContact CE1-CB 3.81Å; F279-V324 HydrophobicContact CD1-CG2 4.36Å
280	S	94.1	Very high	88.7	Confident	4 Å²	4	52 Å²	52	3%	0.028	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-38.5	-180	73.8	0	0	0	0	112.7	L276 N277 P319 C322	L276-S280 WeakPolarHBondContact O-CB 3.24Å; L276-S280 PolarHBondContact O-N 3.29Å; N277-S280 PolarHBondContact O-N 2.96Å; N277-S280 PolarHBondContact O-OG 3.46Å; S280-P319 WeakPolarHBondContact O-CB 3.38Å; S280-C322 VanDerWaalsContact CB-SG 3.5Å
281	Q	91.9	Very high	88.4	Confident	109 Å²	109	54.7 Å²	54.7	51%	0.509	28%	0.28	S	S	.	.	H	α-helix	trans	-74.3	-45.8	177.3	-65.8	-178.9	18.5	0	0	111.8	N277 D278 F279 K283 Q284	N277-Q281 PolarHBondContact ND2-NE2 3.49Å; N277-Q281 PolarHBondContact O-N 2.99Å; D278-Q281 PolarHBondContact O-N 3.4Å; F279-Q281 VanDerWaalsContact C-N 3.28Å; F279-Q281 PolarHBondContact O-N 2.89Å; Q281-K283 VanDerWaalsContact C-N 3.3Å; Q281-K283 PolarHBondContact O-N 3.07Å; Q281-Q284 PolarHBondContact O-N 2.86Å
282	W	92.9	Very high	88.3	Confident	30 Å²	30	54.3 Å²	54.3	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-42.1	178.8	172.2	88.7	0	0	0	111.6	V215 E259 W261 F267 D278 F279 Q284 I285 S286 L287	V215-W282 HydrophobicContact CG1-CH2 4.26Å; V215-W282 HydrophobicContact CG1-CZ3 4.31Å; V215-W282 HydrophobicContact CG2-CH2 4.26Å; V215-W282 HydrophobicContact CG2-CZ3 3.98Å; E259-W282 WeakPolarHBondContact OE1-CH2 3.34Å; E259-W282 WeakPolarHBondContact OE1-CZ2 3.4Å; E259-W282 WeakPolarHBondContact OE2-CH2 3.48Å; W261-W282 HydrophobicContact CZ2-CD2 4.24Å; W261-W282 HydrophobicContact CZ2-CE3 4.46Å; W261-W282 HydrophobicContact CZ2-CH2 4.36Å; W261-W282 HydrophobicContact CZ2-CZ2 4.1Å; W261-W282 AromaticContact NE1-CZ2 3.92Å; F267-W282 HydrophobicContact CE1-CB 4.11Å; F267-W282 HydrophobicContact CE1-CG 4.37Å; D278-W282 VanDerWaalsContact O-CB 3.32Å; D278-W282 WeakPolarHBondContact O-CB 3.4Å; D278-W282 PolarHBondContact O-N 2.82Å; F279-W282 AromaticContact CD2-CE3 3.97Å; F279-W282 HydrophobicContact CD2-CE3 3.97Å; F279-W282 HydrophobicContact CD2-CZ3 4.36Å; F279-W282 AromaticContact CE2-CE3 3.95Å; F279-W282 HydrophobicContact CE2-CE3 3.95Å; F279-W282 AromaticContact CE2-CZ3 3.89Å; F279-W282 HydrophobicContact CE2-CZ3 3.89Å; F279-W282 PolarHBondContact O-N 3.11Å; W282-Q284 VanDerWaalsContact C-N 3.32Å; W282-Q284 PolarHBondContact O-N 2.84Å; W282-I285 PolarHBondContact O-N 3.14Å; W282-I285 VanDerWaalsContact O-N 3.12Å; W282-S286 VanDerWaalsContact CE2-CB 3.43Å; W282-S286 PolarHBondContact NE1-OG 2.86Å; W282-S286 PolarHBondContact O-N 3.35Å; W282-S286 PolarHBondContact O-OG 3.46Å; W282-L287 HydrophobicContact CH2-CD2 4.32Å; W282-L287 HydrophobicContact CH2-CG 4.27Å; W282-L287 HydrophobicContact CZ3-CD1 4.1Å; W282-L287 HydrophobicContact CZ3-CG 4.04Å
283	K	90.9	Very high	88.3	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.013	28%	0.275	C	S	.	.	H	α-helix	trans	-56.2	-43.4	-179.6	176.6	175.1	89.6	121.5	0	112.7	F279 Q281 I285 L287 H292 A295 D321 C322	F279-K283 VanDerWaalsContact O-CB 3.26Å; F279-K283 WeakPolarHBondContact O-CB 3.14Å; F279-K283 PolarHBondContact O-N 3.01Å; Q281-K283 VanDerWaalsContact C-N 3.3Å; Q281-K283 PolarHBondContact O-N 3.07Å; K283-I285 PolarHBondContact O-N 3.32Å; K283-I285 VanDerWaalsContact O-N 3.15Å; K283-L287 HydrophobicContact CD-CD1 4.33Å; K283-L287 HydrophobicContact CG-CB 4.12Å; K283-L287 HydrophobicContact CG-CD1 3.8Å; K283-L287 HydrophobicContact CG-CG 4.27Å; K283-L287 WeakPolarHBondContact O-CB 3.49Å; K283-L287 PolarHBondContact O-N 3.46Å; K283-H292 PolarHBondContact NZ-NE2 2.98Å; K283-H292 VanDerWaalsContact NZ-NE2 3.13Å; K283-A295 HydrophobicContact CD-CB 3.39Å; K283-A295 HydrophobicContact CG-CB 4.48Å; K283-D321 WeakPolarHBondContact CE-OD1 3.37Å; K283-D321 PolarHBondContact NZ-O 2.79Å; K283-D321 VanDerWaalsContact NZ-O 3.08Å; K283-D321 IonicContact NZ-OD1 2.67Å; K283-D321 PolarHBondContact NZ-OD1 2.78Å; K283-D321 IonicContact NZ-OD2 2.78Å; K283-D321 PolarHBondContact NZ-OD2 3.31Å; K283-C322 HydrophobicContact CD-CB 4.28Å
284	Q	83.9	Confident	88.4	Confident	100 Å²	100	51 Å²	51	47%	0.467	26%	0.259	S	S	.	.	H	α-helix	trans	-57.7	-31.2	-179.1	-80.2	-165.8	-16.9	0	0	113.2	Q281 W282 S288 P319	Q281-Q284 PolarHBondContact O-N 2.86Å; W282-Q284 VanDerWaalsContact C-N 3.32Å; W282-Q284 PolarHBondContact O-N 2.84Å; Q284-S288 WeakPolarHBondContact O-CB 3.42Å; Q284-P319 HydrophobicContact CG-CB 3.77Å; Q284-P319 VanDerWaalsContact NE2-CB 3.26Å; Q284-P319 VanDerWaalsContact NE2-N 3.19Å
285	I	82	Confident	88.6	Confident	131 Å²	131	47 Å²	47	67%	0.672	24%	0.24	S	C	*	.	H	α-helix	trans	-90.8	-57	-177.8	-59.4	169.1	0	0	0	109	W282 K283 S288	W282-I285 PolarHBondContact O-N 3.14Å; W282-I285 VanDerWaalsContact O-N 3.12Å; K283-I285 PolarHBondContact O-N 3.32Å; K283-I285 VanDerWaalsContact O-N 3.15Å; I285-S288 WeakPolarHBondContact O-CB 3.36Å; I285-S288 PolarHBondContact O-N 3.01Å; I285-S288 PolarHBondContact O-OG 2.95Å
286	S	82.4	Confident	88.7	Confident	53 Å²	53	47 Å²	47	37%	0.371	24%	0.24	S	C	.	.	H	α-helix	trans	-72.3	-35.8	-169.6	-57.2	0	0	0	0	113.4	W282	W282-S286 VanDerWaalsContact CE2-CB 3.43Å; W282-S286 PolarHBondContact NE1-OG 2.86Å; W282-S286 PolarHBondContact O-N 3.35Å; W282-S286 PolarHBondContact O-OG 3.46Å
287	L	84.3	Confident	88.8	Confident	5 Å²	5	47 Å²	47	3%	0.026	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	10.5	-179.9	-58.7	-177.5	0	0	0	112.9	V213 V215 W282 K283 Q289 L290 A295	V213-L287 HydrophobicContact CB-CD1 4.46Å; V213-L287 HydrophobicContact CG1-CD1 3.74Å; V213-L287 HydrophobicContact CG1-CD2 4.35Å; V215-L287 HydrophobicContact CG2-CD1 4.09Å; W282-L287 HydrophobicContact CH2-CD2 4.32Å; W282-L287 HydrophobicContact CH2-CG 4.27Å; W282-L287 HydrophobicContact CZ3-CD1 4.1Å; W282-L287 HydrophobicContact CZ3-CG 4.04Å; K283-L287 HydrophobicContact CD-CD1 4.33Å; K283-L287 HydrophobicContact CG-CB 4.12Å; K283-L287 HydrophobicContact CG-CD1 3.8Å; K283-L287 HydrophobicContact CG-CG 4.27Å; K283-L287 WeakPolarHBondContact O-CB 3.49Å; K283-L287 PolarHBondContact O-N 3.46Å; L287-Q289 PolarHBondContact O-N 3.45Å; L287-Q289 VanDerWaalsContact O-N 3.14Å; L287-L290 PolarHBondContact O-N 3.24Å; L287-L290 VanDerWaalsContact O-O 3.14Å; L287-A295 HydrophobicContact CD1-CB 4.36Å
288	S	78	Confident	89	Confident	75 Å²	75	44.2 Å²	44.2	52%	0.524	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.6	-178.7	59.5	0	0	0	0	114.5	Q284 I285	Q284-S288 WeakPolarHBondContact O-CB 3.42Å; I285-S288 WeakPolarHBondContact O-CB 3.36Å; I285-S288 PolarHBondContact O-N 3.01Å; I285-S288 PolarHBondContact O-OG 2.95Å
289	Q	71.3	Confident	89	Confident	175 Å²	175	42.5 Å²	42.5	82%	0.818	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-12.2	179.8	-58.7	-57.7	-53	0	0	113.1	L287	L287-Q289 PolarHBondContact O-N 3.45Å; L287-Q289 VanDerWaalsContact O-N 3.14Å
290	L	79.3	Confident	88.9	Confident	29 Å²	29	44.6 Å²	44.6	15%	0.152	23%	0.225	C	C	.	.	S	Bend	trans	-103.5	117.5	-177.9	-172.3	64.3	0	0	0	109.2	P88 F90 V213 L287 H292	P88-L290 HydrophobicContact CG-CD1 3.83Å; F90-L290 HydrophobicContact CE2-CD2 4.3Å; V213-L290 HydrophobicContact CB-CD2 4.33Å; V213-L290 HydrophobicContact CG1-CD2 3.93Å; V213-L290 HydrophobicContact CG2-CD2 3.39Å; V213-L290 HydrophobicContact CG2-CG 4.05Å; L287-L290 PolarHBondContact O-N 3.24Å; L287-L290 VanDerWaalsContact O-O 3.14Å; L290-H292 PolarHBondContact O-N 3.17Å; L290-H292 PolarHBondContact O-ND1 2.73Å
291	Q	82.1	Confident	88.7	Confident	136 Å²	136	45.4 Å²	45.4	64%	0.636	23%	0.229	S	C	*	.			trans	-68.7	124.5	175.5	-170.8	-179.4	-25.1	0	0	109.9	E211	E211-Q291 PolarHBondContact OE2-NE2 3Å
292	H	88.4	Confident	88.3	Confident	35 Å²	35	45.1 Å²	45.1	16%	0.162	24%	0.239	C	C	.	.			trans	-156.5	155.9	179.3	64.6	-80.4	0	0	0	111	V213 K283 L290	V213-H292 HydrophobicContact CB-CB 4.39Å; V213-H292 HydrophobicContact CG2-CB 3.46Å; V213-H292 VanDerWaalsContact CG2-CB 3.46Å; K283-H292 PolarHBondContact NZ-NE2 2.98Å; K283-H292 VanDerWaalsContact NZ-NE2 3.13Å; L290-H292 PolarHBondContact O-N 3.17Å; L290-H292 PolarHBondContact O-ND1 2.73Å
293	D	91.8	Very high	87.9	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	27%	0.273	C	S	.	.	S	Bend	trans	-99.1	-30.9	177.8	-60.6	-38.6	0	0	0	112.1	E211 I315 C393 L394	E211-D293 HydrophobicContact CB-CB 4.38Å; E211-D293 WeakPolarHBondContact CB-OD2 3.24Å; E211-D293 PolarHBondContact N-OD2 2.69Å; E211-D293 PolarHBondContact O-N 3.25Å; D293-I315 HydrophobicContact CB-CD1 4.29Å; D293-I315 WeakPolarHBondContact O-CD1 3.39Å; D293-C393 VanDerWaalsContact OD1-CB 3.22Å; D293-C393 WeakPolarHBondContact OD1-CB 3.28Å; D293-C393 PolarHBondContact OD1-SG 2.8Å; D293-C393 VanDerWaalsContact OD1-SG 3.32Å; D293-L394 HydrophobicContact CB-CD2 4.06Å
294	A	94.6	Very high	87.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155	177.6	0	0	0	0	0	110.8	L210 E211 L212 V213 I315 D321 L343 I346	L210-A294 HydrophobicContact CD2-CB 4.21Å; E211-A294 PolarHBondContact O-N 3.29Å; L212-A294 WeakPolarHBondContact CA-O 3.27Å; L212-A294 HydrophobicContact CD1-CB 4.39Å; V213-A294 PolarHBondContact N-O 2.98Å; A294-I315 HydrophobicContact CB-CD1 4.09Å; A294-D321 WeakPolarHBondContact CA-O 3.1Å; A294-L343 HydrophobicContact CB-CD1 4.22Å; A294-I346 HydrophobicContact CB-CD1 4.47Å; A294-I346 HydrophobicContact CB-CG2 4.41Å
295	A	96.2	Very high	87.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.6	171.2	0	0	0	0	0	112.4	V213 F279 K283 L287 D321 C322 G323	V213-A295 HydrophobicContact CB-CB 4.27Å; V213-A295 CarbonylContact O-C 3.59Å; V213-A295 VanDerWaalsContact O-CA 3.25Å; V213-A295 WeakPolarHBondContact O-CA 3.46Å; F279-A295 HydrophobicContact CE1-CB 4.39Å; F279-A295 HydrophobicContact CZ-CB 4.12Å; K283-A295 HydrophobicContact CD-CB 3.39Å; K283-A295 HydrophobicContact CG-CB 4.48Å; L287-A295 HydrophobicContact CD1-CB 4.36Å; A295-D321 PolarHBondContact N-O 3.47Å; A295-D321 VanDerWaalsContact N-O 3.09Å; A295-C322 WeakPolarHBondContact O-CA 3.35Å; A295-C322 VanDerWaalsContact O-CB 3.24Å; A295-C322 WeakPolarHBondContact O-CB 3.42Å; A295-G323 PolarHBondContact O-N 3.43Å; A295-G323 VanDerWaalsContact O-N 3.11Å
296	H	97.7	Very high	87.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.8	177.6	-85.7	-119.6	0	0	0	110.9	L212 V213 V214 V215 F298 G323 D325 L343 I346	L212-H296 HydrophobicContact CD1-CB 4.3Å; V213-H296 PolarHBondContact O-N 2.99Å; V214-H296 WeakPolarHBondContact CA-O 3.38Å; V215-H296 PolarHBondContact N-O 3.16Å; H296-F298 HydrophobicContact CB-CD1 4.48Å; H296-F298 HydrophobicContact CB-CE1 4.03Å; H296-G323 CarbonylContact C-O 3.55Å; H296-G323 WeakPolarHBondContact CA-O 3.32Å; H296-D325 IonicContact CE1-OD2 2.65Å; H296-D325 IonicContact CG-OD2 2.72Å; H296-D325 IonicContact ND1-OD1 3.52Å; H296-D325 IonicContact ND1-OD2 3.05Å; H296-D325 PolarHBondContact ND1-OD2 2.99Å; H296-L343 PolarHBondContact CE1-N 2.02Å; H296-L343 VanDerWaalsContact CE1-N 3.33Å; H296-L343 WeakPolarHBondContact NE2-CD1 3.48Å; H296-I346 WeakPolarHBondContact NE2-CD1 3.01Å
297	M	97.7	Very high	88.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116	174.4	-169.3	178.8	-173.5	0	0	110.6	V215 N217 W261 F267 M269 V275 F279 I299 G323 V324 D325	V215-M297 HydrophobicContact CB-CG 4.47Å; V215-M297 CarbonylContact O-C 3.39Å; V215-M297 VanDerWaalsContact O-CA 3.25Å; V215-M297 WeakPolarHBondContact O-CA 3.34Å; N217-M297 HydrophobicContact CB-CE 3.82Å; W261-M297 HydrophobicContact CE3-CE 3.83Å; W261-M297 HydrophobicContact CH2-CE 3.43Å; W261-M297 VanDerWaalsContact CH2-CE 3.43Å; W261-M297 HydrophobicContact CH2-SD 4.48Å; W261-M297 HydrophobicContact CZ2-CE 4.22Å; W261-M297 HydrophobicContact CZ3-CE 3.23Å; F267-M297 HydrophobicContact CE2-CE 4.22Å; F267-M297 HydrophobicContact CE2-SD 4.27Å; F267-M297 HydrophobicContact CZ-CE 4.12Å; F267-M297 HydrophobicContact CZ-SD 3.96Å; M269-M297 HydrophobicContact CE-CE 3.62Å; V275-M297 HydrophobicContact CG1-SD 4.1Å; F279-M297 HydrophobicContact CB-SD 4.28Å; F279-M297 HydrophobicContact CD1-CB 3.94Å; F279-M297 HydrophobicContact CD2-CB 4.12Å; F279-M297 HydrophobicContact CD2-CG 4.36Å; F279-M297 HydrophobicContact CD2-SD 3.89Å; F279-M297 HydrophobicContact CE1-CB 3.79Å; F279-M297 HydrophobicContact CE2-CB 3.99Å; F279-M297 HydrophobicContact CE2-CG 4.37Å; F279-M297 HydrophobicContact CE2-SD 4.45Å; F279-M297 HydrophobicContact CG-CB 4.11Å; F279-M297 HydrophobicContact CG-SD 4.09Å; F279-M297 HydrophobicContact CZ-CB 3.83Å; M297-I299 HydrophobicContact CE-CG2 3.96Å; M297-I299 HydrophobicContact CG-CG2 3.74Å; M297-I299 HydrophobicContact SD-CG2 3.92Å; M297-G323 PolarHBondContact N-O 3.44Å; M297-V324 HydrophobicContact CB-CG1 4.48Å; M297-V324 HydrophobicContact CB-CG2 4.23Å; M297-V324 WeakPolarHBondContact O-CA 2.97Å; M297-D325 PolarHBondContact O-N 3.33Å
298	F	97.7	Very high	88.5	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.3	173.5	-65.6	-1.2	0	0	0	109.1	V214 V215 V216 N217 V235 V238 H296 D325 F335 V339	V214-F298 HydrophobicContact CG1-CD1 4.15Å; V214-F298 HydrophobicContact CG1-CD2 3.58Å; V214-F298 HydrophobicContact CG1-CE1 4.19Å; V214-F298 HydrophobicContact CG1-CE2 3.65Å; V214-F298 HydrophobicContact CG1-CG 3.84Å; V214-F298 HydrophobicContact CG1-CZ 3.95Å; V214-F298 HydrophobicContact CG2-CE2 4.4Å; V214-F298 HydrophobicContact CG2-CZ 4.1Å; V215-F298 PolarHBondContact O-N 2.76Å; V216-F298 HydrophobicContact CG2-CB 4.44Å; N217-F298 PolarHBondContact N-O 3.35Å; V235-F298 HydrophobicContact CG1-CE2 4.46Å; V235-F298 HydrophobicContact CG2-CD2 4.1Å; V235-F298 HydrophobicContact CG2-CE2 4.23Å; V238-F298 HydrophobicContact CB-CE2 4.37Å; V238-F298 HydrophobicContact CG1-CE2 4.04Å; V238-F298 HydrophobicContact CG1-CZ 3.94Å; H296-F298 HydrophobicContact CB-CD1 4.48Å; H296-F298 HydrophobicContact CB-CE1 4.03Å; F298-D325 HydrophobicContact CD1-CB 4.02Å; F298-D325 HydrophobicContact CE1-CB 4.39Å; F298-F335 HydrophobicContact CB-CZ 4.12Å; F298-F335 HydrophobicContact CD1-CE1 4.35Å; F298-F335 AromaticContact CD1-CZ 3.94Å; F298-F335 HydrophobicContact CD1-CZ 3.94Å; F298-F335 AromaticContact CD2-CE1 3.8Å; F298-F335 HydrophobicContact CD2-CE1 3.8Å; F298-F335 HydrophobicContact CD2-CZ 4.1Å; F298-F335 HydrophobicContact CE1-CZ 4.41Å; F298-F335 HydrophobicContact CE2-CE1 4.01Å; F298-F335 AromaticContact CG-CE1 4Å; F298-F335 HydrophobicContact CG-CE1 4Å; F298-F335 AromaticContact CG-CZ 3.79Å; F298-F335 HydrophobicContact CG-CZ 3.79Å; F298-F335 HydrophobicContact CZ-CE1 4.39Å; F298-V339 HydrophobicContact CD1-CG2 4.32Å; F298-V339 HydrophobicContact CE1-CB 4.43Å; F298-V339 HydrophobicContact CE1-CG1 3.96Å; F298-V339 HydrophobicContact CE1-CG2 3.51Å; F298-V339 HydrophobicContact CZ-CG1 4.06Å; F298-V339 HydrophobicContact CZ-CG2 3.73Å
299	I	96	Very high	89.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	155.3	-179.9	72.5	172.8	0	0	0	110.6	N217 M297 I304 V324 D325 N326 F327	N217-I299 HydrophobicContact CB-CB 4.34Å; N217-I299 HydrophobicContact CB-CG2 4.05Å; N217-I299 WeakPolarHBondContact OD1-CA 3.09Å; M297-I299 HydrophobicContact CE-CG2 3.96Å; M297-I299 HydrophobicContact CG-CG2 3.74Å; M297-I299 HydrophobicContact SD-CG2 3.92Å; I299-I304 HydrophobicContact CD1-CD1 4.17Å; I299-V324 HydrophobicContact CD1-CG1 3.78Å; I299-V324 HydrophobicContact CG1-CG1 4.13Å; I299-V324 HydrophobicContact CG2-CG1 3.97Å; I299-D325 PolarHBondContact N-O 3.25Å; I299-N326 HydrophobicContact CD1-CB 4.01Å; I299-N326 HydrophobicContact CG1-CB 3.73Å; I299-N326 WeakPolarHBondContact O-CA 3.44Å; I299-F327 PolarHBondContact O-N 2.95Å
300	K	93.4	Very high	90.5	Very high	43 Å²	43	32.4 Å²	32.4	19%	0.187	18%	0.18	C	C	.	.			trans	-123.2	110.1	162.8	-177.3	169.9	-170.1	66.1	0	110	N217 D219 F220 Y223 F327	N217-K300 PolarHBondContact OD1-N 3.43Å; D219-K300 HydrophobicContact CB-CB 4.37Å; D219-K300 WeakPolarHBondContact CB-O 3.21Å; F220-K300 HydrophobicContact CB-CB 3.98Å; F220-K300 HydrophobicContact CD2-CB 4.2Å; F220-K300 HydrophobicContact CG-CB 4.49Å; Y223-K300 VanDerWaalsContact CB-CD 3.46Å; Y223-K300 HydrophobicContact CD1-CD 4.31Å; Y223-K300 HydrophobicContact CD2-CD 3.72Å; Y223-K300 HydrophobicContact CG-CD 3.55Å; K300-F327 HydrophobicContact CD-CD1 4.45Å; K300-F327 PolarHBondContact NZ-O 3.33Å; K300-F327 VanDerWaalsContact NZ-O 3.11Å
301	N	90.1	Very high	91.2	Very high	22 Å²	22	32.1 Å²	32.1	12%	0.118	18%	0.176	C	C	.	.			trans	-146.8	110	173.9	-169.4	-20.4	0	0	0	111	M269 L303 I304 N326	M269-N301 PolarHBondContact O-ND2 3.48Å; N301-L303 PolarHBondContact O-N 3.15Å; N301-L303 VanDerWaalsContact OD1-CB 3.31Å; N301-L303 WeakPolarHBondContact OD1-CB 3.25Å; N301-L303 PolarHBondContact OD1-N 3.19Å; N301-I304 HydrophobicContact CB-CB 4.44Å; N301-I304 HydrophobicContact CB-CD1 4.08Å; N301-I304 HydrophobicContact CB-CG1 4.2Å; N301-I304 PolarHBondContact O-N 3.29Å; N301-N326 PolarHBondContact N-OD1 2.96Å; N301-N326 PolarHBondContact O-ND2 3.12Å; N301-N326 VanDerWaalsContact O-ND2 3.12Å; N301-N326 PolarHBondContact O-OD1 2.72Å
302	S	84.1	Confident	91.6	Very high	103 Å²	103	27.1 Å²	27.1	72%	0.72	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.6	-179.8	53.5	0	0	0	0	113.9
303	L	84.7	Confident	91.7	Very high	156 Å²	156	26.5 Å²	26.5	82%	0.817	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-23.7	175.7	-58	176.1	0	0	0	112.1	N301	N301-L303 PolarHBondContact O-N 3.15Å; N301-L303 VanDerWaalsContact OD1-CB 3.31Å; N301-L303 WeakPolarHBondContact OD1-CB 3.25Å; N301-L303 PolarHBondContact OD1-N 3.19Å
304	I	83.8	Confident	91.5	Very high	12 Å²	12	26.2 Å²	26.2	6%	0.062	15%	0.153	C	C	.	.			trans	-88.4	113.1	175.8	-61.6	177.2	0	0	0	107.1	I272 I299 N301 I306 N326 Q328	I272-I304 HydrophobicContact CB-CG2 4.04Å; I299-I304 HydrophobicContact CD1-CD1 4.17Å; N301-I304 HydrophobicContact CB-CB 4.44Å; N301-I304 HydrophobicContact CB-CD1 4.08Å; N301-I304 HydrophobicContact CB-CG1 4.2Å; N301-I304 PolarHBondContact O-N 3.29Å; I304-I306 HydrophobicContact CG2-CB 4.2Å; I304-N326 PolarHBondContact O-ND2 2.92Å; I304-Q328 PolarHBondContact O-NE2 3.19Å
305	S	82.9	Confident	91.4	Very high	93 Å²	93	26.2 Å²	26.2	65%	0.65	15%	0.153	S	C	*	.			trans	-83.4	-14.3	179.4	54	0	0	0	0	113.7
306	I	86.7	Confident	90.9	Very high	39 Å²	39	27.7 Å²	27.7	20%	0.2	16%	0.163	C	C	.	.			trans	-76.5	136.3	175	-61.7	170.4	0	0	0	109.1	I272 I304 G308 N326	I272-I306 HydrophobicContact CD1-CB 4.18Å; I272-I306 HydrophobicContact CD1-CG2 3.71Å; I272-I306 HydrophobicContact CG2-CB 4.02Å; I272-I306 HydrophobicContact CG2-CD1 3.61Å; I272-I306 HydrophobicContact CG2-CG1 4.41Å; I272-I306 HydrophobicContact CG2-CG2 3.91Å; I304-I306 HydrophobicContact CG2-CB 4.2Å; I306-G308 VanDerWaalsContact CG2-O 3.29Å; I306-G308 WeakPolarHBondContact CG2-O 3.33Å; I306-N326 PolarHBondContact O-ND2 3.32Å
307	L	89.6	Confident	90.4	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	18%	0.176	C	C	.	.			trans	-82.7	-33.2	-177	-68.4	176.3	0	0	0	113.6	M171 R172 N326 Q328 T338 R369	M171-L307 HydrophobicContact CB-CD1 3.54Å; M171-L307 HydrophobicContact CB-CD2 4.03Å; M171-L307 HydrophobicContact CB-CG 3.7Å; M171-L307 HydrophobicContact CG-CD2 4.48Å; M171-L307 HydrophobicContact SD-CD2 3.76Å; M171-L307 HydrophobicContact SD-CG 4.47Å; R172-L307 PolarHBondContact O-N 3.49Å; L307-N326 WeakPolarHBondContact O-CA 3.41Å; L307-N326 WeakPolarHBondContact O-CB 3.4Å; L307-N326 PolarHBondContact O-N 3.5Å; L307-Q328 HydrophobicContact CD2-CG 3.59Å; L307-T338 HydrophobicContact CB-CG2 4.01Å; L307-T338 VanDerWaalsContact O-CG2 3.31Å; L307-T338 WeakPolarHBondContact O-CG2 3.17Å; L307-R369 HydrophobicContact CD1-CB 3.43Å; L307-R369 VanDerWaalsContact CD1-CB 3.43Å; L307-R369 HydrophobicContact CD1-CG 4.17Å
308	G	93.1	Very high	89.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	159.3	-177	0	0	0	0	0	111.7	G174 I306 V324 E342	G174-G308 PolarHBondContact N-O 2.89Å; I306-G308 VanDerWaalsContact CG2-O 3.29Å; I306-G308 WeakPolarHBondContact CG2-O 3.33Å; G308-V324 CarbonylContact C-O 3.52Å; G308-V324 WeakPolarHBondContact CA-O 3.44Å; G308-E342 WeakPolarHBondContact CA-OE1 3.25Å
309	L	95.4	Very high	89.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	130.2	169.8	-175.5	70.5	0	0	0	110	G174 L175 E179 I272 E273 L276 G323 V324 E342	G174-L309 VanDerWaalsContact C-CD1 3.44Å; L175-L309 HydrophobicContact CB-CD1 4.1Å; L175-L309 HydrophobicContact CD1-CD1 4.24Å; E179-L309 HydrophobicContact CG-CD1 4.44Å; I272-L309 HydrophobicContact CD1-CB 4.04Å; I272-L309 HydrophobicContact CG1-CB 4.06Å; I272-L309 HydrophobicContact CG2-CB 4.23Å; I272-L309 HydrophobicContact CG2-CD2 4.21Å; E273-L309 HydrophobicContact CB-CD2 4.28Å; E273-L309 HydrophobicContact CG-CD2 3.99Å; L276-L309 HydrophobicContact CB-CD2 4.31Å; L276-L309 HydrophobicContact CD2-CB 4.39Å; L276-L309 HydrophobicContact CD2-CD2 3.72Å; L276-L309 HydrophobicContact CD2-CG 3.67Å; L309-G323 WeakPolarHBondContact O-CA 3.48Å; L309-V324 PolarHBondContact N-O 2.79Å; L309-V324 PolarHBondContact O-N 2.99Å; L309-E342 WeakPolarHBondContact CA-OE2 3.43Å; L309-E342 PolarHBondContact N-OE2 3.14Å
310	A	95.7	Very high	89.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	164.5	172.3	0	0	0	0	0	112.3	E342 H345 I346	A310-E342 HydrophobicContact CB-CB 4.07Å; A310-E342 VanDerWaalsContact CB-O 3.31Å; A310-E342 WeakPolarHBondContact CB-O 3.34Å; A310-E342 PolarHBondContact N-OE2 3.25Å; A310-H345 HydrophobicContact CB-CB 4.14Å; A310-I346 HydrophobicContact CB-CD1 4.44Å; A310-I346 HydrophobicContact CB-CG1 3.87Å
311	Y	93.4	Very high	89.1	Confident	22 Å²	22	37.5 Å²	37.5	9%	0.086	22%	0.219	C	C	.	.			trans	-78.2	137.6	169.8	-69.4	-78.5	0	0	0	110.8	Q183 L276 I320 C322 H345 I346	Q183-Y311 HydrophobicContact CG-CD1 4.11Å; Q183-Y311 HydrophobicContact CG-CE1 4.48Å; L276-Y311 HydrophobicContact CD1-CD2 3.99Å; L276-Y311 HydrophobicContact CD1-CE2 3.8Å; L276-Y311 HydrophobicContact CD2-CD2 4.01Å; L276-Y311 HydrophobicContact CD2-CE2 3.83Å; L276-Y311 HydrophobicContact CD2-CG 4.45Å; L276-Y311 HydrophobicContact CG-CD2 4.11Å; L276-Y311 HydrophobicContact CG-CE2 3.6Å; Y311-I320 VanDerWaalsContact CB-O 3.25Å; Y311-I320 WeakPolarHBondContact CB-O 3.14Å; Y311-I320 HydrophobicContact CD1-CB 4.21Å; Y311-I320 HydrophobicContact CD1-CG2 4.02Å; Y311-I320 HydrophobicContact CD2-CB 3.93Å; Y311-I320 HydrophobicContact CD2-CG2 4.16Å; Y311-I320 HydrophobicContact CE1-CG2 4.11Å; Y311-I320 HydrophobicContact CE2-CB 4.48Å; Y311-I320 HydrophobicContact CE2-CG2 4.25Å; Y311-I320 HydrophobicContact CG-CB 3.78Å; Y311-I320 HydrophobicContact CG-CG2 4.04Å; Y311-C322 PolarHBondContact N-O 3.36Å; Y311-H345 CarbonylContact O-C 3.26Å; Y311-I346 WeakPolarHBondContact O-CA 3.41Å; Y311-I346 PolarHBondContact O-N 2.94Å
312	I	91.1	Very high	89.4	Confident	32 Å²	32	36.4 Å²	36.4	16%	0.164	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	135.7	177.7	-52.4	174.8	0	0	0	110.6	L175 V180 G314 H345	L175-I312 HydrophobicContact CD1-CD1 4.09Å; L175-I312 HydrophobicContact CD1-CG1 4.05Å; L175-I312 HydrophobicContact CD2-CD1 3.61Å; L175-I312 HydrophobicContact CD2-CG1 3.74Å; L175-I312 HydrophobicContact CG-CD1 4.29Å; V180-I312 HydrophobicContact CB-CD1 4.34Å; V180-I312 HydrophobicContact CG1-CD1 3.95Å; V180-I312 HydrophobicContact CG2-CD1 3.78Å; I312-G314 PolarHBondContact O-N 3.34Å; I312-G314 VanDerWaalsContact O-N 3.15Å; I312-H345 CarbonylContact C-O 3.53Å; I312-H345 VanDerWaalsContact CA-O 3.24Å; I312-H345 WeakPolarHBondContact CA-O 3.43Å
313	A	89.3	Confident	90	Very high	22 Å²	22	31.5 Å²	31.5	18%	0.182	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	36	177.4	0	0	0	0	0	112.1	I315 H345 I346 T386 Q390	A313-I315 VanDerWaalsContact C-N 3.33Å; A313-H345 PolarHBondContact N-O 2.94Å; A313-I346 CarbonylContact C-O 3.59Å; A313-I346 WeakPolarHBondContact CA-O 3.36Å; A313-T386 HydrophobicContact CB-CG2 3.81Å; A313-Q390 PolarHBondContact O-NE2 3.34Å
314	G	89.4	Confident	90.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.14	C	C	.	.			trans	-79.7	-13.1	178.2	0	0	0	0	0	113.8	I312 C316 R317 I320 D321 I346	I312-G314 PolarHBondContact O-N 3.34Å; I312-G314 VanDerWaalsContact O-N 3.15Å; G314-C316 PolarHBondContact O-N 3.36Å; G314-R317 WeakPolarHBondContact O-CB 3.09Å; G314-R317 PolarHBondContact O-N 3.42Å; G314-I320 WeakPolarHBondContact CA-O 3.31Å; G314-D321 WeakPolarHBondContact O-CA 3.21Å; G314-D321 VanDerWaalsContact O-CB 3.26Å; G314-D321 WeakPolarHBondContact O-CB 3.42Å; G314-D321 PolarHBondContact O-N 2.85Å; G314-I346 PolarHBondContact N-O 3.35Å; G314-I346 VanDerWaalsContact N-O 3.07Å
315	I	91.7	Very high	91.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	136.9	-173.2	-164.2	67.4	0	0	0	112.8	D293 A294 A313 R317 I346 L347 T386 Q390 L394	D293-I315 HydrophobicContact CB-CD1 4.29Å; D293-I315 WeakPolarHBondContact O-CD1 3.39Å; A294-I315 HydrophobicContact CB-CD1 4.09Å; A313-I315 VanDerWaalsContact C-N 3.33Å; I315-R317 PolarHBondContact O-N 3.17Å; I315-I346 HydrophobicContact CB-CG2 4Å; I315-I346 WeakPolarHBondContact CB-O 3.37Å; I315-I346 HydrophobicContact CD1-CG2 4.02Å; I315-I346 PolarHBondContact N-O 2.91Å; I315-L347 HydrophobicContact CB-CD2 4.2Å; I315-L347 HydrophobicContact CD1-CD2 4.1Å; I315-L347 HydrophobicContact CG1-CD2 3.88Å; I315-L347 HydrophobicContact CG2-CD2 4.43Å; I315-T386 HydrophobicContact CG2-CG2 3.98Å; I315-Q390 PolarHBondContact O-NE2 2.79Å; I315-L394 HydrophobicContact CD1-CD1 4.47Å; I315-L394 HydrophobicContact CD1-CD2 4.16Å; I315-L394 HydrophobicContact CG1-CD1 3.79Å; I315-L394 HydrophobicContact CG1-CD2 4.25Å; I315-L394 HydrophobicContact CG1-CG 4.12Å
316	C	85.9	Confident	91.8	Very high	32 Å²	32	19.1 Å²	19.1	22%	0.216	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	15.6	-175.9	-44.2	0	0	0	0	115	G314 Q390 C393	G314-C316 PolarHBondContact O-N 3.36Å; C316-Q390 WeakPolarHBondContact CB-O 3.27Å; C316-C393 VanDerWaalsContact CA-SG 3.52Å; C316-C393 HydrophobicContact CB-CB 3.84Å; C316-C393 WeakPolarHBondContact CB-SG 3.28Å; C316-C393 WeakPolarHBondContact SG-CB 3.25Å; C316-C393 PolarHBondContact SG-N 3.13Å; C316-C393 CovalentContact SG-SG 2.02Å; C316-C393 PolarHBondContact SG-SG 3.22Å
317	R	87	Confident	92.1	Very high	72 Å²	72	17.3 Å²	17.3	27%	0.272	10%	0.097	S	C	.	.			trans	-127.2	83.8	-178.4	-67.3	-177.9	173.3	158.2	-3.8	111.6	G314 I315 I320 D321 Q390	G314-R317 WeakPolarHBondContact O-CB 3.09Å; G314-R317 PolarHBondContact O-N 3.42Å; I315-R317 PolarHBondContact O-N 3.17Å; R317-I320 HydrophobicContact CB-CD1 4.41Å; R317-I320 HydrophobicContact CB-CG1 4.06Å; R317-I320 WeakPolarHBondContact O-CG1 3.4Å; R317-I320 PolarHBondContact O-N 2.8Å; R317-D321 PolarHBondContact O-N 2.8Å; R317-Q390 VanDerWaalsContact NH1-NE2 3.19Å; R317-Q390 VanDerWaalsContact NH2-OE1 3.1Å
318	P	84.6	Confident	92	Very high	89 Å²	89	19.3 Å²	19.3	58%	0.578	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	138.8	170.2	25.3	-33.1	0	0	0	111.2	D321	P318-D321 WeakPolarHBondContact CA-OD1 3.38Å
319	P	88.5	Confident	91.4	Very high	43 Å²	43	20.2 Å²	20.2	28%	0.279	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.6	-4.3	6.3	30.1	-28.4	0	0	0	115.9	S280 Q284 D321 C322	S280-P319 WeakPolarHBondContact O-CB 3.38Å; Q284-P319 HydrophobicContact CG-CB 3.77Å; Q284-P319 VanDerWaalsContact NE2-CB 3.26Å; Q284-P319 VanDerWaalsContact NE2-N 3.19Å; P319-D321 VanDerWaalsContact C-N 3.31Å; P319-D321 PolarHBondContact O-N 2.8Å; P319-C322 PolarHBondContact O-SG 3.31Å; P319-C322 VanDerWaalsContact O-SG 3.32Å
320	I	90.8	Very high	90.7	Very high	39 Å²	39	21.6 Å²	21.6	20%	0.2	12%	0.123	C	C	.	.	S	Bend	trans	-87.2	4.8	-165.2	61	166.3	0	0	0	113.8	F187 Y311 G314 R317 C322	F187-I320 HydrophobicContact CD2-CD1 4.42Å; Y311-I320 VanDerWaalsContact CB-O 3.25Å; Y311-I320 WeakPolarHBondContact CB-O 3.14Å; Y311-I320 HydrophobicContact CD1-CB 4.21Å; Y311-I320 HydrophobicContact CD1-CG2 4.02Å; Y311-I320 HydrophobicContact CD2-CB 3.93Å; Y311-I320 HydrophobicContact CD2-CG2 4.16Å; Y311-I320 HydrophobicContact CE1-CG2 4.11Å; Y311-I320 HydrophobicContact CE2-CB 4.48Å; Y311-I320 HydrophobicContact CE2-CG2 4.25Å; Y311-I320 HydrophobicContact CG-CB 3.78Å; Y311-I320 HydrophobicContact CG-CG2 4.04Å; G314-I320 WeakPolarHBondContact CA-O 3.31Å; R317-I320 HydrophobicContact CB-CD1 4.41Å; R317-I320 HydrophobicContact CB-CG1 4.06Å; R317-I320 WeakPolarHBondContact O-CG1 3.4Å; R317-I320 PolarHBondContact O-N 2.8Å; I320-C322 PolarHBondContact O-N 3.18Å
321	D	93.2	Very high	90.3	Very high	6 Å²	6	22.6 Å²	22.6	3%	0.032	13%	0.129	C	C	.	.	S	Bend	trans	-78.3	51.3	171.1	58.6	-29.6	0	0	0	111.6	K283 A294 A295 G314 R317 P318 P319	K283-D321 WeakPolarHBondContact CE-OD1 3.37Å; K283-D321 PolarHBondContact NZ-O 2.79Å; K283-D321 VanDerWaalsContact NZ-O 3.08Å; K283-D321 IonicContact NZ-OD1 2.67Å; K283-D321 PolarHBondContact NZ-OD1 2.78Å; K283-D321 IonicContact NZ-OD2 2.78Å; K283-D321 PolarHBondContact NZ-OD2 3.31Å; A294-D321 WeakPolarHBondContact CA-O 3.1Å; A295-D321 PolarHBondContact N-O 3.47Å; A295-D321 VanDerWaalsContact N-O 3.09Å; G314-D321 WeakPolarHBondContact O-CA 3.21Å; G314-D321 VanDerWaalsContact O-CB 3.26Å; G314-D321 WeakPolarHBondContact O-CB 3.42Å; G314-D321 PolarHBondContact O-N 2.85Å; R317-D321 PolarHBondContact O-N 2.8Å; P318-D321 WeakPolarHBondContact CA-OD1 3.38Å; P319-D321 VanDerWaalsContact C-N 3.31Å; P319-D321 PolarHBondContact O-N 2.8Å
322	C	95.8	Very high	90	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	160.8	-179.1	63	0	0	0	0	115.7	F279 S280 K283 A295 Y311 P319 I320	F279-C322 HydrophobicContact CD1-CB 4.01Å; F279-C322 HydrophobicContact CE1-CB 3.81Å; S280-C322 VanDerWaalsContact CB-SG 3.5Å; K283-C322 HydrophobicContact CD-CB 4.28Å; A295-C322 WeakPolarHBondContact O-CA 3.35Å; A295-C322 VanDerWaalsContact O-CB 3.24Å; A295-C322 WeakPolarHBondContact O-CB 3.42Å; Y311-C322 PolarHBondContact N-O 3.36Å; P319-C322 PolarHBondContact O-SG 3.31Å; P319-C322 VanDerWaalsContact O-SG 3.32Å; I320-C322 PolarHBondContact O-N 3.18Å
323	G	96.8	Very high	89.9	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	163.2	178.9	0	0	0	0	0	112.6	A295 H296 M297 L309	A295-G323 PolarHBondContact O-N 3.43Å; A295-G323 VanDerWaalsContact O-N 3.11Å; H296-G323 CarbonylContact C-O 3.55Å; H296-G323 WeakPolarHBondContact CA-O 3.32Å; M297-G323 PolarHBondContact N-O 3.44Å; L309-G323 WeakPolarHBondContact O-CA 3.48Å
324	V	97.6	Very high	89.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.7	179	-179.2	0	0	0	0	109	I272 V275 L276 F279 M297 I299 G308 L309	I272-V324 HydrophobicContact CG1-CB 4.4Å; I272-V324 HydrophobicContact CG1-CG1 4.18Å; V275-V324 HydrophobicContact CG1-CG1 3.81Å; V275-V324 HydrophobicContact CG1-CG2 4Å; L276-V324 HydrophobicContact CB-CG2 3.96Å; L276-V324 HydrophobicContact CD1-CG2 3.97Å; F279-V324 HydrophobicContact CD1-CG2 4.36Å; M297-V324 HydrophobicContact CB-CG1 4.48Å; M297-V324 HydrophobicContact CB-CG2 4.23Å; M297-V324 WeakPolarHBondContact O-CA 2.97Å; I299-V324 HydrophobicContact CD1-CG1 3.78Å; I299-V324 HydrophobicContact CG1-CG1 4.13Å; I299-V324 HydrophobicContact CG2-CG1 3.97Å; G308-V324 CarbonylContact C-O 3.52Å; G308-V324 WeakPolarHBondContact CA-O 3.44Å; L309-V324 PolarHBondContact N-O 2.79Å; L309-V324 PolarHBondContact O-N 2.99Å
325	D	96.9	Very high	90	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.5	-176.8	-53.7	-74.9	0	0	0	110.6	H296 M297 F298 I299 F335 T338 V339 E342	H296-D325 IonicContact CE1-OD2 2.65Å; H296-D325 IonicContact CG-OD2 2.72Å; H296-D325 IonicContact ND1-OD1 3.52Å; H296-D325 IonicContact ND1-OD2 3.05Å; H296-D325 PolarHBondContact ND1-OD2 2.99Å; M297-D325 PolarHBondContact O-N 3.33Å; F298-D325 HydrophobicContact CD1-CB 4.02Å; F298-D325 HydrophobicContact CE1-CB 4.39Å; I299-D325 PolarHBondContact N-O 3.25Å; D325-F335 HydrophobicContact CB-CE2 3.8Å; D325-F335 HydrophobicContact CB-CZ 3.96Å; D325-T338 HydrophobicContact CB-CG2 4.46Å; D325-V339 HydrophobicContact CB-CG2 3.98Å; D325-V339 WeakPolarHBondContact OD1-CA 3.21Å; D325-E342 WeakPolarHBondContact OD1-CB 3.32Å; D325-E342 VanDerWaalsContact OD1-CG 3.3Å; D325-E342 WeakPolarHBondContact OD1-CG 3.35Å
326	N	94.9	Very high	90.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	114.1	-177.5	-174	20.5	0	0	0	112.4	I299 N301 I304 I306 L307 Q328	I299-N326 HydrophobicContact CD1-CB 4.01Å; I299-N326 HydrophobicContact CG1-CB 3.73Å; I299-N326 WeakPolarHBondContact O-CA 3.44Å; N301-N326 PolarHBondContact N-OD1 2.96Å; N301-N326 PolarHBondContact O-ND2 3.12Å; N301-N326 VanDerWaalsContact O-ND2 3.12Å; N301-N326 PolarHBondContact O-OD1 2.72Å; I304-N326 PolarHBondContact O-ND2 2.92Å; I306-N326 PolarHBondContact O-ND2 3.32Å; L307-N326 WeakPolarHBondContact O-CA 3.41Å; L307-N326 WeakPolarHBondContact O-CB 3.4Å; L307-N326 PolarHBondContact O-N 3.5Å; N326-Q328 PolarHBondContact ND2-NE2 2.99Å; N326-Q328 PolarHBondContact O-N 2.9Å
