A0A3Q0KBT1_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KBT1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 557 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	51.9	Low	58.3	Low	211 Å²	211	147.1 Å²	147.1	100%	1.039	70%	0.698	S	S	*	*				0	-32.9	0	-106.6	173.7	176.8	0	0	114.3	Y3 T4	M1-Y3 PolarHBondContact O-N 3.44Å; M1-Y3 VanDerWaalsContact O-N 3.15Å; M1-T4 PolarHBondContact O-N 3.16Å; M1-T4 VanDerWaalsContact O-N 3.13Å; M1-T4 PolarHBondContact O-OG1 3.21Å
2	M	56	Low	58.6	Low	159 Å²	159	145 Å²	145	78%	0.783	69%	0.694	S	S	*	*	H	α-helix	trans	-58.4	-26.1	176.2	-96.8	172.3	65.3	0	0	115.4	T4 Q5	M2-T4 VanDerWaalsContact C-N 3.26Å; M2-T4 PolarHBondContact O-N 2.97Å; M2-Q5 PolarHBondContact O-N 3.09Å
3	Y	58.2	Low	58.7	Low	201 Å²	201	139.9 Å²	139.9	79%	0.788	68%	0.682	S	S	*	*	H	α-helix	trans	-64.7	-25.6	176.7	-119.9	-91.3	0	0	0	113.5	M1	M1-Y3 PolarHBondContact O-N 3.44Å; M1-Y3 VanDerWaalsContact O-N 3.15Å
4	T	59.3	Low	58.6	Low	96 Å²	96	135.8 Å²	135.8	59%	0.589	67%	0.673	S	S	*	*	H	α-helix	trans	-79.7	-20.6	179.9	57.1	0	0	0	0	113	M1 M2 R8	M1-T4 PolarHBondContact O-N 3.16Å; M1-T4 VanDerWaalsContact O-N 3.13Å; M1-T4 PolarHBondContact O-OG1 3.21Å; M2-T4 VanDerWaalsContact C-N 3.26Å; M2-T4 PolarHBondContact O-N 2.97Å; T4-R8 PolarHBondContact O-N 3.07Å
5	Q	57.9	Low	58.7	Low	136 Å²	136	130 Å²	130	64%	0.636	66%	0.655	S	S	*	*	H	α-helix	trans	-72.5	-36.5	175.5	-95.6	167	-39.6	0	0	112.7	M2 R8 Q9	M2-Q5 PolarHBondContact O-N 3.09Å; Q5-R8 PolarHBondContact O-N 2.69Å; Q5-Q9 PolarHBondContact O-N 3.17Å
6	L	59.1	Low	58.9	Low	121 Å²	121	133.4 Å²	133.4	63%	0.634	66%	0.658	S	S	*	*	H	α-helix	trans	-69.8	-37.9	179.1	-109	137.1	0	0	0	112.7	R8 Q9 M10	L6-R8 VanDerWaalsContact C-N 3.31Å; L6-R8 PolarHBondContact O-N 3.45Å; L6-Q9 PolarHBondContact O-N 3.48Å; L6-M10 PolarHBondContact O-N 3.34Å
7	I	63.1	Low	58.8	Low	100 Å²	100	134.1 Å²	134.1	51%	0.513	66%	0.656	S	S	.	*	H	α-helix	trans	-68	-34.2	176	-63.5	170.8	0	0	0	110.8	Q9 M10 L11	I7-Q9 VanDerWaalsContact C-N 3.35Å; I7-Q9 PolarHBondContact O-N 3.44Å; I7-M10 PolarHBondContact O-N 2.98Å; I7-L11 HydrophobicContact CG2-CD1 4.11Å; I7-L11 PolarHBondContact O-N 2.84Å; I7-L11 VanDerWaalsContact O-N 3.15Å
8	R	59.3	Low	59.1	Low	201 Å²	201	132.6 Å²	132.6	76%	0.758	65%	0.65	S	S	*	*	H	α-helix	trans	-68.3	-32.2	177.6	-140.2	176.4	-172.4	-178	1.5	112.7	T4 Q5 L6 N12	T4-R8 PolarHBondContact O-N 3.07Å; Q5-R8 PolarHBondContact O-N 2.69Å; L6-R8 VanDerWaalsContact C-N 3.31Å; L6-R8 PolarHBondContact O-N 3.45Å; R8-N12 PolarHBondContact O-N 2.92Å
9	Q	59.5	Low	59	Low	137 Å²	137	131.8 Å²	131.8	64%	0.64	65%	0.649	S	S	*	*	H	α-helix	trans	-70.7	-35.7	173.2	-98.4	172.1	-21.1	0	0	112.9	Q5 L6 I7 N12 C13	Q5-Q9 PolarHBondContact O-N 3.17Å; L6-Q9 PolarHBondContact O-N 3.48Å; I7-Q9 VanDerWaalsContact C-N 3.35Å; I7-Q9 PolarHBondContact O-N 3.44Å; Q9-N12 PolarHBondContact O-N 2.93Å; Q9-C13 PolarHBondContact O-N 2.84Å; Q9-C13 PolarHBondContact O-SG 2.88Å; Q9-C13 VanDerWaalsContact O-SG 3.42Å
10	M	57.3	Low	59.2	Low	140 Å²	140	128.9 Å²	128.9	69%	0.69	64%	0.635	S	S	*	*	H	α-helix	trans	-65.7	-40.4	174.7	-76.4	-95.4	-88.1	0	0	112.2	L6 I7 N12 C13 C14	L6-M10 PolarHBondContact O-N 3.34Å; I7-M10 PolarHBondContact O-N 2.98Å; M10-N12 VanDerWaalsContact C-N 3.35Å; M10-N12 PolarHBondContact O-N 3.29Å; M10-C13 WeakPolarHBondContact O-CB 3.24Å; M10-C13 PolarHBondContact O-N 3.25Å; M10-C13 VanDerWaalsContact O-N 3.14Å; M10-C14 PolarHBondContact O-N 3.48Å
11	L	59.5	Low	59	Low	116 Å²	116	126.2 Å²	126.2	61%	0.607	63%	0.628	S	S	*	*	H	α-helix	trans	-65.4	-33.6	176.2	-93.9	137.7	0	0	0	113.4	I7 C13 C14 A15	I7-L11 HydrophobicContact CG2-CD1 4.11Å; I7-L11 PolarHBondContact O-N 2.84Å; I7-L11 VanDerWaalsContact O-N 3.15Å; L11-C13 VanDerWaalsContact C-N 3.3Å; L11-C13 PolarHBondContact O-N 3.11Å; L11-C14 PolarHBondContact O-N 3.37Å; L11-A15 PolarHBondContact O-N 3.49Å
12	N	62.5	Low	58.9	Low	122 Å²	122	121.6 Å²	121.6	65%	0.652	61%	0.607	S	S	*	*	H	α-helix	trans	-67	-30.5	172.5	-95.2	-0.6	0	0	0	112.8	R8 Q9 M10 W16	R8-N12 PolarHBondContact O-N 2.92Å; Q9-N12 PolarHBondContact O-N 2.93Å; M10-N12 VanDerWaalsContact C-N 3.35Å; M10-N12 PolarHBondContact O-N 3.29Å; N12-W16 PolarHBondContact O-N 3.46Å
13	C	59.3	Low	58.9	Low	79 Å²	79	117.2 Å²	117.2	53%	0.534	59%	0.592	S	S	.	*	H	α-helix	trans	-69.1	-38.6	174.7	-65.7	0	0	0	0	111.6	Q9 M10 L11 W16 F17	Q9-C13 PolarHBondContact O-N 2.84Å; Q9-C13 PolarHBondContact O-SG 2.88Å; Q9-C13 VanDerWaalsContact O-SG 3.42Å; M10-C13 WeakPolarHBondContact O-CB 3.24Å; M10-C13 PolarHBondContact O-N 3.25Å; M10-C13 VanDerWaalsContact O-N 3.14Å; L11-C13 VanDerWaalsContact C-N 3.3Å; L11-C13 PolarHBondContact O-N 3.11Å; C13-W16 PolarHBondContact O-N 2.86Å; C13-F17 PolarHBondContact O-N 3.21Å
14	C	57.1	Low	58.5	Low	82 Å²	82	112.2 Å²	112.2	55%	0.554	58%	0.578	S	S	*	*	H	α-helix	trans	-66.1	-36.9	175.7	-74.8	0	0	0	0	112.9	M10 L11 W16 F17 I18	M10-C14 PolarHBondContact O-N 3.48Å; L11-C14 PolarHBondContact O-N 3.37Å; C14-W16 VanDerWaalsContact C-N 3.28Å; C14-W16 PolarHBondContact O-N 3.46Å; C14-F17 PolarHBondContact O-N 3.47Å; C14-I18 WeakPolarHBondContact O-CG1 3.24Å; C14-I18 PolarHBondContact O-N 2.82Å
15	A	61.3	Low	57.8	Low	49 Å²	49	112.8 Å²	112.8	41%	0.405	58%	0.577	S	S	.	*	H	α-helix	trans	-64.5	-33.5	176.2	0	0	0	0	0	112.5	L11 I18 L19	L11-A15 PolarHBondContact O-N 3.49Å; A15-I18 PolarHBondContact O-N 3.13Å; A15-L19 PolarHBondContact O-N 2.78Å
16	W	60.9	Low	57.4	Low	185 Å²	185	115.8 Å²	115.8	70%	0.701	58%	0.584	S	S	*	*	H	α-helix	trans	-70.9	-34.5	177.2	-141.3	55.5	0	0	0	112.4	N12 C13 C14 I18 L19 I20	N12-W16 PolarHBondContact O-N 3.46Å; C13-W16 PolarHBondContact O-N 2.86Å; C14-W16 VanDerWaalsContact C-N 3.28Å; C14-W16 PolarHBondContact O-N 3.46Å; W16-I18 PolarHBondContact O-N 2.86Å; W16-L19 PolarHBondContact O-N 2.93Å; W16-I20 HydrophobicContact CE3-CD1 4.28Å; W16-I20 WeakPolarHBondContact O-CG1 3.43Å; W16-I20 PolarHBondContact O-N 3.43Å
17	F	58.2	Low	57	Low	144 Å²	144	115 Å²	115	63%	0.632	58%	0.584	S	S	*	*	H	α-helix	trans	-66.9	-33.3	173.9	-95.1	-83.2	0	0	0	113.3	C13 C14 I20 C21	C13-F17 PolarHBondContact O-N 3.21Å; C14-F17 PolarHBondContact O-N 3.47Å; F17-I20 PolarHBondContact O-N 2.89Å; F17-C21 PolarHBondContact O-N 3.46Å; F17-C21 VanDerWaalsContact O-N 3.1Å; F17-C21 PolarHBondContact O-SG 2.92Å; F17-C21 VanDerWaalsContact O-SG 3.33Å
18	I	62.7	Low	56.2	Low	108 Å²	108	116.1 Å²	116.1	55%	0.554	59%	0.591	S	S	*	*	H	α-helix	trans	-70.4	-36.1	177.5	-65	165.1	0	0	0	111.1	C14 A15 W16 I20 C21 L22	C14-I18 WeakPolarHBondContact O-CG1 3.24Å; C14-I18 PolarHBondContact O-N 2.82Å; A15-I18 PolarHBondContact O-N 3.13Å; W16-I18 PolarHBondContact O-N 2.86Å; I18-I20 VanDerWaalsContact C-N 3.33Å; I18-I20 PolarHBondContact O-N 3.4Å; I18-C21 PolarHBondContact O-N 3.28Å; I18-L22 HydrophobicContact CG2-CD1 4.46Å; I18-L22 PolarHBondContact O-N 2.9Å; I18-L22 VanDerWaalsContact O-N 3.11Å
19	L	57.6	Low	55.4	Low	118 Å²	118	110.5 Å²	110.5	62%	0.618	59%	0.587	S	S	*	*	H	α-helix	trans	-64.8	-34.6	173.3	-92.6	152.7	0	0	0	112.8	A15 W16 S23	A15-L19 PolarHBondContact O-N 2.78Å; W16-L19 PolarHBondContact O-N 2.93Å; L19-S23 PolarHBondContact O-N 3.42Å
20	I	62.6	Low	54.6	Low	73 Å²	73	108.2 Å²	108.2	37%	0.374	59%	0.586	S	S	.	*	H	α-helix	trans	-71.9	-34.7	174.8	-64.2	164.8	0	0	0	111	W16 F17 I18 S23 I24	W16-I20 HydrophobicContact CE3-CD1 4.28Å; W16-I20 WeakPolarHBondContact O-CG1 3.43Å; W16-I20 PolarHBondContact O-N 3.43Å; F17-I20 PolarHBondContact O-N 2.89Å; I18-I20 VanDerWaalsContact C-N 3.33Å; I18-I20 PolarHBondContact O-N 3.4Å; I20-S23 PolarHBondContact O-N 2.86Å; I20-S23 PolarHBondContact O-OG 3.46Å; I20-I24 HydrophobicContact CG2-CD1 4.07Å; I20-I24 WeakPolarHBondContact O-CD1 3.37Å; I20-I24 VanDerWaalsContact O-CG1 3.29Å; I20-I24 WeakPolarHBondContact O-CG1 3.43Å; I20-I24 PolarHBondContact O-N 3.3Å
21	C	54.8	Low	54.2	Low	72 Å²	72	106.1 Å²	106.1	49%	0.486	59%	0.585	S	S	.	*	H	α-helix	trans	-68.5	-33.9	175.5	-68.4	0	0	0	0	112.7	F17 I18 I24 N25	F17-C21 PolarHBondContact O-N 3.46Å; F17-C21 VanDerWaalsContact O-N 3.1Å; F17-C21 PolarHBondContact O-SG 2.92Å; F17-C21 VanDerWaalsContact O-SG 3.33Å; I18-C21 PolarHBondContact O-N 3.28Å; C21-I24 PolarHBondContact O-N 3.41Å; C21-N25 PolarHBondContact O-N 2.8Å
22	L	51.6	Low	53.9	Low	115 Å²	115	111 Å²	111	60%	0.602	60%	0.597	S	S	*	*	H	α-helix	trans	-73	-29.6	176.9	-72.3	169.7	0	0	0	112.8	I18 Y26	I18-L22 HydrophobicContact CG2-CD1 4.46Å; I18-L22 PolarHBondContact O-N 2.9Å; I18-L22 VanDerWaalsContact O-N 3.11Å; L22-Y26 PolarHBondContact O-N 3.26Å
23	S	54.6	Low	53.7	Low	67 Å²	67	109.2 Å²	109.2	47%	0.469	59%	0.587	S	S	.	*	H	α-helix	trans	-72.8	-33.2	172.6	64.2	0	0	0	0	112.5	L19 I20 Y26 V27	L19-S23 PolarHBondContact O-N 3.42Å; I20-S23 PolarHBondContact O-N 2.86Å; I20-S23 PolarHBondContact O-OG 3.46Å; S23-Y26 PolarHBondContact O-N 3.33Å; S23-V27 WeakPolarHBondContact O-CG2 3.4Å; S23-V27 PolarHBondContact O-N 2.87Å
24	I	51.2	Low	54.5	Low	96 Å²	96	113.9 Å²	113.9	49%	0.492	60%	0.598	S	S	.	*	H	α-helix	trans	-67.2	-36.6	175.6	-65	163.1	0	0	0	111.5	I20 C21 Y26 V27 L28	I20-I24 HydrophobicContact CG2-CD1 4.07Å; I20-I24 WeakPolarHBondContact O-CD1 3.37Å; I20-I24 VanDerWaalsContact O-CG1 3.29Å; I20-I24 WeakPolarHBondContact O-CG1 3.43Å; I20-I24 PolarHBondContact O-N 3.3Å; C21-I24 PolarHBondContact O-N 3.41Å; I24-Y26 VanDerWaalsContact C-N 3.35Å; I24-Y26 PolarHBondContact O-N 3.02Å; I24-V27 PolarHBondContact O-N 3.44Å; I24-L28 PolarHBondContact O-N 3.21Å
25	N	44	Very low	55.7	Low	107 Å²	107	113.2 Å²	113.2	57%	0.572	59%	0.585	S	S	*	*	H	α-helix	trans	-70.1	-26.8	176	-86.2	-33.5	0	0	0	113.8	C21	C21-N25 PolarHBondContact O-N 2.8Å
26	Y	48.5	Very low	56.9	Low	199 Å²	199	118.5 Å²	118.5	78%	0.78	59%	0.594	S	S	*	*	H	α-helix	trans	-73	-31.3	173.5	-163.9	-97.6	0	0	0	112.1	L22 S23 I24 L28 A29	L22-Y26 PolarHBondContact O-N 3.26Å; S23-Y26 PolarHBondContact O-N 3.33Å; I24-Y26 VanDerWaalsContact C-N 3.35Å; I24-Y26 PolarHBondContact O-N 3.02Å; Y26-L28 VanDerWaalsContact C-N 3.31Å; Y26-L28 PolarHBondContact O-N 3.49Å; Y26-A29 PolarHBondContact O-N 3.41Å
27	V	51.4	Low	58.1	Low	104 Å²	104	112 Å²	112	63%	0.63	57%	0.569	S	S	*	*	H	α-helix	trans	-71.6	-26.2	177.3	177.1	0	0	0	0	112	S23 I24 A29	S23-V27 WeakPolarHBondContact O-CG2 3.4Å; S23-V27 PolarHBondContact O-N 2.87Å; I24-V27 PolarHBondContact O-N 3.44Å; V27-A29 VanDerWaalsContact C-N 3.31Å; V27-A29 PolarHBondContact O-N 3.34Å
28	L	46.8	Very low	59.5	Low	125 Å²	125	105.7 Å²	105.7	65%	0.654	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.5	178	-70.1	169.8	0	0	0	114.2	I24 Y26	I24-L28 PolarHBondContact O-N 3.21Å; Y26-L28 VanDerWaalsContact C-N 3.31Å; Y26-L28 PolarHBondContact O-N 3.49Å
29	A	41.4	Very low	60.8	Low	82 Å²	82	109 Å²	109	68%	0.678	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-4.6	178	0	0	0	0	0	114.4	Y26 V27 S31	Y26-A29 PolarHBondContact O-N 3.41Å; V27-A29 VanDerWaalsContact C-N 3.31Å; V27-A29 PolarHBondContact O-N 3.34Å; A29-S31 PolarHBondContact O-N 3.27Å
30	S	43.3	Very low	62.3	Low	89 Å²	89	106.8 Å²	106.8	62%	0.622	54%	0.542	S	S	*	.	S	Bend	trans	-99.8	59.2	170.2	70.6	0	0	0	0	110.9	Y32	S30-Y32 PolarHBondContact O-N 3.35Å
31	S	49.3	Very low	63.7	Low	96 Å²	96	105.7 Å²	105.7	67%	0.671	54%	0.541	S	S	*	.			trans	-72.1	97.8	174.8	57.3	0	0	0	0	111.2	A29	A29-S31 PolarHBondContact O-N 3.27Å
32	Y	53.3	Low	65.3	Low	218 Å²	218	107.4 Å²	107.4	86%	0.855	55%	0.553	S	S	*	*			trans	25.1	98.5	143.3	-54.2	-84.7	0	0	0	118.3	S30 K34	S30-Y32 PolarHBondContact O-N 3.35Å; Y32-K34 PolarHBondContact O-N 3.41Å; Y32-K34 VanDerWaalsContact O-N 3.11Å
33	L	58.1	Low	67.1	Low	85 Å²	85	104.4 Å²	104.4	45%	0.445	54%	0.54	S	S	.	.			trans	-66.3	102.7	154.6	-119.3	101.2	0	0	0	108.3	Y35 D64 Y66	L33-Y35 HydrophobicContact CB-CE2 4.13Å; L33-Y35 HydrophobicContact CD2-CE1 4.47Å; L33-Y35 HydrophobicContact CD2-CE2 4.33Å; L33-Y35 WeakPolarHBondContact O-CD2 3.4Å; L33-D64 HydrophobicContact CD2-CB 4.2Å; L33-Y66 HydrophobicContact CD1-CE2 4.2Å; L33-Y66 HydrophobicContact CD2-CE2 4.42Å
34	K	76	Confident	68.6	Low	177 Å²	177	103.5 Å²	103.5	77%	0.77	53%	0.532	S	S	*	.			trans	-85.5	115.4	176.5	-171.7	174.6	-178.7	177.2	0	109.7	Y32	Y32-K34 PolarHBondContact O-N 3.41Å; Y32-K34 VanDerWaalsContact O-N 3.11Å
35	Y	82.5	Confident	70.3	Confident	69 Å²	69	107.8 Å²	107.8	27%	0.271	56%	0.555	S	S	.	*			trans	-84	145.9	174.4	-64	-96.5	0	0	0	110.4	L33 L63 D64 Q70 M75	L33-Y35 HydrophobicContact CB-CE2 4.13Å; L33-Y35 HydrophobicContact CD2-CE1 4.47Å; L33-Y35 HydrophobicContact CD2-CE2 4.33Å; L33-Y35 WeakPolarHBondContact O-CD2 3.4Å; Y35-L63 WeakPolarHBondContact CA-O 3.43Å; Y35-D64 HydrophobicContact CD1-CB 3.83Å; Y35-D64 HydrophobicContact CE1-CB 3.53Å; Y35-Q70 HydrophobicContact CD1-CG 4.12Å; Y35-Q70 HydrophobicContact CE1-CG 3.89Å; Y35-M75 WeakPolarHBondContact CB-O 3.31Å; Y35-M75 HydrophobicContact CD1-CB 3.89Å; Y35-M75 HydrophobicContact CD1-CG 4.49Å; Y35-M75 HydrophobicContact CD2-CB 3.77Å; Y35-M75 HydrophobicContact CD2-CG 4.33Å; Y35-M75 HydrophobicContact CE1-CB 4.37Å; Y35-M75 HydrophobicContact CE1-CG 4.48Å; Y35-M75 HydrophobicContact CE2-CB 4.25Å; Y35-M75 HydrophobicContact CE2-CG 4.33Å; Y35-M75 HydrophobicContact CG-CB 3.58Å; Y35-M75 HydrophobicContact CG-CG 4.43Å
36	R	85.1	Confident	72.4	Confident	160 Å²	160	107.9 Å²	107.9	60%	0.604	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-141.9	150.1	-178.4	63.2	179.3	177.8	179.1	-1.2	111.9	L63 C76	R36-L63 HydrophobicContact CG-CB 4.42Å; R36-L63 PolarHBondContact N-O 3.11Å; R36-L63 WeakPolarHBondContact O-CB 3.33Å; R36-L63 PolarHBondContact O-N 2.91Å; R36-C76 PolarHBondContact O-SG 3.01Å; R36-C76 VanDerWaalsContact O-SG 3.39Å
37	W	87.7	Confident	74.4	Confident	47 Å²	47	99.6 Å²	99.6	18%	0.178	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136.2	172.3	-73.1	110	0	0	0	111.9	R60 C62 T73 C76 E83 S84 A86	W37-R60 HydrophobicContact CD2-CG 4.39Å; W37-R60 HydrophobicContact CE3-CG 3.7Å; W37-R60 HydrophobicContact CZ3-CG 4.11Å; W37-C62 HydrophobicContact CE3-CB 4.45Å; W37-C62 HydrophobicContact CZ3-CB 4.29Å; W37-T73 HydrophobicContact CH2-CG2 3.8Å; W37-T73 HydrophobicContact CZ3-CG2 3.97Å; W37-C76 HydrophobicContact CD2-CB 3.79Å; W37-C76 VanDerWaalsContact CE2-CB 3.47Å; W37-C76 HydrophobicContact CE3-CB 4.29Å; W37-C76 HydrophobicContact CG-CB 4.2Å; W37-C76 HydrophobicContact CH2-CB 4.26Å; W37-C76 HydrophobicContact CZ2-CB 3.72Å; W37-C76 PolarHBondContact NE1-O 3.32Å; W37-E83 PolarHBondContact NE1-O 2.92Å; W37-E83 VanDerWaalsContact NE1-O 3.08Å; W37-S84 VanDerWaalsContact CZ2-O 3.27Å; W37-S84 WeakPolarHBondContact CZ2-O 3.4Å; W37-A86 HydrophobicContact CH2-CB 3.73Å; W37-A86 HydrophobicContact CZ3-CB 3.81Å
38	G	87.2	Confident	76.1	Confident	12 Å²	12	98.5 Å²	98.5	12%	0.124	53%	0.528	C	S	.	.			trans	-73.6	175.7	166.7	0	0	0	0	0	112.6	S61	G38-S61 PolarHBondContact N-O 2.91Å
39	Q	88.8	Confident	78	Confident	178 Å²	178	94.9 Å²	94.9	83%	0.832	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-63.8	149.1	175.7	-69.3	-67.5	-21.5	0	0	111.3
40	W	90.9	Very high	80.2	Confident	72 Å²	72	97 Å²	97	27%	0.273	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-68.7	141.6	171.5	-74.1	103.9	0	0	0	111.1	R58 V59 R60 Q85 A86 E88	W40-R58 HydrophobicContact CD2-CG 4.37Å; W40-R58 HydrophobicContact CE3-CB 4.31Å; W40-R58 HydrophobicContact CE3-CG 3.79Å; W40-R58 HydrophobicContact CZ3-CG 4.24Å; W40-R58 WeakPolarHBondContact CZ3-O 3.48Å; W40-V59 VanDerWaalsContact CE3-C 3.48Å; W40-R60 HydrophobicContact CD2-CB 3.99Å; W40-R60 HydrophobicContact CD2-CG 3.94Å; W40-R60 VanDerWaalsContact CE2-CD 3.44Å; W40-R60 HydrophobicContact CE3-CB 3.85Å; W40-R60 HydrophobicContact CE3-CG 3.81Å; W40-R60 HydrophobicContact CG-CB 4.42Å; W40-R60 HydrophobicContact CH2-CG 3.87Å; W40-R60 HydrophobicContact CZ2-CG 4Å; W40-R60 HydrophobicContact CZ3-CB 4.27Å; W40-R60 HydrophobicContact CZ3-CG 3.77Å; W40-Q85 VanDerWaalsContact CH2-O 3.23Å; W40-Q85 WeakPolarHBondContact CH2-O 3.4Å; W40-A86 WeakPolarHBondContact CZ3-O 3.45Å; W40-E88 HydrophobicContact CH2-CB 3.85Å; W40-E88 HydrophobicContact CZ2-CB 4.44Å; W40-E88 HydrophobicContact CZ3-CB 4.07Å
41	S	90.4	Very high	82.3	Confident	50 Å²	50	93.8 Å²	93.8	35%	0.35	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-59.6	153.5	166.4	74.1	0	0	0	0	110.3	R58 V59	S41-R58 WeakPolarHBondContact OG-CA 3.26Å; S41-V59 WeakPolarHBondContact CB-O 3.43Å; S41-V59 PolarHBondContact N-O 3.42Å; S41-V59 PolarHBondContact OG-N 2.84Å; S41-V59 PolarHBondContact OG-O 2.96Å
42	S	89.3	Confident	84.1	Confident	107 Å²	107	90 Å²	90	75%	0.748	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-56.9	144.6	170.7	53.5	0	0	0	0	110.4	P44	S42-P44 WeakPolarHBondContact O-CD 3.16Å
43	T	88.4	Confident	85.8	Confident	52 Å²	52	86 Å²	86	32%	0.319	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-69.2	127.2	174.5	51.4	0	0	0	0	109.2	L45 R56 R58 M90	T43-L45 PolarHBondContact O-N 3.44Å; T43-R56 PolarHBondContact OG1-NH1 2.83Å; T43-R58 HydrophobicContact CG2-CB 4.44Å; T43-R58 HydrophobicContact CG2-CG 4.49Å; T43-M90 HydrophobicContact CG2-CE 3.71Å; T43-M90 HydrophobicContact CG2-SD 4Å
44	P	87.9	Confident	87.3	Confident	48 Å²	48	82.5 Å²	82.5	31%	0.312	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-55.9	134.3	176	-23	31.9	0	0	0	111.1	S42 T46 R56 C57	S42-P44 WeakPolarHBondContact O-CD 3.16Å; P44-T46 VanDerWaalsContact C-N 3.3Å; P44-R56 HydrophobicContact CB-CB 4.47Å; P44-R56 WeakPolarHBondContact O-CD 3.48Å; P44-C57 WeakPolarHBondContact CD-O 3.46Å; P44-C57 WeakPolarHBondContact CG-O 3.11Å
45	L	86.1	Confident	88.1	Confident	186 Å²	186	77.5 Å²	77.5	97%	0.974	43%	0.431	S	S	*	.	S	Bend	trans	-70.1	-31.7	172.3	-76.1	143.2	0	0	0	111.2	T43	T43-L45 PolarHBondContact O-N 3.44Å
46	T	88	Confident	88.5	Confident	110 Å²	110	78 Å²	78	68%	0.675	43%	0.432	S	S	*	.	S	Bend	trans	-84.5	139.8	178.8	51.5	0	0	0	0	110.9	P44	P44-T46 VanDerWaalsContact C-N 3.3Å
47	C	90.2	Very high	88.9	Confident	25 Å²	25	72.1 Å²	72.1	17%	0.169	42%	0.415	C	S	.	.			trans	-81.9	157.2	172.9	-163.2	0	0	0	0	109.8	V49 G54 C92 V94	C47-V49 PolarHBondContact O-N 3.25Å; C47-V49 VanDerWaalsContact O-N 3.13Å; C47-G54 VanDerWaalsContact SG-CA 3.52Å; C47-C92 WeakPolarHBondContact CA-SG 3.46Å; C47-C92 HydrophobicContact CB-CB 3.88Å; C47-C92 WeakPolarHBondContact CB-SG 3.44Å; C47-C92 WeakPolarHBondContact SG-CB 3.25Å; C47-C92 CovalentContact SG-SG 2.03Å; C47-C92 PolarHBondContact SG-SG 3.01Å; C47-V94 HydrophobicContact CB-CG2 3.58Å
48	S	88.3	Confident	89.1	Confident	80 Å²	80	73.2 Å²	73.2	56%	0.559	42%	0.419	S	S	*	.	S	Bend	trans	-61.1	-18.7	173.8	63.2	0	0	0	0	113.8	G54 V55	S48-G54 WeakPolarHBondContact OG-CA 3.3Å; S48-V55 VanDerWaalsContact CB-O 3.24Å; S48-V55 WeakPolarHBondContact CB-O 3.42Å; S48-V55 PolarHBondContact N-O 3.37Å; S48-V55 VanDerWaalsContact N-O 3.11Å; S48-V55 PolarHBondContact OG-N 3Å; S48-V55 PolarHBondContact OG-O 3.39Å
49	V	86.7	Confident	89.3	Confident	49 Å²	49	76.3 Å²	76.3	30%	0.297	44%	0.435	S	S	.	.	S	Bend	trans	-120.3	155.7	179.8	-57.5	0	0	0	0	110.2	C47 C51 V94	C47-V49 PolarHBondContact O-N 3.25Å; C47-V49 VanDerWaalsContact O-N 3.13Å; V49-C51 WeakPolarHBondContact CG2-O 3.46Å; V49-V94 HydrophobicContact CG2-CG2 4.38Å; V49-V94 WeakPolarHBondContact O-CG2 3.2Å
50	T	86.8	Confident	89.4	Confident	126 Å²	126	69.8 Å²	69.8	77%	0.773	40%	0.403	S	S	*	.	S	Bend	trans	-93.8	-4.8	175	51.5	0	0	0	0	113.3	V94	T50-V94 VanDerWaalsContact O-CG1 3.22Å; T50-V94 WeakPolarHBondContact O-CG1 3.44Å
51	C	87.3	Confident	89.2	Confident	23 Å²	23	68.6 Å²	68.6	16%	0.155	41%	0.406	C	S	.	.	S	Bend	trans	-155.5	144.6	178.4	68.3	0	0	0	0	109.7	V49 T96 C98	V49-C51 WeakPolarHBondContact CG2-O 3.46Å; C51-T96 VanDerWaalsContact CB-O 3.31Å; C51-T96 WeakPolarHBondContact CB-O 3.43Å; C51-C98 HydrophobicContact CB-CB 3.94Å; C51-C98 WeakPolarHBondContact CB-SG 3.5Å; C51-C98 PolarHBondContact O-SG 3.49Å; C51-C98 WeakPolarHBondContact SG-CA 3.29Å; C51-C98 WeakPolarHBondContact SG-CB 3.26Å; C51-C98 CovalentContact SG-SG 2.04Å; C51-C98 PolarHBondContact SG-SG 3.42Å
52	G	86.5	Confident	89.3	Confident	16 Å²	16	66.2 Å²	66.2	17%	0.165	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73	-152.4	175.5	0	0	0	0	0	115.1	F93 V94	G52-F93 WeakPolarHBondContact O-CA 3.48Å; G52-F93 WeakPolarHBondContact O-CD2 3.31Å; G52-V94 PolarHBondContact N-O 3.47Å; G52-V94 PolarHBondContact O-N 3.41Å
53	N	89.4	Confident	89.1	Confident	135 Å²	135	62.6 Å²	62.6	72%	0.722	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.2	-177.1	-66.7	-4.8	0	0	0	110.9	F93	N53-F93 WeakPolarHBondContact OD1-CD2 3.34Å; N53-F93 VanDerWaalsContact OD1-CE2 3.31Å; N53-F93 WeakPolarHBondContact OD1-CE2 3.41Å
54	G	90.4	Very high	88.8	Confident	11 Å²	11	60.7 Å²	60.7	11%	0.113	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	-167.1	167.2	0	0	0	0	0	111.6	C47 S48 C92	C47-G54 VanDerWaalsContact SG-CA 3.52Å; S48-G54 WeakPolarHBondContact OG-CA 3.3Å; G54-C92 PolarHBondContact N-O 3.26Å; G54-C92 PolarHBondContact O-N 3.4Å; G54-C92 VanDerWaalsContact O-O 3.08Å
55	V	92.9	Very high	88.3	Confident	71 Å²	71	60.6 Å²	60.6	43%	0.43	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.6	177.3	-66.6	0	0	0	0	110.6	S48 M90 C92	S48-V55 VanDerWaalsContact CB-O 3.24Å; S48-V55 WeakPolarHBondContact CB-O 3.42Å; S48-V55 PolarHBondContact N-O 3.37Å; S48-V55 VanDerWaalsContact N-O 3.11Å; S48-V55 PolarHBondContact OG-N 3Å; S48-V55 PolarHBondContact OG-O 3.39Å; V55-M90 WeakPolarHBondContact CA-O 3.28Å; V55-C92 VanDerWaalsContact CA-SG 3.55Å; V55-C92 PolarHBondContact N-SG 2.95Å; V55-C92 VanDerWaalsContact N-SG 3.42Å
56	R	91.3	Very high	88	Confident	81 Å²	81	60.5 Å²	60.5	31%	0.306	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.5	168.2	59.5	-170.6	175.5	112.4	-0.2	107.8	T43 P44 C89 M90 C92	T43-R56 PolarHBondContact OG1-NH1 2.83Å; P44-R56 HydrophobicContact CB-CB 4.47Å; P44-R56 WeakPolarHBondContact O-CD 3.48Å; R56-C89 WeakPolarHBondContact O-CA 3.45Å; R56-M90 HydrophobicContact CG-CG 3.37Å; R56-M90 HydrophobicContact CG-SD 4.12Å; R56-M90 PolarHBondContact N-O 3.45Å; R56-M90 PolarHBondContact NE-SD 3.31Å; R56-M90 PolarHBondContact NH1-SD 3.43Å; R56-M90 PolarHBondContact NH2-SD 2.83Å; R56-M90 WeakPolarHBondContact O-CG 3.46Å; R56-M90 PolarHBondContact O-N 2.95Å; R56-C92 HydrophobicContact CG-CB 4.5Å
57	C	92.3	Very high	87.6	Confident	36 Å²	36	56.9 Å²	56.9	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.3	-175.9	-54.1	0	0	0	0	110.9	P44 K87 E88 C89	P44-C57 WeakPolarHBondContact CD-O 3.46Å; P44-C57 WeakPolarHBondContact CG-O 3.11Å; C57-K87 HydrophobicContact CB-CG 4.3Å; C57-E88 CarbonylContact C-O 3.49Å; C57-E88 WeakPolarHBondContact CA-O 3.45Å; C57-C89 HydrophobicContact CB-CB 4.09Å; C57-C89 WeakPolarHBondContact CB-SG 3.46Å; C57-C89 WeakPolarHBondContact SG-CB 3.48Å; C57-C89 CovalentContact SG-SG 2.04Å; C57-C89 PolarHBondContact SG-SG 2.91Å
58	R	91.8	Very high	87.2	Confident	69 Å²	69	60.1 Å²	60.1	26%	0.26	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	151.9	168.2	60.2	178	-177.3	-176.3	-1.6	110	W40 S41 T43 K87 E88	W40-R58 HydrophobicContact CD2-CG 4.37Å; W40-R58 HydrophobicContact CE3-CB 4.31Å; W40-R58 HydrophobicContact CE3-CG 3.79Å; W40-R58 HydrophobicContact CZ3-CG 4.24Å; W40-R58 WeakPolarHBondContact CZ3-O 3.48Å; S41-R58 WeakPolarHBondContact OG-CA 3.26Å; T43-R58 HydrophobicContact CG2-CB 4.44Å; T43-R58 HydrophobicContact CG2-CG 4.49Å; R58-K87 WeakPolarHBondContact O-CA 3.46Å; R58-E88 HydrophobicContact CG-CB 4.13Å; R58-E88 IonicContact CZ-OE2 3.92Å; R58-E88 PolarHBondContact N-O 3.41Å; R58-E88 IonicContact NE-OE2 3.78Å; R58-E88 PolarHBondContact NE-OE2 2.87Å; R58-E88 IonicContact NH2-OE1 3.75Å; R58-E88 IonicContact NH2-OE2 3.56Å; R58-E88 PolarHBondContact NH2-OE2 3.44Å; R58-E88 PolarHBondContact O-N 3.26Å
59	V	91.7	Very high	87.2	Confident	77 Å²	77	61 Å²	61	47%	0.467	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.7	-177.2	-65.8	0	0	0	0	111.2	W40 S41 A86 K87	W40-V59 VanDerWaalsContact CE3-C 3.48Å; S41-V59 WeakPolarHBondContact CB-O 3.43Å; S41-V59 PolarHBondContact N-O 3.42Å; S41-V59 PolarHBondContact OG-N 2.84Å; S41-V59 PolarHBondContact OG-O 2.96Å; V59-A86 CarbonylContact C-O 3.5Å; V59-A86 VanDerWaalsContact CA-O 3.27Å; V59-A86 WeakPolarHBondContact CA-O 3.45Å; V59-K87 HydrophobicContact CG1-CB 4Å; V59-K87 HydrophobicContact CG1-CD 4.24Å; V59-K87 HydrophobicContact CG1-CG 3.83Å
60	R	90.1	Very high	87	Confident	42 Å²	42	61.7 Å²	61.7	16%	0.158	35%	0.347	C	S	.	.			trans	-135.2	153.6	172.9	60.1	176.9	174.8	168.8	1.5	110.8	W37 W40 E83 Q85 A86	W37-R60 HydrophobicContact CD2-CG 4.39Å; W37-R60 HydrophobicContact CE3-CG 3.7Å; W37-R60 HydrophobicContact CZ3-CG 4.11Å; W40-R60 HydrophobicContact CD2-CB 3.99Å; W40-R60 HydrophobicContact CD2-CG 3.94Å; W40-R60 VanDerWaalsContact CE2-CD 3.44Å; W40-R60 HydrophobicContact CE3-CB 3.85Å; W40-R60 HydrophobicContact CE3-CG 3.81Å; W40-R60 HydrophobicContact CG-CB 4.42Å; W40-R60 HydrophobicContact CH2-CG 3.87Å; W40-R60 HydrophobicContact CZ2-CG 4Å; W40-R60 HydrophobicContact CZ3-CB 4.27Å; W40-R60 HydrophobicContact CZ3-CG 3.77Å; R60-E83 PolarHBondContact NH2-O 3.27Å; R60-Q85 VanDerWaalsContact CZ-O 3.3Å; R60-Q85 PolarHBondContact NE-O 3.08Å; R60-Q85 PolarHBondContact NH2-O 2.91Å; R60-A86 PolarHBondContact N-O 3.35Å
61	S	88.6	Confident	86.7	Confident	46 Å²	46	61.9 Å²	61.9	32%	0.322	35%	0.354	S	S	.	.			trans	-103.5	152.5	180	46.8	0	0	0	0	112.4	G38	G38-S61 PolarHBondContact N-O 2.91Å
62	C	90.8	Very high	86.3	Confident	1 Å²	1	63 Å²	63	1%	0.007	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.8	173.6	-179.6	0	0	0	0	109.6	W37 Q70 T73 C76	W37-C62 HydrophobicContact CE3-CB 4.45Å; W37-C62 HydrophobicContact CZ3-CB 4.29Å; C62-Q70 PolarHBondContact O-N 2.8Å; C62-T73 HydrophobicContact CB-CG2 4.5Å; C62-C76 WeakPolarHBondContact CA-SG 3.35Å; C62-C76 HydrophobicContact CB-CB 3.82Å; C62-C76 WeakPolarHBondContact CB-SG 3.3Å; C62-C76 WeakPolarHBondContact SG-CB 3.45Å; C62-C76 CovalentContact SG-SG 2.03Å; C62-C76 PolarHBondContact SG-SG 3.44Å
63	L	85.8	Confident	86.2	Confident	31 Å²	31	65.4 Å²	65.4	16%	0.162	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	139.4	-177.6	-54.9	177.4	0	0	0	110.5	Y35 R36 N68 V69	Y35-L63 WeakPolarHBondContact CA-O 3.43Å; R36-L63 HydrophobicContact CG-CB 4.42Å; R36-L63 PolarHBondContact N-O 3.11Å; R36-L63 WeakPolarHBondContact O-CB 3.33Å; R36-L63 PolarHBondContact O-N 2.91Å; L63-N68 WeakPolarHBondContact CA-O 3.42Å; L63-V69 HydrophobicContact CD2-CB 4.45Å; L63-V69 HydrophobicContact CD2-CG2 3.67Å
64	D	82.2	Confident	85.8	Confident	11 Å²	11	65.6 Å²	65.6	6%	0.059	37%	0.371	C	S	.	.			trans	-76.1	178.3	169.7	70.6	13.7	0	0	0	112.6	L33 Y35 Y66 G67 N68 Q70	L33-D64 HydrophobicContact CD2-CB 4.2Å; Y35-D64 HydrophobicContact CD1-CB 3.83Å; Y35-D64 HydrophobicContact CE1-CB 3.53Å; D64-Y66 PolarHBondContact O-N 3.36Å; D64-Y66 VanDerWaalsContact O-N 3.07Å; D64-Y66 VanDerWaalsContact OD1-C 3.28Å; D64-Y66 WeakPolarHBondContact OD1-CA 3.35Å; D64-Y66 WeakPolarHBondContact OD1-CB 3.42Å; D64-Y66 PolarHBondContact OD1-N 3.28Å; D64-G67 PolarHBondContact O-N 3.48Å; D64-G67 PolarHBondContact OD1-N 3.07Å; D64-N68 PolarHBondContact N-O 2.93Å; D64-N68 PolarHBondContact OD1-N 3.28Å; D64-N68 WeakPolarHBondContact OD2-CB 3.42Å; D64-N68 PolarHBondContact OD2-ND2 3.38Å; D64-N68 VanDerWaalsContact OD2-ND2 3.12Å; D64-Q70 HydrophobicContact CB-CG 4.19Å; D64-Q70 PolarHBondContact OD2-NE2 2.94Å; D64-Q70 VanDerWaalsContact OD2-NE2 3.11Å
65	G	77.4	Confident	85.3	Confident	47 Å²	47	70.8 Å²	70.8	49%	0.485	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.6	177.6	0	0	0	0	0	114.5
66	Y	79.3	Confident	84.9	Confident	184 Å²	184	67.9 Å²	67.9	72%	0.722	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-0.8	178.2	-55.9	-74.4	0	0	0	112.9	L33 D64	L33-Y66 HydrophobicContact CD1-CE2 4.2Å; L33-Y66 HydrophobicContact CD2-CE2 4.42Å; D64-Y66 PolarHBondContact O-N 3.36Å; D64-Y66 VanDerWaalsContact O-N 3.07Å; D64-Y66 VanDerWaalsContact OD1-C 3.28Å; D64-Y66 WeakPolarHBondContact OD1-CA 3.35Å; D64-Y66 WeakPolarHBondContact OD1-CB 3.42Å; D64-Y66 PolarHBondContact OD1-N 3.28Å
67	G	79.5	Confident	84.5	Confident	34 Å²	34	70.4 Å²	70.4	35%	0.351	39%	0.392	S	S	.	.			trans	86.1	10.6	179.5	0	0	0	0	0	115.2	D64	D64-G67 PolarHBondContact O-N 3.48Å; D64-G67 PolarHBondContact OD1-N 3.07Å
68	N	82.6	Confident	83.8	Confident	93 Å²	93	70.7 Å²	70.7	50%	0.497	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-80.7	138.2	177	-53.7	-58.4	0	0	0	111.2	L63 D64 Q70	L63-N68 WeakPolarHBondContact CA-O 3.42Å; D64-N68 PolarHBondContact N-O 2.93Å; D64-N68 PolarHBondContact OD1-N 3.28Å; D64-N68 WeakPolarHBondContact OD2-CB 3.42Å; D64-N68 PolarHBondContact OD2-ND2 3.38Å; D64-N68 VanDerWaalsContact OD2-ND2 3.12Å; N68-Q70 PolarHBondContact O-N 3.46Å
69	V	86.8	Confident	83.2	Confident	98 Å²	98	73 Å²	73	59%	0.594	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	118.8	175.6	175.2	0	0	0	0	109.9	L63	L63-V69 HydrophobicContact CD2-CB 4.45Å; L63-V69 HydrophobicContact CD2-CG2 3.67Å
70	Q	83.3	Confident	82.5	Confident	64 Å²	64	73.7 Å²	73.7	30%	0.299	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	143.3	176.7	-64.1	-63.7	-39.2	0	0	110.6	Y35 C62 D64 N68 S72	Y35-Q70 HydrophobicContact CD1-CG 4.12Å; Y35-Q70 HydrophobicContact CE1-CG 3.89Å; C62-Q70 PolarHBondContact O-N 2.8Å; D64-Q70 HydrophobicContact CB-CG 4.19Å; D64-Q70 PolarHBondContact OD2-NE2 2.94Å; D64-Q70 VanDerWaalsContact OD2-NE2 3.11Å; N68-Q70 PolarHBondContact O-N 3.46Å; Q70-S72 VanDerWaalsContact C-N 3.31Å
71	S	80.4	Confident	81.8	Confident	130 Å²	130	76.6 Å²	76.6	91%	0.909	45%	0.446	S	S	*	.	S	Bend	trans	-70.8	-28	176.9	49.4	0	0	0	0	112.8
72	S	80.1	Confident	81.2	Confident	45 Å²	45	83 Å²	83	32%	0.315	47%	0.465	S	S	.	.			trans	-100.3	130.7	177.1	174.4	0	0	0	0	111.1	Q70 M74	Q70-S72 VanDerWaalsContact C-N 3.31Å; S72-M74 WeakPolarHBondContact OG-CB 3.28Å; S72-M74 PolarHBondContact OG-N 3.34Å
73	T	82.9	Confident	80.5	Confident	67 Å²	67	88.7 Å²	88.7	41%	0.411	49%	0.491	S	S	.	.	S	Bend	trans	-86.9	-8.5	173.8	51	0	0	0	0	113.6	W37 C62 M75 C76 A86	W37-T73 HydrophobicContact CH2-CG2 3.8Å; W37-T73 HydrophobicContact CZ3-CG2 3.97Å; C62-T73 HydrophobicContact CB-CG2 4.5Å; T73-M75 PolarHBondContact O-N 3.4Å; T73-C76 PolarHBondContact O-N 2.98Å; T73-A86 HydrophobicContact CG2-CB 4.06Å
74	M	81.4	Confident	80.3	Confident	139 Å²	139	88.1 Å²	88.1	69%	0.685	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-57.8	-33.1	-176.8	-69.3	177	153.3	0	0	112.7	S72 C76 E77	S72-M74 WeakPolarHBondContact OG-CB 3.28Å; S72-M74 PolarHBondContact OG-N 3.34Å; M74-C76 PolarHBondContact O-N 3.34Å; M74-E77 WeakPolarHBondContact O-CB 3.48Å; M74-E77 PolarHBondContact O-N 2.88Å
75	M	80.7	Confident	80.3	Confident	120 Å²	120	91.4 Å²	91.4	59%	0.591	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-72.9	-16.8	-178.5	-58.7	-59.8	-176.2	0	0	113.4	Y35 T73	Y35-M75 WeakPolarHBondContact CB-O 3.31Å; Y35-M75 HydrophobicContact CD1-CB 3.89Å; Y35-M75 HydrophobicContact CD1-CG 4.49Å; Y35-M75 HydrophobicContact CD2-CB 3.77Å; Y35-M75 HydrophobicContact CD2-CG 4.33Å; Y35-M75 HydrophobicContact CE1-CB 4.37Å; Y35-M75 HydrophobicContact CE1-CG 4.48Å; Y35-M75 HydrophobicContact CE2-CB 4.25Å; Y35-M75 HydrophobicContact CE2-CG 4.33Å; Y35-M75 HydrophobicContact CG-CB 3.58Å; Y35-M75 HydrophobicContact CG-CG 4.43Å; T73-M75 PolarHBondContact O-N 3.4Å
76	C	84.1	Confident	80.7	Confident	10 Å²	10	90.7 Å²	90.7	7%	0.068	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-102.3	5.9	175.9	-68.5	0	0	0	0	112.8	R36 W37 C62 T73 M74 S78	R36-C76 PolarHBondContact O-SG 3.01Å; R36-C76 VanDerWaalsContact O-SG 3.39Å; W37-C76 HydrophobicContact CD2-CB 3.79Å; W37-C76 VanDerWaalsContact CE2-CB 3.47Å; W37-C76 HydrophobicContact CE3-CB 4.29Å; W37-C76 HydrophobicContact CG-CB 4.2Å; W37-C76 HydrophobicContact CH2-CB 4.26Å; W37-C76 HydrophobicContact CZ2-CB 3.72Å; W37-C76 PolarHBondContact NE1-O 3.32Å; C62-C76 WeakPolarHBondContact CA-SG 3.35Å; C62-C76 HydrophobicContact CB-CB 3.82Å; C62-C76 WeakPolarHBondContact CB-SG 3.3Å; C62-C76 WeakPolarHBondContact SG-CB 3.45Å; C62-C76 CovalentContact SG-SG 2.03Å; C62-C76 PolarHBondContact SG-SG 3.44Å; T73-C76 PolarHBondContact O-N 2.98Å; M74-C76 PolarHBondContact O-N 3.34Å; C76-S78 PolarHBondContact O-N 3.4Å
77	E	82.9	Confident	81.3	Confident	135 Å²	135	87.9 Å²	87.9	63%	0.631	49%	0.486	S	S	*	.			trans	-72.4	120.4	179.3	-170.2	158.2	-152.2	0	0	110.2	M74	M74-E77 WeakPolarHBondContact O-CB 3.48Å; M74-E77 PolarHBondContact O-N 2.88Å
78	S	77.4	Confident	81.8	Confident	41 Å²	41	88.6 Å²	88.6	29%	0.287	48%	0.48	S	S	.	.			trans	-93.5	167.9	176.1	91.5	0	0	0	0	110.9	C76 D80 E83 S84	C76-S78 PolarHBondContact O-N 3.4Å; S78-D80 PolarHBondContact O-N 3.41Å; S78-D80 PolarHBondContact OG-N 3.34Å; S78-D80 PolarHBondContact OG-O 3.33Å; S78-E83 WeakPolarHBondContact OG-CB 3.49Å; S78-S84 PolarHBondContact N-OG 3.02Å; S78-S84 PolarHBondContact O-OG 3.35Å; S78-S84 PolarHBondContact OG-OG 2.92Å
79	S	78.6	Confident	82.2	Confident	119 Å²	119	87.3 Å²	87.3	83%	0.832	48%	0.478	S	S	*	.	S	Bend	trans	-61.2	-27.5	170.3	47.9	0	0	0	0	113.1	P81	S79-P81 WeakPolarHBondContact O-CD 3.27Å
80	D	77.6	Confident	82.3	Confident	90 Å²	90	84.5 Å²	84.5	48%	0.481	46%	0.459	S	S	.	.	S	Bend	trans	-87.6	116.3	179.4	-72.3	-48.2	0	0	0	110.6	S78 Y82 E83 S84	S78-D80 PolarHBondContact O-N 3.41Å; S78-D80 PolarHBondContact OG-N 3.34Å; S78-D80 PolarHBondContact OG-O 3.33Å; D80-Y82 PolarHBondContact O-N 3.14Å; D80-Y82 VanDerWaalsContact O-N 3.09Å; D80-E83 HydrophobicContact CB-CB 4.29Å; D80-E83 HydrophobicContact CB-CG 4.35Å; D80-E83 PolarHBondContact O-N 3.5Å; D80-S84 PolarHBondContact O-N 3.2Å; D80-S84 PolarHBondContact O-OG 3.33Å
81	P	75.5	Confident	82.6	Confident	103 Å²	103	86.8 Å²	86.8	67%	0.669	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.3	-174.8	24.1	-32.5	0	0	0	113.4	S79 Q85	S79-P81 WeakPolarHBondContact O-CD 3.27Å; P81-Q85 WeakPolarHBondContact O-CG 3.32Å; P81-Q85 PolarHBondContact O-NE2 3.36Å
82	Y	75.4	Confident	83.1	Confident	181 Å²	181	81.7 Å²	81.7	71%	0.71	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-38.8	174.5	-134.4	-87.3	0	0	0	111.5	D80 S84	D80-Y82 PolarHBondContact O-N 3.14Å; D80-Y82 VanDerWaalsContact O-N 3.09Å; Y82-S84 VanDerWaalsContact C-N 3.29Å; Y82-S84 PolarHBondContact O-N 3.49Å
83	E	76.6	Confident	83.5	Confident	120 Å²	120	85.8 Å²	85.8	56%	0.561	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-12.4	179.1	-70.7	-165.8	176.9	0	0	113.4	W37 R60 S78 D80	W37-E83 PolarHBondContact NE1-O 2.92Å; W37-E83 VanDerWaalsContact NE1-O 3.08Å; R60-E83 PolarHBondContact NH2-O 3.27Å; S78-E83 WeakPolarHBondContact OG-CB 3.49Å; D80-E83 HydrophobicContact CB-CB 4.29Å; D80-E83 HydrophobicContact CB-CG 4.35Å; D80-E83 PolarHBondContact O-N 3.5Å
84	S	80.6	Confident	83.7	Confident	20 Å²	20	84.3 Å²	84.3	14%	0.14	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.3	179.5	-59.6	0	0	0	0	114.4	W37 S78 D80 Y82 A86	W37-S84 VanDerWaalsContact CZ2-O 3.27Å; W37-S84 WeakPolarHBondContact CZ2-O 3.4Å; S78-S84 PolarHBondContact N-OG 3.02Å; S78-S84 PolarHBondContact O-OG 3.35Å; S78-S84 PolarHBondContact OG-OG 2.92Å; D80-S84 PolarHBondContact O-N 3.2Å; D80-S84 PolarHBondContact O-OG 3.33Å; Y82-S84 VanDerWaalsContact C-N 3.29Å; Y82-S84 PolarHBondContact O-N 3.49Å; S84-A86 PolarHBondContact O-N 2.9Å
85	Q	83.6	Confident	83.7	Confident	80 Å²	80	84.7 Å²	84.7	37%	0.374	45%	0.451	S	S	.	.			trans	-77.2	123.7	-174	-63.9	178.7	20.2	0	0	112	W40 R60 P81 K87	W40-Q85 VanDerWaalsContact CH2-O 3.23Å; W40-Q85 WeakPolarHBondContact CH2-O 3.4Å; R60-Q85 VanDerWaalsContact CZ-O 3.3Å; R60-Q85 PolarHBondContact NE-O 3.08Å; R60-Q85 PolarHBondContact NH2-O 2.91Å; P81-Q85 WeakPolarHBondContact O-CG 3.32Å; P81-Q85 PolarHBondContact O-NE2 3.36Å; Q85-K87 VanDerWaalsContact C-N 3.35Å
86	A	86.2	Confident	83.7	Confident	32 Å²	32	83 Å²	83	26%	0.264	45%	0.448	S	S	.	.	S	Bend	trans	-81.2	-15.3	173.7	0	0	0	0	0	113.3	W37 W40 V59 R60 T73 S84	W37-A86 HydrophobicContact CH2-CB 3.73Å; W37-A86 HydrophobicContact CZ3-CB 3.81Å; W40-A86 WeakPolarHBondContact CZ3-O 3.45Å; V59-A86 CarbonylContact C-O 3.5Å; V59-A86 VanDerWaalsContact CA-O 3.27Å; V59-A86 WeakPolarHBondContact CA-O 3.45Å; R60-A86 PolarHBondContact N-O 3.35Å; T73-A86 HydrophobicContact CG2-CB 4.06Å; S84-A86 PolarHBondContact O-N 2.9Å
87	K	90.9	Very high	83.2	Confident	125 Å²	125	93.6 Å²	93.6	54%	0.543	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	129.6	-175.1	-179.2	175	179.9	-178.3	0	109.7	C57 R58 V59 Q85	C57-K87 HydrophobicContact CB-CG 4.3Å; R58-K87 WeakPolarHBondContact O-CA 3.46Å; V59-K87 HydrophobicContact CG1-CB 4Å; V59-K87 HydrophobicContact CG1-CD 4.24Å; V59-K87 HydrophobicContact CG1-CG 3.83Å; Q85-K87 VanDerWaalsContact C-N 3.35Å
88	E	89.9	Confident	82.7	Confident	49 Å²	49	90.5 Å²	90.5	23%	0.229	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.4	177.6	-174.5	-173.3	173.9	0	0	109.1	W40 C57 R58	W40-E88 HydrophobicContact CH2-CB 3.85Å; W40-E88 HydrophobicContact CZ2-CB 4.44Å; W40-E88 HydrophobicContact CZ3-CB 4.07Å; C57-E88 CarbonylContact C-O 3.49Å; C57-E88 WeakPolarHBondContact CA-O 3.45Å; R58-E88 HydrophobicContact CG-CB 4.13Å; R58-E88 IonicContact CZ-OE2 3.92Å; R58-E88 PolarHBondContact N-O 3.41Å; R58-E88 IonicContact NE-OE2 3.78Å; R58-E88 PolarHBondContact NE-OE2 2.87Å; R58-E88 IonicContact NH2-OE1 3.75Å; R58-E88 IonicContact NH2-OE2 3.56Å; R58-E88 PolarHBondContact NH2-OE2 3.44Å; R58-E88 PolarHBondContact O-N 3.26Å
89	C	90.7	Very high	82.2	Confident	65 Å²	65	94 Å²	94	44%	0.439	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.3	-178.3	-61.1	0	0	0	0	110.3	R56 C57	R56-C89 WeakPolarHBondContact O-CA 3.45Å; C57-C89 HydrophobicContact CB-CB 4.09Å; C57-C89 WeakPolarHBondContact CB-SG 3.46Å; C57-C89 WeakPolarHBondContact SG-CB 3.48Å; C57-C89 CovalentContact SG-SG 2.04Å; C57-C89 PolarHBondContact SG-SG 2.91Å