327	F	93.6	Very high	90.4	Very high	1 Å²	1	20.3 Å²	20.3	0%	0.004	11%	0.112	C	C	.	.			trans	-83.2	109	178.8	-179.6	-120	0	0	0	112.8	F220 Y223 I299 K300 G329 D330 W332 F335	F220-F327 HydrophobicContact CD2-CB 4.02Å; F220-F327 HydrophobicContact CD2-CD1 4.3Å; F220-F327 HydrophobicContact CE2-CB 3.71Å; F220-F327 AromaticContact CE2-CD1 3.81Å; F220-F327 HydrophobicContact CE2-CD1 3.81Å; F220-F327 AromaticContact CE2-CG 3.91Å; F220-F327 HydrophobicContact CE2-CG 3.91Å; Y223-F327 HydrophobicContact CD1-CE1 4.11Å; Y223-F327 HydrophobicContact CE1-CD1 4.31Å; Y223-F327 AromaticContact CE1-CE1 3.5Å; Y223-F327 HydrophobicContact CE1-CE1 3.5Å; Y223-F327 HydrophobicContact CE1-CZ 4.4Å; Y223-F327 AromaticContact CZ-CE1 3.75Å; I299-F327 PolarHBondContact O-N 2.95Å; K300-F327 HydrophobicContact CD-CD1 4.45Å; K300-F327 PolarHBondContact NZ-O 3.33Å; K300-F327 VanDerWaalsContact NZ-O 3.11Å; F327-G329 VanDerWaalsContact C-N 3.31Å; F327-G329 VanDerWaalsContact CZ-CA 3.44Å; F327-G329 PolarHBondContact O-N 3.38Å; F327-D330 VanDerWaalsContact CE2-O 3.31Å; F327-D330 WeakPolarHBondContact CE2-O 3.34Å; F327-D330 WeakPolarHBondContact CE2-OD1 3.48Å; F327-D330 WeakPolarHBondContact CZ-O 3.46Å; F327-W332 HydrophobicContact CE1-CH2 4.22Å; F327-W332 HydrophobicContact CE1-CZ3 4.45Å; F327-W332 HydrophobicContact CE2-CE3 4.43Å; F327-W332 HydrophobicContact CE2-CZ3 4.28Å; F327-W332 HydrophobicContact CZ-CH2 4.16Å; F327-W332 HydrophobicContact CZ-CZ3 4.17Å; F327-F335 HydrophobicContact CB-CD2 3.85Å; F327-F335 HydrophobicContact CB-CE2 3.68Å; F327-F335 HydrophobicContact CB-CG 4.37Å; F327-F335 HydrophobicContact CB-CZ 4.06Å; F327-F335 HydrophobicContact CD2-CB 3.77Å; F327-F335 HydrophobicContact CD2-CD1 4.17Å; F327-F335 AromaticContact CD2-CD2 3.74Å; F327-F335 HydrophobicContact CD2-CD2 3.74Å; F327-F335 HydrophobicContact CD2-CE2 4.42Å; F327-F335 AromaticContact CD2-CG 3.61Å; F327-F335 HydrophobicContact CD2-CG 3.61Å; F327-F335 HydrophobicContact CE2-CB 4.11Å; F327-F335 HydrophobicContact CE2-CG 4.37Å; F327-F335 HydrophobicContact CG-CD2 4.26Å; F327-F335 HydrophobicContact CG-CG 4.36Å
328	Q	86.6	Confident	90.8	Very high	46 Å²	46	17.1 Å²	17.1	22%	0.215	10%	0.101	C	C	.	.			trans	-83.7	2.8	-177.4	-65.9	-69.5	-5.6	0	0	114.6	M171 I304 L307 N326	M171-Q328 HydrophobicContact CE-CG 4.46Å; M171-Q328 HydrophobicContact SD-CB 4.46Å; M171-Q328 HydrophobicContact SD-CG 4.01Å; I304-Q328 PolarHBondContact O-NE2 3.19Å; L307-Q328 HydrophobicContact CD2-CG 3.59Å; N326-Q328 PolarHBondContact ND2-NE2 2.99Å; N326-Q328 PolarHBondContact O-N 2.9Å
329	G	82.1	Confident	91.4	Very high	19 Å²	19	13 Å²	13	20%	0.196	7%	0.074	C	C	.	.	S	Bend	trans	83.2	22.7	-175.8	0	0	0	0	0	113.9	F327	F327-G329 VanDerWaalsContact C-N 3.31Å; F327-G329 VanDerWaalsContact CZ-CA 3.44Å; F327-G329 PolarHBondContact O-N 3.38Å
330	D	80.3	Confident	91.8	Very high	31 Å²	31	10.9 Å²	10.9	17%	0.166	6%	0.06	C	C	.	.			trans	-85.9	-174.7	172.1	42.9	44.9	0	0	0	111.8	F327 L334 R369	F327-D330 VanDerWaalsContact CE2-O 3.31Å; F327-D330 WeakPolarHBondContact CE2-O 3.34Å; F327-D330 WeakPolarHBondContact CE2-OD1 3.48Å; F327-D330 WeakPolarHBondContact CZ-O 3.46Å; D330-L334 HydrophobicContact CB-CB 4.48Å; D330-L334 HydrophobicContact CB-CD1 4.27Å; D330-R369 VanDerWaalsContact CG-NH1 3.35Å; D330-R369 IonicContact OD1-NH1 3.63Å; D330-R369 IonicContact OD2-CZ 3.07Å; D330-R369 IonicContact OD2-NH1 2.66Å; D330-R369 PolarHBondContact OD2-NH1 3.21Å; D330-R369 IonicContact OD2-NH2 2.66Å; D330-R369 PolarHBondContact OD2-NH2 3.29Å
331	T	86.4	Confident	92	Very high	21 Å²	21	9.7 Å²	9.7	13%	0.129	5%	0.054	C	C	.	.			trans	-65.1	145.6	177.9	51.7	0	0	0	0	111.4	E144 S333 L334 F335	E144-T331 VanDerWaalsContact OE2-CB 3.32Å; E144-T331 WeakPolarHBondContact OE2-CB 3.35Å; E144-T331 WeakPolarHBondContact OE2-CG2 3.38Å; T331-S333 PolarHBondContact O-N 2.88Å; T331-S333 VanDerWaalsContact O-N 3.12Å; T331-S333 PolarHBondContact OG1-OG 3.41Å; T331-L334 WeakPolarHBondContact O-CB 3.46Å; T331-L334 PolarHBondContact O-N 2.95Å; T331-L334 WeakPolarHBondContact OG1-CD1 3.42Å; T331-L334 WeakPolarHBondContact OG1-CG 3.46Å; T331-F335 PolarHBondContact O-N 3.32Å
332	W	88.6	Confident	92.2	Very high	30 Å²	30	9.5 Å²	9.5	11%	0.114	5%	0.053	C	C	.	.	H	α-helix	trans	-59.6	-30	-176.2	-65.8	107	0	0	0	113.7	F220 D234 L237 V238 F327 F335 A336	F220-W332 HydrophobicContact CZ-CH2 4.03Å; F220-W332 AromaticContact CZ-CZ3 3.97Å; F220-W332 HydrophobicContact CZ-CZ3 3.97Å; D234-W332 HydrophobicContact CB-CH2 3.63Å; D234-W332 HydrophobicContact CB-CZ2 4.07Å; D234-W332 HydrophobicContact CB-CZ3 3.94Å; D234-W332 VanDerWaalsContact CG-CZ2 3.49Å; D234-W332 WeakPolarHBondContact OD2-CH2 3.45Å; D234-W332 WeakPolarHBondContact OD2-CZ2 3.37Å; L237-W332 HydrophobicContact CD2-CB 3.93Å; L237-W332 HydrophobicContact CD2-CG 3.85Å; V238-W332 HydrophobicContact CG2-CE3 3.91Å; V238-W332 HydrophobicContact CG2-CZ3 4.45Å; F327-W332 HydrophobicContact CE1-CH2 4.22Å; F327-W332 HydrophobicContact CE1-CZ3 4.45Å; F327-W332 HydrophobicContact CE2-CE3 4.43Å; F327-W332 HydrophobicContact CE2-CZ3 4.28Å; F327-W332 HydrophobicContact CZ-CH2 4.16Å; F327-W332 HydrophobicContact CZ-CZ3 4.17Å; W332-F335 HydrophobicContact CE3-CD1 4.41Å; W332-F335 HydrophobicContact CZ3-CD1 4.44Å; W332-F335 PolarHBondContact O-N 2.92Å; W332-A336 WeakPolarHBondContact O-CB 3.45Å; W332-A336 PolarHBondContact O-N 3.34Å
333	S	87.7	Confident	92.2	Very high	9 Å²	9	9.5 Å²	9.5	6%	0.063	5%	0.053	C	C	.	.	H	α-helix	trans	-63.4	-38	172.8	57.5	0	0	0	0	113.3	I161 T331 A336 N337	I161-S333 WeakPolarHBondContact CD1-OG 3.28Å; T331-S333 PolarHBondContact O-N 2.88Å; T331-S333 VanDerWaalsContact O-N 3.12Å; T331-S333 PolarHBondContact OG1-OG 3.41Å; S333-A336 PolarHBondContact O-N 3.23Å; S333-N337 PolarHBondContact O-N 3.09Å; S333-N337 PolarHBondContact O-OD1 3.45Å
334	L	88.9	Confident	92.2	Very high	8 Å²	8	9.5 Å²	9.5	4%	0.042	5%	0.053	C	C	.	.	H	α-helix	trans	-73.9	-35.4	178.5	-73.1	178.3	0	0	0	111.2	F168 D330 T331 N337 T338 R369 P371	F168-L334 HydrophobicContact CE1-CD1 4.06Å; D330-L334 HydrophobicContact CB-CB 4.48Å; D330-L334 HydrophobicContact CB-CD1 4.27Å; T331-L334 WeakPolarHBondContact O-CB 3.46Å; T331-L334 PolarHBondContact O-N 2.95Å; T331-L334 WeakPolarHBondContact OG1-CD1 3.42Å; T331-L334 WeakPolarHBondContact OG1-CG 3.46Å; L334-N337 WeakPolarHBondContact O-CB 3.1Å; L334-N337 PolarHBondContact O-N 2.99Å; L334-T338 PolarHBondContact O-N 3.37Å; L334-T338 PolarHBondContact O-OG1 3.12Å; L334-R369 WeakPolarHBondContact O-CD 3.2Å; L334-P371 HydrophobicContact CD2-CB 4.45Å; L334-P371 HydrophobicContact CD2-CG 4.1Å
335	F	92.7	Very high	92.1	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66.6	-41.6	171.2	-174.4	-121.3	0	0	0	111.4	F220 V238 F298 D325 F327 T331 W332 N337 T338 V339	F220-F335 HydrophobicContact CE2-CE1 4.43Å; V238-F335 HydrophobicContact CG1-CD1 4.2Å; V238-F335 HydrophobicContact CG1-CE1 4.33Å; V238-F335 HydrophobicContact CG2-CD1 3.69Å; V238-F335 HydrophobicContact CG2-CE1 4.18Å; F298-F335 HydrophobicContact CB-CZ 4.12Å; F298-F335 HydrophobicContact CD1-CE1 4.35Å; F298-F335 AromaticContact CD1-CZ 3.94Å; F298-F335 HydrophobicContact CD1-CZ 3.94Å; F298-F335 AromaticContact CD2-CE1 3.8Å; F298-F335 HydrophobicContact CD2-CE1 3.8Å; F298-F335 HydrophobicContact CD2-CZ 4.1Å; F298-F335 HydrophobicContact CE1-CZ 4.41Å; F298-F335 HydrophobicContact CE2-CE1 4.01Å; F298-F335 AromaticContact CG-CE1 4Å; F298-F335 HydrophobicContact CG-CE1 4Å; F298-F335 AromaticContact CG-CZ 3.79Å; F298-F335 HydrophobicContact CG-CZ 3.79Å; F298-F335 HydrophobicContact CZ-CE1 4.39Å; D325-F335 HydrophobicContact CB-CE2 3.8Å; D325-F335 HydrophobicContact CB-CZ 3.96Å; F327-F335 HydrophobicContact CB-CD2 3.85Å; F327-F335 HydrophobicContact CB-CE2 3.68Å; F327-F335 HydrophobicContact CB-CG 4.37Å; F327-F335 HydrophobicContact CB-CZ 4.06Å; F327-F335 HydrophobicContact CD2-CB 3.77Å; F327-F335 HydrophobicContact CD2-CD1 4.17Å; F327-F335 AromaticContact CD2-CD2 3.74Å; F327-F335 HydrophobicContact CD2-CD2 3.74Å; F327-F335 HydrophobicContact CD2-CE2 4.42Å; F327-F335 AromaticContact CD2-CG 3.61Å; F327-F335 HydrophobicContact CD2-CG 3.61Å; F327-F335 HydrophobicContact CE2-CB 4.11Å; F327-F335 HydrophobicContact CE2-CG 4.37Å; F327-F335 HydrophobicContact CG-CD2 4.26Å; F327-F335 HydrophobicContact CG-CG 4.36Å; T331-F335 PolarHBondContact O-N 3.32Å; W332-F335 HydrophobicContact CE3-CD1 4.41Å; W332-F335 HydrophobicContact CZ3-CD1 4.44Å; W332-F335 PolarHBondContact O-N 2.92Å; F335-N337 VanDerWaalsContact C-N 3.28Å; F335-N337 PolarHBondContact O-N 3.47Å; F335-T338 WeakPolarHBondContact O-CA 3.27Å; F335-T338 VanDerWaalsContact O-CB 3.32Å; F335-T338 WeakPolarHBondContact O-CB 3.32Å; F335-T338 PolarHBondContact O-N 3.2Å; F335-V339 HydrophobicContact CD1-CG2 4.48Å; F335-V339 HydrophobicContact CE1-CG2 4.13Å; F335-V339 HydrophobicContact CE2-CG2 4.39Å; F335-V339 HydrophobicContact CZ-CG2 4.08Å; F335-V339 WeakPolarHBondContact O-CG2 3.44Å; F335-V339 PolarHBondContact O-N 3.2Å
336	A	94.1	Very high	92.1	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60.5	-35.4	173.1	0	0	0	0	0	112.8	V238 I241 V242 W332 S333 V339 A340	V238-A336 HydrophobicContact CG1-CB 4.21Å; I241-A336 HydrophobicContact CB-CB 3.74Å; I241-A336 HydrophobicContact CD1-CB 4.23Å; I241-A336 HydrophobicContact CG2-CB 3.54Å; V242-A336 HydrophobicContact CG2-CB 4.15Å; W332-A336 WeakPolarHBondContact O-CB 3.45Å; W332-A336 PolarHBondContact O-N 3.34Å; S333-A336 PolarHBondContact O-N 3.23Å; A336-V339 PolarHBondContact O-N 3.2Å; A336-A340 WeakPolarHBondContact O-CB 3.33Å; A336-A340 PolarHBondContact O-N 3.35Å
337	N	92.4	Very high	92	Very high	12 Å²	12	9.5 Å²	9.5	6%	0.064	5%	0.053	C	C	.	.	H	α-helix	trans	-61.8	-42.2	171.3	-73.1	3.9	0	0	0	112.1	M245 S333 L334 F335 A340 H341 V370 A372	M245-N337 WeakPolarHBondContact CE-OD1 3.41Å; S333-N337 PolarHBondContact O-N 3.09Å; S333-N337 PolarHBondContact O-OD1 3.45Å; L334-N337 WeakPolarHBondContact O-CB 3.1Å; L334-N337 PolarHBondContact O-N 2.99Å; F335-N337 VanDerWaalsContact C-N 3.28Å; F335-N337 PolarHBondContact O-N 3.47Å; N337-A340 PolarHBondContact O-N 3.02Å; N337-H341 VanDerWaalsContact O-CB 3.26Å; N337-H341 WeakPolarHBondContact O-CB 3.07Å; N337-H341 PolarHBondContact O-N 2.93Å; N337-V370 PolarHBondContact ND2-O 3.39Å; N337-A372 PolarHBondContact ND2-N 2.99Å; N337-A372 PolarHBondContact ND2-O 3.4Å; N337-A372 VanDerWaalsContact ND2-O 3.13Å; N337-A372 PolarHBondContact OD1-O 3.25Å; N337-A372 VanDerWaalsContact OD1-O 3.06Å
338	T	94.4	Very high	91.9	Very high	6 Å²	6	9.6 Å²	9.6	4%	0.037	5%	0.054	C	C	.	.	H	α-helix	trans	-59.6	-50.3	174.5	-57.1	0	0	0	0	110.5	L307 D325 L334 F335 A340 H341 E342 R369	L307-T338 HydrophobicContact CB-CG2 4.01Å; L307-T338 VanDerWaalsContact O-CG2 3.31Å; L307-T338 WeakPolarHBondContact O-CG2 3.17Å; D325-T338 HydrophobicContact CB-CG2 4.46Å; L334-T338 PolarHBondContact O-N 3.37Å; L334-T338 PolarHBondContact O-OG1 3.12Å; F335-T338 WeakPolarHBondContact O-CA 3.27Å; F335-T338 VanDerWaalsContact O-CB 3.32Å; F335-T338 WeakPolarHBondContact O-CB 3.32Å; F335-T338 PolarHBondContact O-N 3.2Å; T338-A340 VanDerWaalsContact C-N 3.31Å; T338-A340 PolarHBondContact O-N 2.84Å; T338-H341 WeakPolarHBondContact O-CB 3.13Å; T338-H341 PolarHBondContact O-N 2.93Å; T338-H341 VanDerWaalsContact O-N 3.13Å; T338-E342 HydrophobicContact CG2-CG 4.42Å; T338-E342 WeakPolarHBondContact O-CG 3.16Å; T338-E342 PolarHBondContact O-N 3.03Å; T338-R369 WeakPolarHBondContact OG1-CD 3.09Å
339	V	96.6	Very high	92.3	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.006	4%	0.044	C	C	.	.	H	α-helix	trans	-59.8	-43	179	178.8	0	0	0	0	111.3	V238 V242 F298 D325 F335 A336 H341 L343	V238-V339 HydrophobicContact CG1-CB 4.33Å; V238-V339 HydrophobicContact CG1-CG2 3.89Å; V242-V339 HydrophobicContact CG2-CB 4Å; V242-V339 HydrophobicContact CG2-CG1 3.92Å; F298-V339 HydrophobicContact CD1-CG2 4.32Å; F298-V339 HydrophobicContact CE1-CB 4.43Å; F298-V339 HydrophobicContact CE1-CG1 3.96Å; F298-V339 HydrophobicContact CE1-CG2 3.51Å; F298-V339 HydrophobicContact CZ-CG1 4.06Å; F298-V339 HydrophobicContact CZ-CG2 3.73Å; D325-V339 HydrophobicContact CB-CG2 3.98Å; D325-V339 WeakPolarHBondContact OD1-CA 3.21Å; F335-V339 HydrophobicContact CD1-CG2 4.48Å; F335-V339 HydrophobicContact CE1-CG2 4.13Å; F335-V339 HydrophobicContact CE2-CG2 4.39Å; F335-V339 HydrophobicContact CZ-CG2 4.08Å; F335-V339 WeakPolarHBondContact O-CG2 3.44Å; F335-V339 PolarHBondContact O-N 3.2Å; A336-V339 PolarHBondContact O-N 3.2Å; V339-H341 VanDerWaalsContact C-N 3.33Å; V339-H341 PolarHBondContact O-N 2.93Å; V339-L343 WeakPolarHBondContact O-CB 3.49Å; V339-L343 PolarHBondContact O-N 3.39Å
340	A	96.7	Very high	92.8	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-65	-37	178.2	0	0	0	0	0	112.6	V242 M245 Y246 A336 N337 T338 G344 I364	V242-A340 HydrophobicContact CG1-CB 4.36Å; V242-A340 HydrophobicContact CG2-CB 4.37Å; M245-A340 HydrophobicContact SD-CB 3.7Å; Y246-A340 HydrophobicContact CE2-CB 3.98Å; Y246-A340 PolarHBondContact OH-O 2.84Å; A336-A340 WeakPolarHBondContact O-CB 3.33Å; A336-A340 PolarHBondContact O-N 3.35Å; N337-A340 PolarHBondContact O-N 3.02Å; T338-A340 VanDerWaalsContact C-N 3.31Å; T338-A340 PolarHBondContact O-N 2.84Å; A340-G344 PolarHBondContact O-N 2.77Å; A340-I364 HydrophobicContact CB-CG2 4.2Å
341	H	96.1	Very high	93.3	Very high	13 Å²	13	11.2 Å²	11.2	6%	0.06	6%	0.056	C	C	.	.	H	α-helix	trans	-65.3	-51.9	176.2	-178.9	109	0	0	0	111.6	N337 T338 V339 L343 G344 H345 H351 I364 N366	N337-H341 VanDerWaalsContact O-CB 3.26Å; N337-H341 WeakPolarHBondContact O-CB 3.07Å; N337-H341 PolarHBondContact O-N 2.93Å; T338-H341 WeakPolarHBondContact O-CB 3.13Å; T338-H341 PolarHBondContact O-N 2.93Å; T338-H341 VanDerWaalsContact O-N 3.13Å; V339-H341 VanDerWaalsContact C-N 3.33Å; V339-H341 PolarHBondContact O-N 2.93Å; H341-L343 VanDerWaalsContact C-N 3.33Å; H341-L343 PolarHBondContact O-N 3.37Å; H341-G344 WeakPolarHBondContact O-CA 3.38Å; H341-G344 PolarHBondContact O-N 2.81Å; H341-H345 AromaticContact CD2-CD2 3.86Å; H341-H345 AromaticContact CD2-NE2 3.56Å; H341-H345 AromaticContact NE2-CD2 3.98Å; H341-H345 AromaticContact NE2-CE1 3.97Å; H341-H345 AromaticContact NE2-NE2 3.2Å; H341-H345 PolarHBondContact NE2-NE2 2.78Å; H341-H345 VanDerWaalsContact NE2-NE2 3.2Å; H341-H345 PolarHBondContact O-N 3.06Å; H341-H345 VanDerWaalsContact O-N 3.16Å; H341-H351 AromaticContact CE1-CD2 3.56Å; H341-H351 AromaticContact CE1-NE2 3.66Å; H341-H351 AromaticContact NE2-CD2 3.62Å; H341-H351 AromaticContact NE2-NE2 3.31Å; H341-H351 PolarHBondContact NE2-NE2 3.23Å; H341-I364 HydrophobicContact CB-CG2 4.23Å; H341-I364 PolarHBondContact ND1-O 2.76Å; H341-N366 PolarHBondContact CE1-O 2.88Å
342	E	96.8	Very high	93.4	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.009	6%	0.057	C	C	.	.	H	α-helix	trans	-66.8	-36.1	-179.8	-61.8	-52.8	148.5	0	0	111.8	C173 G308 L309 A310 D325 T338 G344 H345 I346	C173-E342 PolarHBondContact SG-OE1 2.99Å; G308-E342 WeakPolarHBondContact CA-OE1 3.25Å; L309-E342 WeakPolarHBondContact CA-OE2 3.43Å; L309-E342 PolarHBondContact N-OE2 3.14Å; A310-E342 HydrophobicContact CB-CB 4.07Å; A310-E342 VanDerWaalsContact CB-O 3.31Å; A310-E342 WeakPolarHBondContact CB-O 3.34Å; A310-E342 PolarHBondContact N-OE2 3.25Å; D325-E342 WeakPolarHBondContact OD1-CB 3.32Å; D325-E342 VanDerWaalsContact OD1-CG 3.3Å; D325-E342 WeakPolarHBondContact OD1-CG 3.35Å; T338-E342 HydrophobicContact CG2-CG 4.42Å; T338-E342 WeakPolarHBondContact O-CG 3.16Å; T338-E342 PolarHBondContact O-N 3.03Å; E342-G344 PolarHBondContact O-N 3.1Å; E342-H345 WeakPolarHBondContact O-CB 3.44Å; E342-H345 PolarHBondContact O-N 2.88Å; E342-H345 IonicContact OE2-CD2 3.56Å; E342-I346 PolarHBondContact O-N 2.72Å
343	L	97.1	Very high	93.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-64.5	-30	172.3	-172.7	62.5	0	0	0	111	L210 V242 Y246 V253 A294 H296 V339 H341 I346 L347	L210-L343 HydrophobicContact CD1-CD1 3.92Å; L210-L343 HydrophobicContact CD1-CD2 4.13Å; L210-L343 HydrophobicContact CD1-CG 4.19Å; L210-L343 HydrophobicContact CD2-CD1 4.26Å; V242-L343 HydrophobicContact CG1-CD2 4.15Å; Y246-L343 HydrophobicContact CD2-CD2 4.38Å; Y246-L343 HydrophobicContact CE2-CB 4.38Å; Y246-L343 HydrophobicContact CE2-CD2 3.83Å; Y246-L343 HydrophobicContact CE2-CG 4.34Å; Y246-L343 VanDerWaalsContact OH-C 3.23Å; V253-L343 HydrophobicContact CG2-CD2 4.23Å; A294-L343 HydrophobicContact CB-CD1 4.22Å; H296-L343 PolarHBondContact CE1-N 2.02Å; H296-L343 VanDerWaalsContact CE1-N 3.33Å; H296-L343 WeakPolarHBondContact NE2-CD1 3.48Å; V339-L343 WeakPolarHBondContact O-CB 3.49Å; V339-L343 PolarHBondContact O-N 3.39Å; H341-L343 VanDerWaalsContact C-N 3.33Å; H341-L343 PolarHBondContact O-N 3.37Å; L343-I346 HydrophobicContact CD1-CD1 4.35Å; L343-I346 PolarHBondContact O-N 3.35Å; L343-L347 HydrophobicContact CG-CD1 4.38Å; L343-L347 WeakPolarHBondContact O-CG 3.08Å; L343-L347 PolarHBondContact O-N 3.04Å; L343-L347 VanDerWaalsContact O-N 3.08Å
344	G	96.3	Very high	92.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.6	-41.4	175.9	0	0	0	0	0	111.3	Y246 A340 H341 E342 L347 G348 M349	Y246-G344 VanDerWaalsContact OH-CA 3.22Å; Y246-G344 WeakPolarHBondContact OH-CA 3.45Å; Y246-G344 PolarHBondContact OH-N 2.95Å; A340-G344 PolarHBondContact O-N 2.77Å; H341-G344 WeakPolarHBondContact O-CA 3.38Å; H341-G344 PolarHBondContact O-N 2.81Å; E342-G344 PolarHBondContact O-N 3.1Å; G344-L347 CarbonylContact O-C 3.54Å; G344-L347 WeakPolarHBondContact O-CA 3.42Å; G344-L347 PolarHBondContact O-N 2.84Å; G344-G348 PolarHBondContact O-N 2.77Å; G344-G348 VanDerWaalsContact O-N 3.09Å; G344-M349 VanDerWaalsContact O-CB 3.3Å; G344-M349 WeakPolarHBondContact O-CB 3.34Å; G344-M349 WeakPolarHBondContact O-CG 3.49Å; G344-M349 PolarHBondContact O-N 2.86Å
345	H	95.8	Very high	92.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.6	-45.4	172.1	-70.6	-40.6	0	0	0	112.3	L175 A310 Y311 I312 A313 H341 E342 L347 G348 M349 H351 M365	L175-H345 WeakPolarHBondContact CD2-CE1 3.26Å; L175-H345 WeakPolarHBondContact CD2-NE2 3.39Å; A310-H345 HydrophobicContact CB-CB 4.14Å; Y311-H345 CarbonylContact O-C 3.26Å; I312-H345 CarbonylContact C-O 3.53Å; I312-H345 VanDerWaalsContact CA-O 3.24Å; I312-H345 WeakPolarHBondContact CA-O 3.43Å; A313-H345 PolarHBondContact N-O 2.94Å; H341-H345 AromaticContact CD2-CD2 3.86Å; H341-H345 AromaticContact CD2-NE2 3.56Å; H341-H345 AromaticContact NE2-CD2 3.98Å; H341-H345 AromaticContact NE2-CE1 3.97Å; H341-H345 AromaticContact NE2-NE2 3.2Å; H341-H345 PolarHBondContact NE2-NE2 2.78Å; H341-H345 VanDerWaalsContact NE2-NE2 3.2Å; H341-H345 PolarHBondContact O-N 3.06Å; H341-H345 VanDerWaalsContact O-N 3.16Å; E342-H345 WeakPolarHBondContact O-CB 3.44Å; E342-H345 PolarHBondContact O-N 2.88Å; E342-H345 IonicContact OE2-CD2 3.56Å; H345-L347 PolarHBondContact O-N 2.97Å; H345-G348 WeakPolarHBondContact O-CA 3.07Å; H345-G348 PolarHBondContact O-N 3.32Å; H345-M349 PolarHBondContact ND1-O 3.32Å; H345-H351 AromaticContact CE1-CD2 3.77Å; H345-H351 AromaticContact CE1-NE2 3.79Å; H345-H351 AromaticContact NE2-CD2 3.93Å; H345-H351 AromaticContact NE2-NE2 3.53Å; H345-M365 WeakPolarHBondContact CE1-CE 2.96Å; H345-M365 WeakPolarHBondContact ND1-CE 3.48Å
346	I	95.3	Very high	92.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.7	-38	175.7	-61	-179.8	0	0	0	111	A294 H296 A310 Y311 A313 G314 I315 E342 L343 G348	A294-I346 HydrophobicContact CB-CD1 4.47Å; A294-I346 HydrophobicContact CB-CG2 4.41Å; H296-I346 WeakPolarHBondContact NE2-CD1 3.01Å; A310-I346 HydrophobicContact CB-CD1 4.44Å; A310-I346 HydrophobicContact CB-CG1 3.87Å; Y311-I346 WeakPolarHBondContact O-CA 3.41Å; Y311-I346 PolarHBondContact O-N 2.94Å; A313-I346 CarbonylContact C-O 3.59Å; A313-I346 WeakPolarHBondContact CA-O 3.36Å; G314-I346 PolarHBondContact N-O 3.35Å; G314-I346 VanDerWaalsContact N-O 3.07Å; I315-I346 HydrophobicContact CB-CG2 4Å; I315-I346 WeakPolarHBondContact CB-O 3.37Å; I315-I346 HydrophobicContact CD1-CG2 4.02Å; I315-I346 PolarHBondContact N-O 2.91Å; E342-I346 PolarHBondContact O-N 2.72Å; L343-I346 HydrophobicContact CD1-CD1 4.35Å; L343-I346 PolarHBondContact O-N 3.35Å; I346-G348 PolarHBondContact O-N 3.14Å
347	L	94.3	Very high	91.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	5.4	175.8	-68.4	169.1	0	0	0	114.3	L210 Y246 I315 L343 G344 H345 M349 F383 T386 L394	L210-L347 HydrophobicContact CD1-CD1 3.92Å; L210-L347 HydrophobicContact CD1-CD2 4.09Å; L210-L347 HydrophobicContact CD1-CG 4.29Å; Y246-L347 HydrophobicContact CD1-CD1 4.09Å; Y246-L347 HydrophobicContact CE1-CD1 3.3Å; I315-L347 HydrophobicContact CB-CD2 4.2Å; I315-L347 HydrophobicContact CD1-CD2 4.1Å; I315-L347 HydrophobicContact CG1-CD2 3.88Å; I315-L347 HydrophobicContact CG2-CD2 4.43Å; L343-L347 HydrophobicContact CG-CD1 4.38Å; L343-L347 WeakPolarHBondContact O-CG 3.08Å; L343-L347 PolarHBondContact O-N 3.04Å; L343-L347 VanDerWaalsContact O-N 3.08Å; G344-L347 CarbonylContact O-C 3.54Å; G344-L347 WeakPolarHBondContact O-CA 3.42Å; G344-L347 PolarHBondContact O-N 2.84Å; H345-L347 PolarHBondContact O-N 2.97Å; L347-M349 HydrophobicContact CB-CE 4.42Å; L347-F383 HydrophobicContact CB-CD2 4.08Å; L347-F383 HydrophobicContact CD1-CD2 4.34Å; L347-F383 HydrophobicContact CD1-CE2 4.25Å; L347-F383 HydrophobicContact CD2-CD2 4.46Å; L347-F383 HydrophobicContact CD2-CE2 4.18Å; L347-T386 VanDerWaalsContact O-CB 3.25Å; L347-T386 WeakPolarHBondContact O-CB 3.05Å; L347-L394 HydrophobicContact CD2-CD1 3.76Å
348	G	91.9	Very high	91.1	Very high	4 Å²	4	39.8 Å²	39.8	4%	0.041	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	3.9	170.6	0	0	0	0	0	115.7	G344 H345 I346 D382 T386	G344-G348 PolarHBondContact O-N 2.77Å; G344-G348 VanDerWaalsContact O-N 3.09Å; H345-G348 WeakPolarHBondContact O-CA 3.07Å; H345-G348 PolarHBondContact O-N 3.32Å; I346-G348 PolarHBondContact O-N 3.14Å; G348-D382 WeakPolarHBondContact O-CB 3.34Å; G348-T386 WeakPolarHBondContact CA-OG1 3.2Å
349	M	94.5	Very high	90.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-69.4	132.6	177.3	-53.3	177.5	-163.4	0	0	110.6	Y246 L249 G344 H345 L347 M365 F375 F383	Y246-M349 HydrophobicContact CE1-CE 4.24Å; L249-M349 HydrophobicContact CD1-CE 3.25Å; G344-M349 VanDerWaalsContact O-CB 3.3Å; G344-M349 WeakPolarHBondContact O-CB 3.34Å; G344-M349 WeakPolarHBondContact O-CG 3.49Å; G344-M349 PolarHBondContact O-N 2.86Å; H345-M349 PolarHBondContact ND1-O 3.32Å; L347-M349 HydrophobicContact CB-CE 4.42Å; M349-M365 HydrophobicContact CB-CE 3.94Å; M349-M365 HydrophobicContact CB-CG 4.05Å; M349-M365 HydrophobicContact CB-SD 4.08Å; M349-M365 HydrophobicContact SD-CG 4.17Å; M349-M365 HydrophobicContact SD-SD 4.19Å; M349-F375 HydrophobicContact CE-CD1 4.44Å; M349-F375 HydrophobicContact CE-CE1 4.22Å; M349-F375 HydrophobicContact CE-CZ 4.33Å; M349-F375 HydrophobicContact SD-CD1 3.68Å; M349-F375 HydrophobicContact SD-CE1 3.55Å; M349-F375 VanDerWaalsContact SD-CE1 3.55Å; M349-F375 HydrophobicContact SD-CG 4.42Å; M349-F375 HydrophobicContact SD-CZ 4.23Å; M349-F383 HydrophobicContact CE-CB 3.71Å; M349-F383 HydrophobicContact CE-CD2 3.89Å; M349-F383 HydrophobicContact CE-CG 4.04Å; M349-F383 HydrophobicContact CG-CB 4.28Å
350	Q	91.7	Very high	89.1	Confident	91 Å²	91	44.7 Å²	44.7	43%	0.425	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-93.2	172.1	171.7	-60.8	-172.6	32.3	0	0	111.2	M365 D382	Q350-M365 WeakPolarHBondContact O-CB 3.43Å; Q350-D382 PolarHBondContact N-OD2 3.44Å; Q350-D382 VanDerWaalsContact N-OD2 3.11Å
351	H	91.9	Very high	87.8	Confident	39 Å²	39	55.6 Å²	55.6	18%	0.181	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-62.9	142.3	173	-69	139.3	0	0	0	111.3	L175 H341 H345 E353 M365 T367	L175-H351 PolarHBondContact O-CE1 2.88Å; H341-H351 AromaticContact CE1-CD2 3.56Å; H341-H351 AromaticContact CE1-NE2 3.66Å; H341-H351 AromaticContact NE2-CD2 3.62Å; H341-H351 AromaticContact NE2-NE2 3.31Å; H341-H351 PolarHBondContact NE2-NE2 3.23Å; H345-H351 AromaticContact CE1-CD2 3.77Å; H345-H351 AromaticContact CE1-NE2 3.79Å; H345-H351 AromaticContact NE2-CD2 3.93Å; H345-H351 AromaticContact NE2-NE2 3.53Å; H351-E353 PolarHBondContact O-N 2.93Å; H351-M365 VanDerWaalsContact CA-O 3.25Å; H351-M365 WeakPolarHBondContact CA-O 3.25Å; H351-T367 HydrophobicContact CB-CG2 3.72Å
352	D	87.7	Confident	86.9	Confident	28 Å²	28	55.3 Å²	55.3	15%	0.15	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-67.2	128.6	179.8	-67.2	-46.5	0	0	0	111.7	C356 C363 M365 T376 S379	D352-C356 HydrophobicContact CB-CB 3.99Å; D352-C363 VanDerWaalsContact OD2-CB 3.3Å; D352-C363 WeakPolarHBondContact OD2-CB 3.21Å; D352-M365 PolarHBondContact N-O 2.68Å; D352-M365 WeakPolarHBondContact OD2-CB 3.25Å; D352-T376 HydrophobicContact CB-CG2 4.23Å; D352-T376 WeakPolarHBondContact OD1-CB 3.22Å; D352-T376 WeakPolarHBondContact OD1-CG2 3.26Å; D352-T376 PolarHBondContact OD1-OG1 2.78Å; D352-T376 WeakPolarHBondContact OD2-CG2 3.32Å; D352-S379 PolarHBondContact OD1-OG 3.33Å; D352-S379 VanDerWaalsContact OD1-OG 3.13Å
353	E	84.2	Confident	86.6	Confident	125 Å²	125	56 Å²	56	58%	0.584	27%	0.269	S	S	*	.			trans	-89.1	174.2	171.9	-65.9	-169.9	-143.6	0	0	112	H351 F355 C356	H351-E353 PolarHBondContact O-N 2.93Å; E353-F355 HydrophobicContact CB-CD1 3.98Å; E353-F355 HydrophobicContact CB-CE1 3.63Å; E353-F355 HydrophobicContact CB-CZ 4.06Å; E353-F355 HydrophobicContact CG-CE1 4.23Å; E353-F355 HydrophobicContact CG-CZ 4.48Å; E353-F355 PolarHBondContact O-N 3.07Å; E353-F355 VanDerWaalsContact O-N 3.1Å; E353-F355 WeakPolarHBondContact OE2-CE1 3.27Å; E353-C356 PolarHBondContact N-SG 3.22Å; E353-C356 WeakPolarHBondContact O-CB 3.35Å; E353-C356 PolarHBondContact O-N 3.09Å
354	E	80.9	Confident	86.3	Confident	204 Å²	204	56.4 Å²	56.4	95%	0.953	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.4	-175.8	-169.1	177.9	-177.2	0	0	113.9
355	F	83.6	Confident	86.2	Confident	138 Å²	138	56.4 Å²	56.4	61%	0.605	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-3.6	179.1	62.3	-97	0	0	0	114.2	E353 C378	E353-F355 HydrophobicContact CB-CD1 3.98Å; E353-F355 HydrophobicContact CB-CE1 3.63Å; E353-F355 HydrophobicContact CB-CZ 4.06Å; E353-F355 HydrophobicContact CG-CE1 4.23Å; E353-F355 HydrophobicContact CG-CZ 4.48Å; E353-F355 PolarHBondContact O-N 3.07Å; E353-F355 VanDerWaalsContact O-N 3.1Å; E353-F355 WeakPolarHBondContact OE2-CE1 3.27Å; F355-C378 VanDerWaalsContact CE2-SG 3.51Å
356	C	85.4	Confident	85.9	Confident	18 Å²	18	58.8 Å²	58.8	12%	0.122	28%	0.284	C	S	.	.			trans	-85.4	128.3	-179.3	-60.1	0	0	0	0	110.4	D352 E353 T376 C378	D352-C356 HydrophobicContact CB-CB 3.99Å; E353-C356 PolarHBondContact N-SG 3.22Å; E353-C356 WeakPolarHBondContact O-CB 3.35Å; E353-C356 PolarHBondContact O-N 3.09Å; C356-T376 HydrophobicContact CB-CG2 3.93Å; C356-C378 WeakPolarHBondContact CA-SG 3.35Å; C356-C378 HydrophobicContact CB-CB 3.81Å; C356-C378 WeakPolarHBondContact CB-SG 3.46Å; C356-C378 WeakPolarHBondContact SG-CB 3.37Å; C356-C378 CovalentContact SG-SG 2.04Å; C356-C378 PolarHBondContact SG-SG 3.45Å
357	F	81.3	Confident	85.4	Confident	152 Å²	152	60.4 Å²	60.4	67%	0.667	29%	0.294	S	S	*	.			trans	-129	130.5	-171.5	-169.9	-99.8	0	0	0	112.3	G359 N377	F357-G359 VanDerWaalsContact CE1-N 3.31Å; F357-N377 PolarHBondContact N-OD1 2.82Å; F357-N377 PolarHBondContact O-N 3.38Å
358	C	81	Confident	84.8	Confident	15 Å²	15	64.7 Å²	64.7	10%	0.101	31%	0.313	C	S	.	.			trans	-118.7	4.9	175.7	67.8	0	0	0	0	114.1	E360 C363 K374 F375 T376	C358-E360 PolarHBondContact O-N 2.02Å; C358-C363 HydrophobicContact CB-CB 3.88Å; C358-C363 WeakPolarHBondContact CB-SG 2.99Å; C358-C363 VanDerWaalsContact SG-CA 3.53Å; C358-C363 WeakPolarHBondContact SG-CB 3.13Å; C358-C363 CovalentContact SG-SG 2.04Å; C358-C363 PolarHBondContact SG-SG 2.91Å; C358-K374 HydrophobicContact CB-CB 3.96Å; C358-K374 WeakPolarHBondContact O-CD 3.37Å; C358-F375 WeakPolarHBondContact CB-O 3.37Å; C358-T376 HydrophobicContact CB-CG2 3.95Å
359	G	74.3	Confident	84.4	Confident	49 Å²	49	66.6 Å²	66.6	51%	0.505	32%	0.319	S	S	.	.	S	Bend	trans	77.1	2.2	-179.7	0	0	0	0	0	115.4	F357	F357-G359 VanDerWaalsContact CE1-N 3.31Å
360	E	73.8	Confident	83.7	Confident	60 Å²	60	68.6 Å²	68.6	28%	0.28	33%	0.331	S	S	.	.	S	Bend	trans	-128.6	171.6	-177.7	-66.5	-173.1	-168.2	0	0	111.8	C358 G362 K374	C358-E360 PolarHBondContact O-N 2.02Å; E360-G362 VanDerWaalsContact C-N 3.27Å; E360-G362 PolarHBondContact O-N 3.31Å; E360-K374 HydrophobicContact CG-CD 4.2Å; E360-K374 VanDerWaalsContact OE1-CD 3.27Å; E360-K374 WeakPolarHBondContact OE1-CD 3.44Å; E360-K374 WeakPolarHBondContact OE1-CE 3.33Å; E360-K374 IonicContact OE1-NZ 2.81Å; E360-K374 PolarHBondContact OE1-NZ 3.17Å
361	R	69.1	Low	83.1	Confident	230 Å²	230	66.5 Å²	66.5	87%	0.868	33%	0.325	S	S	*	.	S	Bend	trans	-70.8	-23.4	-179.6	-68.5	-174.8	-178	178.5	0	113.3
362	G	79.3	Confident	82.7	Confident	6 Å²	6	64.7 Å²	64.7	6%	0.062	32%	0.317	C	S	.	.			trans	-142.3	140.2	179.9	0	0	0	0	0	110	E360 A372	E360-G362 VanDerWaalsContact C-N 3.27Å; E360-G362 PolarHBondContact O-N 3.31Å; G362-A372 WeakPolarHBondContact O-CB 3.48Å
363	C	88.8	Confident	82.3	Confident	17 Å²	17	64.4 Å²	64.4	12%	0.115	32%	0.315	C	S	.	.			trans	-116.1	154.4	178.4	-47.1	0	0	0	0	109.3	D352 C358 M365 N366 K374 T376	D352-C363 VanDerWaalsContact OD2-CB 3.3Å; D352-C363 WeakPolarHBondContact OD2-CB 3.21Å; C358-C363 HydrophobicContact CB-CB 3.88Å; C358-C363 WeakPolarHBondContact CB-SG 2.99Å; C358-C363 VanDerWaalsContact SG-CA 3.53Å; C358-C363 WeakPolarHBondContact SG-CB 3.13Å; C358-C363 CovalentContact SG-SG 2.04Å; C358-C363 PolarHBondContact SG-SG 2.91Å; C363-M365 VanDerWaalsContact C-N 3.29Å; C363-M365 PolarHBondContact O-N 3.43Å; C363-N366 VanDerWaalsContact O-CB 3.31Å; C363-N366 WeakPolarHBondContact O-CB 3.28Å; C363-N366 PolarHBondContact O-N 3.08Å; C363-N366 VanDerWaalsContact O-N 3.16Å; C363-K374 WeakPolarHBondContact CA-O 3.26Å; C363-T376 HydrophobicContact CB-CG2 3.62Å; C363-T376 WeakPolarHBondContact SG-CG2 3.47Å
364	I	92.4	Very high	82.3	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.046	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-41.4	-172.1	-68	169.4	0	0	0	111.2	M245 A340 H341 N366 A372 K374 F375	M245-I364 HydrophobicContact CB-CD1 4.04Å; M245-I364 HydrophobicContact CG-CD1 4.28Å; M245-I364 HydrophobicContact SD-CD1 4.35Å; A340-I364 HydrophobicContact CB-CG2 4.2Å; H341-I364 HydrophobicContact CB-CG2 4.23Å; H341-I364 PolarHBondContact ND1-O 2.76Å; I364-N366 PolarHBondContact O-N 3.13Å; I364-A372 HydrophobicContact CG1-CB 4.13Å; I364-K374 PolarHBondContact N-O 3.42Å; I364-F375 HydrophobicContact CB-CD1 3.85Å; I364-F375 HydrophobicContact CB-CE1 3.66Å; I364-F375 HydrophobicContact CB-CZ 4.28Å; I364-F375 HydrophobicContact CD1-CD1 4.15Å; I364-F375 HydrophobicContact CD1-CD2 4.09Å; I364-F375 HydrophobicContact CD1-CE1 3.9Å; I364-F375 HydrophobicContact CD1-CE2 3.8Å; I364-F375 HydrophobicContact CD1-CG 4.23Å; I364-F375 HydrophobicContact CD1-CZ 3.69Å; I364-F375 HydrophobicContact CG1-CE1 4.39Å; I364-F375 HydrophobicContact CG2-CD1 4.14Å; I364-F375 HydrophobicContact CG2-CE1 3.43Å; I364-F375 VanDerWaalsContact CG2-CE1 3.43Å; I364-F375 HydrophobicContact CG2-CZ 3.91Å
365	M	93.6	Very high	82.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	19	-177.2	-60.2	-53.2	-57.9	0	0	113.9	H345 M349 Q350 H351 D352 C363 F375	H345-M365 WeakPolarHBondContact CE1-CE 2.96Å; H345-M365 WeakPolarHBondContact ND1-CE 3.48Å; M349-M365 HydrophobicContact CB-CE 3.94Å; M349-M365 HydrophobicContact CB-CG 4.05Å; M349-M365 HydrophobicContact CB-SD 4.08Å; M349-M365 HydrophobicContact SD-CG 4.17Å; M349-M365 HydrophobicContact SD-SD 4.19Å; Q350-M365 WeakPolarHBondContact O-CB 3.43Å; H351-M365 VanDerWaalsContact CA-O 3.25Å; H351-M365 WeakPolarHBondContact CA-O 3.25Å; D352-M365 PolarHBondContact N-O 2.68Å; D352-M365 WeakPolarHBondContact OD2-CB 3.25Å; C363-M365 VanDerWaalsContact C-N 3.29Å; C363-M365 PolarHBondContact O-N 3.43Å; M365-F375 HydrophobicContact CG-CD1 4.01Å; M365-F375 HydrophobicContact CG-CE1 4.12Å; M365-F375 HydrophobicContact SD-CE1 4.09Å
366	N	89	Confident	82.9	Confident	50 Å²	50	45.2 Å²	45.2	27%	0.267	23%	0.227	S	C	.	.			trans	-66.8	137.4	173.2	-166.2	-22.3	0	0	0	110.8	H341 C363 I364 F368 V370	H341-N366 PolarHBondContact CE1-O 2.88Å; C363-N366 VanDerWaalsContact O-CB 3.31Å; C363-N366 WeakPolarHBondContact O-CB 3.28Å; C363-N366 PolarHBondContact O-N 3.08Å; C363-N366 VanDerWaalsContact O-N 3.16Å; I364-N366 PolarHBondContact O-N 3.13Å; N366-F368 PolarHBondContact O-N 3.3Å; N366-F368 VanDerWaalsContact O-N 3.1Å; N366-F368 PolarHBondContact OD1-N 3.41Å; N366-V370 HydrophobicContact CB-CG2 4.14Å
367	T	84.3	Confident	82.7	Confident	33 Å²	33	49 Å²	49	20%	0.202	25%	0.245	C	C	.	.	S	Bend	trans	-53	-30.8	178.3	56.5	0	0	0	0	114.4	R172 C173 H351	R172-T367 WeakPolarHBondContact CG-O 3.39Å; C173-T367 PolarHBondContact N-O 3.33Å; H351-T367 HydrophobicContact CB-CG2 3.72Å
368	F	82.9	Confident	83	Confident	90 Å²	90	42.8 Å²	42.8	40%	0.395	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-107.4	138.9	174.7	-59.9	-78.7	0	0	0	109.7	A170 R172 N366 V370	A170-F368 HydrophobicContact CB-CD1 3.92Å; A170-F368 HydrophobicContact CB-CE1 4.02Å; R172-F368 HydrophobicContact CB-CD1 4.24Å; R172-F368 HydrophobicContact CB-CE1 4.31Å; R172-F368 HydrophobicContact CG-CD1 4.19Å; R172-F368 HydrophobicContact CG-CE1 4.12Å; N366-F368 PolarHBondContact O-N 3.3Å; N366-F368 VanDerWaalsContact O-N 3.1Å; N366-F368 PolarHBondContact OD1-N 3.41Å; F368-V370 PolarHBondContact O-N 3.47Å; F368-V370 VanDerWaalsContact O-N 3.1Å
369	R	83.6	Confident	83.5	Confident	44 Å²	44	42 Å²	42	17%	0.166	22%	0.216	C	C	.	.			trans	-66.8	117.9	178.5	-175.7	-178.6	61.2	179.5	1.6	110.3	M171 L307 D330 L334 T338	M171-R369 PolarHBondContact O-N 2.92Å; L307-R369 HydrophobicContact CD1-CB 3.43Å; L307-R369 VanDerWaalsContact CD1-CB 3.43Å; L307-R369 HydrophobicContact CD1-CG 4.17Å; D330-R369 VanDerWaalsContact CG-NH1 3.35Å; D330-R369 IonicContact OD1-NH1 3.63Å; D330-R369 IonicContact OD2-CZ 3.07Å; D330-R369 IonicContact OD2-NH1 2.66Å; D330-R369 PolarHBondContact OD2-NH1 3.21Å; D330-R369 IonicContact OD2-NH2 2.66Å; D330-R369 PolarHBondContact OD2-NH2 3.29Å; L334-R369 WeakPolarHBondContact O-CD 3.2Å; T338-R369 WeakPolarHBondContact OG1-CD 3.09Å
370	V	78.3	Confident	84	Confident	43 Å²	43	43.8 Å²	43.8	26%	0.261	21%	0.208	S	C	.	.			trans	-123.1	153.4	172.3	-67.6	0	0	0	0	109.2	N337 N366 F368 A372	N337-V370 PolarHBondContact ND2-O 3.39Å; N366-V370 HydrophobicContact CB-CG2 4.14Å; F368-V370 PolarHBondContact O-N 3.47Å; F368-V370 VanDerWaalsContact O-N 3.1Å; V370-A372 HydrophobicContact CG2-CB 4.27Å; V370-A372 PolarHBondContact O-N 2.89Å
371	P	80.4	Confident	84.3	Confident	46 Å²	46	43.5 Å²	43.5	30%	0.299	22%	0.216	S	C	.	.			trans	-57.9	109.2	164.6	-18.2	29.4	0	0	0	109	L334	L334-P371 HydrophobicContact CD2-CB 4.45Å; L334-P371 HydrophobicContact CD2-CG 4.1Å
372	A	83.3	Confident	85.2	Confident	2 Å²	2	34.4 Å²	34.4	2%	0.017	18%	0.184	C	C	.	.			trans	-142.5	143.3	-178.7	0	0	0	0	0	110	N337 G362 I364 V370	N337-A372 PolarHBondContact ND2-N 2.99Å; N337-A372 PolarHBondContact ND2-O 3.4Å; N337-A372 VanDerWaalsContact ND2-O 3.13Å; N337-A372 PolarHBondContact OD1-O 3.25Å; N337-A372 VanDerWaalsContact OD1-O 3.06Å; G362-A372 WeakPolarHBondContact O-CB 3.48Å; I364-A372 HydrophobicContact CG1-CB 4.13Å; V370-A372 HydrophobicContact CG2-CB 4.27Å; V370-A372 PolarHBondContact O-N 2.89Å
373	E	78.1	Confident	85.7	Confident	21 Å²	21	34.1 Å²	34.1	10%	0.098	18%	0.181	C	C	.	.			trans	-125.3	-9.7	178.6	-60.1	-177.5	-156.7	0	0	111.6	L122 Q137 T142 Q248	L122-E373 WeakPolarHBondContact CD2-OE2 3.47Å; Q137-E373 VanDerWaalsContact CD-CD 3.42Å; Q137-E373 PolarHBondContact NE2-OE1 3.13Å; Q137-E373 PolarHBondContact NE2-OE2 2.89Å; Q137-E373 PolarHBondContact OE1-OE2 3.2Å; Q137-E373 VanDerWaalsContact OE1-OE2 3.05Å; T142-E373 PolarHBondContact OG1-OE1 3.39Å; Q248-E373 PolarHBondContact NE2-O 3.05Å; Q248-E373 VanDerWaalsContact NE2-O 3.16Å
374	K	85.2	Confident	85.3	Confident	47 Å²	47	33.9 Å²	33.9	20%	0.204	18%	0.179	C	C	.	.			trans	-116.4	139.7	-175.2	-67.8	-174.9	178.7	147.6	0	113.3	E120 C358 E360 C363 I364	E120-K374 IonicContact OE2-NZ 2.74Å; E120-K374 PolarHBondContact OE2-NZ 2.6Å; C358-K374 HydrophobicContact CB-CB 3.96Å; C358-K374 WeakPolarHBondContact O-CD 3.37Å; E360-K374 HydrophobicContact CG-CD 4.2Å; E360-K374 VanDerWaalsContact OE1-CD 3.27Å; E360-K374 WeakPolarHBondContact OE1-CD 3.44Å; E360-K374 WeakPolarHBondContact OE1-CE 3.33Å; E360-K374 IonicContact OE1-NZ 2.81Å; E360-K374 PolarHBondContact OE1-NZ 3.17Å; C363-K374 WeakPolarHBondContact CA-O 3.26Å; I364-K374 PolarHBondContact N-O 3.42Å
375	F	89.6	Confident	84.8	Confident	15 Å²	15	39.8 Å²	39.8	7%	0.066	20%	0.204	C	C	.	.			trans	-80.9	152.8	164.8	-70.5	-65.9	0	0	0	110.7	Y246 Q248 L249 M349 C358 I364 M365	Y246-F375 HydrophobicContact CD1-CE2 4.43Å; Y246-F375 HydrophobicContact CE1-CE2 4.25Å; Y246-F375 HydrophobicContact CE1-CZ 4.11Å; Y246-F375 HydrophobicContact CE2-CE2 4.37Å; Y246-F375 AromaticContact CE2-CZ 4Å; Y246-F375 HydrophobicContact CE2-CZ 4Å; Y246-F375 AromaticContact CZ-CZ 3.75Å; Q248-F375 HydrophobicContact CG-CD2 3.97Å; Q248-F375 VanDerWaalsContact NE2-N 3.1Å; L249-F375 HydrophobicContact CD1-CD2 3.57Å; L249-F375 HydrophobicContact CD1-CE2 3.65Å; L249-F375 HydrophobicContact CD1-CG 4.32Å; L249-F375 HydrophobicContact CD1-CZ 4.4Å; L249-F375 HydrophobicContact CD2-CB 4.3Å; L249-F375 HydrophobicContact CD2-CD2 3.94Å; L249-F375 HydrophobicContact CD2-CG 4.38Å; L249-F375 HydrophobicContact CG-CD2 3.74Å; L249-F375 HydrophobicContact CG-CE2 4.17Å; M349-F375 HydrophobicContact CE-CD1 4.44Å; M349-F375 HydrophobicContact CE-CE1 4.22Å; M349-F375 HydrophobicContact CE-CZ 4.33Å; M349-F375 HydrophobicContact SD-CD1 3.68Å; M349-F375 HydrophobicContact SD-CE1 3.55Å; M349-F375 VanDerWaalsContact SD-CE1 3.55Å; M349-F375 HydrophobicContact SD-CG 4.42Å; M349-F375 HydrophobicContact SD-CZ 4.23Å; C358-F375 WeakPolarHBondContact CB-O 3.37Å; I364-F375 HydrophobicContact CB-CD1 3.85Å; I364-F375 HydrophobicContact CB-CE1 3.66Å; I364-F375 HydrophobicContact CB-CZ 4.28Å; I364-F375 HydrophobicContact CD1-CD1 4.15Å; I364-F375 HydrophobicContact CD1-CD2 4.09Å; I364-F375 HydrophobicContact CD1-CE1 3.9Å; I364-F375 HydrophobicContact CD1-CE2 3.8Å; I364-F375 HydrophobicContact CD1-CG 4.23Å; I364-F375 HydrophobicContact CD1-CZ 3.69Å; I364-F375 HydrophobicContact CG1-CE1 4.39Å; I364-F375 HydrophobicContact CG2-CD1 4.14Å; I364-F375 HydrophobicContact CG2-CE1 3.43Å; I364-F375 VanDerWaalsContact CG2-CE1 3.43Å; I364-F375 HydrophobicContact CG2-CZ 3.91Å; M365-F375 HydrophobicContact CG-CD1 4.01Å; M365-F375 HydrophobicContact CG-CE1 4.12Å; M365-F375 HydrophobicContact SD-CE1 4.09Å
376	T	87.6	Confident	84.3	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.018	21%	0.208	C	C	.	.			trans	-82.1	168.5	173.5	68.4	0	0	0	0	111.3	D352 C356 C358 C363 C378 S379 Y380	D352-T376 HydrophobicContact CB-CG2 4.23Å; D352-T376 WeakPolarHBondContact OD1-CB 3.22Å; D352-T376 WeakPolarHBondContact OD1-CG2 3.26Å; D352-T376 PolarHBondContact OD1-OG1 2.78Å; D352-T376 WeakPolarHBondContact OD2-CG2 3.32Å; C356-T376 HydrophobicContact CB-CG2 3.93Å; C358-T376 HydrophobicContact CB-CG2 3.95Å; C363-T376 HydrophobicContact CB-CG2 3.62Å; C363-T376 WeakPolarHBondContact SG-CG2 3.47Å; T376-C378 PolarHBondContact O-N 3.05Å; T376-C378 WeakPolarHBondContact OG1-CB 3.38Å; T376-C378 PolarHBondContact OG1-N 2.02Å; T376-S379 PolarHBondContact N-OG 3.49Å; T376-S379 PolarHBondContact O-N 3Å; T376-S379 PolarHBondContact OG1-N 2.88Å; T376-S379 VanDerWaalsContact OG1-N 3.09Å; T376-S379 PolarHBondContact OG1-OG 2.83Å; T376-Y380 PolarHBondContact O-N 3.01Å
377	N	81	Confident	83.9	Confident	96 Å²	96	38.1 Å²	38.1	51%	0.513	20%	0.196	S	C	.	.	H	α-helix	trans	-57	-32.5	166.1	61.7	-33.2	0	0	0	113.2	F357 A381	F357-N377 PolarHBondContact N-OD1 2.82Å; F357-N377 PolarHBondContact O-N 3.38Å; N377-A381 PolarHBondContact O-N 3.26Å; N377-A381 VanDerWaalsContact O-N 3.1Å
378	C	88.1	Confident	83.3	Confident	22 Å²	22	39.8 Å²	39.8	15%	0.149	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-50	175.7	-58.1	0	0	0	0	111.1	F355 C356 T376 Y380 A381 D382	F355-C378 VanDerWaalsContact CE2-SG 3.51Å; C356-C378 WeakPolarHBondContact CA-SG 3.35Å; C356-C378 HydrophobicContact CB-CB 3.81Å; C356-C378 WeakPolarHBondContact CB-SG 3.46Å; C356-C378 WeakPolarHBondContact SG-CB 3.37Å; C356-C378 CovalentContact SG-SG 2.04Å; C356-C378 PolarHBondContact SG-SG 3.45Å; T376-C378 PolarHBondContact O-N 3.05Å; T376-C378 WeakPolarHBondContact OG1-CB 3.38Å; T376-C378 PolarHBondContact OG1-N 2.02Å; C378-Y380 PolarHBondContact O-N 2.61Å; C378-A381 WeakPolarHBondContact O-CB 3.42Å; C378-A381 PolarHBondContact O-N 3.09Å; C378-D382 PolarHBondContact O-N 2.84Å
379	S	91	Very high	82.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-38	177.9	-27	0	0	0	0	110.9	D352 T376 D382 F383	D352-S379 PolarHBondContact OD1-OG 3.33Å; D352-S379 VanDerWaalsContact OD1-OG 3.13Å; T376-S379 PolarHBondContact N-OG 3.49Å; T376-S379 PolarHBondContact O-N 3Å; T376-S379 PolarHBondContact OG1-N 2.88Å; T376-S379 VanDerWaalsContact OG1-N 3.09Å; T376-S379 PolarHBondContact OG1-OG 2.83Å; S379-D382 PolarHBondContact O-N 3.37Å; S379-F383 VanDerWaalsContact O-CB 3.27Å; S379-F383 WeakPolarHBondContact O-CB 3.31Å; S379-F383 PolarHBondContact O-N 3.22Å
380	Y	85.6	Confident	82.3	Confident	85 Å²	85	40.6 Å²	40.6	33%	0.333	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-43.8	173.8	-174.7	-94.9	0	0	0	112.6	W204 L249 T376 C378 M384	W204-Y380 HydrophobicContact CZ3-CE1 4.35Å; W204-Y380 WeakPolarHBondContact CZ3-OH 3.44Å; L249-Y380 HydrophobicContact CD2-CD2 3.63Å; L249-Y380 HydrophobicContact CD2-CE2 4.36Å; T376-Y380 PolarHBondContact O-N 3.01Å; C378-Y380 PolarHBondContact O-N 2.61Å; Y380-M384 HydrophobicContact CD1-CG 4.01Å; Y380-M384 HydrophobicContact CE1-CG 3.61Å; Y380-M384 HydrophobicContact CE1-SD 4.43Å; Y380-M384 HydrophobicContact CE2-CG 4.34Å; Y380-M384 HydrophobicContact CE2-SD 4.5Å; Y380-M384 WeakPolarHBondContact O-CB 3.13Å; Y380-M384 VanDerWaalsContact O-CG 3.27Å; Y380-M384 WeakPolarHBondContact O-CG 3.12Å; Y380-M384 PolarHBondContact O-N 3.24Å
381	A	78.6	Confident	82.2	Confident	55 Å²	55	38.6 Å²	38.6	46%	0.455	20%	0.202	S	C	.	.	H	α-helix	trans	-64.4	-42.5	178.6	0	0	0	0	0	112.1	N377 C378 M384 K385	N377-A381 PolarHBondContact O-N 3.26Å; N377-A381 VanDerWaalsContact O-N 3.1Å; C378-A381 WeakPolarHBondContact O-CB 3.42Å; C378-A381 PolarHBondContact O-N 3.09Å; A381-M384 PolarHBondContact O-N 2.85Å; A381-K385 WeakPolarHBondContact O-CB 3.39Å; A381-K385 PolarHBondContact O-N 2.9Å
382	D	88.1	Confident	82.1	Confident	38 Å²	38	40.6 Å²	40.6	20%	0.203	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-44.4	177.1	-77.2	-17.5	0	0	0	112.5	G348 Q350 C378 S379 K385 T386	G348-D382 WeakPolarHBondContact O-CB 3.34Å; Q350-D382 PolarHBondContact N-OD2 3.44Å; Q350-D382 VanDerWaalsContact N-OD2 3.11Å; C378-D382 PolarHBondContact O-N 2.84Å; S379-D382 PolarHBondContact O-N 3.37Å; D382-K385 PolarHBondContact O-N 2.86Å; D382-T386 WeakPolarHBondContact O-CB 3.13Å; D382-T386 PolarHBondContact O-N 2.93Å; D382-T386 PolarHBondContact O-OG1 3.03Å
383	F	89.8	Confident	82.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-55	-57	172.5	169	-105.1	0	0	0	110.3	W208 L249 L347 M349 S379 K385 T386 T387	W208-F383 AromaticContact CD1-CE1 3.98Å; W208-F383 AromaticContact CD1-CZ 3.67Å; W208-F383 HydrophobicContact CG-CZ 4.03Å; W208-F383 AromaticContact NE1-CE1 3.87Å; W208-F383 AromaticContact NE1-CZ 3.91Å; L249-F383 HydrophobicContact CB-CD1 4.38Å; L249-F383 HydrophobicContact CB-CE1 4.09Å; L249-F383 HydrophobicContact CB-CZ 4.4Å; L249-F383 HydrophobicContact CD1-CD1 4.5Å; L249-F383 HydrophobicContact CD1-CD2 4.38Å; L249-F383 HydrophobicContact CD1-CG 4.3Å; L347-F383 HydrophobicContact CB-CD2 4.08Å; L347-F383 HydrophobicContact CD1-CD2 4.34Å; L347-F383 HydrophobicContact CD1-CE2 4.25Å; L347-F383 HydrophobicContact CD2-CD2 4.46Å; L347-F383 HydrophobicContact CD2-CE2 4.18Å; M349-F383 HydrophobicContact CE-CB 3.71Å; M349-F383 HydrophobicContact CE-CD2 3.89Å; M349-F383 HydrophobicContact CE-CG 4.04Å; M349-F383 HydrophobicContact CG-CB 4.28Å; S379-F383 VanDerWaalsContact O-CB 3.27Å; S379-F383 WeakPolarHBondContact O-CB 3.31Å; S379-F383 PolarHBondContact O-N 3.22Å; F383-K385 VanDerWaalsContact C-N 3.3Å; F383-K385 PolarHBondContact O-N 2.96Å; F383-T386 PolarHBondContact O-N 2.86Å; F383-T386 VanDerWaalsContact O-N 3.14Å; F383-T387 WeakPolarHBondContact CD2-OG1 3.09Å; F383-T387 WeakPolarHBondContact CE2-OG1 2.98Å; F383-T387 WeakPolarHBondContact O-CB 2.97Å; F383-T387 PolarHBondContact O-N 2.93Å; F383-T387 PolarHBondContact O-OG1 3.32Å
384	M	81	Confident	82.3	Confident	12 Å²	12	40.7 Å²	40.7	6%	0.059	22%	0.219	C	C	.	.	H	α-helix	trans	-57.1	-44.9	-179.1	-73.3	-57.7	-50.7	0	0	111.7	W204 Y380 A381 T386 L388	W204-M384 HydrophobicContact CD2-CE 4.23Å; W204-M384 HydrophobicContact CE3-CE 3.44Å; W204-M384 VanDerWaalsContact CE3-CE 3.44Å; W204-M384 HydrophobicContact CE3-SD 4.22Å; W204-M384 HydrophobicContact CH2-CE 3.92Å; W204-M384 HydrophobicContact CZ3-CE 3.26Å; W204-M384 HydrophobicContact CZ3-CG 4.19Å; W204-M384 HydrophobicContact CZ3-SD 3.78Å; Y380-M384 HydrophobicContact CD1-CG 4.01Å; Y380-M384 HydrophobicContact CE1-CG 3.61Å; Y380-M384 HydrophobicContact CE1-SD 4.43Å; Y380-M384 HydrophobicContact CE2-CG 4.34Å; Y380-M384 HydrophobicContact CE2-SD 4.5Å; Y380-M384 WeakPolarHBondContact O-CB 3.13Å; Y380-M384 VanDerWaalsContact O-CG 3.27Å; Y380-M384 WeakPolarHBondContact O-CG 3.12Å; Y380-M384 PolarHBondContact O-N 3.24Å; A381-M384 PolarHBondContact O-N 2.85Å; M384-T386 PolarHBondContact O-N 3.48Å; M384-L388 HydrophobicContact CE-CD1 3.84Å; M384-L388 HydrophobicContact CE-CD2 4.35Å; M384-L388 HydrophobicContact CE-CG 4.06Å; M384-L388 WeakPolarHBondContact O-CB 2.94Å; M384-L388 WeakPolarHBondContact O-CD1 3.48Å; M384-L388 WeakPolarHBondContact O-CG 3.26Å; M384-L388 PolarHBondContact O-N 3.02Å
385	K	81.6	Confident	81.8	Confident	134 Å²	134	41.3 Å²	41.3	58%	0.583	22%	0.223	S	C	*	.	H	α-helix	trans	-57.5	-49.4	177.1	178.3	-175	175.3	-171.4	0	111.6	A381 D382 F383 N389	A381-K385 WeakPolarHBondContact O-CB 3.39Å; A381-K385 PolarHBondContact O-N 2.9Å; D382-K385 PolarHBondContact O-N 2.86Å; F383-K385 VanDerWaalsContact C-N 3.3Å; F383-K385 PolarHBondContact O-N 2.96Å; K385-N389 WeakPolarHBondContact O-CB 3.37Å; K385-N389 PolarHBondContact O-N 3.37Å; K385-N389 PolarHBondContact O-ND2 2.84Å
386	T	84.1	Confident	80.6	Confident	14 Å²	14	43.1 Å²	43.1	9%	0.086	23%	0.233	C	C	.	.	H	α-helix	trans	-68.3	-49.2	-176.9	-57.5	0	0	0	0	110.8	A313 I315 L347 G348 D382 F383 M384 L388 N389 Q390	A313-T386 HydrophobicContact CB-CG2 3.81Å; I315-T386 HydrophobicContact CG2-CG2 3.98Å; L347-T386 VanDerWaalsContact O-CB 3.25Å; L347-T386 WeakPolarHBondContact O-CB 3.05Å; G348-T386 WeakPolarHBondContact CA-OG1 3.2Å; D382-T386 WeakPolarHBondContact O-CB 3.13Å; D382-T386 PolarHBondContact O-N 2.93Å; D382-T386 PolarHBondContact O-OG1 3.03Å; F383-T386 PolarHBondContact O-N 2.86Å; F383-T386 VanDerWaalsContact O-N 3.14Å; M384-T386 PolarHBondContact O-N 3.48Å; T386-L388 VanDerWaalsContact C-N 3.33Å; T386-L388 PolarHBondContact O-N 2.88Å; T386-N389 PolarHBondContact O-N 3.02Å; T386-N389 VanDerWaalsContact O-N 3.17Å; T386-Q390 HydrophobicContact CG2-CG 4.08Å; T386-Q390 VanDerWaalsContact O-CG 3.25Å; T386-Q390 WeakPolarHBondContact O-CG 3.23Å; T386-Q390 PolarHBondContact O-N 2.92Å
387	T	79.6	Confident	79.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-35.9	-176.3	-44.9	0	0	0	0	112.2	W208 F383 G391 L394	W208-T387 HydrophobicContact CD2-CG2 3.67Å; W208-T387 HydrophobicContact CE3-CG2 3.3Å; W208-T387 HydrophobicContact CH2-CG2 3.26Å; W208-T387 HydrophobicContact CZ2-CG2 3.66Å; W208-T387 HydrophobicContact CZ3-CG2 3.06Å; F383-T387 WeakPolarHBondContact CD2-OG1 3.09Å; F383-T387 WeakPolarHBondContact CE2-OG1 2.98Å; F383-T387 WeakPolarHBondContact O-CB 2.97Å; F383-T387 PolarHBondContact O-N 2.93Å; F383-T387 PolarHBondContact O-OG1 3.32Å; T387-G391 WeakPolarHBondContact O-CA 3.14Å; T387-G391 PolarHBondContact O-N 2.91Å; T387-L394 HydrophobicContact CG2-CD1 3.69Å
388	L	71	Confident	78	Confident	67 Å²	67	41.9 Å²	41.9	35%	0.351	23%	0.231	S	C	.	.	H	α-helix	trans	-68.8	-33	174.6	-69.8	170	0	0	0	113.2	D202 M384 T386	D202-L388 WeakPolarHBondContact OD1-CD1 3.4Å; M384-L388 HydrophobicContact CE-CD1 3.84Å; M384-L388 HydrophobicContact CE-CD2 4.35Å; M384-L388 HydrophobicContact CE-CG 4.06Å; M384-L388 WeakPolarHBondContact O-CB 2.94Å; M384-L388 WeakPolarHBondContact O-CD1 3.48Å; M384-L388 WeakPolarHBondContact O-CG 3.26Å; M384-L388 PolarHBondContact O-N 3.02Å; T386-L388 VanDerWaalsContact C-N 3.33Å; T386-L388 PolarHBondContact O-N 2.88Å
389	N	70.9	Confident	76.3	Confident	119 Å²	119	48.9 Å²	48.9	64%	0.636	25%	0.254	S	S	*	.	H	α-helix	trans	-82.5	-37.3	-177.1	-71.4	-23.7	0	0	0	113.4	K385 T386	K385-N389 WeakPolarHBondContact O-CB 3.37Å; K385-N389 PolarHBondContact O-N 3.37Å; K385-N389 PolarHBondContact O-ND2 2.84Å; T386-N389 PolarHBondContact O-N 3.02Å; T386-N389 VanDerWaalsContact O-N 3.17Å
390	Q	76.6	Confident	74.2	Confident	32 Å²	32	54.3 Å²	54.3	15%	0.15	28%	0.282	C	S	.	.	H	α-helix	trans	-144.2	1.2	-170.6	61.1	-178	81.3	0	0	114.8	A313 I315 C316 R317 T386 S392	A313-Q390 PolarHBondContact O-NE2 3.34Å; I315-Q390 PolarHBondContact O-NE2 2.79Å; C316-Q390 WeakPolarHBondContact CB-O 3.27Å; R317-Q390 VanDerWaalsContact NH1-NE2 3.19Å; R317-Q390 VanDerWaalsContact NH2-OE1 3.1Å; T386-Q390 HydrophobicContact CG2-CG 4.08Å; T386-Q390 VanDerWaalsContact O-CG 3.25Å; T386-Q390 WeakPolarHBondContact O-CG 3.23Å; T386-Q390 PolarHBondContact O-N 2.92Å; Q390-S392 PolarHBondContact O-N 3.24Å
391	G	75.3	Confident	72.1	Confident	1 Å²	1	53 Å²	53	1%	0.01	29%	0.294	C	S	.	.			trans	-80	31.3	-175.8	0	0	0	0	0	115.1	T387 C393 L394	T387-G391 WeakPolarHBondContact O-CA 3.14Å; T387-G391 PolarHBondContact O-N 2.91Å; G391-C393 PolarHBondContact O-N 3.4Å; G391-L394 WeakPolarHBondContact O-CB 3.36Å; G391-L394 PolarHBondContact O-N 3.02Å
392	S	78.6	Confident	70.2	Confident	88 Å²	88	56.6 Å²	56.6	62%	0.615	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-63.5	-27	-172.1	56.4	0	0	0	0	114	Q390 L394	Q390-S392 PolarHBondContact O-N 3.24Å; S392-L394 PolarHBondContact O-N 2.85Å
393	C	83.7	Confident	67.8	Low	25 Å²	25	57.2 Å²	57.2	17%	0.169	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-71.2	-17	176.7	71.8	0	0	0	0	113.2	D293 C316 G391 H395 N396	D293-C393 VanDerWaalsContact OD1-CB 3.22Å; D293-C393 WeakPolarHBondContact OD1-CB 3.28Å; D293-C393 PolarHBondContact OD1-SG 2.8Å; D293-C393 VanDerWaalsContact OD1-SG 3.32Å; C316-C393 VanDerWaalsContact CA-SG 3.52Å; C316-C393 HydrophobicContact CB-CB 3.84Å; C316-C393 WeakPolarHBondContact CB-SG 3.28Å; C316-C393 WeakPolarHBondContact SG-CB 3.25Å; C316-C393 PolarHBondContact SG-N 3.13Å; C316-C393 CovalentContact SG-SG 2.02Å; C316-C393 PolarHBondContact SG-SG 3.22Å; G391-C393 PolarHBondContact O-N 3.4Å; C393-H395 VanDerWaalsContact C-N 3.27Å; C393-H395 PolarHBondContact O-N 3.44Å; C393-N396 PolarHBondContact O-OD1 2.86Å
394	L	82.6	Confident	65.5	Low	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-85.8	2.1	-179.3	-61.3	173.8	0	0	0	113.7	W208 F209 L210 D293 I315 L347 T387 G391 S392	W208-L394 WeakPolarHBondContact CA-O 3.3Å; W208-L394 HydrophobicContact CB-CB 4.42Å; W208-L394 HydrophobicContact CE3-CB 3.77Å; W208-L394 HydrophobicContact CZ3-CB 4.46Å; F209-L394 PolarHBondContact N-O 2.94Å; F209-L394 VanDerWaalsContact O-CA 3.24Å; F209-L394 WeakPolarHBondContact O-CA 3.36Å; F209-L394 WeakPolarHBondContact O-CD2 3.38Å; L210-L394 HydrophobicContact CB-CD2 3.81Å; L210-L394 HydrophobicContact CD1-CD2 4.38Å; L210-L394 HydrophobicContact CG-CD2 3.91Å; D293-L394 HydrophobicContact CB-CD2 4.06Å; I315-L394 HydrophobicContact CD1-CD1 4.47Å; I315-L394 HydrophobicContact CD1-CD2 4.16Å; I315-L394 HydrophobicContact CG1-CD1 3.79Å; I315-L394 HydrophobicContact CG1-CD2 4.25Å; I315-L394 HydrophobicContact CG1-CG 4.12Å; L347-L394 HydrophobicContact CD2-CD1 3.76Å; T387-L394 HydrophobicContact CG2-CD1 3.69Å; G391-L394 WeakPolarHBondContact O-CB 3.36Å; G391-L394 PolarHBondContact O-N 3.02Å; S392-L394 PolarHBondContact O-N 2.85Å
395	H	72.8	Confident	63.4	Low	61 Å²	61	67.9 Å²	67.9	28%	0.282	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-93.4	-17.5	-175	-70.1	-51.9	0	0	0	114.2	T205 W208 C393 P397	T205-H395 WeakPolarHBondContact CG2-ND1 3.49Å; W208-H395 AromaticContact CE3-CE1 3.88Å; W208-H395 AromaticContact CE3-ND1 3.73Å; W208-H395 AromaticContact CH2-CE1 3.39Å; W208-H395 WeakPolarHBondContact CH2-CE1 3.43Å; W208-H395 AromaticContact CZ3-CE1 2.96Å; W208-H395 WeakPolarHBondContact CZ3-CE1 3.08Å; W208-H395 AromaticContact CZ3-ND1 3.28Å; W208-H395 VanDerWaalsContact CZ3-ND1 3.28Å; W208-H395 WeakPolarHBondContact CZ3-ND1 3.41Å; W208-H395 AromaticContact CZ3-NE2 3.72Å; C393-H395 VanDerWaalsContact C-N 3.27Å; C393-H395 PolarHBondContact O-N 3.44Å; H395-P397 VanDerWaalsContact O-CD 3.23Å; H395-P397 WeakPolarHBondContact O-CD 3.36Å
396	N	65.3	Low	61.5	Low	53 Å²	53	67.8 Å²	67.8	28%	0.283	36%	0.359	S	S	.	.	S	Bend	trans	-79	114.5	177.3	33.2	-69	0	0	0	109.3	F209 E211 C393	F209-N396 WeakPolarHBondContact CB-O 3.27Å; E211-N396 PolarHBondContact OE1-ND2 2.81Å; C393-N396 PolarHBondContact O-OD1 2.86Å
397	P	60.6	Low	60	Low	66 Å²	66	74.8 Å²	74.8	43%	0.429	39%	0.388	S	S	.	.			trans	-57.3	136.3	160.3	25.2	-31.4	0	0	0	108.1	F209 H395 R399	F209-P397 VanDerWaalsContact CD2-CA 3.41Å; F209-P397 HydrophobicContact CD2-CB 4.02Å; F209-P397 HydrophobicContact CE1-CB 4.31Å; F209-P397 HydrophobicContact CE2-CB 3.64Å; F209-P397 HydrophobicContact CE2-CG 4.4Å; F209-P397 HydrophobicContact CG-CB 4.49Å; F209-P397 HydrophobicContact CZ-CB 3.79Å; H395-P397 VanDerWaalsContact O-CD 3.23Å; H395-P397 WeakPolarHBondContact O-CD 3.36Å; P397-R399 PolarHBondContact O-N 3.43Å
398	P	54.5	Low	59.2	Low	7 Å²	7	83.6 Å²	83.6	5%	0.045	42%	0.421	C	S	.	.			trans	-55.2	130	175.7	24.9	-35.2	0	0	0	107.5	I254 L400 I403	I254-P398 HydrophobicContact CD1-CB 4.26Å; I254-P398 HydrophobicContact CD1-CG 3.55Å; I254-P398 HydrophobicContact CG1-CG 4.22Å; P398-L400 PolarHBondContact O-N 3.24Å; P398-I403 HydrophobicContact CB-CD1 3.82Å
399	R	51.9	Low	59.1	Low	169 Å²	169	82.4 Å²	82.4	64%	0.638	42%	0.418	S	S	*	.			trans	-72.2	80.9	179.8	-61.3	-169.4	-175	177.5	3.6	109.2	P397 G401 E402 I403	P397-R399 PolarHBondContact O-N 3.43Å; R399-G401 PolarHBondContact O-N 3.38Å; R399-E402 HydrophobicContact CB-CB 3.86Å; R399-E402 WeakPolarHBondContact CD-OE2 3.44Å; R399-E402 IonicContact CZ-OE2 2.94Å; R399-E402 IonicContact NE-OE2 3.54Å; R399-E402 IonicContact NH1-OE2 2.6Å; R399-E402 PolarHBondContact NH1-OE2 2.98Å; R399-E402 PolarHBondContact O-N 2.83Å; R399-I403 HydrophobicContact CB-CG1 4.45Å; R399-I403 WeakPolarHBondContact O-CD1 3.3Å; R399-I403 WeakPolarHBondContact O-CG1 3.39Å; R399-I403 PolarHBondContact O-N 3.25Å
400	L	45.9	Very low	58.9	Low	113 Å²	113	78.2 Å²	78.2	59%	0.592	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-9.4	-176.3	-66.4	155	0	0	0	114.7	L81 P398	L81-L400 HydrophobicContact CD2-CD1 3.34Å; L81-L400 HydrophobicContact CD2-CD2 4.09Å; L81-L400 HydrophobicContact CD2-CG 4.21Å; P398-L400 PolarHBondContact O-N 3.24Å
401	G	41.9	Very low	58.2	Low	57 Å²	57	79.1 Å²	79.1	59%	0.588	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-1.6	172.2	0	0	0	0	0	115.8	R399	R399-G401 PolarHBondContact O-N 3.38Å
402	E	38.4	Very low	57.7	Low	132 Å²	132	81.1 Å²	81.1	62%	0.617	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	2.8	174.9	-63.9	-173.7	169.2	0	0	113.4	R399 F404	R399-E402 HydrophobicContact CB-CB 3.86Å; R399-E402 WeakPolarHBondContact CD-OE2 3.44Å; R399-E402 IonicContact CZ-OE2 2.94Å; R399-E402 IonicContact NE-OE2 3.54Å; R399-E402 IonicContact NH1-OE2 2.6Å; R399-E402 PolarHBondContact NH1-OE2 2.98Å; R399-E402 PolarHBondContact O-N 2.83Å; E402-F404 PolarHBondContact O-N 2.63Å
403	I	38.9	Very low	57.2	Low	50 Å²	50	80.5 Å²	80.5	26%	0.256	42%	0.421	S	S	.	.	S	Bend	trans	-72.7	87.4	166.1	-66.1	160	0	0	0	106.6	P398 R399	P398-I403 HydrophobicContact CB-CD1 3.82Å; R399-I403 HydrophobicContact CB-CG1 4.45Å; R399-I403 WeakPolarHBondContact O-CD1 3.3Å; R399-I403 WeakPolarHBondContact O-CG1 3.39Å; R399-I403 PolarHBondContact O-N 3.25Å
404	F	41.1	Very low	56.6	Low	153 Å²	153	81.8 Å²	81.8	67%	0.671	43%	0.428	S	S	*	.			trans	46.8	68.4	172	-60.5	-83	0	0	0	115.2	E402 L406	E402-F404 PolarHBondContact O-N 2.63Å; F404-L406 PolarHBondContact O-N 3.4Å
405	M	36.6	Very low	56.2	Low	84 Å²	84	83.3 Å²	83.3	41%	0.414	44%	0.435	S	S	.	.			trans	-72.2	84.6	156.6	-68.2	-70.5	-72.5	0	0	108.4	K407 N411 V413	M405-K407 PolarHBondContact O-N 3.36Å; M405-K407 VanDerWaalsContact O-N 3.12Å; M405-N411 WeakPolarHBondContact CE-ND2 3.43Å; M405-V413 HydrophobicContact CE-CB 4.46Å
406	L	40.9	Very low	55.8	Low	132 Å²	132	92.7 Å²	92.7	69%	0.691	47%	0.468	S	S	*	.			trans	-62.4	109.6	154.4	-91	153.8	0	0	0	105.9	F404 R408	F404-L406 PolarHBondContact O-N 3.4Å; L406-R408 WeakPolarHBondContact O-CB 3.48Å; L406-R408 PolarHBondContact O-N 2.95Å
407	K	52.3	Low	56.3	Low	161 Å²	161	98.5 Å²	98.5	70%	0.7	49%	0.494	S	S	*	.			trans	-47.1	113.8	173.6	-61.6	175.8	-177.6	176.3	0	108.3	M405 E415	M405-K407 PolarHBondContact O-N 3.36Å; M405-K407 VanDerWaalsContact O-N 3.12Å; K407-E415 WeakPolarHBondContact CA-OE2 3.33Å
408	R	62.9	Low	57.4	Low	186 Å²	186	96.8 Å²	96.8	70%	0.702	48%	0.48	S	S	*	.			trans	-159.1	116.1	-170.9	-175.3	-178.1	178.4	-178.6	1.3	110.7	L406 G410 N411 E415	L406-R408 WeakPolarHBondContact O-CB 3.48Å; L406-R408 PolarHBondContact O-N 2.95Å; R408-G410 PolarHBondContact O-N 2.95Å; R408-N411 PolarHBondContact O-ND2 2.97Å; R408-E415 PolarHBondContact N-OE2 3.15Å
409	C	68.8	Low	58.8	Low	42 Å²	42	101.6 Å²	101.6	28%	0.284	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	124	167.8	175	0	0	0	0	113.4	E418 L436 C438	C409-E418 WeakPolarHBondContact CA-OE1 3.3Å; C409-E418 WeakPolarHBondContact CB-OE1 3.36Å; C409-E418 PolarHBondContact N-OE1 3.3Å; C409-L436 PolarHBondContact SG-O 3.49Å; C409-C438 WeakPolarHBondContact CA-SG 3.4Å; C409-C438 HydrophobicContact CB-CB 3.67Å; C409-C438 WeakPolarHBondContact CB-SG 3.07Å; C409-C438 WeakPolarHBondContact SG-CB 3.23Å; C409-C438 PolarHBondContact SG-N 2.92Å; C409-C438 CovalentContact SG-SG 2.02Å; C409-C438 PolarHBondContact SG-SG 2.93Å
410	G	67.1	Low	60.4	Low	31 Å²	31	93.6 Å²	93.6	32%	0.32	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.9	14.7	175.3	0	0	0	0	0	114.1	R408 D421 G423 C438	R408-G410 PolarHBondContact O-N 2.95Å; G410-D421 VanDerWaalsContact CA-OD1 3.28Å; G410-D421 WeakPolarHBondContact CA-OD1 3.36Å; G410-D421 WeakPolarHBondContact CA-OD2 3.41Å; G410-D421 PolarHBondContact N-OD1 3.34Å; G410-D421 PolarHBondContact N-OD2 2.56Å; G410-G423 CarbonylContact C-O 3.59Å; G410-G423 WeakPolarHBondContact CA-O 3.37Å; G410-G423 CarbonylContact O-C 3.46Å; G410-G423 WeakPolarHBondContact O-CA 3.44Å; G410-C438 PolarHBondContact N-SG 3.24Å
411	N	62.9	Low	62.1	Low	51 Å²	51	89.2 Å²	89.2	27%	0.273	45%	0.449	S	S	.	.	S	Bend	trans	-96.8	-2.3	177	71.7	12.5	0	0	0	112.6	M405 R408 V413 E415 D421	M405-N411 WeakPolarHBondContact CE-ND2 3.43Å; R408-N411 PolarHBondContact O-ND2 2.97Å; N411-V413 WeakPolarHBondContact OD1-CB 3.37Å; N411-V413 PolarHBondContact OD1-N 2.79Å; N411-V413 PolarHBondContact OD1-O 2.87Å; N411-E415 PolarHBondContact ND2-OE1 3.06Å; N411-D421 PolarHBondContact N-OD2 3.44Å; N411-D421 PolarHBondContact OD1-OD2 3.12Å
412	G	63.4	Low	63.8	Low	43 Å²	43	87.5 Å²	87.5	44%	0.443	43%	0.428	S	S	.	.	S	Bend	trans	79.7	12.1	179.1	0	0	0	0	0	114.4	D421	G412-D421 VanDerWaalsContact CA-CG 3.48Å; G412-D421 WeakPolarHBondContact CA-OD1 3.5Å; G412-D421 PolarHBondContact N-OD1 2.97Å; G412-D421 PolarHBondContact N-OD2 3.04Å
413	V	69.3	Low	65.3	Low	74 Å²	74	81.6 Å²	81.6	45%	0.448	40%	0.403	S	S	.	.			trans	-124.1	116.4	-179.9	-177.9	0	0	0	0	109.7	M405 N411 E415	M405-V413 HydrophobicContact CE-CB 4.46Å; N411-V413 WeakPolarHBondContact OD1-CB 3.37Å; N411-V413 PolarHBondContact OD1-N 2.79Å; N411-V413 PolarHBondContact OD1-O 2.87Å; V413-E415 PolarHBondContact O-N 3.43Å; V413-E415 VanDerWaalsContact O-N 3.14Å
414	V	70.6	Confident	66.8	Low	52 Å²	52	81.9 Å²	81.9	32%	0.315	41%	0.409	S	S	.	.			trans	-72.8	111.9	-178.9	-172.2	0	0	0	0	111.1	E418 D421 F448	V414-E418 HydrophobicContact CG1-CB 4.13Å; V414-E418 WeakPolarHBondContact CG1-O 3.48Å; V414-D421 HydrophobicContact CG2-CB 4.17Å; V414-F448 HydrophobicContact CB-CE1 4.27Å; V414-F448 HydrophobicContact CB-CZ 4.03Å; V414-F448 HydrophobicContact CG1-CE1 4.26Å; V414-F448 HydrophobicContact CG1-CZ 4.14Å; V414-F448 HydrophobicContact CG2-CD1 4.02Å; V414-F448 HydrophobicContact CG2-CE1 3.55Å; V414-F448 HydrophobicContact CG2-CE2 4.31Å; V414-F448 HydrophobicContact CG2-CZ 3.7Å
415	E	74.6	Confident	68.2	Low	32 Å²	32	80 Å²	80	15%	0.15	41%	0.405	C	S	.	.			trans	-91.9	170.4	179.1	-67.9	145.5	-179.1	0	0	111.7	K407 R408 N411 V413 E417 E418	K407-E415 WeakPolarHBondContact CA-OE2 3.33Å; R408-E415 PolarHBondContact N-OE2 3.15Å; N411-E415 PolarHBondContact ND2-OE1 3.06Å; V413-E415 PolarHBondContact O-N 3.43Å; V413-E415 VanDerWaalsContact O-N 3.14Å; E415-E417 PolarHBondContact O-N 3.42Å; E415-E418 HydrophobicContact CB-CG 4.36Å; E415-E418 PolarHBondContact O-N 3.37Å
416	R	64.3	Low	70	Confident	259 Å²	259	83 Å²	83	98%	0.977	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.1	-171.8	-72.6	-172.1	-178.6	172.6	1.5	114.9
417	E	75.4	Confident	71.4	Confident	174 Å²	174	82 Å²	82	81%	0.813	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-6.5	-179.6	-66.8	175.7	-154.9	0	0	112.7	E415	E415-E417 PolarHBondContact O-N 3.42Å
418	E	83.3	Confident	72.6	Confident	30 Å²	30	74.4 Å²	74.4	14%	0.14	38%	0.376	C	S	.	.			trans	-103.5	148.6	-176	-59.8	-176.1	171.7	0	0	111.2	C409 V414 E415 C438	C409-E418 WeakPolarHBondContact CA-OE1 3.3Å; C409-E418 WeakPolarHBondContact CB-OE1 3.36Å; C409-E418 PolarHBondContact N-OE1 3.3Å; V414-E418 HydrophobicContact CG1-CB 4.13Å; V414-E418 WeakPolarHBondContact CG1-O 3.48Å; E415-E418 HydrophobicContact CB-CG 4.36Å; E415-E418 PolarHBondContact O-N 3.37Å; E418-C438 HydrophobicContact CB-CB 4Å; E418-C438 HydrophobicContact CG-CB 3.84Å
419	Q	85.3	Confident	73.4	Confident	109 Å²	109	71.7 Å²	71.7	51%	0.509	37%	0.372	S	S	.	.	S	Bend	trans	-98.2	-22.8	176.1	-59.3	-178.5	-21.8	0	0	112.4	C438 L440	Q419-C438 PolarHBondContact N-O 3.45Å; Q419-L440 HydrophobicContact CB-CD1 4.35Å; Q419-L440 HydrophobicContact CB-CG 3.97Å
420	C	84.5	Confident	74	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.007	40%	0.396	C	S	.	.			trans	-162.6	156.1	177.2	60.9	0	0	0	0	108.9	C434 C438 T439 L440 A447	C420-C434 HydrophobicContact CB-CB 3.77Å; C420-C434 WeakPolarHBondContact CB-SG 3.38Å; C420-C434 PolarHBondContact O-SG 2.83Å; C420-C434 WeakPolarHBondContact SG-CA 3.35Å; C420-C434 WeakPolarHBondContact SG-CB 3.43Å; C420-C434 CovalentContact SG-SG 2.03Å; C420-C434 PolarHBondContact SG-SG 3.49Å; C420-C438 PolarHBondContact N-O 2.73Å; C420-C438 CarbonylContact O-C 3.53Å; C420-C438 WeakPolarHBondContact O-CA 3.45Å; C420-C438 WeakPolarHBondContact O-CB 3.34Å; C420-T439 PolarHBondContact SG-O 2.82Å; C420-L440 HydrophobicContact CB-CD2 3.98Å; C420-A447 HydrophobicContact CB-CB 3.64Å
421	D	81.5	Confident	74.8	Confident	21 Å²	21	78.6 Å²	78.6	11%	0.112	39%	0.393	C	S	.	.			trans	-140.2	115.3	169.6	-168.6	-27.1	0	0	0	108.2	G410 N411 G412 V414 G423	G410-D421 VanDerWaalsContact CA-OD1 3.28Å; G410-D421 WeakPolarHBondContact CA-OD1 3.36Å; G410-D421 WeakPolarHBondContact CA-OD2 3.41Å; G410-D421 PolarHBondContact N-OD1 3.34Å; G410-D421 PolarHBondContact N-OD2 2.56Å; N411-D421 PolarHBondContact N-OD2 3.44Å; N411-D421 PolarHBondContact OD1-OD2 3.12Å; G412-D421 VanDerWaalsContact CA-CG 3.48Å; G412-D421 WeakPolarHBondContact CA-OD1 3.5Å; G412-D421 PolarHBondContact N-OD1 2.97Å; G412-D421 PolarHBondContact N-OD2 3.04Å; V414-D421 HydrophobicContact CG2-CB 4.17Å; D421-G423 WeakPolarHBondContact OD1-CA 3.13Å; D421-G423 PolarHBondContact OD1-N 3.03Å
422	C	77.1	Confident	76	Confident	20 Å²	20	79.9 Å²	79.9	14%	0.135	41%	0.41	C	S	.	.			trans	-90.9	-3.4	-176.9	41.6	0	0	0	0	112.6	Q427 C428 D431 C434	C422-Q427 VanDerWaalsContact O-CB 3.22Å; C422-Q427 WeakPolarHBondContact O-CB 3.29Å; C422-C428 HydrophobicContact CB-CB 3.69Å; C422-C428 WeakPolarHBondContact CB-SG 3.45Å; C422-C428 WeakPolarHBondContact SG-CB 3.35Å; C422-C428 CovalentContact SG-SG 2Å; C422-C428 PolarHBondContact SG-SG 3.37Å; C422-D431 HydrophobicContact CB-CB 4.01Å; C422-C434 HydrophobicContact CB-CB 3.93Å
423	G	70.3	Confident	77.4	Confident	9 Å²	9	78.5 Å²	78.5	9%	0.093	39%	0.394	C	S	.	.			trans	84.6	-139.5	-174.9	0	0	0	0	0	112.8	G410 D421	G410-G423 CarbonylContact C-O 3.59Å; G410-G423 WeakPolarHBondContact CA-O 3.37Å; G410-G423 CarbonylContact O-C 3.46Å; G410-G423 WeakPolarHBondContact O-CA 3.44Å; D421-G423 WeakPolarHBondContact OD1-CA 3.13Å; D421-G423 PolarHBondContact OD1-N 3.03Å