90	M	90	Very high	81.5	Confident	40 Å²	40	96.4 Å²	96.4	20%	0.197	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	144.7	176.8	57	-169.4	66.4	0	0	110.5	T43 V55 R56	T43-M90 HydrophobicContact CG2-CE 3.71Å; T43-M90 HydrophobicContact CG2-SD 4Å; V55-M90 WeakPolarHBondContact CA-O 3.28Å; R56-M90 HydrophobicContact CG-CG 3.37Å; R56-M90 HydrophobicContact CG-SD 4.12Å; R56-M90 PolarHBondContact N-O 3.45Å; R56-M90 PolarHBondContact NE-SD 3.31Å; R56-M90 PolarHBondContact NH1-SD 3.43Å; R56-M90 PolarHBondContact NH2-SD 2.83Å; R56-M90 WeakPolarHBondContact O-CG 3.46Å; R56-M90 PolarHBondContact O-N 2.95Å
91	P	90	Very high	80.8	Confident	112 Å²	112	99 Å²	99	73%	0.727	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.1	178.5	27	-33.1	0	0	0	110.5
92	C	90	Very high	80.3	Confident	22 Å²	22	94.8 Å²	94.8	15%	0.149	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.4	168.6	45.8	0	0	0	0	109.5	C47 G54 V55 R56	C47-C92 WeakPolarHBondContact CA-SG 3.46Å; C47-C92 HydrophobicContact CB-CB 3.88Å; C47-C92 WeakPolarHBondContact CB-SG 3.44Å; C47-C92 WeakPolarHBondContact SG-CB 3.25Å; C47-C92 CovalentContact SG-SG 2.03Å; C47-C92 PolarHBondContact SG-SG 3.01Å; G54-C92 PolarHBondContact N-O 3.26Å; G54-C92 PolarHBondContact O-N 3.4Å; G54-C92 VanDerWaalsContact O-O 3.08Å; V55-C92 VanDerWaalsContact CA-SG 3.55Å; V55-C92 PolarHBondContact N-SG 2.95Å; V55-C92 VanDerWaalsContact N-SG 3.42Å; R56-C92 HydrophobicContact CG-CB 4.5Å
93	F	87.7	Confident	80.3	Confident	132 Å²	132	87.2 Å²	87.2	58%	0.579	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.4	177.1	-172.9	-116.5	0	0	0	109.3	G52 N53 N95	G52-F93 WeakPolarHBondContact O-CA 3.48Å; G52-F93 WeakPolarHBondContact O-CD2 3.31Å; N53-F93 WeakPolarHBondContact OD1-CD2 3.34Å; N53-F93 VanDerWaalsContact OD1-CE2 3.31Å; N53-F93 WeakPolarHBondContact OD1-CE2 3.41Å; F93-N95 WeakPolarHBondContact CD1-OD1 3.41Å; F93-N95 WeakPolarHBondContact CE1-OD1 3.41Å
94	V	87.8	Confident	80.6	Confident	35 Å²	35	84.3 Å²	84.3	21%	0.212	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	113.4	176.1	-176	0	0	0	0	108.5	C47 V49 T50 G52 T96	C47-V94 HydrophobicContact CB-CG2 3.58Å; V49-V94 HydrophobicContact CG2-CG2 4.38Å; V49-V94 WeakPolarHBondContact O-CG2 3.2Å; T50-V94 VanDerWaalsContact O-CG1 3.22Å; T50-V94 WeakPolarHBondContact O-CG1 3.44Å; G52-V94 PolarHBondContact N-O 3.47Å; G52-V94 PolarHBondContact O-N 3.41Å; V94-T96 PolarHBondContact O-N 3.42Å
95	N	81.8	Confident	80.6	Confident	147 Å²	147	83.8 Å²	83.8	79%	0.786	44%	0.435	S	S	*	.			trans	-69	27.3	-176.8	-94.6	0.2	0	0	0	114.8	F93	F93-N95 WeakPolarHBondContact CD1-OD1 3.41Å; F93-N95 WeakPolarHBondContact CE1-OD1 3.41Å
96	T	79.7	Confident	80.6	Confident	86 Å²	86	86 Å²	86	53%	0.528	45%	0.454	S	S	.	.	S	Bend	trans	-102.7	132.6	173.7	-44.9	0	0	0	0	108.1	C51 V94 C98	C51-T96 VanDerWaalsContact CB-O 3.31Å; C51-T96 WeakPolarHBondContact CB-O 3.43Å; V94-T96 PolarHBondContact O-N 3.42Å; T96-C98 PolarHBondContact O-N 3.01Å
97	R	73.5	Confident	80.7	Confident	232 Å²	232	87.5 Å²	87.5	88%	0.875	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-63.7	127.8	173.2	-69.8	-175	-167.8	-171.8	3.9	108.9
98	C	74.4	Confident	80.3	Confident	69 Å²	69	83 Å²	83	47%	0.466	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-65.1	135.4	172.9	-69.6	0	0	0	0	110.1	C51 T96 R100	C51-C98 HydrophobicContact CB-CB 3.94Å; C51-C98 WeakPolarHBondContact CB-SG 3.5Å; C51-C98 PolarHBondContact O-SG 3.49Å; C51-C98 WeakPolarHBondContact SG-CA 3.29Å; C51-C98 WeakPolarHBondContact SG-CB 3.26Å; C51-C98 CovalentContact SG-SG 2.04Å; C51-C98 PolarHBondContact SG-SG 3.42Å; T96-C98 PolarHBondContact O-N 3.01Å; C98-R100 PolarHBondContact O-N 3.09Å
99	P	66.5	Low	80	Confident	114 Å²	114	85.9 Å²	85.9	74%	0.74	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-60.4	126.1	175.8	24	-31.6	0	0	0	109.4	I101	P99-I101 PolarHBondContact O-N 3.24Å
100	R	62.3	Low	79.7	Confident	171 Å²	171	86.5 Å²	86.5	65%	0.645	46%	0.456	S	S	*	.			trans	-92.7	92.8	-179.9	-140.6	-169.8	-170.5	-179.1	1.8	108.3	C98 P140	C98-R100 PolarHBondContact O-N 3.09Å; R100-P140 HydrophobicContact CB-CG 4.44Å; R100-P140 VanDerWaalsContact CD-CB 3.45Å; R100-P140 VanDerWaalsContact CD-CG 3.42Å; R100-P140 HydrophobicContact CG-CB 4.09Å; R100-P140 HydrophobicContact CG-CG 3.43Å; R100-P140 VanDerWaalsContact CG-CG 3.43Å
101	I	63.2	Low	79.2	Confident	143 Å²	143	86.7 Å²	86.7	73%	0.733	46%	0.461	S	S	*	.			trans	-62.5	125.4	175.8	-58.2	168	0	0	0	107.6	P99 G103 P140	P99-I101 PolarHBondContact O-N 3.24Å; I101-G103 PolarHBondContact O-N 3.45Å; I101-P140 WeakPolarHBondContact O-CD 3.43Å
102	P	66.3	Low	78.7	Confident	16 Å²	16	86.1 Å²	86.1	10%	0.104	46%	0.459	C	S	.	.			trans	-65.6	128.3	177.4	25.9	-31.8	0	0	0	109.2	P142 F147 C149	P102-P142 HydrophobicContact CB-CB 3.96Å; P102-P142 HydrophobicContact CG-CB 4.49Å; P102-F147 HydrophobicContact CG-CB 3.6Å; P102-F147 WeakPolarHBondContact CG-O 3.24Å; P102-C149 PolarHBondContact O-SG 3.1Å
103	G	75.2	Confident	78.3	Confident	21 Å²	21	86.7 Å²	86.7	22%	0.216	46%	0.463	C	S	.	.			trans	-113.2	156.4	-177.7	0	0	0	0	0	111.3	I101 G105 N138 N139 C149	I101-G103 PolarHBondContact O-N 3.45Å; G103-G105 PolarHBondContact O-N 3.44Å; G103-N138 PolarHBondContact O-N 2.84Å; G103-N139 CarbonylContact C-O 3.54Å; G103-N139 WeakPolarHBondContact CA-O 3.29Å; G103-N139 PolarHBondContact N-O 3.15Å; G103-N139 CarbonylContact O-C 3.46Å; G103-N139 PolarHBondContact O-N 3.32Å; G103-C149 PolarHBondContact O-SG 2.88Å
104	W	81.6	Confident	77.9	Confident	60 Å²	60	85.6 Å²	85.6	23%	0.227	46%	0.463	C	S	.	.			trans	-62.3	127.9	171.2	-71	111.7	0	0	0	110	R135 C137 C149 S150 G151 N153	W104-R135 VanDerWaalsContact CD1-CZ 3.44Å; W104-R135 VanDerWaalsContact CD1-NH1 3.34Å; W104-R135 HydrophobicContact CD2-CG 4.11Å; W104-R135 VanDerWaalsContact CD2-CZ 3.49Å; W104-R135 VanDerWaalsContact CD2-NE 3.28Å; W104-R135 HydrophobicContact CE3-CB 4.38Å; W104-R135 HydrophobicContact CE3-CG 3.53Å; W104-R135 VanDerWaalsContact CG-CZ 3.41Å; W104-R135 HydrophobicContact CZ3-CG 3.98Å; W104-C137 HydrophobicContact CE3-CB 4.24Å; W104-C137 HydrophobicContact CZ3-CB 4.13Å; W104-C149 HydrophobicContact CD2-CB 3.68Å; W104-C149 HydrophobicContact CE3-CB 4.05Å; W104-C149 HydrophobicContact CG-CB 4.24Å; W104-C149 HydrophobicContact CH2-CB 3.85Å; W104-C149 HydrophobicContact CZ2-CB 3.45Å; W104-C149 VanDerWaalsContact CZ2-CB 3.45Å; W104-C149 WeakPolarHBondContact CZ2-O 3.48Å; W104-C149 HydrophobicContact CZ3-CB 4.14Å; W104-S150 PolarHBondContact NE1-O 3.03Å; W104-G151 VanDerWaalsContact CZ2-O 3.27Å; W104-G151 WeakPolarHBondContact CZ2-O 3.49Å; W104-N153 HydrophobicContact CH2-CB 3.67Å; W104-N153 HydrophobicContact CZ3-CB 3.67Å
105	G	81.2	Confident	77.3	Confident	9 Å²	9	86.1 Å²	86.1	9%	0.093	47%	0.467	C	S	.	.			trans	-64.3	175.3	162.8	0	0	0	0	0	112	G103 L136 N138	G103-G105 PolarHBondContact O-N 3.44Å; G105-L136 WeakPolarHBondContact CA-O 3.29Å; G105-L136 PolarHBondContact N-O 2.95Å; G105-N138 VanDerWaalsContact CA-OD1 3.28Å; G105-N138 WeakPolarHBondContact CA-OD1 3.42Å
106	T	83.9	Confident	76.7	Confident	127 Å²	127	83.7 Å²	83.7	78%	0.779	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-59	141.9	174.1	51	0	0	0	0	110.4
107	W	88.3	Confident	75.9	Confident	63 Å²	63	81.8 Å²	81.8	24%	0.239	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-58.4	141.6	167.1	-73.7	102.2	0	0	0	110.4	R133 Y134 R135 N153 Q155	W107-R133 HydrophobicContact CD2-CG 4.22Å; W107-R133 HydrophobicContact CE3-CB 4.32Å; W107-R133 HydrophobicContact CE3-CG 3.59Å; W107-R133 HydrophobicContact CZ3-CG 4.03Å; W107-Y134 VanDerWaalsContact CE3-C 3.41Å; W107-R135 HydrophobicContact CD2-CB 3.87Å; W107-R135 HydrophobicContact CD2-CG 3.98Å; W107-R135 VanDerWaalsContact CE2-CD 3.46Å; W107-R135 HydrophobicContact CE3-CB 3.68Å; W107-R135 HydrophobicContact CE3-CG 3.75Å; W107-R135 HydrophobicContact CG-CB 4.36Å; W107-R135 HydrophobicContact CH2-CG 3.66Å; W107-R135 HydrophobicContact CZ2-CG 3.92Å; W107-R135 HydrophobicContact CZ3-CB 4.03Å; W107-R135 HydrophobicContact CZ3-CG 3.58Å; W107-N153 WeakPolarHBondContact CZ3-O 3.37Å; W107-Q155 HydrophobicContact CH2-CB 4.1Å; W107-Q155 HydrophobicContact CH2-CG 3.54Å; W107-Q155 VanDerWaalsContact CZ2-CD 3.45Å; W107-Q155 HydrophobicContact CZ2-CG 4Å; W107-Q155 HydrophobicContact CZ3-CB 4.2Å; W107-Q155 HydrophobicContact CZ3-CG 4.15Å
108	S	83.2	Confident	75.1	Confident	30 Å²	30	75.2 Å²	75.2	21%	0.21	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-58	161	164.1	76.4	0	0	0	0	109.7	Y134	S108-Y134 WeakPolarHBondContact CB-O 3.36Å; S108-Y134 PolarHBondContact N-O 3.06Å; S108-Y134 WeakPolarHBondContact OG-CD1 3.42Å; S108-Y134 PolarHBondContact OG-N 3.4Å; S108-Y134 PolarHBondContact OG-O 3.03Å
109	S	81.9	Confident	74.1	Confident	110 Å²	110	79.3 Å²	79.3	77%	0.769	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-54.5	147.2	161.7	-56	0	0	0	0	109.9
110	W	84.6	Confident	73.3	Confident	78 Å²	78	83.4 Å²	83.4	30%	0.295	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-61.2	139.9	168.8	-71.6	103.7	0	0	0	109.7	R131 T132 R133 Q155 T157	W110-R131 HydrophobicContact CD2-CG 4.29Å; W110-R131 HydrophobicContact CE3-CB 4.4Å; W110-R131 HydrophobicContact CE3-CG 3.77Å; W110-R131 HydrophobicContact CZ3-CG 4.32Å; W110-R131 WeakPolarHBondContact CZ3-O 3.48Å; W110-T132 CarbonylContact C-O 3.51Å; W110-T132 WeakPolarHBondContact CA-O 3.25Å; W110-R133 HydrophobicContact CD2-CB 3.96Å; W110-R133 HydrophobicContact CD2-CG 3.92Å; W110-R133 VanDerWaalsContact CE2-CD 3.43Å; W110-R133 HydrophobicContact CE3-CB 3.72Å; W110-R133 HydrophobicContact CE3-CG 3.68Å; W110-R133 HydrophobicContact CG-CB 4.46Å; W110-R133 HydrophobicContact CH2-CG 3.7Å; W110-R133 VanDerWaalsContact CZ2-CD 3.45Å; W110-R133 HydrophobicContact CZ2-CG 3.94Å; W110-R133 VanDerWaalsContact CZ2-CZ 3.5Å; W110-R133 HydrophobicContact CZ3-CB 4.08Å; W110-R133 HydrophobicContact CZ3-CG 3.57Å; W110-Q155 HydrophobicContact CH2-CB 4.18Å; W110-Q155 WeakPolarHBondContact CZ3-O 3.31Å; W110-T157 HydrophobicContact CE3-CG2 4.06Å; W110-T157 HydrophobicContact CH2-CG2 3.48Å; W110-T157 VanDerWaalsContact CH2-CG2 3.48Å; W110-T157 HydrophobicContact CZ2-CG2 3.96Å; W110-T157 HydrophobicContact CZ3-CG2 3.53Å
111	S	81	Confident	72.7	Confident	44 Å²	44	77.2 Å²	77.2	31%	0.308	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-60	165.8	169.4	75.2	0	0	0	0	110.8	R131 T132	S111-R131 WeakPolarHBondContact OG-CA 3.25Å; S111-T132 WeakPolarHBondContact CB-O 3.3Å; S111-T132 PolarHBondContact N-O 3.05Å; S111-T132 PolarHBondContact OG-N 3.37Å; S111-T132 PolarHBondContact OG-O 3.16Å; S111-T132 PolarHBondContact OG-OG1 3.48Å
112	S	78.2	Confident	72	Confident	99 Å²	99	77.7 Å²	77.7	69%	0.692	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-54.2	144.1	162.7	-55.6	0	0	0	0	110	L114	S112-L114 PolarHBondContact O-N 2.91Å
113	C	82.2	Confident	71.4	Confident	34 Å²	34	78.9 Å²	78.9	23%	0.23	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-67.8	127	172.2	-166.4	0	0	0	0	108.2	C159 Y161	C113-C159 VanDerWaalsContact CA-SG 3.53Å; C113-C159 HydrophobicContact CB-CB 4.06Å; C113-C159 WeakPolarHBondContact CB-SG 3.29Å; C113-C159 VanDerWaalsContact SG-C 3.57Å; C113-C159 WeakPolarHBondContact SG-CB 3.44Å; C113-C159 CovalentContact SG-SG 2.03Å; C113-C159 PolarHBondContact SG-SG 3.47Å; C113-Y161 HydrophobicContact CB-CD2 4.44Å; C113-Y161 WeakPolarHBondContact O-CD2 3.44Å; C113-Y161 VanDerWaalsContact O-CE2 3.24Å; C113-Y161 WeakPolarHBondContact O-CE2 3.38Å
114	L	79.9	Confident	70.1	Confident	109 Å²	109	86 Å²	86	57%	0.571	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	146.6	178.3	-68	168.6	0	0	0	109.4	S112 T116 G129 S130	S112-L114 PolarHBondContact O-N 2.91Å; L114-T116 PolarHBondContact O-N 3.08Å; L114-G129 CarbonylContact O-C 3.33Å; L114-G129 WeakPolarHBondContact O-CA 3.45Å; L114-S130 PolarHBondContact N-O 3.24Å; L114-S130 PolarHBondContact O-N 2.82Å
115	P	73.6	Confident	68.9	Low	46 Å²	46	85.1 Å²	85.1	30%	0.299	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.3	-179.9	23.5	-21.9	0	0	0	110.4	G117 I121 Y161	P115-G117 PolarHBondContact O-N 3.32Å; P115-I121 HydrophobicContact CB-CD1 3.81Å; P115-Y161 HydrophobicContact CB-CD1 3.51Å; P115-Y161 HydrophobicContact CB-CD2 4.37Å; P115-Y161 HydrophobicContact CB-CE1 3.58Å; P115-Y161 HydrophobicContact CB-CE2 4.43Å; P115-Y161 HydrophobicContact CB-CG 3.93Å; P115-Y161 VanDerWaalsContact CD-CZ 3.45Å; P115-Y161 HydrophobicContact CG-CD1 4.09Å; P115-Y161 HydrophobicContact CG-CD2 4.5Å; P115-Y161 HydrophobicContact CG-CE1 3.65Å; P115-Y161 HydrophobicContact CG-CE2 4.1Å; P115-Y161 HydrophobicContact CG-CG 4.48Å
116	T	69.7	Low	68.1	Low	96 Å²	96	88.8 Å²	88.8	59%	0.589	54%	0.537	S	S	*	.	S	Bend	trans	-89.7	96.7	171.3	-51.7	0	0	0	0	108	L114 T128	L114-T116 PolarHBondContact O-N 3.08Å; T116-T128 PolarHBondContact N-O 2.81Å
117	G	64.2	Low	67.4	Low	46 Å²	46	85.3 Å²	85.3	47%	0.474	51%	0.512	S	S	.	.	S	Bend	trans	125.7	113.4	-177.1	0	0	0	0	0	110.1	P115 Q119	P115-G117 PolarHBondContact O-N 3.32Å; G117-Q119 PolarHBondContact O-N 2.88Å
118	G	56.2	Low	66.9	Low	94 Å²	94	86.1 Å²	86.1	97%	0.969	52%	0.524	S	S	*	.			trans	-67.9	31.5	-172.1	0	0	0	0	0	116.1
119	Q	52.8	Low	66.9	Low	155 Å²	155	84.7 Å²	84.7	72%	0.724	51%	0.514	S	S	*	.			trans	-76.3	133.2	173.8	-66.7	-177.8	-18	0	0	109.4	G117 I121	G117-Q119 PolarHBondContact O-N 2.88Å; Q119-I121 WeakPolarHBondContact O-CG1 3.36Å; Q119-I121 PolarHBondContact O-N 3.32Å
120	K	49.2	Very low	67	Low	200 Å²	200	81 Å²	81	87%	0.87	49%	0.488	S	S	*	.			trans	-64.2	103.5	165.4	-80.1	-178.7	174	179.6	0	107.4	N122	K120-N122 PolarHBondContact O-N 2.77Å
121	I	49.7	Very low	67.1	Low	42 Å²	42	81.5 Å²	81.5	22%	0.215	49%	0.49	C	S	.	.			trans	-81.4	115.2	-177.8	-61.5	165.8	0	0	0	108	P115 Q119 G123 H127 Y161	P115-I121 HydrophobicContact CB-CD1 3.81Å; Q119-I121 WeakPolarHBondContact O-CG1 3.36Å; Q119-I121 PolarHBondContact O-N 3.32Å; I121-G123 PolarHBondContact O-N 3.44Å; I121-H127 HydrophobicContact CD1-CB 4.27Å; I121-H127 WeakPolarHBondContact CG2-CE1 3.26Å; I121-Y161 HydrophobicContact CD1-CD1 3.68Å; I121-Y161 HydrophobicContact CD1-CE1 3.59Å
122	N	49.2	Very low	67.3	Low	152 Å²	152	81.7 Å²	81.7	81%	0.813	49%	0.49	S	S	*	.			trans	-72.4	37.4	178.2	-70.5	-16.8	0	0	0	113.2	K120 Q124	K120-N122 PolarHBondContact O-N 2.77Å; N122-Q124 PolarHBondContact O-N 2.83Å
123	G	53.6	Low	67.9	Low	41 Å²	41	79.9 Å²	79.9	42%	0.423	47%	0.468	S	S	.	.	S	Bend	trans	68.7	2	172.6	0	0	0	0	0	117	I121	I121-G123 PolarHBondContact O-N 3.44Å
124	Q	48.8	Very low	68.3	Low	171 Å²	171	85 Å²	85	80%	0.799	48%	0.483	S	S	*	.			trans	-126.7	122.7	-175.5	-77.2	174.5	-32.3	0	0	111.2	N122	N122-Q124 PolarHBondContact O-N 2.83Å
125	G	54.8	Low	68.7	Low	41 Å²	41	82.1 Å²	82.1	42%	0.423	47%	0.465	S	S	.	.	S	Bend	trans	112.5	149.1	174.2	0	0	0	0	0	114.4	H127 N162	G125-H127 PolarHBondContact O-CE1 3.49Å; G125-H127 PolarHBondContact O-ND1 3.3Å; G125-N162 CarbonylContact O-C 3.57Å
126	C	65.3	Low	69.1	Low	87 Å²	87	84.8 Å²	84.8	59%	0.588	48%	0.476	S	S	*	.			trans	-80.4	126.4	176.2	-174.9	0	0	0	0	110.2	C163	C126-C163 WeakPolarHBondContact CA-SG 3.22Å; C126-C163 HydrophobicContact CB-CB 3.69Å; C126-C163 WeakPolarHBondContact CB-SG 3.44Å; C126-C163 WeakPolarHBondContact SG-CB 3.5Å; C126-C163 CovalentContact SG-SG 2.03Å; C126-C163 PolarHBondContact SG-SG 3.31Å
127	H	70	Confident	69.5	Low	53 Å²	53	82 Å²	82	25%	0.245	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.6	-179.2	-54	74.6	0	0	0	109.9	I121 G125 G129 Y161	I121-H127 HydrophobicContact CD1-CB 4.27Å; I121-H127 WeakPolarHBondContact CG2-CE1 3.26Å; G125-H127 PolarHBondContact O-CE1 3.49Å; G125-H127 PolarHBondContact O-ND1 3.3Å; H127-G129 PolarHBondContact O-N 3.26Å; H127-Y161 WeakPolarHBondContact CA-O 3.33Å; H127-Y161 WeakPolarHBondContact CB-O 3.41Å; H127-Y161 PolarHBondContact N-O 3.35Å; H127-Y161 WeakPolarHBondContact O-CA 3.44Å; H127-Y161 PolarHBondContact O-N 3.35Å; H127-Y161 VanDerWaalsContact O-O 3.1Å
128	T	76.6	Confident	70.2	Confident	81 Å²	81	83.6 Å²	83.6	50%	0.497	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	123	169.9	-41.2	0	0	0	0	109.3	T116 E158	T116-T128 PolarHBondContact N-O 2.81Å; T128-E158 HydrophobicContact CG2-CB 4.35Å; T128-E158 HydrophobicContact CG2-CG 4.33Å
129	G	83.7	Confident	71	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	179.2	168.9	0	0	0	0	0	113.2	L114 H127 E158 C159	L114-G129 CarbonylContact O-C 3.33Å; L114-G129 WeakPolarHBondContact O-CA 3.45Å; H127-G129 PolarHBondContact O-N 3.26Å; G129-E158 WeakPolarHBondContact O-CA 3.46Å; G129-C159 CarbonylContact C-O 3.33Å; G129-C159 VanDerWaalsContact C-SG 3.55Å; G129-C159 WeakPolarHBondContact CA-O 3.44Å; G129-C159 PolarHBondContact N-O 2.93Å; G129-C159 PolarHBondContact O-N 3.15Å; G129-C159 VanDerWaalsContact O-O 3.06Å
130	S	82.8	Confident	71.5	Confident	33 Å²	33	77.8 Å²	77.8	23%	0.231	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	135.9	179.6	-177.1	0	0	0	0	109.6	L114 T156 C159	L114-S130 PolarHBondContact N-O 3.24Å; L114-S130 PolarHBondContact O-N 2.82Å; S130-T156 WeakPolarHBondContact OG-CG2 3.47Å; S130-C159 PolarHBondContact N-SG 3.37Å
131	R	86.9	Confident	72.3	Confident	87 Å²	87	72.2 Å²	72.2	33%	0.328	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.9	173	62.6	-176.6	178.2	169.5	-2.3	109.7	W110 S111 T156 T157 C159	W110-R131 HydrophobicContact CD2-CG 4.29Å; W110-R131 HydrophobicContact CE3-CB 4.4Å; W110-R131 HydrophobicContact CE3-CG 3.77Å; W110-R131 HydrophobicContact CZ3-CG 4.32Å; W110-R131 WeakPolarHBondContact CZ3-O 3.48Å; S111-R131 WeakPolarHBondContact OG-CA 3.25Å; R131-T156 WeakPolarHBondContact O-CA 3.47Å; R131-T157 HydrophobicContact CG-CG2 3.59Å; R131-T157 PolarHBondContact N-O 3.48Å; R131-T157 PolarHBondContact O-N 2.77Å; R131-C159 HydrophobicContact CG-CB 4.06Å; R131-C159 PolarHBondContact N-SG 3.13Å
132	T	85.5	Confident	72.9	Confident	49 Å²	49	73.4 Å²	73.4	30%	0.301	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	151.6	-174.7	57.1	0	0	0	0	111.2	W110 S111 H154 Q155 T156	W110-T132 CarbonylContact C-O 3.51Å; W110-T132 WeakPolarHBondContact CA-O 3.25Å; S111-T132 WeakPolarHBondContact CB-O 3.3Å; S111-T132 PolarHBondContact N-O 3.05Å; S111-T132 PolarHBondContact OG-N 3.37Å; S111-T132 PolarHBondContact OG-O 3.16Å; S111-T132 PolarHBondContact OG-OG1 3.48Å; T132-H154 WeakPolarHBondContact CB-NE2 3.43Å; T132-Q155 CarbonylContact C-O 3.53Å; T132-Q155 VanDerWaalsContact CA-O 3.24Å; T132-Q155 WeakPolarHBondContact CA-O 3.37Å; T132-T156 HydrophobicContact CG2-CG2 3.98Å
133	R	90.9	Very high	73.4	Confident	61 Å²	61	72.7 Å²	72.7	23%	0.23	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.4	168.3	66	175.5	-179.1	-176.2	-1.4	109.5	W107 W110 Q155	W107-R133 HydrophobicContact CD2-CG 4.22Å; W107-R133 HydrophobicContact CE3-CB 4.32Å; W107-R133 HydrophobicContact CE3-CG 3.59Å; W107-R133 HydrophobicContact CZ3-CG 4.03Å; W110-R133 HydrophobicContact CD2-CB 3.96Å; W110-R133 HydrophobicContact CD2-CG 3.92Å; W110-R133 VanDerWaalsContact CE2-CD 3.43Å; W110-R133 HydrophobicContact CE3-CB 3.72Å; W110-R133 HydrophobicContact CE3-CG 3.68Å; W110-R133 HydrophobicContact CG-CB 4.46Å; W110-R133 HydrophobicContact CH2-CG 3.7Å; W110-R133 VanDerWaalsContact CZ2-CD 3.45Å; W110-R133 HydrophobicContact CZ2-CG 3.94Å; W110-R133 VanDerWaalsContact CZ2-CZ 3.5Å; W110-R133 HydrophobicContact CZ3-CB 4.08Å; W110-R133 HydrophobicContact CZ3-CG 3.57Å; R133-Q155 HydrophobicContact CG-CB 4.1Å; R133-Q155 PolarHBondContact N-O 3.39Å; R133-Q155 PolarHBondContact O-N 3.39Å
134	Y	90	Very high	73.7	Confident	142 Å²	142	76.8 Å²	76.8	56%	0.557	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	160.6	178.9	64.1	-88.8	0	0	0	111	W107 S108 N153	W107-Y134 VanDerWaalsContact CE3-C 3.41Å; S108-Y134 WeakPolarHBondContact CB-O 3.36Å; S108-Y134 PolarHBondContact N-O 3.06Å; S108-Y134 WeakPolarHBondContact OG-CD1 3.42Å; S108-Y134 PolarHBondContact OG-N 3.4Å; S108-Y134 PolarHBondContact OG-O 3.03Å; Y134-N153 CarbonylContact C-O 3.58Å; Y134-N153 WeakPolarHBondContact CA-O 3.28Å
135	R	88.7	Confident	74.1	Confident	48 Å²	48	78 Å²	78	18%	0.181	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-136.4	146.8	172.7	57.2	176.2	176.3	177.8	3.1	109.8	W104 W107 I152 N153	W104-R135 VanDerWaalsContact CD1-CZ 3.44Å; W104-R135 VanDerWaalsContact CD1-NH1 3.34Å; W104-R135 HydrophobicContact CD2-CG 4.11Å; W104-R135 VanDerWaalsContact CD2-CZ 3.49Å; W104-R135 VanDerWaalsContact CD2-NE 3.28Å; W104-R135 HydrophobicContact CE3-CB 4.38Å; W104-R135 HydrophobicContact CE3-CG 3.53Å; W104-R135 VanDerWaalsContact CG-CZ 3.41Å; W104-R135 HydrophobicContact CZ3-CG 3.98Å; W107-R135 HydrophobicContact CD2-CB 3.87Å; W107-R135 HydrophobicContact CD2-CG 3.98Å; W107-R135 VanDerWaalsContact CE2-CD 3.46Å; W107-R135 HydrophobicContact CE3-CB 3.68Å; W107-R135 HydrophobicContact CE3-CG 3.75Å; W107-R135 HydrophobicContact CG-CB 4.36Å; W107-R135 HydrophobicContact CH2-CG 3.66Å; W107-R135 HydrophobicContact CZ2-CG 3.92Å; W107-R135 HydrophobicContact CZ3-CB 4.03Å; W107-R135 HydrophobicContact CZ3-CG 3.58Å; R135-I152 VanDerWaalsContact CZ-O 3.22Å; R135-I152 PolarHBondContact NE-O 2.82Å; R135-I152 PolarHBondContact NH2-O 3.45Å; R135-N153 PolarHBondContact N-O 3.32Å
136	L	82.6	Confident	74.1	Confident	102 Å²	102	79.4 Å²	79.4	53%	0.534	43%	0.428	S	S	.	.			trans	-97.9	144.7	178	-63.6	169.7	0	0	0	109.5	G105 N138	G105-L136 WeakPolarHBondContact CA-O 3.29Å; G105-L136 PolarHBondContact N-O 2.95Å; L136-N138 HydrophobicContact CB-CB 4.29Å; L136-N138 PolarHBondContact O-N 2.88Å; L136-N138 PolarHBondContact O-OD1 3.34Å
137	C	78.3	Confident	73.9	Confident	36 Å²	36	82.8 Å²	82.8	24%	0.243	43%	0.433	C	S	.	.	S	Bend	trans	-82	73.8	171.9	-177.2	0	0	0	0	108.3	W104 P142 C149	W104-C137 HydrophobicContact CE3-CB 4.24Å; W104-C137 HydrophobicContact CZ3-CB 4.13Å; C137-P142 WeakPolarHBondContact O-CD 3.43Å; C137-C149 VanDerWaalsContact CA-SG 3.57Å; C137-C149 HydrophobicContact CB-CB 3.76Å; C137-C149 WeakPolarHBondContact CB-SG 3.35Å; C137-C149 WeakPolarHBondContact SG-CB 3.42Å; C137-C149 PolarHBondContact SG-N 2.89Å; C137-C149 VanDerWaalsContact SG-N 3.36Å; C137-C149 CovalentContact SG-SG 2.03Å; C137-C149 PolarHBondContact SG-SG 3.38Å
138	N	77.9	Confident	73.9	Confident	81 Å²	81	86.4 Å²	86.4	43%	0.433	46%	0.459	S	S	.	.			trans	-135.9	11.6	-171.7	71.6	-23.1	0	0	0	114.5	G103 G105 L136 P140 P141	G103-N138 PolarHBondContact O-N 2.84Å; G105-N138 VanDerWaalsContact CA-OD1 3.28Å; G105-N138 WeakPolarHBondContact CA-OD1 3.42Å; L136-N138 HydrophobicContact CB-CB 4.29Å; L136-N138 PolarHBondContact O-N 2.88Å; L136-N138 PolarHBondContact O-OD1 3.34Å; N138-P140 CarbonylContact C-O 3.58Å; N138-P140 CarbonylContact O-C 3.46Å; N138-P141 WeakPolarHBondContact O-CD 3.4Å
139	N	74.3	Confident	73.9	Confident	105 Å²	105	83.3 Å²	83.3	56%	0.561	44%	0.441	S	S	*	.	S	Bend	trans	-130.2	90	179.6	-172.6	29.9	0	0	0	112.3	G103	G103-N139 CarbonylContact C-O 3.54Å; G103-N139 WeakPolarHBondContact CA-O 3.29Å; G103-N139 PolarHBondContact N-O 3.15Å; G103-N139 CarbonylContact O-C 3.46Å; G103-N139 PolarHBondContact O-N 3.32Å
140	P	62.5	Low	73.6	Confident	22 Å²	22	89 Å²	89	14%	0.143	48%	0.481	C	S	.	.	S	Bend	cis	-79.8	160.6	-2.7	26.2	-24.6	0	0	0	112.8	R100 I101 N138	R100-P140 HydrophobicContact CB-CG 4.44Å; R100-P140 VanDerWaalsContact CD-CB 3.45Å; R100-P140 VanDerWaalsContact CD-CG 3.42Å; R100-P140 HydrophobicContact CG-CB 4.09Å; R100-P140 HydrophobicContact CG-CG 3.43Å; R100-P140 VanDerWaalsContact CG-CG 3.43Å; I101-P140 WeakPolarHBondContact O-CD 3.43Å; N138-P140 CarbonylContact C-O 3.58Å; N138-P140 CarbonylContact O-C 3.46Å
141	P	66.8	Low	73.5	Confident	83 Å²	83	90 Å²	90	54%	0.539	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-59.6	137.9	-179.3	22.5	-31.8	0	0	0	110.9	N138 E143	N138-P141 WeakPolarHBondContact O-CD 3.4Å; P141-E143 PolarHBondContact O-N 3.14Å
142	P	60.9	Low	73.4	Confident	66 Å²	66	91.2 Å²	91.2	43%	0.429	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-64.9	134.6	179.3	23.8	-31.5	0	0	0	110.3	P102 C137	P102-P142 HydrophobicContact CB-CB 3.96Å; P102-P142 HydrophobicContact CG-CB 4.49Å; C137-P142 WeakPolarHBondContact O-CD 3.43Å
143	E	60	Low	73.4	Confident	138 Å²	138	93.5 Å²	93.5	65%	0.645	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-66.5	154.4	165.3	-78.4	-179.6	-178.8	0	0	109.7	P141 Y145	P141-E143 PolarHBondContact O-N 3.14Å; E143-Y145 PolarHBondContact O-N 3.45Å
144	P	61.2	Low	73.3	Confident	126 Å²	126	94.6 Å²	94.6	82%	0.818	53%	0.526	S	S	*	.	S	Bend	trans	-55.7	-19.4	-169.8	17.3	-31	0	0	0	115	G146	P144-G146 PolarHBondContact O-N 3.26Å; P144-G146 VanDerWaalsContact O-N 3.11Å
145	Y	56.4	Low	73.2	Confident	198 Å²	198	91 Å²	91	78%	0.776	51%	0.514	S	S	*	.	S	Bend	trans	-85.1	73.9	174.8	-64.1	-78.4	0	0	0	111.9	E143 F147	E143-Y145 PolarHBondContact O-N 3.45Å; Y145-F147 VanDerWaalsContact C-N 3.35Å; Y145-F147 WeakPolarHBondContact O-CD2 3.44Å; Y145-F147 PolarHBondContact O-N 3.3Å
146	G	55.3	Low	73.1	Confident	69 Å²	69	92.5 Å²	92.5	71%	0.711	53%	0.529	S	S	*	.			trans	62.9	4.2	135.1	0	0	0	0	0	121.9	P144 T148	P144-G146 PolarHBondContact O-N 3.26Å; P144-G146 VanDerWaalsContact O-N 3.11Å; G146-T148 PolarHBondContact O-N 3.3Å
147	F	60.4	Low	73.2	Confident	158 Å²	158	90.2 Å²	90.2	69%	0.693	52%	0.519	S	S	*	.			trans	-80.1	113.5	175.6	-67.6	-74.1	0	0	0	111.3	P102 Y145	P102-F147 HydrophobicContact CG-CB 3.6Å; P102-F147 WeakPolarHBondContact CG-O 3.24Å; Y145-F147 VanDerWaalsContact C-N 3.35Å; Y145-F147 WeakPolarHBondContact O-CD2 3.44Å; Y145-F147 PolarHBondContact O-N 3.3Å
148	T	70.4	Confident	73.3	Confident	130 Å²	130	95.9 Å²	95.9	80%	0.798	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-84.4	139	171.6	39.4	0	0	0	0	110.9	G146 S150	G146-T148 PolarHBondContact O-N 3.3Å; T148-S150 PolarHBondContact O-N 3.48Å
149	C	77.2	Confident	73.4	Confident	16 Å²	16	92.9 Å²	92.9	11%	0.108	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-61.6	128.8	170.1	-69.3	0	0	0	0	109.6	P102 G103 W104 C137	P102-C149 PolarHBondContact O-SG 3.1Å; G103-C149 PolarHBondContact O-SG 2.88Å; W104-C149 HydrophobicContact CD2-CB 3.68Å; W104-C149 HydrophobicContact CE3-CB 4.05Å; W104-C149 HydrophobicContact CG-CB 4.24Å; W104-C149 HydrophobicContact CH2-CB 3.85Å; W104-C149 HydrophobicContact CZ2-CB 3.45Å; W104-C149 VanDerWaalsContact CZ2-CB 3.45Å; W104-C149 WeakPolarHBondContact CZ2-O 3.48Å; W104-C149 HydrophobicContact CZ3-CB 4.14Å; C137-C149 VanDerWaalsContact CA-SG 3.57Å; C137-C149 HydrophobicContact CB-CB 3.76Å; C137-C149 WeakPolarHBondContact CB-SG 3.35Å; C137-C149 WeakPolarHBondContact SG-CB 3.42Å; C137-C149 PolarHBondContact SG-N 2.89Å; C137-C149 VanDerWaalsContact SG-N 3.36Å; C137-C149 CovalentContact SG-SG 2.03Å; C137-C149 PolarHBondContact SG-SG 3.38Å
150	S	77.1	Confident	73.4	Confident	120 Å²	120	93.6 Å²	93.6	84%	0.839	53%	0.531	S	S	*	.	S	Bend	trans	-78.9	132.9	177.4	-157.1	0	0	0	0	110.9	W104 T148	W104-S150 PolarHBondContact NE1-O 3.03Å; T148-S150 PolarHBondContact O-N 3.48Å
151	G	80.6	Confident	73.6	Confident	54 Å²	54	95.9 Å²	95.9	56%	0.557	54%	0.537	S	S	*	.	S	Bend	trans	115.8	-177.7	-178.3	0	0	0	0	0	114.4	W104	W104-G151 VanDerWaalsContact CZ2-O 3.27Å; W104-G151 WeakPolarHBondContact CZ2-O 3.49Å
152	I	83.6	Confident	73.4	Confident	111 Å²	111	95.1 Å²	95.1	57%	0.569	53%	0.529	S	S	*	.			trans	-85	133.9	-171.5	-47.6	173.4	0	0	0	110.5	R135 H154	R135-I152 VanDerWaalsContact CZ-O 3.22Å; R135-I152 PolarHBondContact NE-O 2.82Å; R135-I152 PolarHBondContact NH2-O 3.45Å; I152-H154 WeakPolarHBondContact CG2-O 3.32Å
153	N	86	Confident	73.3	Confident	97 Å²	97	93.2 Å²	93.2	52%	0.519	52%	0.517	S	S	.	.	S	Bend	trans	-91.3	-12.6	176.4	63.9	-11.3	0	0	0	113.9	W104 W107 Y134 R135	W104-N153 HydrophobicContact CH2-CB 3.67Å; W104-N153 HydrophobicContact CZ3-CB 3.67Å; W107-N153 WeakPolarHBondContact CZ3-O 3.37Å; Y134-N153 CarbonylContact C-O 3.58Å; Y134-N153 WeakPolarHBondContact CA-O 3.28Å; R135-N153 PolarHBondContact N-O 3.32Å
154	H	88.8	Confident	72.8	Confident	85 Å²	85	91.2 Å²	91.2	39%	0.394	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.8	-176.5	176.2	-93	0	0	0	110.7	T132 I152 T156	T132-H154 WeakPolarHBondContact CB-NE2 3.43Å; I152-H154 WeakPolarHBondContact CG2-O 3.32Å; H154-T156 PolarHBondContact CE1-OG1 3.27Å
155	Q	89	Confident	72.1	Confident	65 Å²	65	89.5 Å²	89.5	30%	0.304	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.8	176	-80.8	179.4	-10.3	0	0	110.4	W107 W110 T132 R133	W107-Q155 HydrophobicContact CH2-CB 4.1Å; W107-Q155 HydrophobicContact CH2-CG 3.54Å; W107-Q155 VanDerWaalsContact CZ2-CD 3.45Å; W107-Q155 HydrophobicContact CZ2-CG 4Å; W107-Q155 HydrophobicContact CZ3-CB 4.2Å; W107-Q155 HydrophobicContact CZ3-CG 4.15Å; W110-Q155 HydrophobicContact CH2-CB 4.18Å; W110-Q155 WeakPolarHBondContact CZ3-O 3.31Å; T132-Q155 CarbonylContact C-O 3.53Å; T132-Q155 VanDerWaalsContact CA-O 3.24Å; T132-Q155 WeakPolarHBondContact CA-O 3.37Å; R133-Q155 HydrophobicContact CG-CB 4.1Å; R133-Q155 PolarHBondContact N-O 3.39Å; R133-Q155 PolarHBondContact O-N 3.39Å
156	T	85.6	Confident	71.5	Confident	81 Å²	81	88.3 Å²	88.3	50%	0.497	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.4	171.9	-52.1	0	0	0	0	108.1	S130 R131 T132 H154	S130-T156 WeakPolarHBondContact OG-CG2 3.47Å; R131-T156 WeakPolarHBondContact O-CA 3.47Å; T132-T156 HydrophobicContact CG2-CG2 3.98Å; H154-T156 PolarHBondContact CE1-OG1 3.27Å
157	T	84.7	Confident	71.1	Confident	54 Å²	54	88.5 Å²	88.5	33%	0.331	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	144.8	173.4	-165.9	0	0	0	0	109.5	W110 R131	W110-T157 HydrophobicContact CE3-CG2 4.06Å; W110-T157 HydrophobicContact CH2-CG2 3.48Å; W110-T157 VanDerWaalsContact CH2-CG2 3.48Å; W110-T157 HydrophobicContact CZ2-CG2 3.96Å; W110-T157 HydrophobicContact CZ3-CG2 3.53Å; R131-T157 HydrophobicContact CG-CG2 3.59Å; R131-T157 PolarHBondContact N-O 3.48Å; R131-T157 PolarHBondContact O-N 2.77Å
158	E	81.5	Confident	70.7	Confident	155 Å²	155	83.6 Å²	83.6	72%	0.724	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.2	170.8	-67.6	177.1	-176.9	0	0	109.8	T128 G129	T128-E158 HydrophobicContact CG2-CB 4.35Å; T128-E158 HydrophobicContact CG2-CG 4.33Å; G129-E158 WeakPolarHBondContact O-CA 3.46Å
159	C	78.2	Confident	70.1	Confident	17 Å²	17	81.8 Å²	81.8	12%	0.115	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	158.1	176.5	52.5	0	0	0	0	109	C113 G129 S130 R131 Y161	C113-C159 VanDerWaalsContact CA-SG 3.53Å; C113-C159 HydrophobicContact CB-CB 4.06Å; C113-C159 WeakPolarHBondContact CB-SG 3.29Å; C113-C159 VanDerWaalsContact SG-C 3.57Å; C113-C159 WeakPolarHBondContact SG-CB 3.44Å; C113-C159 CovalentContact SG-SG 2.03Å; C113-C159 PolarHBondContact SG-SG 3.47Å; G129-C159 CarbonylContact C-O 3.33Å; G129-C159 VanDerWaalsContact C-SG 3.55Å; G129-C159 WeakPolarHBondContact CA-O 3.44Å; G129-C159 PolarHBondContact N-O 2.93Å; G129-C159 PolarHBondContact O-N 3.15Å; G129-C159 VanDerWaalsContact O-O 3.06Å; S130-C159 PolarHBondContact N-SG 3.37Å; R131-C159 HydrophobicContact CG-CB 4.06Å; R131-C159 PolarHBondContact N-SG 3.13Å; C159-Y161 PolarHBondContact O-N 3.18Å
160	D	74.4	Confident	69.8	Low	121 Å²	121	83.8 Å²	83.8	65%	0.647	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	116.1	175.6	-74.5	-21.5	0	0	0	109.9	C163	D160-C163 HydrophobicContact CB-CB 4.12Å; D160-C163 WeakPolarHBondContact CB-SG 3.3Å
161	Y	68	Low	69.6	Low	69 Å²	69	80 Å²	80	27%	0.271	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.6	177.1	-175.5	-93.4	0	0	0	110.8	C113 P115 I121 H127 C159 C163	C113-Y161 HydrophobicContact CB-CD2 4.44Å; C113-Y161 WeakPolarHBondContact O-CD2 3.44Å; C113-Y161 VanDerWaalsContact O-CE2 3.24Å; C113-Y161 WeakPolarHBondContact O-CE2 3.38Å; P115-Y161 HydrophobicContact CB-CD1 3.51Å; P115-Y161 HydrophobicContact CB-CD2 4.37Å; P115-Y161 HydrophobicContact CB-CE1 3.58Å; P115-Y161 HydrophobicContact CB-CE2 4.43Å; P115-Y161 HydrophobicContact CB-CG 3.93Å; P115-Y161 VanDerWaalsContact CD-CZ 3.45Å; P115-Y161 HydrophobicContact CG-CD1 4.09Å; P115-Y161 HydrophobicContact CG-CD2 4.5Å; P115-Y161 HydrophobicContact CG-CE1 3.65Å; P115-Y161 HydrophobicContact CG-CE2 4.1Å; P115-Y161 HydrophobicContact CG-CG 4.48Å; I121-Y161 HydrophobicContact CD1-CD1 3.68Å; I121-Y161 HydrophobicContact CD1-CE1 3.59Å; H127-Y161 WeakPolarHBondContact CA-O 3.33Å; H127-Y161 WeakPolarHBondContact CB-O 3.41Å; H127-Y161 PolarHBondContact N-O 3.35Å; H127-Y161 WeakPolarHBondContact O-CA 3.44Å; H127-Y161 PolarHBondContact O-N 3.35Å; H127-Y161 VanDerWaalsContact O-O 3.1Å; C159-Y161 PolarHBondContact O-N 3.18Å; Y161-C163 PolarHBondContact O-N 3.31Å
162	N	61.4	Low	69.4	Low	67 Å²	67	81.3 Å²	81.3	36%	0.358	44%	0.441	S	S	.	.	S	Bend	trans	53.8	23.2	180	-136.1	33.1	0	0	0	114.3	G125 V164	G125-N162 CarbonylContact O-C 3.57Å; N162-V164 PolarHBondContact O-N 3.48Å
163	C	59.7	Low	69.2	Low	27 Å²	27	78.7 Å²	78.7	18%	0.182	43%	0.428	C	S	.	.			trans	-64.3	97.3	158.2	-49.9	0	0	0	0	104.2	C126 D160 Y161 D165	C126-C163 WeakPolarHBondContact CA-SG 3.22Å; C126-C163 HydrophobicContact CB-CB 3.69Å; C126-C163 WeakPolarHBondContact CB-SG 3.44Å; C126-C163 WeakPolarHBondContact SG-CB 3.5Å; C126-C163 CovalentContact SG-SG 2.03Å; C126-C163 PolarHBondContact SG-SG 3.31Å; D160-C163 HydrophobicContact CB-CB 4.12Å; D160-C163 WeakPolarHBondContact CB-SG 3.3Å; Y161-C163 PolarHBondContact O-N 3.31Å; C163-D165 PolarHBondContact O-N 2.89Å
164	V	49.2	Very low	68.9	Low	95 Å²	95	75 Å²	75	58%	0.576	41%	0.409	S	S	*	.			trans	-56.7	92.5	150.3	-175.1	0	0	0	0	101.7	N162 E166	N162-V164 PolarHBondContact O-N 3.48Å; V164-E166 PolarHBondContact O-N 2.84Å; V164-E166 VanDerWaalsContact O-N 3.09Å
165	D	46	Very low	68.7	Low	91 Å²	91	71.1 Å²	71.1	49%	0.487	39%	0.391	S	S	.	.			trans	-33.8	123	159.7	-74.7	-46.7	0	0	0	103.8	C163 A167 F168	C163-D165 PolarHBondContact O-N 2.89Å; D165-A167 VanDerWaalsContact C-N 3.34Å; D165-A167 WeakPolarHBondContact O-CA 3.39Å; D165-A167 PolarHBondContact O-N 3.28Å; D165-F168 HydrophobicContact CB-CD2 4.08Å; D165-F168 HydrophobicContact CB-CE2 3.75Å
166	E	44.4	Very low	68.6	Low	173 Å²	173	72.8 Å²	72.8	81%	0.808	40%	0.402	S	S	*	.	S	Bend	trans	-26.6	106.7	170.4	-74.3	177.3	145.8	0	0	106.4	V164 F168	V164-E166 PolarHBondContact O-N 2.84Å; V164-E166 VanDerWaalsContact O-N 3.09Å; E166-F168 VanDerWaalsContact C-N 3.32Å; E166-F168 PolarHBondContact O-N 3.48Å
167	A	46.3	Very low	68.5	Low	72 Å²	72	73.1 Å²	73.1	60%	0.595	40%	0.396	S	S	*	.			trans	-52.6	108.7	-158.8	0	0	0	0	0	105.4	D165 S169	D165-A167 VanDerWaalsContact C-N 3.34Å; D165-A167 WeakPolarHBondContact O-CA 3.39Å; D165-A167 PolarHBondContact O-N 3.28Å; A167-S169 WeakPolarHBondContact O-CA 3.49Å; A167-S169 WeakPolarHBondContact O-CB 3.35Å; A167-S169 PolarHBondContact O-N 3.27Å
168	F	52.1	Low	68.7	Low	56 Å²	56	70.6 Å²	70.6	25%	0.246	38%	0.381	C	S	.	.			trans	-64.5	91.9	177.7	-69.9	-75.7	0	0	0	102.7	D165 E166 T170 D173 I174 K177	D165-F168 HydrophobicContact CB-CD2 4.08Å; D165-F168 HydrophobicContact CB-CE2 3.75Å; E166-F168 VanDerWaalsContact C-N 3.32Å; E166-F168 PolarHBondContact O-N 3.48Å; F168-T170 PolarHBondContact O-N 3.39Å; F168-D173 HydrophobicContact CB-CB 4.33Å; F168-D173 HydrophobicContact CD1-CB 3.79Å; F168-I174 HydrophobicContact CB-CD1 4.26Å; F168-I174 HydrophobicContact CB-CG1 3.77Å; F168-I174 HydrophobicContact CD1-CG1 4.12Å; F168-I174 HydrophobicContact CG-CG1 3.95Å; F168-K177 HydrophobicContact CE1-CD 3.89Å; F168-K177 HydrophobicContact CZ-CD 3.7Å
169	S	58.4	Low	69.1	Low	91 Å²	91	66 Å²	66	64%	0.636	36%	0.364	S	S	*	.			trans	-79.4	-22	-160.2	64.1	0	0	0	0	109	A167 D173	A167-S169 WeakPolarHBondContact O-CA 3.49Å; A167-S169 WeakPolarHBondContact O-CB 3.35Å; A167-S169 PolarHBondContact O-N 3.27Å; S169-D173 PolarHBondContact N-OD2 3.33Å; S169-D173 PolarHBondContact OG-OD2 3.5Å
170	T	70.8	Confident	69.5	Low	58 Å²	58	71.3 Å²	71.3	36%	0.356	39%	0.385	S	S	.	.	S	Bend	trans	-134.3	159.1	-178.7	67.5	0	0	0	0	111.4	F168 D172 D173	F168-T170 PolarHBondContact O-N 3.39Å; T170-D172 PolarHBondContact O-N 3.42Å; T170-D172 PolarHBondContact OG1-N 3.31Å; T170-D173 PolarHBondContact N-OD2 3.43Å; T170-D173 PolarHBondContact O-N 3.26Å; T170-D173 VanDerWaalsContact OG1-CG 3.3Å; T170-D173 PolarHBondContact OG1-N 3.47Å; T170-D173 PolarHBondContact OG1-OD1 3.41Å; T170-D173 PolarHBondContact OG1-OD2 3.27Å
171	L	71.9	Confident	70.1	Confident	40 Å²	40	67.4 Å²	67.4	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-56.5	-26.6	169.4	-175.9	69.7	0	0	0	111.6	A175 F232 I317	L171-A175 WeakPolarHBondContact O-CB 3.36Å; L171-A175 PolarHBondContact O-N 2.85Å; L171-F232 HydrophobicContact CD1-CD1 4.19Å; L171-F232 HydrophobicContact CD1-CE1 3.58Å; L171-F232 HydrophobicContact CD1-CZ 4.49Å; L171-I317 HydrophobicContact CD1-CG2 4.22Å
172	D	77.4	Confident	71.2	Confident	83 Å²	83	64.3 Å²	64.3	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-74.2	-37.1	-177.1	-60.2	-35.4	0	0	0	112.1	T170 I174 A175 D176 H320	T170-D172 PolarHBondContact O-N 3.42Å; T170-D172 PolarHBondContact OG1-N 3.31Å; D172-I174 VanDerWaalsContact C-N 3.29Å; D172-I174 PolarHBondContact O-N 3.37Å; D172-A175 CarbonylContact O-C 3.54Å; D172-A175 WeakPolarHBondContact O-CA 3.41Å; D172-A175 VanDerWaalsContact O-CB 3.31Å; D172-A175 WeakPolarHBondContact O-CB 3.28Å; D172-A175 PolarHBondContact O-N 3.3Å; D172-D176 PolarHBondContact O-N 3.11Å; D172-H320 IonicContact OD1-CE1 3.56Å; D172-H320 PolarHBondContact OD1-CE1 3.06Å; D172-H320 IonicContact OD1-NE2 3.51Å; D172-H320 PolarHBondContact OD1-NE2 3.23Å