424	S	70.4	Confident	78.4	Confident	55 Å²	55	75 Å²	75	39%	0.385	37%	0.373	S	S	.	.	S	Bend	trans	-63.4	162.8	-173.3	68.5	0	0	0	0	113.1	Q426 Q427 C428	S424-Q426 PolarHBondContact O-N 3.03Å; S424-Q426 VanDerWaalsContact O-N 3.15Å; S424-Q427 WeakPolarHBondContact O-CB 3.22Å; S424-Q427 PolarHBondContact O-N 3.2Å; S424-Q427 WeakPolarHBondContact OG-CG 3.11Å; S424-Q427 PolarHBondContact OG-OE1 2.95Å; S424-C428 PolarHBondContact O-N 3.15Å
425	I	71.3	Confident	79.2	Confident	114 Å²	114	75 Å²	75	59%	0.585	37%	0.371	S	S	*	.	H	α-helix	trans	-50.3	-44.6	179.4	-64.5	174.2	0	0	0	111.6	Q427 C428 E429 L436	I425-Q427 PolarHBondContact O-N 3.32Å; I425-C428 PolarHBondContact O-N 2.99Å; I425-E429 WeakPolarHBondContact O-CG 3.24Å; I425-E429 PolarHBondContact O-N 3.32Å; I425-L436 VanDerWaalsContact CA-CD2 3.5Å; I425-L436 HydrophobicContact CB-CD2 3.94Å; I425-L436 HydrophobicContact CG1-CD2 4.09Å; I425-L436 HydrophobicContact CG2-CD2 3.74Å
426	Q	73.5	Confident	79.5	Confident	146 Å²	146	77.9 Å²	77.9	68%	0.682	39%	0.387	S	S	*	.	H	α-helix	trans	-67.2	-36.2	-179.8	-67.1	179.9	-5.9	0	0	113.1	S424	S424-Q426 PolarHBondContact O-N 3.03Å; S424-Q426 VanDerWaalsContact O-N 3.15Å
427	Q	71.1	Confident	80.5	Confident	113 Å²	113	70.1 Å²	70.1	53%	0.528	36%	0.364	S	S	.	.	H	α-helix	trans	-68.8	-41	176.9	-70.4	168.9	-38.3	0	0	110.3	C422 S424 I425 Q430 D431	C422-Q427 VanDerWaalsContact O-CB 3.22Å; C422-Q427 WeakPolarHBondContact O-CB 3.29Å; S424-Q427 WeakPolarHBondContact O-CB 3.22Å; S424-Q427 PolarHBondContact O-N 3.2Å; S424-Q427 WeakPolarHBondContact OG-CG 3.11Å; S424-Q427 PolarHBondContact OG-OE1 2.95Å; I425-Q427 PolarHBondContact O-N 3.32Å; Q427-Q430 PolarHBondContact O-N 3.23Å; Q427-D431 PolarHBondContact O-N 2.8Å; Q427-D431 VanDerWaalsContact O-N 3.09Å
428	C	77.9	Confident	80.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-71.8	-30.7	179.2	-144	0	0	0	0	114.6	C422 S424 I425 Q430 D431 L435 L436 R441	C422-C428 HydrophobicContact CB-CB 3.69Å; C422-C428 WeakPolarHBondContact CB-SG 3.45Å; C422-C428 WeakPolarHBondContact SG-CB 3.35Å; C422-C428 CovalentContact SG-SG 2Å; C422-C428 PolarHBondContact SG-SG 3.37Å; S424-C428 PolarHBondContact O-N 3.15Å; I425-C428 PolarHBondContact O-N 2.99Å; C428-Q430 PolarHBondContact O-N 3.19Å; C428-D431 PolarHBondContact O-N 2.95Å; C428-L435 PolarHBondContact SG-O 2.96Å; C428-L435 VanDerWaalsContact SG-O 3.33Å; C428-L436 HydrophobicContact CB-CD2 3.57Å; C428-L436 HydrophobicContact CB-CG 4.14Å; C428-L436 PolarHBondContact SG-N 3.12Å; C428-R441 PolarHBondContact O-NH2 3.44Å; C428-R441 VanDerWaalsContact O-NH2 3.12Å
429	E	79.8	Confident	81.2	Confident	129 Å²	129	62.5 Å²	62.5	60%	0.603	33%	0.332	S	S	*	.	H	α-helix	trans	-60	-32.3	172.3	-80.7	-179.9	170.9	0	0	111.9	I425	I425-E429 WeakPolarHBondContact O-CG 3.24Å; I425-E429 PolarHBondContact O-N 3.32Å
430	Q	80.5	Confident	81.5	Confident	173 Å²	173	59.2 Å²	59.2	81%	0.808	32%	0.318	S	S	*	.	H	α-helix	trans	-91.2	-12.6	178.1	-61.8	179.9	12.5	0	0	113.4	Q427 C428 A432	Q427-Q430 PolarHBondContact O-N 3.23Å; C428-Q430 PolarHBondContact O-N 3.19Å; Q430-A432 PolarHBondContact O-N 3.37Å
431	D	83.5	Confident	81.8	Confident	45 Å²	45	62.9 Å²	62.9	24%	0.241	33%	0.331	C	S	.	.			trans	-75.5	123.9	-179.4	-166.3	-65.6	0	0	0	111.4	C422 Q427 C428 C433 C434 R441	C422-D431 HydrophobicContact CB-CB 4.01Å; Q427-D431 PolarHBondContact O-N 2.8Å; Q427-D431 VanDerWaalsContact O-N 3.09Å; C428-D431 PolarHBondContact O-N 2.95Å; D431-C433 VanDerWaalsContact C-N 3.31Å; D431-C433 PolarHBondContact O-N 3.35Å; D431-C433 WeakPolarHBondContact OD1-CA 3.4Å; D431-C433 PolarHBondContact OD1-N 3.45Å; D431-C434 HydrophobicContact CB-CB 4.48Å; D431-C434 PolarHBondContact OD1-N 3.14Å; D431-R441 VanDerWaalsContact O-CZ 3.24Å; D431-R441 PolarHBondContact O-NE 3.11Å; D431-R441 PolarHBondContact O-NH2 2.93Å
432	A	88.8	Confident	82.2	Confident	78 Å²	78	68 Å²	68	65%	0.645	37%	0.366	S	S	*	.	S	Bend	trans	-78.2	-12.4	-176.4	0	0	0	0	0	114.1	Q430 R441 C455	Q430-A432 PolarHBondContact O-N 3.37Å; A432-R441 WeakPolarHBondContact O-CD 3.22Å; A432-C455 VanDerWaalsContact C-SG 3.55Å; A432-C455 PolarHBondContact O-SG 3.16Å; A432-C455 VanDerWaalsContact O-SG 3.39Å
433	C	91.8	Very high	82.7	Confident	14 Å²	14	70.8 Å²	70.8	10%	0.095	40%	0.398	C	S	.	.	S	Bend	trans	-121.2	-25.5	-170	-47.6	0	0	0	0	113.5	D431 L440 R441 A444 A447 C455	D431-C433 VanDerWaalsContact C-N 3.31Å; D431-C433 PolarHBondContact O-N 3.35Å; D431-C433 WeakPolarHBondContact OD1-CA 3.4Å; D431-C433 PolarHBondContact OD1-N 3.45Å; C433-L440 WeakPolarHBondContact O-CA 3.16Å; C433-R441 PolarHBondContact O-N 2.77Å; C433-A444 HydrophobicContact CB-CB 4.34Å; C433-A447 HydrophobicContact CB-CB 3.67Å; C433-C455 WeakPolarHBondContact CA-SG 3.34Å; C433-C455 HydrophobicContact CB-CB 3.74Å; C433-C455 WeakPolarHBondContact CB-SG 3.44Å; C433-C455 WeakPolarHBondContact SG-CA 3.39Å; C433-C455 WeakPolarHBondContact SG-CB 3.48Å; C433-C455 CovalentContact SG-SG 2.02Å; C433-C455 PolarHBondContact SG-SG 3.32Å
434	C	90.2	Very high	83.8	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.007	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-115.1	145.3	-176.3	-163.1	0	0	0	0	112.4	C420 C422 D431 R441 A447	C420-C434 HydrophobicContact CB-CB 3.77Å; C420-C434 WeakPolarHBondContact CB-SG 3.38Å; C420-C434 PolarHBondContact O-SG 2.83Å; C420-C434 WeakPolarHBondContact SG-CA 3.35Å; C420-C434 WeakPolarHBondContact SG-CB 3.43Å; C420-C434 CovalentContact SG-SG 2.03Å; C420-C434 PolarHBondContact SG-SG 3.49Å; C422-C434 HydrophobicContact CB-CB 3.93Å; D431-C434 HydrophobicContact CB-CB 4.48Å; D431-C434 PolarHBondContact OD1-N 3.14Å; C434-R441 PolarHBondContact O-NE 3.2Å; C434-R441 PolarHBondContact O-NH2 2.94Å; C434-A447 HydrophobicContact CB-CB 4.33Å
435	L	87.5	Confident	84.8	Confident	51 Å²	51	70.8 Å²	70.8	27%	0.267	40%	0.4	S	S	.	.			trans	-101.9	159.5	174.4	-69.7	173.8	0	0	0	111.3	C428 N437 C438 T439 R441	C428-L435 PolarHBondContact SG-O 2.96Å; C428-L435 VanDerWaalsContact SG-O 3.33Å; L435-N437 WeakPolarHBondContact CB-OD1 3.36Å; L435-N437 PolarHBondContact O-N 3.1Å; L435-C438 PolarHBondContact O-N 3.37Å; L435-T439 WeakPolarHBondContact CB-O 3.37Å; L435-T439 PolarHBondContact N-O 2.04Å; L435-R441 HydrophobicContact CD1-CG 4.47Å; L435-R441 HydrophobicContact CD2-CG 3.58Å; L435-R441 HydrophobicContact CG-CG 3.59Å
436	L	82.6	Confident	85.6	Confident	93 Å²	93	65.5 Å²	65.5	49%	0.487	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-15.9	179.9	-72.5	165.2	0	0	0	115.2	C409 I425 C428	C409-L436 PolarHBondContact SG-O 3.49Å; I425-L436 VanDerWaalsContact CA-CD2 3.5Å; I425-L436 HydrophobicContact CB-CD2 3.94Å; I425-L436 HydrophobicContact CG1-CD2 4.09Å; I425-L436 HydrophobicContact CG2-CD2 3.74Å; C428-L436 HydrophobicContact CB-CD2 3.57Å; C428-L436 HydrophobicContact CB-CG 4.14Å; C428-L436 PolarHBondContact SG-N 3.12Å
437	N	83.5	Confident	86.2	Confident	96 Å²	96	59.9 Å²	59.9	51%	0.513	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	16.8	177	69.7	-26.3	0	0	0	112.6	L435 T439	L435-N437 WeakPolarHBondContact CB-OD1 3.36Å; L435-N437 PolarHBondContact O-N 3.1Å; N437-T439 VanDerWaalsContact CG-OG1 3.23Å; N437-T439 PolarHBondContact ND2-OG1 3.47Å; N437-T439 PolarHBondContact O-N 3.16Å; N437-T439 PolarHBondContact OD1-N 3.26Å; N437-T439 PolarHBondContact OD1-OG1 2.67Å
438	C	85.4	Confident	86.6	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.007	34%	0.343	C	S	.	.	S	Bend	trans	60.5	32.7	177.4	-62.7	0	0	0	0	114.1	C409 G410 E418 Q419 C420 L435	C409-C438 WeakPolarHBondContact CA-SG 3.4Å; C409-C438 HydrophobicContact CB-CB 3.67Å; C409-C438 WeakPolarHBondContact CB-SG 3.07Å; C409-C438 WeakPolarHBondContact SG-CB 3.23Å; C409-C438 PolarHBondContact SG-N 2.92Å; C409-C438 CovalentContact SG-SG 2.02Å; C409-C438 PolarHBondContact SG-SG 2.93Å; G410-C438 PolarHBondContact N-SG 3.24Å; E418-C438 HydrophobicContact CB-CB 4Å; E418-C438 HydrophobicContact CG-CB 3.84Å; Q419-C438 PolarHBondContact N-O 3.45Å; C420-C438 PolarHBondContact N-O 2.73Å; C420-C438 CarbonylContact O-C 3.53Å; C420-C438 WeakPolarHBondContact O-CA 3.45Å; C420-C438 WeakPolarHBondContact O-CB 3.34Å; L435-C438 PolarHBondContact O-N 3.37Å
439	T	89.8	Confident	86.6	Confident	44 Å²	44	60 Å²	60	27%	0.27	36%	0.362	S	S	.	.			trans	-114.3	150.5	171.1	66.3	0	0	0	0	110.9	C420 L435 N437	C420-T439 PolarHBondContact SG-O 2.82Å; L435-T439 WeakPolarHBondContact CB-O 3.37Å; L435-T439 PolarHBondContact N-O 2.04Å; N437-T439 VanDerWaalsContact CG-OG1 3.23Å; N437-T439 PolarHBondContact ND2-OG1 3.47Å; N437-T439 PolarHBondContact O-N 3.16Å; N437-T439 PolarHBondContact OD1-N 3.26Å; N437-T439 PolarHBondContact OD1-OG1 2.67Å
440	L	90.6	Very high	86.7	Confident	39 Å²	39	59.4 Å²	59.4	20%	0.204	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-66.7	142	177	-70.1	170.4	0	0	0	110.4	Q419 C420 C433 A444 A447	Q419-L440 HydrophobicContact CB-CD1 4.35Å; Q419-L440 HydrophobicContact CB-CG 3.97Å; C420-L440 HydrophobicContact CB-CD2 3.98Å; C433-L440 WeakPolarHBondContact O-CA 3.16Å; L440-A444 HydrophobicContact CB-CB 4.34Å; L440-A444 HydrophobicContact CD2-CB 4.42Å; L440-A447 HydrophobicContact CD2-CB 3.67Å
441	R	90.8	Very high	87.1	Confident	78 Å²	78	51.2 Å²	51.2	29%	0.294	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-62.2	146.6	172.3	-75.4	-179.5	-171.9	-101.5	7.1	110.4	C428 D431 A432 C433 C434 L435 G443 A444	C428-R441 PolarHBondContact O-NH2 3.44Å; C428-R441 VanDerWaalsContact O-NH2 3.12Å; D431-R441 VanDerWaalsContact O-CZ 3.24Å; D431-R441 PolarHBondContact O-NE 3.11Å; D431-R441 PolarHBondContact O-NH2 2.93Å; A432-R441 WeakPolarHBondContact O-CD 3.22Å; C433-R441 PolarHBondContact O-N 2.77Å; C434-R441 PolarHBondContact O-NE 3.2Å; C434-R441 PolarHBondContact O-NH2 2.94Å; L435-R441 HydrophobicContact CD1-CG 4.47Å; L435-R441 HydrophobicContact CD2-CG 3.58Å; L435-R441 HydrophobicContact CG-CG 3.59Å; R441-G443 PolarHBondContact O-N 2.88Å; R441-G443 VanDerWaalsContact O-N 3.12Å; R441-A444 HydrophobicContact CB-CB 4.48Å; R441-A444 VanDerWaalsContact O-CB 3.29Å; R441-A444 WeakPolarHBondContact O-CB 3.41Å; R441-A444 PolarHBondContact O-N 3.3Å
442	P	90.1	Very high	87.4	Confident	130 Å²	130	50.2 Å²	50.2	84%	0.844	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	120.7	175.7	-26	34.4	0	0	0	111.8
443	G	87.8	Confident	87.4	Confident	77 Å²	77	52.9 Å²	52.9	79%	0.794	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	-6.3	-177.6	0	0	0	0	0	115.5	R441	R441-G443 PolarHBondContact O-N 2.88Å; R441-G443 VanDerWaalsContact O-N 3.12Å
444	A	92.3	Very high	87.4	Confident	19 Å²	19	58.5 Å²	58.5	16%	0.157	35%	0.346	C	S	.	.			trans	-81.5	130.7	168.1	0	0	0	0	0	110.3	C433 L440 R441 C455	C433-A444 HydrophobicContact CB-CB 4.34Å; L440-A444 HydrophobicContact CB-CB 4.34Å; L440-A444 HydrophobicContact CD2-CB 4.42Å; R441-A444 HydrophobicContact CB-CB 4.48Å; R441-A444 VanDerWaalsContact O-CB 3.29Å; R441-A444 WeakPolarHBondContact O-CB 3.41Å; R441-A444 PolarHBondContact O-N 3.3Å; A444-C455 HydrophobicContact CB-CB 3.76Å
445	A	91.4	Very high	87.6	Confident	45 Å²	45	59.3 Å²	59.3	37%	0.372	35%	0.352	S	S	.	.	S	Bend	trans	-94.2	-21.5	172.4	0	0	0	0	0	112.1	C455 F457	A445-C455 PolarHBondContact N-O 3.33Å; A445-F457 HydrophobicContact CB-CD2 4.18Å; A445-F457 HydrophobicContact CB-CE1 4.5Å; A445-F457 HydrophobicContact CB-CE2 3.96Å; A445-F457 HydrophobicContact CB-CZ 4.13Å; A445-F457 WeakPolarHBondContact O-CE1 3.36Å; A445-F457 VanDerWaalsContact O-CZ 3.22Å; A445-F457 WeakPolarHBondContact O-CZ 3.32Å
446	C	89.8	Confident	87.9	Confident	4 Å²	4	63.5 Å²	63.5	3%	0.027	37%	0.367	C	S	.	.			trans	-155	163.5	177.5	61.9	0	0	0	0	110.4	C452 C455 K456 F457 H482	C446-C452 HydrophobicContact CB-CB 3.8Å; C446-C452 WeakPolarHBondContact CB-SG 3.47Å; C446-C452 WeakPolarHBondContact SG-CA 3.45Å; C446-C452 WeakPolarHBondContact SG-CB 3.37Å; C446-C452 CovalentContact SG-SG 2.03Å; C446-C452 PolarHBondContact SG-SG 2.78Å; C446-C455 PolarHBondContact N-O 3.25Å; C446-C455 CarbonylContact O-C 3.51Å; C446-C455 VanDerWaalsContact O-CA 3.25Å; C446-C455 WeakPolarHBondContact O-CA 3.47Å; C446-K456 PolarHBondContact SG-O 2.67Å; C446-K456 VanDerWaalsContact SG-O 3.33Å; C446-F457 HydrophobicContact CB-CD1 3.95Å; C446-F457 HydrophobicContact CB-CE1 3.7Å; C446-H482 HydrophobicContact CB-CB 3.64Å
447	A	85	Confident	88.4	Confident	28 Å²	28	62.5 Å²	62.5	23%	0.231	36%	0.359	C	S	.	.	S	Bend	trans	-125	-26.9	171.6	0	0	0	0	0	113.3	C420 C433 C434 L440	C420-A447 HydrophobicContact CB-CB 3.64Å; C433-A447 HydrophobicContact CB-CB 3.67Å; C434-A447 HydrophobicContact CB-CB 4.33Å; L440-A447 HydrophobicContact CD2-CB 3.67Å
448	F	79.3	Confident	88.7	Confident	79 Å²	79	59.4 Å²	59.4	35%	0.346	34%	0.342	S	S	.	.	S	Bend	trans	-140.4	167.5	-174.8	65.5	-80.4	0	0	0	110.7	V414 C452 H482	V414-F448 HydrophobicContact CB-CE1 4.27Å; V414-F448 HydrophobicContact CB-CZ 4.03Å; V414-F448 HydrophobicContact CG1-CE1 4.26Å; V414-F448 HydrophobicContact CG1-CZ 4.14Å; V414-F448 HydrophobicContact CG2-CD1 4.02Å; V414-F448 HydrophobicContact CG2-CE1 3.55Å; V414-F448 HydrophobicContact CG2-CE2 4.31Å; V414-F448 HydrophobicContact CG2-CZ 3.7Å; F448-C452 WeakPolarHBondContact O-CB 3.28Å; F448-H482 AromaticContact CE2-CD2 3.8Å; F448-H482 AromaticContact CE2-NE2 3.65Å; F448-H482 AromaticContact CZ-CD2 3.71Å; F448-H482 AromaticContact CZ-NE2 3.45Å; F448-H482 WeakPolarHBondContact CZ-NE2 3.44Å; F448-H482 WeakPolarHBondContact O-CB 3.29Å; F448-H482 PolarHBondContact O-CD2 3.38Å; F448-H482 VanDerWaalsContact O-CD2 3.32Å
449	G	78.4	Confident	88.9	Confident	37 Å²	37	63.6 Å²	63.6	38%	0.381	37%	0.369	S	S	.	.	S	Bend	trans	105.3	152.8	177.8	0	0	0	0	0	114.1	C451 C452 H482	G449-C451 PolarHBondContact O-N 3.44Å; G449-C451 VanDerWaalsContact O-N 3.13Å; G449-C452 WeakPolarHBondContact O-CB 3.39Å; G449-C452 PolarHBondContact O-N 3.35Å; G449-H482 CarbonylContact C-O 3.5Å; G449-H482 VanDerWaalsContact C-O 3.25Å; G449-H482 WeakPolarHBondContact CA-O 3.33Å
450	L	81.3	Confident	89	Confident	116 Å²	116	64.5 Å²	64.5	61%	0.607	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.5	-174.6	-64.9	175	0	0	0	113.8	M458 C464 H482 C484	L450-M458 WeakPolarHBondContact O-CE 3.44Å; L450-C464 HydrophobicContact CB-CB 4.22Å; L450-H482 PolarHBondContact N-O 3.24Å; L450-C484 HydrophobicContact CB-CB 4.1Å; L450-C484 HydrophobicContact CD1-CB 4.05Å
451	C	89.7	Confident	88.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	18.4	175.6	-65.8	0	0	0	0	113.6	G449 F457 M458 C464 C477 S481 H482	G449-C451 PolarHBondContact O-N 3.44Å; G449-C451 VanDerWaalsContact O-N 3.13Å; C451-F457 WeakPolarHBondContact O-CA 3.27Å; C451-M458 PolarHBondContact O-N 3Å; C451-C464 VanDerWaalsContact SG-SG 3.66Å; C451-C477 VanDerWaalsContact CA-SG 3.55Å; C451-C477 HydrophobicContact CB-CB 3.83Å; C451-C477 WeakPolarHBondContact CB-SG 3.21Å; C451-C477 WeakPolarHBondContact SG-CA 3.05Å; C451-C477 WeakPolarHBondContact SG-CB 3.01Å; C451-C477 CovalentContact SG-SG 2.03Å; C451-C477 PolarHBondContact SG-SG 3.44Å; C451-S481 VanDerWaalsContact CB-O 3.23Å; C451-S481 WeakPolarHBondContact CB-O 3.48Å; C451-H482 CarbonylContact C-O 3.58Å; C451-H482 WeakPolarHBondContact CA-O 3.42Å; C451-H482 WeakPolarHBondContact CB-O 3.23Å; C451-H482 PolarHBondContact N-O 2.65Å
452	C	89.6	Confident	88.7	Confident	25 Å²	25	63.5 Å²	63.5	17%	0.169	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.7	173.1	-169	0	0	0	0	111.2	C446 F448 G449 H482	C446-C452 HydrophobicContact CB-CB 3.8Å; C446-C452 WeakPolarHBondContact CB-SG 3.47Å; C446-C452 WeakPolarHBondContact SG-CA 3.45Å; C446-C452 WeakPolarHBondContact SG-CB 3.37Å; C446-C452 CovalentContact SG-SG 2.03Å; C446-C452 PolarHBondContact SG-SG 2.78Å; F448-C452 WeakPolarHBondContact O-CB 3.28Å; G449-C452 WeakPolarHBondContact O-CB 3.39Å; G449-C452 PolarHBondContact O-N 3.35Å; C452-H482 HydrophobicContact CB-CB 4.27Å
453	K	89.9	Confident	88.6	Confident	133 Å²	133	59.9 Å²	59.9	58%	0.578	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	130.7	174	-172.3	175.8	179.6	176.4	0	110	C455 K456 M458	K453-C455 PolarHBondContact O-N 2.86Å; K453-K456 PolarHBondContact N-O 2.86Å; K453-K456 PolarHBondContact O-N 2.95Å; K453-M458 HydrophobicContact CB-CG 3.92Å; K453-M458 HydrophobicContact CB-SD 4.22Å
454	D	91.2	Very high	88.6	Confident	133 Å²	133	57.3 Å²	57.3	71%	0.711	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	45.5	179.5	-51.8	-41.9	0	0	0	112.4	K456	D454-K456 PolarHBondContact O-N 2.83Å; D454-K456 VanDerWaalsContact O-N 3.17Å
455	C	92.9	Very high	88.4	Confident	18 Å²	18	58.8 Å²	58.8	12%	0.122	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	15.4	-176.4	-40.5	0	0	0	0	116.1	A432 C433 A444 A445 C446 K453	A432-C455 VanDerWaalsContact C-SG 3.55Å; A432-C455 PolarHBondContact O-SG 3.16Å; A432-C455 VanDerWaalsContact O-SG 3.39Å; C433-C455 WeakPolarHBondContact CA-SG 3.34Å; C433-C455 HydrophobicContact CB-CB 3.74Å; C433-C455 WeakPolarHBondContact CB-SG 3.44Å; C433-C455 WeakPolarHBondContact SG-CA 3.39Å; C433-C455 WeakPolarHBondContact SG-CB 3.48Å; C433-C455 CovalentContact SG-SG 2.02Å; C433-C455 PolarHBondContact SG-SG 3.32Å; A444-C455 HydrophobicContact CB-CB 3.76Å; A445-C455 PolarHBondContact N-O 3.33Å; C446-C455 PolarHBondContact N-O 3.25Å; C446-C455 CarbonylContact O-C 3.51Å; C446-C455 VanDerWaalsContact O-CA 3.25Å; C446-C455 WeakPolarHBondContact O-CA 3.47Å; K453-C455 PolarHBondContact O-N 2.86Å
456	K	93.8	Very high	88	Confident	138 Å²	138	63.4 Å²	63.4	60%	0.6	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	150.6	-178.9	-65.7	180	-177.2	178.2	0	111.1	C446 K453 D454 M458	C446-K456 PolarHBondContact SG-O 2.67Å; C446-K456 VanDerWaalsContact SG-O 3.33Å; K453-K456 PolarHBondContact N-O 2.86Å; K453-K456 PolarHBondContact O-N 2.95Å; D454-K456 PolarHBondContact O-N 2.83Å; D454-K456 VanDerWaalsContact O-N 3.17Å; K456-M458 PolarHBondContact O-N 3.46Å
457	F	93.1	Very high	87.7	Confident	73 Å²	73	68.2 Å²	68.2	32%	0.32	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	134.1	171.7	-57.3	-45.4	0	0	0	110	A445 C446 C451 T480 S481 H482	A445-F457 HydrophobicContact CB-CD2 4.18Å; A445-F457 HydrophobicContact CB-CE1 4.5Å; A445-F457 HydrophobicContact CB-CE2 3.96Å; A445-F457 HydrophobicContact CB-CZ 4.13Å; A445-F457 WeakPolarHBondContact O-CE1 3.36Å; A445-F457 VanDerWaalsContact O-CZ 3.22Å; A445-F457 WeakPolarHBondContact O-CZ 3.32Å; C446-F457 HydrophobicContact CB-CD1 3.95Å; C446-F457 HydrophobicContact CB-CE1 3.7Å; C451-F457 WeakPolarHBondContact O-CA 3.27Å; F457-T480 VanDerWaalsContact CE2-O 3.27Å; F457-T480 WeakPolarHBondContact CE2-O 3.46Å; F457-S481 VanDerWaalsContact CD1-C 3.42Å; F457-H482 HydrophobicContact CD1-CB 4.09Å; F457-H482 VanDerWaalsContact CD1-N 3.3Å; F457-H482 HydrophobicContact CE1-CB 3.84Å; F457-H482 VanDerWaalsContact CE1-N 3.27Å
458	M	90.4	Very high	87.5	Confident	31 Å²	31	72.2 Å²	72.2	15%	0.153	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-62	145.5	172.2	-68.4	-148	-59.2	0	0	109.9	L450 C451 K453 K456 E462 C477 G479	L450-M458 WeakPolarHBondContact O-CE 3.44Å; C451-M458 PolarHBondContact O-N 3Å; K453-M458 HydrophobicContact CB-CG 3.92Å; K453-M458 HydrophobicContact CB-SD 4.22Å; K456-M458 PolarHBondContact O-N 3.46Å; M458-E462 HydrophobicContact CB-CB 4.37Å; M458-E462 HydrophobicContact CE-CB 4.39Å; M458-E462 HydrophobicContact CE-CG 3.82Å; M458-E462 HydrophobicContact SD-CG 4.03Å; M458-C477 HydrophobicContact CB-CB 4.25Å; M458-C477 WeakPolarHBondContact CE-SG 3.3Å; M458-G479 VanDerWaalsContact O-CA 3.29Å; M458-G479 WeakPolarHBondContact O-CA 3.35Å
459	P	90.9	Very high	87.7	Confident	88 Å²	88	70.9 Å²	70.9	57%	0.571	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-60.6	153.3	-178.3	26.3	-34.6	0	0	0	111.9	G461 E462	P459-G461 PolarHBondContact O-N 3.44Å; P459-E462 HydrophobicContact CG-CB 4.47Å; P459-E462 WeakPolarHBondContact O-CB 3.46Å; P459-E462 PolarHBondContact O-N 2.78Å
460	S	90.1	Very high	88.2	Confident	64 Å²	64	74.7 Å²	74.7	45%	0.448	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	132.4	177.9	-161	0	0	0	0	111.4	C477 N478	S460-C477 CarbonylContact C-O 3.51Å; S460-C477 VanDerWaalsContact CA-O 3.28Å; S460-C477 WeakPolarHBondContact CA-O 3.34Å; S460-N478 VanDerWaalsContact CB-O 3.23Å; S460-N478 WeakPolarHBondContact CB-O 3.44Å; S460-N478 PolarHBondContact OG-O 3.16Å
461	G	88.1	Confident	88.7	Confident	5 Å²	5	69.1 Å²	69.1	5%	0.052	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	13.9	-179.2	0	0	0	0	0	115.2	P459 W476 C477 P675 S677	P459-G461 PolarHBondContact O-N 3.44Å; G461-W476 VanDerWaalsContact O-CD1 3.3Å; G461-C477 PolarHBondContact N-O 3.2Å; G461-P675 VanDerWaalsContact CA-O 3.26Å; G461-P675 WeakPolarHBondContact CA-O 3.21Å; G461-S677 VanDerWaalsContact C-OG 3.31Å; G461-S677 PolarHBondContact O-N 2.94Å; G461-S677 PolarHBondContact O-OG 2.98Å
462	E	88.9	Confident	88.7	Confident	90 Å²	90	69.4 Å²	69.4	42%	0.421	36%	0.355	S	S	.	.			trans	-79.3	131.4	167.5	-170.2	65.5	-158.7	0	0	110	M458 P459 C464 W476 C477	M458-E462 HydrophobicContact CB-CB 4.37Å; M458-E462 HydrophobicContact CE-CB 4.39Å; M458-E462 HydrophobicContact CE-CG 3.82Å; M458-E462 HydrophobicContact SD-CG 4.03Å; P459-E462 HydrophobicContact CG-CB 4.47Å; P459-E462 WeakPolarHBondContact O-CB 3.46Å; P459-E462 PolarHBondContact O-N 2.78Å; E462-C464 PolarHBondContact O-N 2.85Å; E462-W476 CarbonylContact O-C 3.53Å; E462-W476 WeakPolarHBondContact O-CA 3.28Å; E462-C477 HydrophobicContact CB-CB 4.49Å; E462-C477 PolarHBondContact O-N 3.5Å
463	L	87.8	Confident	88.8	Confident	55 Å²	55	68.7 Å²	68.7	29%	0.288	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	115	-176.1	-176.3	72.3	0	0	0	110.3	R465 Q466 P474 W476	L463-R465 VanDerWaalsContact CD1-O 3.3Å; L463-R465 WeakPolarHBondContact CD1-O 3.33Å; L463-Q466 HydrophobicContact CD2-CG 3.61Å; L463-Q466 HydrophobicContact CG-CG 4.36Å; L463-P474 HydrophobicContact CD1-CB 3.77Å; L463-W476 HydrophobicContact CD1-CD2 4.45Å; L463-W476 HydrophobicContact CD1-CZ2 4.41Å
464	C	86.8	Confident	88.8	Confident	23 Å²	23	63 Å²	63	16%	0.155	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-28.2	176.8	49	0	0	0	0	113	L450 C451 E462 E475 C484	L450-C464 HydrophobicContact CB-CB 4.22Å; C451-C464 VanDerWaalsContact SG-SG 3.66Å; E462-C464 PolarHBondContact O-N 2.85Å; C464-E475 PolarHBondContact N-O 3.03Å; C464-E475 PolarHBondContact SG-O 3.14Å; C464-E475 VanDerWaalsContact SG-O 3.4Å; C464-C484 HydrophobicContact CB-CB 3.71Å; C464-C484 WeakPolarHBondContact CB-SG 3.5Å; C464-C484 VanDerWaalsContact SG-CA 3.57Å; C464-C484 WeakPolarHBondContact SG-CB 3.4Å; C464-C484 CovalentContact SG-SG 2.04Å; C464-C484 PolarHBondContact SG-SG 3.5Å
465	R	87.4	Confident	88.8	Confident	50 Å²	50	56.7 Å²	56.7	19%	0.189	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	131.8	175.5	-168.8	-174.3	76.3	78.1	-4	111	L463 D472 L473 P474 E475 D487	L463-R465 VanDerWaalsContact CD1-O 3.3Å; L463-R465 WeakPolarHBondContact CD1-O 3.33Å; R465-D472 IonicContact CZ-OD1 3.26Å; R465-D472 IonicContact CZ-OD2 3.56Å; R465-D472 IonicContact NH1-OD1 2.76Å; R465-D472 PolarHBondContact NH1-OD1 3.37Å; R465-D472 IonicContact NH1-OD2 3.38Å; R465-D472 PolarHBondContact NH1-OD2 3.36Å; R465-D472 IonicContact NH2-OD1 2.84Å; R465-D472 PolarHBondContact NH2-OD1 3.44Å; R465-D472 IonicContact NH2-OD2 2.83Å; R465-L473 PolarHBondContact NH2-O 2.92Å; R465-P474 WeakPolarHBondContact O-CA 3.49Å; R465-E475 WeakPolarHBondContact CB-OE2 3.41Å; R465-E475 IonicContact CZ-OE1 3.38Å; R465-E475 IonicContact CZ-OE2 2.71Å; R465-E475 PolarHBondContact N-O 2.76Å; R465-E475 VanDerWaalsContact NE-CD 3.35Å; R465-E475 IonicContact NE-OE1 3.8Å; R465-E475 IonicContact NE-OE2 3.58Å; R465-E475 PolarHBondContact NE-OE2 2.81Å; R465-E475 IonicContact NH2-OE1 3.35Å; R465-E475 PolarHBondContact NH2-OE1 3.19Å; R465-E475 IonicContact NH2-OE2 3.98Å; R465-E475 PolarHBondContact NH2-OE2 3.01Å; R465-E475 PolarHBondContact O-N 2.91Å; R465-E475 VanDerWaalsContact O-N 3.09Å; R465-D487 IonicContact CZ-OD1 3.52Å; R465-D487 IonicContact CZ-OD2 3.66Å; R465-D487 IonicContact NH2-OD1 3.94Å; R465-D487 PolarHBondContact NH2-OD1 3.35Å; R465-D487 IonicContact NH2-OD2 3.81Å
466	Q	83.5	Confident	88.7	Confident	141 Å²	141	57.3 Å²	57.3	66%	0.659	29%	0.292	S	S	*	.			trans	-86.1	151.8	174.3	-76.6	172.7	13.4	0	0	110.7	L463	L463-Q466 HydrophobicContact CD2-CG 3.61Å; L463-Q466 HydrophobicContact CG-CG 4.36Å
467	E	84.1	Confident	88.6	Confident	105 Å²	105	50.7 Å²	50.7	49%	0.491	26%	0.264	S	S	.	.			trans	-63.9	137.5	167.8	66.3	-80.3	-164.4	0	0	111.4	D472 P474	E467-D472 HydrophobicContact CB-CB 4.37Å; E467-P474 WeakPolarHBondContact OE2-CB 2.99Å; E467-P474 WeakPolarHBondContact OE2-CG 3.24Å
468	V	80.5	Confident	88.4	Confident	113 Å²	113	50.3 Å²	50.3	69%	0.685	27%	0.265	S	S	*	.			trans	-94.2	-32.4	-177.8	179.2	0	0	0	0	112.4	D472	V468-D472 WeakPolarHBondContact CG2-OD2 3.07Å; V468-D472 PolarHBondContact N-OD2 2.85Å
469	N	83.4	Confident	88.4	Confident	50 Å²	50	50.1 Å²	50.1	27%	0.267	27%	0.27	S	S	.	.	S	Bend	trans	-151.8	176.2	-179.2	64.9	54.9	0	0	0	110	C471 D472 K505	N469-C471 PolarHBondContact O-N 3.25Å; N469-C471 VanDerWaalsContact O-N 3.17Å; N469-C471 WeakPolarHBondContact OD1-CA 3.22Å; N469-C471 VanDerWaalsContact OD1-CB 3.32Å; N469-C471 WeakPolarHBondContact OD1-CB 3.46Å; N469-C471 PolarHBondContact OD1-N 2.84Å; N469-D472 WeakPolarHBondContact O-CB 3.18Å; N469-D472 PolarHBondContact O-N 2.72Å; N469-D472 PolarHBondContact OD1-N 2.01Å; N469-K505 PolarHBondContact ND2-O 3.49Å; N469-K505 PolarHBondContact OD1-O 3.26Å
470	E	89.8	Confident	88.3	Confident	117 Å²	117	50.7 Å²	50.7	55%	0.547	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-16.6	-178.2	63.8	-85.1	-168.1	0	0	115.3	C496 C507	E470-C496 HydrophobicContact CG-CB 3.65Å; E470-C507 WeakPolarHBondContact OE1-CB 3.4Å
471	C	90.5	Very high	88.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-2.6	175.1	-63.4	0	0	0	0	113.1	N469 Y489 V490 C496 C502	N469-C471 PolarHBondContact O-N 3.25Å; N469-C471 VanDerWaalsContact O-N 3.17Å; N469-C471 WeakPolarHBondContact OD1-CA 3.22Å; N469-C471 VanDerWaalsContact OD1-CB 3.32Å; N469-C471 WeakPolarHBondContact OD1-CB 3.46Å; N469-C471 PolarHBondContact OD1-N 2.84Å; C471-Y489 VanDerWaalsContact O-CB 3.31Å; C471-Y489 WeakPolarHBondContact O-CB 3.29Å; C471-V490 PolarHBondContact O-N 3.49Å; C471-C496 VanDerWaalsContact SG-CB 3.58Å; C471-C502 WeakPolarHBondContact CA-SG 3.44Å; C471-C502 HydrophobicContact CB-CB 3.68Å; C471-C502 WeakPolarHBondContact CB-SG 3.23Å; C471-C502 WeakPolarHBondContact SG-CA 3.42Å; C471-C502 WeakPolarHBondContact SG-CB 3.34Å; C471-C502 CovalentContact SG-SG 2.04Å; C471-C502 PolarHBondContact SG-SG 3.39Å
472	D	90.4	Very high	88	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.027	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-104.4	151.2	179.8	-169.9	24.6	0	0	0	110.8	R465 E467 V468 N469 K505	R465-D472 IonicContact CZ-OD1 3.26Å; R465-D472 IonicContact CZ-OD2 3.56Å; R465-D472 IonicContact NH1-OD1 2.76Å; R465-D472 PolarHBondContact NH1-OD1 3.37Å; R465-D472 IonicContact NH1-OD2 3.38Å; R465-D472 PolarHBondContact NH1-OD2 3.36Å; R465-D472 IonicContact NH2-OD1 2.84Å; R465-D472 PolarHBondContact NH2-OD1 3.44Å; R465-D472 IonicContact NH2-OD2 2.83Å; E467-D472 HydrophobicContact CB-CB 4.37Å; V468-D472 WeakPolarHBondContact CG2-OD2 3.07Å; V468-D472 PolarHBondContact N-OD2 2.85Å; N469-D472 WeakPolarHBondContact O-CB 3.18Å; N469-D472 PolarHBondContact O-N 2.72Å; N469-D472 PolarHBondContact OD1-N 2.01Å; D472-K505 HydrophobicContact CB-CD 4.48Å; D472-K505 HydrophobicContact CB-CG 3.81Å; D472-K505 WeakPolarHBondContact OD1-CE 3.47Å; D472-K505 IonicContact OD1-NZ 3.72Å; D472-K505 PolarHBondContact OD1-NZ 3.13Å; D472-K505 WeakPolarHBondContact OD2-CE 3.11Å; D472-K505 IonicContact OD2-NZ 3.55Å; D472-K505 PolarHBondContact OD2-NZ 2.82Å
473	L	90.6	Very high	87.8	Confident	10 Å²	10	52 Å²	52	5%	0.052	27%	0.274	C	S	.	.			trans	-118.1	152.6	178.3	-60.4	169	0	0	0	110.3	R465 R488 V490 N646 H652	R465-L473 PolarHBondContact NH2-O 2.92Å; L473-R488 WeakPolarHBondContact CB-O 3.28Å; L473-R488 PolarHBondContact N-O 3.02Å; L473-V490 HydrophobicContact CD2-CG2 3.86Å; L473-V490 HydrophobicContact CG-CG2 4.1Å; L473-N646 HydrophobicContact CD1-CB 3.66Å; L473-H652 HydrophobicContact CD1-CB 3.91Å; L473-H652 HydrophobicContact CD2-CB 4.33Å
474	P	90.3	Very high	87.6	Confident	15 Å²	15	50.6 Å²	50.6	10%	0.097	27%	0.268	C	S	.	.			trans	-80.1	157.2	173.5	22.9	-23.3	0	0	0	113.4	L463 R465 E467 W476 S673	L463-P474 HydrophobicContact CD1-CB 3.77Å; R465-P474 WeakPolarHBondContact O-CA 3.49Å; E467-P474 WeakPolarHBondContact OE2-CB 2.99Å; E467-P474 WeakPolarHBondContact OE2-CG 3.24Å; P474-W476 HydrophobicContact CB-CH2 4.01Å; P474-W476 HydrophobicContact CB-CZ2 4.03Å; P474-W476 HydrophobicContact CB-CZ3 4.45Å; P474-W476 HydrophobicContact CG-CH2 3.53Å; P474-W476 HydrophobicContact CG-CZ2 3.8Å; P474-W476 HydrophobicContact CG-CZ3 4.26Å; P474-W476 WeakPolarHBondContact O-CZ3 3.33Å; P474-S673 PolarHBondContact O-OG 2.9Å
475	E	91.1	Very high	87.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.7	176.3	-63.8	70.6	-164.3	0	0	112.3	C464 R465 P485 D487 R488 S673	C464-E475 PolarHBondContact N-O 3.03Å; C464-E475 PolarHBondContact SG-O 3.14Å; C464-E475 VanDerWaalsContact SG-O 3.4Å; R465-E475 WeakPolarHBondContact CB-OE2 3.41Å; R465-E475 IonicContact CZ-OE1 3.38Å; R465-E475 IonicContact CZ-OE2 2.71Å; R465-E475 PolarHBondContact N-O 2.76Å; R465-E475 VanDerWaalsContact NE-CD 3.35Å; R465-E475 IonicContact NE-OE1 3.8Å; R465-E475 IonicContact NE-OE2 3.58Å; R465-E475 PolarHBondContact NE-OE2 2.81Å; R465-E475 IonicContact NH2-OE1 3.35Å; R465-E475 PolarHBondContact NH2-OE1 3.19Å; R465-E475 IonicContact NH2-OE2 3.98Å; R465-E475 PolarHBondContact NH2-OE2 3.01Å; R465-E475 PolarHBondContact O-N 2.91Å; R465-E475 VanDerWaalsContact O-N 3.09Å; E475-P485 HydrophobicContact CG-CB 4.43Å; E475-D487 WeakPolarHBondContact OE1-CA 3.43Å; E475-R488 PolarHBondContact OE1-N 3.45Å; E475-S673 WeakPolarHBondContact CA-O 3.39Å
476	W	91.9	Very high	87.4	Confident	30 Å²	30	54.7 Å²	54.7	11%	0.114	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.9	-179.8	-59	-95	0	0	0	111.6	G461 E462 L463 P474 N478 P485 H652 G669 S673 A676	G461-W476 VanDerWaalsContact O-CD1 3.3Å; E462-W476 CarbonylContact O-C 3.53Å; E462-W476 WeakPolarHBondContact O-CA 3.28Å; L463-W476 HydrophobicContact CD1-CD2 4.45Å; L463-W476 HydrophobicContact CD1-CZ2 4.41Å; P474-W476 HydrophobicContact CB-CH2 4.01Å; P474-W476 HydrophobicContact CB-CZ2 4.03Å; P474-W476 HydrophobicContact CB-CZ3 4.45Å; P474-W476 HydrophobicContact CG-CH2 3.53Å; P474-W476 HydrophobicContact CG-CZ2 3.8Å; P474-W476 HydrophobicContact CG-CZ3 4.26Å; P474-W476 WeakPolarHBondContact O-CZ3 3.33Å; W476-N478 PolarHBondContact O-N 3.42Å; W476-P485 WeakPolarHBondContact O-CD 3.49Å; W476-P485 WeakPolarHBondContact O-CG 3.43Å; W476-H652 AromaticContact CH2-CE1 3.61Å; W476-H652 AromaticContact CH2-NE2 3.59Å; W476-H652 AromaticContact CZ3-CE1 3.44Å; W476-H652 VanDerWaalsContact CZ3-CE1 3.44Å; W476-H652 WeakPolarHBondContact CZ3-CE1 3.26Å; W476-H652 AromaticContact CZ3-NE2 3.89Å; W476-G669 VanDerWaalsContact CZ3-CA 3.44Å; W476-S673 PolarHBondContact N-O 3.02Å; W476-A676 HydrophobicContact CD2-CB 4.13Å; W476-A676 HydrophobicContact CH2-CB 4.36Å; W476-A676 HydrophobicContact CZ2-CB 3.78Å
477	C	90.9	Very high	87.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.			trans	-55.8	140.2	174.5	-60.8	0	0	0	0	110.7	C451 M458 S460 G461 E462	C451-C477 VanDerWaalsContact CA-SG 3.55Å; C451-C477 HydrophobicContact CB-CB 3.83Å; C451-C477 WeakPolarHBondContact CB-SG 3.21Å; C451-C477 WeakPolarHBondContact SG-CA 3.05Å; C451-C477 WeakPolarHBondContact SG-CB 3.01Å; C451-C477 CovalentContact SG-SG 2.03Å; C451-C477 PolarHBondContact SG-SG 3.44Å; M458-C477 HydrophobicContact CB-CB 4.25Å; M458-C477 WeakPolarHBondContact CE-SG 3.3Å; S460-C477 CarbonylContact C-O 3.51Å; S460-C477 VanDerWaalsContact CA-O 3.28Å; S460-C477 WeakPolarHBondContact CA-O 3.34Å; G461-C477 PolarHBondContact N-O 3.2Å; E462-C477 HydrophobicContact CB-CB 4.49Å; E462-C477 PolarHBondContact O-N 3.5Å
478	N	88.8	Confident	87.6	Confident	65 Å²	65	47.5 Å²	47.5	35%	0.348	26%	0.257	S	S	.	.			trans	-84.3	-12.4	179.9	64.2	3.9	0	0	0	113.4	S460 W476 T480 S481	S460-N478 VanDerWaalsContact CB-O 3.23Å; S460-N478 WeakPolarHBondContact CB-O 3.44Å; S460-N478 PolarHBondContact OG-O 3.16Å; W476-N478 PolarHBondContact O-N 3.42Å; N478-T480 VanDerWaalsContact CG-OG1 3.26Å; N478-T480 PolarHBondContact ND2-OG1 3.01Å; N478-T480 PolarHBondContact OD1-N 3.26Å; N478-T480 PolarHBondContact OD1-OG1 2.88Å; N478-S481 PolarHBondContact OD1-N 3.37Å
479	G	90.2	Very high	88.1	Confident	26 Å²	26	44.4 Å²	44.4	27%	0.268	23%	0.234	S	C	.	.	S	Bend	trans	91.1	-5.4	-176.1	0	0	0	0	0	115.3	M458	M458-G479 VanDerWaalsContact O-CA 3.29Å; M458-G479 WeakPolarHBondContact O-CA 3.35Å
480	T	89.9	Confident	88.5	Confident	101 Å²	101	42.3 Å²	42.3	62%	0.62	22%	0.222	S	C	*	.	S	Bend	trans	-127.6	-10.1	-171.8	59.7	0	0	0	0	113.9	F457 N478	F457-T480 VanDerWaalsContact CE2-O 3.27Å; F457-T480 WeakPolarHBondContact CE2-O 3.46Å; N478-T480 VanDerWaalsContact CG-OG1 3.26Å; N478-T480 PolarHBondContact ND2-OG1 3.01Å; N478-T480 PolarHBondContact OD1-N 3.26Å; N478-T480 PolarHBondContact OD1-OG1 2.88Å
481	S	87.2	Confident	88.6	Confident	31 Å²	31	36.9 Å²	36.9	22%	0.217	20%	0.197	C	C	.	.			trans	-127.1	147.4	176.8	-177	0	0	0	0	111.6	C451 F457 N478 Q483	C451-S481 VanDerWaalsContact CB-O 3.23Å; C451-S481 WeakPolarHBondContact CB-O 3.48Å; F457-S481 VanDerWaalsContact CD1-C 3.42Å; N478-S481 PolarHBondContact OD1-N 3.37Å; S481-Q483 VanDerWaalsContact C-N 3.31Å; S481-Q483 PolarHBondContact OG-N 2.72Å; S481-Q483 VanDerWaalsContact OG-N 3.12Å
482	H	83.6	Confident	88.6	Confident	41 Å²	41	38.5 Å²	38.5	19%	0.19	21%	0.206	C	C	.	.	S	Bend	trans	-72.2	-19.6	168.6	64.4	-29.4	0	0	0	114.6	C446 F448 G449 L450 C451 C452 F457	C446-H482 HydrophobicContact CB-CB 3.64Å; F448-H482 AromaticContact CE2-CD2 3.8Å; F448-H482 AromaticContact CE2-NE2 3.65Å; F448-H482 AromaticContact CZ-CD2 3.71Å; F448-H482 AromaticContact CZ-NE2 3.45Å; F448-H482 WeakPolarHBondContact CZ-NE2 3.44Å; F448-H482 WeakPolarHBondContact O-CB 3.29Å; F448-H482 PolarHBondContact O-CD2 3.38Å; F448-H482 VanDerWaalsContact O-CD2 3.32Å; G449-H482 CarbonylContact C-O 3.5Å; G449-H482 VanDerWaalsContact C-O 3.25Å; G449-H482 WeakPolarHBondContact CA-O 3.33Å; L450-H482 PolarHBondContact N-O 3.24Å; C451-H482 CarbonylContact C-O 3.58Å; C451-H482 WeakPolarHBondContact CA-O 3.42Å; C451-H482 WeakPolarHBondContact CB-O 3.23Å; C451-H482 PolarHBondContact N-O 2.65Å; C452-H482 HydrophobicContact CB-CB 4.27Å; F457-H482 HydrophobicContact CD1-CB 4.09Å; F457-H482 VanDerWaalsContact CD1-N 3.3Å; F457-H482 HydrophobicContact CE1-CB 3.84Å; F457-H482 VanDerWaalsContact CE1-N 3.27Å
483	Q	84.3	Confident	88.6	Confident	115 Å²	115	38.7 Å²	38.7	54%	0.537	21%	0.209	S	C	.	.	S	Bend	trans	-92	139.4	178.8	-73	170.7	10.8	0	0	109.6	S481	S481-Q483 VanDerWaalsContact C-N 3.31Å; S481-Q483 PolarHBondContact OG-N 2.72Å; S481-Q483 VanDerWaalsContact OG-N 3.12Å
484	C	85.1	Confident	88.5	Confident	25 Å²	25	40.4 Å²	40.4	17%	0.169	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-62	144	167	-166.3	0	0	0	0	108.4	L450 C464	L450-C484 HydrophobicContact CB-CB 4.1Å; L450-C484 HydrophobicContact CD1-CB 4.05Å; C464-C484 HydrophobicContact CB-CB 3.71Å; C464-C484 WeakPolarHBondContact CB-SG 3.5Å; C464-C484 VanDerWaalsContact SG-CA 3.57Å; C464-C484 WeakPolarHBondContact SG-CB 3.4Å; C464-C484 CovalentContact SG-SG 2.04Å; C464-C484 PolarHBondContact SG-SG 3.5Å
485	P	86.6	Confident	88.5	Confident	28 Å²	28	44.2 Å²	44.2	18%	0.182	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-51.3	157.9	172.5	-26.2	35	0	0	0	112.1	E475 W476	E475-P485 HydrophobicContact CG-CB 4.43Å; W476-P485 WeakPolarHBondContact O-CD 3.49Å; W476-P485 WeakPolarHBondContact O-CG 3.43Å
486	E	83.6	Confident	88.5	Confident	131 Å²	131	45.5 Å²	45.5	61%	0.612	25%	0.25	S	C	*	.	P	Polyproline II helix	trans	-55.6	144.4	176.7	-68.2	-175.1	167.4	0	0	111.4	R488	E486-R488 VanDerWaalsContact CB-NH1 3.25Å; E486-R488 PolarHBondContact O-N 3.49Å; E486-R488 IonicContact OE2-CZ 3.04Å; E486-R488 VanDerWaalsContact OE2-CZ 3.26Å; E486-R488 IonicContact OE2-NH1 3.6Å; E486-R488 PolarHBondContact OE2-NH1 3.07Å; E486-R488 IonicContact OE2-NH2 2.76Å; E486-R488 PolarHBondContact OE2-NH2 3.24Å
487	D	82.8	Confident	88.3	Confident	71 Å²	71	47 Å²	47	38%	0.38	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-56.7	121.6	176.8	-169.4	-24.4	0	0	0	110.7	R465 E475 K505	R465-D487 IonicContact CZ-OD1 3.52Å; R465-D487 IonicContact CZ-OD2 3.66Å; R465-D487 IonicContact NH2-OD1 3.94Å; R465-D487 PolarHBondContact NH2-OD1 3.35Å; R465-D487 IonicContact NH2-OD2 3.81Å; E475-D487 WeakPolarHBondContact OE1-CA 3.43Å; D487-K505 IonicContact OD1-NZ 2.8Å; D487-K505 PolarHBondContact OD1-NZ 2.68Å; D487-K505 IonicContact OD2-NZ 2.72Å; D487-K505 PolarHBondContact OD2-NZ 3.1Å
488	R	88.3	Confident	87.8	Confident	24 Å²	24	55.6 Å²	55.6	9%	0.091	31%	0.311	C	S	.	.			trans	-116.6	143.4	176.2	-63.7	-60.9	178.1	-112.2	-2.8	109.5	L473 E475 E486 N647 Q648 D672	L473-R488 WeakPolarHBondContact CB-O 3.28Å; L473-R488 PolarHBondContact N-O 3.02Å; E475-R488 PolarHBondContact OE1-N 3.45Å; E486-R488 VanDerWaalsContact CB-NH1 3.25Å; E486-R488 PolarHBondContact O-N 3.49Å; E486-R488 IonicContact OE2-CZ 3.04Å; E486-R488 VanDerWaalsContact OE2-CZ 3.26Å; E486-R488 IonicContact OE2-NH1 3.6Å; E486-R488 PolarHBondContact OE2-NH1 3.07Å; E486-R488 IonicContact OE2-NH2 2.76Å; E486-R488 PolarHBondContact OE2-NH2 3.24Å; R488-N647 VanDerWaalsContact CD-OD1 3.29Å; R488-N647 WeakPolarHBondContact CD-OD1 3.45Å; R488-Q648 VanDerWaalsContact CZ-NE2 3.31Å; R488-Q648 VanDerWaalsContact CZ-OE1 3.28Å; R488-Q648 VanDerWaalsContact NH2-CD 3.32Å; R488-Q648 VanDerWaalsContact NH2-OE1 3.15Å; R488-D672 HydrophobicContact CG-CB 4.13Å
489	Y	91.1	Very high	87.5	Confident	48 Å²	48	55.7 Å²	55.7	19%	0.188	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-137.6	165.3	-177.7	57	-91	0	0	0	110.2	C471 K505 N646 N647	C471-Y489 VanDerWaalsContact O-CB 3.31Å; C471-Y489 WeakPolarHBondContact O-CB 3.29Å; Y489-K505 HydrophobicContact CD1-CB 4.15Å; Y489-K505 HydrophobicContact CD2-CB 4.3Å; Y489-K505 VanDerWaalsContact CD2-N 3.31Å; Y489-K505 HydrophobicContact CG-CB 3.81Å; Y489-N646 CarbonylContact O-C 3.57Å; Y489-N646 VanDerWaalsContact O-CA 3.24Å; Y489-N646 WeakPolarHBondContact O-CA 3.11Å; Y489-N647 HydrophobicContact CD1-CB 4.18Å; Y489-N647 HydrophobicContact CD2-CB 3.8Å; Y489-N647 HydrophobicContact CE1-CB 3.86Å; Y489-N647 WeakPolarHBondContact CE1-ND2 3.41Å; Y489-N647 HydrophobicContact CE2-CB 3.43Å; Y489-N647 VanDerWaalsContact CE2-CB 3.43Å; Y489-N647 HydrophobicContact CG-CB 4.14Å; Y489-N647 VanDerWaalsContact CZ-CB 3.46Å; Y489-N647 PolarHBondContact N-OD1 2.85Å; Y489-N647 PolarHBondContact O-N 2.92Å; Y489-N647 PolarHBondContact O-OD1 2.87Å
490	V	92	Very high	87.5	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.03	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-61.1	138.3	179.5	176.6	0	0	0	0	109.6	C471 L473 D492 F494 I644	C471-V490 PolarHBondContact O-N 3.49Å; L473-V490 HydrophobicContact CD2-CG2 3.86Å; L473-V490 HydrophobicContact CG-CG2 4.1Å; V490-D492 PolarHBondContact O-N 2.79Å; V490-F494 HydrophobicContact CG1-CB 3.56Å; V490-F494 HydrophobicContact CG1-CD1 4.45Å; V490-F494 HydrophobicContact CG1-CD2 4.01Å; V490-F494 HydrophobicContact CG1-CG 3.75Å; V490-I644 HydrophobicContact CB-CG2 4.47Å; V490-I644 HydrophobicContact CG1-CG2 3.71Å; V490-I644 HydrophobicContact CG2-CG2 4.18Å
491	Q	91.4	Very high	87.6	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.019	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-52.2	139.8	178.6	-176.5	-177.9	-68.4	0	0	111.6	G493 F494 C634 C645 H649	Q491-G493 PolarHBondContact O-N 3.49Å; Q491-F494 HydrophobicContact CB-CD2 3.9Å; Q491-F494 HydrophobicContact CB-CE2 3.98Å; Q491-F494 WeakPolarHBondContact O-CD2 3.17Å; Q491-F494 PolarHBondContact O-N 2.7Å; Q491-C634 PolarHBondContact NE2-O 3.09Å; Q491-C634 PolarHBondContact OE1-O 2.95Å; Q491-C645 HydrophobicContact CB-CB 4.06Å; Q491-C645 WeakPolarHBondContact CB-O 3.48Å; Q491-C645 PolarHBondContact N-O 2.82Å; Q491-H649 PolarHBondContact OE1-ND1 3.42Å
492	D	91.3	Very high	87.8	Confident	33 Å²	33	51.3 Å²	51.3	18%	0.176	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	139.3	178.9	-63.6	-19.3	0	0	0	111.5	V490 C502 Y503 Q504 L630	V490-D492 PolarHBondContact O-N 2.79Å; D492-C502 CarbonylContact C-O 3.45Å; D492-C502 WeakPolarHBondContact CA-O 3.22Å; D492-Y503 HydrophobicContact CB-CD2 4.06Å; D492-Y503 WeakPolarHBondContact OD1-CA 2.98Å; D492-Q504 PolarHBondContact OD1-N 3.5Å; D492-L630 HydrophobicContact CB-CD1 3.97Å; D492-L630 HydrophobicContact CB-CD2 4.25Å
493	G	89.3	Confident	88.2	Confident	10 Å²	10	50.4 Å²	50.4	10%	0.103	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	-4	-179.8	0	0	0	0	0	115.2	Q491 Y501 C502	Q491-G493 PolarHBondContact O-N 3.49Å; G493-Y501 WeakPolarHBondContact O-CD1 3.46Å; G493-C502 PolarHBondContact N-O 2.84Å
494	F	89.6	Confident	88.4	Confident	45 Å²	45	50 Å²	50	20%	0.197	27%	0.27	C	S	.	.			trans	-67.9	136.5	169.6	-93.5	-94.6	0	0	0	111.2	V490 Q491 C496 Y501 C502 P636 I644 C645	V490-F494 HydrophobicContact CG1-CB 3.56Å; V490-F494 HydrophobicContact CG1-CD1 4.45Å; V490-F494 HydrophobicContact CG1-CD2 4.01Å; V490-F494 HydrophobicContact CG1-CG 3.75Å; Q491-F494 HydrophobicContact CB-CD2 3.9Å; Q491-F494 HydrophobicContact CB-CE2 3.98Å; Q491-F494 WeakPolarHBondContact O-CD2 3.17Å; Q491-F494 PolarHBondContact O-N 2.7Å; F494-C496 PolarHBondContact O-N 2.57Å; F494-Y501 CarbonylContact O-C 3.57Å; F494-Y501 VanDerWaalsContact O-CA 3.3Å; F494-Y501 WeakPolarHBondContact O-CA 3.43Å; F494-C502 HydrophobicContact CB-CB 4.5Å; F494-C502 PolarHBondContact O-N 3.23Å; F494-P636 HydrophobicContact CE1-CG 4.46Å; F494-P636 HydrophobicContact CZ-CG 4.35Å; F494-I644 HydrophobicContact CD1-CG2 4.36Å; F494-I644 HydrophobicContact CE1-CG2 4.2Å; F494-I644 HydrophobicContact CZ-CG2 4.36Å; F494-C645 HydrophobicContact CE2-CB 4.01Å; F494-C645 HydrophobicContact CZ-CB 4.31Å
495	P	90.2	Very high	88.4	Confident	95 Å²	95	50.8 Å²	50.8	62%	0.617	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	130	179.3	28.6	-33.4	0	0	0	111	Y501	P495-Y501 HydrophobicContact CB-CD1 4.34Å; P495-Y501 HydrophobicContact CB-CE1 4.45Å
496	C	90.7	Very high	88.4	Confident	28 Å²	28	56.4 Å²	56.4	19%	0.189	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-20.8	176	52	0	0	0	0	113	E470 C471 F494 A500 C507	E470-C496 HydrophobicContact CG-CB 3.65Å; C471-C496 VanDerWaalsContact SG-CB 3.58Å; F494-C496 PolarHBondContact O-N 2.57Å; C496-A500 PolarHBondContact N-O 2.88Å; C496-A500 VanDerWaalsContact SG-C 3.53Å; C496-A500 PolarHBondContact SG-O 2.83Å; C496-C507 HydrophobicContact CB-CB 3.69Å; C496-C507 WeakPolarHBondContact CB-SG 3.34Å; C496-C507 VanDerWaalsContact SG-CA 3.59Å; C496-C507 WeakPolarHBondContact SG-CB 3.2Å; C496-C507 CovalentContact SG-SG 2.02Å; C496-C507 PolarHBondContact SG-SG 2.99Å
497	S	86.4	Confident	88.7	Confident	62 Å²	62	51.8 Å²	51.8	43%	0.434	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	172.7	175.4	-172.8	0	0	0	0	109.5	S499 A500	S497-S499 PolarHBondContact O-N 2.93Å; S497-A500 PolarHBondContact N-O 2.88Å; S497-A500 PolarHBondContact O-N 3.47Å
498	D	81.1	Confident	89.1	Confident	179 Å²	179	49.8 Å²	49.8	96%	0.957	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.5	178.3	-66.2	-28.2	0	0	0	112.9
499	S	82.6	Confident	89.1	Confident	67 Å²	67	50.3 Å²	50.3	47%	0.469	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	27.9	-176.9	70.1	0	0	0	0	113.8	S497 V612	S497-S499 PolarHBondContact O-N 2.93Å; S499-V612 WeakPolarHBondContact O-CG2 3.15Å
500	A	90.8	Very high	89.3	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	154.5	179.5	0	0	0	0	0	112.6	C496 S497	C496-A500 PolarHBondContact N-O 2.88Å; C496-A500 VanDerWaalsContact SG-C 3.53Å; C496-A500 PolarHBondContact SG-O 2.83Å; S497-A500 PolarHBondContact N-O 2.88Å; S497-A500 PolarHBondContact O-N 3.47Å
501	Y	91.9	Very high	89.3	Confident	63 Å²	63	51.1 Å²	51.1	25%	0.247	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.5	-179.7	-54.6	-82.5	0	0	0	110.4	G493 F494 P495 V612 I618 L627	G493-Y501 WeakPolarHBondContact O-CD1 3.46Å; F494-Y501 CarbonylContact O-C 3.57Å; F494-Y501 VanDerWaalsContact O-CA 3.3Å; F494-Y501 WeakPolarHBondContact O-CA 3.43Å; P495-Y501 HydrophobicContact CB-CD1 4.34Å; P495-Y501 HydrophobicContact CB-CE1 4.45Å; Y501-V612 HydrophobicContact CD2-CG2 3.71Å; Y501-V612 HydrophobicContact CE2-CG2 3.88Å; Y501-I618 HydrophobicContact CD2-CG2 4.07Å; Y501-L627 HydrophobicContact CD1-CD2 4.17Å; Y501-L627 HydrophobicContact CD2-CD1 4.25Å; Y501-L627 HydrophobicContact CE1-CD2 3.95Å; Y501-L627 HydrophobicContact CE2-CD2 4.35Å; Y501-L627 HydrophobicContact CG-CD1 4.26Å; Y501-L627 HydrophobicContact CG-CD2 4.46Å
502	C	91.9	Very high	89.2	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.02	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	132.7	170.9	-65.9	0	0	0	0	110.3	C471 D492 G493 F494 R506	C471-C502 WeakPolarHBondContact CA-SG 3.44Å; C471-C502 HydrophobicContact CB-CB 3.68Å; C471-C502 WeakPolarHBondContact CB-SG 3.23Å; C471-C502 WeakPolarHBondContact SG-CA 3.42Å; C471-C502 WeakPolarHBondContact SG-CB 3.34Å; C471-C502 CovalentContact SG-SG 2.04Å; C471-C502 PolarHBondContact SG-SG 3.39Å; D492-C502 CarbonylContact C-O 3.45Å; D492-C502 WeakPolarHBondContact CA-O 3.22Å; G493-C502 PolarHBondContact N-O 2.84Å; F494-C502 HydrophobicContact CB-CB 4.5Å; F494-C502 PolarHBondContact O-N 3.23Å; C502-R506 WeakPolarHBondContact CA-O 3.35Å
503	Y	91.6	Very high	89.2	Confident	21 Å²	21	54.1 Å²	54.1	8%	0.082	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	122.2	170.5	-172.2	-97.9	0	0	0	108.7	D492 K505 R506 D609 G610 I618 I620 L630	D492-Y503 HydrophobicContact CB-CD2 4.06Å; D492-Y503 WeakPolarHBondContact OD1-CA 2.98Å; Y503-K505 PolarHBondContact O-N 3.34Å; Y503-R506 PolarHBondContact N-O 3.24Å; Y503-R506 PolarHBondContact O-N 3.49Å; Y503-D609 HydrophobicContact CD1-CB 4.01Å; Y503-D609 HydrophobicContact CE1-CB 3.54Å; Y503-G610 VanDerWaalsContact CB-CA 3.47Å; Y503-I618 HydrophobicContact CD2-CD1 4.35Å; Y503-I620 HydrophobicContact CE2-CD1 4.09Å; Y503-I620 HydrophobicContact CE2-CG1 4.38Å; Y503-L630 HydrophobicContact CD2-CD2 4.31Å; Y503-L630 HydrophobicContact CE2-CD2 3.95Å
504	Q	88.6	Confident	89.4	Confident	108 Å²	108	53.7 Å²	53.7	51%	0.505	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.6	55.8	179.5	-63	-177.6	-6.9	0	0	112.7	D492 R506	D492-Q504 PolarHBondContact OD1-N 3.5Å; Q504-R506 PolarHBondContact O-N 2.91Å
505	K	84.8	Confident	89.5	Confident	40 Å²	40	56.3 Å²	56.3	17%	0.174	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	7.4	178.3	-168.2	179.8	165.9	127.7	0	115.7	N469 D472 D487 Y489 Y503	N469-K505 PolarHBondContact ND2-O 3.49Å; N469-K505 PolarHBondContact OD1-O 3.26Å; D472-K505 HydrophobicContact CB-CD 4.48Å; D472-K505 HydrophobicContact CB-CG 3.81Å; D472-K505 WeakPolarHBondContact OD1-CE 3.47Å; D472-K505 IonicContact OD1-NZ 3.72Å; D472-K505 PolarHBondContact OD1-NZ 3.13Å; D472-K505 WeakPolarHBondContact OD2-CE 3.11Å; D472-K505 IonicContact OD2-NZ 3.55Å; D472-K505 PolarHBondContact OD2-NZ 2.82Å; D487-K505 IonicContact OD1-NZ 2.8Å; D487-K505 PolarHBondContact OD1-NZ 2.68Å; D487-K505 IonicContact OD2-NZ 2.72Å; D487-K505 PolarHBondContact OD2-NZ 3.1Å; Y489-K505 HydrophobicContact CD1-CB 4.15Å; Y489-K505 HydrophobicContact CD2-CB 4.3Å; Y489-K505 VanDerWaalsContact CD2-N 3.31Å; Y489-K505 HydrophobicContact CG-CB 3.81Å; Y503-K505 PolarHBondContact O-N 3.34Å
506	R	86.4	Confident	89.4	Confident	147 Å²	147	58.2 Å²	58.2	56%	0.555	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.9	-177.1	-61.1	-178.1	-174.9	178.7	2.6	112.3	C502 Y503 Q504	C502-R506 WeakPolarHBondContact CA-O 3.35Å; Y503-R506 PolarHBondContact N-O 3.24Å; Y503-R506 PolarHBondContact O-N 3.49Å; Q504-R506 PolarHBondContact O-N 2.91Å
507	C	89.8	Confident	89.2	Confident	34 Å²	34	57.6 Å²	57.6	23%	0.23	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	92.4	168.4	-171.7	0	0	0	0	108.9	E470 C496	E470-C507 WeakPolarHBondContact OE1-CB 3.4Å; C496-C507 HydrophobicContact CB-CB 3.69Å; C496-C507 WeakPolarHBondContact CB-SG 3.34Å; C496-C507 VanDerWaalsContact SG-CA 3.59Å; C496-C507 WeakPolarHBondContact SG-CB 3.2Å; C496-C507 CovalentContact SG-SG 2.02Å; C496-C507 PolarHBondContact SG-SG 2.99Å
508	N	90.8	Very high	89.3	Confident	28 Å²	28	55.2 Å²	55.2	15%	0.15	27%	0.265	C	S	.	.			trans	-92.1	135.9	-173.7	-64.4	-40.9	0	0	0	112	D609 T611	N508-D609 PolarHBondContact ND2-O 2.94Å; N508-T611 WeakPolarHBondContact CB-OG1 3.32Å
509	N	89.7	Confident	89.6	Confident	35 Å²	35	48.4 Å²	48.4	19%	0.187	24%	0.236	C	C	.	.			trans	-146.3	134.5	178.2	-179.4	-19.2	0	0	0	110.5	D511 Q512 H513	N509-D511 VanDerWaalsContact C-N 3.33Å; N509-D511 PolarHBondContact O-N 3.16Å; N509-D511 PolarHBondContact OD1-N 3.15Å; N509-Q512 HydrophobicContact CB-CB 4.16Å; N509-Q512 PolarHBondContact O-N 3.5Å; N509-H513 WeakPolarHBondContact O-CB 3.02Å; N509-H513 PolarHBondContact O-N 2.64Å
510	H	93.6	Very high	89.9	Confident	13 Å²	13	53.5 Å²	53.5	6%	0.06	25%	0.25	C	S	.	.	H	α-helix	trans	-56.8	-39.5	176.7	-71.1	-59.1	0	0	0	114.3	Q512 H513 C514 S524 Y530 F559 V607 V612	H510-Q512 VanDerWaalsContact C-N 3.35Å; H510-H513 PolarHBondContact O-N 3.38Å; H510-C514 PolarHBondContact O-N 2.88Å; H510-C514 PolarHBondContact O-SG 2.8Å; H510-S524 WeakPolarHBondContact CB-OG 3.37Å; H510-Y530 PolarHBondContact ND1-OH 3.39Å; H510-F559 PolarHBondContact CE1-O 2.84Å; H510-F559 PolarHBondContact NE2-O 3.36Å; H510-V607 VanDerWaalsContact CE1-CG1 3.49Å; H510-V607 WeakPolarHBondContact CE1-CG1 3.36Å; H510-V612 PolarHBondContact NE2-O 3.42Å
511	D	92.4	Very high	89.8	Confident	57 Å²	57	56.5 Å²	56.5	31%	0.305	27%	0.266	S	S	.	.	H	α-helix	trans	-67.3	-39.8	179.8	-76.7	-31.8	0	0	0	111.7	N509 R515 S524	N509-D511 VanDerWaalsContact C-N 3.33Å; N509-D511 PolarHBondContact O-N 3.16Å; N509-D511 PolarHBondContact OD1-N 3.15Å; D511-R515 WeakPolarHBondContact O-CG 3.31Å; D511-R515 PolarHBondContact O-N 2.02Å; D511-R515 VanDerWaalsContact O-N 3.1Å; D511-R515 PolarHBondContact O-NE 2.04Å; D511-S524 VanDerWaalsContact OD1-CB 3.23Å; D511-S524 WeakPolarHBondContact OD1-CB 3.43Å; D511-S524 PolarHBondContact OD1-N 3.24Å
512	Q	89.6	Confident	89.9	Confident	79 Å²	79	53.7 Å²	53.7	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-67.6	-41.9	176.9	-179.9	60.1	18.1	0	0	110.1	N509 H510 C514 R515 E516	N509-Q512 HydrophobicContact CB-CB 4.16Å; N509-Q512 PolarHBondContact O-N 3.5Å; H510-Q512 VanDerWaalsContact C-N 3.35Å; Q512-C514 PolarHBondContact O-N 2.8Å; Q512-R515 WeakPolarHBondContact O-CB 3.48Å; Q512-R515 PolarHBondContact O-N 3.37Å; Q512-R515 VanDerWaalsContact O-N 3.11Å; Q512-E516 WeakPolarHBondContact CG-OE1 3Å; Q512-E516 PolarHBondContact NE2-OE1 3.13Å; Q512-E516 WeakPolarHBondContact O-CG 3.3Å; Q512-E516 PolarHBondContact O-N 2.03Å
513	H	92	Very high	90	Very high	22 Å²	22	57.6 Å²	57.6	10%	0.102	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-44	176.6	-167	-173.9	0	0	0	112.1	N509 H510 R515 E516 I517 I604 D606	N509-H513 WeakPolarHBondContact O-CB 3.02Å; N509-H513 PolarHBondContact O-N 2.64Å; H510-H513 PolarHBondContact O-N 3.38Å; H513-R515 VanDerWaalsContact C-N 3.33Å; H513-R515 PolarHBondContact O-N 3.16Å; H513-E516 PolarHBondContact O-N 2.94Å; H513-I517 WeakPolarHBondContact O-CG1 3.37Å; H513-I517 PolarHBondContact O-N 2.94Å; H513-I604 PolarHBondContact CE1-O 3.5Å; H513-I604 PolarHBondContact NE2-O 2.77Å; H513-D606 PolarHBondContact CE1-O 3.26Å
514	C	93.1	Very high	90.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-38.5	173.3	-76.4	0	0	0	0	112.8	H510 Q512 E516 I517 F518 A522 C565	H510-C514 PolarHBondContact O-N 2.88Å; H510-C514 PolarHBondContact O-SG 2.8Å; Q512-C514 PolarHBondContact O-N 2.8Å; C514-E516 VanDerWaalsContact C-N 3.35Å; C514-I517 PolarHBondContact O-N 2.89Å; C514-F518 PolarHBondContact O-N 2.97Å; C514-A522 HydrophobicContact CB-CB 4.32Å; C514-C565 WeakPolarHBondContact CA-SG 3.33Å; C514-C565 HydrophobicContact CB-CB 3.8Å; C514-C565 WeakPolarHBondContact CB-SG 3.32Å; C514-C565 VanDerWaalsContact SG-CA 3.51Å; C514-C565 WeakPolarHBondContact SG-CB 3.47Å; C514-C565 CovalentContact SG-SG 2.04Å; C514-C565 PolarHBondContact SG-SG 2.99Å
515	R	91.4	Very high	90.4	Very high	101 Å²	101	52.9 Å²	52.9	38%	0.381	26%	0.255	S	S	.	.	H	α-helix	trans	-67.2	-34.9	177.7	-76.7	-179.4	-94.4	164.8	-12.5	113.2	D511 Q512 H513 I517 G519 A522	D511-R515 WeakPolarHBondContact O-CG 3.31Å; D511-R515 PolarHBondContact O-N 2.02Å; D511-R515 VanDerWaalsContact O-N 3.1Å; D511-R515 PolarHBondContact O-NE 2.04Å; Q512-R515 WeakPolarHBondContact O-CB 3.48Å; Q512-R515 PolarHBondContact O-N 3.37Å; Q512-R515 VanDerWaalsContact O-N 3.11Å; H513-R515 VanDerWaalsContact C-N 3.33Å; H513-R515 PolarHBondContact O-N 3.16Å; R515-I517 VanDerWaalsContact C-N 3.34Å; R515-G519 WeakPolarHBondContact CA-O 3.36Å; R515-G519 CarbonylContact O-C 3.49Å; R515-G519 VanDerWaalsContact O-C 3.26Å; R515-G519 WeakPolarHBondContact O-CA 3.02Å; R515-G519 PolarHBondContact O-N 2.93Å; R515-A522 WeakPolarHBondContact CG-O 3.49Å
516	E	87.7	Confident	90.8	Very high	134 Å²	134	53 Å²	53	63%	0.626	26%	0.26	S	S	*	.	H	α-helix	trans	-67.6	-36	175.9	-74.1	167.8	-171.5	0	0	112	Q512 H513 C514	Q512-E516 WeakPolarHBondContact CG-OE1 3Å; Q512-E516 PolarHBondContact NE2-OE1 3.13Å; Q512-E516 WeakPolarHBondContact O-CG 3.3Å; Q512-E516 PolarHBondContact O-N 2.03Å; H513-E516 PolarHBondContact O-N 2.94Å; C514-E516 VanDerWaalsContact C-N 3.35Å
517	I	86.9	Confident	91.1	Very high	15 Å²	15	50.5 Å²	50.5	8%	0.077	26%	0.255	C	S	.	.	H	α-helix	trans	-80.4	-57.8	179.8	-63.2	170.6	0	0	0	111.6	H513 C514 R515 V563 P572 I593 I604	H513-I517 WeakPolarHBondContact O-CG1 3.37Å; H513-I517 PolarHBondContact O-N 2.94Å; C514-I517 PolarHBondContact O-N 2.89Å; R515-I517 VanDerWaalsContact C-N 3.34Å; I517-V563 HydrophobicContact CD1-CG1 3.72Å; I517-P572 WeakPolarHBondContact O-CG 3Å; I517-I593 HydrophobicContact CG2-CD1 3.2Å; I517-I593 HydrophobicContact CG2-CG1 4.06Å; I517-I604 WeakPolarHBondContact CD1-O 3.35Å
518	F	88.5	Confident	91.2	Very high	13 Å²	13	52 Å²	52	6%	0.057	26%	0.261	C	S	.	.	H	α-helix	trans	-104.5	4.7	-167.3	-67.7	-68.1	0	0	0	113.8	C514 A522 C565 V568 P572 L580 W591 I593	C514-F518 PolarHBondContact O-N 2.97Å; F518-A522 HydrophobicContact CB-CB 3.58Å; F518-C565 HydrophobicContact CD2-CB 3.73Å; F518-C565 HydrophobicContact CE2-CB 3.89Å; F518-V568 HydrophobicContact CB-CB 4.43Å; F518-V568 HydrophobicContact CB-CG1 4.04Å; F518-V568 HydrophobicContact CB-CG2 3.73Å; F518-V568 HydrophobicContact CD1-CB 4.44Å; F518-V568 HydrophobicContact CD1-CG1 3.65Å; F518-V568 HydrophobicContact CD1-CG2 3.89Å; F518-V568 HydrophobicContact CD2-CG2 3.88Å; F518-V568 HydrophobicContact CE1-CG1 4.38Å; F518-V568 HydrophobicContact CE1-CG2 4.46Å; F518-V568 HydrophobicContact CE2-CG2 4.45Å; F518-V568 HydrophobicContact CG-CB 4.45Å; F518-V568 HydrophobicContact CG-CG1 4.04Å; F518-V568 HydrophobicContact CG-CG2 3.56Å; F518-P572 HydrophobicContact CD1-CG 4.38Å; F518-L580 HydrophobicContact CE1-CD2 3.72Å; F518-L580 HydrophobicContact CZ-CD2 4.01Å; F518-W591 HydrophobicContact CE2-CB 4.22Å; F518-W591 HydrophobicContact CZ-CB 4.09Å; F518-I593 HydrophobicContact CE1-CD1 4.33Å; F518-I593 HydrophobicContact CE1-CG1 4.39Å; F518-I593 HydrophobicContact CE2-CG1 4.3Å; F518-I593 HydrophobicContact CZ-CD1 3.98Å; F518-I593 HydrophobicContact CZ-CG1 3.67Å
519	G	87.8	Confident	91.4	Very high	35 Å²	35	50.6 Å²	50.6	36%	0.361	25%	0.254	S	S	.	.			trans	89.7	171.5	-179.4	0	0	0	0	0	113.9	R515 D521 A522	R515-G519 WeakPolarHBondContact CA-O 3.36Å; R515-G519 CarbonylContact O-C 3.49Å; R515-G519 VanDerWaalsContact O-C 3.26Å; R515-G519 WeakPolarHBondContact O-CA 3.02Å; R515-G519 PolarHBondContact O-N 2.93Å; G519-D521 PolarHBondContact O-N 3.36Å; G519-A522 WeakPolarHBondContact O-CB 3.05Å; G519-A522 PolarHBondContact O-N 3.2Å
520	K	88.4	Confident	91.6	Very high	174 Å²	174	49 Å²	49	76%	0.757	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-26.1	-166.6	63.6	176.2	-174.4	177.6	0	117
521	D	89.9	Confident	91.7	Very high	65 Å²	65	51.6 Å²	51.6	35%	0.348	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-14	-175.6	-69.7	-11.9	0	0	0	112.2	G519 N567 R569	G519-D521 PolarHBondContact O-N 3.36Å; D521-N567 WeakPolarHBondContact O-CB 3.38Å; D521-R569 WeakPolarHBondContact OD2-CD 3.01Å; D521-R569 IonicContact OD2-CZ 3.84Å; D521-R569 IonicContact OD2-NE 3.65Å; D521-R569 IonicContact OD2-NH1 3.37Å; D521-R569 PolarHBondContact OD2-NH1 3.14Å
522	A	92.9	Very high	91.7	Very high	3 Å²	3	54 Å²	54	3%	0.025	27%	0.266	C	S	.	.			trans	-73.9	150.1	178.5	0	0	0	0	0	111.5	C514 R515 F518 G519 E566 V568	C514-A522 HydrophobicContact CB-CB 4.32Å; R515-A522 WeakPolarHBondContact CG-O 3.49Å; F518-A522 HydrophobicContact CB-CB 3.58Å; G519-A522 WeakPolarHBondContact O-CB 3.05Å; G519-A522 PolarHBondContact O-N 3.2Å; A522-E566 WeakPolarHBondContact CA-O 3.26Å; A522-V568 HydrophobicContact CB-CG2 4.39Å
523	K	94.2	Very high	91.9	Very high	85 Å²	85	50.3 Å²	50.3	37%	0.37	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	165.5	176.5	60	175.4	174.7	132	0	111.1	A525 C565 E566 N567	K523-A525 PolarHBondContact O-N 2.99Å; K523-C565 CarbonylContact O-C 3.23Å; K523-C565 VanDerWaalsContact O-CA 3.26Å; K523-C565 WeakPolarHBondContact O-CA 3.45Å; K523-E566 HydrophobicContact CD-CG 4.32Å; K523-E566 WeakPolarHBondContact CE-OE1 3.36Å; K523-E566 HydrophobicContact CG-CG 3.65Å; K523-E566 PolarHBondContact N-O 3.41Å; K523-E566 VanDerWaalsContact N-O 3.09Å; K523-E566 IonicContact NZ-OE1 3.64Å; K523-E566 PolarHBondContact NZ-OE1 2.87Å; K523-E566 PolarHBondContact O-N 2.79Å; K523-N567 WeakPolarHBondContact CE-ND2 3.44Å
524	S	94.6	Very high	92.1	Very high	24 Å²	24	49.3 Å²	49.3	17%	0.168	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	134.4	175	-172.3	0	0	0	0	110.2	H510 D511 Y530	H510-S524 WeakPolarHBondContact CB-OG 3.37Å; D511-S524 VanDerWaalsContact OD1-CB 3.23Å; D511-S524 WeakPolarHBondContact OD1-CB 3.43Å; D511-S524 PolarHBondContact OD1-N 3.24Å; S524-Y530 PolarHBondContact OG-OH 2.66Å
525	A	94.3	Very high	92.1	Very high	6 Å²	6	51.5 Å²	51.5	5%	0.05	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-76.3	163.8	-178.6	0	0	0	0	0	112.3	K523 C529 Y530 Q564 E566	K523-A525 PolarHBondContact O-N 2.99Å; A525-C529 HydrophobicContact CB-CB 3.68Å; A525-Y530 HydrophobicContact CB-CE2 4.44Å; A525-Y530 WeakPolarHBondContact O-CE2 3.37Å; A525-Q564 HydrophobicContact CB-CB 4.02Å; A525-Q564 VanDerWaalsContact CB-O 3.27Å; A525-Q564 WeakPolarHBondContact CB-O 3.42Å; A525-Q564 PolarHBondContact N-O 3.14Å; A525-E566 WeakPolarHBondContact CA-OE2 3.46Å; A525-E566 HydrophobicContact CB-CB 4.27Å; A525-E566 HydrophobicContact CB-CG 4.48Å
526	S	92.8	Very high	92.1	Very high	42 Å²	42	50.4 Å²	50.4	29%	0.294	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-56.2	156	174.3	75.5	0	0	0	0	113.5	N528 C529 E566	S526-N528 PolarHBondContact O-N 2.93Å; S526-C529 WeakPolarHBondContact O-CB 3.33Å; S526-C529 PolarHBondContact O-N 3.34Å; S526-E566 PolarHBondContact N-OE2 2.91Å
527	Q	92.3	Very high	92.2	Very high	95 Å²	95	44.8 Å²	44.8	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-54.2	-28.4	176.2	-175.9	170.5	21.1	0	0	113.5	Y530 K531 F559	Q527-Y530 PolarHBondContact O-N 2.85Å; Q527-K531 HydrophobicContact CG-CD 4.07Å; Q527-K531 HydrophobicContact CG-CG 4.23Å; Q527-K531 VanDerWaalsContact NE2-CE 3.3Å; Q527-K531 WeakPolarHBondContact O-CB 3.39Å; Q527-K531 WeakPolarHBondContact O-CG 3.47Å; Q527-K531 PolarHBondContact O-N 2.92Å; Q527-F559 HydrophobicContact CB-CE2 4.03Å; Q527-F559 HydrophobicContact CB-CZ 3.7Å; Q527-F559 HydrophobicContact CG-CE2 3.6Å; Q527-F559 HydrophobicContact CG-CZ 3.82Å
528	N	92.6	Very high	92.3	Very high	65 Å²	65	46.3 Å²	46.3	35%	0.348	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-40.1	177.4	-66.9	-21.1	0	0	0	111.6	S526 K531 E532 I585 N586	S526-N528 PolarHBondContact O-N 2.93Å; N528-K531 PolarHBondContact O-N 3.48Å; N528-E532 WeakPolarHBondContact O-CB 3.5Å; N528-E532 WeakPolarHBondContact O-CG 3.48Å; N528-E532 PolarHBondContact O-N 2.91Å; N528-I585 HydrophobicContact CB-CG2 4.24Å; N528-N586 PolarHBondContact ND2-ND2 3.31Å
529	C	94.2	Very high	92.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-49.5	175.9	-66.7	0	0	0	0	111.1	A525 S526 K531 I533 Q564 C590	A525-C529 HydrophobicContact CB-CB 3.68Å; S526-C529 WeakPolarHBondContact O-CB 3.33Å; S526-C529 PolarHBondContact O-N 3.34Å; C529-K531 PolarHBondContact O-N 2.89Å; C529-I533 WeakPolarHBondContact O-CB 3.33Å; C529-I533 VanDerWaalsContact O-CG1 3.28Å; C529-I533 WeakPolarHBondContact O-CG1 3.46Å; C529-I533 PolarHBondContact O-N 3.36Å; C529-Q564 HydrophobicContact CB-CB 4.08Å; C529-C590 VanDerWaalsContact CA-SG 3.54Å; C529-C590 HydrophobicContact CB-CB 3.59Å; C529-C590 WeakPolarHBondContact CB-SG 3.18Å; C529-C590 WeakPolarHBondContact SG-CB 3.08Å; C529-C590 CovalentContact SG-SG 2.02Å; C529-C590 PolarHBondContact SG-SG 2.88Å
530	Y	95.3	Very high	92.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-45.1	178	-76.2	-90.4	0	0	0	112	H510 S524 A525 Q527 N534 V558 F559 R562 V563 Q564	H510-Y530 PolarHBondContact ND1-OH 3.39Å; S524-Y530 PolarHBondContact OG-OH 2.66Å; A525-Y530 HydrophobicContact CB-CE2 4.44Å; A525-Y530 WeakPolarHBondContact O-CE2 3.37Å; Q527-Y530 PolarHBondContact O-N 2.85Å; Y530-N534 VanDerWaalsContact O-CB 3.24Å; Y530-N534 WeakPolarHBondContact O-CB 3.43Å; Y530-N534 PolarHBondContact O-N 3.24Å; Y530-V558 WeakPolarHBondContact CD1-O 3.23Å; Y530-F559 AromaticContact CD1-CD1 3.97Å; Y530-F559 HydrophobicContact CD1-CD1 3.97Å; Y530-F559 HydrophobicContact CD1-CE1 4.45Å; Y530-F559 AromaticContact CD2-CD1 3.8Å; Y530-F559 HydrophobicContact CD2-CD1 3.8Å; Y530-F559 AromaticContact CD2-CE1 3.45Å; Y530-F559 HydrophobicContact CD2-CE1 3.45Å; Y530-F559 VanDerWaalsContact CD2-CE1 3.45Å; Y530-F559 HydrophobicContact CD2-CZ 4.26Å; Y530-F559 HydrophobicContact CE1-CD1 4.07Å; Y530-F559 AromaticContact CE2-CD1 3.93Å; Y530-F559 HydrophobicContact CE2-CD1 3.93Å; Y530-F559 AromaticContact CE2-CE1 3.71Å; Y530-F559 HydrophobicContact CE2-CE1 3.71Å; Y530-F559 AromaticContact CG-CD1 3.81Å; Y530-F559 HydrophobicContact CG-CD1 3.81Å; Y530-F559 AromaticContact CG-CE1 3.86Å; Y530-F559 HydrophobicContact CG-CE1 3.86Å; Y530-F559 HydrophobicContact CG-CG 4.48Å; Y530-R562 WeakPolarHBondContact CE1-O 3.44Å; Y530-V563 WeakPolarHBondContact OH-CG2 3.38Å; Y530-Q564 HydrophobicContact CD1-CB 4.28Å; Y530-Q564 HydrophobicContact CD1-CG 3.96Å; Y530-Q564 HydrophobicContact CD2-CB 4Å; Y530-Q564 HydrophobicContact CD2-CG 4.39Å; Y530-Q564 HydrophobicContact CE1-CB 4.16Å; Y530-Q564 HydrophobicContact CE1-CG 4.17Å; Y530-Q564 HydrophobicContact CE2-CB 3.84Å; Y530-Q564 HydrophobicContact CG-CB 4.23Å; Y530-Q564 HydrophobicContact CG-CG 4.11Å; Y530-Q564 VanDerWaalsContact CZ-N 3.32Å; Y530-Q564 PolarHBondContact OH-N 3.3Å; Y530-Q564 PolarHBondContact OH-O 2.86Å
531	K	94.3	Very high	92.4	Very high	69 Å²	69	40.6 Å²	40.6	30%	0.3	21%	0.208	S	C	.	.	H	α-helix	trans	-60.1	-49.9	179.1	-78.3	177	177.3	168.7	0	112.6	Q527 N528 C529 S535 V558	Q527-K531 HydrophobicContact CG-CD 4.07Å; Q527-K531 HydrophobicContact CG-CG 4.23Å; Q527-K531 VanDerWaalsContact NE2-CE 3.3Å; Q527-K531 WeakPolarHBondContact O-CB 3.39Å; Q527-K531 WeakPolarHBondContact O-CG 3.47Å; Q527-K531 PolarHBondContact O-N 2.92Å; N528-K531 PolarHBondContact O-N 3.48Å; C529-K531 PolarHBondContact O-N 2.89Å; K531-S535 WeakPolarHBondContact O-CB 3.49Å; K531-S535 PolarHBondContact O-N 2.91Å; K531-S535 PolarHBondContact O-OG 2.96Å; K531-V558 HydrophobicContact CG-CG2 4Å
532	E	92.9	Very high	92.6	Very high	108 Å²	108	37.6 Å²	37.6	51%	0.505	19%	0.192	S	C	.	.	H	α-helix	trans	-71.6	-38.4	-175.6	-70.4	-59.3	141.2	0	0	112.6	N528 S535 Q536 I585	N528-E532 WeakPolarHBondContact O-CB 3.5Å; N528-E532 WeakPolarHBondContact O-CG 3.48Å; N528-E532 PolarHBondContact O-N 2.91Å; E532-S535 PolarHBondContact O-OG 2.89Å; E532-Q536 VanDerWaalsContact O-CG 3.29Å; E532-Q536 WeakPolarHBondContact O-CG 2.87Å; E532-Q536 PolarHBondContact O-NE2 3.32Å; E532-I585 HydrophobicContact CB-CD1 3.55Å; E532-I585 HydrophobicContact CG-CD1 3.97Å; E532-I585 HydrophobicContact CG-CG2 4.1Å
533	I	94.2	Very high	92.6	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-83.1	-50.5	-176.1	-57.7	-61.1	0	0	0	110.9	C529 S535 Q536 F540 Q564 I585	C529-I533 WeakPolarHBondContact O-CB 3.33Å; C529-I533 VanDerWaalsContact O-CG1 3.28Å; C529-I533 WeakPolarHBondContact O-CG1 3.46Å; C529-I533 PolarHBondContact O-N 3.36Å; I533-S535 VanDerWaalsContact C-N 3.29Å; I533-S535 PolarHBondContact O-N 3.37Å; I533-Q536 WeakPolarHBondContact O-CB 3.22Å; I533-Q536 PolarHBondContact O-N 2.89Å; I533-Q536 VanDerWaalsContact O-N 3.15Å; I533-F540 WeakPolarHBondContact CG2-O 3.33Å; I533-Q564 HydrophobicContact CB-CG 4.49Å; I533-I585 HydrophobicContact CD1-CD1 4.25Å; I533-I585 HydrophobicContact CG1-CD1 4.36Å