173	D	78.8	Confident	72.4	Confident	55 Å²	55	62.3 Å²	62.3	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-38.9	175.7	-55.5	-34	0	0	0	111.6	F168 S169 T170 K177	F168-D173 HydrophobicContact CB-CB 4.33Å; F168-D173 HydrophobicContact CD1-CB 3.79Å; S169-D173 PolarHBondContact N-OD2 3.33Å; S169-D173 PolarHBondContact OG-OD2 3.5Å; T170-D173 PolarHBondContact N-OD2 3.43Å; T170-D173 PolarHBondContact O-N 3.26Å; T170-D173 VanDerWaalsContact OG1-CG 3.3Å; T170-D173 PolarHBondContact OG1-N 3.47Å; T170-D173 PolarHBondContact OG1-OD1 3.41Å; T170-D173 PolarHBondContact OG1-OD2 3.27Å; D173-K177 PolarHBondContact O-N 3.34Å; D173-K177 VanDerWaalsContact O-N 3.17Å
174	I	80.2	Confident	73.5	Confident	21 Å²	21	66.9 Å²	66.9	11%	0.108	36%	0.361	C	S	.	.	H	α-helix	trans	-66.5	-43.3	173.9	-65.1	176.8	0	0	0	109.9	F168 D172 D176 K177 I178 L219 F232	F168-I174 HydrophobicContact CB-CD1 4.26Å; F168-I174 HydrophobicContact CB-CG1 3.77Å; F168-I174 HydrophobicContact CD1-CG1 4.12Å; F168-I174 HydrophobicContact CG-CG1 3.95Å; D172-I174 VanDerWaalsContact C-N 3.29Å; D172-I174 PolarHBondContact O-N 3.37Å; I174-D176 VanDerWaalsContact C-N 3.32Å; I174-D176 PolarHBondContact O-N 3.26Å; I174-K177 PolarHBondContact O-N 3.1Å; I174-I178 HydrophobicContact CG2-CD1 3.87Å; I174-I178 VanDerWaalsContact O-CG1 3.32Å; I174-I178 WeakPolarHBondContact O-CG1 3.05Å; I174-I178 PolarHBondContact O-N 3.3Å; I174-L219 HydrophobicContact CG2-CB 4.31Å; I174-L219 HydrophobicContact CG2-CD1 4.01Å; I174-F232 HydrophobicContact CD1-CE1 3.76Å; I174-F232 HydrophobicContact CD1-CZ 3.78Å
175	A	85.6	Confident	75.3	Confident	2 Å²	2	63 Å²	63	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-59.7	-44	178	0	0	0	0	0	110.8	L171 D172 K177 I178 T179 H320 W322	L171-A175 WeakPolarHBondContact O-CB 3.36Å; L171-A175 PolarHBondContact O-N 2.85Å; D172-A175 CarbonylContact O-C 3.54Å; D172-A175 WeakPolarHBondContact O-CA 3.41Å; D172-A175 VanDerWaalsContact O-CB 3.31Å; D172-A175 WeakPolarHBondContact O-CB 3.28Å; D172-A175 PolarHBondContact O-N 3.3Å; A175-K177 PolarHBondContact O-N 3.41Å; A175-I178 CarbonylContact O-C 3.59Å; A175-I178 WeakPolarHBondContact O-CA 3.17Å; A175-I178 WeakPolarHBondContact O-CB 3.37Å; A175-I178 PolarHBondContact O-N 3.32Å; A175-I178 VanDerWaalsContact O-N 3.11Å; A175-T179 WeakPolarHBondContact O-CG2 3.44Å; A175-T179 PolarHBondContact O-N 3.34Å; A175-H320 HydrophobicContact CB-CB 4.43Å; A175-W322 HydrophobicContact CB-CH2 4.06Å; A175-W322 HydrophobicContact CB-CZ2 3.71Å
176	D	85.6	Confident	77.2	Confident	100 Å²	100	58.9 Å²	58.9	54%	0.535	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-38.1	178.5	-76	-17.8	0	0	0	112.9	D172 I174 I178 T179 F180	D172-D176 PolarHBondContact O-N 3.11Å; I174-D176 VanDerWaalsContact C-N 3.32Å; I174-D176 PolarHBondContact O-N 3.26Å; D176-I178 VanDerWaalsContact C-N 3.3Å; D176-I178 PolarHBondContact O-N 3.45Å; D176-T179 VanDerWaalsContact CA-OG1 3.3Å; D176-T179 WeakPolarHBondContact CA-OG1 3.48Å; D176-T179 PolarHBondContact O-N 3.26Å; D176-T179 PolarHBondContact O-OG1 3.46Å; D176-F180 WeakPolarHBondContact O-CB 3.27Å; D176-F180 PolarHBondContact O-N 3.27Å
177	K	84.7	Confident	78.7	Confident	89 Å²	89	52.5 Å²	52.5	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-38.4	172.9	-168.4	170.1	-175.6	164.2	0	111.8	F168 D173 I174 A175 Q181 L215 L219	F168-K177 HydrophobicContact CE1-CD 3.89Å; F168-K177 HydrophobicContact CZ-CD 3.7Å; D173-K177 PolarHBondContact O-N 3.34Å; D173-K177 VanDerWaalsContact O-N 3.17Å; I174-K177 PolarHBondContact O-N 3.1Å; A175-K177 PolarHBondContact O-N 3.41Å; K177-Q181 PolarHBondContact O-N 3.48Å; K177-L215 HydrophobicContact CG-CD2 4.33Å; K177-L219 HydrophobicContact CD-CD1 4.46Å
178	I	88.8	Confident	80.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-71.5	-43.7	176.9	-66.2	169.6	0	0	0	110.7	I174 A175 D176 F180 Q181 V182 A216 L219 M315 I317 W322	I174-I178 HydrophobicContact CG2-CD1 3.87Å; I174-I178 VanDerWaalsContact O-CG1 3.32Å; I174-I178 WeakPolarHBondContact O-CG1 3.05Å; I174-I178 PolarHBondContact O-N 3.3Å; A175-I178 CarbonylContact O-C 3.59Å; A175-I178 WeakPolarHBondContact O-CA 3.17Å; A175-I178 WeakPolarHBondContact O-CB 3.37Å; A175-I178 PolarHBondContact O-N 3.32Å; A175-I178 VanDerWaalsContact O-N 3.11Å; D176-I178 VanDerWaalsContact C-N 3.3Å; D176-I178 PolarHBondContact O-N 3.45Å; I178-F180 VanDerWaalsContact C-N 3.28Å; I178-F180 PolarHBondContact O-N 2.72Å; I178-Q181 PolarHBondContact O-N 2.92Å; I178-Q181 VanDerWaalsContact O-N 3.13Å; I178-V182 HydrophobicContact CG2-CG2 4.16Å; I178-V182 VanDerWaalsContact O-CG2 3.29Å; I178-V182 WeakPolarHBondContact O-CG2 3.49Å; I178-V182 PolarHBondContact O-N 2.9Å; I178-A216 HydrophobicContact CD1-CB 3.87Å; I178-A216 HydrophobicContact CG1-CB 4.4Å; I178-L219 HydrophobicContact CG1-CD1 4.32Å; I178-M315 HydrophobicContact CG2-CE 3.29Å; I178-I317 HydrophobicContact CD1-CD1 3.67Å; I178-W322 HydrophobicContact CB-CH2 4.37Å; I178-W322 HydrophobicContact CB-CZ2 4.02Å; I178-W322 HydrophobicContact CD1-CH2 4.23Å; I178-W322 HydrophobicContact CG2-CD2 3.88Å; I178-W322 HydrophobicContact CG2-CE3 4.19Å; I178-W322 HydrophobicContact CG2-CG 4.37Å; I178-W322 HydrophobicContact CG2-CH2 4.2Å; I178-W322 HydrophobicContact CG2-CZ2 3.93Å; I178-W322 HydrophobicContact CG2-CZ3 4.34Å
179	T	89.1	Confident	81.3	Confident	60 Å²	60	51 Å²	51	37%	0.368	27%	0.27	S	S	.	.	H	α-helix	trans	-57.1	-44.6	177.3	58.6	0	0	0	0	110.4	A175 D176 Q181 V182 A183 W322	A175-T179 WeakPolarHBondContact O-CG2 3.44Å; A175-T179 PolarHBondContact O-N 3.34Å; D176-T179 VanDerWaalsContact CA-OG1 3.3Å; D176-T179 WeakPolarHBondContact CA-OG1 3.48Å; D176-T179 PolarHBondContact O-N 3.26Å; D176-T179 PolarHBondContact O-OG1 3.46Å; T179-Q181 PolarHBondContact O-N 3.42Å; T179-V182 PolarHBondContact O-N 3.32Å; T179-A183 PolarHBondContact O-N 3.41Å; T179-W322 HydrophobicContact CG2-CZ2 4.41Å
180	F	87.3	Confident	81.8	Confident	127 Å²	127	51.7 Å²	51.7	56%	0.557	27%	0.267	S	S	*	.	H	α-helix	trans	-61.4	-44.8	176.7	-177	-96.8	0	0	0	111.8	D176 I178 A183 K184	D176-F180 WeakPolarHBondContact O-CB 3.27Å; D176-F180 PolarHBondContact O-N 3.27Å; I178-F180 VanDerWaalsContact C-N 3.28Å; I178-F180 PolarHBondContact O-N 2.72Å; F180-A183 PolarHBondContact O-N 3.38Å; F180-K184 PolarHBondContact O-N 3.3Å
181	Q	87.2	Confident	81.5	Confident	39 Å²	39	52.3 Å²	52.3	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-39.1	177.7	-171.9	60	45	0	0	112.1	K177 I178 T179 K184 D185 A212 L215	K177-Q181 PolarHBondContact O-N 3.48Å; I178-Q181 PolarHBondContact O-N 2.92Å; I178-Q181 VanDerWaalsContact O-N 3.13Å; T179-Q181 PolarHBondContact O-N 3.42Å; Q181-K184 WeakPolarHBondContact O-CB 3.08Å; Q181-K184 PolarHBondContact O-N 3.38Å; Q181-D185 PolarHBondContact NE2-OD1 3.22Å; Q181-D185 VanDerWaalsContact O-CG 3.25Å; Q181-D185 PolarHBondContact O-N 3.48Å; Q181-A212 HydrophobicContact CB-CB 4.21Å; Q181-A212 HydrophobicContact CG-CB 3.82Å; Q181-L215 HydrophobicContact CB-CD2 3.68Å; Q181-L215 HydrophobicContact CG-CD2 3.87Å
182	V	89.6	Confident	81.5	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-45.9	174.8	171.1	0	0	0	0	110.8	I178 T179 K184 D185 Q186 A212 M315 W322	I178-V182 HydrophobicContact CG2-CG2 4.16Å; I178-V182 VanDerWaalsContact O-CG2 3.29Å; I178-V182 WeakPolarHBondContact O-CG2 3.49Å; I178-V182 PolarHBondContact O-N 2.9Å; T179-V182 PolarHBondContact O-N 3.32Å; V182-K184 VanDerWaalsContact C-N 3.28Å; V182-K184 PolarHBondContact O-N 2.93Å; V182-D185 PolarHBondContact O-N 2.95Å; V182-Q186 HydrophobicContact CG1-CG 4.34Å; V182-Q186 WeakPolarHBondContact O-CB 3.26Å; V182-Q186 VanDerWaalsContact O-CG 3.32Å; V182-Q186 WeakPolarHBondContact O-CG 3.45Å; V182-Q186 PolarHBondContact O-N 3.27Å; V182-A212 HydrophobicContact CB-CB 4.49Å; V182-A212 HydrophobicContact CG2-CB 3.64Å; V182-M315 HydrophobicContact CG2-CE 3.27Å; V182-W322 HydrophobicContact CG2-CB 4.02Å; V182-W322 HydrophobicContact CG2-CG 4.14Å
183	A	86.4	Confident	81.6	Confident	25 Å²	25	57.6 Å²	57.6	21%	0.207	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-41.2	177	0	0	0	0	0	111.6	T179 F180 L187 A360	T179-A183 PolarHBondContact O-N 3.41Å; F180-A183 PolarHBondContact O-N 3.38Å; A183-L187 WeakPolarHBondContact O-CG 3.11Å; A183-L187 PolarHBondContact O-N 2.9Å; A183-L187 VanDerWaalsContact O-N 3.14Å; A183-A360 HydrophobicContact CB-CB 3.78Å
184	K	84.7	Confident	81.9	Confident	122 Å²	122	55.2 Å²	55.2	53%	0.53	28%	0.284	S	S	.	.	H	α-helix	trans	-65.1	-41.4	175.2	-172	-179.4	179.5	178.9	0	112.8	F180 Q181 V182 L187 N188	F180-K184 PolarHBondContact O-N 3.3Å; Q181-K184 WeakPolarHBondContact O-CB 3.08Å; Q181-K184 PolarHBondContact O-N 3.38Å; V182-K184 VanDerWaalsContact C-N 3.28Å; V182-K184 PolarHBondContact O-N 2.93Å; K184-L187 WeakPolarHBondContact O-CB 3.34Å; K184-L187 PolarHBondContact O-N 3.33Å; K184-N188 PolarHBondContact O-N 3.43Å
185	D	86.1	Confident	82.5	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-68.6	-39.8	179.2	-71.8	-4.6	0	0	0	111.8	Q181 V182 L187 N188 L189 P211 A212	Q181-D185 PolarHBondContact NE2-OD1 3.22Å; Q181-D185 VanDerWaalsContact O-CG 3.25Å; Q181-D185 PolarHBondContact O-N 3.48Å; V182-D185 PolarHBondContact O-N 2.95Å; D185-L187 PolarHBondContact O-N 3.34Å; D185-N188 CarbonylContact O-C 3.58Å; D185-N188 WeakPolarHBondContact O-CA 3.34Å; D185-N188 PolarHBondContact O-N 3.28Å; D185-L189 PolarHBondContact O-N 3.48Å; D185-P211 WeakPolarHBondContact OD1-CB 3.38Å; D185-P211 VanDerWaalsContact OD2-CD 3.3Å; D185-P211 WeakPolarHBondContact OD2-CD 3.49Å; D185-A212 WeakPolarHBondContact OD2-CB 3.44Å; D185-A212 PolarHBondContact OD2-N 3.38Å
186	Q	85	Confident	82.8	Confident	6 Å²	6	58 Å²	58	3%	0.028	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-32.9	173.6	-72.5	177.1	-6.1	0	0	111.3	V182 N188 L189 N323 W362 M363	V182-Q186 HydrophobicContact CG1-CG 4.34Å; V182-Q186 WeakPolarHBondContact O-CB 3.26Å; V182-Q186 VanDerWaalsContact O-CG 3.32Å; V182-Q186 WeakPolarHBondContact O-CG 3.45Å; V182-Q186 PolarHBondContact O-N 3.27Å; Q186-N188 PolarHBondContact O-N 3.45Å; Q186-L189 HydrophobicContact CB-CD1 4.47Å; Q186-L189 VanDerWaalsContact O-CD1 3.26Å; Q186-L189 WeakPolarHBondContact O-CD1 3.36Å; Q186-L189 VanDerWaalsContact O-CG 3.23Å; Q186-L189 WeakPolarHBondContact O-CG 3.42Å; Q186-N323 PolarHBondContact NE2-O 2.83Å; Q186-W362 HydrophobicContact CB-CH2 4.13Å; Q186-W362 HydrophobicContact CB-CZ2 3.54Å; Q186-W362 WeakPolarHBondContact O-CH2 3.47Å; Q186-M363 HydrophobicContact CB-CE 4.39Å
187	L	76.9	Confident	83.2	Confident	39 Å²	39	58.8 Å²	58.8	20%	0.204	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.8	170.7	-70.9	169	0	0	0	113.1	A183 K184 D185 W362 T411 L414 R427	A183-L187 WeakPolarHBondContact O-CG 3.11Å; A183-L187 PolarHBondContact O-N 2.9Å; A183-L187 VanDerWaalsContact O-N 3.14Å; K184-L187 WeakPolarHBondContact O-CB 3.34Å; K184-L187 PolarHBondContact O-N 3.33Å; D185-L187 PolarHBondContact O-N 3.34Å; L187-W362 HydrophobicContact CB-CZ2 4.26Å; L187-W362 HydrophobicContact CD2-CD2 4.1Å; L187-W362 HydrophobicContact CD2-CE3 4.18Å; L187-W362 HydrophobicContact CD2-CH2 3.63Å; L187-W362 HydrophobicContact CD2-CZ2 3.5Å; L187-W362 HydrophobicContact CD2-CZ3 3.96Å; L187-W362 HydrophobicContact CG-CH2 4.04Å; L187-W362 HydrophobicContact CG-CZ2 3.52Å; L187-T411 HydrophobicContact CD2-CG2 3.89Å; L187-L414 HydrophobicContact CD1-CD1 4.18Å; L187-R427 PolarHBondContact O-NH1 3.14Å; L187-R427 PolarHBondContact O-NH2 2.96Å
188	N	79.2	Confident	83.6	Confident	92 Å²	92	56.6 Å²	56.6	49%	0.492	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	33.6	175.3	-160.8	24.2	0	0	0	113.7	K184 D185 Q186 N190 A191	K184-N188 PolarHBondContact O-N 3.43Å; D185-N188 CarbonylContact O-C 3.58Å; D185-N188 WeakPolarHBondContact O-CA 3.34Å; D185-N188 PolarHBondContact O-N 3.28Å; Q186-N188 PolarHBondContact O-N 3.45Å; N188-N190 PolarHBondContact O-N 2.94Å; N188-N190 VanDerWaalsContact O-N 3.17Å; N188-A191 WeakPolarHBondContact O-CB 3.29Å; N188-A191 PolarHBondContact O-N 3.42Å
189	L	73.1	Confident	83.8	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-61.9	-21.3	180	-71.6	164.4	0	0	0	115	D185 Q186 A191 Y192 N194 I325 F326 M363 Y429	D185-L189 PolarHBondContact O-N 3.48Å; Q186-L189 HydrophobicContact CB-CD1 4.47Å; Q186-L189 VanDerWaalsContact O-CD1 3.26Å; Q186-L189 WeakPolarHBondContact O-CD1 3.36Å; Q186-L189 VanDerWaalsContact O-CG 3.23Å; Q186-L189 WeakPolarHBondContact O-CG 3.42Å; L189-A191 PolarHBondContact O-N 3.4Å; L189-Y192 PolarHBondContact O-N 3.37Å; L189-N194 WeakPolarHBondContact CD2-ND2 3.2Å; L189-I325 HydrophobicContact CD2-CG1 4.06Å; L189-F326 HydrophobicContact CD1-CD1 4.15Å; L189-F326 HydrophobicContact CD1-CE1 3.35Å; L189-F326 HydrophobicContact CD1-CZ 3.85Å; L189-M363 HydrophobicContact CD1-CE 4.29Å; L189-Y429 HydrophobicContact CB-CE1 4.33Å; L189-Y429 WeakPolarHBondContact CB-OH 3.46Å
190	N	70.7	Confident	83.9	Confident	106 Å²	106	63.6 Å²	63.6	57%	0.567	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.4	177.1	-68.6	-0.4	0	0	0	113	N188 Y192	N188-N190 PolarHBondContact O-N 2.94Å; N188-N190 VanDerWaalsContact O-N 3.17Å; N190-Y192 PolarHBondContact O-N 3.45Å
191	A	64.1	Low	84.1	Confident	72 Å²	72	65.8 Å²	65.8	60%	0.595	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-66	-15.6	172.9	0	0	0	0	0	112.4	N188 L189	N188-A191 WeakPolarHBondContact O-CB 3.29Å; N188-A191 PolarHBondContact O-N 3.42Å; L189-A191 PolarHBondContact O-N 3.4Å
192	Y	70.4	Confident	84.3	Confident	62 Å²	62	68 Å²	68	24%	0.243	33%	0.329	C	S	.	.	S	Bend	trans	-110.9	138.8	-177.5	-53.1	-94.3	0	0	0	110.5	L189 N190 N194 P211 I325	L189-Y192 PolarHBondContact O-N 3.37Å; N190-Y192 PolarHBondContact O-N 3.45Å; Y192-N194 WeakPolarHBondContact CB-OD1 3.43Å; Y192-N194 PolarHBondContact O-N 3.24Å; Y192-P211 WeakPolarHBondContact OH-CD 3.49Å; Y192-I325 HydrophobicContact CD1-CD1 3.58Å; Y192-I325 HydrophobicContact CD2-CD1 4.2Å; Y192-I325 HydrophobicContact CE1-CD1 4.07Å; Y192-I325 HydrophobicContact CG-CD1 3.66Å
193	Q	79.8	Confident	84.4	Confident	172 Å²	172	71.8 Å²	71.8	80%	0.804	36%	0.356	S	S	*	.			trans	-76.7	66.3	173.1	-68.8	-175.8	-4.1	0	0	110.8	I195 L196	Q193-I195 VanDerWaalsContact C-N 3.29Å; Q193-I195 PolarHBondContact O-N 2.91Å; Q193-L196 WeakPolarHBondContact O-CD2 3.42Å
194	N	86.3	Confident	84.7	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	35%	0.347	C	S	.	.			trans	-75.8	-15.9	-171.6	-70	-8.4	0	0	0	114	L189 Y192 I325 F326 Y327 T328	L189-N194 WeakPolarHBondContact CD2-ND2 3.2Å; Y192-N194 WeakPolarHBondContact CB-OD1 3.43Å; Y192-N194 PolarHBondContact O-N 3.24Å; N194-I325 WeakPolarHBondContact OD1-CD1 3.23Å; N194-F326 VanDerWaalsContact CB-O 3.29Å; N194-F326 WeakPolarHBondContact CB-O 3.34Å; N194-F326 PolarHBondContact ND2-O 2.9Å; N194-Y327 CarbonylContact O-C 3.42Å; N194-Y327 VanDerWaalsContact O-CA 3.23Å; N194-Y327 WeakPolarHBondContact O-CA 3.21Å; N194-T328 PolarHBondContact O-N 2.54Å
195	I	91.6	Very high	85	Confident	64 Å²	64	70.9 Å²	70.9	33%	0.328	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	104	180	-57.1	165.4	0	0	0	108.1	Q193 R197 I330 Y429 L430	Q193-I195 VanDerWaalsContact C-N 3.29Å; Q193-I195 PolarHBondContact O-N 2.91Å; I195-R197 HydrophobicContact CG2-CG 4.33Å; I195-I330 HydrophobicContact CG2-CD1 4.09Å; I195-Y429 HydrophobicContact CD1-CD1 4.27Å; I195-L430 HydrophobicContact CD1-CB 4.44Å; I195-L430 HydrophobicContact CG2-CB 4.32Å
196	L	92.4	Very high	85.4	Confident	19 Å²	19	70.3 Å²	70.3	10%	0.099	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	104.3	-176.9	-58.1	177.6	0	0	0	109.2	Q193 M198 V204 M206 Y327 T328 L329 I330	Q193-L196 WeakPolarHBondContact O-CD2 3.42Å; L196-M198 HydrophobicContact CB-CE 3.96Å; L196-M198 HydrophobicContact CB-CG 4.35Å; L196-M198 HydrophobicContact CD2-CE 4Å; L196-M198 HydrophobicContact CG-CE 4.49Å; L196-V204 HydrophobicContact CD1-CG1 3.64Å; L196-M206 HydrophobicContact CD1-CE 3.96Å; L196-M206 HydrophobicContact CD1-CG 3.79Å; L196-Y327 HydrophobicContact CD1-CD1 3.92Å; L196-Y327 HydrophobicContact CG-CD1 4.24Å; L196-T328 PolarHBondContact N-O 3.31Å; L196-L329 HydrophobicContact CB-CD1 4.1Å; L196-I330 PolarHBondContact O-N 3.41Å
197	R	93.4	Very high	85.7	Confident	115 Å²	115	71.7 Å²	71.7	43%	0.434	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	106.2	175	-64.2	-175.7	70.7	-110.8	3.7	109.8	I195 I330 I332 E433	I195-R197 HydrophobicContact CG2-CG 4.33Å; R197-I330 CarbonylContact C-O 3.51Å; R197-I330 WeakPolarHBondContact CA-O 3.39Å; R197-I330 HydrophobicContact CG-CB 4.23Å; R197-I330 HydrophobicContact CG-CD1 4.44Å; R197-I332 HydrophobicContact CB-CD1 4.23Å; R197-I332 HydrophobicContact CB-CG1 4.39Å; R197-E433 IonicContact CZ-OE2 2.84Å; R197-E433 IonicContact NE-OE2 3.11Å; R197-E433 PolarHBondContact NE-OE2 3.46Å; R197-E433 VanDerWaalsContact NE-OE2 3.15Å; R197-E433 IonicContact NH2-OE1 3.3Å; R197-E433 IonicContact NH2-OE2 2.8Å; R197-E433 PolarHBondContact NH2-OE2 3.48Å
198	M	93.7	Very high	86.5	Confident	43 Å²	43	69.8 Å²	69.8	21%	0.212	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	161.9	-168.7	-59.1	-68.6	173.8	0	0	111.2	L196 V204 L329 I330 I331 I332	L196-M198 HydrophobicContact CB-CE 3.96Å; L196-M198 HydrophobicContact CB-CG 4.35Å; L196-M198 HydrophobicContact CD2-CE 4Å; L196-M198 HydrophobicContact CG-CE 4.49Å; M198-V204 HydrophobicContact CB-CG2 4.37Å; M198-V204 HydrophobicContact CE-CG2 3.94Å; M198-V204 HydrophobicContact CG-CG2 3.51Å; M198-V204 HydrophobicContact SD-CG2 3.92Å; M198-L329 HydrophobicContact CB-CD1 4.19Å; M198-L329 HydrophobicContact CG-CD1 3.88Å; M198-I330 PolarHBondContact N-O 2.92Å; M198-I331 CarbonylContact O-C 3.55Å; M198-I331 WeakPolarHBondContact O-CA 3.4Å; M198-I332 PolarHBondContact O-N 3.28Å
199	R	93	Very high	87	Confident	169 Å²	169	67.8 Å²	67.8	64%	0.638	33%	0.329	S	S	*	.			trans	-103.8	157.6	169.7	-64.3	-179	-179.8	-179.5	0.5	109.3	Q202	R199-Q202 HydrophobicContact CB-CG 4.33Å; R199-Q202 WeakPolarHBondContact O-CB 3.5Å; R199-Q202 WeakPolarHBondContact O-CG 3.33Å; R199-Q202 PolarHBondContact O-N 2.88Å
200	V	91.1	Very high	87.8	Confident	39 Å²	39	67.7 Å²	67.7	24%	0.236	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	146.2	174.6	-173.2	0	0	0	0	110.2	Q202 I303 Y305 I331	V200-Q202 PolarHBondContact O-N 3.31Å; V200-I303 WeakPolarHBondContact CA-O 3.39Å; V200-I303 WeakPolarHBondContact CG1-O 3.41Å; V200-Y305 HydrophobicContact CG1-CE2 4.49Å; V200-Y305 HydrophobicContact CG2-CD1 3.61Å; V200-Y305 HydrophobicContact CG2-CD2 4.06Å; V200-Y305 HydrophobicContact CG2-CE1 3.37Å; V200-Y305 HydrophobicContact CG2-CE2 3.84Å; V200-Y305 HydrophobicContact CG2-CG 3.96Å; V200-Y305 VanDerWaalsContact CG2-CZ 3.5Å; V200-I331 HydrophobicContact CG2-CG2 3.82Å
201	K	90.7	Very high	88.6	Confident	172 Å²	172	65.5 Å²	65.5	75%	0.748	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	8.1	-175.9	-50.6	-176.5	177.2	178	0	116	I303	K201-I303 PolarHBondContact N-O 3.35Å
202	Q	92.3	Very high	89.8	Confident	86 Å²	86	62.1 Å²	62.1	40%	0.402	29%	0.292	S	S	.	.			trans	-84.6	152.6	169.2	-65.3	-171.7	-50.9	0	0	110.9	R199 V200 I303	R199-Q202 HydrophobicContact CB-CG 4.33Å; R199-Q202 WeakPolarHBondContact O-CB 3.5Å; R199-Q202 WeakPolarHBondContact O-CG 3.33Å; R199-Q202 PolarHBondContact O-N 2.88Å; V200-Q202 PolarHBondContact O-N 3.31Å; Q202-I303 VanDerWaalsContact O-CD1 3.31Å; Q202-I303 WeakPolarHBondContact O-CD1 3.48Å; Q202-I303 WeakPolarHBondContact O-CG1 3.44Å; Q202-I303 PolarHBondContact O-N 2.82Å; Q202-I303 VanDerWaalsContact O-N 3.08Å
203	S	90.8	Very high	90.8	Very high	85 Å²	85	60.3 Å²	60.3	59%	0.594	29%	0.285	S	S	*	.			trans	-86.6	135.6	172.5	60.7	0	0	0	0	110.8	F300 P301	S203-F300 CarbonylContact C-O 3.58Å; S203-F300 WeakPolarHBondContact CA-O 3.46Å; S203-P301 WeakPolarHBondContact CA-O 3.13Å; S203-P301 WeakPolarHBondContact CB-O 3.41Å
204	V	93.2	Very high	91.3	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	172.3	165.3	0	0	0	0	110.7	L196 M198 M206 V299 F300 I303 L329	L196-V204 HydrophobicContact CD1-CG1 3.64Å; M198-V204 HydrophobicContact CB-CG2 4.37Å; M198-V204 HydrophobicContact CE-CG2 3.94Å; M198-V204 HydrophobicContact CG-CG2 3.51Å; M198-V204 HydrophobicContact SD-CG2 3.92Å; V204-M206 HydrophobicContact CG1-CE 3.75Å; V204-M206 HydrophobicContact CG1-CG 3.94Å; V204-V299 WeakPolarHBondContact O-CA 3.35Å; V204-F300 HydrophobicContact CB-CB 4.5Å; V204-F300 PolarHBondContact N-O 2.94Å; V204-F300 PolarHBondContact O-N 3.3Å; V204-I303 HydrophobicContact CB-CD1 3.43Å; V204-I303 VanDerWaalsContact CB-CD1 3.43Å; V204-I303 HydrophobicContact CB-CG1 4.48Å; V204-I303 HydrophobicContact CG2-CD1 3.06Å; V204-I303 HydrophobicContact CG2-CG1 4.45Å; V204-L329 HydrophobicContact CG2-CD1 4.05Å
205	R	92.3	Very high	91.3	Very high	123 Å²	123	57.5 Å²	57.5	46%	0.464	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.6	173.4	-179.6	175.3	-170.9	120	5.4	108.4	E294 Y297 V299	R205-E294 IonicContact CZ-OE2 2.88Å; R205-E294 IonicContact NH1-OE2 2.78Å; R205-E294 PolarHBondContact NH1-OE2 3.21Å; R205-E294 IonicContact NH2-OE2 3.76Å; R205-E294 PolarHBondContact NH2-OE2 2.91Å; R205-Y297 HydrophobicContact CG-CD1 3.64Å; R205-Y297 HydrophobicContact CG-CE1 4.34Å; R205-Y297 HydrophobicContact CG-CG 4.31Å; R205-Y297 VanDerWaalsContact NH2-CE2 3.27Å; R205-Y297 VanDerWaalsContact NH2-CG 3.3Å; R205-V299 HydrophobicContact CG-CG2 4.16Å
206	M	93.7	Very high	91.1	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.8	174.9	-60.6	174.4	-163.9	0	0	109.1	L196 V204 W241 Y297 L298 Y311 Y327 L329	L196-M206 HydrophobicContact CD1-CE 3.96Å; L196-M206 HydrophobicContact CD1-CG 3.79Å; V204-M206 HydrophobicContact CG1-CE 3.75Å; V204-M206 HydrophobicContact CG1-CG 3.94Å; M206-W241 HydrophobicContact CB-CH2 3.8Å; M206-W241 HydrophobicContact CB-CZ2 4.39Å; M206-W241 HydrophobicContact CB-CZ3 4.27Å; M206-W241 HydrophobicContact SD-CZ3 4.48Å; M206-Y297 CarbonylContact O-C 3.48Å; M206-Y297 VanDerWaalsContact O-CA 3.23Å; M206-Y297 WeakPolarHBondContact O-CA 3.41Å; M206-L298 HydrophobicContact CB-CB 4.44Å; M206-L298 PolarHBondContact N-O 3.13Å; M206-L298 PolarHBondContact O-N 3.01Å; M206-L298 HydrophobicContact SD-CD2 4.33Å; M206-Y311 HydrophobicContact CE-CD2 3.7Å; M206-Y311 HydrophobicContact CE-CE2 4.17Å; M206-Y311 HydrophobicContact CE-CG 3.99Å; M206-Y311 HydrophobicContact SD-CD2 4.18Å; M206-Y311 HydrophobicContact SD-CG 3.88Å; M206-Y327 HydrophobicContact CB-CD1 4.43Å; M206-Y327 HydrophobicContact CB-CD2 3.82Å; M206-Y327 HydrophobicContact CB-CE2 3.93Å; M206-Y327 HydrophobicContact CB-CG 4.08Å; M206-Y327 HydrophobicContact CG-CD1 4.14Å; M206-Y327 HydrophobicContact CG-CD2 4.1Å; M206-Y327 HydrophobicContact CG-CG 3.85Å; M206-Y327 HydrophobicContact SD-CD2 4.23Å; M206-Y327 HydrophobicContact SD-CG 3.97Å; M206-L329 HydrophobicContact CE-CB 3.91Å; M206-L329 HydrophobicContact CE-CD2 4.14Å; M206-L329 HydrophobicContact CE-CG 4.45Å
207	D	91.5	Very high	90.8	Very high	35 Å²	35	59 Å²	59	19%	0.187	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.6	-176.1	-164	-6.4	0	0	0	111.4	V209 T296 Y297 Y327	D207-V209 VanDerWaalsContact OD1-CG2 3.31Å; D207-V209 WeakPolarHBondContact OD1-CG2 3.27Å; D207-V209 PolarHBondContact OD1-N 3.48Å; D207-T296 PolarHBondContact OD1-OG1 2.83Å; D207-T296 VanDerWaalsContact OD1-OG1 3.05Å; D207-Y297 HydrophobicContact CB-CD1 3.75Å; D207-Y297 HydrophobicContact CB-CE1 3.44Å; D207-Y297 VanDerWaalsContact CB-CE1 3.44Å; D207-Y297 WeakPolarHBondContact OD2-CE1 3.16Å; D207-Y297 PolarHBondContact OD2-OH 2.84Å; D207-Y327 PolarHBondContact N-OH 2.89Å; D207-Y327 VanDerWaalsContact O-CE2 3.26Å; D207-Y327 WeakPolarHBondContact O-CE2 3.17Å; D207-Y327 PolarHBondContact O-OH 2.82Å
208	C	92.5	Very high	90.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.			trans	-87.1	-7.3	174.6	-171.5	0	0	0	0	113.7	T210 I239 W241 T296 C313	C208-T210 PolarHBondContact O-N 3.11Å; C208-T210 VanDerWaalsContact O-N 3.09Å; C208-I239 HydrophobicContact CB-CD1 4.19Å; C208-I239 HydrophobicContact CB-CG2 4.45Å; C208-W241 HydrophobicContact CB-CZ2 3.89Å; C208-T296 VanDerWaalsContact CB-O 3.3Å; C208-T296 WeakPolarHBondContact CB-O 3.23Å; C208-T296 PolarHBondContact N-O 2.98Å; C208-C313 HydrophobicContact CB-CB 3.68Å; C208-C313 WeakPolarHBondContact CB-SG 3.44Å; C208-C313 WeakPolarHBondContact SG-CB 3.45Å; C208-C313 CovalentContact SG-SG 1.99Å; C208-C313 PolarHBondContact SG-SG 3.06Å
209	V	90.2	Very high	89.3	Confident	49 Å²	49	57.9 Å²	57.9	30%	0.297	28%	0.278	S	S	.	.			trans	-68.7	112.6	-174.5	176.5	0	0	0	0	111.7	D207 Y213 T296	D207-V209 VanDerWaalsContact OD1-CG2 3.31Å; D207-V209 WeakPolarHBondContact OD1-CG2 3.27Å; D207-V209 PolarHBondContact OD1-N 3.48Å; V209-Y213 HydrophobicContact CB-CD1 4.49Å; V209-Y213 HydrophobicContact CG1-CD1 4.44Å; V209-Y213 HydrophobicContact CG2-CD1 4.11Å; V209-Y213 HydrophobicContact CG2-CE1 4.19Å; V209-T296 HydrophobicContact CG2-CG2 3.92Å; V209-T296 WeakPolarHBondContact CG2-OG1 3.49Å
210	T	89.7	Confident	88.5	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.012	26%	0.262	C	S	.	.			trans	-123.8	164.2	170.5	62.4	0	0	0	0	110.8	C208 A212 Y213 N214 I325	C208-T210 PolarHBondContact O-N 3.11Å; C208-T210 VanDerWaalsContact O-N 3.09Å; T210-A212 PolarHBondContact O-N 2.89Å; T210-Y213 WeakPolarHBondContact O-CB 3.36Å; T210-Y213 PolarHBondContact O-N 3.44Å; T210-Y213 VanDerWaalsContact O-N 3.08Å; T210-Y213 PolarHBondContact OG1-N 3.4Å; T210-Y213 VanDerWaalsContact OG1-N 3.13Å; T210-N214 PolarHBondContact O-N 2.92Å; T210-N214 PolarHBondContact O-ND2 2.95Å; T210-I325 HydrophobicContact CG2-CB 4.02Å; T210-I325 HydrophobicContact CG2-CD1 4.44Å; T210-I325 HydrophobicContact CG2-CG2 4.33Å
211	P	88.5	Confident	87.4	Confident	60 Å²	60	53.6 Å²	53.6	39%	0.39	27%	0.273	S	S	.	.	H	α-helix	trans	-52	-37.5	169.6	-27.1	33.3	0	0	0	113.5	D185 Y192 N214 L215	D185-P211 WeakPolarHBondContact OD1-CB 3.38Å; D185-P211 VanDerWaalsContact OD2-CD 3.3Å; D185-P211 WeakPolarHBondContact OD2-CD 3.49Å; Y192-P211 WeakPolarHBondContact OH-CD 3.49Å; P211-N214 PolarHBondContact O-N 3.28Å; P211-L215 WeakPolarHBondContact O-CB 3.03Å; P211-L215 PolarHBondContact O-N 2.95Å
212	A	89.8	Confident	85.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-43.3	173.8	0	0	0	0	0	112.3	Q181 V182 D185 T210 L215 A216 M315	Q181-A212 HydrophobicContact CB-CB 4.21Å; Q181-A212 HydrophobicContact CG-CB 3.82Å; V182-A212 HydrophobicContact CB-CB 4.49Å; V182-A212 HydrophobicContact CG2-CB 3.64Å; D185-A212 WeakPolarHBondContact OD2-CB 3.44Å; D185-A212 PolarHBondContact OD2-N 3.38Å; T210-A212 PolarHBondContact O-N 2.89Å; A212-L215 PolarHBondContact O-N 2.79Å; A212-A216 WeakPolarHBondContact O-CB 3.44Å; A212-A216 PolarHBondContact O-N 2.82Å; A212-M315 HydrophobicContact CB-CE 4.27Å
213	Y	91.1	Very high	83.7	Confident	24 Å²	24	50.9 Å²	50.9	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-60.7	-45.4	173.8	172.9	-98.4	0	0	0	111.6	V209 T210 L215 A216 K217 L237 I239 T296	V209-Y213 HydrophobicContact CB-CD1 4.49Å; V209-Y213 HydrophobicContact CG1-CD1 4.44Å; V209-Y213 HydrophobicContact CG2-CD1 4.11Å; V209-Y213 HydrophobicContact CG2-CE1 4.19Å; T210-Y213 WeakPolarHBondContact O-CB 3.36Å; T210-Y213 PolarHBondContact O-N 3.44Å; T210-Y213 VanDerWaalsContact O-N 3.08Å; T210-Y213 PolarHBondContact OG1-N 3.4Å; T210-Y213 VanDerWaalsContact OG1-N 3.13Å; Y213-L215 VanDerWaalsContact C-N 3.33Å; Y213-L215 PolarHBondContact O-N 2.94Å; Y213-A216 PolarHBondContact O-N 3.43Å; Y213-K217 HydrophobicContact CE1-CD 4.15Å; Y213-K217 WeakPolarHBondContact O-CB 3.44Å; Y213-K217 PolarHBondContact O-N 2.93Å; Y213-L237 HydrophobicContact CD2-CD2 4.03Å; Y213-L237 HydrophobicContact CE2-CD2 3.62Å; Y213-L237 HydrophobicContact CE2-CG 4.26Å; Y213-I239 HydrophobicContact CD2-CD1 4.16Å; Y213-I239 HydrophobicContact CE2-CD1 3.54Å; Y213-I239 HydrophobicContact CE2-CG1 4.06Å; Y213-T296 HydrophobicContact CE1-CG2 3.85Å; Y213-T296 HydrophobicContact CE2-CG2 4.36Å; Y213-T296 WeakPolarHBondContact OH-CG2 3.16Å
214	N	89.9	Confident	81.5	Confident	84 Å²	84	52.8 Å²	52.8	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-38.8	177.7	-72.6	-36.1	0	0	0	112.2	T210 P211 K218	T210-N214 PolarHBondContact O-N 2.92Å; T210-N214 PolarHBondContact O-ND2 2.95Å; P211-N214 PolarHBondContact O-N 3.28Å; N214-K218 WeakPolarHBondContact O-CB 3.1Å; N214-K218 PolarHBondContact O-N 2.88Å
215	L	86.7	Confident	78.9	Confident	34 Å²	34	62.2 Å²	62.2	18%	0.178	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-49.5	173.7	179.5	67.2	0	0	0	111	K177 Q181 P211 A212 Y213 K217 K218 L219	K177-L215 HydrophobicContact CG-CD2 4.33Å; Q181-L215 HydrophobicContact CB-CD2 3.68Å; Q181-L215 HydrophobicContact CG-CD2 3.87Å; P211-L215 WeakPolarHBondContact O-CB 3.03Å; P211-L215 PolarHBondContact O-N 2.95Å; A212-L215 PolarHBondContact O-N 2.79Å; Y213-L215 VanDerWaalsContact C-N 3.33Å; Y213-L215 PolarHBondContact O-N 2.94Å; L215-K217 VanDerWaalsContact C-N 3.33Å; L215-K217 PolarHBondContact O-N 2.83Å; L215-K218 WeakPolarHBondContact O-CB 3.09Å; L215-K218 PolarHBondContact O-N 3.11Å; L215-K218 VanDerWaalsContact O-N 3.14Å; L215-L219 HydrophobicContact CD1-CD1 4.09Å; L215-L219 HydrophobicContact CD1-CG 4.34Å; L215-L219 HydrophobicContact CG-CD1 3.98Å; L215-L219 WeakPolarHBondContact O-CG 3.34Å; L215-L219 PolarHBondContact O-N 3.12Å
216	A	86.9	Confident	76.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-44.7	177.3	0	0	0	0	0	111.6	I178 A212 Y213 K218 L219 T220 L237 M315 I317	I178-A216 HydrophobicContact CD1-CB 3.87Å; I178-A216 HydrophobicContact CG1-CB 4.4Å; A212-A216 WeakPolarHBondContact O-CB 3.44Å; A212-A216 PolarHBondContact O-N 2.82Å; Y213-A216 PolarHBondContact O-N 3.43Å; A216-K218 VanDerWaalsContact C-N 3.34Å; A216-K218 PolarHBondContact O-N 3Å; A216-L219 PolarHBondContact O-N 3.07Å; A216-T220 WeakPolarHBondContact O-CB 3.12Å; A216-T220 WeakPolarHBondContact O-CG2 3.39Å; A216-T220 PolarHBondContact O-N 3.05Å; A216-T220 PolarHBondContact O-OG1 2.85Å; A216-L237 HydrophobicContact CB-CD1 4.21Å; A216-L237 HydrophobicContact CB-CD2 4.12Å; A216-M315 HydrophobicContact CB-SD 4.3Å; A216-I317 HydrophobicContact CB-CD1 4.06Å
217	K	85.8	Confident	73.9	Confident	114 Å²	114	66.8 Å²	66.8	50%	0.496	35%	0.351	S	S	.	.	H	α-helix	trans	-62.2	-39.7	175.6	-170.1	174.1	-174.7	171.1	0	112	Y213 L215 T220 S221 L237	Y213-K217 HydrophobicContact CE1-CD 4.15Å; Y213-K217 WeakPolarHBondContact O-CB 3.44Å; Y213-K217 PolarHBondContact O-N 2.93Å; L215-K217 VanDerWaalsContact C-N 3.33Å; L215-K217 PolarHBondContact O-N 2.83Å; K217-T220 WeakPolarHBondContact CA-OG1 3.4Å; K217-T220 PolarHBondContact O-OG1 3.32Å; K217-S221 VanDerWaalsContact O-CB 3.23Å; K217-S221 WeakPolarHBondContact O-CB 3.31Å; K217-S221 PolarHBondContact O-N 3.26Å; K217-S221 PolarHBondContact O-OG 3.39Å; K217-L237 HydrophobicContact CB-CD2 3.96Å
218	K	80.4	Confident	71.6	Confident	102 Å²	102	69.5 Å²	69.5	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-40.7	176.9	-177.4	-176.8	174.9	-169.8	0	112.2	N214 L215 A216 S221 R222	N214-K218 WeakPolarHBondContact O-CB 3.1Å; N214-K218 PolarHBondContact O-N 2.88Å; L215-K218 WeakPolarHBondContact O-CB 3.09Å; L215-K218 PolarHBondContact O-N 3.11Å; L215-K218 VanDerWaalsContact O-N 3.14Å; A216-K218 VanDerWaalsContact C-N 3.34Å; A216-K218 PolarHBondContact O-N 3Å; K218-S221 PolarHBondContact O-OG 2.85Å; K218-R222 VanDerWaalsContact CE-NH2 3.32Å; K218-R222 WeakPolarHBondContact O-CB 3Å; K218-R222 WeakPolarHBondContact O-CD 3.13Å; K218-R222 VanDerWaalsContact O-CG 3.22Å; K218-R222 WeakPolarHBondContact O-CG 2.94Å; K218-R222 PolarHBondContact O-N 2.86Å
219	L	76	Confident	69.4	Low	33 Å²	33	72.1 Å²	72.1	17%	0.173	39%	0.388	C	S	.	.	H	α-helix	trans	-73	-41.2	-179.4	-66.7	172.9	0	0	0	111.6	I174 K177 I178 L215 A216	I174-L219 HydrophobicContact CG2-CB 4.31Å; I174-L219 HydrophobicContact CG2-CD1 4.01Å; K177-L219 HydrophobicContact CD-CD1 4.46Å; I178-L219 HydrophobicContact CG1-CD1 4.32Å; L215-L219 HydrophobicContact CD1-CD1 4.09Å; L215-L219 HydrophobicContact CD1-CG 4.34Å; L215-L219 HydrophobicContact CG-CD1 3.98Å; L215-L219 WeakPolarHBondContact O-CG 3.34Å; L215-L219 PolarHBondContact O-N 3.12Å; A216-L219 PolarHBondContact O-N 3.07Å
220	T	74.8	Confident	67.4	Low	49 Å²	49	80.8 Å²	80.8	30%	0.301	42%	0.415	S	S	.	.	H	α-helix	trans	-71.4	-37	177.4	51.9	0	0	0	0	113.2	A216 K217 R222 L237 I317	A216-T220 WeakPolarHBondContact O-CB 3.12Å; A216-T220 WeakPolarHBondContact O-CG2 3.39Å; A216-T220 PolarHBondContact O-N 3.05Å; A216-T220 PolarHBondContact O-OG1 2.85Å; K217-T220 WeakPolarHBondContact CA-OG1 3.4Å; K217-T220 PolarHBondContact O-OG1 3.32Å; T220-R222 VanDerWaalsContact C-N 3.34Å; T220-R222 PolarHBondContact O-N 3.09Å; T220-L237 HydrophobicContact CG2-CB 4.37Å; T220-I317 HydrophobicContact CG2-CD1 3.82Å; T220-I317 HydrophobicContact CG2-CG1 4.24Å; T220-I317 HydrophobicContact CG2-CG2 4.42Å
221	S	69.5	Low	65.4	Low	69 Å²	69	86.6 Å²	86.6	48%	0.483	45%	0.446	S	S	.	.	H	α-helix	trans	-72.2	-21.6	177.5	56.3	0	0	0	0	114.5	K217 K218 G223	K217-S221 VanDerWaalsContact O-CB 3.23Å; K217-S221 WeakPolarHBondContact O-CB 3.31Å; K217-S221 PolarHBondContact O-N 3.26Å; K217-S221 PolarHBondContact O-OG 3.39Å; K218-S221 PolarHBondContact O-OG 2.85Å; S221-G223 VanDerWaalsContact C-N 3.33Å; S221-G223 PolarHBondContact O-N 2.87Å
222	R	55.9	Low	63.7	Low	161 Å²	161	86.6 Å²	86.6	61%	0.608	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	1.4	-176.7	-79.8	178.1	175.2	-164.3	-8.7	115.1	K218 T220 I224	K218-R222 VanDerWaalsContact CE-NH2 3.32Å; K218-R222 WeakPolarHBondContact O-CB 3Å; K218-R222 WeakPolarHBondContact O-CD 3.13Å; K218-R222 VanDerWaalsContact O-CG 3.22Å; K218-R222 WeakPolarHBondContact O-CG 2.94Å; K218-R222 PolarHBondContact O-N 2.86Å; T220-R222 VanDerWaalsContact C-N 3.34Å; T220-R222 PolarHBondContact O-N 3.09Å; R222-I224 PolarHBondContact O-N 3.16Å
223	G	48.3	Very low	61.9	Low	39 Å²	39	95.5 Å²	95.5	40%	0.402	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	22.3	176.4	0	0	0	0	0	116.8	S221	S221-G223 VanDerWaalsContact C-N 3.33Å; S221-G223 PolarHBondContact O-N 2.87Å
224	I	44	Very low	60.3	Low	126 Å²	126	102.2 Å²	102.2	65%	0.646	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-6.5	-172	-58.9	178.9	0	0	0	114.2	R222	R222-I224 PolarHBondContact O-N 3.16Å
225	F	39.7	Very low	59.3	Low	202 Å²	202	100.8 Å²	100.8	89%	0.886	50%	0.501	S	S	*	.	S	Bend	trans	-135	47.4	-178.8	-70.4	-75.4	0	0	0	116.5
226	G	39.6	Very low	58.9	Low	37 Å²	37	105.1 Å²	105.1	38%	0.381	52%	0.523	S	S	.	.	S	Bend	trans	-152.7	157.1	170.1	0	0	0	0	0	114.4	T228 S229	G226-T228 PolarHBondContact O-N 3.24Å; G226-S229 WeakPolarHBondContact O-CB 3.49Å; G226-S229 PolarHBondContact O-N 3.05Å; G226-S229 PolarHBondContact O-OG 2.99Å; G226-S229 VanDerWaalsContact O-OG 3.05Å
227	L	42.1	Very low	58.9	Low	182 Å²	182	106.5 Å²	106.5	95%	0.953	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-11.4	178.1	-88.1	155.4	0	0	0	114.1	S229	L227-S229 PolarHBondContact O-N 2.99Å
228	T	42.8	Very low	59.1	Low	92 Å²	92	104 Å²	104	56%	0.564	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	0.4	169.3	48.2	0	0	0	0	114	G226 R230 L231	G226-T228 PolarHBondContact O-N 3.24Å; T228-R230 PolarHBondContact O-N 3.32Å; T228-L231 PolarHBondContact O-N 2.94Å; T228-L231 VanDerWaalsContact O-N 3.09Å
229	S	45.8	Very low	59.6	Low	56 Å²	56	101 Å²	101	39%	0.392	51%	0.513	S	S	.	.	H	α-helix	trans	-55.1	-19.8	179.4	52.4	0	0	0	0	116.1	G226 L227	G226-S229 WeakPolarHBondContact O-CB 3.49Å; G226-S229 PolarHBondContact O-N 3.05Å; G226-S229 PolarHBondContact O-OG 2.99Å; G226-S229 VanDerWaalsContact O-OG 3.05Å; L227-S229 PolarHBondContact O-N 2.99Å
230	R	47.8	Very low	60.3	Low	231 Å²	231	103.5 Å²	103.5	87%	0.872	52%	0.523	S	S	*	.	H	α-helix	trans	-78.3	-28.8	176	-72.6	-174.3	-178.5	175.9	0.8	113.9	T228	T228-R230 PolarHBondContact O-N 3.32Å
231	L	48.9	Very low	61.2	Low	124 Å²	124	101.4 Å²	101.4	65%	0.649	51%	0.509	S	S	*	.	H	α-helix	trans	-75.6	-27.6	-177.9	-71.2	169.7	0	0	0	112.9	T228	T228-L231 PolarHBondContact O-N 2.94Å; T228-L231 VanDerWaalsContact O-N 3.09Å
232	F	52.6	Low	62.2	Low	60 Å²	60	99 Å²	99	26%	0.263	49%	0.491	S	S	.	.	H	α-helix	trans	-105.9	-9	-170.3	-72.2	-82.6	0	0	0	115	L171 I174 E234 H235	L171-F232 HydrophobicContact CD1-CD1 4.19Å; L171-F232 HydrophobicContact CD1-CE1 3.58Å; L171-F232 HydrophobicContact CD1-CZ 4.49Å; I174-F232 HydrophobicContact CD1-CE1 3.76Å; I174-F232 HydrophobicContact CD1-CZ 3.78Å; F232-E234 PolarHBondContact O-N 3.45Å; F232-E234 VanDerWaalsContact O-N 3.09Å; F232-H235 PolarHBondContact O-N 3.08Å; F232-H235 VanDerWaalsContact O-N 3.1Å
233	K	51.7	Low	63.9	Low	186 Å²	186	92.5 Å²	92.5	81%	0.809	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.6	179.9	-155.2	175.3	-176.9	-177.7	0	113
234	E	56.7	Low	65.8	Low	165 Å²	165	91.8 Å²	91.8	77%	0.771	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-8.9	179	-63.3	-174.1	173.8	0	0	114.2	F232	F232-E234 PolarHBondContact O-N 3.45Å; F232-E234 VanDerWaalsContact O-N 3.09Å
235	H	68.6	Low	67.8	Low	54 Å²	54	86.4 Å²	86.4	25%	0.25	43%	0.429	C	S	.	.			trans	-109.3	72.5	-171.3	-62.9	-30.5	0	0	0	112.1	F232 I317 G318	F232-H235 PolarHBondContact O-N 3.08Å; F232-H235 VanDerWaalsContact O-N 3.1Å; H235-I317 HydrophobicContact CB-CG2 4.04Å; H235-G318 WeakPolarHBondContact ND1-CA 3.5Å
236	I	79.7	Confident	69.8	Low	126 Å²	126	78.6 Å²	78.6	65%	0.646	39%	0.394	S	S	*	.			trans	-74	129.4	175	-58.9	170.3	0	0	0	109.2	T238	I236-T238 HydrophobicContact CG2-CG2 4.35Å; I236-T238 PolarHBondContact O-N 2.66Å; I236-T238 VanDerWaalsContact O-N 3.15Å