534	N	95.9	Very high	92.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-74.8	-16.1	-173.7	-72.5	-23.3	0	0	0	114.3	Y530 Q536 G541 C553 V558 R562	Y530-N534 VanDerWaalsContact O-CB 3.24Å; Y530-N534 WeakPolarHBondContact O-CB 3.43Å; Y530-N534 PolarHBondContact O-N 3.24Å; N534-Q536 VanDerWaalsContact C-N 3.29Å; N534-G541 WeakPolarHBondContact OD1-CA 3.18Å; N534-C553 HydrophobicContact CB-CB 4.11Å; N534-C553 VanDerWaalsContact O-CB 3.29Å; N534-C553 WeakPolarHBondContact O-CB 3.45Å; N534-C553 PolarHBondContact O-N 2.04Å; N534-C553 PolarHBondContact O-SG 2.83Å; N534-V558 HydrophobicContact CB-CB 4.39Å; N534-V558 PolarHBondContact ND2-O 3Å; N534-R562 PolarHBondContact ND2-N 2.76Å; N534-R562 PolarHBondContact ND2-O 3.04Å; N534-R562 PolarHBondContact OD1-N 3.23Å
535	S	93.9	Very high	91.7	Very high	46 Å²	46	37.1 Å²	37.1	32%	0.322	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.3	171.9	64.7	0	0	0	0	113.7	K531 E532 I533 K552	K531-S535 WeakPolarHBondContact O-CB 3.49Å; K531-S535 PolarHBondContact O-N 2.91Å; K531-S535 PolarHBondContact O-OG 2.96Å; E532-S535 PolarHBondContact O-OG 2.89Å; I533-S535 VanDerWaalsContact C-N 3.29Å; I533-S535 PolarHBondContact O-N 3.37Å; S535-K552 WeakPolarHBondContact O-CD 3.02Å; S535-K552 WeakPolarHBondContact O-CG 3Å
536	Q	91.4	Very high	90.9	Very high	78 Å²	78	42.3 Å²	42.3	36%	0.364	22%	0.223	S	C	.	.	S	Bend	trans	-72.2	-33.4	-179.1	-67.4	174.2	32.8	0	0	112.5	E532 I533 N534 N538 K552	E532-Q536 VanDerWaalsContact O-CG 3.29Å; E532-Q536 WeakPolarHBondContact O-CG 2.87Å; E532-Q536 PolarHBondContact O-NE2 3.32Å; I533-Q536 WeakPolarHBondContact O-CB 3.22Å; I533-Q536 PolarHBondContact O-N 2.89Å; I533-Q536 VanDerWaalsContact O-N 3.15Å; N534-Q536 VanDerWaalsContact C-N 3.29Å; Q536-N538 WeakPolarHBondContact CB-ND2 3.32Å; Q536-N538 PolarHBondContact OE1-ND2 3.09Å; Q536-K552 VanDerWaalsContact O-CE 3.23Å; Q536-K552 WeakPolarHBondContact O-CE 3.34Å
537	G	89.8	Confident	89.8	Confident	17 Å²	17	43.5 Å²	43.5	18%	0.175	24%	0.242	C	C	.	.			trans	65.5	54.5	-176.8	0	0	0	0	0	111	G541 Y550	G537-G541 CarbonylContact C-O 3.59Å; G537-G541 VanDerWaalsContact CA-O 3.22Å; G537-G541 WeakPolarHBondContact CA-O 3.16Å; G537-G541 PolarHBondContact N-O 3.33Å; G537-Y550 WeakPolarHBondContact O-CB 3.02Å
538	N	87.9	Confident	88.4	Confident	47 Å²	47	42.7 Å²	42.7	25%	0.251	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-133.7	-177.4	176.6	66.3	28.3	0	0	0	110.1	Q536 F540 G541 H542	Q536-N538 WeakPolarHBondContact CB-ND2 3.32Å; Q536-N538 PolarHBondContact OE1-ND2 3.09Å; N538-F540 PolarHBondContact O-N 3.02Å; N538-F540 PolarHBondContact OD1-N 3.17Å; N538-G541 PolarHBondContact N-O 2.97Å; N538-G541 CarbonylContact O-C 3.16Å; N538-G541 PolarHBondContact O-N 2.91Å; N538-G541 VanDerWaalsContact O-N 3.12Å; N538-G541 PolarHBondContact OD1-N 2.95Å; N538-H542 PolarHBondContact O-ND1 2.96Å
539	R	85.3	Confident	87.6	Confident	77 Å²	77	43.8 Å²	43.8	29%	0.291	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.2	-177.6	73.3	-177.9	-156.3	167.3	15.1	114.7	Y550 T579 D594 N595	R539-Y550 HydrophobicContact CB-CE1 4.48Å; R539-Y550 HydrophobicContact CB-CE2 4.19Å; R539-T579 VanDerWaalsContact NH2-CG2 3.26Å; R539-T579 PolarHBondContact NH2-OG1 3.04Å; R539-D594 HydrophobicContact CB-CB 4.27Å; R539-D594 HydrophobicContact CG-CB 3.96Å; R539-D594 IonicContact CZ-OD2 2.7Å; R539-D594 IonicContact NE-OD2 2.57Å; R539-D594 IonicContact NH1-OD2 3.53Å; R539-D594 IonicContact NH2-OD2 3.7Å; R539-D594 PolarHBondContact NH2-OD2 3.13Å; R539-D594 CarbonylContact O-C 3.48Å; R539-D594 WeakPolarHBondContact O-CA 3.02Å; R539-N595 PolarHBondContact O-N 2.76Å
540	F	89.6	Confident	87.2	Confident	24 Å²	24	45.9 Å²	45.9	11%	0.105	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-13.7	-178.1	-58.3	-75.3	0	0	0	114.1	I533 N538 R562 Q564 T579 Q581 D594	I533-F540 WeakPolarHBondContact CG2-O 3.33Å; N538-F540 PolarHBondContact O-N 3.02Å; N538-F540 PolarHBondContact OD1-N 3.17Å; F540-R562 VanDerWaalsContact C-CD 3.48Å; F540-R562 WeakPolarHBondContact O-CD 3.4Å; F540-Q564 PolarHBondContact O-NE2 3Å; F540-T579 HydrophobicContact CE1-CG2 4.3Å; F540-T579 HydrophobicContact CZ-CG2 4.15Å; F540-Q581 HydrophobicContact CD1-CB 3.54Å; F540-Q581 HydrophobicContact CD2-CB 4.41Å; F540-Q581 HydrophobicContact CE1-CB 3.56Å; F540-Q581 HydrophobicContact CE2-CB 4.42Å; F540-Q581 HydrophobicContact CG-CB 3.96Å; F540-Q581 HydrophobicContact CZ-CB 3.97Å; F540-D594 HydrophobicContact CD1-CB 3.65Å; F540-D594 HydrophobicContact CE1-CB 3.59Å; F540-D594 HydrophobicContact CG-CB 4.48Å; F540-D594 HydrophobicContact CZ-CB 4.38Å
541	G	92.6	Very high	87	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-157.9	116.1	174.4	0	0	0	0	0	113.8	N534 G537 N538	N534-G541 WeakPolarHBondContact OD1-CA 3.18Å; G537-G541 CarbonylContact C-O 3.59Å; G537-G541 VanDerWaalsContact CA-O 3.22Å; G537-G541 WeakPolarHBondContact CA-O 3.16Å; G537-G541 PolarHBondContact N-O 3.33Å; N538-G541 PolarHBondContact N-O 2.97Å; N538-G541 CarbonylContact O-C 3.16Å; N538-G541 PolarHBondContact O-N 2.91Å; N538-G541 VanDerWaalsContact O-N 3.12Å; N538-G541 PolarHBondContact OD1-N 2.95Å
542	H	93.8	Very high	87.1	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.014	30%	0.297	C	S	.	.			trans	-162.9	165.9	-179.4	56.3	-91.8	0	0	0	111.9	N538 G544 Y550 L551 G561 N595	N538-H542 PolarHBondContact O-ND1 2.96Å; H542-G544 PolarHBondContact CD2-O 3.47Å; H542-Y550 HydrophobicContact CB-CD1 4.31Å; H542-Y550 AromaticContact CD2-CD1 3.93Å; H542-Y550 AromaticContact CE1-CD1 3.46Å; H542-Y550 VanDerWaalsContact CE1-CD1 3.46Å; H542-Y550 WeakPolarHBondContact CE1-CD1 3.48Å; H542-Y550 AromaticContact CE1-CE1 3.63Å; H542-Y550 AromaticContact CG-CD1 3.66Å; H542-Y550 AromaticContact ND1-CD1 3.35Å; H542-Y550 WeakPolarHBondContact ND1-CD1 3.47Å; H542-Y550 AromaticContact ND1-CE1 3.93Å; H542-Y550 AromaticContact NE2-CD1 3.85Å; H542-L551 CarbonylContact C-O 3.25Å; H542-L551 WeakPolarHBondContact CA-O 3.39Å; H542-L551 WeakPolarHBondContact CB-O 3.11Å; H542-G561 CarbonylContact O-C 3.5Å; H542-G561 WeakPolarHBondContact O-CA 3.32Å; H542-N595 PolarHBondContact NE2-ND2 3.01Å
543	C	94	Very high	87.2	Confident	19 Å²	19	48.8 Å²	48.8	13%	0.128	28%	0.276	C	S	.	.	S	Bend	trans	-113.1	53.2	176.1	-84.7	0	0	0	0	111.2	L551 C553 K622	C543-L551 PolarHBondContact N-O 3.41Å; C543-C553 WeakPolarHBondContact CA-SG 3.46Å; C543-C553 HydrophobicContact CB-CB 3.92Å; C543-C553 WeakPolarHBondContact CB-SG 3.48Å; C543-C553 PolarHBondContact N-SG 3.2Å; C543-C553 WeakPolarHBondContact SG-CA 3.28Å; C543-C553 WeakPolarHBondContact SG-CB 3.5Å; C543-C553 CovalentContact SG-SG 2.01Å; C543-C553 PolarHBondContact SG-SG 3.23Å; C543-K622 HydrophobicContact CB-CB 4.1Å
544	G	87.6	Confident	87.3	Confident	19 Å²	19	54.6 Å²	54.6	20%	0.196	30%	0.303	C	S	.	.			trans	102.1	178.1	-176.9	0	0	0	0	0	114.1	H542 L551	H542-G544 PolarHBondContact CD2-O 3.47Å; G544-L551 PolarHBondContact O-N 3.07Å
545	I	82.1	Confident	87.2	Confident	64 Å²	64	60.1 Å²	60.1	33%	0.328	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.7	-174.2	-66	156.6	0	0	0	107.2	G547 T549 Y550 N595 L597	I545-G547 WeakPolarHBondContact CG2-O 3.34Å; I545-T549 WeakPolarHBondContact CA-O 3.3Å; I545-Y550 HydrophobicContact CD1-CD1 4.36Å; I545-Y550 HydrophobicContact CD1-CE1 4.06Å; I545-Y550 HydrophobicContact CG1-CD1 3.77Å; I545-Y550 HydrophobicContact CG1-CE1 3.96Å; I545-N595 WeakPolarHBondContact CD1-ND2 3.39Å; I545-L597 HydrophobicContact CB-CD2 4.38Å; I545-L597 HydrophobicContact CD1-CD2 3.87Å; I545-L597 HydrophobicContact CG1-CD2 4.08Å; I545-L597 HydrophobicContact CG2-CD2 3.39Å
546	N	76.9	Confident	87.2	Confident	115 Å²	115	60.8 Å²	60.8	62%	0.615	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	105.9	170.6	-171.9	10.2	0	0	0	109.2	T548 T549 L551	N546-T548 PolarHBondContact O-N 3.03Å; N546-T549 PolarHBondContact N-O 3.47Å; N546-T549 PolarHBondContact O-N 3.43Å; N546-L551 HydrophobicContact CB-CD1 4.27Å; N546-L551 HydrophobicContact CB-CD2 4Å; N546-L551 HydrophobicContact CB-CG 4.29Å
547	G	70.1	Confident	87.4	Confident	67 Å²	67	58.2 Å²	58.2	69%	0.691	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-103.6	-170.2	0	0	0	0	0	111.1	I545	I545-G547 WeakPolarHBondContact CG2-O 3.34Å
548	T	62.8	Low	87.8	Confident	77 Å²	77	57.5 Å²	57.5	47%	0.472	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-0.7	178.1	55.3	0	0	0	0	113.5	N546 L597	N546-T548 PolarHBondContact O-N 3.03Å; T548-L597 HydrophobicContact CG2-CD1 4.49Å; T548-L597 WeakPolarHBondContact O-CD1 3.44Å
549	T	75.1	Confident	88.2	Confident	88 Å²	88	57 Å²	57	54%	0.54	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.9	-175.2	-56.2	0	0	0	0	111.4	I545 N546	I545-T549 WeakPolarHBondContact CA-O 3.3Å; N546-T549 PolarHBondContact N-O 3.47Å; N546-T549 PolarHBondContact O-N 3.43Å
550	Y	85.6	Confident	88.7	Confident	45 Å²	45	53.3 Å²	53.3	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.2	171.7	-63.7	-77.2	0	0	0	110.7	G537 R539 H542 I545 N595 L597	G537-Y550 WeakPolarHBondContact O-CB 3.02Å; R539-Y550 HydrophobicContact CB-CE1 4.48Å; R539-Y550 HydrophobicContact CB-CE2 4.19Å; H542-Y550 HydrophobicContact CB-CD1 4.31Å; H542-Y550 AromaticContact CD2-CD1 3.93Å; H542-Y550 AromaticContact CE1-CD1 3.46Å; H542-Y550 VanDerWaalsContact CE1-CD1 3.46Å; H542-Y550 WeakPolarHBondContact CE1-CD1 3.48Å; H542-Y550 AromaticContact CE1-CE1 3.63Å; H542-Y550 AromaticContact CG-CD1 3.66Å; H542-Y550 AromaticContact ND1-CD1 3.35Å; H542-Y550 WeakPolarHBondContact ND1-CD1 3.47Å; H542-Y550 AromaticContact ND1-CE1 3.93Å; H542-Y550 AromaticContact NE2-CD1 3.85Å; I545-Y550 HydrophobicContact CD1-CD1 4.36Å; I545-Y550 HydrophobicContact CD1-CE1 4.06Å; I545-Y550 HydrophobicContact CG1-CD1 3.77Å; I545-Y550 HydrophobicContact CG1-CE1 3.96Å; Y550-N595 PolarHBondContact OH-O 2.77Å; Y550-L597 HydrophobicContact CE1-CD2 4.24Å; Y550-L597 HydrophobicContact CE2-CG 4.45Å; Y550-L597 PolarHBondContact OH-N 3.45Å
551	L	91.6	Very high	89	Confident	75 Å²	75	52.2 Å²	52.2	39%	0.393	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-84.8	128.6	-178.9	-60.4	178.2	0	0	0	110.5	H542 C543 G544 N546	H542-L551 CarbonylContact C-O 3.25Å; H542-L551 WeakPolarHBondContact CA-O 3.39Å; H542-L551 WeakPolarHBondContact CB-O 3.11Å; C543-L551 PolarHBondContact N-O 3.41Å; G544-L551 PolarHBondContact O-N 3.07Å; N546-L551 HydrophobicContact CB-CD1 4.27Å; N546-L551 HydrophobicContact CB-CD2 4Å; N546-L551 HydrophobicContact CB-CG 4.29Å
552	K	95.5	Very high	89	Confident	151 Å²	151	52.2 Å²	52.2	66%	0.657	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-63.8	136.8	171.4	-64.6	-176.8	177.2	-171.2	0	110	S535 Q536	S535-K552 WeakPolarHBondContact O-CD 3.02Å; S535-K552 WeakPolarHBondContact O-CG 3Å; Q536-K552 VanDerWaalsContact O-CE 3.23Å; Q536-K552 WeakPolarHBondContact O-CE 3.34Å
553	C	96.3	Very high	89.1	Confident	11 Å²	11	52.2 Å²	52.2	7%	0.074	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-71.6	139.8	171.1	-68.5	0	0	0	0	111.4	N534 C543 V558	N534-C553 HydrophobicContact CB-CB 4.11Å; N534-C553 VanDerWaalsContact O-CB 3.29Å; N534-C553 WeakPolarHBondContact O-CB 3.45Å; N534-C553 PolarHBondContact O-N 2.04Å; N534-C553 PolarHBondContact O-SG 2.83Å; C543-C553 WeakPolarHBondContact CA-SG 3.46Å; C543-C553 HydrophobicContact CB-CB 3.92Å; C543-C553 WeakPolarHBondContact CB-SG 3.48Å; C543-C553 PolarHBondContact N-SG 3.2Å; C543-C553 WeakPolarHBondContact SG-CA 3.28Å; C543-C553 WeakPolarHBondContact SG-CB 3.5Å; C543-C553 CovalentContact SG-SG 2.01Å; C543-C553 PolarHBondContact SG-SG 3.23Å; C553-V558 HydrophobicContact CB-CG1 4.05Å
554	H	95.8	Very high	89.2	Confident	124 Å²	124	51.5 Å²	51.5	57%	0.574	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-67.8	151.1	161.2	-173.3	-98.3	0	0	0	109.5	S556 D557 V558	H554-S556 PolarHBondContact ND1-N 2.81Å; H554-S556 PolarHBondContact ND1-OG 2.97Å; H554-S556 PolarHBondContact O-N 3.01Å; H554-S556 VanDerWaalsContact O-N 3.13Å; H554-D557 HydrophobicContact CB-CB 4.47Å; H554-D557 CarbonylContact O-C 3.37Å; H554-D557 WeakPolarHBondContact O-CA 3.35Å; H554-D557 PolarHBondContact O-N 2.78Å; H554-V558 WeakPolarHBondContact O-CG1 3.35Å; H554-V558 PolarHBondContact O-N 2.97Å
555	I	93.1	Very high	89.5	Confident	116 Å²	116	50.6 Å²	50.6	60%	0.595	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-31.9	-173.6	-61.9	169.9	0	0	0	112.3	D557 V558	I555-D557 VanDerWaalsContact C-N 3.27Å; I555-D557 PolarHBondContact O-N 2.67Å; I555-V558 WeakPolarHBondContact O-CG2 3.26Å
556	S	94.4	Very high	90.1	Very high	60 Å²	60	48.6 Å²	48.6	42%	0.42	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.8	174.9	59.2	0	0	0	0	113.8	H554 C624	H554-S556 PolarHBondContact ND1-N 2.81Å; H554-S556 PolarHBondContact ND1-OG 2.97Å; H554-S556 PolarHBondContact O-N 3.01Å; H554-S556 VanDerWaalsContact O-N 3.13Å; S556-C624 WeakPolarHBondContact O-CB 3.34Å
557	D	96.6	Very high	90.8	Very high	23 Å²	23	47.6 Å²	47.6	12%	0.123	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	1.8	-168.1	-56.6	-28.7	0	0	0	112	H554 I555 F559 C560 G561 C624	H554-D557 HydrophobicContact CB-CB 4.47Å; H554-D557 CarbonylContact O-C 3.37Å; H554-D557 WeakPolarHBondContact O-CA 3.35Å; H554-D557 PolarHBondContact O-N 2.78Å; I555-D557 VanDerWaalsContact C-N 3.27Å; I555-D557 PolarHBondContact O-N 2.67Å; D557-F559 PolarHBondContact O-N 2.78Å; D557-F559 VanDerWaalsContact O-N 3.09Å; D557-C560 WeakPolarHBondContact O-CA 3.41Å; D557-C560 WeakPolarHBondContact O-CB 3.31Å; D557-C560 PolarHBondContact O-N 3.4Å; D557-G561 PolarHBondContact O-N 2.71Å; D557-C624 PolarHBondContact OD1-N 2.84Å
558	V	96.4	Very high	91.7	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-58.5	-27.8	-175.8	-63	0	0	0	0	113.1	Y530 K531 N534 C553 H554 I555 C560	Y530-V558 WeakPolarHBondContact CD1-O 3.23Å; K531-V558 HydrophobicContact CG-CG2 4Å; N534-V558 HydrophobicContact CB-CB 4.39Å; N534-V558 PolarHBondContact ND2-O 3Å; C553-V558 HydrophobicContact CB-CG1 4.05Å; H554-V558 WeakPolarHBondContact O-CG1 3.35Å; H554-V558 PolarHBondContact O-N 2.97Å; I555-V558 WeakPolarHBondContact O-CG2 3.26Å; V558-C560 VanDerWaalsContact C-N 3.28Å; V558-C560 PolarHBondContact O-N 3.47Å
559	F	96.2	Very high	92.6	Very high	36 Å²	36	50.7 Å²	50.7	16%	0.158	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-76.3	-13.9	174	-77.7	-77.3	0	0	0	113.5	H510 Q527 Y530 D557 V607 C613	H510-F559 PolarHBondContact CE1-O 2.84Å; H510-F559 PolarHBondContact NE2-O 3.36Å; Q527-F559 HydrophobicContact CB-CE2 4.03Å; Q527-F559 HydrophobicContact CB-CZ 3.7Å; Q527-F559 HydrophobicContact CG-CE2 3.6Å; Q527-F559 HydrophobicContact CG-CZ 3.82Å; Y530-F559 AromaticContact CD1-CD1 3.97Å; Y530-F559 HydrophobicContact CD1-CD1 3.97Å; Y530-F559 HydrophobicContact CD1-CE1 4.45Å; Y530-F559 AromaticContact CD2-CD1 3.8Å; Y530-F559 HydrophobicContact CD2-CD1 3.8Å; Y530-F559 AromaticContact CD2-CE1 3.45Å; Y530-F559 HydrophobicContact CD2-CE1 3.45Å; Y530-F559 VanDerWaalsContact CD2-CE1 3.45Å; Y530-F559 HydrophobicContact CD2-CZ 4.26Å; Y530-F559 HydrophobicContact CE1-CD1 4.07Å; Y530-F559 AromaticContact CE2-CD1 3.93Å; Y530-F559 HydrophobicContact CE2-CD1 3.93Å; Y530-F559 AromaticContact CE2-CE1 3.71Å; Y530-F559 HydrophobicContact CE2-CE1 3.71Å; Y530-F559 AromaticContact CG-CD1 3.81Å; Y530-F559 HydrophobicContact CG-CD1 3.81Å; Y530-F559 AromaticContact CG-CE1 3.86Å; Y530-F559 HydrophobicContact CG-CE1 3.86Å; Y530-F559 HydrophobicContact CG-CG 4.48Å; D557-F559 PolarHBondContact O-N 2.78Å; D557-F559 VanDerWaalsContact O-N 3.09Å; F559-V607 WeakPolarHBondContact O-CG1 3.14Å; F559-C613 HydrophobicContact CB-CB 3.85Å
560	C	96.6	Very high	92.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-100.7	3.6	179.8	-58	0	0	0	0	113.9	D557 V558 C613 C619 K622	D557-C560 WeakPolarHBondContact O-CA 3.41Å; D557-C560 WeakPolarHBondContact O-CB 3.31Å; D557-C560 PolarHBondContact O-N 3.4Å; V558-C560 VanDerWaalsContact C-N 3.28Å; V558-C560 PolarHBondContact O-N 3.47Å; C560-C613 VanDerWaalsContact SG-CB 3.57Å; C560-C619 WeakPolarHBondContact CA-SG 3.44Å; C560-C619 HydrophobicContact CB-CB 3.66Å; C560-C619 WeakPolarHBondContact CB-SG 3.07Å; C560-C619 WeakPolarHBondContact SG-CA 3.09Å; C560-C619 WeakPolarHBondContact SG-CB 3.5Å; C560-C619 CovalentContact SG-SG 2.04Å; C560-C619 PolarHBondContact SG-SG 3.21Å; C560-K622 WeakPolarHBondContact O-CD 3.42Å
561	G	95.2	Very high	92.2	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.01	27%	0.273	C	S	.	.	S	Bend	trans	-83.4	-118.3	174.2	0	0	0	0	0	112.1	H542 D557 V607	H542-G561 CarbonylContact O-C 3.5Å; H542-G561 WeakPolarHBondContact O-CA 3.32Å; D557-G561 PolarHBondContact O-N 2.71Å; G561-V607 WeakPolarHBondContact O-CB 3.48Å; G561-V607 VanDerWaalsContact O-CG2 3.3Å; G561-V607 WeakPolarHBondContact O-CG2 3.39Å; G561-V607 PolarHBondContact O-N 2.95Å; G561-V607 VanDerWaalsContact O-N 3.16Å
562	R	94.4	Very high	91.1	Very high	1 Å²	1	54 Å²	54	0%	0.004	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-94.2	144.7	173.9	-56.7	-163.7	63.4	66.1	-8.4	112	Y530 N534 F540 I593 D594 D603 G605	Y530-R562 WeakPolarHBondContact CE1-O 3.44Å; N534-R562 PolarHBondContact ND2-N 2.76Å; N534-R562 PolarHBondContact ND2-O 3.04Å; N534-R562 PolarHBondContact OD1-N 3.23Å; F540-R562 VanDerWaalsContact C-CD 3.48Å; F540-R562 WeakPolarHBondContact O-CD 3.4Å; R562-I593 PolarHBondContact NE-O 3.33Å; R562-I593 PolarHBondContact NH2-O 3.06Å; R562-D594 VanDerWaalsContact NH2-C 3.27Å; R562-D594 PolarHBondContact NH2-O 3.03Å; R562-D603 IonicContact CZ-OD1 3.25Å; R562-D603 IonicContact CZ-OD2 2.84Å; R562-D603 VanDerWaalsContact NH1-CG 3.32Å; R562-D603 IonicContact NH1-OD1 3.52Å; R562-D603 PolarHBondContact NH1-OD1 3.29Å; R562-D603 VanDerWaalsContact NH1-OD1 3.16Å; R562-D603 IonicContact NH1-OD2 2.71Å; R562-D603 PolarHBondContact NH1-OD2 3.41Å; R562-D603 IonicContact NH2-OD1 2.77Å; R562-D603 PolarHBondContact NH2-OD1 3.3Å; R562-D603 IonicContact NH2-OD2 3.24Å; R562-G605 WeakPolarHBondContact CA-O 3.03Å
563	V	95.4	Very high	89.5	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.018	28%	0.279	C	S	.	.			trans	-67.7	137.5	176.6	75.5	0	0	0	0	110	I517 Y530 G605 V607	I517-V563 HydrophobicContact CD1-CG1 3.72Å; Y530-V563 WeakPolarHBondContact OH-CG2 3.38Å; V563-G605 WeakPolarHBondContact CG1-O 3.4Å; V563-G605 PolarHBondContact N-O 3.46Å; V563-V607 HydrophobicContact CB-CG2 4.13Å
564	Q	95.5	Very high	87.8	Confident	3 Å²	3	57.1 Å²	57.1	1%	0.014	29%	0.289	C	S	.	.			trans	-122.6	130.5	174.9	-58	-61.1	-45.8	0	0	107.7	A525 C529 Y530 I533 F540	A525-Q564 HydrophobicContact CB-CB 4.02Å; A525-Q564 VanDerWaalsContact CB-O 3.27Å; A525-Q564 WeakPolarHBondContact CB-O 3.42Å; A525-Q564 PolarHBondContact N-O 3.14Å; C529-Q564 HydrophobicContact CB-CB 4.08Å; Y530-Q564 HydrophobicContact CD1-CB 4.28Å; Y530-Q564 HydrophobicContact CD1-CG 3.96Å; Y530-Q564 HydrophobicContact CD2-CB 4Å; Y530-Q564 HydrophobicContact CD2-CG 4.39Å; Y530-Q564 HydrophobicContact CE1-CB 4.16Å; Y530-Q564 HydrophobicContact CE1-CG 4.17Å; Y530-Q564 HydrophobicContact CE2-CB 3.84Å; Y530-Q564 HydrophobicContact CG-CB 4.23Å; Y530-Q564 HydrophobicContact CG-CG 4.11Å; Y530-Q564 VanDerWaalsContact CZ-N 3.32Å; Y530-Q564 PolarHBondContact OH-N 3.3Å; Y530-Q564 PolarHBondContact OH-O 2.86Å; I533-Q564 HydrophobicContact CB-CG 4.49Å; F540-Q564 PolarHBondContact O-NE2 3Å
565	C	95	Very high	85.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	154.7	-172.4	-55.1	0	0	0	0	111.7	C514 F518 K523 V568 W591	C514-C565 WeakPolarHBondContact CA-SG 3.33Å; C514-C565 HydrophobicContact CB-CB 3.8Å; C514-C565 WeakPolarHBondContact CB-SG 3.32Å; C514-C565 VanDerWaalsContact SG-CA 3.51Å; C514-C565 WeakPolarHBondContact SG-CB 3.47Å; C514-C565 CovalentContact SG-SG 2.04Å; C514-C565 PolarHBondContact SG-SG 2.99Å; F518-C565 HydrophobicContact CD2-CB 3.73Å; F518-C565 HydrophobicContact CE2-CB 3.89Å; K523-C565 CarbonylContact O-C 3.23Å; K523-C565 VanDerWaalsContact O-CA 3.26Å; K523-C565 WeakPolarHBondContact O-CA 3.45Å; C565-V568 HydrophobicContact CB-CG2 4.47Å; C565-W591 PolarHBondContact N-O 3.32Å; C565-W591 PolarHBondContact O-N 3.43Å
566	E	94.2	Very high	83.7	Confident	23 Å²	23	58.3 Å²	58.3	11%	0.107	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	172.7	171.8	65.4	-177.3	-137	0	0	110	A522 K523 A525 S526 V568 V588	A522-E566 WeakPolarHBondContact CA-O 3.26Å; K523-E566 HydrophobicContact CD-CG 4.32Å; K523-E566 WeakPolarHBondContact CE-OE1 3.36Å; K523-E566 HydrophobicContact CG-CG 3.65Å; K523-E566 PolarHBondContact N-O 3.41Å; K523-E566 VanDerWaalsContact N-O 3.09Å; K523-E566 IonicContact NZ-OE1 3.64Å; K523-E566 PolarHBondContact NZ-OE1 2.87Å; K523-E566 PolarHBondContact O-N 2.79Å; A525-E566 WeakPolarHBondContact CA-OE2 3.46Å; A525-E566 HydrophobicContact CB-CB 4.27Å; A525-E566 HydrophobicContact CB-CG 4.48Å; S526-E566 PolarHBondContact N-OE2 2.91Å; E566-V568 VanDerWaalsContact C-N 3.26Å; E566-V568 PolarHBondContact O-N 3.29Å; E566-V588 HydrophobicContact CB-CG1 4.1Å; E566-V588 WeakPolarHBondContact OE2-CG1 3.03Å
567	N	91	Very high	81.9	Confident	93 Å²	93	62.1 Å²	62.1	50%	0.497	31%	0.306	S	S	.	.			trans	60.1	27.9	-176.5	-68.5	-5.3	0	0	0	115.6	D521 K523 R569	D521-N567 WeakPolarHBondContact O-CB 3.38Å; K523-N567 WeakPolarHBondContact CE-ND2 3.44Å; N567-R569 PolarHBondContact O-N 2.9Å
568	V	88.5	Confident	80.5	Confident	18 Å²	18	62.8 Å²	62.8	11%	0.109	31%	0.308	C	S	.	.			trans	-70.3	117.4	171	-177	0	0	0	0	109.3	F518 A522 C565 E566 W591	F518-V568 HydrophobicContact CB-CB 4.43Å; F518-V568 HydrophobicContact CB-CG1 4.04Å; F518-V568 HydrophobicContact CB-CG2 3.73Å; F518-V568 HydrophobicContact CD1-CB 4.44Å; F518-V568 HydrophobicContact CD1-CG1 3.65Å; F518-V568 HydrophobicContact CD1-CG2 3.89Å; F518-V568 HydrophobicContact CD2-CG2 3.88Å; F518-V568 HydrophobicContact CE1-CG1 4.38Å; F518-V568 HydrophobicContact CE1-CG2 4.46Å; F518-V568 HydrophobicContact CE2-CG2 4.45Å; F518-V568 HydrophobicContact CG-CB 4.45Å; F518-V568 HydrophobicContact CG-CG1 4.04Å; F518-V568 HydrophobicContact CG-CG2 3.56Å; A522-V568 HydrophobicContact CB-CG2 4.39Å; C565-V568 HydrophobicContact CB-CG2 4.47Å; E566-V568 VanDerWaalsContact C-N 3.26Å; E566-V568 PolarHBondContact O-N 3.29Å; V568-W591 HydrophobicContact CB-CD2 3.94Å; V568-W591 HydrophobicContact CB-CG 3.87Å; V568-W591 HydrophobicContact CG1-CD2 4.29Å; V568-W591 HydrophobicContact CG2-CB 3.73Å; V568-W591 HydrophobicContact CG2-CD2 4.08Å; V568-W591 HydrophobicContact CG2-CG 3.52Å
569	R	81.9	Confident	79.5	Confident	191 Å²	191	65.2 Å²	65.2	72%	0.721	32%	0.323	S	S	*	.			trans	-100.4	-44.9	-179.4	-71.1	-176.2	174.8	169.9	-8.3	112.9	D521 N567	D521-R569 WeakPolarHBondContact OD2-CD 3.01Å; D521-R569 IonicContact OD2-CZ 3.84Å; D521-R569 IonicContact OD2-NE 3.65Å; D521-R569 IonicContact OD2-NH1 3.37Å; D521-R569 PolarHBondContact OD2-NH1 3.14Å; N567-R569 PolarHBondContact O-N 2.9Å
570	D	75.9	Confident	78.8	Confident	128 Å²	128	65.6 Å²	65.6	68%	0.684	33%	0.326	S	S	*	.	S	Bend	trans	-116.7	135.4	-179.6	-61.5	-55.1	0	0	0	108.8	P572	D570-P572 WeakPolarHBondContact O-CD 3.38Å
571	I	76.3	Confident	78.2	Confident	111 Å²	111	67.8 Å²	67.8	57%	0.569	34%	0.337	S	S	*	.			trans	-81.2	119.1	173.9	-66.9	173.9	0	0	0	107.7	L580 W591	I571-L580 HydrophobicContact CB-CD1 4.43Å; I571-L580 HydrophobicContact CG1-CD1 4.42Å; I571-L580 HydrophobicContact CG2-CD1 3.36Å; I571-W591 HydrophobicContact CD1-CZ3 4.45Å
572	P	68.9	Low	77.7	Confident	39 Å²	39	73.4 Å²	73.4	25%	0.253	36%	0.362	S	S	.	.			trans	-64.3	145	178.6	27.9	-35.4	0	0	0	110.6	I517 F518 D570 L574	I517-P572 WeakPolarHBondContact O-CG 3Å; F518-P572 HydrophobicContact CD1-CG 4.38Å; D570-P572 WeakPolarHBondContact O-CD 3.38Å; P572-L574 VanDerWaalsContact C-N 3.3Å; P572-L574 HydrophobicContact CB-CD2 4.16Å; P572-L574 HydrophobicContact CB-CG 4.39Å; P572-L574 HydrophobicContact CG-CD1 4.39Å; P572-L574 HydrophobicContact CG-CD2 3.91Å; P572-L574 HydrophobicContact CG-CG 3.98Å; P572-L574 PolarHBondContact O-N 2.83Å
573	L	60.8	Low	77.3	Confident	176 Å²	176	75.4 Å²	75.4	92%	0.921	38%	0.375	S	S	*	.			trans	-73.7	89.3	168	-160.9	99.2	0	0	0	107.9
574	L	62	Low	77	Confident	52 Å²	52	84.3 Å²	84.3	27%	0.272	41%	0.408	S	S	.	.			trans	-76.1	132.7	176.2	-60.5	172.8	0	0	0	108.7	P572 F578 L580 I593	P572-L574 VanDerWaalsContact C-N 3.3Å; P572-L574 HydrophobicContact CB-CD2 4.16Å; P572-L574 HydrophobicContact CB-CG 4.39Å; P572-L574 HydrophobicContact CG-CD1 4.39Å; P572-L574 HydrophobicContact CG-CD2 3.91Å; P572-L574 HydrophobicContact CG-CG 3.98Å; P572-L574 PolarHBondContact O-N 2.83Å; L574-F578 HydrophobicContact CB-CB 4.2Å; L574-F578 HydrophobicContact CB-CD2 3.77Å; L574-F578 HydrophobicContact CB-CG 4.31Å; L574-F578 HydrophobicContact CD1-CB 3.69Å; L574-F578 HydrophobicContact CD1-CD2 4.28Å; L574-F578 HydrophobicContact CD1-CG 4.05Å; L574-L580 HydrophobicContact CD1-CD2 4.03Å; L574-I593 HydrophobicContact CD1-CD1 3.87Å
575	Q	48.7	Very low	76.6	Confident	154 Å²	154	85.1 Å²	85.1	72%	0.72	41%	0.413	S	S	*	.	S	Bend	trans	-76.2	141	170.2	-68.1	-171.4	-21.7	0	0	108.4	F578	Q575-F578 VanDerWaalsContact O-CD2 3.32Å; Q575-F578 WeakPolarHBondContact O-CD2 3.14Å; Q575-F578 VanDerWaalsContact O-CE2 3.27Å; Q575-F578 WeakPolarHBondContact O-CE2 3.46Å
576	D	54.4	Low	75.9	Confident	110 Å²	110	91.6 Å²	91.6	59%	0.588	45%	0.447	S	S	*	.	S	Bend	trans	65.7	161.7	-178.6	-48.4	-41	0	0	0	114.2	F578	D576-F578 VanDerWaalsContact C-N 3.29Å; D576-F578 WeakPolarHBondContact O-CD2 3.31Å; D576-F578 PolarHBondContact O-N 3.02Å
577	H	56.7	Low	75.2	Confident	140 Å²	140	93 Å²	93	65%	0.648	47%	0.467	S	S	*	.	S	Bend	trans	-61.5	60.5	-163.7	-62.5	-86.7	0	0	0	117
578	F	66.8	Low	75	Confident	38 Å²	38	90.9 Å²	90.9	17%	0.167	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-80.7	127.2	171.7	-71.8	-77.7	0	0	0	111.6	L574 Q575 D576 I593 M599 I601 I604	L574-F578 HydrophobicContact CB-CB 4.2Å; L574-F578 HydrophobicContact CB-CD2 3.77Å; L574-F578 HydrophobicContact CB-CG 4.31Å; L574-F578 HydrophobicContact CD1-CB 3.69Å; L574-F578 HydrophobicContact CD1-CD2 4.28Å; L574-F578 HydrophobicContact CD1-CG 4.05Å; Q575-F578 VanDerWaalsContact O-CD2 3.32Å; Q575-F578 WeakPolarHBondContact O-CD2 3.14Å; Q575-F578 VanDerWaalsContact O-CE2 3.27Å; Q575-F578 WeakPolarHBondContact O-CE2 3.46Å; D576-F578 VanDerWaalsContact C-N 3.29Å; D576-F578 WeakPolarHBondContact O-CD2 3.31Å; D576-F578 PolarHBondContact O-N 3.02Å; F578-I593 HydrophobicContact CB-CG2 4.24Å; F578-I593 HydrophobicContact CD1-CG2 3.48Å; F578-I593 VanDerWaalsContact CD1-CG2 3.48Å; F578-I593 HydrophobicContact CE1-CG2 4.21Å; F578-I593 HydrophobicContact CG-CG2 4.23Å; F578-M599 HydrophobicContact CE1-CE 4.3Å; F578-M599 HydrophobicContact CE1-SD 4.32Å; F578-I601 HydrophobicContact CE1-CD1 4.07Å; F578-I601 HydrophobicContact CE2-CD1 3.59Å; F578-I601 HydrophobicContact CZ-CD1 3.28Å; F578-I601 HydrophobicContact CZ-CG1 4.3Å; F578-I604 HydrophobicContact CD1-CD1 4.4Å; F578-I604 HydrophobicContact CE1-CD1 3.85Å; F578-I604 HydrophobicContact CE1-CG1 3.89Å; F578-I604 HydrophobicContact CE2-CD1 4.44Å; F578-I604 HydrophobicContact CZ-CD1 3.85Å; F578-I604 HydrophobicContact CZ-CG1 4.14Å
579	T	74.9	Confident	75.1	Confident	53 Å²	53	92.4 Å²	92.4	33%	0.325	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-95.4	127.5	166.8	-40.5	0	0	0	0	110.2	R539 F540 D594	R539-T579 VanDerWaalsContact NH2-CG2 3.26Å; R539-T579 PolarHBondContact NH2-OG1 3.04Å; F540-T579 HydrophobicContact CE1-CG2 4.3Å; F540-T579 HydrophobicContact CZ-CG2 4.15Å; T579-D594 WeakPolarHBondContact CB-OD2 3.35Å; T579-D594 PolarHBondContact N-OD1 3.43Å; T579-D594 PolarHBondContact N-OD2 3.23Å; T579-D594 PolarHBondContact O-N 2.66Å; T579-D594 VanDerWaalsContact O-N 3.1Å; T579-D594 VanDerWaalsContact O-OD1 3.1Å; T579-D594 PolarHBondContact OG1-OD2 3.12Å
580	L	81.3	Confident	75.6	Confident	43 Å²	43	83.4 Å²	83.4	23%	0.225	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.1	170.6	-61.3	174.6	0	0	0	109.6	F518 I571 L574 I593	F518-L580 HydrophobicContact CE1-CD2 3.72Å; F518-L580 HydrophobicContact CZ-CD2 4.01Å; I571-L580 HydrophobicContact CB-CD1 4.43Å; I571-L580 HydrophobicContact CG1-CD1 4.42Å; I571-L580 HydrophobicContact CG2-CD1 3.36Å; L574-L580 HydrophobicContact CD1-CD2 4.03Å; L580-I593 HydrophobicContact CD2-CB 4.37Å; L580-I593 HydrophobicContact CD2-CD1 3.64Å; L580-I593 HydrophobicContact CD2-CG1 3.53Å; L580-I593 HydrophobicContact CD2-CG2 4.48Å
581	Q	83.5	Confident	76.4	Confident	47 Å²	47	79.2 Å²	79.2	22%	0.22	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133.5	167.2	-175.9	177.2	41.9	0	0	109.1	F540 W591 G592	F540-Q581 HydrophobicContact CD1-CB 3.54Å; F540-Q581 HydrophobicContact CD2-CB 4.41Å; F540-Q581 HydrophobicContact CE1-CB 3.56Å; F540-Q581 HydrophobicContact CE2-CB 4.42Å; F540-Q581 HydrophobicContact CG-CB 3.96Å; F540-Q581 HydrophobicContact CZ-CB 3.97Å; Q581-W591 WeakPolarHBondContact O-CA 2.98Å; Q581-G592 PolarHBondContact N-O 2.95Å; Q581-G592 PolarHBondContact O-N 2.95Å
582	H	86.6	Confident	77.1	Confident	118 Å²	118	74 Å²	74	55%	0.546	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.2	161.5	69.8	-102.1	0	0	0	109.8	T589 C590 W591	H582-T589 HydrophobicContact CB-CG2 3.92Å; H582-C590 CarbonylContact C-O 3.34Å; H582-C590 VanDerWaalsContact CA-O 3.26Å; H582-C590 WeakPolarHBondContact CA-O 2.92Å; H582-W591 HydrophobicContact CB-CD2 3.78Å; H582-W591 HydrophobicContact CB-CE3 3.72Å; H582-W591 HydrophobicContact CB-CG 4.48Å; H582-W591 HydrophobicContact CB-CH2 3.91Å; H582-W591 HydrophobicContact CB-CZ2 3.97Å; H582-W591 HydrophobicContact CB-CZ3 3.79Å; H582-W591 AromaticContact ND1-CH2 3.82Å; H582-W591 AromaticContact ND1-CZ3 3.94Å
583	T	85.6	Confident	78	Confident	43 Å²	43	72.2 Å²	72.2	26%	0.264	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133	177.3	-54.8	0	0	0	0	108.6	I585 C590	T583-I585 HydrophobicContact CG2-CD1 4.17Å; T583-I585 HydrophobicContact CG2-CG1 3.95Å; T583-C590 PolarHBondContact N-O 2.91Å; T583-C590 PolarHBondContact O-N 3.38Å
584	R	88.9	Confident	79.1	Confident	190 Å²	190	63.9 Å²	63.9	72%	0.717	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.7	178.1	-164	172.8	-170.9	174.8	0.4	110.1	V588	R584-V588 CarbonylContact C-O 3.59Å; R584-V588 WeakPolarHBondContact CA-O 3.45Å
585	I	86.6	Confident	79.8	Confident	21 Å²	21	62.2 Å²	62.2	11%	0.108	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.5	-176.9	-58.6	175.4	0	0	0	108.2	N528 E532 I533 T583 G587 V588	N528-I585 HydrophobicContact CB-CG2 4.24Å; E532-I585 HydrophobicContact CB-CD1 3.55Å; E532-I585 HydrophobicContact CG-CD1 3.97Å; E532-I585 HydrophobicContact CG-CG2 4.1Å; I533-I585 HydrophobicContact CD1-CD1 4.25Å; I533-I585 HydrophobicContact CG1-CD1 4.36Å; T583-I585 HydrophobicContact CG2-CD1 4.17Å; T583-I585 HydrophobicContact CG2-CG1 3.95Å; I585-G587 PolarHBondContact O-N 2.91Å; I585-G587 VanDerWaalsContact O-N 3.14Å; I585-V588 PolarHBondContact N-O 3.44Å; I585-V588 PolarHBondContact O-N 2.9Å
586	N	81.3	Confident	80.8	Confident	135 Å²	135	55.9 Å²	55.9	72%	0.722	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	39.4	179.4	-65.8	-19.4	0	0	0	114.3	N528 V588	N528-N586 PolarHBondContact ND2-ND2 3.31Å; N586-V588 VanDerWaalsContact C-N 3.29Å; N586-V588 PolarHBondContact O-N 2.89Å
587	G	79.7	Confident	80.8	Confident	52 Å²	52	51.4 Å²	51.4	54%	0.536	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	-9.9	178.3	0	0	0	0	0	115.4	I585	I585-G587 PolarHBondContact O-N 2.91Å; I585-G587 VanDerWaalsContact O-N 3.14Å
588	V	85.7	Confident	80.6	Confident	50 Å²	50	52.7 Å²	52.7	30%	0.303	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	140.9	175.9	-178.8	0	0	0	0	110	E566 R584 I585 N586	E566-V588 HydrophobicContact CB-CG1 4.1Å; E566-V588 WeakPolarHBondContact OE2-CG1 3.03Å; R584-V588 CarbonylContact C-O 3.59Å; R584-V588 WeakPolarHBondContact CA-O 3.45Å; I585-V588 PolarHBondContact N-O 3.44Å; I585-V588 PolarHBondContact O-N 2.9Å; N586-V588 VanDerWaalsContact C-N 3.29Å; N586-V588 PolarHBondContact O-N 2.89Å
589	T	90.1	Very high	79.9	Confident	50 Å²	50	52 Å²	52	31%	0.307	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	113.3	173.6	-52.4	0	0	0	0	109.4	H582 W591	H582-T589 HydrophobicContact CB-CG2 3.92Å; T589-W591 HydrophobicContact CG2-CZ2 4.29Å
590	C	93.1	Very high	78.6	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.007	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.6	175.8	-44.5	0	0	0	0	108.9	C529 H582 T583	C529-C590 VanDerWaalsContact CA-SG 3.54Å; C529-C590 HydrophobicContact CB-CB 3.59Å; C529-C590 WeakPolarHBondContact CB-SG 3.18Å; C529-C590 WeakPolarHBondContact SG-CB 3.08Å; C529-C590 CovalentContact SG-SG 2.02Å; C529-C590 PolarHBondContact SG-SG 2.88Å; H582-C590 CarbonylContact C-O 3.34Å; H582-C590 VanDerWaalsContact CA-O 3.26Å; H582-C590 WeakPolarHBondContact CA-O 2.92Å; T583-C590 PolarHBondContact N-O 2.91Å; T583-C590 PolarHBondContact O-N 3.38Å