237	L	87	Confident	72	Confident	28 Å²	28	78.9 Å²	78.9	15%	0.147	39%	0.39	C	S	.	.			trans	-61.3	114.4	169.9	174.7	63	0	0	0	109.2	Y213 A216 K217 T220 M315 I317	Y213-L237 HydrophobicContact CD2-CD2 4.03Å; Y213-L237 HydrophobicContact CE2-CD2 3.62Å; Y213-L237 HydrophobicContact CE2-CG 4.26Å; A216-L237 HydrophobicContact CB-CD1 4.21Å; A216-L237 HydrophobicContact CB-CD2 4.12Å; K217-L237 HydrophobicContact CB-CD2 3.96Å; T220-L237 HydrophobicContact CG2-CB 4.37Å; L237-M315 HydrophobicContact CD1-CB 4.14Å; L237-I317 HydrophobicContact CB-CG1 4.38Å; L237-I317 HydrophobicContact CD1-CD1 4.05Å; L237-I317 HydrophobicContact CD1-CG1 3.76Å
238	T	88.4	Confident	74.1	Confident	61 Å²	61	70.9 Å²	70.9	37%	0.374	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.7	178.6	54.2	0	0	0	0	110.8	I236 M315 M316	I236-T238 HydrophobicContact CG2-CG2 4.35Å; I236-T238 PolarHBondContact O-N 2.66Å; I236-T238 VanDerWaalsContact O-N 3.15Å; T238-M315 CarbonylContact O-C 3.47Å; T238-M315 WeakPolarHBondContact O-CA 3.47Å; T238-M316 PolarHBondContact N-O 3.42Å; T238-M316 PolarHBondContact O-N 3.38Å; T238-M316 WeakPolarHBondContact OG1-CE 3.29Å
239	I	91.5	Very high	75.9	Confident	40 Å²	40	69.7 Å²	69.7	21%	0.205	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.7	177.2	-66.1	171.2	0	0	0	108.9	C208 Y213 T296 C313 Q314	C208-I239 HydrophobicContact CB-CD1 4.19Å; C208-I239 HydrophobicContact CB-CG2 4.45Å; Y213-I239 HydrophobicContact CD2-CD1 4.16Å; Y213-I239 HydrophobicContact CE2-CD1 3.54Å; Y213-I239 HydrophobicContact CE2-CG1 4.06Å; I239-T296 HydrophobicContact CD1-CG2 3.7Å; I239-C313 WeakPolarHBondContact CG2-SG 3.22Å; I239-Q314 CarbonylContact C-O 3.57Å; I239-Q314 WeakPolarHBondContact CA-O 3.43Å
240	K	91.5	Very high	77.2	Confident	86 Å²	86	69.5 Å²	69.5	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.8	168.3	-74.4	-176.5	176.9	168.8	0	109.8	Q314 M316	K240-Q314 PolarHBondContact N-O 2.83Å; K240-Q314 PolarHBondContact O-N 2.67Å; K240-M316 HydrophobicContact CD-CE 3.41Å; K240-M316 VanDerWaalsContact CD-CE 3.41Å; K240-M316 HydrophobicContact CD-SD 4.04Å; K240-M316 HydrophobicContact CG-CE 3.78Å
241	W	92.9	Very high	78.1	Confident	4 Å²	4	62 Å²	62	2%	0.015	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.1	171.2	-74.8	89.7	0	0	0	110.6	M206 C208 S247 I248 M293 L298 I312 C313 Y327	M206-W241 HydrophobicContact CB-CH2 3.8Å; M206-W241 HydrophobicContact CB-CZ2 4.39Å; M206-W241 HydrophobicContact CB-CZ3 4.27Å; M206-W241 HydrophobicContact SD-CZ3 4.48Å; C208-W241 HydrophobicContact CB-CZ2 3.89Å; W241-S247 WeakPolarHBondContact O-CA 3.43Å; W241-I248 HydrophobicContact CB-CD1 4.07Å; W241-I248 HydrophobicContact CB-CG1 3.89Å; W241-I248 WeakPolarHBondContact O-CG1 3.31Å; W241-I248 PolarHBondContact O-N 3.27Å; W241-M293 HydrophobicContact CG-SD 4.3Å; W241-L298 HydrophobicContact CB-CD2 4.22Å; W241-L298 HydrophobicContact CD2-CB 3.89Å; W241-L298 HydrophobicContact CD2-CD2 3.92Å; W241-L298 HydrophobicContact CD2-CG 4.49Å; W241-L298 HydrophobicContact CE3-CB 4.47Å; W241-L298 HydrophobicContact CE3-CD2 4Å; W241-L298 HydrophobicContact CG-CB 4.14Å; W241-L298 HydrophobicContact CG-CD2 4.03Å; W241-L298 HydrophobicContact CG-CG 4.5Å; W241-L298 HydrophobicContact CZ2-CB 4.04Å; W241-I312 CarbonylContact C-O 3.44Å; W241-I312 WeakPolarHBondContact CA-O 3.46Å; W241-I312 VanDerWaalsContact CE3-C 3.47Å; W241-C313 HydrophobicContact CD2-CB 4.23Å; W241-C313 HydrophobicContact CE3-CB 4.11Å; W241-C313 HydrophobicContact CH2-CB 3.79Å; W241-C313 HydrophobicContact CZ2-CB 3.9Å; W241-C313 HydrophobicContact CZ3-CB 3.89Å; W241-Y327 AromaticContact CH2-CD2 3.94Å; W241-Y327 HydrophobicContact CH2-CD2 3.94Å; W241-Y327 AromaticContact CH2-CE2 3.94Å; W241-Y327 HydrophobicContact CH2-CE2 3.94Å; W241-Y327 AromaticContact CZ3-CD2 3.98Å; W241-Y327 HydrophobicContact CZ3-CD2 3.98Å; W241-Y327 HydrophobicContact CZ3-CE2 4.43Å
242	L	91.1	Very high	78.7	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.099	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.3	173.4	-57.1	97.9	0	0	0	110.2	G245 R246 Y311 I312 Q314	L242-G245 WeakPolarHBondContact CD2-O 3.44Å; L242-R246 CarbonylContact C-O 3.55Å; L242-R246 WeakPolarHBondContact CA-O 3.46Å; L242-Y311 CarbonylContact O-C 3.58Å; L242-Y311 VanDerWaalsContact O-CA 3.25Å; L242-Y311 WeakPolarHBondContact O-CA 3.48Å; L242-I312 HydrophobicContact CB-CB 4.49Å; L242-I312 PolarHBondContact N-O 2.88Å; L242-I312 PolarHBondContact O-N 2.83Å; L242-Q314 HydrophobicContact CD1-CB 3.35Å; L242-Q314 HydrophobicContact CD1-CG 4.3Å
243	K	90.4	Very high	78.8	Confident	24 Å²	24	56.6 Å²	56.6	10%	0.104	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.8	167.8	-176.9	-175.9	-179.3	-179.1	0	108.3	G245 R246 I248 I288 Y306 Y311	K243-G245 PolarHBondContact O-N 2.81Å; K243-G245 VanDerWaalsContact O-N 3.14Å; K243-R246 PolarHBondContact N-O 2.81Å; K243-R246 WeakPolarHBondContact O-CB 3.34Å; K243-R246 PolarHBondContact O-N 2.89Å; K243-I248 HydrophobicContact CB-CG2 3.86Å; K243-I288 HydrophobicContact CD-CD1 3.99Å; K243-Y306 PolarHBondContact NZ-O 3.36Å; K243-Y311 HydrophobicContact CB-CD1 4.19Å; K243-Y311 HydrophobicContact CB-CE1 3.84Å; K243-Y311 HydrophobicContact CD-CE1 4.09Å; K243-Y311 WeakPolarHBondContact CD-OH 3.17Å; K243-Y311 WeakPolarHBondContact CE-OH 3.24Å; K243-Y311 HydrophobicContact CG-CD1 4.44Å; K243-Y311 HydrophobicContact CG-CE1 3.83Å; K243-Y311 HydrophobicContact CG-CE2 4.47Å
244	N	89.1	Confident	78.7	Confident	25 Å²	25	55 Å²	55	13%	0.134	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	36.9	179.5	-53.4	-19	0	0	0	112.8	G309 F310 N349 G351	N244-G309 WeakPolarHBondContact OD1-CA 3.43Å; N244-F310 PolarHBondContact N-O 2.82Å; N244-F310 PolarHBondContact OD1-N 3.08Å; N244-N349 WeakPolarHBondContact CA-O 3.49Å; N244-N349 VanDerWaalsContact CB-O 3.32Å; N244-N349 WeakPolarHBondContact CB-O 2.98Å; N244-N349 VanDerWaalsContact CG-O 3.24Å; N244-N349 PolarHBondContact OD1-O 2.91Å; N244-G351 WeakPolarHBondContact O-CA 3.34Å
245	G	85.3	Confident	78.2	Confident	12 Å²	12	49.4 Å²	49.4	12%	0.124	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	1.2	-177.8	0	0	0	0	0	115.7	L242 K243	L242-G245 WeakPolarHBondContact CD2-O 3.44Å; K243-G245 PolarHBondContact O-N 2.81Å; K243-G245 VanDerWaalsContact O-N 3.14Å
246	R	83.4	Confident	77.2	Confident	38 Å²	38	50 Å²	50	14%	0.143	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130	177.1	-178.4	179.7	177.5	177.4	-0.4	111.3	L242 K243 I248 I258 F262	L242-R246 CarbonylContact C-O 3.55Å; L242-R246 WeakPolarHBondContact CA-O 3.46Å; K243-R246 PolarHBondContact N-O 2.81Å; K243-R246 WeakPolarHBondContact O-CB 3.34Å; K243-R246 PolarHBondContact O-N 2.89Å; R246-I248 PolarHBondContact O-N 2.03Å; R246-I258 VanDerWaalsContact CZ-CG2 3.47Å; R246-I258 PolarHBondContact NH2-O 3.23Å; R246-F262 VanDerWaalsContact NH2-CZ 3.32Å
247	S	85.3	Confident	75.5	Confident	43 Å²	43	47 Å²	47	30%	0.301	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	132.5	176	-172.2	0	0	0	0	111.3	W241	W241-S247 WeakPolarHBondContact O-CA 3.43Å
248	I	86.5	Confident	73.7	Confident	15 Å²	15	47.9 Å²	47.9	8%	0.077	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.7	174.2	53.8	168.7	0	0	0	109.3	W241 K243 R246 I288 F291 L298 Y311	W241-I248 HydrophobicContact CB-CD1 4.07Å; W241-I248 HydrophobicContact CB-CG1 3.89Å; W241-I248 WeakPolarHBondContact O-CG1 3.31Å; W241-I248 PolarHBondContact O-N 3.27Å; K243-I248 HydrophobicContact CB-CG2 3.86Å; R246-I248 PolarHBondContact O-N 2.03Å; I248-I288 HydrophobicContact CG2-CD1 4.05Å; I248-F291 HydrophobicContact CB-CE2 4.48Å; I248-F291 HydrophobicContact CB-CZ 3.95Å; I248-F291 HydrophobicContact CD1-CE2 4.21Å; I248-F291 HydrophobicContact CD1-CZ 4.24Å; I248-F291 HydrophobicContact CG1-CZ 4.43Å; I248-L298 HydrophobicContact CD1-CD1 4.33Å; I248-L298 HydrophobicContact CD1-CD2 4.03Å; I248-Y311 HydrophobicContact CD1-CD1 4.2Å; I248-Y311 HydrophobicContact CD1-CE1 4.01Å
249	N	80.2	Confident	71.7	Confident	66 Å²	66	47.7 Å²	47.7	35%	0.353	30%	0.297	S	S	.	.			trans	-122.1	145.9	170.2	-53.6	-69.9	0	0	0	110.3	A251 D252 F291	N249-A251 PolarHBondContact O-N 3.39Å; N249-D252 WeakPolarHBondContact CB-OD2 3.32Å; N249-D252 PolarHBondContact N-OD2 2.87Å; N249-D252 VanDerWaalsContact N-OD2 3.14Å; N249-D252 PolarHBondContact ND2-OD2 3.32Å; N249-D252 VanDerWaalsContact ND2-OD2 3.12Å; N249-D252 VanDerWaalsContact O-CB 3.25Å; N249-D252 WeakPolarHBondContact O-CB 3.01Å; N249-D252 PolarHBondContact O-N 3.34Å; N249-F291 WeakPolarHBondContact O-CZ 3.02Å
250	P	73	Confident	69.5	Low	52 Å²	52	47.7 Å²	47.7	34%	0.338	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-29.7	177.3	22.7	-31.9	0	0	0	112.5	D252 S253 F291 M293	P250-D252 PolarHBondContact O-N 2.81Å; P250-S253 WeakPolarHBondContact O-CB 3.29Å; P250-S253 PolarHBondContact O-N 2.9Å; P250-S253 VanDerWaalsContact O-N 3.09Å; P250-S253 PolarHBondContact O-OG 3.35Å; P250-F291 HydrophobicContact CB-CE2 4.33Å; P250-M293 HydrophobicContact CG-CG 4.19Å
251	A	66.1	Low	67.4	Low	75 Å²	75	52.6 Å²	52.6	62%	0.62	32%	0.323	S	S	*	.	H	α-helix	trans	-61	-26.8	172.6	0	0	0	0	0	113.1	N249 S253	N249-A251 PolarHBondContact O-N 3.39Å; A251-S253 VanDerWaalsContact C-N 3.29Å; A251-S253 PolarHBondContact O-N 3.04Å
252	D	61.1	Low	65.4	Low	31 Å²	31	55.4 Å²	55.4	17%	0.166	34%	0.335	C	S	.	.	H	α-helix	trans	-74.8	-19.9	178.4	-58.2	-42.3	0	0	0	111.9	N249 P250 N254 I258	N249-D252 WeakPolarHBondContact CB-OD2 3.32Å; N249-D252 PolarHBondContact N-OD2 2.87Å; N249-D252 VanDerWaalsContact N-OD2 3.14Å; N249-D252 PolarHBondContact ND2-OD2 3.32Å; N249-D252 VanDerWaalsContact ND2-OD2 3.12Å; N249-D252 VanDerWaalsContact O-CB 3.25Å; N249-D252 WeakPolarHBondContact O-CB 3.01Å; N249-D252 PolarHBondContact O-N 3.34Å; P250-D252 PolarHBondContact O-N 2.81Å; D252-N254 VanDerWaalsContact C-N 3.32Å; D252-N254 PolarHBondContact O-N 3.48Å; D252-I258 HydrophobicContact CB-CD1 4.05Å; D252-I258 HydrophobicContact CB-CG1 3.9Å
253	S	54.7	Low	63.3	Low	39 Å²	39	63.8 Å²	63.8	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-27.9	177.4	70.4	0	0	0	0	113.4	P250 A251	P250-S253 WeakPolarHBondContact O-CB 3.29Å; P250-S253 PolarHBondContact O-N 2.9Å; P250-S253 VanDerWaalsContact O-N 3.09Å; P250-S253 PolarHBondContact O-OG 3.35Å; A251-S253 VanDerWaalsContact C-N 3.29Å; A251-S253 PolarHBondContact O-N 3.04Å
254	N	51	Low	61.2	Low	151 Å²	151	73.8 Å²	73.8	81%	0.807	40%	0.404	S	S	*	.	H	α-helix	trans	-95.4	-15.8	179.3	-73.6	-8.7	0	0	0	113.2	D252	D252-N254 VanDerWaalsContact C-N 3.32Å; D252-N254 PolarHBondContact O-N 3.48Å
255	S	45.8	Very low	59.2	Low	49 Å²	49	76.7 Å²	76.7	34%	0.343	42%	0.423	S	S	.	.	S	Bend	trans	-97.3	112.6	178.4	73.6	0	0	0	0	109.7	S257	S255-S257 PolarHBondContact O-N 3.4Å
256	G	46.3	Very low	57.1	Low	67 Å²	67	85.6 Å²	85.6	69%	0.691	46%	0.458	S	S	*	.	S	Bend	trans	-64.1	32.6	179.6	0	0	0	0	0	116.3
257	S	45.4	Very low	55.4	Low	61 Å²	61	90.9 Å²	90.9	43%	0.427	49%	0.49	S	S	.	.			trans	-146.1	52.9	176.8	89.4	0	0	0	0	113.8	S255 S259	S255-S257 PolarHBondContact O-N 3.4Å; S257-S259 PolarHBondContact O-N 2.84Å
258	I	48.6	Very low	53.5	Low	48 Å²	48	94 Å²	94	25%	0.246	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.8	157.2	-72.6	178.4	0	0	0	109.5	R246 D252 F262 I288	R246-I258 VanDerWaalsContact CZ-CG2 3.47Å; R246-I258 PolarHBondContact NH2-O 3.23Å; D252-I258 HydrophobicContact CB-CD1 4.05Å; D252-I258 HydrophobicContact CB-CG1 3.9Å; I258-F262 WeakPolarHBondContact O-CD2 3.34Å; I258-I288 HydrophobicContact CD1-CD1 4.36Å
259	S	46.8	Very low	51.7	Low	56 Å²	56	102 Å²	102	39%	0.392	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-49.6	-179.9	53.2	0	0	0	0	114.3	S257 R261 F262 Y263	S257-S259 PolarHBondContact O-N 2.84Å; S259-R261 PolarHBondContact O-N 3.37Å; S259-F262 PolarHBondContact O-N 3.48Å; S259-Y263 PolarHBondContact O-N 3.45Å
260	G	44.6	Very low	50.5	Low	41 Å²	41	105.3 Å²	105.3	42%	0.423	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	-29.9	-170.3	0	0	0	0	0	115	F262	G260-F262 VanDerWaalsContact C-N 3.28Å; G260-F262 PolarHBondContact O-N 2.91Å
261	R	48.5	Very low	49.8	Very low	188 Å²	188	109.2 Å²	109.2	71%	0.709	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-24.2	-179.7	-135.6	179.9	-150.2	156.8	5.6	113.1	S259	S259-R261 PolarHBondContact O-N 3.37Å
262	F	50.6	Low	49.4	Very low	63 Å²	63	111.3 Å²	111.3	28%	0.276	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.2	-22.9	-170.5	-68.4	-100.7	0	0	0	112.9	R246 I258 S259 G260 R264 T265	R246-F262 VanDerWaalsContact NH2-CZ 3.32Å; I258-F262 WeakPolarHBondContact O-CD2 3.34Å; S259-F262 PolarHBondContact O-N 3.48Å; G260-F262 VanDerWaalsContact C-N 3.28Å; G260-F262 PolarHBondContact O-N 2.91Å; F262-R264 PolarHBondContact O-N 3.38Å; F262-R264 VanDerWaalsContact O-N 3.1Å; F262-T265 PolarHBondContact O-N 2.86Å; F262-T265 PolarHBondContact O-OG1 3.4Å; F262-T265 VanDerWaalsContact O-OG1 3.13Å
263	Y	47.3	Very low	49.8	Very low	195 Å²	195	111.4 Å²	111.4	77%	0.765	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-17.1	175.5	-155.2	-96.3	0	0	0	113.2	S259 T265	S259-Y263 PolarHBondContact O-N 3.45Å; Y263-T265 VanDerWaalsContact C-N 3.34Å; Y263-T265 PolarHBondContact O-N 3.13Å
264	R	45.4	Very low	51	Low	235 Å²	235	115.4 Å²	115.4	89%	0.887	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-2.8	-179.4	-79.6	-171.7	174.7	-176.4	-0.3	115.3	F262	F262-R264 PolarHBondContact O-N 3.38Å; F262-R264 VanDerWaalsContact O-N 3.1Å
265	T	47.3	Very low	52.3	Low	86 Å²	86	109.4 Å²	109.4	53%	0.528	56%	0.557	S	S	.	*	S	Bend	trans	-96.2	104.6	-179.5	52.3	0	0	0	0	113.5	F262 Y263	F262-T265 PolarHBondContact O-N 2.86Å; F262-T265 PolarHBondContact O-OG1 3.4Å; F262-T265 VanDerWaalsContact O-OG1 3.13Å; Y263-T265 VanDerWaalsContact C-N 3.34Å; Y263-T265 PolarHBondContact O-N 3.13Å
266	K	41.4	Very low	54	Low	198 Å²	198	108.5 Å²	108.5	86%	0.861	55%	0.546	S	S	*	.			trans	78.2	131.8	155.1	-68.1	-175.6	176.4	178.3	0	120.2
267	N	47.2	Very low	55.4	Low	150 Å²	150	109.7 Å²	109.7	80%	0.802	54%	0.537	S	S	*	.			trans	-58.6	148.8	173.8	-78.7	-17.3	0	0	0	114.1	K269	N267-K269 PolarHBondContact O-N 3.35Å
268	P	45.7	Very low	57	Low	109 Å²	109	108.2 Å²	108.2	71%	0.708	52%	0.523	S	S	*	.			trans	-72.3	110.7	-174.5	27.5	-32.5	0	0	0	113.4	N273	P268-N273 WeakPolarHBondContact CA-ND2 3.44Å
269	K	49.8	Very low	58.5	Low	182 Å²	182	106.5 Å²	106.5	79%	0.791	52%	0.515	S	S	*	.			trans	-127.7	119.5	158.4	-71.7	-173.4	178.8	-177.4	0	107.4	N267	N267-K269 PolarHBondContact O-N 3.35Å
270	N	53.7	Low	59.8	Low	135 Å²	135	104.9 Å²	104.9	72%	0.722	50%	0.501	S	S	*	.	S	Bend	trans	83.9	162.2	161.9	-131.3	-2.7	0	0	0	118.5	Q272 N273	N270-Q272 PolarHBondContact O-N 3.49Å; N270-N273 PolarHBondContact O-N 2.94Å
271	N	57.7	Low	61.3	Low	135 Å²	135	108.4 Å²	108.4	72%	0.722	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-22.2	179.4	-87.4	-15	0	0	0	115	N273 K274	N271-N273 PolarHBondContact O-N 3.44Å; N271-K274 PolarHBondContact O-N 3.38Å
272	Q	59.1	Low	62.3	Low	118 Å²	118	103 Å²	103	55%	0.551	48%	0.484	S	S	*	.	H	α-helix	trans	-60	-28.4	174.4	-73.9	177.2	-26.2	0	0	112.2	N270 F276 Y352	N270-Q272 PolarHBondContact O-N 3.49Å; Q272-F276 PolarHBondContact O-N 2.84Å; Q272-Y352 WeakPolarHBondContact O-CE2 3.44Å
273	N	68.8	Low	63	Low	34 Å²	34	103.1 Å²	103.1	18%	0.182	49%	0.488	C	S	.	.	H	α-helix	trans	-78.2	-32.4	-179.7	-70.5	22.3	0	0	0	112	P268 N270 N271 L275 F276 D277	P268-N273 WeakPolarHBondContact CA-ND2 3.44Å; N270-N273 PolarHBondContact O-N 2.94Å; N271-N273 PolarHBondContact O-N 3.44Å; N273-L275 VanDerWaalsContact C-N 3.29Å; N273-L275 PolarHBondContact O-N 3.3Å; N273-F276 CarbonylContact O-C 3.58Å; N273-F276 WeakPolarHBondContact O-CB 3.47Å; N273-F276 PolarHBondContact O-N 3.18Å; N273-F276 VanDerWaalsContact O-N 3.08Å; N273-D277 WeakPolarHBondContact O-CB 3.31Å; N273-D277 PolarHBondContact O-N 2.92Å
274	K	79	Confident	63.4	Low	122 Å²	122	98.6 Å²	98.6	53%	0.53	48%	0.476	S	S	.	.	H	α-helix	trans	-59	-41	177	-172.2	178.7	-177.9	-177	0	112.2	N271 E278 Y345	N271-K274 PolarHBondContact O-N 3.38Å; K274-E278 VanDerWaalsContact O-CB 3.32Å; K274-E278 WeakPolarHBondContact O-CB 3.5Å; K274-E278 PolarHBondContact O-N 3.02Å; K274-Y345 WeakPolarHBondContact CE-OH 3.37Å
275	L	80	Confident	63.9	Low	26 Å²	26	93 Å²	93	14%	0.136	46%	0.463	C	S	.	.	H	α-helix	trans	-72	-33.7	177.4	-66.1	177.7	0	0	0	112.3	N273 E279 Y345 L385 N386 I389	N273-L275 VanDerWaalsContact C-N 3.29Å; N273-L275 PolarHBondContact O-N 3.3Å; L275-E279 WeakPolarHBondContact O-CB 3.34Å; L275-E279 PolarHBondContact O-N 3.27Å; L275-Y345 HydrophobicContact CD2-CD1 4.42Å; L275-Y345 HydrophobicContact CD2-CE1 3.9Å; L275-L385 HydrophobicContact CD1-CD2 4.16Å; L275-L385 HydrophobicContact CD1-CG 4.1Å; L275-N386 HydrophobicContact CD1-CB 4.43Å; L275-I389 HydrophobicContact CD2-CB 4.36Å; L275-I389 HydrophobicContact CD2-CG2 3.99Å
276	F	79.9	Confident	64.4	Low	29 Å²	29	90.7 Å²	90.7	13%	0.127	45%	0.45	C	S	.	.	H	α-helix	trans	-65.9	-48.2	173	177.7	-99.3	0	0	0	111.4	Q272 N273 E278 E279 M280 Y352 F353	Q272-F276 PolarHBondContact O-N 2.84Å; N273-F276 CarbonylContact O-C 3.58Å; N273-F276 WeakPolarHBondContact O-CB 3.47Å; N273-F276 PolarHBondContact O-N 3.18Å; N273-F276 VanDerWaalsContact O-N 3.08Å; F276-E278 VanDerWaalsContact C-N 3.27Å; F276-E278 PolarHBondContact O-N 3Å; F276-E279 PolarHBondContact O-N 3.37Å; F276-M280 HydrophobicContact CD1-CG 4.23Å; F276-M280 HydrophobicContact CD2-CE 4.22Å; F276-M280 HydrophobicContact CE1-CE 4.38Å; F276-M280 HydrophobicContact CE1-CG 3.88Å; F276-M280 HydrophobicContact CE2-CE 3.42Å; F276-M280 VanDerWaalsContact CE2-CE 3.42Å; F276-M280 HydrophobicContact CE2-CG 4.37Å; F276-M280 HydrophobicContact CZ-CE 3.52Å; F276-M280 HydrophobicContact CZ-CG 3.97Å; F276-M280 HydrophobicContact CZ-SD 4.38Å; F276-M280 WeakPolarHBondContact O-CB 3.47Å; F276-M280 WeakPolarHBondContact O-CG 3.22Å; F276-M280 PolarHBondContact O-N 3.45Å; F276-Y352 HydrophobicContact CB-CD2 3.95Å; F276-Y352 HydrophobicContact CB-CE2 3.69Å; F276-Y352 AromaticContact CD2-CD1 3.94Å; F276-Y352 HydrophobicContact CD2-CD1 3.94Å; F276-Y352 HydrophobicContact CD2-CD2 4.26Å; F276-Y352 HydrophobicContact CD2-CE1 4.05Å; F276-Y352 HydrophobicContact CD2-CE2 4.34Å; F276-Y352 HydrophobicContact CD2-CG 4.09Å; F276-F353 HydrophobicContact CE2-CE2 4.29Å; F276-F353 AromaticContact CE2-CZ 3.86Å; F276-F353 HydrophobicContact CE2-CZ 3.86Å
277	D	77	Confident	65.5	Low	92 Å²	92	88.6 Å²	88.6	49%	0.492	44%	0.443	S	S	.	.	H	α-helix	trans	-60.3	-40.4	177.2	-63.8	-27.1	0	0	0	110.8	N273 M280 K281	N273-D277 WeakPolarHBondContact O-CB 3.31Å; N273-D277 PolarHBondContact O-N 2.92Å; D277-M280 PolarHBondContact O-N 3.45Å; D277-K281 WeakPolarHBondContact O-CB 3.35Å; D277-K281 PolarHBondContact O-N 3.27Å
278	E	78.8	Confident	66.7	Low	30 Å²	30	83.1 Å²	83.1	14%	0.14	41%	0.413	C	S	.	.	H	α-helix	trans	-67.8	-44.4	175.5	-169.5	71.1	-153.9	0	0	111.1	K274 F276 M280 K281 W282 Y345 Y347	K274-E278 VanDerWaalsContact O-CB 3.32Å; K274-E278 WeakPolarHBondContact O-CB 3.5Å; K274-E278 PolarHBondContact O-N 3.02Å; F276-E278 VanDerWaalsContact C-N 3.27Å; F276-E278 PolarHBondContact O-N 3Å; E278-M280 VanDerWaalsContact C-N 3.27Å; E278-M280 PolarHBondContact O-N 3.42Å; E278-K281 WeakPolarHBondContact O-CB 3.41Å; E278-K281 PolarHBondContact O-N 3.2Å; E278-K281 VanDerWaalsContact O-N 3.15Å; E278-W282 VanDerWaalsContact O-CD1 3.23Å; E278-W282 PolarHBondContact O-N 2.96Å; E278-W282 PolarHBondContact OE1-NE1 2.87Å; E278-Y345 HydrophobicContact CG-CD1 4.33Å; E278-Y345 HydrophobicContact CG-CD2 3.74Å; E278-Y345 HydrophobicContact CG-CE1 4.3Å; E278-Y345 HydrophobicContact CG-CE2 3.74Å; E278-Y345 HydrophobicContact CG-CG 4.04Å; E278-Y347 WeakPolarHBondContact CG-OH 3.32Å
279	E	79.1	Confident	68.4	Low	13 Å²	13	78.9 Å²	78.9	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-58.2	-41.8	172.5	-174.4	-173.4	-137.1	0	0	111.6	L275 F276 W282 N283 G351 Y352 I389	L275-E279 WeakPolarHBondContact O-CB 3.34Å; L275-E279 PolarHBondContact O-N 3.27Å; F276-E279 PolarHBondContact O-N 3.37Å; E279-W282 PolarHBondContact O-N 2.82Å; E279-N283 WeakPolarHBondContact O-CB 3.35Å; E279-N283 VanDerWaalsContact O-CG 3.28Å; E279-N283 PolarHBondContact O-N 2.03Å; E279-N283 PolarHBondContact O-ND2 3.42Å; E279-N283 VanDerWaalsContact O-ND2 3.09Å; E279-G351 WeakPolarHBondContact OE1-CA 3.32Å; E279-Y352 PolarHBondContact OE1-N 3.26Å; E279-Y352 WeakPolarHBondContact OE2-CB 3.43Å; E279-I389 HydrophobicContact CB-CD1 4.01Å; E279-I389 HydrophobicContact CG-CD1 4.44Å
280	M	74.3	Confident	70	Confident	21 Å²	21	74 Å²	74	10%	0.103	38%	0.375	C	S	.	.	H	α-helix	trans	-62.4	-44.1	175.2	-71.7	-61.4	150.3	0	0	111	F276 D277 E278 W282 N283 L284 F353	F276-M280 HydrophobicContact CD1-CG 4.23Å; F276-M280 HydrophobicContact CD2-CE 4.22Å; F276-M280 HydrophobicContact CE1-CE 4.38Å; F276-M280 HydrophobicContact CE1-CG 3.88Å; F276-M280 HydrophobicContact CE2-CE 3.42Å; F276-M280 VanDerWaalsContact CE2-CE 3.42Å; F276-M280 HydrophobicContact CE2-CG 4.37Å; F276-M280 HydrophobicContact CZ-CE 3.52Å; F276-M280 HydrophobicContact CZ-CG 3.97Å; F276-M280 HydrophobicContact CZ-SD 4.38Å; F276-M280 WeakPolarHBondContact O-CB 3.47Å; F276-M280 WeakPolarHBondContact O-CG 3.22Å; F276-M280 PolarHBondContact O-N 3.45Å; D277-M280 PolarHBondContact O-N 3.45Å; E278-M280 VanDerWaalsContact C-N 3.27Å; E278-M280 PolarHBondContact O-N 3.42Å; M280-W282 VanDerWaalsContact C-N 3.34Å; M280-W282 PolarHBondContact O-N 3.38Å; M280-N283 CarbonylContact O-C 3.58Å; M280-N283 PolarHBondContact O-N 3.36Å; M280-N283 VanDerWaalsContact O-N 3.09Å; M280-L284 WeakPolarHBondContact O-CB 3.34Å; M280-L284 WeakPolarHBondContact O-CG 3.3Å; M280-L284 PolarHBondContact O-N 2.89Å; M280-F353 HydrophobicContact CE-CE2 4.32Å
281	K	76.5	Confident	71.6	Confident	115 Å²	115	68 Å²	68	50%	0.5	34%	0.343	S	S	.	.	H	α-helix	trans	-57.3	-44.3	174.8	-175.5	-175.8	174.8	-169.4	0	112.3	D277 E278 N283 L284 L285	D277-K281 WeakPolarHBondContact O-CB 3.35Å; D277-K281 PolarHBondContact O-N 3.27Å; E278-K281 WeakPolarHBondContact O-CB 3.41Å; E278-K281 PolarHBondContact O-N 3.2Å; E278-K281 VanDerWaalsContact O-N 3.15Å; K281-N283 VanDerWaalsContact C-N 3.3Å; K281-N283 PolarHBondContact O-N 3.11Å; K281-L284 PolarHBondContact O-N 2.94Å; K281-L285 WeakPolarHBondContact O-CG 3.33Å; K281-L285 PolarHBondContact O-N 2.89Å
282	W	70.1	Confident	73.1	Confident	76 Å²	76	66.9 Å²	66.9	29%	0.288	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-35.1	175.7	-82.7	79.1	0	0	0	112.8	E278 E279 M280 Y336 Y347	E278-W282 VanDerWaalsContact O-CD1 3.23Å; E278-W282 PolarHBondContact O-N 2.96Å; E278-W282 PolarHBondContact OE1-NE1 2.87Å; E279-W282 PolarHBondContact O-N 2.82Å; M280-W282 VanDerWaalsContact C-N 3.34Å; M280-W282 PolarHBondContact O-N 3.38Å; W282-Y336 HydrophobicContact CH2-CD1 4.46Å; W282-Y336 HydrophobicContact CH2-CE1 4.01Å; W282-Y336 AromaticContact CZ3-CE1 3.9Å; W282-Y336 HydrophobicContact CZ3-CE1 3.9Å; W282-Y347 AromaticContact CD1-CE2 3.67Å; W282-Y347 AromaticContact CD1-CZ 3.34Å; W282-Y347 HydrophobicContact CD2-CD2 4.25Å; W282-Y347 AromaticContact CD2-CE2 3.62Å; W282-Y347 HydrophobicContact CD2-CE2 3.62Å; W282-Y347 AromaticContact CD2-CZ 4Å; W282-Y347 AromaticContact CE2-CE2 3.31Å; W282-Y347 AromaticContact CE2-CZ 3.87Å; W282-Y347 HydrophobicContact CE3-CE2 4.38Å; W282-Y347 HydrophobicContact CG-CE1 4.31Å; W282-Y347 AromaticContact CG-CE2 3.8Å; W282-Y347 HydrophobicContact CG-CE2 3.8Å; W282-Y347 AromaticContact CG-CZ 3.64Å; W282-Y347 HydrophobicContact CZ2-CD2 4.43Å; W282-Y347 AromaticContact CZ2-CE2 3.81Å; W282-Y347 HydrophobicContact CZ2-CE2 3.81Å; W282-Y347 AromaticContact NE1-CE2 3.35Å; W282-Y347 VanDerWaalsContact NE1-CE2 3.35Å; W282-Y347 AromaticContact NE1-CZ 3.46Å; W282-Y347 PolarHBondContact NE1-OH 2.9Å
283	N	64.8	Low	74.5	Confident	64 Å²	64	64.2 Å²	64.2	34%	0.342	32%	0.318	S	S	.	.	H	α-helix	trans	-78.6	-20.9	175.5	-68.9	-36.5	0	0	0	113.9	E279 M280 K281 L285	E279-N283 WeakPolarHBondContact O-CB 3.35Å; E279-N283 VanDerWaalsContact O-CG 3.28Å; E279-N283 PolarHBondContact O-N 2.03Å; E279-N283 PolarHBondContact O-ND2 3.42Å; E279-N283 VanDerWaalsContact O-ND2 3.09Å; M280-N283 CarbonylContact O-C 3.58Å; M280-N283 PolarHBondContact O-N 3.36Å; M280-N283 VanDerWaalsContact O-N 3.09Å; K281-N283 VanDerWaalsContact C-N 3.3Å; K281-N283 PolarHBondContact O-N 3.11Å; N283-L285 VanDerWaalsContact C-N 3.31Å
284	L	55.7	Low	75.2	Confident	100 Å²	100	66.5 Å²	66.5	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-77.8	-16.8	177.4	-75	167.4	0	0	0	112.6	M280 K281	M280-L284 WeakPolarHBondContact O-CB 3.34Å; M280-L284 WeakPolarHBondContact O-CG 3.3Å; M280-L284 PolarHBondContact O-N 2.89Å; K281-L284 PolarHBondContact O-N 2.94Å
285	L	55.9	Low	75.5	Confident	118 Å²	118	67.8 Å²	67.8	62%	0.618	34%	0.34	S	S	*	.	S	Bend	trans	-74.9	-29.2	-175.1	-73.3	162.2	0	0	0	113.3	K281 N283	K281-L285 WeakPolarHBondContact O-CG 3.33Å; K281-L285 PolarHBondContact O-N 2.89Å; N283-L285 VanDerWaalsContact C-N 3.31Å
286	P	58.5	Low	75.9	Confident	38 Å²	38	67 Å²	67	25%	0.247	34%	0.336	C	S	.	.			trans	-153.5	154.1	173.8	29.2	-4.4	0	0	0	117.6	Y306	P286-Y306 HydrophobicContact CB-CD1 3.9Å; P286-Y306 HydrophobicContact CB-CD2 3.39Å; P286-Y306 HydrophobicContact CB-CE1 4.05Å; P286-Y306 HydrophobicContact CB-CE2 3.57Å; P286-Y306 HydrophobicContact CB-CG 3.54Å; P286-Y306 HydrophobicContact CG-CD1 3.1Å; P286-Y306 HydrophobicContact CG-CD2 3.64Å; P286-Y306 HydrophobicContact CG-CE1 3.38Å; P286-Y306 HydrophobicContact CG-CE2 3.88Å; P286-Y306 HydrophobicContact CG-CG 3.21Å
287	E	63.9	Low	76.4	Confident	154 Å²	154	68.8 Å²	68.8	72%	0.72	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-75.4	140	173.7	-65.4	177.2	169.5	0	0	111.6
288	I	72.3	Confident	77.2	Confident	34 Å²	34	64.4 Å²	64.4	17%	0.174	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-62.3	141.4	171.9	-57.2	174.3	0	0	0	107.8	K243 I248 I258 F291 F300 D307	K243-I288 HydrophobicContact CD-CD1 3.99Å; I248-I288 HydrophobicContact CG2-CD1 4.05Å; I258-I288 HydrophobicContact CD1-CD1 4.36Å; I288-F291 HydrophobicContact CG2-CD1 3.81Å; I288-F291 HydrophobicContact CG2-CE1 3.93Å; I288-F300 HydrophobicContact CG2-CE1 4.03Å; I288-D307 WeakPolarHBondContact CG2-OD1 3.09Å
289	S	80.8	Confident	77.8	Confident	20 Å²	20	63.4 Å²	63.4	14%	0.14	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-59.2	157.6	175.9	67	0	0	0	0	111.6	F291 F300 S302 D307	S289-F291 WeakPolarHBondContact O-CD1 3.46Å; S289-F291 PolarHBondContact O-N 2.04Å; S289-F291 VanDerWaalsContact O-N 3.13Å; S289-F300 WeakPolarHBondContact OG-CD1 3.17Å; S289-S302 PolarHBondContact OG-O 3Å; S289-D307 WeakPolarHBondContact CB-OD2 3.48Å; S289-D307 PolarHBondContact N-OD1 3.46Å; S289-D307 PolarHBondContact OG-OD1 2.85Å; S289-D307 PolarHBondContact OG-OD2 3.48Å
290	S	83.2	Confident	78.4	Confident	80 Å²	80	62.8 Å²	62.8	56%	0.559	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-57.1	121.9	176.5	60.8	0	0	0	0	109.9	P301	S290-P301 VanDerWaalsContact O-CD 3.23Å; S290-P301 WeakPolarHBondContact O-CD 3.42Å
291	F	89.3	Confident	79.2	Confident	10 Å²	10	64.6 Å²	64.6	4%	0.044	33%	0.326	C	S	.	.			trans	-129.9	155.8	176.1	66.5	-90.8	0	0	0	109.8	I248 N249 P250 I288 S289 L298 V299 F300	I248-F291 HydrophobicContact CB-CE2 4.48Å; I248-F291 HydrophobicContact CB-CZ 3.95Å; I248-F291 HydrophobicContact CD1-CE2 4.21Å; I248-F291 HydrophobicContact CD1-CZ 4.24Å; I248-F291 HydrophobicContact CG1-CZ 4.43Å; N249-F291 WeakPolarHBondContact O-CZ 3.02Å; P250-F291 HydrophobicContact CB-CE2 4.33Å; I288-F291 HydrophobicContact CG2-CD1 3.81Å; I288-F291 HydrophobicContact CG2-CE1 3.93Å; S289-F291 WeakPolarHBondContact O-CD1 3.46Å; S289-F291 PolarHBondContact O-N 2.04Å; S289-F291 VanDerWaalsContact O-N 3.13Å; F291-L298 HydrophobicContact CB-CD1 4.5Å; F291-L298 HydrophobicContact CD2-CD1 3.58Å; F291-L298 HydrophobicContact CE2-CD1 4.19Å; F291-L298 HydrophobicContact CG-CD1 4.3Å; F291-V299 WeakPolarHBondContact CA-O 3.41Å; F291-V299 WeakPolarHBondContact CB-O 3.44Å; F291-F300 HydrophobicContact CB-CD1 3.69Å; F291-F300 HydrophobicContact CB-CE1 3.58Å; F291-F300 HydrophobicContact CB-CG 4.24Å; F291-F300 HydrophobicContact CB-CZ 4.03Å; F291-F300 HydrophobicContact CD1-CE1 4.05Å; F291-F300 HydrophobicContact CD1-CZ 4.44Å; F291-F300 HydrophobicContact CG-CE1 4.06Å; F291-F300 HydrophobicContact CG-CZ 4.28Å
292	Y	89.1	Confident	79.8	Confident	110 Å²	110	61.7 Å²	61.7	43%	0.431	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	161.9	175.7	65.9	-88.3	0	0	0	111.1	E294 V299 P301	Y292-E294 HydrophobicContact CE2-CB 4.37Å; Y292-V299 HydrophobicContact CD1-CB 4.38Å; Y292-V299 HydrophobicContact CD2-CB 4.3Å; Y292-V299 HydrophobicContact CE1-CB 3.93Å; Y292-V299 HydrophobicContact CE1-CG1 3.8Å; Y292-V299 HydrophobicContact CE2-CB 3.85Å; Y292-V299 HydrophobicContact CE2-CG1 4.26Å; Y292-V299 HydrophobicContact CE2-CG2 4.06Å; Y292-V299 PolarHBondContact N-O 3.38Å; Y292-V299 PolarHBondContact O-N 3.11Å; Y292-V299 WeakPolarHBondContact OH-CG1 3.41Å; Y292-P301 HydrophobicContact CE1-CG 4.41Å
293	M	87.8	Confident	80.9	Confident	63 Å²	63	58.1 Å²	58.1	31%	0.31	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127	180	-73	-63.4	-52	0	0	108.9	W241 P250 Y297 L298	W241-M293 HydrophobicContact CG-SD 4.3Å; P250-M293 HydrophobicContact CG-CG 4.19Å; M293-Y297 WeakPolarHBondContact CA-O 3.34Å; M293-Y297 WeakPolarHBondContact CE-O 3.4Å; M293-L298 HydrophobicContact SD-CB 4.04Å; M293-L298 HydrophobicContact SD-CD1 3.6Å; M293-L298 HydrophobicContact SD-CG 4.44Å
294	E	83.4	Confident	82.1	Confident	81 Å²	81	58 Å²	58	38%	0.379	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	96.8	173.8	-177.3	-178.4	-150.5	0	0	107.6	R205 Y292 T296 Y297	R205-E294 IonicContact CZ-OE2 2.88Å; R205-E294 IonicContact NH1-OE2 2.78Å; R205-E294 PolarHBondContact NH1-OE2 3.21Å; R205-E294 IonicContact NH2-OE2 3.76Å; R205-E294 PolarHBondContact NH2-OE2 2.91Å; Y292-E294 HydrophobicContact CE2-CB 4.37Å; E294-T296 PolarHBondContact O-N 2.97Å; E294-Y297 PolarHBondContact N-O 3.24Å; E294-Y297 WeakPolarHBondContact O-CB 3.36Å; E294-Y297 WeakPolarHBondContact O-CD2 2.84Å; E294-Y297 PolarHBondContact O-N 2.88Å
295	D	84.2	Confident	83.7	Confident	149 Å²	149	58.8 Å²	58.8	80%	0.797	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	-99.6	-173.7	-61.1	-36.7	0	0	0	113.6
296	T	88.8	Confident	85.1	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-10.4	178.4	59.8	0	0	0	0	113.2	D207 C208 V209 Y213 I239 E294	D207-T296 PolarHBondContact OD1-OG1 2.83Å; D207-T296 VanDerWaalsContact OD1-OG1 3.05Å; C208-T296 VanDerWaalsContact CB-O 3.3Å; C208-T296 WeakPolarHBondContact CB-O 3.23Å; C208-T296 PolarHBondContact N-O 2.98Å; V209-T296 HydrophobicContact CG2-CG2 3.92Å; V209-T296 WeakPolarHBondContact CG2-OG1 3.49Å; Y213-T296 HydrophobicContact CE1-CG2 3.85Å; Y213-T296 HydrophobicContact CE2-CG2 4.36Å; Y213-T296 WeakPolarHBondContact OH-CG2 3.16Å; I239-T296 HydrophobicContact CD1-CG2 3.7Å; E294-T296 PolarHBondContact O-N 2.97Å
297	Y	91.8	Very high	86.6	Confident	65 Å²	65	57.4 Å²	57.4	26%	0.255	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	138.1	-173.6	-62.8	-84	0	0	0	112.3	R205 M206 D207 M293 E294	R205-Y297 HydrophobicContact CG-CD1 3.64Å; R205-Y297 HydrophobicContact CG-CE1 4.34Å; R205-Y297 HydrophobicContact CG-CG 4.31Å; R205-Y297 VanDerWaalsContact NH2-CE2 3.27Å; R205-Y297 VanDerWaalsContact NH2-CG 3.3Å; M206-Y297 CarbonylContact O-C 3.48Å; M206-Y297 VanDerWaalsContact O-CA 3.23Å; M206-Y297 WeakPolarHBondContact O-CA 3.41Å; D207-Y297 HydrophobicContact CB-CD1 3.75Å; D207-Y297 HydrophobicContact CB-CE1 3.44Å; D207-Y297 VanDerWaalsContact CB-CE1 3.44Å; D207-Y297 WeakPolarHBondContact OD2-CE1 3.16Å; D207-Y297 PolarHBondContact OD2-OH 2.84Å; M293-Y297 WeakPolarHBondContact CA-O 3.34Å; M293-Y297 WeakPolarHBondContact CE-O 3.4Å; E294-Y297 PolarHBondContact N-O 3.24Å; E294-Y297 WeakPolarHBondContact O-CB 3.36Å; E294-Y297 WeakPolarHBondContact O-CD2 2.84Å; E294-Y297 PolarHBondContact O-N 2.88Å
298	L	93	Very high	87.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.9	163.9	177.5	66.7	0	0	0	108.5	M206 W241 I248 F291 M293 F300 Y311	M206-L298 HydrophobicContact CB-CB 4.44Å; M206-L298 PolarHBondContact N-O 3.13Å; M206-L298 PolarHBondContact O-N 3.01Å; M206-L298 HydrophobicContact SD-CD2 4.33Å; W241-L298 HydrophobicContact CB-CD2 4.22Å; W241-L298 HydrophobicContact CD2-CB 3.89Å; W241-L298 HydrophobicContact CD2-CD2 3.92Å; W241-L298 HydrophobicContact CD2-CG 4.49Å; W241-L298 HydrophobicContact CE3-CB 4.47Å; W241-L298 HydrophobicContact CE3-CD2 4Å; W241-L298 HydrophobicContact CG-CB 4.14Å; W241-L298 HydrophobicContact CG-CD2 4.03Å; W241-L298 HydrophobicContact CG-CG 4.5Å; W241-L298 HydrophobicContact CZ2-CB 4.04Å; I248-L298 HydrophobicContact CD1-CD1 4.33Å; I248-L298 HydrophobicContact CD1-CD2 4.03Å; F291-L298 HydrophobicContact CB-CD1 4.5Å; F291-L298 HydrophobicContact CD2-CD1 3.58Å; F291-L298 HydrophobicContact CE2-CD1 4.19Å; F291-L298 HydrophobicContact CG-CD1 4.3Å; M293-L298 HydrophobicContact SD-CB 4.04Å; M293-L298 HydrophobicContact SD-CD1 3.6Å; M293-L298 HydrophobicContact SD-CG 4.44Å; L298-F300 HydrophobicContact CD1-CE2 4.39Å; L298-F300 HydrophobicContact CD2-CE2 3.76Å; L298-F300 HydrophobicContact CD2-CZ 4.38Å; L298-F300 HydrophobicContact CG-CD2 4.42Å; L298-F300 HydrophobicContact CG-CE2 3.85Å; L298-Y311 HydrophobicContact CD2-CD1 3.74Å; L298-Y311 HydrophobicContact CD2-CE1 4.18Å
299	V	92	Very high	88.8	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.055	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.8	-174.4	-171.5	0	0	0	0	111.2	V204 R205 F291 Y292	V204-V299 WeakPolarHBondContact O-CA 3.35Å; R205-V299 HydrophobicContact CG-CG2 4.16Å; F291-V299 WeakPolarHBondContact CA-O 3.41Å; F291-V299 WeakPolarHBondContact CB-O 3.44Å; Y292-V299 HydrophobicContact CD1-CB 4.38Å; Y292-V299 HydrophobicContact CD2-CB 4.3Å; Y292-V299 HydrophobicContact CE1-CB 3.93Å; Y292-V299 HydrophobicContact CE1-CG1 3.8Å; Y292-V299 HydrophobicContact CE2-CB 3.85Å; Y292-V299 HydrophobicContact CE2-CG1 4.26Å; Y292-V299 HydrophobicContact CE2-CG2 4.06Å; Y292-V299 PolarHBondContact N-O 3.38Å; Y292-V299 PolarHBondContact O-N 3.11Å; Y292-V299 WeakPolarHBondContact OH-CG1 3.41Å
300	F	92	Very high	89.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	107.3	167.6	-69.8	-89.1	0	0	0	108.2	S203 V204 I288 S289 F291 L298 S302 I303 Y311	S203-F300 CarbonylContact C-O 3.58Å; S203-F300 WeakPolarHBondContact CA-O 3.46Å; V204-F300 HydrophobicContact CB-CB 4.5Å; V204-F300 PolarHBondContact N-O 2.94Å; V204-F300 PolarHBondContact O-N 3.3Å; I288-F300 HydrophobicContact CG2-CE1 4.03Å; S289-F300 WeakPolarHBondContact OG-CD1 3.17Å; F291-F300 HydrophobicContact CB-CD1 3.69Å; F291-F300 HydrophobicContact CB-CE1 3.58Å; F291-F300 HydrophobicContact CB-CG 4.24Å; F291-F300 HydrophobicContact CB-CZ 4.03Å; F291-F300 HydrophobicContact CD1-CE1 4.05Å; F291-F300 HydrophobicContact CD1-CZ 4.44Å; F291-F300 HydrophobicContact CG-CE1 4.06Å; F291-F300 HydrophobicContact CG-CZ 4.28Å; L298-F300 HydrophobicContact CD1-CE2 4.39Å; L298-F300 HydrophobicContact CD2-CE2 3.76Å; L298-F300 HydrophobicContact CD2-CZ 4.38Å; L298-F300 HydrophobicContact CG-CD2 4.42Å; L298-F300 HydrophobicContact CG-CE2 3.85Å; F300-S302 VanDerWaalsContact C-N 3.34Å; F300-I303 HydrophobicContact CB-CD1 4.3Å; F300-I303 HydrophobicContact CB-CG1 3.66Å; F300-I303 HydrophobicContact CG-CG1 4.29Å; F300-Y311 HydrophobicContact CE2-CE1 4.03Å; F300-Y311 AromaticContact CZ-CE1 3.79Å; F300-Y311 HydrophobicContact CZ-CE1 3.79Å; F300-Y311 AromaticContact CZ-CZ 3.9Å
301	P	90.1	Very high	89.9	Confident	60 Å²	60	44.5 Å²	44.5	39%	0.39	21%	0.213	S	C	.	.	S	Bend	trans	-64.8	-36.9	177	24.3	-33.4	0	0	0	112.5	S203 S290 Y292	S203-P301 WeakPolarHBondContact CA-O 3.13Å; S203-P301 WeakPolarHBondContact CB-O 3.41Å; S290-P301 VanDerWaalsContact O-CD 3.23Å; S290-P301 WeakPolarHBondContact O-CD 3.42Å; Y292-P301 HydrophobicContact CE1-CG 4.41Å
302	S	89.6	Confident	90.1	Very high	54 Å²	54	44.2 Å²	44.2	38%	0.378	21%	0.212	S	C	.	.	S	Bend	trans	-146.3	117.4	176	170.8	0	0	0	0	109.9	S289 F300	S289-S302 PolarHBondContact OG-O 3Å; F300-S302 VanDerWaalsContact C-N 3.34Å
303	I	91.9	Very high	90.4	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.191	C	C	.	.			trans	-86.3	142.8	-177.1	-69	160.5	0	0	0	111.9	V200 K201 Q202 V204 F300 D307 L329 I331	V200-I303 WeakPolarHBondContact CA-O 3.39Å; V200-I303 WeakPolarHBondContact CG1-O 3.41Å; K201-I303 PolarHBondContact N-O 3.35Å; Q202-I303 VanDerWaalsContact O-CD1 3.31Å; Q202-I303 WeakPolarHBondContact O-CD1 3.48Å; Q202-I303 WeakPolarHBondContact O-CG1 3.44Å; Q202-I303 PolarHBondContact O-N 2.82Å; Q202-I303 VanDerWaalsContact O-N 3.08Å; V204-I303 HydrophobicContact CB-CD1 3.43Å; V204-I303 VanDerWaalsContact CB-CD1 3.43Å; V204-I303 HydrophobicContact CB-CG1 4.48Å; V204-I303 HydrophobicContact CG2-CD1 3.06Å; V204-I303 HydrophobicContact CG2-CG1 4.45Å; F300-I303 HydrophobicContact CB-CD1 4.3Å; F300-I303 HydrophobicContact CB-CG1 3.66Å; F300-I303 HydrophobicContact CG-CG1 4.29Å; I303-D307 WeakPolarHBondContact CA-OD2 3.37Å; I303-D307 HydrophobicContact CG2-CB 4.06Å; I303-L329 HydrophobicContact CD1-CD1 4.31Å; I303-L329 HydrophobicContact CD1-CD2 4.33Å; I303-L329 HydrophobicContact CG2-CD2 4.45Å; I303-I331 HydrophobicContact CG2-CD1 3.51Å; I303-I331 HydrophobicContact CG2-CG1 4.02Å
304	D	90	Very high	90.6	Very high	62 Å²	62	36.8 Å²	36.8	33%	0.332	18%	0.18	S	C	.	.			trans	-116.2	162	170.1	-163	16.1	0	0	0	112.4	Y306 D307 I331	D304-Y306 PolarHBondContact O-N 3.33Å; D304-D307 PolarHBondContact N-OD2 3.18Å; D304-D307 WeakPolarHBondContact O-CB 3.49Å; D304-D307 PolarHBondContact O-N 3.33Å; D304-I331 WeakPolarHBondContact O-CD1 3.43Å
305	Y	89.8	Confident	91	Very high	116 Å²	116	33 Å²	33	46%	0.455	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-48.3	-31.8	-176.6	-66.4	-72.7	0	0	0	114.2	V200 I331 I334	V200-Y305 HydrophobicContact CG1-CE2 4.49Å; V200-Y305 HydrophobicContact CG2-CD1 3.61Å; V200-Y305 HydrophobicContact CG2-CD2 4.06Å; V200-Y305 HydrophobicContact CG2-CE1 3.37Å; V200-Y305 HydrophobicContact CG2-CE2 3.84Å; V200-Y305 HydrophobicContact CG2-CG 3.96Å; V200-Y305 VanDerWaalsContact CG2-CZ 3.5Å; Y305-I331 HydrophobicContact CD1-CG2 4.04Å; Y305-I334 HydrophobicContact CD1-CG1 4.05Å
306	Y	85.3	Confident	91.3	Very high	127 Å²	127	26.8 Å²	26.8	50%	0.498	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-82.9	-9.4	-176.9	-56.3	-65.1	0	0	0	114.4	K243 P286 D304 Q308	K243-Y306 PolarHBondContact NZ-O 3.36Å; P286-Y306 HydrophobicContact CB-CD1 3.9Å; P286-Y306 HydrophobicContact CB-CD2 3.39Å; P286-Y306 HydrophobicContact CB-CE1 4.05Å; P286-Y306 HydrophobicContact CB-CE2 3.57Å; P286-Y306 HydrophobicContact CB-CG 3.54Å; P286-Y306 HydrophobicContact CG-CD1 3.1Å; P286-Y306 HydrophobicContact CG-CD2 3.64Å; P286-Y306 HydrophobicContact CG-CE1 3.38Å; P286-Y306 HydrophobicContact CG-CE2 3.88Å; P286-Y306 HydrophobicContact CG-CG 3.21Å; D304-Y306 PolarHBondContact O-N 3.33Å; Y306-Q308 PolarHBondContact O-N 3.02Å
307	D	89.9	Confident	91.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-77.8	-9.9	175.6	-59.7	-37.5	0	0	0	112.5	I288 S289 I303 D304 G309 Y311 L329 I331	I288-D307 WeakPolarHBondContact CG2-OD1 3.09Å; S289-D307 WeakPolarHBondContact CB-OD2 3.48Å; S289-D307 PolarHBondContact N-OD1 3.46Å; S289-D307 PolarHBondContact OG-OD1 2.85Å; S289-D307 PolarHBondContact OG-OD2 3.48Å; I303-D307 WeakPolarHBondContact CA-OD2 3.37Å; I303-D307 HydrophobicContact CG2-CB 4.06Å; D304-D307 PolarHBondContact N-OD2 3.18Å; D304-D307 WeakPolarHBondContact O-CB 3.49Å; D304-D307 PolarHBondContact O-N 3.33Å; D307-G309 PolarHBondContact O-N 2.04Å; D307-Y311 VanDerWaalsContact O-CE2 3.29Å; D307-Y311 WeakPolarHBondContact O-CE2 3.46Å; D307-Y311 PolarHBondContact O-OH 2.92Å; D307-L329 HydrophobicContact CB-CD2 4.16Å; D307-I331 HydrophobicContact CB-CD1 4.39Å
308	Q	91.9	Very high	90.8	Very high	17 Å²	17	25 Å²	25	8%	0.079	13%	0.131	C	C	.	.			trans	-52.3	132.4	172.5	173.3	152.6	-48.8	0	0	110.9	Y306 L329 I331 I334 N432 E433	Y306-Q308 PolarHBondContact O-N 3.02Å; Q308-L329 WeakPolarHBondContact CA-O 3.36Å; Q308-I331 HydrophobicContact CB-CD1 4Å; Q308-I331 HydrophobicContact CB-CG1 4.15Å; Q308-I331 PolarHBondContact OE1-O 2.83Å; Q308-I334 HydrophobicContact CB-CD1 4.14Å; Q308-I334 VanDerWaalsContact CD-CD1 3.41Å; Q308-I334 HydrophobicContact CG-CD1 4.33Å; Q308-N432 PolarHBondContact NE2-OD1 2.77Å; Q308-E433 PolarHBondContact NE2-O 2.81Å
309	G	91.6	Very high	90.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-177.6	-177.5	0	0	0	0	0	114.7	N244 D307 L329	N244-G309 WeakPolarHBondContact OD1-CA 3.43Å; D307-G309 PolarHBondContact O-N 2.04Å; G309-L329 PolarHBondContact N-O 3.03Å; G309-L329 PolarHBondContact O-N 2.81Å
310	F	93.3	Very high	90.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	109.6	176.8	-165.8	-102.3	0	0	0	109.1	N244 I312 F326 N349 L350 A355 L356 I431	N244-F310 PolarHBondContact N-O 2.82Å; N244-F310 PolarHBondContact OD1-N 3.08Å; F310-I312 HydrophobicContact CD1-CD1 3.78Å; F310-I312 HydrophobicContact CD1-CG1 3.69Å; F310-I312 HydrophobicContact CE1-CD1 3.52Å; F310-I312 HydrophobicContact CE1-CG1 3.59Å; F310-F326 HydrophobicContact CD2-CD2 4.36Å; F310-F326 HydrophobicContact CE1-CB 3.69Å; F310-F326 HydrophobicContact CE1-CD2 4.4Å; F310-F326 HydrophobicContact CE1-CG 4.05Å; F310-F326 HydrophobicContact CE2-CB 4.04Å; F310-F326 AromaticContact CE2-CD2 3.27Å; F310-F326 HydrophobicContact CE2-CD2 3.27Å; F310-F326 AromaticContact CE2-CE2 3.81Å; F310-F326 HydrophobicContact CE2-CE2 3.81Å; F310-F326 AromaticContact CE2-CG 3.76Å; F310-F326 HydrophobicContact CE2-CG 3.76Å; F310-F326 HydrophobicContact CZ-CB 3.41Å; F310-F326 VanDerWaalsContact CZ-CB 3.41Å; F310-F326 AromaticContact CZ-CD1 3.88Å; F310-F326 HydrophobicContact CZ-CD1 3.88Å; F310-F326 AromaticContact CZ-CD2 3.31Å; F310-F326 HydrophobicContact CZ-CD2 3.31Å; F310-F326 HydrophobicContact CZ-CE1 4.45Å; F310-F326 AromaticContact CZ-CE2 3.98Å; F310-F326 HydrophobicContact CZ-CE2 3.98Å; F310-F326 AromaticContact CZ-CG 3.26Å; F310-F326 HydrophobicContact CZ-CG 3.26Å; F310-N349 HydrophobicContact CB-CB 4.02Å; F310-N349 WeakPolarHBondContact CB-O 3.14Å; F310-L350 HydrophobicContact CD1-CD2 4.05Å; F310-L350 HydrophobicContact CD2-CD2 4.44Å; F310-L350 HydrophobicContact CE1-CD2 4.07Å; F310-L350 HydrophobicContact CE2-CD2 4.46Å; F310-L350 HydrophobicContact CG-CD2 4.21Å; F310-L350 HydrophobicContact CZ-CD2 4.26Å; F310-A355 HydrophobicContact CD1-CB 3.67Å; F310-A355 HydrophobicContact CE1-CB 4.12Å; F310-L356 HydrophobicContact CE1-CD2 4.11Å; F310-L356 HydrophobicContact CZ-CD2 4.17Å; F310-I431 HydrophobicContact CD2-CG2 4.18Å; F310-I431 HydrophobicContact CE2-CG2 4.08Å
311	Y	93.9	Very high	90.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135	-178.4	-69.2	-92.1	0	0	0	110.2	M206 L242 K243 I248 L298 F300 D307 F326 Y327 L329	M206-Y311 HydrophobicContact CE-CD2 3.7Å; M206-Y311 HydrophobicContact CE-CE2 4.17Å; M206-Y311 HydrophobicContact CE-CG 3.99Å; M206-Y311 HydrophobicContact SD-CD2 4.18Å; M206-Y311 HydrophobicContact SD-CG 3.88Å; L242-Y311 CarbonylContact O-C 3.58Å; L242-Y311 VanDerWaalsContact O-CA 3.25Å; L242-Y311 WeakPolarHBondContact O-CA 3.48Å; K243-Y311 HydrophobicContact CB-CD1 4.19Å; K243-Y311 HydrophobicContact CB-CE1 3.84Å; K243-Y311 HydrophobicContact CD-CE1 4.09Å; K243-Y311 WeakPolarHBondContact CD-OH 3.17Å; K243-Y311 WeakPolarHBondContact CE-OH 3.24Å; K243-Y311 HydrophobicContact CG-CD1 4.44Å; K243-Y311 HydrophobicContact CG-CE1 3.83Å; K243-Y311 HydrophobicContact CG-CE2 4.47Å; I248-Y311 HydrophobicContact CD1-CD1 4.2Å; I248-Y311 HydrophobicContact CD1-CE1 4.01Å; L298-Y311 HydrophobicContact CD2-CD1 3.74Å; L298-Y311 HydrophobicContact CD2-CE1 4.18Å; F300-Y311 HydrophobicContact CE2-CE1 4.03Å; F300-Y311 AromaticContact CZ-CE1 3.79Å; F300-Y311 HydrophobicContact CZ-CE1 3.79Å; F300-Y311 AromaticContact CZ-CZ 3.9Å; D307-Y311 VanDerWaalsContact O-CE2 3.29Å; D307-Y311 WeakPolarHBondContact O-CE2 3.46Å; D307-Y311 PolarHBondContact O-OH 2.92Å; Y311-F326 CarbonylContact O-C 3.4Å; Y311-F326 WeakPolarHBondContact O-CA 3.34Å; Y311-Y327 PolarHBondContact N-O 3.28Å; Y311-Y327 PolarHBondContact O-N 2.95Å; Y311-L329 HydrophobicContact CD2-CB 4Å; Y311-L329 HydrophobicContact CE2-CB 3.8Å; Y311-L329 HydrophobicContact CE2-CD2 4.02Å
312	I	93.4	Very high	90.4	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.015	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.4	-179.9	-59	-179.9	0	0	0	109.3	W241 L242 F310 N323 F326 A355	W241-I312 CarbonylContact C-O 3.44Å; W241-I312 WeakPolarHBondContact CA-O 3.46Å; W241-I312 VanDerWaalsContact CE3-C 3.47Å; L242-I312 HydrophobicContact CB-CB 4.49Å; L242-I312 PolarHBondContact N-O 2.88Å; L242-I312 PolarHBondContact O-N 2.83Å; F310-I312 HydrophobicContact CD1-CD1 3.78Å; F310-I312 HydrophobicContact CD1-CG1 3.69Å; F310-I312 HydrophobicContact CE1-CD1 3.52Å; F310-I312 HydrophobicContact CE1-CG1 3.59Å; I312-N323 HydrophobicContact CG2-CB 3.66Å; I312-F326 HydrophobicContact CG1-CB 3.96Å; I312-A355 VanDerWaalsContact CD1-C 3.42Å; I312-A355 HydrophobicContact CD1-CB 3.59Å; I312-A355 WeakPolarHBondContact CD1-O 3.47Å
313	C	93.9	Very high	90.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.1	166.1	-170.7	0	0	0	0	111.1	C208 I239 W241 T324 I325	C208-C313 HydrophobicContact CB-CB 3.68Å; C208-C313 WeakPolarHBondContact CB-SG 3.44Å; C208-C313 WeakPolarHBondContact SG-CB 3.45Å; C208-C313 CovalentContact SG-SG 1.99Å; C208-C313 PolarHBondContact SG-SG 3.06Å; I239-C313 WeakPolarHBondContact CG2-SG 3.22Å; W241-C313 HydrophobicContact CD2-CB 4.23Å; W241-C313 HydrophobicContact CE3-CB 4.11Å; W241-C313 HydrophobicContact CH2-CB 3.79Å; W241-C313 HydrophobicContact CZ2-CB 3.9Å; W241-C313 HydrophobicContact CZ3-CB 3.89Å; C313-T324 PolarHBondContact O-N 3.03Å; C313-T324 PolarHBondContact O-OG1 3.46Å; C313-I325 HydrophobicContact CB-CG2 4.02Å; C313-I325 PolarHBondContact N-O 3.44Å
314	Q	93.5	Very high	90.4	Very high	18 Å²	18	35 Å²	35	8%	0.084	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.4	173	177.8	171.6	77.4	0	0	110	I239 K240 L242 M316 K321 W322 N323	I239-Q314 CarbonylContact C-O 3.57Å; I239-Q314 WeakPolarHBondContact CA-O 3.43Å; K240-Q314 PolarHBondContact N-O 2.83Å; K240-Q314 PolarHBondContact O-N 2.67Å; L242-Q314 HydrophobicContact CD1-CB 3.35Å; L242-Q314 HydrophobicContact CD1-CG 4.3Å; Q314-M316 HydrophobicContact CG-CG 4.11Å; Q314-K321 HydrophobicContact CG-CB 4.36Å; Q314-W322 CarbonylContact C-O 3.48Å; Q314-W322 WeakPolarHBondContact CA-O 3.43Å; Q314-N323 PolarHBondContact NE2-OD1 3.34Å
315	M	92.4	Very high	90.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.6	169.5	70.4	179.1	175.4	0	0	109.9	I178 V182 A212 A216 L237 T238 K321 W322 T324	I178-M315 HydrophobicContact CG2-CE 3.29Å; V182-M315 HydrophobicContact CG2-CE 3.27Å; A212-M315 HydrophobicContact CB-CE 4.27Å; A216-M315 HydrophobicContact CB-SD 4.3Å; L237-M315 HydrophobicContact CD1-CB 4.14Å; T238-M315 CarbonylContact O-C 3.47Å; T238-M315 WeakPolarHBondContact O-CA 3.47Å; M315-K321 WeakPolarHBondContact O-CA 3.46Å; M315-W322 HydrophobicContact CE-CB 3.46Å; M315-W322 VanDerWaalsContact CE-CB 3.46Å; M315-W322 HydrophobicContact CE-CD2 3.86Å; M315-W322 HydrophobicContact CE-CE3 3.94Å; M315-W322 HydrophobicContact CE-CG 3.71Å; M315-W322 HydrophobicContact CG-CB 3.88Å; M315-W322 HydrophobicContact CG-CE3 3.98Å; M315-W322 PolarHBondContact N-O 3.21Å; M315-W322 PolarHBondContact O-N 2.84Å; M315-T324 HydrophobicContact CB-CG2 4.1Å; M315-T324 HydrophobicContact CE-CG2 3.63Å; M315-T324 HydrophobicContact CG-CG2 3.52Å; M315-T324 HydrophobicContact SD-CG2 3.35Å; M315-T324 WeakPolarHBondContact SD-CG2 3.32Å
316	M	89.7	Confident	90.6	Very high	20 Å²	20	27.2 Å²	27.2	10%	0.099	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	138.3	-179.2	-51.3	-178.9	-63.6	0	0	111.1	T238 K240 Q314 H320 K321	T238-M316 PolarHBondContact N-O 3.42Å; T238-M316 PolarHBondContact O-N 3.38Å; T238-M316 WeakPolarHBondContact OG1-CE 3.29Å; K240-M316 HydrophobicContact CD-CE 3.41Å; K240-M316 VanDerWaalsContact CD-CE 3.41Å; K240-M316 HydrophobicContact CD-SD 4.04Å; K240-M316 HydrophobicContact CG-CE 3.78Å; Q314-M316 HydrophobicContact CG-CG 4.11Å; M316-H320 VanDerWaalsContact CA-O 3.29Å; M316-H320 WeakPolarHBondContact CA-O 3.41Å; M316-K321 HydrophobicContact CB-CG 4.45Å; M316-K321 HydrophobicContact CG-CB 4.28Å; M316-K321 HydrophobicContact CG-CD 4.38Å; M316-K321 HydrophobicContact CG-CG 3.88Å; M316-K321 HydrophobicContact SD-CD 4.13Å; M316-K321 HydrophobicContact SD-CG 4.21Å
317	I	86.9	Confident	91.1	Very high	6 Å²	6	22.2 Å²	22.2	3%	0.031	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	114.7	171.3	-62.3	166.9	0	0	0	107.1	L171 I178 A216 T220 H235 L237 N319 H320 W322	L171-I317 HydrophobicContact CD1-CG2 4.22Å; I178-I317 HydrophobicContact CD1-CD1 3.67Å; A216-I317 HydrophobicContact CB-CD1 4.06Å; T220-I317 HydrophobicContact CG2-CD1 3.82Å; T220-I317 HydrophobicContact CG2-CG1 4.24Å; T220-I317 HydrophobicContact CG2-CG2 4.42Å; H235-I317 HydrophobicContact CB-CG2 4.04Å; L237-I317 HydrophobicContact CB-CG1 4.38Å; L237-I317 HydrophobicContact CD1-CD1 4.05Å; L237-I317 HydrophobicContact CD1-CG1 3.76Å; I317-N319 PolarHBondContact O-N 2.91Å; I317-N319 VanDerWaalsContact O-N 3.16Å; I317-H320 PolarHBondContact N-O 2.98Å; I317-H320 PolarHBondContact O-N 3.27Å; I317-W322 HydrophobicContact CB-CH2 4.44Å; I317-W322 HydrophobicContact CB-CZ3 4Å; I317-W322 HydrophobicContact CD1-CH2 4.42Å; I317-W322 HydrophobicContact CD1-CZ3 4.01Å; I317-W322 HydrophobicContact CG1-CZ3 4.11Å
318	G	83.3	Confident	91.3	Very high	32 Å²	32	22.2 Å²	22.2	33%	0.33	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	-120.2	-174.6	0	0	0	0	0	111.2	H235	H235-G318 WeakPolarHBondContact ND1-CA 3.5Å
319	N	85.2	Confident	91.4	Very high	153 Å²	153	21.4 Å²	21.4	82%	0.818	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-11.7	178.3	-66.1	-12.9	0	0	0	113.7	I317	I317-N319 PolarHBondContact O-N 2.91Å; I317-N319 VanDerWaalsContact O-N 3.16Å
320	H	88.6	Confident	91.5	Very high	56 Å²	56	21.4 Å²	21.4	26%	0.259	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	136.4	-176.4	-65.2	-64.4	0	0	0	111	D172 A175 M316 I317 W322	D172-H320 IonicContact OD1-CE1 3.56Å; D172-H320 PolarHBondContact OD1-CE1 3.06Å; D172-H320 IonicContact OD1-NE2 3.51Å; D172-H320 PolarHBondContact OD1-NE2 3.23Å; A175-H320 HydrophobicContact CB-CB 4.43Å; M316-H320 VanDerWaalsContact CA-O 3.29Å; M316-H320 WeakPolarHBondContact CA-O 3.41Å; I317-H320 PolarHBondContact N-O 2.98Å; I317-H320 PolarHBondContact O-N 3.27Å; H320-W322 HydrophobicContact CB-CE3 4.42Å; H320-W322 HydrophobicContact CB-CH2 3.26Å; H320-W322 HydrophobicContact CB-CZ2 3.64Å; H320-W322 HydrophobicContact CB-CZ3 3.69Å
321	K	91.1	Very high	91.6	Very high	104 Å²	104	21.4 Å²	21.4	45%	0.452	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.3	-177.8	-51.6	-176.9	-174	165.6	0	109.7	Q314 M315 M316	Q314-K321 HydrophobicContact CG-CB 4.36Å; M315-K321 WeakPolarHBondContact O-CA 3.46Å; M316-K321 HydrophobicContact CB-CG 4.45Å; M316-K321 HydrophobicContact CG-CB 4.28Å; M316-K321 HydrophobicContact CG-CD 4.38Å; M316-K321 HydrophobicContact CG-CG 3.88Å; M316-K321 HydrophobicContact SD-CD 4.13Å; M316-K321 HydrophobicContact SD-CG 4.21Å
322	W	92.5	Very high	91.5	Very high	15 Å²	15	24.4 Å²	24.4	6%	0.057	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	132.5	178.9	-59.5	-86.5	0	0	0	111	A175 I178 T179 V182 Q314 M315 I317 H320 T324	A175-W322 HydrophobicContact CB-CH2 4.06Å; A175-W322 HydrophobicContact CB-CZ2 3.71Å; I178-W322 HydrophobicContact CB-CH2 4.37Å; I178-W322 HydrophobicContact CB-CZ2 4.02Å; I178-W322 HydrophobicContact CD1-CH2 4.23Å; I178-W322 HydrophobicContact CG2-CD2 3.88Å; I178-W322 HydrophobicContact CG2-CE3 4.19Å; I178-W322 HydrophobicContact CG2-CG 4.37Å; I178-W322 HydrophobicContact CG2-CH2 4.2Å; I178-W322 HydrophobicContact CG2-CZ2 3.93Å; I178-W322 HydrophobicContact CG2-CZ3 4.34Å; T179-W322 HydrophobicContact CG2-CZ2 4.41Å; V182-W322 HydrophobicContact CG2-CB 4.02Å; V182-W322 HydrophobicContact CG2-CG 4.14Å; Q314-W322 CarbonylContact C-O 3.48Å; Q314-W322 WeakPolarHBondContact CA-O 3.43Å; M315-W322 HydrophobicContact CE-CB 3.46Å; M315-W322 VanDerWaalsContact CE-CB 3.46Å; M315-W322 HydrophobicContact CE-CD2 3.86Å; M315-W322 HydrophobicContact CE-CE3 3.94Å; M315-W322 HydrophobicContact CE-CG 3.71Å; M315-W322 HydrophobicContact CG-CB 3.88Å; M315-W322 HydrophobicContact CG-CE3 3.98Å; M315-W322 PolarHBondContact N-O 3.21Å; M315-W322 PolarHBondContact O-N 2.84Å; I317-W322 HydrophobicContact CB-CH2 4.44Å; I317-W322 HydrophobicContact CB-CZ3 4Å; I317-W322 HydrophobicContact CD1-CH2 4.42Å; I317-W322 HydrophobicContact CD1-CZ3 4.01Å; I317-W322 HydrophobicContact CG1-CZ3 4.11Å; H320-W322 HydrophobicContact CB-CE3 4.42Å; H320-W322 HydrophobicContact CB-CH2 3.26Å; H320-W322 HydrophobicContact CB-CZ2 3.64Å; H320-W322 HydrophobicContact CB-CZ3 3.69Å; W322-T324 PolarHBondContact O-N 3.24Å
323	N	92.6	Very high	91.3	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.027	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	107.1	168.9	-68.1	2.5	0	0	0	108.6	Q186 I312 Q314 A355 D357 N358 T359	Q186-N323 PolarHBondContact NE2-O 2.83Å; I312-N323 HydrophobicContact CG2-CB 3.66Å; Q314-N323 PolarHBondContact NE2-OD1 3.34Å; N323-A355 PolarHBondContact ND2-O 2.86Å; N323-A355 VanDerWaalsContact ND2-O 3.11Å; N323-D357 PolarHBondContact ND2-O 3.19Å; N323-N358 PolarHBondContact N-O 3.49Å; N323-T359 HydrophobicContact CB-CG2 3.81Å
324	T	89.7	Confident	91.2	Very high	2 Å²	2	28 Å²	28	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-52.5	-170.1	52.5	0	0	0	0	112.3	C313 M315 W322	C313-T324 PolarHBondContact O-N 3.03Å; C313-T324 PolarHBondContact O-OG1 3.46Å; M315-T324 HydrophobicContact CB-CG2 4.1Å; M315-T324 HydrophobicContact CE-CG2 3.63Å; M315-T324 HydrophobicContact CG-CG2 3.52Å; M315-T324 HydrophobicContact SD-CG2 3.35Å; M315-T324 WeakPolarHBondContact SD-CG2 3.32Å; W322-T324 PolarHBondContact O-N 3.24Å
325	I	91.3	Very high	91.2	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	150.3	-176.3	-169	163	0	0	0	109.3	L189 Y192 N194 T210 C313 Y327	L189-I325 HydrophobicContact CD2-CG1 4.06Å; Y192-I325 HydrophobicContact CD1-CD1 3.58Å; Y192-I325 HydrophobicContact CD2-CD1 4.2Å; Y192-I325 HydrophobicContact CE1-CD1 4.07Å; Y192-I325 HydrophobicContact CG-CD1 3.66Å; N194-I325 WeakPolarHBondContact OD1-CD1 3.23Å; T210-I325 HydrophobicContact CG2-CB 4.02Å; T210-I325 HydrophobicContact CG2-CD1 4.44Å; T210-I325 HydrophobicContact CG2-CG2 4.33Å; C313-I325 HydrophobicContact CB-CG2 4.02Å; C313-I325 PolarHBondContact N-O 3.44Å; I325-Y327 HydrophobicContact CD1-CE2 4.16Å; I325-Y327 HydrophobicContact CG1-CE2 4.16Å; I325-Y327 HydrophobicContact CG2-CE2 3.98Å
326	F	93.2	Very high	91.3	Very high	10 Å²	10	36 Å²	36	4%	0.044	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	146.9	172.2	66.4	-101.8	0	0	0	110.8	L189 N194 F310 Y311 I312 M363 I409 Y429	L189-F326 HydrophobicContact CD1-CD1 4.15Å; L189-F326 HydrophobicContact CD1-CE1 3.35Å; L189-F326 HydrophobicContact CD1-CZ 3.85Å; N194-F326 VanDerWaalsContact CB-O 3.29Å; N194-F326 WeakPolarHBondContact CB-O 3.34Å; N194-F326 PolarHBondContact ND2-O 2.9Å; F310-F326 HydrophobicContact CD2-CD2 4.36Å; F310-F326 HydrophobicContact CE1-CB 3.69Å; F310-F326 HydrophobicContact CE1-CD2 4.4Å; F310-F326 HydrophobicContact CE1-CG 4.05Å; F310-F326 HydrophobicContact CE2-CB 4.04Å; F310-F326 AromaticContact CE2-CD2 3.27Å; F310-F326 HydrophobicContact CE2-CD2 3.27Å; F310-F326 AromaticContact CE2-CE2 3.81Å; F310-F326 HydrophobicContact CE2-CE2 3.81Å; F310-F326 AromaticContact CE2-CG 3.76Å; F310-F326 HydrophobicContact CE2-CG 3.76Å; F310-F326 HydrophobicContact CZ-CB 3.41Å; F310-F326 VanDerWaalsContact CZ-CB 3.41Å; F310-F326 AromaticContact CZ-CD1 3.88Å; F310-F326 HydrophobicContact CZ-CD1 3.88Å; F310-F326 AromaticContact CZ-CD2 3.31Å; F310-F326 HydrophobicContact CZ-CD2 3.31Å; F310-F326 HydrophobicContact CZ-CE1 4.45Å; F310-F326 AromaticContact CZ-CE2 3.98Å; F310-F326 HydrophobicContact CZ-CE2 3.98Å; F310-F326 AromaticContact CZ-CG 3.26Å; F310-F326 HydrophobicContact CZ-CG 3.26Å; Y311-F326 CarbonylContact O-C 3.4Å; Y311-F326 WeakPolarHBondContact O-CA 3.34Å; I312-F326 HydrophobicContact CG1-CB 3.96Å; F326-M363 HydrophobicContact CE1-CE 4.27Å; F326-I409 HydrophobicContact CZ-CD1 4.46Å; F326-Y429 HydrophobicContact CE2-CD1 4.14Å; F326-Y429 HydrophobicContact CE2-CG 4.15Å; F326-Y429 HydrophobicContact CZ-CD1 4.11Å; F326-Y429 HydrophobicContact CZ-CD2 4.03Å; F326-Y429 HydrophobicContact CZ-CE1 4.21Å; F326-Y429 HydrophobicContact CZ-CE2 4.13Å; F326-Y429 HydrophobicContact CZ-CG 4.01Å
327	Y	94.6	Very high	91.4	Very high	21 Å²	21	40.2 Å²	40.2	8%	0.082	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133	171.8	-70.4	-89.9	0	0	0	109.1	N194 L196 M206 D207 W241 Y311 I325	N194-Y327 CarbonylContact O-C 3.42Å; N194-Y327 VanDerWaalsContact O-CA 3.23Å; N194-Y327 WeakPolarHBondContact O-CA 3.21Å; L196-Y327 HydrophobicContact CD1-CD1 3.92Å; L196-Y327 HydrophobicContact CG-CD1 4.24Å; M206-Y327 HydrophobicContact CB-CD1 4.43Å; M206-Y327 HydrophobicContact CB-CD2 3.82Å; M206-Y327 HydrophobicContact CB-CE2 3.93Å; M206-Y327 HydrophobicContact CB-CG 4.08Å; M206-Y327 HydrophobicContact CG-CD1 4.14Å; M206-Y327 HydrophobicContact CG-CD2 4.1Å; M206-Y327 HydrophobicContact CG-CG 3.85Å; M206-Y327 HydrophobicContact SD-CD2 4.23Å; M206-Y327 HydrophobicContact SD-CG 3.97Å; D207-Y327 PolarHBondContact N-OH 2.89Å; D207-Y327 VanDerWaalsContact O-CE2 3.26Å; D207-Y327 WeakPolarHBondContact O-CE2 3.17Å; D207-Y327 PolarHBondContact O-OH 2.82Å; W241-Y327 AromaticContact CH2-CD2 3.94Å; W241-Y327 HydrophobicContact CH2-CD2 3.94Å; W241-Y327 AromaticContact CH2-CE2 3.94Å; W241-Y327 HydrophobicContact CH2-CE2 3.94Å; W241-Y327 AromaticContact CZ3-CD2 3.98Å; W241-Y327 HydrophobicContact CZ3-CD2 3.98Å; W241-Y327 HydrophobicContact CZ3-CE2 4.43Å; Y311-Y327 PolarHBondContact N-O 3.28Å; Y311-Y327 PolarHBondContact O-N 2.95Å; I325-Y327 HydrophobicContact CD1-CE2 4.16Å; I325-Y327 HydrophobicContact CG1-CE2 4.16Å; I325-Y327 HydrophobicContact CG2-CE2 3.98Å
328	T	93.9	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	115.9	165.5	-49.2	0	0	0	0	108.6	N194 L196 I330 L430 I431	N194-T328 PolarHBondContact O-N 2.54Å; L196-T328 PolarHBondContact N-O 3.31Å; T328-I330 HydrophobicContact CG2-CD1 3.94Å; T328-I330 HydrophobicContact CG2-CG1 3.6Å; T328-L430 WeakPolarHBondContact CB-O 3.34Å; T328-L430 WeakPolarHBondContact CG2-O 3.4Å; T328-L430 PolarHBondContact OG1-O 2.98Å; T328-I431 VanDerWaalsContact CG2-CA 3.48Å; T328-I431 WeakPolarHBondContact CG2-O 3.48Å
329	L	94.7	Very high	92.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	115.9	168.7	-178.3	58.5	0	0	0	109.4	L196 M198 V204 M206 I303 D307 Q308 G309 Y311	L196-L329 HydrophobicContact CB-CD1 4.1Å; M198-L329 HydrophobicContact CB-CD1 4.19Å; M198-L329 HydrophobicContact CG-CD1 3.88Å; V204-L329 HydrophobicContact CG2-CD1 4.05Å; M206-L329 HydrophobicContact CE-CB 3.91Å; M206-L329 HydrophobicContact CE-CD2 4.14Å; M206-L329 HydrophobicContact CE-CG 4.45Å; I303-L329 HydrophobicContact CD1-CD1 4.31Å; I303-L329 HydrophobicContact CD1-CD2 4.33Å; I303-L329 HydrophobicContact CG2-CD2 4.45Å; D307-L329 HydrophobicContact CB-CD2 4.16Å; Q308-L329 WeakPolarHBondContact CA-O 3.36Å; G309-L329 PolarHBondContact N-O 3.03Å; G309-L329 PolarHBondContact O-N 2.81Å; Y311-L329 HydrophobicContact CD2-CB 4Å; Y311-L329 HydrophobicContact CE2-CB 3.8Å; Y311-L329 HydrophobicContact CE2-CD2 4.02Å
330	I	94.3	Very high	92.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.9	-180	-60.2	175.1	0	0	0	108.3	I195 L196 R197 M198 T328 L430 E433	I195-I330 HydrophobicContact CG2-CD1 4.09Å; L196-I330 PolarHBondContact O-N 3.41Å; R197-I330 CarbonylContact C-O 3.51Å; R197-I330 WeakPolarHBondContact CA-O 3.39Å; R197-I330 HydrophobicContact CG-CB 4.23Å; R197-I330 HydrophobicContact CG-CD1 4.44Å; M198-I330 PolarHBondContact N-O 2.92Å; T328-I330 HydrophobicContact CG2-CD1 3.94Å; T328-I330 HydrophobicContact CG2-CG1 3.6Å; I330-L430 HydrophobicContact CD1-CB 4.12Å; I330-L430 HydrophobicContact CD1-CD2 3.37Å; I330-L430 HydrophobicContact CD1-CG 3.45Å; I330-L430 VanDerWaalsContact CD1-CG 3.45Å; I330-E433 HydrophobicContact CG2-CB 3.75Å
331	I	94	Very high	92.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.5	179.6	-58.5	174.1	0	0	0	108.5	M198 V200 I303 D304 Y305 D307 Q308 G333 I334	M198-I331 CarbonylContact O-C 3.55Å; M198-I331 WeakPolarHBondContact O-CA 3.4Å; V200-I331 HydrophobicContact CG2-CG2 3.82Å; I303-I331 HydrophobicContact CG2-CD1 3.51Å; I303-I331 HydrophobicContact CG2-CG1 4.02Å; D304-I331 WeakPolarHBondContact O-CD1 3.43Å; Y305-I331 HydrophobicContact CD1-CG2 4.04Å; D307-I331 HydrophobicContact CB-CD1 4.39Å; Q308-I331 HydrophobicContact CB-CD1 4Å; Q308-I331 HydrophobicContact CB-CG1 4.15Å; Q308-I331 PolarHBondContact OE1-O 2.83Å; I331-G333 PolarHBondContact O-N 2.77Å; I331-I334 HydrophobicContact CB-CD1 4.22Å; I331-I334 HydrophobicContact CB-CG1 4.45Å
332	I	92.3	Very high	92.5	Very high	63 Å²	63	35.4 Å²	35.4	32%	0.323	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	131.9	-177	-56.6	171.1	0	0	0	109.1	R197 M198	R197-I332 HydrophobicContact CB-CD1 4.23Å; R197-I332 HydrophobicContact CB-CG1 4.39Å; M198-I332 PolarHBondContact O-N 3.28Å
333	G	89.9	Confident	92.5	Very high	63 Å²	63	38.8 Å²	38.8	65%	0.649	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.7	8.2	172.9	0	0	0	0	0	115.3	I331 K335	I331-G333 PolarHBondContact O-N 2.77Å; G333-K335 PolarHBondContact O-N 3.42Å
334	I	91.6	Very high	92.5	Very high	16 Å²	16	39.4 Å²	39.4	8%	0.082	22%	0.223	C	C	.	.			trans	-64.9	125.7	172.2	-63	-177.3	0	0	0	110.1	Y305 Q308 I331 Y336 F434 Y435	Y305-I334 HydrophobicContact CD1-CG1 4.05Å; Q308-I334 HydrophobicContact CB-CD1 4.14Å; Q308-I334 VanDerWaalsContact CD-CD1 3.41Å; Q308-I334 HydrophobicContact CG-CD1 4.33Å; I331-I334 HydrophobicContact CB-CD1 4.22Å; I331-I334 HydrophobicContact CB-CG1 4.45Å; I334-Y336 HydrophobicContact CG2-CD2 4.23Å; I334-Y336 HydrophobicContact CG2-CE1 4.34Å; I334-Y336 HydrophobicContact CG2-CE2 3.6Å; I334-F434 HydrophobicContact CB-CB 4.31Å; I334-F434 HydrophobicContact CG2-CB 4.03Å; I334-Y435 PolarHBondContact O-N 2.98Å
335	K	93.8	Very high	92.6	Very high	111 Å²	111	40.3 Å²	40.3	48%	0.483	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.5	-179.6	176.9	171.9	178.6	-173.9	0	110.4	G333 Y435	G333-K335 PolarHBondContact O-N 3.42Å; K335-Y435 CarbonylContact C-O 3.58Å; K335-Y435 WeakPolarHBondContact CA-O 3.4Å; K335-Y435 HydrophobicContact CD-CD1 4.24Å; K335-Y435 HydrophobicContact CG-CD1 4.03Å
336	Y	93.5	Very high	92.7	Very high	74 Å²	74	40.1 Å²	40.1	29%	0.29	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	143.5	170.8	-62.2	-67.2	0	0	0	110.4	W282 I334 F344 F434 Y435 K437	W282-Y336 HydrophobicContact CH2-CD1 4.46Å; W282-Y336 HydrophobicContact CH2-CE1 4.01Å; W282-Y336 AromaticContact CZ3-CE1 3.9Å; W282-Y336 HydrophobicContact CZ3-CE1 3.9Å; I334-Y336 HydrophobicContact CG2-CD2 4.23Å; I334-Y336 HydrophobicContact CG2-CE1 4.34Å; I334-Y336 HydrophobicContact CG2-CE2 3.6Å; Y336-F344 HydrophobicContact CD2-CZ 4.24Å; Y336-F344 HydrophobicContact CG-CE2 4.44Å; Y336-F344 HydrophobicContact CG-CZ 4.39Å; Y336-F434 HydrophobicContact CD2-CB 4.02Å; Y336-F434 AromaticContact CD2-CD2 3.51Å; Y336-F434 HydrophobicContact CD2-CD2 3.51Å; Y336-F434 HydrophobicContact CD2-CE2 4.09Å; Y336-F434 AromaticContact CD2-CG 3.82Å; Y336-F434 HydrophobicContact CD2-CG 3.82Å; Y336-F434 HydrophobicContact CE2-CB 3.82Å; Y336-F434 HydrophobicContact CE2-CD1 4.28Å; Y336-F434 AromaticContact CE2-CD2 3.95Å; Y336-F434 HydrophobicContact CE2-CD2 3.95Å; Y336-F434 AromaticContact CE2-CG 3.77Å; Y336-F434 HydrophobicContact CE2-CG 3.77Å; Y336-Y435 PolarHBondContact N-O 2.95Å; Y336-K437 PolarHBondContact O-N 3.47Å
337	I	93.3	Very high	92.6	Very high	109 Å²	109	41.3 Å²	41.3	56%	0.559	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.1	177.9	-63.4	171	0	0	0	106.9	K437 Y439	I337-K437 WeakPolarHBondContact CA-O 3.12Å; I337-K437 HydrophobicContact CG1-CB 4.47Å; I337-Y439 HydrophobicContact CG2-CD2 3.75Å; I337-Y439 HydrophobicContact CG2-CE2 3.45Å; I337-Y439 VanDerWaalsContact CG2-CE2 3.45Å
338	A	92.6	Very high	92.5	Very high	12 Å²	12	40.3 Å²	40.3	10%	0.099	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	160.2	177.8	0	0	0	0	0	110.5	L395 L436 K437 V438 Y439	A338-L395 HydrophobicContact CB-CD1 3.34Å; A338-L436 HydrophobicContact CB-CD1 4.39Å; A338-K437 PolarHBondContact N-O 3.41Å; A338-V438 WeakPolarHBondContact O-CA 2.77Å; A338-Y439 PolarHBondContact O-N 2.88Å
339	L	91.7	Very high	92.3	Very high	85 Å²	85	41.1 Å²	41.1	45%	0.445	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	156.2	173.1	-57.2	174.7	0	0	0	110.3	D342 Y439 T441	L339-D342 WeakPolarHBondContact CA-OD2 3.4Å; L339-D342 WeakPolarHBondContact CB-OD2 3.45Å; L339-D342 PolarHBondContact N-OD2 3.28Å; L339-D342 VanDerWaalsContact O-CB 3.29Å; L339-D342 WeakPolarHBondContact O-CB 3.06Å; L339-D342 PolarHBondContact O-N 3.42Å; L339-Y439 CarbonylContact C-O 3.45Å; L339-T441 HydrophobicContact CB-CG2 4.37Å
340	E	91.8	Very high	92.1	Very high	55 Å²	55	41.1 Å²	41.1	26%	0.257	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	136.1	171.4	179.4	167.5	-144.9	0	0	110.6	D342 L395 V438 Y439 S440 T441	E340-D342 VanDerWaalsContact C-N 3.28Å; E340-D342 PolarHBondContact O-N 2.66Å; E340-L395 CarbonylContact C-O 3.21Å; E340-L395 WeakPolarHBondContact CA-O 3.24Å; E340-L395 WeakPolarHBondContact CG-O 3.46Å; E340-V438 HydrophobicContact CB-CG1 4.3Å; E340-Y439 WeakPolarHBondContact CB-O 3.43Å; E340-Y439 PolarHBondContact N-O 2.77Å; E340-S440 WeakPolarHBondContact OE2-CA 3.23Å; E340-T441 HydrophobicContact CB-CG2 4.09Å; E340-T441 WeakPolarHBondContact O-CG2 3.43Å
341	G	90.1	Very high	91.6	Very high	34 Å²	34	41.4 Å²	41.4	35%	0.351	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	-13.5	-172.9	0	0	0	0	0	114.7	L395	G341-L395 PolarHBondContact N-O 2.89Å
342	D	91.3	Very high	91.2	Very high	63 Å²	63	43.8 Å²	43.8	34%	0.337	24%	0.242	S	C	.	.			trans	-65.9	141.2	176.3	-73	-17.1	0	0	0	110.8	L339 E340 L395	L339-D342 WeakPolarHBondContact CA-OD2 3.4Å; L339-D342 WeakPolarHBondContact CB-OD2 3.45Å; L339-D342 PolarHBondContact N-OD2 3.28Å; L339-D342 VanDerWaalsContact O-CB 3.29Å; L339-D342 WeakPolarHBondContact O-CB 3.06Å; L339-D342 PolarHBondContact O-N 3.42Å; E340-D342 VanDerWaalsContact C-N 3.28Å; E340-D342 PolarHBondContact O-N 2.66Å; D342-L395 HydrophobicContact CB-CD1 4.42Å; D342-L395 WeakPolarHBondContact O-CB 3.34Å; D342-L395 WeakPolarHBondContact O-CG 3.18Å; D342-L395 PolarHBondContact O-N 3.17Å
343	P	92.8	Very high	90.7	Very high	86 Å²	86	45.3 Å²	45.3	56%	0.558	25%	0.247	S	C	*	.			trans	-72.8	133.5	169	29.6	-32.8	0	0	0	110.2	L391 I392 P393	P343-L391 HydrophobicContact CB-CD1 4.05Å; P343-I392 WeakPolarHBondContact CA-O 3.07Å; P343-P393 WeakPolarHBondContact CA-O 3.34Å
344	F	92.7	Very high	90.3	Very high	19 Å²	19	43.5 Å²	43.5	8%	0.083	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133	179.8	-170.3	-100.3	0	0	0	111.8	Y336 L346 I392 L395 F434 L436	Y336-F344 HydrophobicContact CD2-CZ 4.24Å; Y336-F344 HydrophobicContact CG-CE2 4.44Å; Y336-F344 HydrophobicContact CG-CZ 4.39Å; F344-L346 HydrophobicContact CD1-CD2 4.07Å; F344-L346 HydrophobicContact CE1-CD2 3.84Å; F344-I392 HydrophobicContact CD1-CD1 4.48Å; F344-I392 PolarHBondContact N-O 2.83Å; F344-I392 PolarHBondContact O-N 3.34Å; F344-L395 HydrophobicContact CB-CD1 3.64Å; F344-L395 HydrophobicContact CB-CD2 3.77Å; F344-L395 HydrophobicContact CB-CG 3.68Å; F344-L395 HydrophobicContact CD2-CD1 4.31Å; F344-L395 HydrophobicContact CG-CD1 4.14Å; F344-L395 HydrophobicContact CG-CD2 4.31Å; F344-F434 AromaticContact CE1-CE2 3.95Å; F344-F434 HydrophobicContact CE1-CE2 3.95Å; F344-F434 AromaticContact CE1-CZ 3.93Å; F344-F434 HydrophobicContact CE1-CZ 3.93Å; F344-F434 AromaticContact CZ-CE2 3.96Å; F344-F434 HydrophobicContact CZ-CE2 3.96Å; F344-F434 HydrophobicContact CZ-CZ 4.23Å; F344-L436 HydrophobicContact CD1-CD2 4.21Å; F344-L436 HydrophobicContact CD2-CD1 4.19Å; F344-L436 HydrophobicContact CE1-CD1 4.39Å; F344-L436 HydrophobicContact CE1-CD2 4.17Å; F344-L436 HydrophobicContact CE2-CD1 3.77Å; F344-L436 HydrophobicContact CZ-CD1 3.89Å; F344-L436 HydrophobicContact CZ-CD2 4.48Å
345	Y	91.8	Very high	90	Very high	20 Å²	20	42.9 Å²	42.9	8%	0.078	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.9	177.7	-72.1	-86.6	0	0	0	110.6	K274 L275 E278 Y347 I389 Q390 L391	K274-Y345 WeakPolarHBondContact CE-OH 3.37Å; L275-Y345 HydrophobicContact CD2-CD1 4.42Å; L275-Y345 HydrophobicContact CD2-CE1 3.9Å; E278-Y345 HydrophobicContact CG-CD1 4.33Å; E278-Y345 HydrophobicContact CG-CD2 3.74Å; E278-Y345 HydrophobicContact CG-CE1 4.3Å; E278-Y345 HydrophobicContact CG-CE2 3.74Å; E278-Y345 HydrophobicContact CG-CG 4.04Å; Y345-Y347 VanDerWaalsContact CB-CE2 3.47Å; Y345-Y347 WeakPolarHBondContact O-CD2 3.41Å; Y345-Y347 WeakPolarHBondContact O-CE2 3.25Å; Y345-I389 HydrophobicContact CD1-CG2 3.95Å; Y345-Q390 CarbonylContact C-O 3.5Å; Y345-Q390 WeakPolarHBondContact CA-O 3.49Å; Y345-L391 HydrophobicContact CD1-CB 3.97Å; Y345-L391 HydrophobicContact CD1-CD1 4.12Å; Y345-L391 HydrophobicContact CD2-CD1 4.22Å; Y345-L391 HydrophobicContact CE1-CB 3.7Å; Y345-L391 HydrophobicContact CE1-CD1 3.8Å; Y345-L391 HydrophobicContact CE1-CD2 4.39Å; Y345-L391 HydrophobicContact CE1-CG 4.16Å; Y345-L391 HydrophobicContact CE2-CD1 3.88Å; Y345-L391 HydrophobicContact CG-CD1 4.34Å
346	L	92.9	Very high	89.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.4	170.4	-64.3	176.2	0	0	0	109.6	F344 W370 Y377 I389 Q390 I392 W403 F434	F344-L346 HydrophobicContact CD1-CD2 4.07Å; F344-L346 HydrophobicContact CE1-CD2 3.84Å; L346-W370 HydrophobicContact CB-CH2 4.24Å; L346-W370 HydrophobicContact CB-CZ2 3.75Å; L346-W370 HydrophobicContact CD1-CD2 4.22Å; L346-W370 HydrophobicContact CD1-CG 4.25Å; L346-W370 HydrophobicContact CD2-CH2 4.5Å; L346-W370 HydrophobicContact CD2-CZ3 4.39Å; L346-Y377 HydrophobicContact CD1-CE1 4.3Å; L346-I389 WeakPolarHBondContact O-CA 3.43Å; L346-Q390 HydrophobicContact CB-CB 4.18Å; L346-Q390 HydrophobicContact CD1-CG 4.36Å; L346-Q390 PolarHBondContact N-O 2.81Å; L346-Q390 PolarHBondContact O-N 3.03Å; L346-I392 HydrophobicContact CD1-CD1 3.97Å; L346-I392 HydrophobicContact CD1-CG1 4.21Å; L346-I392 HydrophobicContact CD2-CD1 4.24Å; L346-I392 HydrophobicContact CG-CD1 3.98Å; L346-I392 HydrophobicContact CG-CG1 4.26Å; L346-W403 HydrophobicContact CD1-CE3 4.23Å; L346-W403 HydrophobicContact CD1-CH2 4.2Å; L346-W403 HydrophobicContact CD1-CZ3 3.66Å; L346-W403 HydrophobicContact CD2-CD2 4.06Å; L346-W403 HydrophobicContact CD2-CE3 3.72Å; L346-W403 HydrophobicContact CD2-CH2 4.36Å; L346-W403 HydrophobicContact CD2-CZ3 3.89Å; L346-W403 HydrophobicContact CG-CZ3 4.45Å; L346-F434 HydrophobicContact CD2-CZ 3.83Å
347	Y	91.2	Very high	89	Confident	35 Å²	35	38.8 Å²	38.8	14%	0.137	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.7	176.3	-70.2	-84.7	0	0	0	111	E278 W282 Y345 N349 W370 I389 N432	E278-Y347 WeakPolarHBondContact CG-OH 3.32Å; W282-Y347 AromaticContact CD1-CE2 3.67Å; W282-Y347 AromaticContact CD1-CZ 3.34Å; W282-Y347 HydrophobicContact CD2-CD2 4.25Å; W282-Y347 AromaticContact CD2-CE2 3.62Å; W282-Y347 HydrophobicContact CD2-CE2 3.62Å; W282-Y347 AromaticContact CD2-CZ 4Å; W282-Y347 AromaticContact CE2-CE2 3.31Å; W282-Y347 AromaticContact CE2-CZ 3.87Å; W282-Y347 HydrophobicContact CE3-CE2 4.38Å; W282-Y347 HydrophobicContact CG-CE1 4.31Å; W282-Y347 AromaticContact CG-CE2 3.8Å; W282-Y347 HydrophobicContact CG-CE2 3.8Å; W282-Y347 AromaticContact CG-CZ 3.64Å; W282-Y347 HydrophobicContact CZ2-CD2 4.43Å; W282-Y347 AromaticContact CZ2-CE2 3.81Å; W282-Y347 HydrophobicContact CZ2-CE2 3.81Å; W282-Y347 AromaticContact NE1-CE2 3.35Å; W282-Y347 VanDerWaalsContact NE1-CE2 3.35Å; W282-Y347 AromaticContact NE1-CZ 3.46Å; W282-Y347 PolarHBondContact NE1-OH 2.9Å; Y345-Y347 VanDerWaalsContact CB-CE2 3.47Å; Y345-Y347 WeakPolarHBondContact O-CD2 3.41Å; Y345-Y347 WeakPolarHBondContact O-CE2 3.25Å; Y347-N349 VanDerWaalsContact C-N 3.29Å; Y347-N349 PolarHBondContact O-N 2.9Å; Y347-W370 WeakPolarHBondContact O-CH2 3.32Å; Y347-W370 WeakPolarHBondContact O-CZ2 3.41Å; Y347-I389 HydrophobicContact CD1-CG1 4.08Å; Y347-I389 HydrophobicContact CD1-CG2 4.25Å; Y347-I389 HydrophobicContact CE1-CD1 4.26Å; Y347-I389 HydrophobicContact CE1-CG1 4.07Å; Y347-I389 HydrophobicContact CE1-CG2 3.72Å; Y347-N432 PolarHBondContact O-ND2 3.14Å
348	S	91.4	Very high	88.6	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.007	20%	0.2	C	C	.	.			trans	-82	-4.1	177.6	71.5	0	0	0	0	114.5	L350 R388 I431	S348-L350 PolarHBondContact O-N 3.4Å; S348-L350 PolarHBondContact OG-N 2.71Å; S348-R388 WeakPolarHBondContact CB-O 3.46Å; S348-R388 PolarHBondContact N-O 2.84Å; S348-R388 WeakPolarHBondContact OG-CA 3.35Å; S348-R388 PolarHBondContact OG-O 3.15Å; S348-R388 VanDerWaalsContact OG-O 3.14Å; S348-I431 VanDerWaalsContact O-CD1 3.24Å; S348-I431 WeakPolarHBondContact O-CD1 3.32Å; S348-I431 WeakPolarHBondContact O-CG1 3.33Å
349	N	90.8	Very high	88.2	Confident	16 Å²	16	38 Å²	38	9%	0.086	21%	0.205	C	C	.	.	S	Bend	trans	70.3	-3.2	-168.3	-58.1	-18.9	0	0	0	115.8	N244 F310 Y347 G351 I431	N244-N349 WeakPolarHBondContact CA-O 3.49Å; N244-N349 VanDerWaalsContact CB-O 3.32Å; N244-N349 WeakPolarHBondContact CB-O 2.98Å; N244-N349 VanDerWaalsContact CG-O 3.24Å; N244-N349 PolarHBondContact OD1-O 2.91Å; F310-N349 HydrophobicContact CB-CB 4.02Å; F310-N349 WeakPolarHBondContact CB-O 3.14Å; Y347-N349 VanDerWaalsContact C-N 3.29Å; Y347-N349 PolarHBondContact O-N 2.9Å; N349-G351 PolarHBondContact O-N 3.48Å; N349-I431 PolarHBondContact ND2-O 3.02Å
350	L	89.9	Confident	87.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-75	-8.2	174	-61.8	179.7	0	0	0	113.8	F310 S348 A355 L356 I368 A382 R388 L407 I431	F310-L350 HydrophobicContact CD1-CD2 4.05Å; F310-L350 HydrophobicContact CD2-CD2 4.44Å; F310-L350 HydrophobicContact CE1-CD2 4.07Å; F310-L350 HydrophobicContact CE2-CD2 4.46Å; F310-L350 HydrophobicContact CG-CD2 4.21Å; F310-L350 HydrophobicContact CZ-CD2 4.26Å; S348-L350 PolarHBondContact O-N 3.4Å; S348-L350 PolarHBondContact OG-N 2.71Å; L350-A355 HydrophobicContact CD2-CB 4.4Å; L350-A355 WeakPolarHBondContact O-CB 3.38Å; L350-A355 PolarHBondContact O-N 3.25Å; L350-L356 HydrophobicContact CD1-CD1 4.31Å; L350-L356 HydrophobicContact CD2-CD1 4.4Å; L350-L356 HydrophobicContact CD2-CG 4.24Å; L350-I368 HydrophobicContact CD1-CD1 3.8Å; L350-I368 HydrophobicContact CD1-CG1 4Å; L350-A382 HydrophobicContact CD1-CB 3.95Å; L350-R388 HydrophobicContact CB-CG 4.07Å; L350-R388 HydrophobicContact CD1-CG 4.34Å; L350-L407 HydrophobicContact CD1-CD1 4.22Å; L350-I431 HydrophobicContact CG-CD1 4.35Å
351	G	84.1	Confident	87.2	Confident	6 Å²	6	37.4 Å²	37.4	6%	0.062	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	-178.7	177.9	0	0	0	0	0	115.3	N244 E279 N349 R388	N244-G351 WeakPolarHBondContact O-CA 3.34Å; E279-G351 WeakPolarHBondContact OE1-CA 3.32Å; N349-G351 PolarHBondContact O-N 3.48Å; G351-R388 WeakPolarHBondContact O-CD 3.47Å; G351-R388 PolarHBondContact O-NH1 3.11Å