591	W	93.4	Very high	77.3	Confident	40 Å²	40	55.2 Å²	55.2	15%	0.152	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.9	177.4	-67.1	84.4	0	0	0	110.1	F518 C565 V568 I571 Q581 H582 T589	F518-W591 HydrophobicContact CE2-CB 4.22Å; F518-W591 HydrophobicContact CZ-CB 4.09Å; C565-W591 PolarHBondContact N-O 3.32Å; C565-W591 PolarHBondContact O-N 3.43Å; V568-W591 HydrophobicContact CB-CD2 3.94Å; V568-W591 HydrophobicContact CB-CG 3.87Å; V568-W591 HydrophobicContact CG1-CD2 4.29Å; V568-W591 HydrophobicContact CG2-CB 3.73Å; V568-W591 HydrophobicContact CG2-CD2 4.08Å; V568-W591 HydrophobicContact CG2-CG 3.52Å; I571-W591 HydrophobicContact CD1-CZ3 4.45Å; Q581-W591 WeakPolarHBondContact O-CA 2.98Å; H582-W591 HydrophobicContact CB-CD2 3.78Å; H582-W591 HydrophobicContact CB-CE3 3.72Å; H582-W591 HydrophobicContact CB-CG 4.48Å; H582-W591 HydrophobicContact CB-CH2 3.91Å; H582-W591 HydrophobicContact CB-CZ2 3.97Å; H582-W591 HydrophobicContact CB-CZ3 3.79Å; H582-W591 AromaticContact ND1-CH2 3.82Å; H582-W591 AromaticContact ND1-CZ3 3.94Å; T589-W591 HydrophobicContact CG2-CZ2 4.29Å
592	G	90	Very high	76.5	Confident	2 Å²	2	58.2 Å²	58.2	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.3	176.5	0	0	0	0	0	111.2	Q581	Q581-G592 PolarHBondContact N-O 2.95Å; Q581-G592 PolarHBondContact O-N 2.95Å
593	I	87.3	Confident	76.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.7	174.3	-51.2	-156	0	0	0	108	I517 F518 R562 L574 F578 L580 I604	I517-I593 HydrophobicContact CG2-CD1 3.2Å; I517-I593 HydrophobicContact CG2-CG1 4.06Å; F518-I593 HydrophobicContact CE1-CD1 4.33Å; F518-I593 HydrophobicContact CE1-CG1 4.39Å; F518-I593 HydrophobicContact CE2-CG1 4.3Å; F518-I593 HydrophobicContact CZ-CD1 3.98Å; F518-I593 HydrophobicContact CZ-CG1 3.67Å; R562-I593 PolarHBondContact NE-O 3.33Å; R562-I593 PolarHBondContact NH2-O 3.06Å; L574-I593 HydrophobicContact CD1-CD1 3.87Å; F578-I593 HydrophobicContact CB-CG2 4.24Å; F578-I593 HydrophobicContact CD1-CG2 3.48Å; F578-I593 VanDerWaalsContact CD1-CG2 3.48Å; F578-I593 HydrophobicContact CE1-CG2 4.21Å; F578-I593 HydrophobicContact CG-CG2 4.23Å; L580-I593 HydrophobicContact CD2-CB 4.37Å; L580-I593 HydrophobicContact CD2-CD1 3.64Å; L580-I593 HydrophobicContact CD2-CG1 3.53Å; L580-I593 HydrophobicContact CD2-CG2 4.48Å; I593-I604 HydrophobicContact CD1-CD1 4Å
594	D	84.1	Confident	76.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.281	C	S	.	.			trans	-66.5	157.1	172.8	54.6	-0.5	0	0	0	113.1	R539 F540 R562 T579 H596	R539-D594 HydrophobicContact CB-CB 4.27Å; R539-D594 HydrophobicContact CG-CB 3.96Å; R539-D594 IonicContact CZ-OD2 2.7Å; R539-D594 IonicContact NE-OD2 2.57Å; R539-D594 IonicContact NH1-OD2 3.53Å; R539-D594 IonicContact NH2-OD2 3.7Å; R539-D594 PolarHBondContact NH2-OD2 3.13Å; R539-D594 CarbonylContact O-C 3.48Å; R539-D594 WeakPolarHBondContact O-CA 3.02Å; F540-D594 HydrophobicContact CD1-CB 3.65Å; F540-D594 HydrophobicContact CE1-CB 3.59Å; F540-D594 HydrophobicContact CG-CB 4.48Å; F540-D594 HydrophobicContact CZ-CB 4.38Å; R562-D594 VanDerWaalsContact NH2-C 3.27Å; R562-D594 PolarHBondContact NH2-O 3.03Å; T579-D594 WeakPolarHBondContact CB-OD2 3.35Å; T579-D594 PolarHBondContact N-OD1 3.43Å; T579-D594 PolarHBondContact N-OD2 3.23Å; T579-D594 PolarHBondContact O-N 2.66Å; T579-D594 VanDerWaalsContact O-N 3.1Å; T579-D594 VanDerWaalsContact O-OD1 3.1Å; T579-D594 PolarHBondContact OG1-OD2 3.12Å; D594-H596 IonicContact OD2-CD2 2.81Å; D594-H596 IonicContact OD2-CE1 2.66Å; D594-H596 IonicContact OD2-NE2 3.01Å; D594-H596 PolarHBondContact OD2-NE2 3.18Å
595	N	77.4	Confident	76.1	Confident	17 Å²	17	45.4 Å²	45.4	9%	0.091	25%	0.247	C	C	.	.			trans	-115.4	121.1	159.5	-172.8	17.6	0	0	0	106.6	R539 H542 I545 Y550 M599 D603	R539-N595 PolarHBondContact O-N 2.76Å; H542-N595 PolarHBondContact NE2-ND2 3.01Å; I545-N595 WeakPolarHBondContact CD1-ND2 3.39Å; Y550-N595 PolarHBondContact OH-O 2.77Å; N595-M599 VanDerWaalsContact OD1-CE 3.3Å; N595-M599 WeakPolarHBondContact OD1-CE 3.39Å; N595-D603 PolarHBondContact ND2-OD2 2.98Å; N595-D603 PolarHBondContact OD1-OD2 3.13Å
596	H	70.3	Confident	76.4	Confident	21 Å²	21	45.8 Å²	45.8	10%	0.097	25%	0.25	C	C	.	.			trans	-87.8	145.2	167.9	-72	-88.9	0	0	0	110.3	H206 D594 R598 M599	H206-H596 WeakPolarHBondContact CE1-CB 3.38Å; H206-H596 AromaticContact CE1-CD2 3.54Å; H206-H596 AromaticContact CE1-CG 3.28Å; H206-H596 AromaticContact CE1-ND1 3.94Å; H206-H596 AromaticContact NE2-CD2 3.52Å; H206-H596 AromaticContact NE2-CG 3.77Å; D594-H596 IonicContact OD2-CD2 2.81Å; D594-H596 IonicContact OD2-CE1 2.66Å; D594-H596 IonicContact OD2-NE2 3.01Å; D594-H596 PolarHBondContact OD2-NE2 3.18Å; H596-R598 PolarHBondContact O-N 3.12Å; H596-M599 HydrophobicContact CB-CG 3.73Å; H596-M599 HydrophobicContact CB-SD 4.14Å
597	L	54.5	Low	77	Confident	16 Å²	16	39.4 Å²	39.4	8%	0.084	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	136.5	170.9	-62.8	168.5	0	0	0	108.6	I545 T548 Y550 M599	I545-L597 HydrophobicContact CB-CD2 4.38Å; I545-L597 HydrophobicContact CD1-CD2 3.87Å; I545-L597 HydrophobicContact CG1-CD2 4.08Å; I545-L597 HydrophobicContact CG2-CD2 3.39Å; T548-L597 HydrophobicContact CG2-CD1 4.49Å; T548-L597 WeakPolarHBondContact O-CD1 3.44Å; Y550-L597 HydrophobicContact CE1-CD2 4.24Å; Y550-L597 HydrophobicContact CE2-CG 4.45Å; Y550-L597 PolarHBondContact OH-N 3.45Å; L597-M599 VanDerWaalsContact C-N 3.34Å; L597-M599 PolarHBondContact O-N 3.49Å
598	R	52.2	Low	77.6	Confident	168 Å²	168	39.8 Å²	39.8	63%	0.634	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	37.5	176.1	-55.4	175.7	173.3	-134.8	-0.3	115	T205 H596 N600	T205-R598 HydrophobicContact CG2-CB 3.69Å; T205-R598 HydrophobicContact CG2-CG 4.21Å; H596-R598 PolarHBondContact O-N 3.12Å; R598-N600 PolarHBondContact O-N 2.86Å
599	M	52.2	Low	77.9	Confident	24 Å²	24	39.1 Å²	39.1	12%	0.118	20%	0.197	C	C	.	.			trans	-64.6	125.5	157.9	-73.8	-159.2	-60.5	0	0	109.7	F578 N595 H596 L597 I601	F578-M599 HydrophobicContact CE1-CE 4.3Å; F578-M599 HydrophobicContact CE1-SD 4.32Å; N595-M599 VanDerWaalsContact OD1-CE 3.3Å; N595-M599 WeakPolarHBondContact OD1-CE 3.39Å; H596-M599 HydrophobicContact CB-CG 3.73Å; H596-M599 HydrophobicContact CB-SD 4.14Å; L597-M599 VanDerWaalsContact C-N 3.34Å; L597-M599 PolarHBondContact O-N 3.49Å; M599-I601 HydrophobicContact CB-CG1 3.83Å; M599-I601 HydrophobicContact CG-CG1 4.28Å; M599-I601 PolarHBondContact O-N 3.46Å; M599-I601 HydrophobicContact SD-CD1 3.93Å; M599-I601 HydrophobicContact SD-CG1 3.91Å
600	N	46.1	Very low	78	Confident	111 Å²	111	36.8 Å²	36.8	59%	0.594	18%	0.183	S	C	*	.	S	Bend	trans	-77.1	-1.6	169.4	-101.5	0	0	0	0	112.7	F209 R598	F209-N600 WeakPolarHBondContact CZ-ND2 3.43Å; R598-N600 PolarHBondContact O-N 2.86Å
601	I	54.8	Low	78.1	Confident	52 Å²	52	36.9 Å²	36.9	27%	0.267	18%	0.183	S	C	.	.	S	Bend	trans	-95.9	137.6	172.3	54.2	-178.2	0	0	0	109.5	F578 M599 D603	F578-I601 HydrophobicContact CE1-CD1 4.07Å; F578-I601 HydrophobicContact CE2-CD1 3.59Å; F578-I601 HydrophobicContact CZ-CD1 3.28Å; F578-I601 HydrophobicContact CZ-CG1 4.3Å; M599-I601 HydrophobicContact CB-CG1 3.83Å; M599-I601 HydrophobicContact CG-CG1 4.28Å; M599-I601 PolarHBondContact O-N 3.46Å; M599-I601 HydrophobicContact SD-CD1 3.93Å; M599-I601 HydrophobicContact SD-CG1 3.91Å; I601-D603 PolarHBondContact O-N 3.21Å
602	P	65.8	Low	78.1	Confident	109 Å²	109	36.8 Å²	36.8	71%	0.708	19%	0.187	S	C	*	.			trans	-54.3	129.9	175.8	-24.7	33.4	0	0	0	110.9	I604	P602-I604 WeakPolarHBondContact O-CG2 3.44Å; P602-I604 PolarHBondContact O-N 2Å
603	D	80.9	Confident	78.3	Confident	23 Å²	23	37.4 Å²	37.4	12%	0.123	19%	0.191	C	C	.	.			trans	-63.1	107	178.4	-176.9	-1.5	0	0	0	110.1	R562 N595 I601 G605 D606 K608	R562-D603 IonicContact CZ-OD1 3.25Å; R562-D603 IonicContact CZ-OD2 2.84Å; R562-D603 VanDerWaalsContact NH1-CG 3.32Å; R562-D603 IonicContact NH1-OD1 3.52Å; R562-D603 PolarHBondContact NH1-OD1 3.29Å; R562-D603 VanDerWaalsContact NH1-OD1 3.16Å; R562-D603 IonicContact NH1-OD2 2.71Å; R562-D603 PolarHBondContact NH1-OD2 3.41Å; R562-D603 IonicContact NH2-OD1 2.77Å; R562-D603 PolarHBondContact NH2-OD1 3.3Å; R562-D603 IonicContact NH2-OD2 3.24Å; N595-D603 PolarHBondContact ND2-OD2 2.98Å; N595-D603 PolarHBondContact OD1-OD2 3.13Å; I601-D603 PolarHBondContact O-N 3.21Å; D603-G605 PolarHBondContact OD1-N 3.33Å; D603-D606 HydrophobicContact CB-CB 3.91Å; D603-D606 PolarHBondContact OD1-N 3.19Å; D603-D606 WeakPolarHBondContact OD2-CB 3.33Å; D603-K608 PolarHBondContact O-NZ 3.09Å
604	I	84.8	Confident	78.5	Confident	58 Å²	58	38.2 Å²	38.2	30%	0.297	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-21.5	-178.8	63.4	172.4	0	0	0	112	H513 I517 F578 I593 P602 D606	H513-I604 PolarHBondContact CE1-O 3.5Å; H513-I604 PolarHBondContact NE2-O 2.77Å; I517-I604 WeakPolarHBondContact CD1-O 3.35Å; F578-I604 HydrophobicContact CD1-CD1 4.4Å; F578-I604 HydrophobicContact CE1-CD1 3.85Å; F578-I604 HydrophobicContact CE1-CG1 3.89Å; F578-I604 HydrophobicContact CE2-CD1 4.44Å; F578-I604 HydrophobicContact CZ-CD1 3.85Å; F578-I604 HydrophobicContact CZ-CG1 4.14Å; I593-I604 HydrophobicContact CD1-CD1 4Å; P602-I604 WeakPolarHBondContact O-CG2 3.44Å; P602-I604 PolarHBondContact O-N 2Å; I604-D606 VanDerWaalsContact C-N 3.34Å
605	G	88.8	Confident	78.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-5.2	178.2	0	0	0	0	0	113.4	R562 V563 D603	R562-G605 WeakPolarHBondContact CA-O 3.03Å; V563-G605 WeakPolarHBondContact CG1-O 3.4Å; V563-G605 PolarHBondContact N-O 3.46Å; D603-G605 PolarHBondContact OD1-N 3.33Å
606	D	91.6	Very high	79.3	Confident	30 Å²	30	45.6 Å²	45.6	16%	0.16	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-76.9	123.6	-177.3	-173.6	52.5	0	0	0	112.9	H513 D603 I604 K608 K622	H513-D606 PolarHBondContact CE1-O 3.26Å; D603-D606 HydrophobicContact CB-CB 3.91Å; D603-D606 PolarHBondContact OD1-N 3.19Å; D603-D606 WeakPolarHBondContact OD2-CB 3.33Å; I604-D606 VanDerWaalsContact C-N 3.34Å; D606-K608 WeakPolarHBondContact O-CE 3.35Å; D606-K608 PolarHBondContact O-N 2.85Å; D606-K608 IonicContact OD2-NZ 2.76Å; D606-K622 VanDerWaalsContact OD1-CE 3.28Å; D606-K622 WeakPolarHBondContact OD1-CE 3.39Å; D606-K622 IonicContact OD1-NZ 2.73Å; D606-K622 PolarHBondContact OD1-NZ 3.13Å; D606-K622 IonicContact OD2-NZ 3.8Å; D606-K622 PolarHBondContact OD2-NZ 3Å
607	V	94.8	Very high	80.4	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-67.7	120.9	175.4	176.6	0	0	0	0	109.1	H510 F559 G561 V563 T611 K622	H510-V607 VanDerWaalsContact CE1-CG1 3.49Å; H510-V607 WeakPolarHBondContact CE1-CG1 3.36Å; F559-V607 WeakPolarHBondContact O-CG1 3.14Å; G561-V607 WeakPolarHBondContact O-CB 3.48Å; G561-V607 VanDerWaalsContact O-CG2 3.3Å; G561-V607 WeakPolarHBondContact O-CG2 3.39Å; G561-V607 PolarHBondContact O-N 2.95Å; G561-V607 VanDerWaalsContact O-N 3.16Å; V563-V607 HydrophobicContact CB-CG2 4.13Å; V607-T611 HydrophobicContact CG1-CG2 4.04Å; V607-K622 PolarHBondContact O-NZ 2.89Å
608	K	91.5	Very high	82.3	Confident	61 Å²	61	48.3 Å²	48.3	27%	0.265	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-77.2	149.2	-176.8	-53.6	-55.4	172.5	-165.9	0	111.4	D603 D606 T611	D603-K608 PolarHBondContact O-NZ 3.09Å; D606-K608 WeakPolarHBondContact O-CE 3.35Å; D606-K608 PolarHBondContact O-N 2.85Å; D606-K608 IonicContact OD2-NZ 2.76Å; K608-T611 VanDerWaalsContact O-CB 3.3Å; K608-T611 WeakPolarHBondContact O-CB 3.41Å; K608-T611 PolarHBondContact O-N 3.38Å; K608-T611 PolarHBondContact O-OG1 2.9Å
609	D	92.6	Very high	84.4	Confident	35 Å²	35	40.3 Å²	40.3	19%	0.187	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	148.7	175.8	-74.3	1.7	0	0	0	110.9	Y503 N508 T611 C619 H621	Y503-D609 HydrophobicContact CD1-CB 4.01Å; Y503-D609 HydrophobicContact CE1-CB 3.54Å; N508-D609 PolarHBondContact ND2-O 2.94Å; D609-T611 VanDerWaalsContact C-N 3.29Å; D609-T611 PolarHBondContact O-N 2.71Å; D609-C619 CarbonylContact C-O 3.56Å; D609-C619 VanDerWaalsContact CA-O 3.26Å; D609-C619 WeakPolarHBondContact CA-O 3.38Å; D609-H621 VanDerWaalsContact CG-N 3.34Å; D609-H621 PolarHBondContact OD1-N 2.6Å; D609-H621 VanDerWaalsContact OD1-N 3.13Å; D609-H621 PolarHBondContact OD2-N 2.78Å
610	G	91.9	Very high	86.3	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.01	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	-11.4	-169.7	0	0	0	0	0	115.3	Y503 C619	Y503-G610 VanDerWaalsContact CB-CA 3.47Å; G610-C619 PolarHBondContact N-O 2.83Å
611	T	94.6	Very high	88.5	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.025	24%	0.242	C	C	.	.			trans	-66.5	136.7	177.3	-52.8	0	0	0	0	110.8	N508 V607 K608 D609 C613 I618 C619	N508-T611 WeakPolarHBondContact CB-OG1 3.32Å; V607-T611 HydrophobicContact CG1-CG2 4.04Å; K608-T611 VanDerWaalsContact O-CB 3.3Å; K608-T611 WeakPolarHBondContact O-CB 3.41Å; K608-T611 PolarHBondContact O-N 3.38Å; K608-T611 PolarHBondContact O-OG1 2.9Å; D609-T611 VanDerWaalsContact C-N 3.29Å; D609-T611 PolarHBondContact O-N 2.71Å; T611-C613 PolarHBondContact O-N 3.5Å; T611-I618 CarbonylContact O-C 3.54Å; T611-I618 VanDerWaalsContact O-CA 3.31Å; T611-I618 WeakPolarHBondContact O-CA 3.36Å; T611-C619 PolarHBondContact O-N 2.02Å; T611-C619 PolarHBondContact O-SG 3.48Å
612	V	93.6	Very high	90.3	Very high	37 Å²	37	41.7 Å²	41.7	22%	0.224	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	123.3	178.9	176.2	0	0	0	0	110.9	S499 Y501 H510 G614 K617 I618	S499-V612 WeakPolarHBondContact O-CG2 3.15Å; Y501-V612 HydrophobicContact CD2-CG2 3.71Å; Y501-V612 HydrophobicContact CE2-CG2 3.88Å; H510-V612 PolarHBondContact NE2-O 3.42Å; V612-G614 WeakPolarHBondContact CG1-O 3.25Å; V612-K617 WeakPolarHBondContact CA-O 3.26Å; V612-I618 HydrophobicContact CG2-CG2 4.34Å
613	C	94.2	Very high	91.7	Very high	15 Å²	15	42.7 Å²	42.7	10%	0.101	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-1.9	178.7	58.5	0	0	0	0	113.6	F559 C560 T611 K617 C624	F559-C613 HydrophobicContact CB-CB 3.85Å; C560-C613 VanDerWaalsContact SG-CB 3.57Å; T611-C613 PolarHBondContact O-N 3.5Å; C613-K617 PolarHBondContact N-O 3.15Å; C613-K617 VanDerWaalsContact N-O 3.16Å; C613-C624 HydrophobicContact CB-CB 3.81Å; C613-C624 WeakPolarHBondContact CB-SG 3.46Å; C613-C624 WeakPolarHBondContact SG-CA 3.43Å; C613-C624 WeakPolarHBondContact SG-CB 3.18Å; C613-C624 CovalentContact SG-SG 2.03Å; C613-C624 PolarHBondContact SG-SG 2.98Å
614	G	91	Very high	92.5	Very high	20 Å²	20	42.5 Å²	42.5	21%	0.206	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	175.3	176.7	0	0	0	0	0	111.8	V612 G616 K617	V612-G614 WeakPolarHBondContact CG1-O 3.25Å; G614-G616 PolarHBondContact O-N 3.38Å; G614-G616 VanDerWaalsContact O-N 3.14Å; G614-K617 PolarHBondContact O-N 2.03Å
615	P	89.8	Confident	93	Very high	134 Å²	134	41.6 Å²	41.6	87%	0.87	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	119.6	179.2	-24	34.2	0	0	0	111.6	K617	P615-K617 PolarHBondContact O-N 3.28Å
616	G	89	Confident	93.2	Very high	37 Å²	37	44 Å²	44	38%	0.381	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	21.9	-177.7	0	0	0	0	0	114.7	G614 L627	G614-G616 PolarHBondContact O-N 3.38Å; G614-G616 VanDerWaalsContact O-N 3.14Å; G616-L627 WeakPolarHBondContact O-CB 3.3Å; G616-L627 PolarHBondContact O-N 3.48Å
617	K	93.4	Very high	93.1	Very high	93 Å²	93	43.8 Å²	43.8	40%	0.404	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.5	-178.1	-63.1	-172.8	179.7	-174.2	0	112.6	V612 C613 G614 P615 V625	V612-K617 WeakPolarHBondContact CA-O 3.26Å; C613-K617 PolarHBondContact N-O 3.15Å; C613-K617 VanDerWaalsContact N-O 3.16Å; G614-K617 PolarHBondContact O-N 2.03Å; P615-K617 PolarHBondContact O-N 3.28Å; K617-V625 CarbonylContact C-O 3.45Å; K617-V625 WeakPolarHBondContact CA-O 3.18Å; K617-V625 VanDerWaalsContact CB-O 3.26Å; K617-V625 WeakPolarHBondContact CB-O 3.43Å
618	I	94.6	Very high	92.7	Very high	2 Å²	2	48 Å²	48	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	158.5	179.1	57.3	164.8	0	0	0	111.5	Y501 Y503 T611 V612 I620 V625 L627 L630	Y501-I618 HydrophobicContact CD2-CG2 4.07Å; Y503-I618 HydrophobicContact CD2-CD1 4.35Å; T611-I618 CarbonylContact O-C 3.54Å; T611-I618 VanDerWaalsContact O-CA 3.31Å; T611-I618 WeakPolarHBondContact O-CA 3.36Å; V612-I618 HydrophobicContact CG2-CG2 4.34Å; I618-I620 HydrophobicContact CD1-CD1 3.95Å; I618-I620 HydrophobicContact CD1-CG1 4.11Å; I618-I620 HydrophobicContact CG1-CD1 4.43Å; I618-I620 HydrophobicContact CG1-CG1 4.34Å; I618-V625 HydrophobicContact CG1-CG2 4.43Å; I618-V625 PolarHBondContact N-O 2.68Å; I618-V625 WeakPolarHBondContact O-CG2 3.43Å; I618-V625 PolarHBondContact O-N 3.47Å; I618-L627 HydrophobicContact CD1-CD1 3.94Å; I618-L627 HydrophobicContact CG1-CD1 4.15Å; I618-L627 HydrophobicContact CG2-CD1 3.86Å; I618-L630 HydrophobicContact CD1-CD1 3.76Å; I618-L630 HydrophobicContact CD1-CD2 4.28Å; I618-L630 HydrophobicContact CD1-CG 4.17Å
619	C	95.5	Very high	92.4	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127.1	174.1	-64	0	0	0	0	111.1	C560 D609 G610 T611 K623	C560-C619 WeakPolarHBondContact CA-SG 3.44Å; C560-C619 HydrophobicContact CB-CB 3.66Å; C560-C619 WeakPolarHBondContact CB-SG 3.07Å; C560-C619 WeakPolarHBondContact SG-CA 3.09Å; C560-C619 WeakPolarHBondContact SG-CB 3.5Å; C560-C619 CovalentContact SG-SG 2.04Å; C560-C619 PolarHBondContact SG-SG 3.21Å; D609-C619 CarbonylContact C-O 3.56Å; D609-C619 VanDerWaalsContact CA-O 3.26Å; D609-C619 WeakPolarHBondContact CA-O 3.38Å; G610-C619 PolarHBondContact N-O 2.83Å; T611-C619 PolarHBondContact O-N 2.02Å; T611-C619 PolarHBondContact O-SG 3.48Å; C619-K623 WeakPolarHBondContact CA-O 3.25Å
620	I	93.1	Very high	92	Very high	25 Å²	25	49.2 Å²	49.2	13%	0.128	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	125.9	169.3	-62	-175.7	0	0	0	107.6	Y503 I618 K622 K623 V625 L630	Y503-I620 HydrophobicContact CE2-CD1 4.09Å; Y503-I620 HydrophobicContact CE2-CG1 4.38Å; I618-I620 HydrophobicContact CD1-CD1 3.95Å; I618-I620 HydrophobicContact CD1-CG1 4.11Å; I618-I620 HydrophobicContact CG1-CD1 4.43Å; I618-I620 HydrophobicContact CG1-CG1 4.34Å; I620-K622 VanDerWaalsContact C-N 3.26Å; I620-K622 PolarHBondContact O-N 3.37Å; I620-K623 PolarHBondContact N-O 2.83Å; I620-K623 PolarHBondContact O-N 3.02Å; I620-V625 HydrophobicContact CB-CG2 3.95Å; I620-V625 HydrophobicContact CD1-CG2 3.8Å; I620-V625 HydrophobicContact CG1-CG2 3.82Å; I620-L630 HydrophobicContact CD1-CD2 4.07Å
621	H	91.8	Very high	91.1	Very high	153 Å²	153	52.6 Å²	52.6	71%	0.708	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	47.9	-177.5	-58.8	114.1	0	0	0	112.9	D609 K623	D609-H621 VanDerWaalsContact CG-N 3.34Å; D609-H621 PolarHBondContact OD1-N 2.6Å; D609-H621 VanDerWaalsContact OD1-N 3.13Å; D609-H621 PolarHBondContact OD2-N 2.78Å; H621-K623 PolarHBondContact O-N 3.06Å
622	K	93.7	Very high	89.8	Confident	38 Å²	38	56.7 Å²	56.7	17%	0.165	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	13.7	-179.7	-45.8	-60.1	162.7	-164.4	0	115.9	C543 C560 D606 V607 I620	C543-K622 HydrophobicContact CB-CB 4.1Å; C560-K622 WeakPolarHBondContact O-CD 3.42Å; D606-K622 VanDerWaalsContact OD1-CE 3.28Å; D606-K622 WeakPolarHBondContact OD1-CE 3.39Å; D606-K622 IonicContact OD1-NZ 2.73Å; D606-K622 PolarHBondContact OD1-NZ 3.13Å; D606-K622 IonicContact OD2-NZ 3.8Å; D606-K622 PolarHBondContact OD2-NZ 3Å; V607-K622 PolarHBondContact O-NZ 2.89Å; I620-K622 VanDerWaalsContact C-N 3.26Å; I620-K622 PolarHBondContact O-N 3.37Å
623	K	95.6	Very high	89.1	Confident	129 Å²	129	59.6 Å²	59.6	56%	0.561	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.7	175.1	-66	-173	177.5	-178.6	0	111.5	C619 I620 H621 V625	C619-K623 WeakPolarHBondContact CA-O 3.25Å; I620-K623 PolarHBondContact N-O 2.83Å; I620-K623 PolarHBondContact O-N 3.02Å; H621-K623 PolarHBondContact O-N 3.06Å; K623-V625 HydrophobicContact CB-CG1 4.13Å; K623-V625 PolarHBondContact O-N 2.74Å
624	C	96	Very high	88.6	Confident	19 Å²	19	59 Å²	59	13%	0.128	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	100.1	175.8	-175.2	0	0	0	0	110.2	S556 D557 C613	S556-C624 WeakPolarHBondContact O-CB 3.34Å; D557-C624 PolarHBondContact OD1-N 2.84Å; C613-C624 HydrophobicContact CB-CB 3.81Å; C613-C624 WeakPolarHBondContact CB-SG 3.46Å; C613-C624 WeakPolarHBondContact SG-CA 3.43Å; C613-C624 WeakPolarHBondContact SG-CB 3.18Å; C613-C624 CovalentContact SG-SG 2.03Å; C613-C624 PolarHBondContact SG-SG 2.98Å
625	V	95.4	Very high	88.4	Confident	39 Å²	39	62 Å²	62	24%	0.236	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	158.1	-173.9	-59.9	0	0	0	0	111.8	K617 I618 I620 K623 V629	K617-V625 CarbonylContact C-O 3.45Å; K617-V625 WeakPolarHBondContact CA-O 3.18Å; K617-V625 VanDerWaalsContact CB-O 3.26Å; K617-V625 WeakPolarHBondContact CB-O 3.43Å; I618-V625 HydrophobicContact CG1-CG2 4.43Å; I618-V625 PolarHBondContact N-O 2.68Å; I618-V625 WeakPolarHBondContact O-CG2 3.43Å; I618-V625 PolarHBondContact O-N 3.47Å; I620-V625 HydrophobicContact CB-CG2 3.95Å; I620-V625 HydrophobicContact CD1-CG2 3.8Å; I620-V625 HydrophobicContact CG1-CG2 3.82Å; K623-V625 HydrophobicContact CB-CG1 4.13Å; K623-V625 PolarHBondContact O-N 2.74Å; V625-V629 HydrophobicContact CB-CG2 4.48Å
626	S	94.1	Very high	88.2	Confident	51 Å²	51	57.8 Å²	57.8	36%	0.357	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	139.3	174.6	-176.6	0	0	0	0	110.7	S628 V629	S626-S628 WeakPolarHBondContact CB-OG 3.44Å; S626-S628 PolarHBondContact O-N 3.09Å; S626-S628 VanDerWaalsContact O-N 3.13Å; S626-S628 PolarHBondContact OG-N 2.86Å; S626-S628 PolarHBondContact OG-OG 2.91Å; S626-V629 WeakPolarHBondContact O-CB 3.02Å; S626-V629 WeakPolarHBondContact O-CG2 3.32Å; S626-V629 PolarHBondContact O-N 2.79Å
627	L	88.8	Confident	88.2	Confident	26 Å²	26	61.9 Å²	61.9	14%	0.136	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-56.8	-28.1	173.9	-167.2	72.4	0	0	0	111.8	Y501 G616 I618 V629 L630	Y501-L627 HydrophobicContact CD1-CD2 4.17Å; Y501-L627 HydrophobicContact CD2-CD1 4.25Å; Y501-L627 HydrophobicContact CE1-CD2 3.95Å; Y501-L627 HydrophobicContact CE2-CD2 4.35Å; Y501-L627 HydrophobicContact CG-CD1 4.26Å; Y501-L627 HydrophobicContact CG-CD2 4.46Å; G616-L627 WeakPolarHBondContact O-CB 3.3Å; G616-L627 PolarHBondContact O-N 3.48Å; I618-L627 HydrophobicContact CD1-CD1 3.94Å; I618-L627 HydrophobicContact CG1-CD1 4.15Å; I618-L627 HydrophobicContact CG2-CD1 3.86Å; L627-V629 PolarHBondContact O-N 3.24Å; L627-L630 HydrophobicContact CD1-CD1 3.67Å; L627-L630 HydrophobicContact CG-CD1 4.37Å; L627-L630 WeakPolarHBondContact O-CB 3.16Å; L627-L630 PolarHBondContact O-N 2.91Å
628	S	86.5	Confident	88	Confident	89 Å²	89	60.1 Å²	60.1	62%	0.622	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-61.8	-8.9	176.3	67	0	0	0	0	115.2	S626 L630	S626-S628 WeakPolarHBondContact CB-OG 3.44Å; S626-S628 PolarHBondContact O-N 3.09Å; S626-S628 VanDerWaalsContact O-N 3.13Å; S626-S628 PolarHBondContact OG-N 2.86Å; S626-S628 PolarHBondContact OG-OG 2.91Å; S628-L630 VanDerWaalsContact C-N 3.26Å
629	V	85.7	Confident	88	Confident	102 Å²	102	60 Å²	60	62%	0.618	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-72.9	-23.6	172.5	175.5	0	0	0	0	111.1	V625 S626 L627	V625-V629 HydrophobicContact CB-CG2 4.48Å; S626-V629 WeakPolarHBondContact O-CB 3.02Å; S626-V629 WeakPolarHBondContact O-CG2 3.32Å; S626-V629 PolarHBondContact O-N 2.79Å; L627-V629 PolarHBondContact O-N 3.24Å
630	L	83.9	Confident	87.8	Confident	20 Å²	20	63 Å²	63	11%	0.105	35%	0.347	C	S	.	.	S	Bend	trans	-71.7	142.9	176.9	-59.2	179.2	0	0	0	110.9	D492 Y503 I618 I620 L627 S628 H632	D492-L630 HydrophobicContact CB-CD1 3.97Å; D492-L630 HydrophobicContact CB-CD2 4.25Å; Y503-L630 HydrophobicContact CD2-CD2 4.31Å; Y503-L630 HydrophobicContact CE2-CD2 3.95Å; I618-L630 HydrophobicContact CD1-CD1 3.76Å; I618-L630 HydrophobicContact CD1-CD2 4.28Å; I618-L630 HydrophobicContact CD1-CG 4.17Å; I620-L630 HydrophobicContact CD1-CD2 4.07Å; L627-L630 HydrophobicContact CD1-CD1 3.67Å; L627-L630 HydrophobicContact CG-CD1 4.37Å; L627-L630 WeakPolarHBondContact O-CB 3.16Å; L627-L630 PolarHBondContact O-N 2.91Å; S628-L630 VanDerWaalsContact C-N 3.26Å; L630-H632 PolarHBondContact O-CD2 3.17Å; L630-H632 VanDerWaalsContact O-CD2 3.24Å; L630-H632 PolarHBondContact O-N 3.25Å
631	S	72.2	Confident	87.8	Confident	72 Å²	72	68.2 Å²	68.2	50%	0.503	37%	0.372	S	S	.	.			trans	-77.7	115.8	-178.7	-166.9	0	0	0	0	110.7	V633 H649	S631-V633 WeakPolarHBondContact OG-CG2 3.45Å; S631-H649 PolarHBondContact O-CE1 2.87Å
632	H	68.7	Low	87.9	Confident	89 Å²	89	64.7 Å²	64.7	41%	0.412	36%	0.355	S	S	.	.			trans	-103	55.5	177.4	-63	-74.3	0	0	0	111.3	L630 L635	L630-H632 PolarHBondContact O-CD2 3.17Å; L630-H632 VanDerWaalsContact O-CD2 3.24Å; L630-H632 PolarHBondContact O-N 3.25Å; H632-L635 HydrophobicContact CB-CD2 4.35Å
633	V	77.1	Confident	87.8	Confident	99 Å²	99	63.6 Å²	63.6	60%	0.6	36%	0.355	S	S	*	.			trans	-69.5	-41.9	179.9	-173.7	0	0	0	0	111.3	S631 H649	S631-V633 WeakPolarHBondContact OG-CG2 3.45Å; V633-H649 HydrophobicContact CB-CB 4.05Å; V633-H649 HydrophobicContact CG1-CB 4.41Å
634	C	83.6	Confident	87.7	Confident	3 Å²	3	61 Å²	61	2%	0.02	35%	0.346	C	S	.	.	S	Bend	trans	-99.3	126	175.9	-179.6	0	0	0	0	109.4	Q491 C645 H649	Q491-C634 PolarHBondContact NE2-O 3.09Å; Q491-C634 PolarHBondContact OE1-O 2.95Å; C634-C645 HydrophobicContact CB-CB 3.57Å; C634-C645 WeakPolarHBondContact CB-SG 3.41Å; C634-C645 PolarHBondContact O-SG 3.27Å; C634-C645 VanDerWaalsContact O-SG 3.39Å; C634-C645 WeakPolarHBondContact SG-CB 3.03Å; C634-C645 CovalentContact SG-SG 2.03Å; C634-C645 PolarHBondContact SG-SG 3.12Å; C634-H649 HydrophobicContact CB-CB 3.87Å; C634-H649 WeakPolarHBondContact CB-O 3.38Å
635	L	87.1	Confident	87.5	Confident	83 Å²	83	60.1 Å²	60.1	44%	0.435	34%	0.34	S	S	.	.			trans	-110.1	158.8	176.8	-63.3	174	0	0	0	109.7	H632 E637 T638	H632-L635 HydrophobicContact CB-CD2 4.35Å; L635-E637 VanDerWaalsContact CB-OE2 3.27Å; L635-E637 WeakPolarHBondContact CB-OE2 3.08Å; L635-E637 PolarHBondContact O-N 3.39Å; L635-E637 VanDerWaalsContact O-N 3.08Å; L635-T638 PolarHBondContact N-OG1 2.02Å; L635-T638 WeakPolarHBondContact O-CB 3.09Å; L635-T638 PolarHBondContact O-N 2.96Å; L635-T638 PolarHBondContact O-OG1 3.37Å
636	P	86.1	Confident	87.4	Confident	45 Å²	45	58.2 Å²	58.2	29%	0.292	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-32.7	176.9	-29.1	37.7	0	0	0	114.1	F494 T638 C639 N640 M641	F494-P636 HydrophobicContact CE1-CG 4.46Å; F494-P636 HydrophobicContact CZ-CG 4.35Å; P636-T638 VanDerWaalsContact C-N 3.34Å; P636-C639 CarbonylContact O-C 3.48Å; P636-C639 PolarHBondContact O-N 2.04Å; P636-N640 PolarHBondContact O-N 2.82Å; P636-M641 VanDerWaalsContact C-SD 3.59Å; P636-M641 HydrophobicContact CB-CE 4.07Å; P636-M641 HydrophobicContact CB-SD 3.43Å; P636-M641 WeakPolarHBondContact CB-SD 3.38Å; P636-M641 PolarHBondContact O-N 3.4Å
637	E	89.2	Confident	87.2	Confident	122 Å²	122	57.8 Å²	57.8	57%	0.57	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-33.3	176.6	-61.2	75.6	-165.2	0	0	112.5	L635 C639 N640	L635-E637 VanDerWaalsContact CB-OE2 3.27Å; L635-E637 WeakPolarHBondContact CB-OE2 3.08Å; L635-E637 PolarHBondContact O-N 3.39Å; L635-E637 VanDerWaalsContact O-N 3.08Å; E637-C639 PolarHBondContact O-N 3Å; E637-N640 WeakPolarHBondContact O-CA 3.45Å; E637-N640 PolarHBondContact O-N 2.03Å
638	T	90.3	Very high	87.2	Confident	57 Å²	57	60 Å²	60	35%	0.35	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.4	174.4	-52.3	0	0	0	0	111.1	L635 P636 N640 Y661	L635-T638 PolarHBondContact N-OG1 2.02Å; L635-T638 WeakPolarHBondContact O-CB 3.09Å; L635-T638 PolarHBondContact O-N 2.96Å; L635-T638 PolarHBondContact O-OG1 3.37Å; P636-T638 VanDerWaalsContact C-N 3.34Å; T638-N640 VanDerWaalsContact C-N 3.33Å; T638-Y661 HydrophobicContact CG2-CD1 4.49Å
639	C	92.8	Very high	87.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	17.2	177.7	-51	0	0	0	0	113.1	P636 E637 M641 K642 C651 Y661 C662	P636-C639 CarbonylContact O-C 3.48Å; P636-C639 PolarHBondContact O-N 2.04Å; E637-C639 PolarHBondContact O-N 3Å; C639-M641 PolarHBondContact O-N 3.32Å; C639-M641 VanDerWaalsContact O-N 3.09Å; C639-K642 PolarHBondContact O-N 2.83Å; C639-C651 WeakPolarHBondContact CA-SG 3.16Å; C639-C651 HydrophobicContact CB-CB 3.7Å; C639-C651 WeakPolarHBondContact CB-SG 3.02Å; C639-C651 PolarHBondContact N-SG 2.03Å; C639-C651 WeakPolarHBondContact SG-CA 3.24Å; C639-C651 WeakPolarHBondContact SG-CB 3.04Å; C639-C651 CovalentContact SG-SG 2.03Å; C639-C651 PolarHBondContact SG-SG 2.87Å; C639-Y661 CarbonylContact C-O 3.52Å; C639-C662 WeakPolarHBondContact O-CB 3.22Å
640	N	92.9	Very high	87.7	Confident	63 Å²	63	57.9 Å²	57.9	34%	0.337	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	30.3	179.8	-69.8	-89.4	0	0	0	113.8	P636 E637 T638 K642 Y661 L663	P636-N640 PolarHBondContact O-N 2.82Å; E637-N640 WeakPolarHBondContact O-CA 3.45Å; E637-N640 PolarHBondContact O-N 2.03Å; T638-N640 VanDerWaalsContact C-N 3.33Å; N640-K642 HydrophobicContact CB-CD 4.01Å; N640-K642 WeakPolarHBondContact O-CD 3.33Å; N640-K642 VanDerWaalsContact O-CG 3.3Å; N640-K642 WeakPolarHBondContact O-CG 3.34Å; N640-K642 PolarHBondContact O-N 2.87Å; N640-Y661 PolarHBondContact ND2-O 3.02Å; N640-L663 VanDerWaalsContact CG-CD2 3.49Å; N640-L663 WeakPolarHBondContact ND2-CD2 3.29Å; N640-L663 WeakPolarHBondContact ND2-CG 3.23Å; N640-L663 VanDerWaalsContact OD1-CD2 3.3Å; N640-L663 WeakPolarHBondContact OD1-CD2 3.43Å
641	M	91.8	Very high	88.2	Confident	134 Å²	134	57 Å²	57	66%	0.66	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	19.9	-174.3	-51	-61.2	-71.2	0	0	114	P636 C639	P636-M641 VanDerWaalsContact C-SD 3.59Å; P636-M641 HydrophobicContact CB-CE 4.07Å; P636-M641 HydrophobicContact CB-SD 3.43Å; P636-M641 WeakPolarHBondContact CB-SD 3.38Å; P636-M641 PolarHBondContact O-N 3.4Å; C639-M641 PolarHBondContact O-N 3.32Å; C639-M641 VanDerWaalsContact O-N 3.09Å
642	K	93.6	Very high	89.3	Confident	78 Å²	78	54.5 Å²	54.5	34%	0.339	28%	0.281	S	S	.	.	S	Bend	trans	-118.1	8.2	-175.4	-69.5	154.4	-169.9	-68.7	0	112.4	C639 N640 G654 W657 C662	C639-K642 PolarHBondContact O-N 2.83Å; N640-K642 HydrophobicContact CB-CD 4.01Å; N640-K642 WeakPolarHBondContact O-CD 3.33Å; N640-K642 VanDerWaalsContact O-CG 3.3Å; N640-K642 WeakPolarHBondContact O-CG 3.34Å; N640-K642 PolarHBondContact O-N 2.87Å; K642-G654 PolarHBondContact O-N 3.02Å; K642-W657 HydrophobicContact CB-CD2 4.18Å; K642-W657 HydrophobicContact CB-CG 3.89Å; K642-W657 HydrophobicContact CD-CD2 3.61Å; K642-W657 HydrophobicContact CD-CE3 3.78Å; K642-W657 HydrophobicContact CD-CG 4.22Å; K642-W657 HydrophobicContact CD-CH2 4.05Å; K642-W657 HydrophobicContact CD-CZ2 3.87Å; K642-W657 HydrophobicContact CD-CZ3 3.98Å; K642-W657 HydrophobicContact CG-CD2 4.07Å; K642-W657 HydrophobicContact CG-CG 4.27Å; K642-W657 HydrophobicContact CG-CZ2 4.33Å; K642-C662 HydrophobicContact CB-CB 3.83Å; K642-C662 VanDerWaalsContact CD-O 3.27Å; K642-C662 WeakPolarHBondContact CD-O 3.38Å
643	G	92.3	Very high	90.5	Very high	16 Å²	16	50.4 Å²	50.4	17%	0.165	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	177.9	-179.5	0	0	0	0	0	110.8	H652	G643-H652 CarbonylContact C-O 3.58Å; G643-H652 WeakPolarHBondContact CA-O 3.43Å
644	I	93.2	Very high	91.2	Very high	74 Å²	74	47.2 Å²	47.2	38%	0.379	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.1	-179	-60.3	173	0	0	0	108.1	V490 F494 H652	V490-I644 HydrophobicContact CB-CG2 4.47Å; V490-I644 HydrophobicContact CG1-CG2 3.71Å; V490-I644 HydrophobicContact CG2-CG2 4.18Å; F494-I644 HydrophobicContact CD1-CG2 4.36Å; F494-I644 HydrophobicContact CE1-CG2 4.2Å; F494-I644 HydrophobicContact CZ-CG2 4.36Å; I644-H652 PolarHBondContact N-O 2.84Å; I644-H652 WeakPolarHBondContact O-CB 2.99Å; I644-H652 PolarHBondContact O-N 3.44Å
645	C	93.1	Very high	91.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132.6	175.3	-61.2	0	0	0	0	110.4	Q491 F494 C634 H650	Q491-C645 HydrophobicContact CB-CB 4.06Å; Q491-C645 WeakPolarHBondContact CB-O 3.48Å; Q491-C645 PolarHBondContact N-O 2.82Å; F494-C645 HydrophobicContact CE2-CB 4.01Å; F494-C645 HydrophobicContact CZ-CB 4.31Å; C634-C645 HydrophobicContact CB-CB 3.57Å; C634-C645 WeakPolarHBondContact CB-SG 3.41Å; C634-C645 PolarHBondContact O-SG 3.27Å; C634-C645 VanDerWaalsContact O-SG 3.39Å; C634-C645 WeakPolarHBondContact SG-CB 3.03Å; C634-C645 CovalentContact SG-SG 2.03Å; C634-C645 PolarHBondContact SG-SG 3.12Å; C645-H650 WeakPolarHBondContact CA-O 3.45Å