352	Y	85.3	Confident	86.6	Confident	51 Å²	51	37.8 Å²	37.8	20%	0.2	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-40	177.2	-179.9	-84.2	0	0	0	112.8	Q272 F276 E279 N354 L385 R388	Q272-Y352 WeakPolarHBondContact O-CE2 3.44Å; F276-Y352 HydrophobicContact CB-CD2 3.95Å; F276-Y352 HydrophobicContact CB-CE2 3.69Å; F276-Y352 AromaticContact CD2-CD1 3.94Å; F276-Y352 HydrophobicContact CD2-CD1 3.94Å; F276-Y352 HydrophobicContact CD2-CD2 4.26Å; F276-Y352 HydrophobicContact CD2-CE1 4.05Å; F276-Y352 HydrophobicContact CD2-CE2 4.34Å; F276-Y352 HydrophobicContact CD2-CG 4.09Å; E279-Y352 PolarHBondContact OE1-N 3.26Å; E279-Y352 WeakPolarHBondContact OE2-CB 3.43Å; Y352-N354 PolarHBondContact O-N 2.78Å; Y352-L385 HydrophobicContact CD2-CD1 3.51Å; Y352-L385 HydrophobicContact CD2-CD2 3.77Å; Y352-L385 HydrophobicContact CD2-CG 4.21Å; Y352-L385 HydrophobicContact CE2-CD1 4.03Å; Y352-L385 HydrophobicContact CE2-CD2 3.41Å; Y352-L385 VanDerWaalsContact CE2-CD2 3.41Å; Y352-L385 HydrophobicContact CE2-CG 4.33Å; Y352-L385 HydrophobicContact CG-CD1 3.94Å; Y352-R388 PolarHBondContact O-NH1 2.88Å
353	F	82.1	Confident	86.2	Confident	95 Å²	95	35 Å²	35	42%	0.417	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	0.9	-179.1	-66.2	-71.1	0	0	0	114.1	F276 M280	F276-F353 HydrophobicContact CE2-CE2 4.29Å; F276-F353 AromaticContact CE2-CZ 3.86Å; F276-F353 HydrophobicContact CE2-CZ 3.86Å; M280-F353 HydrophobicContact CE-CE2 4.32Å
354	N	82.4	Confident	85.8	Confident	26 Å²	26	37 Å²	37	14%	0.139	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	96.4	-176.4	-172.9	24.3	0	0	0	111.4	Y352 L356 D357	Y352-N354 PolarHBondContact O-N 2.78Å; N354-L356 PolarHBondContact O-N 3.09Å; N354-L356 VanDerWaalsContact O-N 3.12Å; N354-L356 PolarHBondContact OD1-N 3.4Å; N354-D357 HydrophobicContact CB-CB 4.47Å; N354-D357 VanDerWaalsContact O-CB 3.25Å; N354-D357 WeakPolarHBondContact O-CB 3.49Å; N354-D357 PolarHBondContact O-N 3.15Å
355	A	83.6	Confident	85.3	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.025	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-29	177	0	0	0	0	0	112.1	F310 I312 N323 L350 D357	F310-A355 HydrophobicContact CD1-CB 3.67Å; F310-A355 HydrophobicContact CE1-CB 4.12Å; I312-A355 VanDerWaalsContact CD1-C 3.42Å; I312-A355 HydrophobicContact CD1-CB 3.59Å; I312-A355 WeakPolarHBondContact CD1-O 3.47Å; N323-A355 PolarHBondContact ND2-O 2.86Å; N323-A355 VanDerWaalsContact ND2-O 3.11Å; L350-A355 HydrophobicContact CD2-CB 4.4Å; L350-A355 WeakPolarHBondContact O-CB 3.38Å; L350-A355 PolarHBondContact O-N 3.25Å; A355-D357 PolarHBondContact O-N 2.66Å
356	L	85.5	Confident	85.2	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.052	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	10.6	178.7	-59	174.9	0	0	0	114.2	F310 L350 N354 T359 A366 A382 L407	F310-L356 HydrophobicContact CE1-CD2 4.11Å; F310-L356 HydrophobicContact CZ-CD2 4.17Å; L350-L356 HydrophobicContact CD1-CD1 4.31Å; L350-L356 HydrophobicContact CD2-CD1 4.4Å; L350-L356 HydrophobicContact CD2-CG 4.24Å; N354-L356 PolarHBondContact O-N 3.09Å; N354-L356 VanDerWaalsContact O-N 3.12Å; N354-L356 PolarHBondContact OD1-N 3.4Å; L356-T359 HydrophobicContact CB-CG2 4.3Å; L356-T359 HydrophobicContact CD2-CG2 4.23Å; L356-T359 WeakPolarHBondContact O-CB 3.25Å; L356-T359 WeakPolarHBondContact O-CG2 3.33Å; L356-T359 PolarHBondContact O-N 3.45Å; L356-T359 PolarHBondContact O-OG1 2.8Å; L356-A366 HydrophobicContact CD1-CB 4.39Å; L356-A382 HydrophobicContact CD1-CB 4.43Å; L356-L407 HydrophobicContact CD1-CD1 4.25Å; L356-L407 HydrophobicContact CD1-CD2 4.28Å
357	D	82.6	Confident	85.2	Confident	89 Å²	89	38.7 Å²	38.7	48%	0.476	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	135.5	175.7	-171	44.1	0	0	0	111.5	N323 N354 A355 T359	N323-D357 PolarHBondContact ND2-O 3.19Å; N354-D357 HydrophobicContact CB-CB 4.47Å; N354-D357 VanDerWaalsContact O-CB 3.25Å; N354-D357 WeakPolarHBondContact O-CB 3.49Å; N354-D357 PolarHBondContact O-N 3.15Å; A355-D357 PolarHBondContact O-N 2.66Å; D357-T359 VanDerWaalsContact C-N 3.34Å
358	N	84.6	Confident	85.3	Confident	73 Å²	73	37.1 Å²	37.1	39%	0.39	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	27.5	-170.1	-43.2	-74.6	0	0	0	115.3	N323	N323-N358 PolarHBondContact N-O 3.49Å
359	T	83.7	Confident	85.5	Confident	32 Å²	32	37.1 Å²	37.1	20%	0.196	19%	0.193	C	C	.	.	S	Bend	trans	-92.2	172.2	165.5	60.8	0	0	0	0	111	N323 L356 D357 M363	N323-T359 HydrophobicContact CB-CG2 3.81Å; L356-T359 HydrophobicContact CB-CG2 4.3Å; L356-T359 HydrophobicContact CD2-CG2 4.23Å; L356-T359 WeakPolarHBondContact O-CB 3.25Å; L356-T359 WeakPolarHBondContact O-CG2 3.33Å; L356-T359 PolarHBondContact O-N 3.45Å; L356-T359 PolarHBondContact O-OG1 2.8Å; D357-T359 VanDerWaalsContact C-N 3.34Å; T359-M363 VanDerWaalsContact OG1-CB 3.23Å; T359-M363 WeakPolarHBondContact OG1-CB 3.24Å
360	A	82.5	Confident	85.8	Confident	15 Å²	15	36.3 Å²	36.3	12%	0.124	19%	0.189	C	C	.	.			trans	-65.7	150.3	-179.2	0	0	0	0	0	112.1	A183 W362 M363	A183-A360 HydrophobicContact CB-CB 3.78Å; A360-W362 PolarHBondContact O-N 3.09Å; A360-M363 VanDerWaalsContact O-CB 3.23Å; A360-M363 WeakPolarHBondContact O-CB 3.44Å; A360-M363 PolarHBondContact O-N 2.99Å
361	V	79.8	Confident	86.1	Confident	111 Å²	111	39.4 Å²	39.4	67%	0.673	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-49.5	-37.2	-172.4	-176.8	0	0	0	0	113.7	M363 E364	V361-M363 PolarHBondContact O-N 2.94Å; V361-E364 VanDerWaalsContact O-CB 3.29Å; V361-E364 WeakPolarHBondContact O-CB 3.39Å; V361-E364 VanDerWaalsContact O-CG 3.3Å; V361-E364 WeakPolarHBondContact O-CG 3.37Å; V361-E364 PolarHBondContact O-N 3.06Å
362	W	76.9	Confident	86.7	Confident	42 Å²	42	40 Å²	40	16%	0.159	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-65.9	-20.3	179.9	55.4	-79.3	0	0	0	113.8	Q186 L187 A360 E364 S365 I409 T411	Q186-W362 HydrophobicContact CB-CH2 4.13Å; Q186-W362 HydrophobicContact CB-CZ2 3.54Å; Q186-W362 WeakPolarHBondContact O-CH2 3.47Å; L187-W362 HydrophobicContact CB-CZ2 4.26Å; L187-W362 HydrophobicContact CD2-CD2 4.1Å; L187-W362 HydrophobicContact CD2-CE3 4.18Å; L187-W362 HydrophobicContact CD2-CH2 3.63Å; L187-W362 HydrophobicContact CD2-CZ2 3.5Å; L187-W362 HydrophobicContact CD2-CZ3 3.96Å; L187-W362 HydrophobicContact CG-CH2 4.04Å; L187-W362 HydrophobicContact CG-CZ2 3.52Å; A360-W362 PolarHBondContact O-N 3.09Å; W362-E364 PolarHBondContact O-N 3.04Å; W362-S365 PolarHBondContact O-N 2.97Å; W362-S365 PolarHBondContact O-OG 2.77Å; W362-I409 HydrophobicContact CE3-CG2 3.57Å; W362-I409 HydrophobicContact CH2-CG2 4.44Å; W362-I409 HydrophobicContact CZ3-CB 4.45Å; W362-I409 HydrophobicContact CZ3-CG2 3.32Å; W362-T411 HydrophobicContact CE3-CG2 4.11Å; W362-T411 HydrophobicContact CH2-CG2 4.1Å; W362-T411 HydrophobicContact CZ3-CG2 3.47Å; W362-T411 VanDerWaalsContact CZ3-CG2 3.47Å
363	M	84.4	Confident	87.1	Confident	6 Å²	6	41.4 Å²	41.4	3%	0.03	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-67.6	-17.9	172.1	-70.2	-77.2	-174.3	0	0	113.6	Q186 L189 F326 T359 A360 V361 S365 A366 I409	Q186-M363 HydrophobicContact CB-CE 4.39Å; L189-M363 HydrophobicContact CD1-CE 4.29Å; F326-M363 HydrophobicContact CE1-CE 4.27Å; T359-M363 VanDerWaalsContact OG1-CB 3.23Å; T359-M363 WeakPolarHBondContact OG1-CB 3.24Å; A360-M363 VanDerWaalsContact O-CB 3.23Å; A360-M363 WeakPolarHBondContact O-CB 3.44Å; A360-M363 PolarHBondContact O-N 2.99Å; V361-M363 PolarHBondContact O-N 2.94Å; M363-S365 PolarHBondContact O-N 3.33Å; M363-A366 WeakPolarHBondContact O-CB 3.48Å; M363-A366 PolarHBondContact O-N 3.02Å; M363-I409 HydrophobicContact CE-CD1 3.62Å; M363-I409 HydrophobicContact CE-CG2 4.34Å; M363-I409 HydrophobicContact SD-CD1 3.48Å; M363-I409 WeakPolarHBondContact SD-CD1 3.45Å; M363-I409 HydrophobicContact SD-CG1 4.15Å; M363-I409 HydrophobicContact SD-CG2 3.73Å
364	E	82.7	Confident	87.6	Confident	127 Å²	127	39.6 Å²	39.6	59%	0.593	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-62.9	-28.6	175.8	-65.2	179.4	175.7	0	0	112.1	V361 W362 A366	V361-E364 VanDerWaalsContact O-CB 3.29Å; V361-E364 WeakPolarHBondContact O-CB 3.39Å; V361-E364 VanDerWaalsContact O-CG 3.3Å; V361-E364 WeakPolarHBondContact O-CG 3.37Å; V361-E364 PolarHBondContact O-N 3.06Å; W362-E364 PolarHBondContact O-N 3.04Å; E364-A366 PolarHBondContact O-N 3.13Å
365	S	83.4	Confident	88.2	Confident	32 Å²	32	47.2 Å²	47.2	22%	0.224	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-78	-4.1	174.6	73.7	0	0	0	0	114	W362 M363 Q367	W362-S365 PolarHBondContact O-N 2.97Å; W362-S365 PolarHBondContact O-OG 2.77Å; M363-S365 PolarHBondContact O-N 3.33Å; S365-Q367 PolarHBondContact O-N 2.77Å
366	A	90	Very high	88.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.			trans	-60.8	140.6	-175.5	0	0	0	0	0	111.3	L356 M363 E364 A382 L407 F408 I409	L356-A366 HydrophobicContact CD1-CB 4.39Å; M363-A366 WeakPolarHBondContact O-CB 3.48Å; M363-A366 PolarHBondContact O-N 3.02Å; E364-A366 PolarHBondContact O-N 3.13Å; A366-A382 HydrophobicContact CB-CB 4.21Å; A366-A382 WeakPolarHBondContact O-CB 3.34Å; A366-A382 PolarHBondContact O-N 2.8Å; A366-L407 HydrophobicContact CB-CD1 3.98Å; A366-F408 CarbonylContact C-O 3.44Å; A366-F408 VanDerWaalsContact CA-O 3.31Å; A366-F408 WeakPolarHBondContact CA-O 2.84Å; A366-I409 HydrophobicContact CB-CG1 4.32Å
367	Q	92.3	Very high	89.2	Confident	42 Å²	42	55.6 Å²	55.6	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.1	-178.8	-62.5	176.6	3.1	0	0	110.8	S365 N380 L381 L407 F408	S365-Q367 PolarHBondContact O-N 2.77Å; Q367-N380 CarbonylContact C-O 3.59Å; Q367-N380 WeakPolarHBondContact CA-O 3.4Å; Q367-N380 WeakPolarHBondContact CB-O 3.49Å; Q367-L381 HydrophobicContact CG-CD2 4.22Å; Q367-L407 WeakPolarHBondContact O-CA 3.4Å; Q367-F408 HydrophobicContact CB-CB 4.17Å; Q367-F408 PolarHBondContact N-O 2.92Å; Q367-F408 PolarHBondContact O-N 3.09Å
368	I	94	Very high	89.7	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.1	167.9	-60.1	169.3	0	0	0	107.9	L350 R379 N380 A382 R388 C405 F406	L350-I368 HydrophobicContact CD1-CD1 3.8Å; L350-I368 HydrophobicContact CD1-CG1 4Å; I368-R379 WeakPolarHBondContact O-CA 3.26Å; I368-N380 PolarHBondContact N-O 2.84Å; I368-N380 PolarHBondContact O-N 2.97Å; I368-A382 HydrophobicContact CD1-CB 4.08Å; I368-A382 HydrophobicContact CG1-CB 3.78Å; I368-R388 HydrophobicContact CD1-CB 4.42Å; I368-R388 HydrophobicContact CD1-CG 3.76Å; I368-C405 WeakPolarHBondContact CG2-SG 3.06Å; I368-F406 WeakPolarHBondContact CA-O 3.23Å
369	V	94.6	Very high	90.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	115.6	177.1	-177.8	0	0	0	0	109.3	K371 E376 S378 R379 F406 F408	V369-K371 HydrophobicContact CG1-CG 4.33Å; V369-E376 HydrophobicContact CG1-CG 3.91Å; V369-S378 CarbonylContact C-O 3.54Å; V369-S378 WeakPolarHBondContact CA-O 3.19Å; V369-R379 HydrophobicContact CG2-CB 4.01Å; V369-R379 HydrophobicContact CG2-CG 3.92Å; V369-R379 VanDerWaalsContact CG2-CZ 3.45Å; V369-F406 HydrophobicContact CB-CB 4.49Å; V369-F406 PolarHBondContact N-O 2.92Å; V369-F406 PolarHBondContact O-N 2.68Å; V369-F408 HydrophobicContact CB-CD2 3.66Å; V369-F408 HydrophobicContact CB-CE2 3.48Å; V369-F408 VanDerWaalsContact CB-CE2 3.48Å; V369-F408 HydrophobicContact CG1-CE2 3.98Å; V369-F408 HydrophobicContact CG2-CD2 3.24Å; V369-F408 HydrophobicContact CG2-CE2 3.44Å; V369-F408 VanDerWaalsContact CG2-CE2 3.44Å; V369-F408 HydrophobicContact CG2-CG 4.01Å; V369-F408 HydrophobicContact CG2-CZ 4.34Å
370	W	96.9	Very high	90.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	129.3	171.7	-75.2	102.9	0	0	0	109.8	L346 Y347 Y377 S378 W403 C405 N432 F434	L346-W370 HydrophobicContact CB-CH2 4.24Å; L346-W370 HydrophobicContact CB-CZ2 3.75Å; L346-W370 HydrophobicContact CD1-CD2 4.22Å; L346-W370 HydrophobicContact CD1-CG 4.25Å; L346-W370 HydrophobicContact CD2-CH2 4.5Å; L346-W370 HydrophobicContact CD2-CZ3 4.39Å; Y347-W370 WeakPolarHBondContact O-CH2 3.32Å; Y347-W370 WeakPolarHBondContact O-CZ2 3.41Å; W370-Y377 PolarHBondContact O-N 2.89Å; W370-S378 PolarHBondContact N-O 2.8Å; W370-S378 PolarHBondContact O-N 2.79Å; W370-W403 HydrophobicContact CB-CZ3 4.38Å; W370-W403 AromaticContact CE3-CE3 3.92Å; W370-W403 HydrophobicContact CE3-CE3 3.92Å; W370-W403 HydrophobicContact CZ3-CB 4.38Å; W370-C405 HydrophobicContact CD2-CB 3.94Å; W370-C405 HydrophobicContact CE3-CB 3.66Å; W370-C405 HydrophobicContact CH2-CB 3.59Å; W370-C405 HydrophobicContact CZ2-CB 3.84Å; W370-C405 VanDerWaalsContact CZ2-SG 3.55Å; W370-C405 HydrophobicContact CZ3-CB 3.5Å; W370-N432 HydrophobicContact CH2-CB 4.36Å; W370-F434 AromaticContact CH2-CE1 3.85Å; W370-F434 HydrophobicContact CH2-CE1 3.85Å; W370-F434 AromaticContact CZ3-CE1 3.7Å; W370-F434 HydrophobicContact CZ3-CE1 3.7Å; W370-F434 HydrophobicContact CZ3-CZ 4.23Å
371	K	96.1	Very high	91.1	Very high	64 Å²	64	55.6 Å²	55.6	28%	0.278	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.7	171.6	-61.3	-167.3	178.2	-172	0	110.6	V369 Y375 K404 F406	V369-K371 HydrophobicContact CG1-CG 4.33Å; K371-Y375 CarbonylContact C-O 3.35Å; K371-Y375 WeakPolarHBondContact CA-O 3.23Å; K371-K404 PolarHBondContact N-O 3.12Å; K371-K404 PolarHBondContact O-N 3.14Å; K371-F406 HydrophobicContact CB-CE2 4.19Å; K371-F406 HydrophobicContact CD-CD2 4.04Å; K371-F406 HydrophobicContact CD-CE2 3.73Å; K371-F406 HydrophobicContact CG-CD2 4.02Å; K371-F406 HydrophobicContact CG-CE2 3.99Å
372	L	96.6	Very high	91.6	Very high	20 Å²	20	50.4 Å²	50.4	11%	0.105	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.4	173	173.3	57.7	0	0	0	108.6	G374 Y375 T398 W403	L372-G374 PolarHBondContact O-N 3.02Å; L372-Y375 PolarHBondContact N-O 3.37Å; L372-Y375 PolarHBondContact O-N 2.7Å; L372-T398 WeakPolarHBondContact CD2-O 3.14Å; L372-W403 HydrophobicContact CB-CH2 4.41Å; L372-W403 HydrophobicContact CB-CZ2 4.4Å; L372-W403 HydrophobicContact CB-CZ3 4.47Å; L372-W403 HydrophobicContact CD1-CD2 4.16Å; L372-W403 HydrophobicContact CD1-CG 4.3Å; L372-W403 HydrophobicContact CD1-CZ2 4.12Å; L372-W403 HydrophobicContact CD2-CH2 4.33Å; L372-W403 HydrophobicContact CD2-CZ2 3.88Å; L372-W403 HydrophobicContact CG-CZ2 4.36Å
373	N	95.1	Very high	92.2	Very high	80 Å²	80	53.4 Å²	53.4	43%	0.428	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	29.3	-178.5	-58	-34.9	0	0	0	113.4	H400 G401 T402	N373-H400 PolarHBondContact ND2-O 2.98Å; N373-G401 VanDerWaalsContact OD1-CA 3.3Å; N373-G401 WeakPolarHBondContact OD1-CA 3.13Å; N373-T402 PolarHBondContact N-O 3.23Å; N373-T402 PolarHBondContact OD1-N 2.91Å; N373-T402 PolarHBondContact OD1-OG1 2.82Å
374	G	92	Very high	92.5	Very high	57 Å²	57	59.4 Å²	59.4	59%	0.588	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	93	-17.9	-177.5	0	0	0	0	0	115.4	L372	L372-G374 PolarHBondContact O-N 3.02Å
375	Y	95.3	Very high	92.6	Very high	185 Å²	185	54.8 Å²	54.8	73%	0.725	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	141.1	177.9	-61.3	-80.9	0	0	0	111.5	K371 L372 Y377	K371-Y375 CarbonylContact C-O 3.35Å; K371-Y375 WeakPolarHBondContact CA-O 3.23Å; L372-Y375 PolarHBondContact N-O 3.37Å; L372-Y375 PolarHBondContact O-N 2.7Å; Y375-Y377 PolarHBondContact O-N 2.81Å
376	E	94.9	Very high	92.8	Very high	99 Å²	99	57.3 Å²	57.3	46%	0.463	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	116.6	177.2	-174.8	165.9	139.5	0	0	110.3	V369 R379	V369-E376 HydrophobicContact CG1-CG 3.91Å; E376-R379 WeakPolarHBondContact OE1-CB 3.46Å; E376-R379 IonicContact OE1-CZ 3.15Å; E376-R379 IonicContact OE1-NE 2.81Å; E376-R379 PolarHBondContact OE1-NE 2.82Å; E376-R379 IonicContact OE1-NH2 3.35Å; E376-R379 IonicContact OE2-CZ 3.89Å; E376-R379 IonicContact OE2-NE 2.67Å; E376-R379 PolarHBondContact OE2-NE 3.35Å; E376-R379 IonicContact OE2-NH2 2.79Å; E376-R379 PolarHBondContact OE2-NH2 3.46Å
377	Y	94.3	Very high	92.8	Very high	91 Å²	91	60.9 Å²	60.9	36%	0.357	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-44.2	176.6	177.8	-99.4	0	0	0	111.2	L346 W370 Y375 H399 W403	L346-Y377 HydrophobicContact CD1-CE1 4.3Å; W370-Y377 PolarHBondContact O-N 2.89Å; Y375-Y377 PolarHBondContact O-N 2.81Å; Y377-H399 AromaticContact CE2-CD2 3.89Å; Y377-H399 AromaticContact CE2-NE2 3.74Å; Y377-H399 AromaticContact CZ-NE2 3.89Å; Y377-H399 PolarHBondContact OH-NE2 2.76Å; Y377-W403 AromaticContact CD1-CH2 3.81Å; Y377-W403 HydrophobicContact CD1-CH2 3.81Å; Y377-W403 AromaticContact CD1-CZ3 3.7Å; Y377-W403 HydrophobicContact CD1-CZ3 3.7Å; Y377-W403 AromaticContact CD2-CH2 3.94Å; Y377-W403 HydrophobicContact CD2-CH2 3.94Å; Y377-W403 HydrophobicContact CD2-CZ3 4.43Å; Y377-W403 AromaticContact CE1-CH2 3.94Å; Y377-W403 HydrophobicContact CE1-CH2 3.94Å; Y377-W403 HydrophobicContact CE1-CZ3 4.17Å; Y377-W403 HydrophobicContact CE2-CH2 4.06Å; Y377-W403 AromaticContact CG-CH2 3.8Å; Y377-W403 HydrophobicContact CG-CH2 3.8Å; Y377-W403 AromaticContact CG-CZ3 3.84Å; Y377-W403 HydrophobicContact CG-CZ3 3.84Å
378	S	94.3	Very high	92.7	Very high	16 Å²	16	59.8 Å²	59.8	11%	0.112	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	143.8	178.5	68.1	0	0	0	0	111.6	V369 W370 Q390	V369-S378 CarbonylContact C-O 3.54Å; V369-S378 WeakPolarHBondContact CA-O 3.19Å; W370-S378 PolarHBondContact N-O 2.8Å; W370-S378 PolarHBondContact O-N 2.79Å; S378-Q390 PolarHBondContact OG-OE1 3.36Å
379	R	94.3	Very high	92.6	Very high	89 Å²	89	59.7 Å²	59.7	34%	0.336	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127.8	173.9	165.9	-176.7	-58.9	-86.2	-1.9	109.8	I368 V369 E376	I368-R379 WeakPolarHBondContact O-CA 3.26Å; V369-R379 HydrophobicContact CG2-CB 4.01Å; V369-R379 HydrophobicContact CG2-CG 3.92Å; V369-R379 VanDerWaalsContact CG2-CZ 3.45Å; E376-R379 WeakPolarHBondContact OE1-CB 3.46Å; E376-R379 IonicContact OE1-CZ 3.15Å; E376-R379 IonicContact OE1-NE 2.81Å; E376-R379 PolarHBondContact OE1-NE 2.82Å; E376-R379 IonicContact OE1-NH2 3.35Å; E376-R379 IonicContact OE2-CZ 3.89Å; E376-R379 IonicContact OE2-NE 2.67Å; E376-R379 PolarHBondContact OE2-NE 3.35Å; E376-R379 IonicContact OE2-NH2 2.79Å; E376-R379 PolarHBondContact OE2-NH2 3.46Å
380	N	93.6	Very high	92.4	Very high	38 Å²	38	60.6 Å²	60.6	20%	0.203	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	167.7	178.4	-77.1	-70.7	0	0	0	111.9	Q367 I368 R387	Q367-N380 CarbonylContact C-O 3.59Å; Q367-N380 WeakPolarHBondContact CA-O 3.4Å; Q367-N380 WeakPolarHBondContact CB-O 3.49Å; I368-N380 PolarHBondContact N-O 2.84Å; I368-N380 PolarHBondContact O-N 2.97Å; N380-R387 HydrophobicContact CB-CB 4Å; N380-R387 HydrophobicContact CB-CG 3.6Å; N380-R387 WeakPolarHBondContact ND2-CD 3.29Å; N380-R387 PolarHBondContact ND2-NE 2.88Å
381	L	92.1	Very high	92.1	Very high	65 Å²	65	63.8 Å²	63.8	34%	0.34	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.4	173.8	-64.5	171.7	0	0	0	112.3	Q367 L383 R384	Q367-L381 HydrophobicContact CG-CD2 4.22Å; L381-L383 VanDerWaalsContact C-N 3.25Å; L381-L383 PolarHBondContact O-N 2.87Å; L381-R384 HydrophobicContact CB-CG 4.44Å; L381-R384 PolarHBondContact O-N 3.41Å
382	A	90.4	Very high	92	Very high	3 Å²	3	61 Å²	61	3%	0.025	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.6	177.5	0	0	0	0	0	113	L350 L356 A366 I368 R384 R388 L407	L350-A382 HydrophobicContact CD1-CB 3.95Å; L356-A382 HydrophobicContact CD1-CB 4.43Å; A366-A382 HydrophobicContact CB-CB 4.21Å; A366-A382 WeakPolarHBondContact O-CB 3.34Å; A366-A382 PolarHBondContact O-N 2.8Å; I368-A382 HydrophobicContact CD1-CB 4.08Å; I368-A382 HydrophobicContact CG1-CB 3.78Å; A382-R384 PolarHBondContact O-N 3.37Å; A382-R388 VanDerWaalsContact O-CD 3.24Å; A382-R388 WeakPolarHBondContact O-CD 2.99Å; A382-R388 VanDerWaalsContact O-CG 3.23Å; A382-R388 WeakPolarHBondContact O-CG 3.5Å; A382-R388 PolarHBondContact O-NE 3.43Å; A382-L407 HydrophobicContact CB-CD1 4.21Å
383	L	89.1	Confident	91.7	Very high	104 Å²	104	63.4 Å²	63.4	55%	0.545	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.2	177.9	-169.1	66.6	0	0	0	112.4	L381 L385	L381-L383 VanDerWaalsContact C-N 3.25Å; L381-L383 PolarHBondContact O-N 2.87Å; L383-L385 PolarHBondContact O-N 3.37Å
384	R	89.7	Confident	91.6	Very high	132 Å²	132	67.6 Å²	67.6	50%	0.498	32%	0.321	S	S	.	.			trans	-73.7	117.9	-176.7	-68	-175.9	175.5	176.5	-2.9	111.4	L381 A382 N386 R387 R388	L381-R384 HydrophobicContact CB-CG 4.44Å; L381-R384 PolarHBondContact O-N 3.41Å; A382-R384 PolarHBondContact O-N 3.37Å; R384-N386 WeakPolarHBondContact CB-OD1 3.14Å; R384-N386 PolarHBondContact O-N 3.34Å; R384-R387 HydrophobicContact CB-CB 4.21Å; R384-R387 HydrophobicContact CB-CG 3.88Å; R384-R387 PolarHBondContact O-N 2.84Å; R384-R388 PolarHBondContact O-N 3.33Å
385	L	86.6	Confident	91.7	Very high	31 Å²	31	64.9 Å²	64.9	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-56.9	-45.8	-177.8	-179.7	69.2	0	0	0	113.4	L275 Y352 L383 R387 R388 I389	L275-L385 HydrophobicContact CD1-CD2 4.16Å; L275-L385 HydrophobicContact CD1-CG 4.1Å; Y352-L385 HydrophobicContact CD2-CD1 3.51Å; Y352-L385 HydrophobicContact CD2-CD2 3.77Å; Y352-L385 HydrophobicContact CD2-CG 4.21Å; Y352-L385 HydrophobicContact CE2-CD1 4.03Å; Y352-L385 HydrophobicContact CE2-CD2 3.41Å; Y352-L385 VanDerWaalsContact CE2-CD2 3.41Å; Y352-L385 HydrophobicContact CE2-CG 4.33Å; Y352-L385 HydrophobicContact CG-CD1 3.94Å; L383-L385 PolarHBondContact O-N 3.37Å; L385-R387 PolarHBondContact O-N 3.26Å; L385-R388 PolarHBondContact O-N 3.48Å; L385-R388 VanDerWaalsContact O-N 3.1Å; L385-I389 PolarHBondContact O-N 3.36Å; L385-I389 VanDerWaalsContact O-N 3.09Å
386	N	87.6	Confident	91.6	Very high	84 Å²	84	59.8 Å²	59.8	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-5.7	178.1	63.8	-14.4	0	0	0	114.5	L275 R384 I389 Q390	L275-N386 HydrophobicContact CD1-CB 4.43Å; R384-N386 WeakPolarHBondContact CB-OD1 3.14Å; R384-N386 PolarHBondContact O-N 3.34Å; N386-I389 CarbonylContact C-O 3.58Å; N386-I389 VanDerWaalsContact O-O 3.1Å; N386-Q390 WeakPolarHBondContact O-CA 3.39Å
387	R	89.4	Confident	91.4	Very high	75 Å²	75	59.2 Å²	59.2	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-107.7	-22.5	175.5	-55.7	-56.5	-175	179.4	0.4	112.6	N380 R384 L385	N380-R387 HydrophobicContact CB-CB 4Å; N380-R387 HydrophobicContact CB-CG 3.6Å; N380-R387 WeakPolarHBondContact ND2-CD 3.29Å; N380-R387 PolarHBondContact ND2-NE 2.88Å; R384-R387 HydrophobicContact CB-CB 4.21Å; R384-R387 HydrophobicContact CB-CG 3.88Å; R384-R387 PolarHBondContact O-N 2.84Å; L385-R387 PolarHBondContact O-N 3.26Å
388	R	90.9	Very high	91.3	Very high	19 Å²	19	60 Å²	60	7%	0.072	29%	0.293	C	S	.	.	H	α-helix	trans	-69.3	-42.1	165.9	-70.1	-176.6	-84.1	145.7	-10.1	111.3	S348 L350 G351 Y352 I368 A382 R384 L385	S348-R388 WeakPolarHBondContact CB-O 3.46Å; S348-R388 PolarHBondContact N-O 2.84Å; S348-R388 WeakPolarHBondContact OG-CA 3.35Å; S348-R388 PolarHBondContact OG-O 3.15Å; S348-R388 VanDerWaalsContact OG-O 3.14Å; L350-R388 HydrophobicContact CB-CG 4.07Å; L350-R388 HydrophobicContact CD1-CG 4.34Å; G351-R388 WeakPolarHBondContact O-CD 3.47Å; G351-R388 PolarHBondContact O-NH1 3.11Å; Y352-R388 PolarHBondContact O-NH1 2.88Å; I368-R388 HydrophobicContact CD1-CB 4.42Å; I368-R388 HydrophobicContact CD1-CG 3.76Å; A382-R388 VanDerWaalsContact O-CD 3.24Å; A382-R388 WeakPolarHBondContact O-CD 2.99Å; A382-R388 VanDerWaalsContact O-CG 3.23Å; A382-R388 WeakPolarHBondContact O-CG 3.5Å; A382-R388 PolarHBondContact O-NE 3.43Å; R384-R388 PolarHBondContact O-N 3.33Å; L385-R388 PolarHBondContact O-N 3.48Å; L385-R388 VanDerWaalsContact O-N 3.1Å
389	I	90.6	Very high	91.4	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	100.3	172.8	-54.8	167.7	0	0	0	106.9	L275 E279 Y345 L346 Y347 L385 N386	L275-I389 HydrophobicContact CD2-CB 4.36Å; L275-I389 HydrophobicContact CD2-CG2 3.99Å; E279-I389 HydrophobicContact CB-CD1 4.01Å; E279-I389 HydrophobicContact CG-CD1 4.44Å; Y345-I389 HydrophobicContact CD1-CG2 3.95Å; L346-I389 WeakPolarHBondContact O-CA 3.43Å; Y347-I389 HydrophobicContact CD1-CG1 4.08Å; Y347-I389 HydrophobicContact CD1-CG2 4.25Å; Y347-I389 HydrophobicContact CE1-CD1 4.26Å; Y347-I389 HydrophobicContact CE1-CG1 4.07Å; Y347-I389 HydrophobicContact CE1-CG2 3.72Å; L385-I389 PolarHBondContact O-N 3.36Å; L385-I389 VanDerWaalsContact O-N 3.09Å; N386-I389 CarbonylContact C-O 3.58Å; N386-I389 VanDerWaalsContact O-O 3.1Å
390	Q	90.4	Very high	91.4	Very high	18 Å²	18	58.8 Å²	58.8	8%	0.084	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122	-174.1	172.4	173.1	-16.2	0	0	110.8	Y345 L346 S378 N386	Y345-Q390 CarbonylContact C-O 3.5Å; Y345-Q390 WeakPolarHBondContact CA-O 3.49Å; L346-Q390 HydrophobicContact CB-CB 4.18Å; L346-Q390 HydrophobicContact CD1-CG 4.36Å; L346-Q390 PolarHBondContact N-O 2.81Å; L346-Q390 PolarHBondContact O-N 3.03Å; S378-Q390 PolarHBondContact OG-OE1 3.36Å; N386-Q390 WeakPolarHBondContact O-CA 3.39Å
391	L	91.3	Very high	91.5	Very high	68 Å²	68	57.1 Å²	57.1	36%	0.356	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	125.2	173.8	175.7	59.9	0	0	0	110.7	P343 Y345	P343-L391 HydrophobicContact CB-CD1 4.05Å; Y345-L391 HydrophobicContact CD1-CB 3.97Å; Y345-L391 HydrophobicContact CD1-CD1 4.12Å; Y345-L391 HydrophobicContact CD2-CD1 4.22Å; Y345-L391 HydrophobicContact CE1-CB 3.7Å; Y345-L391 HydrophobicContact CE1-CD1 3.8Å; Y345-L391 HydrophobicContact CE1-CD2 4.39Å; Y345-L391 HydrophobicContact CE1-CG 4.16Å; Y345-L391 HydrophobicContact CE2-CD1 3.88Å; Y345-L391 HydrophobicContact CG-CD1 4.34Å
392	I	93	Very high	91.7	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	110.1	157.3	-55.7	176.8	0	0	0	106.1	P343 F344 L346 Y394 L395 W403	P343-I392 WeakPolarHBondContact CA-O 3.07Å; F344-I392 HydrophobicContact CD1-CD1 4.48Å; F344-I392 PolarHBondContact N-O 2.83Å; F344-I392 PolarHBondContact O-N 3.34Å; L346-I392 HydrophobicContact CD1-CD1 3.97Å; L346-I392 HydrophobicContact CD1-CG1 4.21Å; L346-I392 HydrophobicContact CD2-CD1 4.24Å; L346-I392 HydrophobicContact CG-CD1 3.98Å; L346-I392 HydrophobicContact CG-CG1 4.26Å; I392-Y394 PolarHBondContact O-N 3.31Å; I392-L395 HydrophobicContact CD1-CD2 4.29Å; I392-L395 HydrophobicContact CG2-CD2 4.2Å; I392-W403 HydrophobicContact CD1-CH2 3.98Å; I392-W403 HydrophobicContact CD1-CZ2 4.21Å
393	P	91.2	Very high	92.1	Very high	72 Å²	72	56.6 Å²	56.6	47%	0.468	28%	0.28	S	S	.	.	S	Bend	trans	-68.2	-35.3	-171.6	25.8	-34	0	0	0	113.2	P343	P343-P393 WeakPolarHBondContact CA-O 3.34Å
394	Y	92.7	Very high	92.4	Very high	167 Å²	167	55.1 Å²	55.1	66%	0.655	27%	0.269	S	S	*	.	S	Bend	trans	-137.4	117.2	178.5	-51.4	-73.2	0	0	0	108.4	I392	I392-Y394 PolarHBondContact O-N 3.31Å
395	L	94.4	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.			trans	-71.5	129.1	172.6	-79	175.6	0	0	0	110.6	A338 E340 G341 D342 F344 I392 H399 L436 V438	A338-L395 HydrophobicContact CB-CD1 3.34Å; E340-L395 CarbonylContact C-O 3.21Å; E340-L395 WeakPolarHBondContact CA-O 3.24Å; E340-L395 WeakPolarHBondContact CG-O 3.46Å; G341-L395 PolarHBondContact N-O 2.89Å; D342-L395 HydrophobicContact CB-CD1 4.42Å; D342-L395 WeakPolarHBondContact O-CB 3.34Å; D342-L395 WeakPolarHBondContact O-CG 3.18Å; D342-L395 PolarHBondContact O-N 3.17Å; F344-L395 HydrophobicContact CB-CD1 3.64Å; F344-L395 HydrophobicContact CB-CD2 3.77Å; F344-L395 HydrophobicContact CB-CG 3.68Å; F344-L395 HydrophobicContact CD2-CD1 4.31Å; F344-L395 HydrophobicContact CG-CD1 4.14Å; F344-L395 HydrophobicContact CG-CD2 4.31Å; I392-L395 HydrophobicContact CD1-CD2 4.29Å; I392-L395 HydrophobicContact CG2-CD2 4.2Å; L395-H399 HydrophobicContact CD2-CB 3.84Å; L395-L436 HydrophobicContact CD1-CD2 4.47Å; L395-L436 HydrophobicContact CD2-CD2 3.82Å; L395-V438 HydrophobicContact CB-CG1 4.34Å; L395-V438 HydrophobicContact CD1-CG2 4.37Å; L395-V438 HydrophobicContact CD2-CG2 4.46Å
396	N	92.7	Very high	93.1	Very high	78 Å²	78	49.2 Å²	49.2	42%	0.417	25%	0.246	S	C	.	.			trans	-104.3	161.9	168.8	-62.1	-9.5	0	0	0	110.3	T398 H399	N396-T398 PolarHBondContact O-N 2.7Å; N396-H399 PolarHBondContact N-ND1 3.49Å; N396-H399 WeakPolarHBondContact O-CB 3.49Å; N396-H399 PolarHBondContact O-N 3.36Å; N396-H399 PolarHBondContact O-ND1 3.49Å
397	L	91.7	Very high	93.3	Very high	88 Å²	88	45.2 Å²	45.2	46%	0.461	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-54.4	-27.3	172.6	-66	175.8	0	0	0	113.9	H399 H400 V438	L397-H399 PolarHBondContact O-N 2.81Å; L397-H400 VanDerWaalsContact O-CB 3.22Å; L397-H400 WeakPolarHBondContact O-CB 3.28Å; L397-H400 PolarHBondContact O-N 3.19Å; L397-V438 HydrophobicContact CD2-CG1 4.41Å
398	T	92.5	Very high	93.3	Very high	106 Å²	106	42.9 Å²	42.9	65%	0.65	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-65.2	-21.1	175.6	58.5	0	0	0	0	113.6	L372 N396 H400	L372-T398 WeakPolarHBondContact CD2-O 3.14Å; N396-T398 PolarHBondContact O-N 2.7Å; T398-H400 PolarHBondContact O-N 3.39Å
399	H	95.2	Very high	93.1	Very high	15 Å²	15	42 Å²	42	7%	0.069	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-81	-3.8	178.5	-60.7	89.6	0	0	0	113	Y377 L395 N396 L397 W403 L436 V438	Y377-H399 AromaticContact CE2-CD2 3.89Å; Y377-H399 AromaticContact CE2-NE2 3.74Å; Y377-H399 AromaticContact CZ-NE2 3.89Å; Y377-H399 PolarHBondContact OH-NE2 2.76Å; L395-H399 HydrophobicContact CD2-CB 3.84Å; N396-H399 PolarHBondContact N-ND1 3.49Å; N396-H399 WeakPolarHBondContact O-CB 3.49Å; N396-H399 PolarHBondContact O-N 3.36Å; N396-H399 PolarHBondContact O-ND1 3.49Å; L397-H399 PolarHBondContact O-N 2.81Å; H399-W403 HydrophobicContact CB-CZ2 4.12Å; H399-W403 AromaticContact CD2-CZ2 3.96Å; H399-W403 PolarHBondContact O-NE1 3.36Å; H399-L436 HydrophobicContact CB-CD2 4.5Å; H399-V438 HydrophobicContact CB-CG2 4.35Å
400	H	95.1	Very high	92.3	Very high	65 Å²	65	45 Å²	45	30%	0.301	23%	0.228	S	C	.	.			trans	-67	130.8	175.3	176.5	-78.3	0	0	0	111.5	N373 L397 T398 Y435 L436 V438	N373-H400 PolarHBondContact ND2-O 2.98Å; L397-H400 VanDerWaalsContact O-CB 3.22Å; L397-H400 WeakPolarHBondContact O-CB 3.28Å; L397-H400 PolarHBondContact O-N 3.19Å; T398-H400 PolarHBondContact O-N 3.39Å; H400-Y435 AromaticContact CE1-CZ 3.91Å; H400-Y435 PolarHBondContact CE1-OH 2.86Å; H400-Y435 PolarHBondContact NE2-OH 3.25Å; H400-L436 WeakPolarHBondContact CA-O 3.35Å; H400-V438 HydrophobicContact CB-CB 4.36Å; H400-V438 HydrophobicContact CB-CG2 4.43Å
401	G	95.7	Very high	91.1	Very high	3 Å²	3	44.6 Å²	44.6	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.2	-158.3	171.3	0	0	0	0	0	114.7	N373 L436	N373-G401 VanDerWaalsContact OD1-CA 3.3Å; N373-G401 WeakPolarHBondContact OD1-CA 3.13Å; G401-L436 PolarHBondContact N-O 2.99Å; G401-L436 PolarHBondContact O-N 2.83Å
402	T	96.3	Very high	89.5	Confident	57 Å²	57	48.4 Å²	48.4	35%	0.35	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.6	-179.1	57.7	0	0	0	0	110.6	N373 Y435	N373-T402 PolarHBondContact N-O 3.23Å; N373-T402 PolarHBondContact OD1-N 2.91Å; N373-T402 PolarHBondContact OD1-OG1 2.82Å; T402-Y435 HydrophobicContact CG2-CD2 3.74Å; T402-Y435 HydrophobicContact CG2-CE2 4.25Å
403	W	97.2	Very high	87.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.1	174.2	-73.5	82.3	0	0	0	110	L346 W370 L372 Y377 I392 H399 E433 F434	L346-W403 HydrophobicContact CD1-CE3 4.23Å; L346-W403 HydrophobicContact CD1-CH2 4.2Å; L346-W403 HydrophobicContact CD1-CZ3 3.66Å; L346-W403 HydrophobicContact CD2-CD2 4.06Å; L346-W403 HydrophobicContact CD2-CE3 3.72Å; L346-W403 HydrophobicContact CD2-CH2 4.36Å; L346-W403 HydrophobicContact CD2-CZ3 3.89Å; L346-W403 HydrophobicContact CG-CZ3 4.45Å; W370-W403 HydrophobicContact CB-CZ3 4.38Å; W370-W403 AromaticContact CE3-CE3 3.92Å; W370-W403 HydrophobicContact CE3-CE3 3.92Å; W370-W403 HydrophobicContact CZ3-CB 4.38Å; L372-W403 HydrophobicContact CB-CH2 4.41Å; L372-W403 HydrophobicContact CB-CZ2 4.4Å; L372-W403 HydrophobicContact CB-CZ3 4.47Å; L372-W403 HydrophobicContact CD1-CD2 4.16Å; L372-W403 HydrophobicContact CD1-CG 4.3Å; L372-W403 HydrophobicContact CD1-CZ2 4.12Å; L372-W403 HydrophobicContact CD2-CH2 4.33Å; L372-W403 HydrophobicContact CD2-CZ2 3.88Å; L372-W403 HydrophobicContact CG-CZ2 4.36Å; Y377-W403 AromaticContact CD1-CH2 3.81Å; Y377-W403 HydrophobicContact CD1-CH2 3.81Å; Y377-W403 AromaticContact CD1-CZ3 3.7Å; Y377-W403 HydrophobicContact CD1-CZ3 3.7Å; Y377-W403 AromaticContact CD2-CH2 3.94Å; Y377-W403 HydrophobicContact CD2-CH2 3.94Å; Y377-W403 HydrophobicContact CD2-CZ3 4.43Å; Y377-W403 AromaticContact CE1-CH2 3.94Å; Y377-W403 HydrophobicContact CE1-CH2 3.94Å; Y377-W403 HydrophobicContact CE1-CZ3 4.17Å; Y377-W403 HydrophobicContact CE2-CH2 4.06Å; Y377-W403 AromaticContact CG-CH2 3.8Å; Y377-W403 HydrophobicContact CG-CH2 3.8Å; Y377-W403 AromaticContact CG-CZ3 3.84Å; Y377-W403 HydrophobicContact CG-CZ3 3.84Å; I392-W403 HydrophobicContact CD1-CH2 3.98Å; I392-W403 HydrophobicContact CD1-CZ2 4.21Å; H399-W403 HydrophobicContact CB-CZ2 4.12Å; H399-W403 AromaticContact CD2-CZ2 3.96Å; H399-W403 PolarHBondContact O-NE1 3.36Å; W403-E433 WeakPolarHBondContact O-CA 3.5Å; W403-F434 HydrophobicContact CB-CD1 4.29Å; W403-F434 HydrophobicContact CB-CD2 3.99Å; W403-F434 HydrophobicContact CB-CE1 3.91Å; W403-F434 HydrophobicContact CB-CE2 3.58Å; W403-F434 HydrophobicContact CB-CG 4.33Å; W403-F434 HydrophobicContact CB-CZ 3.53Å; W403-F434 AromaticContact CD1-CE2 3.73Å; W403-F434 HydrophobicContact CD2-CZ 4.43Å; W403-F434 HydrophobicContact CG-CD2 4.4Å; W403-F434 AromaticContact CG-CE2 3.67Å; W403-F434 HydrophobicContact CG-CE2 3.67Å; W403-F434 AromaticContact CG-CZ 3.8Å; W403-F434 HydrophobicContact CG-CZ 3.8Å; W403-F434 PolarHBondContact N-O 2.84Å; W403-F434 PolarHBondContact O-N 2.83Å
404	K	95.8	Very high	85.5	Confident	74 Å²	74	52.7 Å²	52.7	32%	0.322	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.8	174.7	-67.6	-176.5	179.4	-174.9	0	109.6	K371 F406 L430 N432 E433	K371-K404 PolarHBondContact N-O 3.12Å; K371-K404 PolarHBondContact O-N 3.14Å; K404-F406 HydrophobicContact CB-CD2 4.34Å; K404-F406 HydrophobicContact CB-CE2 3.54Å; K404-F406 HydrophobicContact CB-CZ 3.96Å; K404-F406 HydrophobicContact CD-CZ 4.22Å; K404-L430 HydrophobicContact CB-CD1 3.95Å; K404-L430 HydrophobicContact CD-CD1 4.43Å; K404-L430 HydrophobicContact CG-CD1 4.28Å; K404-N432 WeakPolarHBondContact CA-O 3.43Å; K404-E433 WeakPolarHBondContact CE-OE1 3.3Å; K404-E433 HydrophobicContact CG-CG 4.22Å; K404-E433 IonicContact NZ-OE1 3.41Å
405	C	95.9	Very high	83.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.8	176.5	-162.1	0	0	0	0	109.4	I368 W370 I431 N432	I368-C405 WeakPolarHBondContact CG2-SG 3.06Å; W370-C405 HydrophobicContact CD2-CB 3.94Å; W370-C405 HydrophobicContact CE3-CB 3.66Å; W370-C405 HydrophobicContact CH2-CB 3.59Å; W370-C405 HydrophobicContact CZ2-CB 3.84Å; W370-C405 VanDerWaalsContact CZ2-SG 3.55Å; W370-C405 HydrophobicContact CZ3-CB 3.5Å; C405-I431 HydrophobicContact CB-CD1 4.41Å; C405-I431 HydrophobicContact CB-CG1 3.78Å; C405-I431 WeakPolarHBondContact O-CG1 3.04Å; C405-I431 PolarHBondContact O-N 2.92Å; C405-N432 HydrophobicContact CB-CB 3.68Å; C405-N432 PolarHBondContact N-O 2.75Å; C405-N432 PolarHBondContact O-N 2.78Å
406	F	94.6	Very high	81.1	Confident	39 Å²	39	55.3 Å²	55.3	17%	0.171	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.2	-179.7	-64.6	-84.6	0	0	0	110.7	I368 V369 K371 K404 F408 I428 Y429 L430	I368-F406 WeakPolarHBondContact CA-O 3.23Å; V369-F406 HydrophobicContact CB-CB 4.49Å; V369-F406 PolarHBondContact N-O 2.92Å; V369-F406 PolarHBondContact O-N 2.68Å; K371-F406 HydrophobicContact CB-CE2 4.19Å; K371-F406 HydrophobicContact CD-CD2 4.04Å; K371-F406 HydrophobicContact CD-CE2 3.73Å; K371-F406 HydrophobicContact CG-CD2 4.02Å; K371-F406 HydrophobicContact CG-CE2 3.99Å; K404-F406 HydrophobicContact CB-CD2 4.34Å; K404-F406 HydrophobicContact CB-CE2 3.54Å; K404-F406 HydrophobicContact CB-CZ 3.96Å; K404-F406 HydrophobicContact CD-CZ 4.22Å; F406-F408 HydrophobicContact CB-CD2 3.95Å; F406-F408 HydrophobicContact CB-CE2 3.57Å; F406-F408 HydrophobicContact CG-CE2 4.39Å; F406-I428 HydrophobicContact CB-CG2 3.93Å; F406-I428 HydrophobicContact CD1-CG2 3.63Å; F406-I428 HydrophobicContact CE1-CG2 4.47Å; F406-I428 HydrophobicContact CG-CG2 4.06Å; F406-Y429 CarbonylContact C-O 3.48Å; F406-Y429 VanDerWaalsContact CA-O 3.24Å; F406-Y429 WeakPolarHBondContact CA-O 3.5Å; F406-L430 HydrophobicContact CD1-CB 4.28Å; F406-L430 HydrophobicContact CD1-CD1 4Å; F406-L430 HydrophobicContact CE1-CB 4.17Å; F406-L430 HydrophobicContact CE1-CD1 3.59Å; F406-L430 HydrophobicContact CE1-CG 4.45Å; F406-L430 HydrophobicContact CE2-CD1 4.34Å; F406-L430 HydrophobicContact CZ-CD1 3.79Å
407	L	92.5	Very high	78.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.6	168	-171.9	67	0	0	0	108.8	L350 L356 A366 Q367 A382 I409 I428 Y429 I431	L350-L407 HydrophobicContact CD1-CD1 4.22Å; L356-L407 HydrophobicContact CD1-CD1 4.25Å; L356-L407 HydrophobicContact CD1-CD2 4.28Å; A366-L407 HydrophobicContact CB-CD1 3.98Å; Q367-L407 WeakPolarHBondContact O-CA 3.4Å; A382-L407 HydrophobicContact CB-CD1 4.21Å; L407-I409 HydrophobicContact CD2-CD1 3.83Å; L407-I409 HydrophobicContact CD2-CG1 4.15Å; L407-I409 HydrophobicContact CG-CD1 4.19Å; L407-I409 HydrophobicContact CG-CG1 3.94Å; L407-I428 WeakPolarHBondContact O-CA 3.45Å; L407-Y429 PolarHBondContact N-O 2.82Å; L407-Y429 PolarHBondContact O-N 3.33Å; L407-I431 HydrophobicContact CB-CD1 4.19Å; L407-I431 HydrophobicContact CB-CG2 3.65Å; L407-I431 HydrophobicContact CD2-CG2 4.46Å
408	F	89.8	Confident	76.6	Confident	25 Å²	25	58.9 Å²	58.9	11%	0.11	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	119.8	175	-79.4	-106.3	0	0	0	108.8	A366 Q367 V369 F406 R427 I428	A366-F408 CarbonylContact C-O 3.44Å; A366-F408 VanDerWaalsContact CA-O 3.31Å; A366-F408 WeakPolarHBondContact CA-O 2.84Å; Q367-F408 HydrophobicContact CB-CB 4.17Å; Q367-F408 PolarHBondContact N-O 2.92Å; Q367-F408 PolarHBondContact O-N 3.09Å; V369-F408 HydrophobicContact CB-CD2 3.66Å; V369-F408 HydrophobicContact CB-CE2 3.48Å; V369-F408 VanDerWaalsContact CB-CE2 3.48Å; V369-F408 HydrophobicContact CG1-CE2 3.98Å; V369-F408 HydrophobicContact CG2-CD2 3.24Å; V369-F408 HydrophobicContact CG2-CE2 3.44Å; V369-F408 VanDerWaalsContact CG2-CE2 3.44Å; V369-F408 HydrophobicContact CG2-CG 4.01Å; V369-F408 HydrophobicContact CG2-CZ 4.34Å; F406-F408 HydrophobicContact CB-CD2 3.95Å; F406-F408 HydrophobicContact CB-CE2 3.57Å; F406-F408 HydrophobicContact CG-CE2 4.39Å; F408-R427 WeakPolarHBondContact CA-O 3.44Å; F408-I428 HydrophobicContact CD1-CD1 4.09Å; F408-I428 HydrophobicContact CD1-CG1 3.73Å; F408-I428 HydrophobicContact CD2-CG2 4.28Å; F408-I428 HydrophobicContact CE1-CD1 3.35Å; F408-I428 HydrophobicContact CE1-CG1 3.51Å; F408-I428 HydrophobicContact CE1-CG2 4.29Å; F408-I428 HydrophobicContact CE2-CG2 3.88Å; F408-I428 HydrophobicContact CG-CG1 4.38Å; F408-I428 HydrophobicContact CZ-CD1 3.7Å; F408-I428 HydrophobicContact CZ-CG1 3.97Å; F408-I428 HydrophobicContact CZ-CG2 3.89Å
409	I	85.7	Confident	74.6	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.3	179.3	-45.9	175.7	0	0	0	107.1	F326 W362 M363 A366 L407 T411 R427 Y429	F326-I409 HydrophobicContact CZ-CD1 4.46Å; W362-I409 HydrophobicContact CE3-CG2 3.57Å; W362-I409 HydrophobicContact CH2-CG2 4.44Å; W362-I409 HydrophobicContact CZ3-CB 4.45Å; W362-I409 HydrophobicContact CZ3-CG2 3.32Å; M363-I409 HydrophobicContact CE-CD1 3.62Å; M363-I409 HydrophobicContact CE-CG2 4.34Å; M363-I409 HydrophobicContact SD-CD1 3.48Å; M363-I409 WeakPolarHBondContact SD-CD1 3.45Å; M363-I409 HydrophobicContact SD-CG1 4.15Å; M363-I409 HydrophobicContact SD-CG2 3.73Å; A366-I409 HydrophobicContact CB-CG1 4.32Å; L407-I409 HydrophobicContact CD2-CD1 3.83Å; L407-I409 HydrophobicContact CD2-CG1 4.15Å; L407-I409 HydrophobicContact CG-CD1 4.19Å; L407-I409 HydrophobicContact CG-CG1 3.94Å; I409-T411 PolarHBondContact O-N 2.91Å; I409-R427 PolarHBondContact N-O 2.8Å; I409-R427 PolarHBondContact O-N 3.36Å; I409-R427 VanDerWaalsContact O-N 3.08Å; I409-Y429 HydrophobicContact CD1-CD2 3.69Å; I409-Y429 HydrophobicContact CD1-CE2 3.46Å; I409-Y429 VanDerWaalsContact CD1-CE2 3.46Å; I409-Y429 HydrophobicContact CG1-CD2 4.22Å; I409-Y429 HydrophobicContact CG1-CE2 4.15Å
410	Q	73.9	Confident	72.3	Confident	65 Å²	65	65.2 Å²	65.2	30%	0.304	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	105	176.1	-65.1	-174	-34.1	0	0	107.5
411	T	66.8	Low	70	Confident	8 Å²	8	67.7 Å²	67.7	5%	0.049	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115.3	170.1	65.4	0	0	0	0	107.7	L187 W362 I409 I425 R427	L187-T411 HydrophobicContact CD2-CG2 3.89Å; W362-T411 HydrophobicContact CE3-CG2 4.11Å; W362-T411 HydrophobicContact CH2-CG2 4.1Å; W362-T411 HydrophobicContact CZ3-CG2 3.47Å; W362-T411 VanDerWaalsContact CZ3-CG2 3.47Å; I409-T411 PolarHBondContact O-N 2.91Å; T411-I425 PolarHBondContact OG1-O 2.92Å; T411-R427 HydrophobicContact CG2-CG 4.04Å
412	Y	57.8	Low	67.6	Low	149 Å²	149	78.4 Å²	78.4	58%	0.584	40%	0.403	S	S	*	.			trans	-77.7	139.4	157.4	-57.4	-81.3	0	0	0	106.8
413	H	50.4	Low	64.9	Low	83 Å²	83	79.5 Å²	79.5	38%	0.384	41%	0.409	S	S	.	.			trans	-54.6	153.7	159	-82.9	-88.9	0	0	0	108.3
414	L	49.3	Very low	62.5	Low	82 Å²	82	82.6 Å²	82.6	43%	0.429	43%	0.431	S	S	.	.			trans	-42.8	139.2	175.3	-88.3	79.3	0	0	0	109.2	L187 S416 Q417	L187-L414 HydrophobicContact CD1-CD1 4.18Å; L414-S416 PolarHBondContact O-N 3.3Å; L414-Q417 PolarHBondContact O-N 3.14Å
415	P	47.7	Very low	60.4	Low	123 Å²	123	83 Å²	83	80%	0.799	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-49.9	-23.2	-176.1	-28.2	33.2	0	0	0	114.7	Q417 V418	P415-Q417 VanDerWaalsContact C-N 3.31Å; P415-Q417 PolarHBondContact O-N 2.8Å; P415-V418 WeakPolarHBondContact O-CG2 3.15Å
416	S	46.2	Very low	58.9	Low	100 Å²	100	87.3 Å²	87.3	70%	0.699	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-74.8	-5.2	176.7	60.5	0	0	0	0	115.8	L414	L414-S416 PolarHBondContact O-N 3.3Å
417	Q	45.1	Very low	58.1	Low	139 Å²	139	86.8 Å²	86.8	65%	0.65	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-127.2	33.7	177.7	-72.3	-172.5	-19.2	0	0	112.3	L414 P415 D419	L414-Q417 PolarHBondContact O-N 3.14Å; P415-Q417 VanDerWaalsContact C-N 3.31Å; P415-Q417 PolarHBondContact O-N 2.8Å; Q417-D419 PolarHBondContact O-N 2.77Å
418	V	45.7	Very low	57.9	Low	102 Å²	102	91.1 Å²	91.1	62%	0.618	48%	0.478	S	S	*	.			trans	-82.2	60.6	174.3	-172.3	0	0	0	0	109.6	P415	P415-V418 WeakPolarHBondContact O-CG2 3.15Å
419	D	49.6	Very low	57.9	Low	162 Å²	162	90.4 Å²	90.4	87%	0.866	48%	0.475	S	S	*	.	S	Bend	trans	-100.4	-1.1	171.6	-105.7	-11.8	0	0	0	112.7	Q417	Q417-D419 PolarHBondContact O-N 2.77Å
420	N	46.3	Very low	58.3	Low	91 Å²	91	91.2 Å²	91.2	49%	0.487	48%	0.479	S	S	.	.			trans	-151.1	107.4	173.6	-138.5	-23.8	0	0	0	113.2	R422 T423	N420-R422 PolarHBondContact O-N 3.09Å; N420-R422 VanDerWaalsContact O-N 3.12Å; N420-T423 PolarHBondContact O-N 2.99Å; N420-T423 PolarHBondContact O-OG1 2.94Å
421	P	47.8	Very low	59.2	Low	118 Å²	118	88.1 Å²	88.1	77%	0.766	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11	174.8	26.6	-33.5	0	0	0	113.2
422	R	45.3	Very low	60.5	Low	227 Å²	227	88.1 Å²	88.1	86%	0.857	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-9.3	-179.1	-91.3	-173.8	-101.8	-139.1	-3.8	115.4	N420	N420-R422 PolarHBondContact O-N 3.09Å; N420-R422 VanDerWaalsContact O-N 3.12Å
423	T	40.3	Very low	62.3	Low	80 Å²	80	82.6 Å²	82.6	49%	0.491	44%	0.444	S	S	.	.			trans	-112.9	47.8	-179.9	55.9	0	0	0	0	111.9	N420 I425	N420-T423 PolarHBondContact O-N 2.99Å; N420-T423 PolarHBondContact O-OG1 2.94Å; T423-I425 PolarHBondContact O-N 2.77Å
424	S	46.2	Very low	64.4	Low	66 Å²	66	79.1 Å²	79.1	46%	0.462	43%	0.428	S	S	.	.			trans	-69.9	108.8	163.3	56.8	0	0	0	0	108.8	N426	S424-N426 PolarHBondContact O-N 2.82Å
425	I	51.6	Low	66.7	Low	83 Å²	83	79.1 Å²	79.1	43%	0.426	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	95.5	171.7	-60.4	168.4	0	0	0	106.5	T411 T423 R427	T411-I425 PolarHBondContact OG1-O 2.92Å; T423-I425 PolarHBondContact O-N 2.77Å; I425-R427 HydrophobicContact CG2-CG 4.29Å; I425-R427 PolarHBondContact O-N 3.35Å
426	N	64	Low	69	Low	89 Å²	89	73.2 Å²	73.2	48%	0.476	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	119.4	172.5	-72.7	-23.5	0	0	0	109.2	S424	S424-N426 PolarHBondContact O-N 2.82Å
427	R	79.2	Confident	71.3	Confident	29 Å²	29	71.2 Å²	71.2	11%	0.109	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.1	175.1	-62.4	-167.1	179.7	-170.6	0.3	110.6	L187 F408 I409 T411 I425 Y429	L187-R427 PolarHBondContact O-NH1 3.14Å; L187-R427 PolarHBondContact O-NH2 2.96Å; F408-R427 WeakPolarHBondContact CA-O 3.44Å; I409-R427 PolarHBondContact N-O 2.8Å; I409-R427 PolarHBondContact O-N 3.36Å; I409-R427 VanDerWaalsContact O-N 3.08Å; T411-R427 HydrophobicContact CG2-CG 4.04Å; I425-R427 HydrophobicContact CG2-CG 4.29Å; I425-R427 PolarHBondContact O-N 3.35Å; R427-Y429 HydrophobicContact CB-CE2 3.77Å; R427-Y429 WeakPolarHBondContact CD-OH 3.41Å
428	I	86.9	Confident	73.7	Confident	90 Å²	90	64.9 Å²	64.9	46%	0.462	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	117	-174.8	-51.4	175.9	0	0	0	108	F406 L407 F408	F406-I428 HydrophobicContact CB-CG2 3.93Å; F406-I428 HydrophobicContact CD1-CG2 3.63Å; F406-I428 HydrophobicContact CE1-CG2 4.47Å; F406-I428 HydrophobicContact CG-CG2 4.06Å; L407-I428 WeakPolarHBondContact O-CA 3.45Å; F408-I428 HydrophobicContact CD1-CD1 4.09Å; F408-I428 HydrophobicContact CD1-CG1 3.73Å; F408-I428 HydrophobicContact CD2-CG2 4.28Å; F408-I428 HydrophobicContact CE1-CD1 3.35Å; F408-I428 HydrophobicContact CE1-CG1 3.51Å; F408-I428 HydrophobicContact CE1-CG2 4.29Å; F408-I428 HydrophobicContact CE2-CG2 3.88Å; F408-I428 HydrophobicContact CG-CG1 4.38Å; F408-I428 HydrophobicContact CZ-CD1 3.7Å; F408-I428 HydrophobicContact CZ-CG1 3.97Å; F408-I428 HydrophobicContact CZ-CG2 3.89Å
429	Y	90.9	Very high	75.8	Confident	10 Å²	10	64.9 Å²	64.9	4%	0.039	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.1	176.5	-56.3	-87	0	0	0	110	L189 I195 F326 F406 L407 I409 R427 I431	L189-Y429 HydrophobicContact CB-CE1 4.33Å; L189-Y429 WeakPolarHBondContact CB-OH 3.46Å; I195-Y429 HydrophobicContact CD1-CD1 4.27Å; F326-Y429 HydrophobicContact CE2-CD1 4.14Å; F326-Y429 HydrophobicContact CE2-CG 4.15Å; F326-Y429 HydrophobicContact CZ-CD1 4.11Å; F326-Y429 HydrophobicContact CZ-CD2 4.03Å; F326-Y429 HydrophobicContact CZ-CE1 4.21Å; F326-Y429 HydrophobicContact CZ-CE2 4.13Å; F326-Y429 HydrophobicContact CZ-CG 4.01Å; F406-Y429 CarbonylContact C-O 3.48Å; F406-Y429 VanDerWaalsContact CA-O 3.24Å; F406-Y429 WeakPolarHBondContact CA-O 3.5Å; L407-Y429 PolarHBondContact N-O 2.82Å; L407-Y429 PolarHBondContact O-N 3.33Å; I409-Y429 HydrophobicContact CD1-CD2 3.69Å; I409-Y429 HydrophobicContact CD1-CE2 3.46Å; I409-Y429 VanDerWaalsContact CD1-CE2 3.46Å; I409-Y429 HydrophobicContact CG1-CD2 4.22Å; I409-Y429 HydrophobicContact CG1-CE2 4.15Å; R427-Y429 HydrophobicContact CB-CE2 3.77Å; R427-Y429 WeakPolarHBondContact CD-OH 3.41Å; Y429-I431 PolarHBondContact O-N 3.32Å
430	L	93	Very high	77.6	Confident	20 Å²	20	59.4 Å²	59.4	11%	0.105	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.8	170.2	-175.6	69.7	0	0	0	108	I195 T328 I330 K404 F406	I195-L430 HydrophobicContact CD1-CB 4.44Å; I195-L430 HydrophobicContact CG2-CB 4.32Å; T328-L430 WeakPolarHBondContact CB-O 3.34Å; T328-L430 WeakPolarHBondContact CG2-O 3.4Å; T328-L430 PolarHBondContact OG1-O 2.98Å; I330-L430 HydrophobicContact CD1-CB 4.12Å; I330-L430 HydrophobicContact CD1-CD2 3.37Å; I330-L430 HydrophobicContact CD1-CG 3.45Å; I330-L430 VanDerWaalsContact CD1-CG 3.45Å; K404-L430 HydrophobicContact CB-CD1 3.95Å; K404-L430 HydrophobicContact CD-CD1 4.43Å; K404-L430 HydrophobicContact CG-CD1 4.28Å; F406-L430 HydrophobicContact CD1-CB 4.28Å; F406-L430 HydrophobicContact CD1-CD1 4Å; F406-L430 HydrophobicContact CE1-CB 4.17Å; F406-L430 HydrophobicContact CE1-CD1 3.59Å; F406-L430 HydrophobicContact CE1-CG 4.45Å; F406-L430 HydrophobicContact CE2-CD1 4.34Å; F406-L430 HydrophobicContact CZ-CD1 3.79Å
431	I	93.4	Very high	79	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-24.3	-178.1	60.4	177	0	0	0	113.3	F310 T328 S348 N349 L350 C405 L407 Y429	F310-I431 HydrophobicContact CD2-CG2 4.18Å; F310-I431 HydrophobicContact CE2-CG2 4.08Å; T328-I431 VanDerWaalsContact CG2-CA 3.48Å; T328-I431 WeakPolarHBondContact CG2-O 3.48Å; S348-I431 VanDerWaalsContact O-CD1 3.24Å; S348-I431 WeakPolarHBondContact O-CD1 3.32Å; S348-I431 WeakPolarHBondContact O-CG1 3.33Å; N349-I431 PolarHBondContact ND2-O 3.02Å; L350-I431 HydrophobicContact CG-CD1 4.35Å; C405-I431 HydrophobicContact CB-CD1 4.41Å; C405-I431 HydrophobicContact CB-CG1 3.78Å; C405-I431 WeakPolarHBondContact O-CG1 3.04Å; C405-I431 PolarHBondContact O-N 2.92Å; L407-I431 HydrophobicContact CB-CD1 4.19Å; L407-I431 HydrophobicContact CB-CG2 3.65Å; L407-I431 HydrophobicContact CD2-CG2 4.46Å; Y429-I431 PolarHBondContact O-N 3.32Å
432	N	94.3	Very high	79.9	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.037	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	148.2	174.9	-160.1	-0	0	0	0	111.5	Q308 Y347 W370 K404 C405	Q308-N432 PolarHBondContact NE2-OD1 2.77Å; Y347-N432 PolarHBondContact O-ND2 3.14Å; W370-N432 HydrophobicContact CH2-CB 4.36Å; K404-N432 WeakPolarHBondContact CA-O 3.43Å; C405-N432 HydrophobicContact CB-CB 3.68Å; C405-N432 PolarHBondContact N-O 2.75Å; C405-N432 PolarHBondContact O-N 2.78Å
433	E	94.8	Very high	80.3	Confident	33 Å²	33	53.5 Å²	53.5	15%	0.154	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	131.1	175.4	178.9	174	-157.2	0	0	108.9	R197 Q308 I330 W403 K404	R197-E433 IonicContact CZ-OE2 2.84Å; R197-E433 IonicContact NE-OE2 3.11Å; R197-E433 PolarHBondContact NE-OE2 3.46Å; R197-E433 VanDerWaalsContact NE-OE2 3.15Å; R197-E433 IonicContact NH2-OE1 3.3Å; R197-E433 IonicContact NH2-OE2 2.8Å; R197-E433 PolarHBondContact NH2-OE2 3.48Å; Q308-E433 PolarHBondContact NE2-O 2.81Å; I330-E433 HydrophobicContact CG2-CB 3.75Å; W403-E433 WeakPolarHBondContact O-CA 3.5Å; K404-E433 WeakPolarHBondContact CE-OE1 3.3Å; K404-E433 HydrophobicContact CG-CG 4.22Å; K404-E433 IonicContact NZ-OE1 3.41Å
434	F	95.3	Very high	81.1	Confident	11 Å²	11	52.2 Å²	52.2	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	165.4	170.7	61.9	-93.6	0	0	0	111.4	I334 Y336 F344 L346 W370 W403 L436	I334-F434 HydrophobicContact CB-CB 4.31Å; I334-F434 HydrophobicContact CG2-CB 4.03Å; Y336-F434 HydrophobicContact CD2-CB 4.02Å; Y336-F434 AromaticContact CD2-CD2 3.51Å; Y336-F434 HydrophobicContact CD2-CD2 3.51Å; Y336-F434 HydrophobicContact CD2-CE2 4.09Å; Y336-F434 AromaticContact CD2-CG 3.82Å; Y336-F434 HydrophobicContact CD2-CG 3.82Å; Y336-F434 HydrophobicContact CE2-CB 3.82Å; Y336-F434 HydrophobicContact CE2-CD1 4.28Å; Y336-F434 AromaticContact CE2-CD2 3.95Å; Y336-F434 HydrophobicContact CE2-CD2 3.95Å; Y336-F434 AromaticContact CE2-CG 3.77Å; Y336-F434 HydrophobicContact CE2-CG 3.77Å; F344-F434 AromaticContact CE1-CE2 3.95Å; F344-F434 HydrophobicContact CE1-CE2 3.95Å; F344-F434 AromaticContact CE1-CZ 3.93Å; F344-F434 HydrophobicContact CE1-CZ 3.93Å; F344-F434 AromaticContact CZ-CE2 3.96Å; F344-F434 HydrophobicContact CZ-CE2 3.96Å; F344-F434 HydrophobicContact CZ-CZ 4.23Å; L346-F434 HydrophobicContact CD2-CZ 3.83Å; W370-F434 AromaticContact CH2-CE1 3.85Å; W370-F434 HydrophobicContact CH2-CE1 3.85Å; W370-F434 AromaticContact CZ3-CE1 3.7Å; W370-F434 HydrophobicContact CZ3-CE1 3.7Å; W370-F434 HydrophobicContact CZ3-CZ 4.23Å; W403-F434 HydrophobicContact CB-CD1 4.29Å; W403-F434 HydrophobicContact CB-CD2 3.99Å; W403-F434 HydrophobicContact CB-CE1 3.91Å; W403-F434 HydrophobicContact CB-CE2 3.58Å; W403-F434 HydrophobicContact CB-CG 4.33Å; W403-F434 HydrophobicContact CB-CZ 3.53Å; W403-F434 AromaticContact CD1-CE2 3.73Å; W403-F434 HydrophobicContact CD2-CZ 4.43Å; W403-F434 HydrophobicContact CG-CD2 4.4Å; W403-F434 AromaticContact CG-CE2 3.67Å; W403-F434 HydrophobicContact CG-CE2 3.67Å; W403-F434 AromaticContact CG-CZ 3.8Å; W403-F434 HydrophobicContact CG-CZ 3.8Å; W403-F434 PolarHBondContact N-O 2.84Å; W403-F434 PolarHBondContact O-N 2.83Å; F434-L436 HydrophobicContact CD2-CB 4.45Å; F434-L436 HydrophobicContact CE2-CB 4.15Å
435	Y	96.2	Very high	81.4	Confident	81 Å²	81	56.2 Å²	56.2	32%	0.318	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.5	172.1	-171.7	-90.3	0	0	0	110.7	I334 K335 Y336 H400 T402 K437	I334-Y435 PolarHBondContact O-N 2.98Å; K335-Y435 CarbonylContact C-O 3.58Å; K335-Y435 WeakPolarHBondContact CA-O 3.4Å; K335-Y435 HydrophobicContact CD-CD1 4.24Å; K335-Y435 HydrophobicContact CG-CD1 4.03Å; Y336-Y435 PolarHBondContact N-O 2.95Å; H400-Y435 AromaticContact CE1-CZ 3.91Å; H400-Y435 PolarHBondContact CE1-OH 2.86Å; H400-Y435 PolarHBondContact NE2-OH 3.25Å; T402-Y435 HydrophobicContact CG2-CD2 3.74Å; T402-Y435 HydrophobicContact CG2-CE2 4.25Å; Y435-K437 HydrophobicContact CD1-CB 4.4Å; Y435-K437 HydrophobicContact CE1-CB 4.02Å
436	L	96.5	Very high	81.6	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119	174.9	-175.9	62.1	0	0	0	109.9	A338 F344 L395 H399 H400 G401 F434 V438	A338-L436 HydrophobicContact CB-CD1 4.39Å; F344-L436 HydrophobicContact CD1-CD2 4.21Å; F344-L436 HydrophobicContact CD2-CD1 4.19Å; F344-L436 HydrophobicContact CE1-CD1 4.39Å; F344-L436 HydrophobicContact CE1-CD2 4.17Å; F344-L436 HydrophobicContact CE2-CD1 3.77Å; F344-L436 HydrophobicContact CZ-CD1 3.89Å; F344-L436 HydrophobicContact CZ-CD2 4.48Å; L395-L436 HydrophobicContact CD1-CD2 4.47Å; L395-L436 HydrophobicContact CD2-CD2 3.82Å; H399-L436 HydrophobicContact CB-CD2 4.5Å; H400-L436 WeakPolarHBondContact CA-O 3.35Å; G401-L436 PolarHBondContact N-O 2.99Å; G401-L436 PolarHBondContact O-N 2.83Å; F434-L436 HydrophobicContact CD2-CB 4.45Å; F434-L436 HydrophobicContact CE2-CB 4.15Å; L436-V438 HydrophobicContact CD2-CG2 4.13Å; L436-V438 HydrophobicContact CG-CG2 4.04Å
437	K	95.4	Very high	81	Confident	57 Å²	57	63.1 Å²	63.1	25%	0.248	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	108.3	172.3	-167.9	173.8	-175.2	-169.9	0	109.6	Y336 I337 A338 Y435 Y439	Y336-K437 PolarHBondContact O-N 3.47Å; I337-K437 WeakPolarHBondContact CA-O 3.12Å; I337-K437 HydrophobicContact CG1-CB 4.47Å; A338-K437 PolarHBondContact N-O 3.41Å; Y435-K437 HydrophobicContact CD1-CB 4.4Å; Y435-K437 HydrophobicContact CE1-CB 4.02Å; K437-Y439 HydrophobicContact CD-CE1 4.21Å; K437-Y439 HydrophobicContact CD-CE2 4.32Å; K437-Y439 VanDerWaalsContact CE-CE1 3.47Å; K437-Y439 WeakPolarHBondContact CE-OH 3.24Å; K437-Y439 PolarHBondContact NZ-OH 2.9Å
438	V	94.6	Very high	79.7	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.3	173.1	-171.8	0	0	0	0	109.1	A338 E340 L395 L397 H399 H400 L436	A338-V438 WeakPolarHBondContact O-CA 2.77Å; E340-V438 HydrophobicContact CB-CG1 4.3Å; L395-V438 HydrophobicContact CB-CG1 4.34Å; L395-V438 HydrophobicContact CD1-CG2 4.37Å; L395-V438 HydrophobicContact CD2-CG2 4.46Å; L397-V438 HydrophobicContact CD2-CG1 4.41Å; H399-V438 HydrophobicContact CB-CG2 4.35Å; H400-V438 HydrophobicContact CB-CB 4.36Å; H400-V438 HydrophobicContact CB-CG2 4.43Å; L436-V438 HydrophobicContact CD2-CG2 4.13Å; L436-V438 HydrophobicContact CG-CG2 4.04Å
439	Y	90.8	Very high	78.1	Confident	102 Å²	102	64.6 Å²	64.6	40%	0.4	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	142.5	169	-69.1	-71	0	0	0	110	I337 A338 L339 E340 K437	I337-Y439 HydrophobicContact CG2-CD2 3.75Å; I337-Y439 HydrophobicContact CG2-CE2 3.45Å; I337-Y439 VanDerWaalsContact CG2-CE2 3.45Å; A338-Y439 PolarHBondContact O-N 2.88Å; L339-Y439 CarbonylContact C-O 3.45Å; E340-Y439 WeakPolarHBondContact CB-O 3.43Å; E340-Y439 PolarHBondContact N-O 2.77Å; K437-Y439 HydrophobicContact CD-CE1 4.21Å; K437-Y439 HydrophobicContact CD-CE2 4.32Å; K437-Y439 VanDerWaalsContact CE-CE1 3.47Å; K437-Y439 WeakPolarHBondContact CE-OH 3.24Å; K437-Y439 PolarHBondContact NZ-OH 2.9Å
440	S	87.1	Confident	76.5	Confident	46 Å²	46	71.5 Å²	71.5	32%	0.322	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-65.5	147	172.8	55.8	0	0	0	0	110.2	E340 Q442	E340-S440 WeakPolarHBondContact OE2-CA 3.23Å; S440-Q442 PolarHBondContact O-N 3.41Å
441	T	75	Confident	74.8	Confident	83 Å²	83	78.3 Å²	78.3	51%	0.509	38%	0.378	S	S	.	.			trans	-80.2	19.7	167.9	45.1	0	0	0	0	112.2	L339 E340	L339-T441 HydrophobicContact CB-CG2 4.37Å; E340-T441 HydrophobicContact CB-CG2 4.09Å; E340-T441 WeakPolarHBondContact O-CG2 3.43Å
442	Q	66.3	Low	73	Confident	157 Å²	157	82 Å²	82	73%	0.734	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-52.1	122.7	171.1	-81.7	-168.7	-30.8	0	0	107.4	S440 S444	S440-Q442 PolarHBondContact O-N 3.41Å; Q442-S444 PolarHBondContact O-N 2.88Å
443	P	54.9	Low	71.4	Confident	72 Å²	72	88.4 Å²	88.4	47%	0.468	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-59.3	121	-177.3	23.9	-31.7	0	0	0	105.8	Q447	P443-Q447 HydrophobicContact CB-CB 4.11Å
444	S	57.4	Low	69.5	Low	54 Å²	54	90.7 Å²	90.7	38%	0.378	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-49	150.1	163.7	61.6	0	0	0	0	107.7	Q442 W446 Q447 S448	Q442-S444 PolarHBondContact O-N 2.88Å; S444-W446 CarbonylContact O-C 3.37Å; S444-W446 PolarHBondContact O-N 3.26Å; S444-Q447 PolarHBondContact O-N 2.98Å; S444-Q447 PolarHBondContact OG-N 2.78Å; S444-Q447 PolarHBondContact OG-OE1 2.98Å; S444-S448 PolarHBondContact O-N 3.27Å
445	L	52.1	Low	67.9	Low	149 Å²	149	92 Å²	92	78%	0.78	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-23.5	173.8	-102.6	153.1	0	0	0	112.7	S448 I449	L445-S448 PolarHBondContact O-OG 3.05Å; L445-S448 VanDerWaalsContact O-OG 3.11Å; L445-I449 WeakPolarHBondContact O-CG1 3.48Å
446	W	54.8	Low	66.5	Low	206 Å²	206	96.6 Å²	96.6	78%	0.78	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-38.9	173	-66.1	106.9	0	0	0	114.1	S444 I449	S444-W446 CarbonylContact O-C 3.37Å; S444-W446 PolarHBondContact O-N 3.26Å; W446-I449 HydrophobicContact CE3-CD1 4.08Å; W446-I449 WeakPolarHBondContact O-CB 3.5Å
447	Q	52.9	Low	65.3	Low	111 Å²	111	98.8 Å²	98.8	52%	0.519	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-79.9	-22	175.5	-95.8	158.8	-38.2	0	0	114.2	P443 S444 I449 E450	P443-Q447 HydrophobicContact CB-CB 4.11Å; S444-Q447 PolarHBondContact O-N 2.98Å; S444-Q447 PolarHBondContact OG-N 2.78Å; S444-Q447 PolarHBondContact OG-OE1 2.98Å; Q447-I449 PolarHBondContact O-N 3.34Å; Q447-E450 WeakPolarHBondContact O-CB 3.3Å; Q447-E450 PolarHBondContact O-N 3.35Å
448	S	51.7	Low	64.4	Low	37 Å²	37	101.8 Å²	101.8	26%	0.259	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-68.8	-14.8	173.7	65.9	0	0	0	0	112.8	S444 L445 E450	S444-S448 PolarHBondContact O-N 3.27Å; L445-S448 PolarHBondContact O-OG 3.05Å; L445-S448 VanDerWaalsContact O-OG 3.11Å; S448-E450 VanDerWaalsContact C-N 3.33Å
449	I	53.1	Low	63.6	Low	114 Å²	114	108.7 Å²	108.7	59%	0.585	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-71.6	-30.9	169.5	-59.6	170.4	0	0	0	110.6	L445 W446 Q447	L445-I449 WeakPolarHBondContact O-CG1 3.48Å; W446-I449 HydrophobicContact CE3-CD1 4.08Å; W446-I449 WeakPolarHBondContact O-CB 3.5Å; Q447-I449 PolarHBondContact O-N 3.34Å
450	E	56.2	Low	63.2	Low	155 Å²	155	110.2 Å²	110.2	72%	0.724	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-24.9	-179.9	-127.6	90.6	-142.2	0	0	113	Q447 S448	Q447-E450 WeakPolarHBondContact O-CB 3.3Å; Q447-E450 PolarHBondContact O-N 3.35Å; S448-E450 VanDerWaalsContact C-N 3.33Å
451	Y	57	Low	63.1	Low	162 Å²	162	113.4 Å²	113.4	64%	0.635	57%	0.57	S	S	*	*			trans	-86.9	118	-178.4	-85.5	-85	0	0	0	112.3	I453 T454 A455	Y451-I453 VanDerWaalsContact C-N 3.35Å; Y451-I453 PolarHBondContact O-N 2.74Å; Y451-T454 PolarHBondContact O-OG1 3.48Å; Y451-A455 PolarHBondContact O-N 2.03Å
452	P	56.4	Low	63.6	Low	78 Å²	78	114.2 Å²	114.2	51%	0.506	57%	0.571	S	S	.	*	H	α-helix	trans	-72.6	-21	-164.9	26.1	-34.6	0	0	0	114.9	R456	P452-R456 WeakPolarHBondContact O-CG 3.05Å; P452-R456 PolarHBondContact O-N 3.36Å
453	I	59.9	Low	64.7	Low	142 Å²	142	111.9 Å²	111.9	73%	0.728	56%	0.561	S	S	*	*	H	α-helix	trans	-79.4	-45.8	-172.2	-61.9	164.6	0	0	0	110.8	Y451 R456 A457	Y451-I453 VanDerWaalsContact C-N 3.35Å; Y451-I453 PolarHBondContact O-N 2.74Å; I453-R456 PolarHBondContact O-N 3.35Å; I453-A457 PolarHBondContact O-N 3.1Å
454	T	56.3	Low	66.4	Low	81 Å²	81	112.2 Å²	112.2	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-71.3	-33.4	175.5	45.4	0	0	0	0	111.7	Y451 R456 A457 L458	Y451-T454 PolarHBondContact O-OG1 3.48Å; T454-R456 VanDerWaalsContact C-N 3.35Å; T454-R456 PolarHBondContact O-N 3.39Å; T454-A457 PolarHBondContact O-N 3.42Å; T454-L458 WeakPolarHBondContact O-CB 2.96Å; T454-L458 PolarHBondContact O-N 3.35Å
455	A	62.2	Low	68	Low	39 Å²	39	115.2 Å²	115.2	32%	0.322	57%	0.573	S	S	.	*	H	α-helix	trans	-61.9	-39.3	174.5	0	0	0	0	0	112.5	Y451 K459	Y451-A455 PolarHBondContact O-N 2.03Å; A455-K459 WeakPolarHBondContact O-CB 3.32Å; A455-K459 PolarHBondContact O-N 3.29Å
456	R	66.1	Low	69.9	Low	177 Å²	177	113.1 Å²	113.1	67%	0.668	56%	0.562	S	S	*	*	H	α-helix	trans	-66.5	-46.2	175.5	-74.6	179	-161.2	173.2	5.4	112.3	P452 I453 T454 K459 Q460	P452-R456 WeakPolarHBondContact O-CG 3.05Å; P452-R456 PolarHBondContact O-N 3.36Å; I453-R456 PolarHBondContact O-N 3.35Å; T454-R456 VanDerWaalsContact C-N 3.35Å; T454-R456 PolarHBondContact O-N 3.39Å; R456-K459 PolarHBondContact O-N 3.08Å; R456-Q460 WeakPolarHBondContact O-CB 3.44Å; R456-Q460 WeakPolarHBondContact O-CG 3.26Å; R456-Q460 PolarHBondContact O-N 3.29Å
457	A	71.2	Confident	71.6	Confident	46 Å²	46	107.1 Å²	107.1	38%	0.38	55%	0.549	S	S	.	.	H	α-helix	trans	-63.9	-44.6	179.1	0	0	0	0	0	111.5	I453 T454 K459 Q460 I461	I453-A457 PolarHBondContact O-N 3.1Å; T454-A457 PolarHBondContact O-N 3.42Å; A457-K459 PolarHBondContact O-N 3.28Å; A457-Q460 PolarHBondContact O-N 3.42Å; A457-I461 VanDerWaalsContact O-CG1 3.29Å; A457-I461 WeakPolarHBondContact O-CG1 3.23Å; A457-I461 PolarHBondContact O-N 2.71Å
458	L	76	Confident	73.5	Confident	120 Å²	120	106 Å²	106	63%	0.628	55%	0.545	S	S	*	.	H	α-helix	trans	-64	-41.4	176.1	-169.4	73.4	0	0	0	111.3	T454 Q460 I461 N462	T454-L458 WeakPolarHBondContact O-CB 2.96Å; T454-L458 PolarHBondContact O-N 3.35Å; L458-Q460 VanDerWaalsContact C-N 3.33Å; L458-Q460 PolarHBondContact O-N 2.95Å; L458-I461 PolarHBondContact O-N 3.13Å; L458-N462 VanDerWaalsContact O-CB 3.28Å; L458-N462 WeakPolarHBondContact O-CB 3.48Å; L458-N462 PolarHBondContact O-N 2.71Å
459	K	78.7	Confident	75.4	Confident	152 Å²	152	105.7 Å²	105.7	66%	0.661	55%	0.547	S	S	*	.	H	α-helix	trans	-62.8	-40.8	174.9	-170.1	175.9	-176	178.2	0	111.2	A455 R456 A457 N462 M463	A455-K459 WeakPolarHBondContact O-CB 3.32Å; A455-K459 PolarHBondContact O-N 3.29Å; R456-K459 PolarHBondContact O-N 3.08Å; A457-K459 PolarHBondContact O-N 3.28Å; K459-N462 PolarHBondContact O-N 2.96Å; K459-M463 WeakPolarHBondContact O-CB 3.31Å; K459-M463 WeakPolarHBondContact O-CG 3.42Å; K459-M463 PolarHBondContact O-N 3.1Å
460	Q	81.1	Confident	77.3	Confident	134 Å²	134	105.2 Å²	105.2	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-64.8	-47	175	-77.2	176	-13.9	0	0	111.9	R456 A457 L458 N462 M463 V464	R456-Q460 WeakPolarHBondContact O-CB 3.44Å; R456-Q460 WeakPolarHBondContact O-CG 3.26Å; R456-Q460 PolarHBondContact O-N 3.29Å; A457-Q460 PolarHBondContact O-N 3.42Å; L458-Q460 VanDerWaalsContact C-N 3.33Å; L458-Q460 PolarHBondContact O-N 2.95Å; Q460-N462 VanDerWaalsContact C-N 3.3Å; Q460-N462 PolarHBondContact O-N 3.45Å; Q460-M463 PolarHBondContact O-N 3.03Å; Q460-V464 WeakPolarHBondContact O-CB 3.16Å; Q460-V464 VanDerWaalsContact O-CG2 3.26Å; Q460-V464 WeakPolarHBondContact O-CG2 3.31Å; Q460-V464 PolarHBondContact O-N 3.37Å
461	I	84.8	Confident	79.1	Confident	112 Å²	112	104.1 Å²	104.1	57%	0.574	54%	0.539	S	S	*	.	H	α-helix	trans	-58.5	-44.7	176.1	-68.3	165.3	0	0	0	110.4	A457 L458 V464 L465	A457-I461 VanDerWaalsContact O-CG1 3.29Å; A457-I461 WeakPolarHBondContact O-CG1 3.23Å; A457-I461 PolarHBondContact O-N 2.71Å; L458-I461 PolarHBondContact O-N 3.13Å; I461-V464 PolarHBondContact O-N 2.87Å; I461-L465 WeakPolarHBondContact O-CB 3.12Å; I461-L465 PolarHBondContact O-N 2.78Å
462	N	85.8	Confident	80.8	Confident	100 Å²	100	101 Å²	101	54%	0.535	53%	0.533	S	S	.	.	H	α-helix	trans	-66.6	-40.6	179.5	-153.9	4.3	0	0	0	111.7	L458 K459 Q460 L465 L466	L458-N462 VanDerWaalsContact O-CB 3.28Å; L458-N462 WeakPolarHBondContact O-CB 3.48Å; L458-N462 PolarHBondContact O-N 2.71Å; K459-N462 PolarHBondContact O-N 2.96Å; Q460-N462 VanDerWaalsContact C-N 3.3Å; Q460-N462 PolarHBondContact O-N 3.45Å; N462-L465 PolarHBondContact O-N 3.07Å; N462-L466 VanDerWaalsContact O-CB 3.3Å; N462-L466 WeakPolarHBondContact O-CB 3.38Å; N462-L466 PolarHBondContact O-N 2.85Å
463	M	89.3	Confident	82.5	Confident	108 Å²	108	100.8 Å²	100.8	53%	0.532	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-39.7	173.8	-71.9	-58.3	-61.9	0	0	112.3	K459 Q460 L466 T467	K459-M463 WeakPolarHBondContact O-CB 3.31Å; K459-M463 WeakPolarHBondContact O-CG 3.42Å; K459-M463 PolarHBondContact O-N 3.1Å; Q460-M463 PolarHBondContact O-N 3.03Å; M463-L466 PolarHBondContact O-N 2.88Å; M463-T467 WeakPolarHBondContact O-CG2 3.42Å; M463-T467 PolarHBondContact O-N 3.02Å; M463-T467 PolarHBondContact O-OG1 3.34Å
464	V	90.5	Very high	84.1	Confident	80 Å²	80	98 Å²	98	49%	0.485	52%	0.516	S	S	.	.	H	α-helix	trans	-67.4	-41.6	175.9	171	0	0	0	0	111.3	Q460 I461 L466 T467 I468	Q460-V464 WeakPolarHBondContact O-CB 3.16Å; Q460-V464 VanDerWaalsContact O-CG2 3.26Å; Q460-V464 WeakPolarHBondContact O-CG2 3.31Å; Q460-V464 PolarHBondContact O-N 3.37Å; I461-V464 PolarHBondContact O-N 2.87Å; V464-L466 VanDerWaalsContact C-N 3.28Å; V464-L466 PolarHBondContact O-N 3.32Å; V464-T467 WeakPolarHBondContact CA-OG1 3.4Å; V464-T467 PolarHBondContact O-N 3.25Å; V464-T467 PolarHBondContact O-OG1 3.38Å; V464-I468 HydrophobicContact CG1-CD1 3.75Å; V464-I468 HydrophobicContact CG1-CG1 4.42Å; V464-I468 WeakPolarHBondContact O-CB 3.27Å; V464-I468 WeakPolarHBondContact O-CD1 3.35Å; V464-I468 WeakPolarHBondContact O-CG1 3.37Å; V464-I468 PolarHBondContact O-N 3.27Å
465	L	91	Very high	85.8	Confident	116 Å²	116	97.2 Å²	97.2	61%	0.607	51%	0.508	S	S	*	.	H	α-helix	trans	-63.5	-38.8	176.2	-165.2	75.1	0	0	0	111	I461 N462 G469	I461-L465 WeakPolarHBondContact O-CB 3.12Å; I461-L465 PolarHBondContact O-N 2.78Å; N462-L465 PolarHBondContact O-N 3.07Å; L465-G469 PolarHBondContact O-N 3.05Å
466	L	93.3	Very high	87.2	Confident	105 Å²	105	100.1 Å²	100.1	55%	0.55	52%	0.517	S	S	.	.	H	α-helix	trans	-70.2	-38.4	178.6	-160.4	136.3	0	0	0	112	N462 M463 V464 G469 L470	N462-L466 VanDerWaalsContact O-CB 3.3Å; N462-L466 WeakPolarHBondContact O-CB 3.38Å; N462-L466 PolarHBondContact O-N 2.85Å; M463-L466 PolarHBondContact O-N 2.88Å; V464-L466 VanDerWaalsContact C-N 3.28Å; V464-L466 PolarHBondContact O-N 3.32Å; L466-G469 PolarHBondContact O-N 3.21Å; L466-L470 WeakPolarHBondContact O-CB 3.48Å; L466-L470 PolarHBondContact O-N 1.99Å
467	T	90.9	Very high	88.5	Confident	81 Å²	81	97.1 Å²	97.1	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-68.9	-39.8	174.1	56	0	0	0	0	112.3	M463 V464 L470 F471	M463-T467 WeakPolarHBondContact O-CG2 3.42Å; M463-T467 PolarHBondContact O-N 3.02Å; M463-T467 PolarHBondContact O-OG1 3.34Å; V464-T467 WeakPolarHBondContact CA-OG1 3.4Å; V464-T467 PolarHBondContact O-N 3.25Å; V464-T467 PolarHBondContact O-OG1 3.38Å; T467-L470 PolarHBondContact O-N 2.97Å; T467-F471 WeakPolarHBondContact O-CB 3.4Å; T467-F471 PolarHBondContact O-N 3.09Å
468	I	92.3	Very high	89.5	Confident	87 Å²	87	99.5 Å²	99.5	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-61.8	-45.9	172.9	-68.9	166.9	0	0	0	110.1	V464 L470 F471 L472	V464-I468 HydrophobicContact CG1-CD1 3.75Å; V464-I468 HydrophobicContact CG1-CG1 4.42Å; V464-I468 WeakPolarHBondContact O-CB 3.27Å; V464-I468 WeakPolarHBondContact O-CD1 3.35Å; V464-I468 WeakPolarHBondContact O-CG1 3.37Å; V464-I468 PolarHBondContact O-N 3.27Å; I468-L470 PolarHBondContact O-N 2.79Å; I468-F471 PolarHBondContact O-N 2.88Å; I468-L472 HydrophobicContact CG2-CD1 4.06Å; I468-L472 HydrophobicContact CG2-CG 4.38Å; I468-L472 WeakPolarHBondContact O-CG 3.33Å; I468-L472 PolarHBondContact O-N 2.82Å
469	G	91.2	Very high	90.3	Very high	30 Å²	30	98.7 Å²	98.7	31%	0.309	52%	0.516	S	S	.	.	H	α-helix	trans	-57.4	-46.8	175.7	0	0	0	0	0	112.2	L465 L466 F471 L472 T473	L465-G469 PolarHBondContact O-N 3.05Å; L466-G469 PolarHBondContact O-N 3.21Å; G469-F471 PolarHBondContact O-N 2.79Å; G469-L472 PolarHBondContact O-N 3.18Å; G469-T473 WeakPolarHBondContact O-CG2 3.25Å; G469-T473 PolarHBondContact O-N 3.49Å; G469-T473 PolarHBondContact O-OG1 3.23Å
470	L	94.1	Very high	90.9	Very high	104 Å²	104	95.7 Å²	95.7	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-43.3	177.1	-138.1	169.3	0	0	0	111.3	L466 T467 I468 L472 T473 L474	L466-L470 WeakPolarHBondContact O-CB 3.48Å; L466-L470 PolarHBondContact O-N 1.99Å; T467-L470 PolarHBondContact O-N 2.97Å; I468-L470 PolarHBondContact O-N 2.79Å; L470-L472 PolarHBondContact O-N 2.74Å; L470-T473 WeakPolarHBondContact CA-OG1 3.38Å; L470-T473 PolarHBondContact O-N 2.98Å; L470-T473 PolarHBondContact O-OG1 3.48Å; L470-L474 WeakPolarHBondContact O-CB 3.43Å; L470-L474 PolarHBondContact O-N 3.19Å
471	F	93.4	Very high	91.4	Very high	133 Å²	133	96.3 Å²	96.3	58%	0.583	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-42	177	-170.8	-107.1	0	0	0	112.5	T467 I468 G469 L474 I475	T467-F471 WeakPolarHBondContact O-CB 3.4Å; T467-F471 PolarHBondContact O-N 3.09Å; I468-F471 PolarHBondContact O-N 2.88Å; G469-F471 PolarHBondContact O-N 2.79Å; F471-L474 PolarHBondContact O-N 2.77Å; F471-I475 HydrophobicContact CD1-CD1 3.63Å; F471-I475 HydrophobicContact CD1-CG1 4.42Å; F471-I475 HydrophobicContact CE1-CD1 3.29Å; F471-I475 HydrophobicContact CE1-CG1 4.2Å; F471-I475 HydrophobicContact CG-CD1 4.5Å; F471-I475 HydrophobicContact CZ-CD1 3.89Å; F471-I475 HydrophobicContact CZ-CG1 4.44Å; F471-I475 WeakPolarHBondContact O-CG1 3.35Å; F471-I475 PolarHBondContact O-N 3.31Å
472	L	91.3	Very high	91.5	Very high	96 Å²	96	93.2 Å²	93.2	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-42.9	174.9	-71.1	174.7	0	0	0	111.7	I468 G469 L470 L474 I475 I476	I468-L472 HydrophobicContact CG2-CD1 4.06Å; I468-L472 HydrophobicContact CG2-CG 4.38Å; I468-L472 WeakPolarHBondContact O-CG 3.33Å; I468-L472 PolarHBondContact O-N 2.82Å; G469-L472 PolarHBondContact O-N 3.18Å; L470-L472 PolarHBondContact O-N 2.74Å; L472-L474 VanDerWaalsContact C-N 3.3Å; L472-L474 PolarHBondContact O-N 3.08Å; L472-I475 PolarHBondContact O-N 3.28Å; L472-I476 VanDerWaalsContact O-CG1 3.28Å; L472-I476 WeakPolarHBondContact O-CG1 3.23Å; L472-I476 PolarHBondContact O-N 2.63Å
473	T	92.4	Very high	91.6	Very high	74 Å²	74	90.9 Å²	90.9	45%	0.454	49%	0.488	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.3	61.2	0	0	0	0	112.2	G469 L470 I476 L477	G469-T473 WeakPolarHBondContact O-CG2 3.25Å; G469-T473 PolarHBondContact O-N 3.49Å; G469-T473 PolarHBondContact O-OG1 3.23Å; L470-T473 WeakPolarHBondContact CA-OG1 3.38Å; L470-T473 PolarHBondContact O-N 2.98Å; L470-T473 PolarHBondContact O-OG1 3.48Å; T473-I476 PolarHBondContact O-N 3.17Å; T473-L477 WeakPolarHBondContact O-CB 3.08Å; T473-L477 WeakPolarHBondContact O-CG 3.23Å; T473-L477 PolarHBondContact O-N 2.8Å
474	L	93.9	Very high	91.4	Very high	84 Å²	84	94.5 Å²	94.5	44%	0.44	50%	0.496	S	S	.	.	H	α-helix	trans	-67.4	-42.2	176.2	-170.5	147	0	0	0	111.5	L470 F471 L472 L477 L478	L470-L474 WeakPolarHBondContact O-CB 3.43Å; L470-L474 PolarHBondContact O-N 3.19Å; F471-L474 PolarHBondContact O-N 2.77Å; L472-L474 VanDerWaalsContact C-N 3.3Å; L472-L474 PolarHBondContact O-N 3.08Å; L474-L477 PolarHBondContact O-N 2.83Å; L474-L478 HydrophobicContact CD2-CD1 3.55Å; L474-L478 HydrophobicContact CD2-CG 4.1Å; L474-L478 WeakPolarHBondContact O-CB 3.43Å; L474-L478 WeakPolarHBondContact O-CG 3.45Å; L474-L478 PolarHBondContact O-N 3.25Å
475	I	91.8	Very high	91.2	Very high	63 Å²	63	95.9 Å²	95.9	32%	0.323	49%	0.493	S	S	.	.	H	α-helix	trans	-60.9	-44.7	173	-73.2	172.2	0	0	0	110.9	F471 L472 L477 L478 N479	F471-I475 HydrophobicContact CD1-CD1 3.63Å; F471-I475 HydrophobicContact CD1-CG1 4.42Å; F471-I475 HydrophobicContact CE1-CD1 3.29Å; F471-I475 HydrophobicContact CE1-CG1 4.2Å; F471-I475 HydrophobicContact CG-CD1 4.5Å; F471-I475 HydrophobicContact CZ-CD1 3.89Å; F471-I475 HydrophobicContact CZ-CG1 4.44Å; F471-I475 WeakPolarHBondContact O-CG1 3.35Å; F471-I475 PolarHBondContact O-N 3.31Å; L472-I475 PolarHBondContact O-N 3.28Å; I475-L477 VanDerWaalsContact C-N 3.34Å; I475-L477 PolarHBondContact O-N 2.92Å; I475-L478 PolarHBondContact O-N 2.98Å; I475-N479 WeakPolarHBondContact O-CB 3.3Å; I475-N479 PolarHBondContact O-N 2.8Å; I475-N479 PolarHBondContact O-ND2 2.86Å
476	I	92.4	Very high	90.9	Very high	100 Å²	100	99.1 Å²	99.1	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-61.6	-44.7	177.4	-69.1	165.7	0	0	0	110.2	L472 T473 L478 N479 I480	L472-I476 VanDerWaalsContact O-CG1 3.28Å; L472-I476 WeakPolarHBondContact O-CG1 3.23Å; L472-I476 PolarHBondContact O-N 2.63Å; T473-I476 PolarHBondContact O-N 3.17Å; I476-L478 PolarHBondContact O-N 3.34Å; I476-N479 PolarHBondContact O-N 3.02Å; I476-I480 HydrophobicContact CG2-CD1 3.77Å; I476-I480 HydrophobicContact CG2-CG1 4.44Å; I476-I480 VanDerWaalsContact O-CG1 3.25Å; I476-I480 WeakPolarHBondContact O-CG1 3.48Å; I476-I480 PolarHBondContact O-N 2.87Å
477	L	93.3	Very high	90.3	Very high	115 Å²	115	99.5 Å²	99.5	60%	0.602	50%	0.499	S	S	*	.	H	α-helix	trans	-62.3	-41.1	175.9	-79	167.5	0	0	0	112.4	T473 L474 I475 I480 W481	T473-L477 WeakPolarHBondContact O-CB 3.08Å; T473-L477 WeakPolarHBondContact O-CG 3.23Å; T473-L477 PolarHBondContact O-N 2.8Å; L474-L477 PolarHBondContact O-N 2.83Å; I475-L477 VanDerWaalsContact C-N 3.34Å; I475-L477 PolarHBondContact O-N 2.92Å; L477-I480 PolarHBondContact O-N 2.79Å; L477-W481 VanDerWaalsContact O-CB 3.3Å; L477-W481 WeakPolarHBondContact O-CB 3.48Å; L477-W481 PolarHBondContact O-N 3.11Å
478	L	92.4	Very high	89.8	Confident	95 Å²	95	104.8 Å²	104.8	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-40.4	174.9	-76.2	176.6	0	0	0	111.8	L474 I475 I476 W481 A482	L474-L478 HydrophobicContact CD2-CD1 3.55Å; L474-L478 HydrophobicContact CD2-CG 4.1Å; L474-L478 WeakPolarHBondContact O-CB 3.43Å; L474-L478 WeakPolarHBondContact O-CG 3.45Å; L474-L478 PolarHBondContact O-N 3.25Å; I475-L478 PolarHBondContact O-N 2.98Å; I476-L478 PolarHBondContact O-N 3.34Å; L478-W481 PolarHBondContact O-N 3.24Å; L478-A482 VanDerWaalsContact O-CB 3.26Å; L478-A482 WeakPolarHBondContact O-CB 3.32Å; L478-A482 PolarHBondContact O-N 3.33Å
479	N	91.7	Very high	89	Confident	103 Å²	103	109.2 Å²	109.2	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-41.8	175.4	-76.8	-33.7	0	0	0	111.6	I475 I476 W481 A482 A483	I475-N479 WeakPolarHBondContact O-CB 3.3Å; I475-N479 PolarHBondContact O-N 2.8Å; I475-N479 PolarHBondContact O-ND2 2.86Å; I476-N479 PolarHBondContact O-N 3.02Å; N479-W481 VanDerWaalsContact C-N 3.34Å; N479-A482 PolarHBondContact O-N 2.66Å; N479-A483 VanDerWaalsContact O-CB 3.29Å; N479-A483 WeakPolarHBondContact O-CB 3.4Å; N479-A483 PolarHBondContact O-N 3.12Å
480	I	91.1	Very high	88.2	Confident	89 Å²	89	110.3 Å²	110.3	46%	0.456	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-42.7	173.9	-68.8	166.1	0	0	0	110.5	I476 L477 A483 R484	I476-I480 HydrophobicContact CG2-CD1 3.77Å; I476-I480 HydrophobicContact CG2-CG1 4.44Å; I476-I480 VanDerWaalsContact O-CG1 3.25Å; I476-I480 WeakPolarHBondContact O-CG1 3.48Å; I476-I480 PolarHBondContact O-N 2.87Å; L477-I480 PolarHBondContact O-N 2.79Å; I480-A483 PolarHBondContact O-N 3.32Å; I480-R484 WeakPolarHBondContact O-CB 3.38Å; I480-R484 PolarHBondContact O-N 2.69Å