646	N	92.1	Very high	91.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-87.8	176.2	172.5	70.5	12.9	0	0	0	111.8	L473 Y489 Q648 H649 H650 S670 D672	L473-N646 HydrophobicContact CD1-CB 3.66Å; Y489-N646 CarbonylContact O-C 3.57Å; Y489-N646 VanDerWaalsContact O-CA 3.24Å; Y489-N646 WeakPolarHBondContact O-CA 3.11Å; N646-Q648 PolarHBondContact O-N 3.39Å; N646-Q648 VanDerWaalsContact O-N 3.11Å; N646-Q648 WeakPolarHBondContact OD1-CA 3.39Å; N646-Q648 PolarHBondContact OD1-N 3.45Å; N646-H649 PolarHBondContact O-N 2.68Å; N646-H649 PolarHBondContact OD1-N 3.25Å; N646-H650 VanDerWaalsContact CG-O 3.3Å; N646-H650 PolarHBondContact N-O 3.25Å; N646-H650 PolarHBondContact OD1-N 2.92Å; N646-H650 PolarHBondContact OD1-O 2.86Å; N646-S670 PolarHBondContact ND2-OG 3.26Å; N646-D672 PolarHBondContact ND2-OD2 3.05Å
647	N	89.8	Confident	92	Very high	42 Å²	42	53.3 Å²	53.3	23%	0.225	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.6	178.6	68.2	-61.6	0	0	0	115.3	R488 Y489	R488-N647 VanDerWaalsContact CD-OD1 3.29Å; R488-N647 WeakPolarHBondContact CD-OD1 3.45Å; Y489-N647 HydrophobicContact CD1-CB 4.18Å; Y489-N647 HydrophobicContact CD2-CB 3.8Å; Y489-N647 HydrophobicContact CE1-CB 3.86Å; Y489-N647 WeakPolarHBondContact CE1-ND2 3.41Å; Y489-N647 HydrophobicContact CE2-CB 3.43Å; Y489-N647 VanDerWaalsContact CE2-CB 3.43Å; Y489-N647 HydrophobicContact CG-CB 4.14Å; Y489-N647 VanDerWaalsContact CZ-CB 3.46Å; Y489-N647 PolarHBondContact N-OD1 2.85Å; Y489-N647 PolarHBondContact O-N 2.92Å; Y489-N647 PolarHBondContact O-OD1 2.87Å
648	Q	89.9	Confident	92.1	Very high	73 Å²	73	49 Å²	49	34%	0.341	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	8.5	170.9	-65.8	-169.9	-46.3	0	0	112.8	R488 N646 H650 D672	R488-Q648 VanDerWaalsContact CZ-NE2 3.31Å; R488-Q648 VanDerWaalsContact CZ-OE1 3.28Å; R488-Q648 VanDerWaalsContact NH2-CD 3.32Å; R488-Q648 VanDerWaalsContact NH2-OE1 3.15Å; N646-Q648 PolarHBondContact O-N 3.39Å; N646-Q648 VanDerWaalsContact O-N 3.11Å; N646-Q648 WeakPolarHBondContact OD1-CA 3.39Å; N646-Q648 PolarHBondContact OD1-N 3.45Å; Q648-H650 PolarHBondContact O-N 3.11Å; Q648-D672 VanDerWaalsContact OE1-CB 3.3Å; Q648-D672 PolarHBondContact OE1-OD1 3.33Å; Q648-D672 VanDerWaalsContact OE1-OD1 3.12Å
649	H	90.2	Very high	92.2	Very high	62 Å²	62	47.3 Å²	47.3	29%	0.287	24%	0.239	S	C	.	.	S	Bend	trans	63.5	26.2	-178.2	-48.7	-61.8	0	0	0	114	Q491 S631 V633 C634 N646	Q491-H649 PolarHBondContact OE1-ND1 3.42Å; S631-H649 PolarHBondContact O-CE1 2.87Å; V633-H649 HydrophobicContact CB-CB 4.05Å; V633-H649 HydrophobicContact CG1-CB 4.41Å; C634-H649 HydrophobicContact CB-CB 3.87Å; C634-H649 WeakPolarHBondContact CB-O 3.38Å; N646-H649 PolarHBondContact O-N 2.68Å; N646-H649 PolarHBondContact OD1-N 3.25Å
650	H	92.9	Very high	92.2	Very high	84 Å²	84	50.5 Å²	50.5	39%	0.389	26%	0.259	S	S	.	.			trans	-105.3	160.1	169.9	-62.6	156.2	0	0	0	111	C645 N646 Q648 V671 D672	C645-H650 WeakPolarHBondContact CA-O 3.45Å; N646-H650 VanDerWaalsContact CG-O 3.3Å; N646-H650 PolarHBondContact N-O 3.25Å; N646-H650 PolarHBondContact OD1-N 2.92Å; N646-H650 PolarHBondContact OD1-O 2.86Å; Q648-H650 PolarHBondContact O-N 3.11Å; H650-V671 HydrophobicContact CB-CG2 4.16Å; H650-D672 VanDerWaalsContact CB-OD2 3.23Å; H650-D672 WeakPolarHBondContact CB-OD2 3.29Å; H650-D672 IonicContact CE1-OD1 3.51Å; H650-D672 IonicContact CG-OD2 3.46Å; H650-D672 VanDerWaalsContact ND1-CG 3.27Å; H650-D672 IonicContact ND1-OD1 2.85Å; H650-D672 PolarHBondContact ND1-OD1 3.32Å; H650-D672 IonicContact ND1-OD2 2.95Å; H650-D672 PolarHBondContact ND1-OD2 2.82Å
651	C	94.1	Very high	92.3	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	125.6	-179.2	-60.8	0	0	0	0	112.4	C639 P660 S670	C639-C651 WeakPolarHBondContact CA-SG 3.16Å; C639-C651 HydrophobicContact CB-CB 3.7Å; C639-C651 WeakPolarHBondContact CB-SG 3.02Å; C639-C651 PolarHBondContact N-SG 2.03Å; C639-C651 WeakPolarHBondContact SG-CA 3.24Å; C639-C651 WeakPolarHBondContact SG-CB 3.04Å; C639-C651 CovalentContact SG-SG 2.03Å; C639-C651 PolarHBondContact SG-SG 2.87Å; C651-P660 VanDerWaalsContact CB-O 3.26Å; C651-P660 WeakPolarHBondContact CB-O 3.29Å; C651-S670 PolarHBondContact O-OG 2.8Å
652	H	94.4	Very high	92.4	Very high	19 Å²	19	47.5 Å²	47.5	9%	0.088	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	105.9	161.3	-166.7	107.5	0	0	0	109	L473 W476 G643 I644 S673	L473-H652 HydrophobicContact CD1-CB 3.91Å; L473-H652 HydrophobicContact CD2-CB 4.33Å; W476-H652 AromaticContact CH2-CE1 3.61Å; W476-H652 AromaticContact CH2-NE2 3.59Å; W476-H652 AromaticContact CZ3-CE1 3.44Å; W476-H652 VanDerWaalsContact CZ3-CE1 3.44Å; W476-H652 WeakPolarHBondContact CZ3-CE1 3.26Å; W476-H652 AromaticContact CZ3-NE2 3.89Å; G643-H652 CarbonylContact C-O 3.58Å; G643-H652 WeakPolarHBondContact CA-O 3.43Å; I644-H652 PolarHBondContact N-O 2.84Å; I644-H652 WeakPolarHBondContact O-CB 2.99Å; I644-H652 PolarHBondContact O-N 3.44Å; H652-S673 PolarHBondContact ND1-OG 2.76Å
653	C	94.9	Very high	92.4	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.014	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	139.9	-173.9	-60.5	0	0	0	0	112.3	W657 S658 P659 C662 G668 G669	C653-W657 HydrophobicContact CB-CB 4.17Å; C653-S658 PolarHBondContact SG-O 2.73Å; C653-P659 VanDerWaalsContact SG-CA 3.57Å; C653-P659 VanDerWaalsContact SG-N 3.44Å; C653-C662 WeakPolarHBondContact CA-SG 3.29Å; C653-C662 HydrophobicContact CB-CB 3.9Å; C653-C662 WeakPolarHBondContact CB-SG 3.38Å; C653-C662 WeakPolarHBondContact SG-CA 3.16Å; C653-C662 WeakPolarHBondContact SG-CB 3.27Å; C653-C662 PolarHBondContact SG-N 2.99Å; C653-C662 VanDerWaalsContact SG-N 3.35Å; C653-C662 CovalentContact SG-SG 2.04Å; C653-C662 PolarHBondContact SG-SG 2.8Å; C653-G668 CarbonylContact O-C 3.04Å; C653-G668 WeakPolarHBondContact O-CA 2.95Å; C653-G669 PolarHBondContact N-O 2.93Å; C653-G669 PolarHBondContact O-N 3.27Å
654	G	91.3	Very high	92.4	Very high	32 Å²	32	54 Å²	54	33%	0.33	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-68.9	162.7	171.4	0	0	0	0	0	112.2	K642 G656 W657	K642-G654 PolarHBondContact O-N 3.02Å; G654-G656 PolarHBondContact O-N 3.3Å; G654-W657 PolarHBondContact O-N 3.49Å; G654-W657 VanDerWaalsContact O-N 3.14Å
655	Y	89.8	Confident	92.3	Very high	194 Å²	194	59.8 Å²	59.8	76%	0.761	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	132.9	175.5	-179.5	-98.6	0	0	0	111.3	Y667	Y655-Y667 HydrophobicContact CE2-CD1 4.18Å
656	G	89.6	Confident	92.2	Very high	11 Å²	11	60.7 Å²	60.7	11%	0.113	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.9	-6	-175.6	0	0	0	0	0	114.4	G654 R665 G666	G654-G656 PolarHBondContact O-N 3.3Å; G656-R665 WeakPolarHBondContact O-CA 3.34Å; G656-R665 WeakPolarHBondContact O-CD 3.48Å; G656-G666 CarbonylContact C-O 3.02Å; G656-G666 WeakPolarHBondContact CA-O 3.46Å; G656-G666 PolarHBondContact N-O 3.24Å; G656-G666 VanDerWaalsContact N-O 3.09Å; G656-G666 PolarHBondContact O-N 3.38Å
657	W	93.9	Very high	92	Very high	54 Å²	54	66.6 Å²	66.6	21%	0.205	32%	0.315	C	S	.	.			trans	-130.5	152.8	178.9	-56.9	97.5	0	0	0	111.9	K642 C653 G654 C662 L663 H664 G666 G668	K642-W657 HydrophobicContact CB-CD2 4.18Å; K642-W657 HydrophobicContact CB-CG 3.89Å; K642-W657 HydrophobicContact CD-CD2 3.61Å; K642-W657 HydrophobicContact CD-CE3 3.78Å; K642-W657 HydrophobicContact CD-CG 4.22Å; K642-W657 HydrophobicContact CD-CH2 4.05Å; K642-W657 HydrophobicContact CD-CZ2 3.87Å; K642-W657 HydrophobicContact CD-CZ3 3.98Å; K642-W657 HydrophobicContact CG-CD2 4.07Å; K642-W657 HydrophobicContact CG-CG 4.27Å; K642-W657 HydrophobicContact CG-CZ2 4.33Å; C653-W657 HydrophobicContact CB-CB 4.17Å; G654-W657 PolarHBondContact O-N 3.49Å; G654-W657 VanDerWaalsContact O-N 3.14Å; W657-C662 HydrophobicContact CB-CB 4.03Å; W657-C662 VanDerWaalsContact CE3-O 3.25Å; W657-L663 WeakPolarHBondContact CZ3-O 3.4Å; W657-H664 CarbonylContact C-O 3.48Å; W657-H664 VanDerWaalsContact CA-O 3.24Å; W657-H664 WeakPolarHBondContact CA-O 3.12Å; W657-G666 PolarHBondContact N-O 2.75Å; W657-G666 CarbonylContact O-C 3.48Å; W657-G668 VanDerWaalsContact O-CA 3.29Å; W657-G668 WeakPolarHBondContact O-CA 3.01Å; W657-G668 PolarHBondContact O-N 2.91Å
658	S	92	Very high	92.1	Very high	31 Å²	31	64.8 Å²	64.8	22%	0.217	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-109.4	142.8	179	65.1	0	0	0	0	112.4	C653 C662 H664	C653-S658 PolarHBondContact SG-O 2.73Å; S658-C662 VanDerWaalsContact O-CA 3.25Å; S658-C662 WeakPolarHBondContact O-CA 3.38Å; S658-C662 PolarHBondContact O-N 3.04Å; S658-C662 VanDerWaalsContact O-N 3.15Å; S658-H664 PolarHBondContact N-O 3.09Å; S658-H664 PolarHBondContact OG-O 3.14Å
659	P	92.4	Very high	92.1	Very high	23 Å²	23	61.3 Å²	61.3	15%	0.149	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	162	166.9	27.6	-34	0	0	0	111.1	C653 V671 P675	C653-P659 VanDerWaalsContact SG-CA 3.57Å; C653-P659 VanDerWaalsContact SG-N 3.44Å; P659-V671 HydrophobicContact CB-CG1 4Å; P659-P675 HydrophobicContact CG-CB 4.3Å
660	P	92.8	Very high	92.2	Very high	66 Å²	66	58.4 Å²	58.4	43%	0.429	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.9	-15.6	9.5	31.4	-33.7	0	0	0	116.3	C651 V671	C651-P660 VanDerWaalsContact CB-O 3.26Å; C651-P660 WeakPolarHBondContact CB-O 3.29Å; P660-V671 HydrophobicContact CB-CG1 3.84Å
661	Y	93.4	Very high	92.2	Very high	135 Å²	135	58.1 Å²	58.1	53%	0.529	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	4.9	-174.1	-56.4	-67.4	0	0	0	114.3	T638 C639 N640 L663	T638-Y661 HydrophobicContact CG2-CD1 4.49Å; C639-Y661 CarbonylContact C-O 3.52Å; N640-Y661 PolarHBondContact ND2-O 3.02Å; Y661-L663 VanDerWaalsContact C-N 3.25Å; Y661-L663 PolarHBondContact O-N 3.34Å
662	C	94.3	Very high	91.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	60.6	29.8	-178.4	-40.2	0	0	0	0	114.5	C639 K642 C653 W657 S658	C639-C662 WeakPolarHBondContact O-CB 3.22Å; K642-C662 HydrophobicContact CB-CB 3.83Å; K642-C662 VanDerWaalsContact CD-O 3.27Å; K642-C662 WeakPolarHBondContact CD-O 3.38Å; C653-C662 WeakPolarHBondContact CA-SG 3.29Å; C653-C662 HydrophobicContact CB-CB 3.9Å; C653-C662 WeakPolarHBondContact CB-SG 3.38Å; C653-C662 WeakPolarHBondContact SG-CA 3.16Å; C653-C662 WeakPolarHBondContact SG-CB 3.27Å; C653-C662 PolarHBondContact SG-N 2.99Å; C653-C662 VanDerWaalsContact SG-N 3.35Å; C653-C662 CovalentContact SG-SG 2.04Å; C653-C662 PolarHBondContact SG-SG 2.8Å; W657-C662 HydrophobicContact CB-CB 4.03Å; W657-C662 VanDerWaalsContact CE3-O 3.25Å; S658-C662 VanDerWaalsContact O-CA 3.25Å; S658-C662 WeakPolarHBondContact O-CA 3.38Å; S658-C662 PolarHBondContact O-N 3.04Å; S658-C662 VanDerWaalsContact O-N 3.15Å
663	L	94.3	Very high	91.3	Very high	92 Å²	92	58.6 Å²	58.6	48%	0.482	28%	0.284	S	S	.	.			trans	-83.6	-38.5	179.7	-76.5	164.2	0	0	0	113.3	N640 W657 Y661	N640-L663 VanDerWaalsContact CG-CD2 3.49Å; N640-L663 WeakPolarHBondContact ND2-CD2 3.29Å; N640-L663 WeakPolarHBondContact ND2-CG 3.23Å; N640-L663 VanDerWaalsContact OD1-CD2 3.3Å; N640-L663 WeakPolarHBondContact OD1-CD2 3.43Å; W657-L663 WeakPolarHBondContact CZ3-O 3.4Å; Y661-L663 VanDerWaalsContact C-N 3.25Å; Y661-L663 PolarHBondContact O-N 3.34Å
664	H	92.8	Very high	90.8	Very high	137 Å²	137	58.9 Å²	58.9	63%	0.634	29%	0.287	S	S	*	.	B	Isolated β-bridge	trans	-102.7	159.8	-174.2	-57.8	-64.9	0	0	0	111.4	W657 S658	W657-H664 CarbonylContact C-O 3.48Å; W657-H664 VanDerWaalsContact CA-O 3.24Å; W657-H664 WeakPolarHBondContact CA-O 3.12Å; S658-H664 PolarHBondContact N-O 3.09Å; S658-H664 PolarHBondContact OG-O 3.14Å
665	R	91.3	Very high	90.5	Very high	197 Å²	197	60.3 Å²	60.3	74%	0.743	29%	0.291	S	S	*	.			trans	-66.7	134.1	175.9	-72.7	-65.3	-166.1	169.6	1.4	110.4	G656	G656-R665 WeakPolarHBondContact O-CA 3.34Å; G656-R665 WeakPolarHBondContact O-CD 3.48Å
666	G	89.4	Confident	90.2	Very high	18 Å²	18	51.9 Å²	51.9	19%	0.186	26%	0.261	C	S	.	.			trans	-162.8	-168.5	-179.5	0	0	0	0	0	112.5	G656 W657	G656-G666 CarbonylContact C-O 3.02Å; G656-G666 WeakPolarHBondContact CA-O 3.46Å; G656-G666 PolarHBondContact N-O 3.24Å; G656-G666 VanDerWaalsContact N-O 3.09Å; G656-G666 PolarHBondContact O-N 3.38Å; W657-G666 PolarHBondContact N-O 2.75Å; W657-G666 CarbonylContact O-C 3.48Å
667	Y	88.6	Confident	89.8	Confident	124 Å²	124	53.6 Å²	53.6	49%	0.486	27%	0.272	S	S	.	.			trans	-104	1.2	-176.2	-62.2	-73.6	0	0	0	113.6	Y655 A676 A678	Y655-Y667 HydrophobicContact CE2-CD1 4.18Å; Y667-A676 WeakPolarHBondContact CB-O 3.17Å; Y667-A676 WeakPolarHBondContact O-CB 3.46Å; Y667-A678 HydrophobicContact CD1-CB 4.12Å; Y667-A678 HydrophobicContact CE1-CB 3.63Å; Y667-A678 HydrophobicContact CE2-CB 4.12Å
668	G	91.1	Very high	88.6	Confident	4 Å²	4	53.4 Å²	53.4	4%	0.041	28%	0.282	C	S	.	.			trans	99.6	-172.6	-178.7	0	0	0	0	0	113.8	C653 W657 A676	C653-G668 CarbonylContact O-C 3.04Å; C653-G668 WeakPolarHBondContact O-CA 2.95Å; W657-G668 VanDerWaalsContact O-CA 3.29Å; W657-G668 WeakPolarHBondContact O-CA 3.01Å; W657-G668 PolarHBondContact O-N 2.91Å; G668-A676 PolarHBondContact O-N 3.07Å
669	G	91.3	Very high	87	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	92.1	-173.2	179.4	0	0	0	0	0	114	W476 C653	W476-G669 VanDerWaalsContact CZ3-CA 3.44Å; C653-G669 PolarHBondContact N-O 2.93Å; C653-G669 PolarHBondContact O-N 3.27Å
670	S	92.4	Very high	84.8	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	164.4	-178.2	-177.2	0	0	0	0	111	N646 C651 D672 S673 G674	N646-S670 PolarHBondContact ND2-OG 3.26Å; C651-S670 PolarHBondContact O-OG 2.8Å; S670-D672 PolarHBondContact O-N 2.85Å; S670-D672 PolarHBondContact OG-N 3.4Å; S670-D672 PolarHBondContact OG-OD2 3.42Å; S670-S673 WeakPolarHBondContact CB-OG 3.47Å; S670-G674 PolarHBondContact N-O 3.12Å; S670-G674 CarbonylContact O-C 3.55Å; S670-G674 WeakPolarHBondContact O-CA 3.27Å; S670-G674 PolarHBondContact O-N 2.92Å; S670-G674 VanDerWaalsContact O-N 3.15Å
671	V	91.1	Very high	82.2	Confident	78 Å²	78	76.5 Å²	76.5	47%	0.473	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.6	165.9	-65.9	0	0	0	0	112.2	H650 P659 P660	H650-V671 HydrophobicContact CB-CG2 4.16Å; P659-V671 HydrophobicContact CB-CG1 4Å; P660-V671 HydrophobicContact CB-CG1 3.84Å
672	D	86.9	Confident	79.5	Confident	32 Å²	32	73.3 Å²	73.3	17%	0.171	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-34.9	-175.1	-44.6	-61.1	0	0	0	113.4	R488 N646 Q648 H650 S670	R488-D672 HydrophobicContact CG-CB 4.13Å; N646-D672 PolarHBondContact ND2-OD2 3.05Å; Q648-D672 VanDerWaalsContact OE1-CB 3.3Å; Q648-D672 PolarHBondContact OE1-OD1 3.33Å; Q648-D672 VanDerWaalsContact OE1-OD1 3.12Å; H650-D672 VanDerWaalsContact CB-OD2 3.23Å; H650-D672 WeakPolarHBondContact CB-OD2 3.29Å; H650-D672 IonicContact CE1-OD1 3.51Å; H650-D672 IonicContact CG-OD2 3.46Å; H650-D672 VanDerWaalsContact ND1-CG 3.27Å; H650-D672 IonicContact ND1-OD1 2.85Å; H650-D672 PolarHBondContact ND1-OD1 3.32Å; H650-D672 IonicContact ND1-OD2 2.95Å; H650-D672 PolarHBondContact ND1-OD2 2.82Å; S670-D672 PolarHBondContact O-N 2.85Å; S670-D672 PolarHBondContact OG-N 3.4Å; S670-D672 PolarHBondContact OG-OD2 3.42Å
673	S	83.4	Confident	76.7	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	6	-179.5	62.8	0	0	0	0	113.3	P474 E475 W476 H652 S670	P474-S673 PolarHBondContact O-OG 2.9Å; E475-S673 WeakPolarHBondContact CA-O 3.39Å; W476-S673 PolarHBondContact N-O 3.02Å; H652-S673 PolarHBondContact ND1-OG 2.76Å; S670-S673 WeakPolarHBondContact CB-OG 3.47Å
674	G	84.6	Confident	74	Confident	7 Å²	7	84.7 Å²	84.7	7%	0.072	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86	142.2	-176.2	0	0	0	0	0	112.7	S670	S670-G674 PolarHBondContact N-O 3.12Å; S670-G674 CarbonylContact O-C 3.55Å; S670-G674 WeakPolarHBondContact O-CA 3.27Å; S670-G674 PolarHBondContact O-N 2.92Å; S670-G674 VanDerWaalsContact O-N 3.15Å
675	P	84.1	Confident	71.4	Confident	63 Å²	63	81.6 Å²	81.6	41%	0.409	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.5	169.9	29.4	-32.1	0	0	0	109.2	G461 P659	G461-P675 VanDerWaalsContact CA-O 3.26Å; G461-P675 WeakPolarHBondContact CA-O 3.21Å; P659-P675 HydrophobicContact CG-CB 4.3Å
676	A	84.9	Confident	69.3	Low	16 Å²	16	78.9 Å²	78.9	13%	0.132	42%	0.415	C	S	.	.			trans	-65.3	151	172.8	0	0	0	0	0	110.2	W476 Y667 G668	W476-A676 HydrophobicContact CD2-CB 4.13Å; W476-A676 HydrophobicContact CH2-CB 4.36Å; W476-A676 HydrophobicContact CZ2-CB 3.78Å; Y667-A676 WeakPolarHBondContact CB-O 3.17Å; Y667-A676 WeakPolarHBondContact O-CB 3.46Å; G668-A676 PolarHBondContact O-N 3.07Å
677	S	81.3	Confident	67.5	Low	48 Å²	48	83.7 Å²	83.7	34%	0.336	44%	0.435	S	S	.	.			trans	-106	161	173.7	70.5	0	0	0	0	112.2	G461 K679	G461-S677 VanDerWaalsContact C-OG 3.31Å; G461-S677 PolarHBondContact O-N 2.94Å; G461-S677 PolarHBondContact O-OG 2.98Å; S677-K679 PolarHBondContact O-N 2.92Å
678	A	68.8	Low	65.6	Low	50 Å²	50	82 Å²	82	41%	0.413	44%	0.437	S	S	.	.			trans	-60.5	109.4	167.3	0	0	0	0	0	109.1	Y667 K680	Y667-A678 HydrophobicContact CD1-CB 4.12Å; Y667-A678 HydrophobicContact CE1-CB 3.63Å; Y667-A678 HydrophobicContact CE2-CB 4.12Å; A678-K680 PolarHBondContact O-N 2.83Å
679	K	57.3	Low	64	Low	177 Å²	177	87 Å²	87	77%	0.77	46%	0.462	S	S	*	.			trans	-50.4	121.8	162.6	-84.2	-175.3	176.6	177.4	0	107.3	S677 R681	S677-K679 PolarHBondContact O-N 2.92Å; K679-R681 PolarHBondContact O-N 2.96Å
680	K	47.1	Very low	62.2	Low	210 Å²	210	90.4 Å²	90.4	91%	0.913	48%	0.484	S	S	*	.			trans	-62.4	82.9	151.7	-79.4	-176.1	-179.3	176.6	0	105.4	A678 G682	A678-K680 PolarHBondContact O-N 2.83Å; K680-G682 VanDerWaalsContact C-N 3.33Å; K680-G682 PolarHBondContact O-N 3.37Å
681	R	38.2	Very low	60.6	Low	217 Å²	217	93.4 Å²	93.4	82%	0.819	51%	0.505	S	S	*	.			trans	-53.2	112.5	159.4	-114.8	179.1	-179.7	170	0.8	103.2	K679 F683	K679-R681 PolarHBondContact O-N 2.96Å; R681-F683 PolarHBondContact O-N 3.48Å
682	G	36.5	Very low	59.4	Low	69 Å²	69	94.9 Å²	94.9	71%	0.711	51%	0.51	S	S	*	.			trans	-53.4	100	159.6	0	0	0	0	0	104.7	K680 L684	K680-G682 VanDerWaalsContact C-N 3.33Å; K680-G682 PolarHBondContact O-N 3.37Å; G682-L684 PolarHBondContact O-N 3.2Å
683	F	36.2	Very low	58.5	Low	185 Å²	185	96.5 Å²	96.5	81%	0.811	52%	0.524	S	S	*	.			trans	-55.5	100.9	152.6	-97.6	-93.2	0	0	0	102.5	R681 P685	R681-F683 PolarHBondContact O-N 3.48Å; F683-P685 VanDerWaalsContact C-N 3.26Å; F683-P685 WeakPolarHBondContact O-CD 3.38Å
684	L	36.2	Very low	58.1	Low	146 Å²	146	100.7 Å²	100.7	76%	0.764	55%	0.549	S	S	*	.			trans	-51.2	112.2	147.7	-116	90.3	0	0	0	102.4	G682 L686	G682-L684 PolarHBondContact O-N 3.2Å; L684-L686 PolarHBondContact O-N 2.88Å; L684-L686 VanDerWaalsContact O-N 3.09Å
685	P	39.1	Very low	57.7	Low	71 Å²	71	106 Å²	106	46%	0.461	58%	0.575	S	S	.	*			trans	-58.3	130.6	-179.5	24.9	-30.3	0	0	0	104.8	F683 I687	F683-P685 VanDerWaalsContact C-N 3.26Å; F683-P685 WeakPolarHBondContact O-CD 3.38Å; P685-I687 HydrophobicContact CB-CB 4.08Å; P685-I687 HydrophobicContact CB-CD1 3.78Å; P685-I687 HydrophobicContact CB-CG1 3.83Å; P685-I687 PolarHBondContact O-N 2.95Å
686	L	47.6	Very low	57.4	Low	140 Å²	140	107.7 Å²	107.7	73%	0.733	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	30.3	172.3	-138.1	96.2	0	0	0	111.3	L684 I689 P690	L684-L686 PolarHBondContact O-N 2.88Å; L684-L686 VanDerWaalsContact O-N 3.09Å; L686-I689 HydrophobicContact CG-CD1 4.49Å; L686-P690 VanDerWaalsContact O-CD 3.25Å; L686-P690 WeakPolarHBondContact O-CD 3.01Å
687	I	51.4	Low	57.2	Low	119 Å²	119	113.5 Å²	113.5	61%	0.61	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-15.7	-176.9	-60	176.5	0	0	0	110.4	P685 P690 S691	P685-I687 HydrophobicContact CB-CB 4.08Å; P685-I687 HydrophobicContact CB-CD1 3.78Å; P685-I687 HydrophobicContact CB-CG1 3.83Å; P685-I687 PolarHBondContact O-N 2.95Å; I687-P690 WeakPolarHBondContact O-CD 3.03Å; I687-S691 PolarHBondContact O-OG 3.42Å
688	V	48.9	Very low	57.1	Low	88 Å²	88	116.6 Å²	116.6	53%	0.533	62%	0.615	S	S	.	*	H	α-helix	trans	-79.2	-25.1	175.7	-170.6	0	0	0	0	112.5	S691 L692	V688-S691 WeakPolarHBondContact CA-OG 3.45Å; V688-S691 PolarHBondContact O-OG 3.02Å; V688-L692 WeakPolarHBondContact O-CB 3.23Å; V688-L692 PolarHBondContact O-N 3.23Å
689	I	55.8	Low	57.6	Low	111 Å²	111	121.3 Å²	121.3	57%	0.569	63%	0.626	S	S	*	*	H	α-helix	trans	-73.2	-45.7	178.1	-55	179.1	0	0	0	112.7	L686 S693	L686-I689 HydrophobicContact CG-CD1 4.49Å; I689-S693 WeakPolarHBondContact O-CB 3.46Å; I689-S693 PolarHBondContact O-N 2.78Å; I689-S693 VanDerWaalsContact O-N 3.13Å; I689-S693 PolarHBondContact O-OG 3.4Å
690	P	54.4	Low	58.5	Low	72 Å²	72	115.9 Å²	115.9	47%	0.468	61%	0.608	S	S	.	*	H	α-helix	trans	-70.6	-32.4	178.2	25.3	-32.3	0	0	0	112.6	L686 I687 S693 V694	L686-P690 VanDerWaalsContact O-CD 3.25Å; L686-P690 WeakPolarHBondContact O-CD 3.01Å; I687-P690 WeakPolarHBondContact O-CD 3.03Å; P690-S693 PolarHBondContact O-N 2.03Å; P690-V694 VanDerWaalsContact O-CG2 3.26Å; P690-V694 WeakPolarHBondContact O-CG2 3.2Å; P690-V694 PolarHBondContact O-N 3.37Å
691	S	58.3	Low	60.1	Low	62 Å²	62	108.4 Å²	108.4	43%	0.434	58%	0.579	S	S	.	*	H	α-helix	trans	-69.5	-40	178.5	48.5	0	0	0	0	112.6	I687 V688 L695	I687-S691 PolarHBondContact O-OG 3.42Å; V688-S691 WeakPolarHBondContact CA-OG 3.45Å; V688-S691 PolarHBondContact O-OG 3.02Å; S691-L695 PolarHBondContact O-N 3.18Å
692	L	66.1	Low	61.9	Low	109 Å²	109	99.9 Å²	99.9	57%	0.571	56%	0.559	S	S	*	*	H	α-helix	trans	-68.2	-36.7	174.3	-153.8	79	0	0	0	112	V688 L695 I696	V688-L692 WeakPolarHBondContact O-CB 3.23Å; V688-L692 PolarHBondContact O-N 3.23Å; L692-L695 PolarHBondContact O-N 3.27Å; L692-I696 HydrophobicContact CD2-CD1 4.48Å; L692-I696 HydrophobicContact CG-CD1 4.27Å; L692-I696 WeakPolarHBondContact O-CD1 3.39Å; L692-I696 VanDerWaalsContact O-CG1 3.23Å; L692-I696 WeakPolarHBondContact O-CG1 3.24Å; L692-I696 PolarHBondContact O-N 3.15Å
693	S	67.4	Low	63.9	Low	67 Å²	67	100.8 Å²	100.8	47%	0.469	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-42	176.8	-53.8	0	0	0	0	112.1	I689 P690 F697	I689-S693 WeakPolarHBondContact O-CB 3.46Å; I689-S693 PolarHBondContact O-N 2.78Å; I689-S693 VanDerWaalsContact O-N 3.13Å; I689-S693 PolarHBondContact O-OG 3.4Å; P690-S693 PolarHBondContact O-N 2.03Å; S693-F697 WeakPolarHBondContact O-CB 3Å; S693-F697 PolarHBondContact O-N 3.41Å
694	V	75.4	Confident	65.6	Low	87 Å²	87	97 Å²	97	53%	0.527	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-39.5	175.6	172	0	0	0	0	111	P690 F697 L698	P690-V694 VanDerWaalsContact O-CG2 3.26Å; P690-V694 WeakPolarHBondContact O-CG2 3.2Å; P690-V694 PolarHBondContact O-N 3.37Å; V694-F697 PolarHBondContact O-N 3.18Å; V694-L698 HydrophobicContact CG1-CD1 4.01Å; V694-L698 HydrophobicContact CG1-CG 4.4Å; V694-L698 WeakPolarHBondContact O-CB 3.32Å; V694-L698 WeakPolarHBondContact O-CG 3.23Å; V694-L698 PolarHBondContact O-N 3.29Å
695	L	75.7	Confident	67.4	Low	119 Å²	119	95.6 Å²	95.6	62%	0.623	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-41.9	177.2	-129.1	116	0	0	0	112	S691 L692 L698 F699	S691-L695 PolarHBondContact O-N 3.18Å; L692-L695 PolarHBondContact O-N 3.27Å; L695-L698 PolarHBondContact O-N 2.89Å; L695-F699 WeakPolarHBondContact O-CB 3.28Å; L695-F699 PolarHBondContact O-N 3.08Å
696	I	79	Confident	68.9	Low	99 Å²	99	99.6 Å²	99.6	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-65.4	-39.6	175.1	-66.7	164.3	0	0	0	110.6	L692 F699 T700	L692-I696 HydrophobicContact CD2-CD1 4.48Å; L692-I696 HydrophobicContact CG-CD1 4.27Å; L692-I696 WeakPolarHBondContact O-CD1 3.39Å; L692-I696 VanDerWaalsContact O-CG1 3.23Å; L692-I696 WeakPolarHBondContact O-CG1 3.24Å; L692-I696 PolarHBondContact O-N 3.15Å; I696-F699 PolarHBondContact O-N 3.31Å; I696-T700 HydrophobicContact CG2-CG2 4.41Å; I696-T700 WeakPolarHBondContact O-CB 3.43Å; I696-T700 WeakPolarHBondContact O-CG2 3.27Å; I696-T700 PolarHBondContact O-N 3.39Å; I696-T700 PolarHBondContact O-OG1 2.94Å
697	F	79.8	Confident	69.6	Low	137 Å²	137	97.1 Å²	97.1	60%	0.601	52%	0.52	S	S	*	.	H	α-helix	trans	-64.2	-45.1	175.5	-173.8	-100.8	0	0	0	112	S693 V694 F699 T700 V701	S693-F697 WeakPolarHBondContact O-CB 3Å; S693-F697 PolarHBondContact O-N 3.41Å; V694-F697 PolarHBondContact O-N 3.18Å; F697-F699 VanDerWaalsContact C-N 3.32Å; F697-F699 PolarHBondContact O-N 2.03Å; F697-T700 WeakPolarHBondContact CA-OG1 3.3Å; F697-T700 PolarHBondContact O-N 3.14Å; F697-T700 PolarHBondContact O-OG1 3.37Å; F697-V701 HydrophobicContact CD1-CG2 4.26Å; F697-V701 HydrophobicContact CE1-CG2 3.89Å; F697-V701 HydrophobicContact CE2-CG2 4.33Å; F697-V701 HydrophobicContact CZ-CG2 3.94Å; F697-V701 WeakPolarHBondContact O-CB 3.05Å; F697-V701 VanDerWaalsContact O-CG2 3.31Å; F697-V701 WeakPolarHBondContact O-CG2 3.44Å; F697-V701 PolarHBondContact O-N 3.21Å
698	L	79.5	Confident	70.1	Confident	114 Å²	114	98.6 Å²	98.6	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-38.3	175.7	-70.8	172	0	0	0	112	V694 L695 G702	V694-L698 HydrophobicContact CG1-CD1 4.01Å; V694-L698 HydrophobicContact CG1-CG 4.4Å; V694-L698 WeakPolarHBondContact O-CB 3.32Å; V694-L698 WeakPolarHBondContact O-CG 3.23Å; V694-L698 PolarHBondContact O-N 3.29Å; L695-L698 PolarHBondContact O-N 2.89Å; L698-G702 PolarHBondContact O-N 3.01Å
699	F	78.8	Confident	70.5	Confident	149 Å²	149	102.8 Å²	102.8	65%	0.654	54%	0.538	S	S	*	.	H	α-helix	trans	-67.9	-40.9	177.4	-155.6	-91.3	0	0	0	112	L695 I696 F697 G702 L703	L695-F699 WeakPolarHBondContact O-CB 3.28Å; L695-F699 PolarHBondContact O-N 3.08Å; I696-F699 PolarHBondContact O-N 3.31Å; F697-F699 VanDerWaalsContact C-N 3.32Å; F697-F699 PolarHBondContact O-N 2.03Å; F699-G702 PolarHBondContact O-N 2.73Å; F699-L703 HydrophobicContact CE1-CD1 4.18Å; F699-L703 WeakPolarHBondContact O-CB 3.07Å; F699-L703 PolarHBondContact O-N 2.95Å
700	T	77.6	Confident	70.5	Confident	63 Å²	63	101 Å²	101	39%	0.387	54%	0.535	S	S	.	.	H	α-helix	trans	-69.2	-39.1	177.2	48.8	0	0	0	0	112.5	I696 F697 L703 L704	I696-T700 HydrophobicContact CG2-CG2 4.41Å; I696-T700 WeakPolarHBondContact O-CB 3.43Å; I696-T700 WeakPolarHBondContact O-CG2 3.27Å; I696-T700 PolarHBondContact O-N 3.39Å; I696-T700 PolarHBondContact O-OG1 2.94Å; F697-T700 WeakPolarHBondContact CA-OG1 3.3Å; F697-T700 PolarHBondContact O-N 3.14Å; F697-T700 PolarHBondContact O-OG1 3.37Å; T700-L703 PolarHBondContact O-N 3.12Å; T700-L704 WeakPolarHBondContact O-CB 3.25Å; T700-L704 WeakPolarHBondContact O-CG 3.32Å; T700-L704 PolarHBondContact O-N 3.45Å
701	V	81.1	Confident	70.4	Confident	52 Å²	52	102.3 Å²	102.3	32%	0.315	55%	0.545	S	S	.	.	H	α-helix	trans	-64.9	-41.7	172.2	172.6	0	0	0	0	111	F697 L704 M705	F697-V701 HydrophobicContact CD1-CG2 4.26Å; F697-V701 HydrophobicContact CE1-CG2 3.89Å; F697-V701 HydrophobicContact CE2-CG2 4.33Å; F697-V701 HydrophobicContact CZ-CG2 3.94Å; F697-V701 WeakPolarHBondContact O-CB 3.05Å; F697-V701 VanDerWaalsContact O-CG2 3.31Å; F697-V701 WeakPolarHBondContact O-CG2 3.44Å; F697-V701 PolarHBondContact O-N 3.21Å; V701-L704 PolarHBondContact O-N 2.93Å; V701-M705 HydrophobicContact CG1-CE 4.02Å; V701-M705 PolarHBondContact O-N 3.24Å
702	G	76.2	Confident	69.9	Low	38 Å²	38	102.2 Å²	102.2	39%	0.392	55%	0.554	S	S	.	*	H	α-helix	trans	-61.3	-42.2	173.6	0	0	0	0	0	112.6	L698 F699 M705 Y706	L698-G702 PolarHBondContact O-N 3.01Å; F699-G702 PolarHBondContact O-N 2.73Å; G702-M705 PolarHBondContact O-N 3.23Å; G702-Y706 VanDerWaalsContact O-CB 3.32Å; G702-Y706 WeakPolarHBondContact O-CB 3.5Å; G702-Y706 PolarHBondContact O-N 2.04Å
703	L	76.8	Confident	69.1	Low	89 Å²	89	103 Å²	103	47%	0.466	57%	0.566	S	S	.	*	H	α-helix	trans	-66.6	-39	176.8	-151.8	99.5	0	0	0	111.8	F699 T700 Y706 L707	F699-L703 HydrophobicContact CE1-CD1 4.18Å; F699-L703 WeakPolarHBondContact O-CB 3.07Å; F699-L703 PolarHBondContact O-N 2.95Å; T700-L703 PolarHBondContact O-N 3.12Å; L703-Y706 PolarHBondContact O-N 2.85Å; L703-L707 HydrophobicContact CD2-CD1 4.02Å; L703-L707 HydrophobicContact CG-CD1 4.38Å; L703-L707 WeakPolarHBondContact O-CB 3.21Å; L703-L707 WeakPolarHBondContact O-CG 3.26Å; L703-L707 PolarHBondContact O-N 3.45Å
704	L	73.1	Confident	68	Low	106 Å²	106	109.7 Å²	109.7	56%	0.555	59%	0.587	S	S	*	*	H	α-helix	trans	-68	-41.6	176.5	-79.8	165.8	0	0	0	112.2	T700 V701 Y706 L707 Q708	T700-L704 WeakPolarHBondContact O-CB 3.25Å; T700-L704 WeakPolarHBondContact O-CG 3.32Å; T700-L704 PolarHBondContact O-N 3.45Å; V701-L704 PolarHBondContact O-N 2.93Å; L704-Y706 VanDerWaalsContact C-N 3.35Å; L704-L707 PolarHBondContact O-N 3.15Å; L704-Q708 WeakPolarHBondContact O-CB 3.18Å; L704-Q708 WeakPolarHBondContact O-CG 3.38Å; L704-Q708 PolarHBondContact O-N 3.35Å
705	M	73.7	Confident	66.3	Low	115 Å²	115	114.4 Å²	114.4	57%	0.567	60%	0.603	S	S	*	*	H	α-helix	trans	-64.9	-40.3	173.2	-73.4	-151.9	-91.3	0	0	111.4	V701 G702 Q708 Q709	V701-M705 HydrophobicContact CG1-CE 4.02Å; V701-M705 PolarHBondContact O-N 3.24Å; G702-M705 PolarHBondContact O-N 3.23Å; M705-Q708 PolarHBondContact O-N 2.9Å; M705-Q709 WeakPolarHBondContact O-CB 3.3Å; M705-Q709 PolarHBondContact O-N 3.09Å
706	Y	69.6	Low	64.8	Low	156 Å²	156	115.5 Å²	115.5	61%	0.612	61%	0.614	S	S	*	*	H	α-helix	trans	-62.1	-43.6	173.7	-175.2	-99.7	0	0	0	112.1	G702 L703 L704 Q709 C710	G702-Y706 VanDerWaalsContact O-CB 3.32Å; G702-Y706 WeakPolarHBondContact O-CB 3.5Å; G702-Y706 PolarHBondContact O-N 2.04Å; L703-Y706 PolarHBondContact O-N 2.85Å; L704-Y706 VanDerWaalsContact C-N 3.35Å; Y706-Q709 PolarHBondContact O-N 2.94Å; Y706-C710 WeakPolarHBondContact O-CB 3.37Å; Y706-C710 PolarHBondContact O-N 3.24Å; Y706-C710 PolarHBondContact O-SG 2.79Å
707	L	63.8	Low	62.9	Low	87 Å²	87	120.7 Å²	120.7	46%	0.455	63%	0.633	S	S	.	*	H	α-helix	trans	-68.8	-33.8	177.4	-73.1	168	0	0	0	112.9	L703 L704 Q709 C710 S711	L703-L707 HydrophobicContact CD2-CD1 4.02Å; L703-L707 HydrophobicContact CG-CD1 4.38Å; L703-L707 WeakPolarHBondContact O-CB 3.21Å; L703-L707 WeakPolarHBondContact O-CG 3.26Å; L703-L707 PolarHBondContact O-N 3.45Å; L704-L707 PolarHBondContact O-N 3.15Å; L707-Q709 VanDerWaalsContact C-N 3.33Å; L707-C710 PolarHBondContact O-N 3.49Å; L707-S711 WeakPolarHBondContact O-CB 3.41Å; L707-S711 PolarHBondContact O-N 3.46Å; L707-S711 VanDerWaalsContact O-N 3.1Å; L707-S711 PolarHBondContact O-OG 2.87Å
708	Q	60.8	Low	61.2	Low	151 Å²	151	119 Å²	119	71%	0.706	65%	0.645	S	S	*	*	H	α-helix	trans	-68.9	-32	172.1	-81.2	-178.2	-28.6	0	0	112.1	L704 M705	L704-Q708 WeakPolarHBondContact O-CB 3.18Å; L704-Q708 WeakPolarHBondContact O-CG 3.38Å; L704-Q708 PolarHBondContact O-N 3.35Å; M705-Q708 PolarHBondContact O-N 2.9Å
709	Q	58.1	Low	59.5	Low	175 Å²	175	122.7 Å²	122.7	82%	0.818	66%	0.659	S	S	*	*	H	α-helix	trans	-81.7	-22.8	177.5	-150.7	146.4	11.8	0	0	113	M705 Y706 L707	M705-Q709 WeakPolarHBondContact O-CB 3.3Å; M705-Q709 PolarHBondContact O-N 3.09Å; Y706-Q709 PolarHBondContact O-N 2.94Å; L707-Q709 VanDerWaalsContact C-N 3.33Å
710	C	54.5	Low	57.6	Low	75 Å²	75	120.5 Å²	120.5	51%	0.507	66%	0.662	S	S	.	*	S	Bend	trans	-90.9	-2.9	172	-70	0	0	0	0	114.2	Y706 L707 G712	Y706-C710 WeakPolarHBondContact O-CB 3.37Å; Y706-C710 PolarHBondContact O-N 3.24Å; Y706-C710 PolarHBondContact O-SG 2.79Å; L707-C710 PolarHBondContact O-N 3.49Å; C710-G712 PolarHBondContact O-N 3.28Å
711	S	53.2	Low	55.9	Low	99 Å²	99	123.3 Å²	123.3	69%	0.692	68%	0.684	S	S	*	*			trans	-97.9	67.8	175.8	-59.8	0	0	0	0	111.4	L707	L707-S711 WeakPolarHBondContact O-CB 3.41Å; L707-S711 PolarHBondContact O-N 3.46Å; L707-S711 VanDerWaalsContact O-N 3.1Å; L707-S711 PolarHBondContact O-OG 2.87Å
712	G	47.3	Very low	53.7	Low	60 Å²	60	128.4 Å²	128.4	62%	0.619	75%	0.747	S	S	*	*			trans	-130.4	166.5	152.9	0	0	0	0	0	109.1	C710	C710-G712 PolarHBondContact O-N 3.28Å
713	P	50.5	Low	52.5	Low	126 Å²	126	132.9 Å²	132.9	82%	0.818	77%	0.765	S	S	*	*			cis	-114.8	167.8	-49.4	36.3	-24.6	0	0	0	109.6
714	K	42.8	Very low	51.3	Low	207 Å²	207	135.2 Å²	135.2	90%	0.9	78%	0.78	S	S	*	*			trans	-139.5	114.1	160.2	-77.8	-166.3	178.4	176.9	0	113.1
715	E	40.9	Very low	50	Low	185 Å²	185	136.8 Å²	136.8	86%	0.864	79%	0.793	S	S	*	*			trans	-51.6	134	161.9	-68.4	177	134.8	0	0	111.3
716	T	43.3	Very low	48.6	Very low	142 Å²	142	138.1 Å²	138.1	87%	0.871	81%	0.806	S	S	*	*			trans	-84.4	112.2	168.6	27.9	0	0	0	0	109.8
717	K	39	Very low	47.3	Very low	208 Å²	208	137 Å²	137	90%	0.904	82%	0.818	S	S	*	*			trans	-108.5	111.7	155.7	-85.7	-175.5	178.3	176.2	0	108.5
718	A	44.7	Very low	46.2	Very low	102 Å²	102	140.3 Å²	140.3	84%	0.843	84%	0.842	S	S	*	*			trans	-109.6	135.1	166.2	0	0	0	0	0	109.1
719	H	43.6	Very low	45.2	Very low	192 Å²	192	139.6 Å²	139.6	89%	0.889	85%	0.852	S	S	*	*			trans	-70.3	151.7	-179.4	-106.3	-75.4	0	0	0	113
720	S	38.1	Very low	44.2	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	86%	0.855	S	S	*	*			trans	-64.4	145.6	165.5	63.7	0	0	0	0	113.2
721	S	42.1	Very low	43.3	Very low	121 Å²	121	142 Å²	142	85%	0.846	88%	0.884	S	S	*	*				166.9	126.1	119.3	54.6	0	0	0	0	110.8
722	G	34.7	Very low	42.5	Very low	159 Å²	159	145.9 Å²	145.9	100%	1.639	90%	0.901	S	S	*	*			trans	125	0	169.5	0	0	0	0	0	113.5

Retrieved 722 of 722 residues in 316.3 ms (Link to these results)

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