481	W	92.1	Very high	87.3	Confident	148 Å²	148	109 Å²	109	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-44.5	176.6	-179.6	88.2	0	0	0	111.7	L477 L478 N479 R484 R485	L477-W481 VanDerWaalsContact O-CB 3.3Å; L477-W481 WeakPolarHBondContact O-CB 3.48Å; L477-W481 PolarHBondContact O-N 3.11Å; L478-W481 PolarHBondContact O-N 3.24Å; N479-W481 VanDerWaalsContact C-N 3.34Å; W481-R484 PolarHBondContact O-N 3.02Å; W481-R485 VanDerWaalsContact CH2-NH1 3.32Å; W481-R485 VanDerWaalsContact CZ2-NH1 3.26Å; W481-R485 VanDerWaalsContact O-CB 3.25Å; W481-R485 WeakPolarHBondContact O-CB 3.41Å; W481-R485 PolarHBondContact O-N 3.42Å
482	A	87.7	Confident	86.5	Confident	47 Å²	47	106.3 Å²	106.3	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-62.4	-44.7	176.3	0	0	0	0	0	111.2	L478 N479 R485 W486	L478-A482 VanDerWaalsContact O-CB 3.26Å; L478-A482 WeakPolarHBondContact O-CB 3.32Å; L478-A482 PolarHBondContact O-N 3.33Å; N479-A482 PolarHBondContact O-N 2.66Å; A482-R485 PolarHBondContact O-N 2.89Å; A482-W486 VanDerWaalsContact O-CB 3.31Å; A482-W486 WeakPolarHBondContact O-CB 3.34Å; A482-W486 PolarHBondContact O-N 3.31Å
483	A	87.7	Confident	86	Confident	50 Å²	50	105.1 Å²	105.1	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-47.2	175.5	0	0	0	0	0	111.8	N479 I480 R485 W486 I487	N479-A483 VanDerWaalsContact O-CB 3.29Å; N479-A483 WeakPolarHBondContact O-CB 3.4Å; N479-A483 PolarHBondContact O-N 3.12Å; I480-A483 PolarHBondContact O-N 3.32Å; A483-R485 VanDerWaalsContact C-N 3.34Å; A483-R485 PolarHBondContact O-N 2.76Å; A483-W486 PolarHBondContact O-N 2.98Å; A483-I487 WeakPolarHBondContact O-CD1 3.36Å; A483-I487 VanDerWaalsContact O-CG1 3.29Å; A483-I487 WeakPolarHBondContact O-CG1 3.5Å; A483-I487 PolarHBondContact O-N 3.26Å
484	R	85.1	Confident	85.5	Confident	184 Å²	184	107.2 Å²	107.2	69%	0.694	52%	0.522	S	S	*	.	H	α-helix	trans	-60.5	-42.6	174.8	-89	-175	163.1	-179.4	-2.8	112.2	I480 W481 W486 I487 K488	I480-R484 WeakPolarHBondContact O-CB 3.38Å; I480-R484 PolarHBondContact O-N 2.69Å; W481-R484 PolarHBondContact O-N 3.02Å; R484-W486 VanDerWaalsContact C-N 3.33Å; R484-I487 PolarHBondContact O-N 3Å; R484-K488 PolarHBondContact O-N 3.27Å; R484-K488 VanDerWaalsContact O-N 3.08Å
485	R	85.7	Confident	84.9	Confident	110 Å²	110	108 Å²	108	42%	0.415	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-38.1	178.3	-175.1	174.5	-176.3	121	1.9	111.4	W481 A482 A483 K488 R489	W481-R485 VanDerWaalsContact CH2-NH1 3.32Å; W481-R485 VanDerWaalsContact CZ2-NH1 3.26Å; W481-R485 VanDerWaalsContact O-CB 3.25Å; W481-R485 WeakPolarHBondContact O-CB 3.41Å; W481-R485 PolarHBondContact O-N 3.42Å; A482-R485 PolarHBondContact O-N 2.89Å; A483-R485 VanDerWaalsContact C-N 3.34Å; A483-R485 PolarHBondContact O-N 2.76Å; R485-K488 PolarHBondContact O-N 3.43Å; R485-R489 VanDerWaalsContact NH2-NH2 3.12Å; R485-R489 PolarHBondContact O-N 3.38Å; R485-R489 VanDerWaalsContact O-N 3.16Å
486	W	84.1	Confident	84.4	Confident	183 Å²	183	110 Å²	110	69%	0.693	53%	0.532	S	S	*	.	H	α-helix	trans	-65.3	-49.1	176.2	-166.3	76.6	0	0	0	110.5	A482 A483 R484 K488 R489 T490	A482-W486 VanDerWaalsContact O-CB 3.31Å; A482-W486 WeakPolarHBondContact O-CB 3.34Å; A482-W486 PolarHBondContact O-N 3.31Å; A483-W486 PolarHBondContact O-N 2.98Å; R484-W486 VanDerWaalsContact C-N 3.33Å; W486-K488 VanDerWaalsContact C-N 3.27Å; W486-K488 PolarHBondContact O-N 2.96Å; W486-R489 CarbonylContact O-C 3.51Å; W486-R489 WeakPolarHBondContact O-CA 3.29Å; W486-R489 PolarHBondContact O-N 3.08Å; W486-T490 HydrophobicContact CD2-CG2 3.53Å; W486-T490 HydrophobicContact CE3-CG2 3.6Å; W486-T490 HydrophobicContact CG-CG2 4.23Å; W486-T490 HydrophobicContact CH2-CG2 3.72Å; W486-T490 HydrophobicContact CZ2-CG2 3.65Å; W486-T490 HydrophobicContact CZ3-CG2 3.7Å; W486-T490 WeakPolarHBondContact O-CG2 3.42Å; W486-T490 PolarHBondContact O-N 3.43Å; W486-T490 PolarHBondContact O-OG1 2.7Å
487	I	81.9	Confident	84.1	Confident	114 Å²	114	111.2 Å²	111.2	59%	0.585	53%	0.533	S	S	*	.	H	α-helix	trans	-57.3	-38.5	176.6	-67.6	161.4	0	0	0	112.2	A483 R484 R489 T490	A483-I487 WeakPolarHBondContact O-CD1 3.36Å; A483-I487 VanDerWaalsContact O-CG1 3.29Å; A483-I487 WeakPolarHBondContact O-CG1 3.5Å; A483-I487 PolarHBondContact O-N 3.26Å; R484-I487 PolarHBondContact O-N 3Å; I487-R489 VanDerWaalsContact C-N 3.31Å; I487-R489 PolarHBondContact O-N 3.13Å; I487-T490 WeakPolarHBondContact CA-OG1 3.2Å; I487-T490 PolarHBondContact O-OG1 3.36Å
488	K	79.6	Confident	83.7	Confident	191 Å²	191	108.5 Å²	108.5	83%	0.83	53%	0.527	S	S	*	.	H	α-helix	trans	-69.6	-26.3	175.4	-75.6	-172.1	178.2	-171	0	113.8	R484 R485 W486	R484-K488 PolarHBondContact O-N 3.27Å; R484-K488 VanDerWaalsContact O-N 3.08Å; R485-K488 PolarHBondContact O-N 3.43Å; W486-K488 VanDerWaalsContact C-N 3.27Å; W486-K488 PolarHBondContact O-N 2.96Å
489	R	76.7	Confident	83.4	Confident	181 Å²	181	108.2 Å²	108.2	68%	0.683	53%	0.525	S	S	*	.	H	α-helix	trans	-96	-20.1	-179.7	-79.4	-174.5	172.4	-172.4	-7.9	113.2	R485 W486 I487 L491	R485-R489 VanDerWaalsContact NH2-NH2 3.12Å; R485-R489 PolarHBondContact O-N 3.38Å; R485-R489 VanDerWaalsContact O-N 3.16Å; W486-R489 CarbonylContact O-C 3.51Å; W486-R489 WeakPolarHBondContact O-CA 3.29Å; W486-R489 PolarHBondContact O-N 3.08Å; I487-R489 VanDerWaalsContact C-N 3.31Å; I487-R489 PolarHBondContact O-N 3.13Å; R489-L491 PolarHBondContact O-N 3.27Å
490	T	74.5	Confident	83.1	Confident	52 Å²	52	107.7 Å²	107.7	32%	0.319	52%	0.521	S	S	.	.	S	Bend	trans	-65.8	125.9	175.2	46	0	0	0	0	108.8	W486 I487 T492	W486-T490 HydrophobicContact CD2-CG2 3.53Å; W486-T490 HydrophobicContact CE3-CG2 3.6Å; W486-T490 HydrophobicContact CG-CG2 4.23Å; W486-T490 HydrophobicContact CH2-CG2 3.72Å; W486-T490 HydrophobicContact CZ2-CG2 3.65Å; W486-T490 HydrophobicContact CZ3-CG2 3.7Å; W486-T490 WeakPolarHBondContact O-CG2 3.42Å; W486-T490 PolarHBondContact O-N 3.43Å; W486-T490 PolarHBondContact O-OG1 2.7Å; I487-T490 WeakPolarHBondContact CA-OG1 3.2Å; I487-T490 PolarHBondContact O-OG1 3.36Å; T490-T492 PolarHBondContact O-N 2.81Å
491	L	75.4	Confident	83	Confident	77 Å²	77	110.2 Å²	110.2	40%	0.403	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-57.4	127.6	-180	-157.2	69.9	0	0	0	109.2	R489 Q495 Q496 I499	R489-L491 PolarHBondContact O-N 3.27Å; L491-Q495 HydrophobicContact CD1-CB 3.6Å; L491-Q495 HydrophobicContact CD1-CG 4.39Å; L491-Q495 HydrophobicContact CD2-CB 4.33Å; L491-Q495 HydrophobicContact CG-CB 3.55Å; L491-Q496 VanDerWaalsContact CD2-CA 3.44Å; L491-Q496 HydrophobicContact CD2-CB 3.83Å; L491-Q496 HydrophobicContact CD2-CG 4.28Å; L491-Q496 HydrophobicContact CG-CB 4.39Å; L491-I499 HydrophobicContact CD1-CD1 4.03Å; L491-I499 HydrophobicContact CD2-CD1 3.57Å; L491-I499 HydrophobicContact CD2-CG1 4.36Å; L491-I499 HydrophobicContact CG-CD1 4.45Å
492	T	76.4	Confident	82.9	Confident	76 Å²	76	109.3 Å²	109.3	47%	0.466	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-62.2	153.1	175.4	54	0	0	0	0	109.9	T490 D494 Q495 Q496	T490-T492 PolarHBondContact O-N 2.81Å; T492-D494 PolarHBondContact O-N 3.25Å; T492-D494 VanDerWaalsContact O-N 3.1Å; T492-Q495 PolarHBondContact O-N 3.24Å; T492-Q495 WeakPolarHBondContact OG1-CB 3.23Å; T492-Q495 WeakPolarHBondContact OG1-CG 3.37Å; T492-Q495 PolarHBondContact OG1-N 3.48Å; T492-Q495 PolarHBondContact OG1-OE1 3Å; T492-Q495 VanDerWaalsContact OG1-OE1 3.05Å; T492-Q496 PolarHBondContact O-N 2.86Å
493	S	80.2	Confident	82.9	Confident	71 Å²	71	112.8 Å²	112.8	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-54.3	-35	-178.9	-173.7	0	0	0	0	112	Q496 K497	S493-Q496 PolarHBondContact O-N 2.74Å; S493-K497 VanDerWaalsContact O-CG 3.31Å; S493-K497 WeakPolarHBondContact O-CG 3.29Å; S493-K497 PolarHBondContact O-N 3.34Å
494	D	81.2	Confident	83.1	Confident	118 Å²	118	116.1 Å²	116.1	63%	0.631	56%	0.555	S	S	*	*	H	α-helix	trans	-71.5	-41.7	178.4	-58.4	-34.6	0	0	0	112.2	T492 Q496 K497 A498	T492-D494 PolarHBondContact O-N 3.25Å; T492-D494 VanDerWaalsContact O-N 3.1Å; D494-Q496 VanDerWaalsContact C-N 3.33Å; D494-Q496 PolarHBondContact O-N 3.14Å; D494-K497 PolarHBondContact O-N 2.88Å; D494-A498 WeakPolarHBondContact O-CB 3.34Å; D494-A498 PolarHBondContact O-N 3.42Å
495	Q	81.5	Confident	83.4	Confident	102 Å²	102	111 Å²	111	48%	0.477	54%	0.542	S	S	.	.	H	α-helix	trans	-64.6	-37.7	172.9	-76	175.2	-36.7	0	0	112	L491 T492 A498 I499	L491-Q495 HydrophobicContact CD1-CB 3.6Å; L491-Q495 HydrophobicContact CD1-CG 4.39Å; L491-Q495 HydrophobicContact CD2-CB 4.33Å; L491-Q495 HydrophobicContact CG-CB 3.55Å; T492-Q495 PolarHBondContact O-N 3.24Å; T492-Q495 WeakPolarHBondContact OG1-CB 3.23Å; T492-Q495 WeakPolarHBondContact OG1-CG 3.37Å; T492-Q495 PolarHBondContact OG1-N 3.48Å; T492-Q495 PolarHBondContact OG1-OE1 3Å; T492-Q495 VanDerWaalsContact OG1-OE1 3.05Å; Q495-A498 PolarHBondContact O-N 3.48Å; Q495-I499 WeakPolarHBondContact O-CG1 3.49Å; Q495-I499 PolarHBondContact O-N 3.26Å
496	Q	81.8	Confident	83.7	Confident	105 Å²	105	109.9 Å²	109.9	49%	0.491	54%	0.544	S	S	.	.	H	α-helix	trans	-64.2	-42.6	176.5	-168.7	176.8	-4.4	0	0	111.5	L491 T492 S493 D494 A498 I500	L491-Q496 VanDerWaalsContact CD2-CA 3.44Å; L491-Q496 HydrophobicContact CD2-CB 3.83Å; L491-Q496 HydrophobicContact CD2-CG 4.28Å; L491-Q496 HydrophobicContact CG-CB 4.39Å; T492-Q496 PolarHBondContact O-N 2.86Å; S493-Q496 PolarHBondContact O-N 2.74Å; D494-Q496 VanDerWaalsContact C-N 3.33Å; D494-Q496 PolarHBondContact O-N 3.14Å; Q496-A498 VanDerWaalsContact C-N 3.35Å; Q496-I500 HydrophobicContact CG-CD1 4.06Å; Q496-I500 WeakPolarHBondContact O-CB 3.43Å; Q496-I500 WeakPolarHBondContact O-CD1 3.3Å; Q496-I500 VanDerWaalsContact O-CG1 3.24Å; Q496-I500 WeakPolarHBondContact O-CG1 3.32Å; Q496-I500 PolarHBondContact O-N 3.04Å
497	K	85.9	Confident	84	Confident	125 Å²	125	106.6 Å²	106.6	54%	0.543	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-42.8	173	-71	171.5	-172.7	172.7	0	111.6	S493 D494 I500 Q501	S493-K497 VanDerWaalsContact O-CG 3.31Å; S493-K497 WeakPolarHBondContact O-CG 3.29Å; S493-K497 PolarHBondContact O-N 3.34Å; D494-K497 PolarHBondContact O-N 2.88Å; K497-I500 PolarHBondContact O-N 3.19Å; K497-Q501 VanDerWaalsContact O-CB 3.25Å; K497-Q501 WeakPolarHBondContact O-CB 3.2Å; K497-Q501 PolarHBondContact O-N 2.9Å
498	A	86.1	Confident	84.4	Confident	57 Å²	57	104.2 Å²	104.2	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-47	178.6	0	0	0	0	0	112.5	D494 Q495 Q496 Q501 E502	D494-A498 WeakPolarHBondContact O-CB 3.34Å; D494-A498 PolarHBondContact O-N 3.42Å; Q495-A498 PolarHBondContact O-N 3.48Å; Q496-A498 VanDerWaalsContact C-N 3.35Å; A498-Q501 PolarHBondContact O-N 3.12Å; A498-E502 WeakPolarHBondContact O-CB 3.46Å; A498-E502 PolarHBondContact O-N 3.27Å
499	I	84.5	Confident	85	Confident	90 Å²	90	102.5 Å²	102.5	46%	0.462	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-44.6	177.8	-66.5	-176.5	0	0	0	111.1	L491 Q495 Q501 E502 L503	L491-I499 HydrophobicContact CD1-CD1 4.03Å; L491-I499 HydrophobicContact CD2-CD1 3.57Å; L491-I499 HydrophobicContact CD2-CG1 4.36Å; L491-I499 HydrophobicContact CG-CD1 4.45Å; Q495-I499 WeakPolarHBondContact O-CG1 3.49Å; Q495-I499 PolarHBondContact O-N 3.26Å; I499-Q501 VanDerWaalsContact C-N 3.27Å; I499-Q501 PolarHBondContact O-N 3.15Å; I499-E502 PolarHBondContact O-N 2.94Å; I499-L503 WeakPolarHBondContact O-CB 3.37Å; I499-L503 PolarHBondContact O-N 3.07Å
500	I	86.2	Confident	85.7	Confident	91 Å²	91	98.9 Å²	98.9	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-41.3	178	-69.7	168.7	0	0	0	110.3	Q496 K497 L503 L504	Q496-I500 HydrophobicContact CG-CD1 4.06Å; Q496-I500 WeakPolarHBondContact O-CB 3.43Å; Q496-I500 WeakPolarHBondContact O-CD1 3.3Å; Q496-I500 VanDerWaalsContact O-CG1 3.24Å; Q496-I500 WeakPolarHBondContact O-CG1 3.32Å; Q496-I500 PolarHBondContact O-N 3.04Å; K497-I500 PolarHBondContact O-N 3.19Å; I500-L503 PolarHBondContact O-N 3.3Å; I500-L504 HydrophobicContact CG2-CD1 4.2Å; I500-L504 WeakPolarHBondContact O-CB 3.35Å; I500-L504 PolarHBondContact O-N 2.99Å
501	Q	88.3	Confident	86.4	Confident	143 Å²	143	102.1 Å²	102.1	67%	0.668	53%	0.525	S	S	*	.	H	α-helix	trans	-68.3	-39	-179.9	-168.2	163.8	-18.5	0	0	112.2	K497 A498 I499 L504 D505	K497-Q501 VanDerWaalsContact O-CB 3.25Å; K497-Q501 WeakPolarHBondContact O-CB 3.2Å; K497-Q501 PolarHBondContact O-N 2.9Å; A498-Q501 PolarHBondContact O-N 3.12Å; I499-Q501 VanDerWaalsContact C-N 3.27Å; I499-Q501 PolarHBondContact O-N 3.15Å; Q501-L504 PolarHBondContact O-N 2.89Å; Q501-D505 WeakPolarHBondContact O-CB 3.49Å; Q501-D505 PolarHBondContact O-N 2.74Å
502	E	89.7	Confident	87.2	Confident	129 Å²	129	103.5 Å²	103.5	60%	0.603	53%	0.532	S	S	*	.	H	α-helix	trans	-67.6	-39.2	175.7	-163.4	177.4	-162.5	0	0	112	A498 I499 D505 N506	A498-E502 WeakPolarHBondContact O-CB 3.46Å; A498-E502 PolarHBondContact O-N 3.27Å; I499-E502 PolarHBondContact O-N 2.94Å; E502-D505 PolarHBondContact O-N 3.34Å; E502-N506 WeakPolarHBondContact O-CB 3.29Å; E502-N506 PolarHBondContact O-N 3.45Å; E502-N506 PolarHBondContact O-ND2 3.35Å
503	L	89.7	Confident	87.9	Confident	119 Å²	119	102.3 Å²	102.3	62%	0.623	53%	0.531	S	S	*	.	H	α-helix	trans	-62.3	-44.9	174.2	-159.3	89.2	0	0	0	111.1	I499 I500 N506 E507	I499-L503 WeakPolarHBondContact O-CB 3.37Å; I499-L503 PolarHBondContact O-N 3.07Å; I500-L503 PolarHBondContact O-N 3.3Å; L503-N506 PolarHBondContact O-N 2.85Å; L503-E507 PolarHBondContact O-N 2.66Å; L503-E507 VanDerWaalsContact O-N 3.09Å
504	L	90	Very high	88.4	Confident	121 Å²	121	102.4 Å²	102.4	63%	0.634	53%	0.53	S	S	*	.	H	α-helix	trans	-63.5	-41.3	177.4	-115.7	138.2	0	0	0	112.2	I500 Q501 C508	I500-L504 HydrophobicContact CG2-CD1 4.2Å; I500-L504 WeakPolarHBondContact O-CB 3.35Å; I500-L504 PolarHBondContact O-N 2.99Å; Q501-L504 PolarHBondContact O-N 2.89Å; L504-C508 WeakPolarHBondContact O-CB 3.37Å; L504-C508 PolarHBondContact O-N 3.3Å
505	D	91.9	Very high	88.9	Confident	77 Å²	77	104.2 Å²	104.2	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-67.8	-38.8	179	-158.5	45.2	0	0	0	111.4	Q501 E502 C508 R509	Q501-D505 WeakPolarHBondContact O-CB 3.49Å; Q501-D505 PolarHBondContact O-N 2.74Å; E502-D505 PolarHBondContact O-N 3.34Å; D505-C508 PolarHBondContact O-N 2.96Å; D505-R509 WeakPolarHBondContact O-CB 3.5Å; D505-R509 VanDerWaalsContact O-CG 3.27Å; D505-R509 WeakPolarHBondContact O-CG 3.44Å; D505-R509 PolarHBondContact O-N 3.32Å; D505-R509 IonicContact OD2-CZ 2.8Å; D505-R509 VanDerWaalsContact OD2-CZ 3.3Å; D505-R509 IonicContact OD2-NE 3.53Å; D505-R509 PolarHBondContact OD2-NE 3.14Å; D505-R509 VanDerWaalsContact OD2-NE 3.11Å; D505-R509 IonicContact OD2-NH2 3.19Å; D505-R509 PolarHBondContact OD2-NH2 3.31Å
506	N	92.5	Very high	89.4	Confident	86 Å²	86	106.6 Å²	106.6	46%	0.46	54%	0.541	S	S	.	.	H	α-helix	trans	-63.8	-47.2	176.1	-77.5	-28.7	0	0	0	112.7	E502 L503 C508 R509 L510	E502-N506 WeakPolarHBondContact O-CB 3.29Å; E502-N506 PolarHBondContact O-N 3.45Å; E502-N506 PolarHBondContact O-ND2 3.35Å; L503-N506 PolarHBondContact O-N 2.85Å; N506-C508 VanDerWaalsContact C-N 3.32Å; N506-C508 PolarHBondContact O-N 3.42Å; N506-R509 PolarHBondContact O-N 2.88Å; N506-L510 PolarHBondContact O-N 2.93Å; N506-L510 VanDerWaalsContact O-N 3.07Å
507	E	89.8	Confident	89.9	Confident	114 Å²	114	110.6 Å²	110.6	53%	0.533	55%	0.552	S	S	.	*	H	α-helix	trans	-61.1	-42.1	175.2	-76.2	-66.3	158.4	0	0	111.4	L503 R509 L510 L511	L503-E507 PolarHBondContact O-N 2.66Å; L503-E507 VanDerWaalsContact O-N 3.09Å; E507-R509 PolarHBondContact O-N 2.72Å; E507-L510 WeakPolarHBondContact O-CB 3.46Å; E507-L510 PolarHBondContact O-N 3.38Å; E507-L511 WeakPolarHBondContact O-CG 3.48Å; E507-L511 PolarHBondContact O-N 2.85Å
508	C	91.6	Very high	90.1	Very high	63 Å²	63	107.3 Å²	107.3	43%	0.426	55%	0.548	S	S	.	.	H	α-helix	trans	-64	-42.3	178.5	-157.1	0	0	0	0	112.2	L504 D505 N506 L510 L511 L512	L504-C508 WeakPolarHBondContact O-CB 3.37Å; L504-C508 PolarHBondContact O-N 3.3Å; D505-C508 PolarHBondContact O-N 2.96Å; N506-C508 VanDerWaalsContact C-N 3.32Å; N506-C508 PolarHBondContact O-N 3.42Å; C508-L510 VanDerWaalsContact C-N 3.34Å; C508-L510 PolarHBondContact O-N 3.38Å; C508-L511 PolarHBondContact O-N 3.44Å; C508-L512 WeakPolarHBondContact O-CG 3.49Å; C508-L512 PolarHBondContact O-N 2.85Å
509	R	90.7	Very high	90.4	Very high	155 Å²	155	108.8 Å²	108.8	59%	0.585	55%	0.548	S	S	*	.	H	α-helix	trans	-60.7	-41.7	174.8	-74.9	174.8	-169.6	-163.6	5.2	112.2	D505 N506 E507 L512 A513	D505-R509 WeakPolarHBondContact O-CB 3.5Å; D505-R509 VanDerWaalsContact O-CG 3.27Å; D505-R509 WeakPolarHBondContact O-CG 3.44Å; D505-R509 PolarHBondContact O-N 3.32Å; D505-R509 IonicContact OD2-CZ 2.8Å; D505-R509 VanDerWaalsContact OD2-CZ 3.3Å; D505-R509 IonicContact OD2-NE 3.53Å; D505-R509 PolarHBondContact OD2-NE 3.14Å; D505-R509 VanDerWaalsContact OD2-NE 3.11Å; D505-R509 IonicContact OD2-NH2 3.19Å; D505-R509 PolarHBondContact OD2-NH2 3.31Å; N506-R509 PolarHBondContact O-N 2.88Å; E507-R509 PolarHBondContact O-N 2.72Å; R509-L512 PolarHBondContact O-N 2.83Å; R509-A513 WeakPolarHBondContact O-CB 3.24Å; R509-A513 PolarHBondContact O-N 2.77Å
510	L	91.2	Very high	90.7	Very high	106 Å²	106	108 Å²	108	56%	0.555	54%	0.544	S	S	*	.	H	α-helix	trans	-61.4	-47.6	176.9	-117.3	160	0	0	0	111.2	N506 E507 C508 L512 A513 C514	N506-L510 PolarHBondContact O-N 2.93Å; N506-L510 VanDerWaalsContact O-N 3.07Å; E507-L510 WeakPolarHBondContact O-CB 3.46Å; E507-L510 PolarHBondContact O-N 3.38Å; C508-L510 VanDerWaalsContact C-N 3.34Å; C508-L510 PolarHBondContact O-N 3.38Å; L510-L512 PolarHBondContact O-N 3.28Å; L510-A513 PolarHBondContact O-N 2.88Å; L510-C514 WeakPolarHBondContact O-CB 2.97Å; L510-C514 PolarHBondContact O-N 2.9Å; L510-C514 PolarHBondContact O-SG 3.21Å; L510-C514 VanDerWaalsContact O-SG 3.35Å
511	L	91	Very high	90.8	Very high	119 Å²	119	107.7 Å²	107.7	62%	0.623	54%	0.544	S	S	*	.	H	α-helix	trans	-61.5	-41.9	177.1	-72.3	172.9	0	0	0	112.5	E507 C508 C514 K515	E507-L511 WeakPolarHBondContact O-CG 3.48Å; E507-L511 PolarHBondContact O-N 2.85Å; C508-L511 PolarHBondContact O-N 3.44Å; L511-C514 PolarHBondContact O-N 3Å; L511-K515 WeakPolarHBondContact O-CB 3.5Å; L511-K515 PolarHBondContact O-N 3.2Å
512	L	91.3	Very high	90.9	Very high	106 Å²	106	107.2 Å²	107.2	56%	0.555	54%	0.539	S	S	*	.	H	α-helix	trans	-65.3	-41.3	176.6	-73.7	169.8	0	0	0	112.2	C508 R509 L510 K515 K516	C508-L512 WeakPolarHBondContact O-CG 3.49Å; C508-L512 PolarHBondContact O-N 2.85Å; R509-L512 PolarHBondContact O-N 2.83Å; L510-L512 PolarHBondContact O-N 3.28Å; L512-K515 PolarHBondContact O-N 3.03Å; L512-K516 WeakPolarHBondContact O-CB 3.34Å; L512-K516 PolarHBondContact O-N 3.1Å
513	A	91	Very high	90.8	Very high	52 Å²	52	105.8 Å²	105.8	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-43.4	175.4	0	0	0	0	0	111.6	R509 L510 K516 R517	R509-A513 WeakPolarHBondContact O-CB 3.24Å; R509-A513 PolarHBondContact O-N 2.77Å; L510-A513 PolarHBondContact O-N 2.88Å; A513-K516 PolarHBondContact O-N 2.89Å; A513-R517 PolarHBondContact O-N 2.98Å
514	C	90	Very high	90.8	Very high	72 Å²	72	108.5 Å²	108.5	49%	0.486	54%	0.538	S	S	.	.	H	α-helix	trans	-60.5	-46.7	173.9	-74.3	0	0	0	0	111.6	L510 L511 K516 R517 A518	L510-C514 WeakPolarHBondContact O-CB 2.97Å; L510-C514 PolarHBondContact O-N 2.9Å; L510-C514 PolarHBondContact O-SG 3.21Å; L510-C514 VanDerWaalsContact O-SG 3.35Å; L511-C514 PolarHBondContact O-N 3Å; C514-K516 VanDerWaalsContact C-N 3.34Å; C514-K516 PolarHBondContact O-N 3.16Å; C514-R517 PolarHBondContact O-N 3.46Å; C514-A518 VanDerWaalsContact O-CB 3.31Å; C514-A518 WeakPolarHBondContact O-CB 3.22Å; C514-A518 PolarHBondContact O-N 3.45Å
515	K	92.5	Very high	90.8	Very high	157 Å²	157	107.1 Å²	107.1	68%	0.683	53%	0.531	S	S	*	.	H	α-helix	trans	-60.1	-42.8	176.2	-176.1	175.3	-179.6	177.4	0	112	L511 L512 A518 N519	L511-K515 WeakPolarHBondContact O-CB 3.5Å; L511-K515 PolarHBondContact O-N 3.2Å; L512-K515 PolarHBondContact O-N 3.03Å; K515-A518 PolarHBondContact O-N 3.02Å; K515-N519 WeakPolarHBondContact O-CB 3.36Å; K515-N519 PolarHBondContact O-N 3.16Å
516	K	92.3	Very high	90.7	Very high	152 Å²	152	107.5 Å²	107.5	66%	0.661	53%	0.532	S	S	*	.	H	α-helix	trans	-64.6	-45.6	177.6	-169	176.6	-178.1	178.6	0	111.6	L512 A513 C514 N519 I520	L512-K516 WeakPolarHBondContact O-CB 3.34Å; L512-K516 PolarHBondContact O-N 3.1Å; A513-K516 PolarHBondContact O-N 2.89Å; C514-K516 VanDerWaalsContact C-N 3.34Å; C514-K516 PolarHBondContact O-N 3.16Å; K516-N519 PolarHBondContact O-N 2.75Å; K516-I520 HydrophobicContact CG-CD1 4.29Å; K516-I520 WeakPolarHBondContact O-CG1 3.45Å; K516-I520 PolarHBondContact O-N 3.06Å
517	R	92	Very high	90.4	Very high	188 Å²	188	106.8 Å²	106.8	71%	0.709	53%	0.532	S	S	*	.	H	α-helix	trans	-62.2	-44.3	174.7	-83.5	-176.9	178.5	174.1	0.2	112.1	A513 C514 N519 I520 N521	A513-R517 PolarHBondContact O-N 2.98Å; C514-R517 PolarHBondContact O-N 3.46Å; R517-N519 VanDerWaalsContact C-N 3.29Å; R517-N519 PolarHBondContact O-N 3.11Å; R517-I520 PolarHBondContact O-N 3.44Å; R517-N521 WeakPolarHBondContact O-CB 3.44Å; R517-N521 PolarHBondContact O-N 3.38Å
518	A	89.3	Confident	90.3	Very high	57 Å²	57	106 Å²	106	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-59.3	-41.1	176.2	0	0	0	0	0	111.5	C514 K515 N521 K522	C514-A518 VanDerWaalsContact O-CB 3.31Å; C514-A518 WeakPolarHBondContact O-CB 3.22Å; C514-A518 PolarHBondContact O-N 3.45Å; K515-A518 PolarHBondContact O-N 3.02Å; A518-N521 PolarHBondContact O-N 2.99Å; A518-K522 VanDerWaalsContact O-CB 3.28Å; A518-K522 WeakPolarHBondContact O-CB 3.41Å; A518-K522 PolarHBondContact O-N 3.46Å
519	N	92.2	Very high	90.1	Very high	88 Å²	88	108 Å²	108	47%	0.471	54%	0.536	S	S	.	.	H	α-helix	trans	-68.4	-39	177.4	-159.3	41	0	0	0	112.7	K515 K516 R517 K522 N523	K515-N519 WeakPolarHBondContact O-CB 3.36Å; K515-N519 PolarHBondContact O-N 3.16Å; K516-N519 PolarHBondContact O-N 2.75Å; R517-N519 VanDerWaalsContact C-N 3.29Å; R517-N519 PolarHBondContact O-N 3.11Å; N519-K522 PolarHBondContact O-N 2.92Å; N519-N523 WeakPolarHBondContact O-CB 3.32Å; N519-N523 VanDerWaalsContact O-CG 3.28Å; N519-N523 PolarHBondContact O-N 3.33Å
520	I	91.9	Very high	89.8	Confident	72 Å²	72	105 Å²	105	37%	0.369	53%	0.531	S	S	.	.	H	α-helix	trans	-63.2	-46.7	173.8	-68.4	165.2	0	0	0	110.5	K516 R517 K522 N523 R524	K516-I520 HydrophobicContact CG-CD1 4.29Å; K516-I520 WeakPolarHBondContact O-CG1 3.45Å; K516-I520 PolarHBondContact O-N 3.06Å; R517-I520 PolarHBondContact O-N 3.44Å; I520-K522 VanDerWaalsContact C-N 3.34Å; I520-K522 PolarHBondContact O-N 3.13Å; I520-N523 PolarHBondContact O-N 3.18Å; I520-R524 WeakPolarHBondContact O-CG 3.45Å; I520-R524 PolarHBondContact O-N 2.77Å
521	N	89.1	Confident	89.6	Confident	86 Å²	86	105.5 Å²	105.5	46%	0.46	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-43	178	-73	-5.5	0	0	0	111	R517 A518 N523 R524 L525	R517-N521 WeakPolarHBondContact O-CB 3.44Å; R517-N521 PolarHBondContact O-N 3.38Å; A518-N521 PolarHBondContact O-N 2.99Å; N521-N523 PolarHBondContact O-N 3.06Å; N521-R524 PolarHBondContact O-N 3.49Å; N521-L525 VanDerWaalsContact O-CB 3.3Å; N521-L525 WeakPolarHBondContact O-CB 3.3Å; N521-L525 WeakPolarHBondContact O-CG 3.46Å; N521-L525 PolarHBondContact O-N 3.47Å
522	K	88.9	Confident	89.2	Confident	132 Å²	132	105.9 Å²	105.9	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-56.1	-50.7	173	-176.3	-177.7	177.5	-178.3	0	110.9	A518 N519 I520 R524 L525 L526	A518-K522 VanDerWaalsContact O-CB 3.28Å; A518-K522 WeakPolarHBondContact O-CB 3.41Å; A518-K522 PolarHBondContact O-N 3.46Å; N519-K522 PolarHBondContact O-N 2.92Å; I520-K522 VanDerWaalsContact C-N 3.34Å; I520-K522 PolarHBondContact O-N 3.13Å; K522-R524 VanDerWaalsContact C-N 3.3Å; K522-R524 PolarHBondContact O-N 3.44Å; K522-L525 PolarHBondContact O-N 3.36Å; K522-L526 WeakPolarHBondContact O-CB 3.47Å; K522-L526 PolarHBondContact O-N 3.44Å
523	N	88.9	Confident	88.8	Confident	99 Å²	99	103.7 Å²	103.7	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-29.2	-178.5	-71.4	-6.6	0	0	0	113.6	N519 I520 N521 P527	N519-N523 WeakPolarHBondContact O-CB 3.32Å; N519-N523 VanDerWaalsContact O-CG 3.28Å; N519-N523 PolarHBondContact O-N 3.33Å; I520-N523 PolarHBondContact O-N 3.18Å; N521-N523 PolarHBondContact O-N 3.06Å; N523-P527 WeakPolarHBondContact O-CD 3.37Å
524	R	89.5	Confident	88.4	Confident	177 Å²	177	106.8 Å²	106.8	67%	0.668	52%	0.524	S	S	*	.	H	α-helix	trans	-78.1	-40.7	175.7	-73.4	178.5	174.8	-174.1	-3.2	112.8	I520 N521 K522 P527	I520-R524 WeakPolarHBondContact O-CG 3.45Å; I520-R524 PolarHBondContact O-N 2.77Å; N521-R524 PolarHBondContact O-N 3.49Å; K522-R524 VanDerWaalsContact C-N 3.3Å; K522-R524 PolarHBondContact O-N 3.44Å; R524-P527 WeakPolarHBondContact O-CD 3.31Å; R524-P527 WeakPolarHBondContact O-CG 3.45Å
525	L	89.7	Confident	87.8	Confident	92 Å²	92	106.8 Å²	106.8	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-81.3	-32.8	-177	-70.9	166.5	0	0	0	112.3	N521 K522 L528 I529	N521-L525 VanDerWaalsContact O-CB 3.3Å; N521-L525 WeakPolarHBondContact O-CB 3.3Å; N521-L525 WeakPolarHBondContact O-CG 3.46Å; N521-L525 PolarHBondContact O-N 3.47Å; K522-L525 PolarHBondContact O-N 3.36Å; L525-L528 PolarHBondContact O-N 2.91Å; L525-L528 VanDerWaalsContact O-N 3.11Å; L525-I529 HydrophobicContact CB-CD1 4.06Å; L525-I529 VanDerWaalsContact O-CG1 3.29Å; L525-I529 WeakPolarHBondContact O-CG1 3.48Å; L525-I529 PolarHBondContact O-N 3.48Å
526	L	89.5	Confident	86.9	Confident	84 Å²	84	102.5 Å²	102.5	44%	0.44	51%	0.508	S	S	.	.	H	α-helix	trans	-52.5	-49.6	-178.8	-168.4	78.5	0	0	0	113.6	K522 L528 I529 L530	K522-L526 WeakPolarHBondContact O-CB 3.47Å; K522-L526 PolarHBondContact O-N 3.44Å; L526-L528 VanDerWaalsContact C-N 3.34Å; L526-L528 PolarHBondContact O-N 2.97Å; L526-I529 PolarHBondContact O-N 2.82Å; L526-L530 HydrophobicContact CG-CD1 4.07Å; L526-L530 WeakPolarHBondContact O-CB 3.24Å; L526-L530 VanDerWaalsContact O-CG 3.24Å; L526-L530 WeakPolarHBondContact O-CG 3.4Å; L526-L530 PolarHBondContact O-N 3.41Å
527	P	87.3	Confident	86.1	Confident	72 Å²	72	103 Å²	103	47%	0.468	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-35.3	178.3	25.3	-34.1	0	0	0	112.7	N523 R524 L530 Q531	N523-P527 WeakPolarHBondContact O-CD 3.37Å; R524-P527 WeakPolarHBondContact O-CD 3.31Å; R524-P527 WeakPolarHBondContact O-CG 3.45Å; P527-L530 PolarHBondContact O-N 2.87Å; P527-Q531 VanDerWaalsContact O-CB 3.26Å; P527-Q531 WeakPolarHBondContact O-CB 2.94Å; P527-Q531 PolarHBondContact O-N 3Å
528	L	87.6	Confident	85.3	Confident	98 Å²	98	100.6 Å²	100.6	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-66.6	-45.4	176.7	-66.9	170.8	0	0	0	111	L525 L526 L530 Q531 E532	L525-L528 PolarHBondContact O-N 2.91Å; L525-L528 VanDerWaalsContact O-N 3.11Å; L526-L528 VanDerWaalsContact C-N 3.34Å; L526-L528 PolarHBondContact O-N 2.97Å; L528-L530 VanDerWaalsContact C-N 3.33Å; L528-L530 PolarHBondContact O-N 3.35Å; L528-Q531 PolarHBondContact O-N 3.33Å; L528-E532 WeakPolarHBondContact O-CB 3.43Å; L528-E532 PolarHBondContact O-N 3.46Å
529	I	85.6	Confident	84.4	Confident	104 Å²	104	100 Å²	100	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-62.5	-42.2	176.6	-66.6	166	0	0	0	110.5	L525 L526 Q531 E532 D533	L525-I529 HydrophobicContact CB-CD1 4.06Å; L525-I529 VanDerWaalsContact O-CG1 3.29Å; L525-I529 WeakPolarHBondContact O-CG1 3.48Å; L525-I529 PolarHBondContact O-N 3.48Å; L526-I529 PolarHBondContact O-N 2.82Å; I529-Q531 VanDerWaalsContact C-N 3.34Å; I529-E532 PolarHBondContact O-N 3.09Å; I529-D533 WeakPolarHBondContact O-CB 3.09Å; I529-D533 PolarHBondContact O-N 2.79Å
530	L	86.3	Confident	83.3	Confident	91 Å²	91	96.9 Å²	96.9	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-66.5	-36.7	176.3	-72.2	171.8	0	0	0	112	L526 P527 L528 Q534	L526-L530 HydrophobicContact CG-CD1 4.07Å; L526-L530 WeakPolarHBondContact O-CB 3.24Å; L526-L530 VanDerWaalsContact O-CG 3.24Å; L526-L530 WeakPolarHBondContact O-CG 3.4Å; L526-L530 PolarHBondContact O-N 3.41Å; P527-L530 PolarHBondContact O-N 2.87Å; L528-L530 VanDerWaalsContact C-N 3.33Å; L528-L530 PolarHBondContact O-N 3.35Å; L530-Q534 WeakPolarHBondContact O-CB 3.16Å; L530-Q534 VanDerWaalsContact O-CG 3.24Å; L530-Q534 WeakPolarHBondContact O-CG 3.02Å; L530-Q534 PolarHBondContact O-N 2.98Å
531	Q	85.9	Confident	82.2	Confident	118 Å²	118	97.6 Å²	97.6	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-68.4	-44.2	175.5	-177.2	178.6	-7.6	0	0	111.4	P527 L528 I529 Q534 C535	P527-Q531 VanDerWaalsContact O-CB 3.26Å; P527-Q531 WeakPolarHBondContact O-CB 2.94Å; P527-Q531 PolarHBondContact O-N 3Å; L528-Q531 PolarHBondContact O-N 3.33Å; I529-Q531 VanDerWaalsContact C-N 3.34Å; Q531-Q534 PolarHBondContact O-N 3.05Å; Q531-C535 WeakPolarHBondContact O-CB 3.38Å; Q531-C535 PolarHBondContact O-N 3.47Å; Q531-C535 PolarHBondContact O-SG 2.81Å; Q531-C535 VanDerWaalsContact O-SG 3.41Å
532	E	82.8	Confident	81.1	Confident	127 Å²	127	100.3 Å²	100.3	59%	0.593	51%	0.505	S	S	*	.	H	α-helix	trans	-59.7	-47.1	174.5	-156.5	90.4	-150.5	0	0	110.4	L528 I529 Q534 C535 L536	L528-E532 WeakPolarHBondContact O-CB 3.43Å; L528-E532 PolarHBondContact O-N 3.46Å; I529-E532 PolarHBondContact O-N 3.09Å; E532-Q534 VanDerWaalsContact C-N 3.33Å; E532-Q534 PolarHBondContact O-N 3.47Å; E532-C535 CarbonylContact O-C 3.6Å; E532-C535 WeakPolarHBondContact O-CB 2.9Å; E532-C535 PolarHBondContact O-N 2.77Å; E532-C535 VanDerWaalsContact O-N 3.13Å; E532-L536 HydrophobicContact CG-CD1 4.38Å; E532-L536 WeakPolarHBondContact O-CB 3.21Å; E532-L536 VanDerWaalsContact O-CG 3.3Å; E532-L536 WeakPolarHBondContact O-CG 3.18Å; E532-L536 PolarHBondContact O-N 3.05Å
533	D	82.9	Confident	80.2	Confident	60 Å²	60	99.6 Å²	99.6	32%	0.321	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-41.9	176.1	-176.3	58.8	0	0	0	111.5	I529 L536 R537	I529-D533 WeakPolarHBondContact O-CB 3.09Å; I529-D533 PolarHBondContact O-N 2.79Å; D533-L536 PolarHBondContact O-N 3.43Å; D533-R537 WeakPolarHBondContact O-CB 3.39Å; D533-R537 VanDerWaalsContact O-CG 3.26Å; D533-R537 WeakPolarHBondContact O-CG 3.48Å; D533-R537 PolarHBondContact O-N 3.21Å; D533-R537 IonicContact OD1-NE 3.19Å; D533-R537 IonicContact OD1-NH2 3.15Å; D533-R537 IonicContact OD2-CZ 3.03Å; D533-R537 IonicContact OD2-NE 3.57Å; D533-R537 PolarHBondContact OD2-NE 3.17Å; D533-R537 IonicContact OD2-NH2 3.63Å; D533-R537 PolarHBondContact OD2-NH2 2.03Å
534	Q	82.2	Confident	78.9	Confident	117 Å²	117	97.9 Å²	97.9	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-40	174.3	-76.2	177.3	2.4	0	0	112.6	L530 Q531 E532 K538	L530-Q534 WeakPolarHBondContact O-CB 3.16Å; L530-Q534 VanDerWaalsContact O-CG 3.24Å; L530-Q534 WeakPolarHBondContact O-CG 3.02Å; L530-Q534 PolarHBondContact O-N 2.98Å; Q531-Q534 PolarHBondContact O-N 3.05Å; E532-Q534 VanDerWaalsContact C-N 3.33Å; E532-Q534 PolarHBondContact O-N 3.47Å; Q534-K538 WeakPolarHBondContact O-CG 3.33Å; Q534-K538 PolarHBondContact O-N 2.91Å; Q534-K538 VanDerWaalsContact O-N 3.09Å
535	C	77.8	Confident	77.6	Confident	72 Å²	72	91.4 Å²	91.4	49%	0.486	49%	0.491	S	S	.	.	H	α-helix	trans	-64.3	-46.3	174.8	-76.9	0	0	0	0	111.2	Q531 E532 R537 K538 A539	Q531-C535 WeakPolarHBondContact O-CB 3.38Å; Q531-C535 PolarHBondContact O-N 3.47Å; Q531-C535 PolarHBondContact O-SG 2.81Å; Q531-C535 VanDerWaalsContact O-SG 3.41Å; E532-C535 CarbonylContact O-C 3.6Å; E532-C535 WeakPolarHBondContact O-CB 2.9Å; E532-C535 PolarHBondContact O-N 2.77Å; E532-C535 VanDerWaalsContact O-N 3.13Å; C535-R537 PolarHBondContact O-N 3.37Å; C535-K538 PolarHBondContact O-N 3.05Å; C535-K538 VanDerWaalsContact O-N 3.16Å; C535-A539 PolarHBondContact O-N 3.43Å
536	L	73.7	Confident	76.1	Confident	66 Å²	66	94.8 Å²	94.8	35%	0.346	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-42.9	177.4	-72.9	171.2	0	0	0	111.5	E532 D533 K538 A539 S540	E532-L536 HydrophobicContact CG-CD1 4.38Å; E532-L536 WeakPolarHBondContact O-CB 3.21Å; E532-L536 VanDerWaalsContact O-CG 3.3Å; E532-L536 WeakPolarHBondContact O-CG 3.18Å; E532-L536 PolarHBondContact O-N 3.05Å; D533-L536 PolarHBondContact O-N 3.43Å; L536-K538 VanDerWaalsContact C-N 3.33Å; L536-K538 PolarHBondContact O-N 3.09Å; L536-A539 PolarHBondContact O-N 3.19Å; L536-S540 WeakPolarHBondContact O-CB 3.05Å; L536-S540 PolarHBondContact O-N 3.35Å; L536-S540 PolarHBondContact O-OG 2.89Å
537	R	74.8	Confident	74.7	Confident	162 Å²	162	95.6 Å²	95.6	61%	0.611	51%	0.514	S	S	*	.	H	α-helix	trans	-63.6	-35	174.7	-72.9	179.1	-164.1	-152.7	9.1	113.3	D533 C535 S540 S541	D533-R537 WeakPolarHBondContact O-CB 3.39Å; D533-R537 VanDerWaalsContact O-CG 3.26Å; D533-R537 WeakPolarHBondContact O-CG 3.48Å; D533-R537 PolarHBondContact O-N 3.21Å; D533-R537 IonicContact OD1-NE 3.19Å; D533-R537 IonicContact OD1-NH2 3.15Å; D533-R537 IonicContact OD2-CZ 3.03Å; D533-R537 IonicContact OD2-NE 3.57Å; D533-R537 PolarHBondContact OD2-NE 3.17Å; D533-R537 IonicContact OD2-NH2 3.63Å; D533-R537 PolarHBondContact OD2-NH2 2.03Å; C535-R537 PolarHBondContact O-N 3.37Å; R537-S540 WeakPolarHBondContact CA-OG 3.14Å; R537-S540 PolarHBondContact O-OG 2.67Å; R537-S541 PolarHBondContact O-N 3.46Å
538	K	75.3	Confident	73.3	Confident	139 Å²	139	98.4 Å²	98.4	60%	0.604	52%	0.521	S	S	*	.	H	α-helix	trans	-71.4	-44.9	174.5	-73.5	176.6	-176.6	178.6	0	111.1	Q534 C535 L536 S540 S541 I542	Q534-K538 WeakPolarHBondContact O-CG 3.33Å; Q534-K538 PolarHBondContact O-N 2.91Å; Q534-K538 VanDerWaalsContact O-N 3.09Å; C535-K538 PolarHBondContact O-N 3.05Å; C535-K538 VanDerWaalsContact O-N 3.16Å; L536-K538 VanDerWaalsContact C-N 3.33Å; L536-K538 PolarHBondContact O-N 3.09Å; K538-S540 VanDerWaalsContact C-N 3.32Å; K538-S540 PolarHBondContact O-N 3.04Å; K538-S541 PolarHBondContact O-N 3.42Å; K538-S541 PolarHBondContact O-OG 2.93Å; K538-I542 WeakPolarHBondContact O-CG1 3.5Å; K538-I542 PolarHBondContact O-N 3.04Å; K538-I542 VanDerWaalsContact O-N 3.07Å
539	A	71.4	Confident	71.9	Confident	43 Å²	43	101.1 Å²	101.1	36%	0.355	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-43.2	177	0	0	0	0	0	111.2	C535 L536 S541 I542 L543	C535-A539 PolarHBondContact O-N 3.43Å; L536-A539 PolarHBondContact O-N 3.19Å; A539-S541 VanDerWaalsContact C-N 3.34Å; A539-S541 PolarHBondContact O-N 2.87Å; A539-I542 PolarHBondContact O-N 2.96Å; A539-L543 WeakPolarHBondContact O-CG 3.43Å; A539-L543 PolarHBondContact O-N 3.24Å
540	S	68.2	Low	70.5	Confident	23 Å²	23	100.6 Å²	100.6	16%	0.161	53%	0.527	C	S	.	.	H	α-helix	trans	-63.1	-38.6	176.4	68.3	0	0	0	0	112.4	L536 R537 K538 I542 L543 G544 L545 I551	L536-S540 WeakPolarHBondContact O-CB 3.05Å; L536-S540 PolarHBondContact O-N 3.35Å; L536-S540 PolarHBondContact O-OG 2.89Å; R537-S540 WeakPolarHBondContact CA-OG 3.14Å; R537-S540 PolarHBondContact O-OG 2.67Å; K538-S540 VanDerWaalsContact C-N 3.32Å; K538-S540 PolarHBondContact O-N 3.04Å; S540-I542 VanDerWaalsContact C-N 3.34Å; S540-I542 PolarHBondContact O-N 3.42Å; S540-L543 PolarHBondContact O-N 3.31Å; S540-G544 PolarHBondContact O-N 2.82Å; S540-L545 PolarHBondContact O-N 2.65Å; S540-I551 VanDerWaalsContact CB-CD1 3.42Å
541	S	69.1	Low	69.1	Low	87 Å²	87	98.6 Å²	98.6	61%	0.608	52%	0.516	S	S	*	.	H	α-helix	trans	-66.3	-32.8	175.1	73	0	0	0	0	113.6	R537 K538 A539	R537-S541 PolarHBondContact O-N 3.46Å; K538-S541 PolarHBondContact O-N 3.42Å; K538-S541 PolarHBondContact O-OG 2.93Å; A539-S541 VanDerWaalsContact C-N 3.34Å; A539-S541 PolarHBondContact O-N 2.87Å
542	I	66.4	Low	67.6	Low	143 Å²	143	100.3 Å²	100.3	73%	0.733	52%	0.517	S	S	*	.	H	α-helix	trans	-74.5	-35.8	178.2	-69	164.9	0	0	0	110.7	K538 A539 S540 G544	K538-I542 WeakPolarHBondContact O-CG1 3.5Å; K538-I542 PolarHBondContact O-N 3.04Å; K538-I542 VanDerWaalsContact O-N 3.07Å; A539-I542 PolarHBondContact O-N 2.96Å; S540-I542 VanDerWaalsContact C-N 3.34Å; S540-I542 PolarHBondContact O-N 3.42Å; I542-G544 VanDerWaalsContact C-N 3.31Å; I542-G544 PolarHBondContact O-N 2.77Å
543	L	69	Low	66.5	Low	118 Å²	118	99.6 Å²	99.6	62%	0.618	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-4.4	-178.6	-71.1	165.9	0	0	0	113.8	A539 S540 L545	A539-L543 WeakPolarHBondContact O-CG 3.43Å; A539-L543 PolarHBondContact O-N 3.24Å; S540-L543 PolarHBondContact O-N 3.31Å; L543-L545 HydrophobicContact CB-CD1 3.68Å; L543-L545 HydrophobicContact CB-CG 3.83Å; L543-L545 HydrophobicContact CD1-CD1 3.99Å; L543-L545 HydrophobicContact CG-CD1 4.44Å; L543-L545 PolarHBondContact O-N 2.67Å
544	G	62.7	Low	65.2	Low	63 Å²	63	99.5 Å²	99.5	65%	0.649	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	27.1	-178.4	0	0	0	0	0	113.5	S540 I542 D546	S540-G544 PolarHBondContact O-N 2.82Å; I542-G544 VanDerWaalsContact C-N 3.31Å; I542-G544 PolarHBondContact O-N 2.77Å; G544-D546 PolarHBondContact O-N 2.03Å
545	L	61.7	Low	64.1	Low	40 Å²	40	97.8 Å²	97.8	21%	0.209	52%	0.524	C	S	.	.			trans	-92.3	90.3	-177.6	-67	169.4	0	0	0	109.7	S540 L543 N547 Q550 I551	S540-L545 PolarHBondContact O-N 2.65Å; L543-L545 HydrophobicContact CB-CD1 3.68Å; L543-L545 HydrophobicContact CB-CG 3.83Å; L543-L545 HydrophobicContact CD1-CD1 3.99Å; L543-L545 HydrophobicContact CG-CD1 4.44Å; L543-L545 PolarHBondContact O-N 2.67Å; L545-N547 PolarHBondContact O-N 3.09Å; L545-Q550 HydrophobicContact CB-CB 4.49Å; L545-Q550 HydrophobicContact CD2-CB 3.8Å; L545-Q550 HydrophobicContact CD2-CG 4.23Å; L545-I551 HydrophobicContact CB-CG1 4.5Å
546	D	58.9	Low	63	Low	163 Å²	163	104.5 Å²	104.5	87%	0.872	54%	0.54	S	S	*	.			trans	-83.5	13	177.8	-89.1	-7.6	0	0	0	114.1	G544	G544-D546 PolarHBondContact O-N 2.03Å
547	N	58.7	Low	61.7	Low	101 Å²	101	111.8 Å²	111.8	54%	0.54	57%	0.572	S	S	.	*			trans	-118	121.6	175.5	-81.7	-26.4	0	0	0	112.1	L545 Q549 Q550 I551	L545-N547 PolarHBondContact O-N 3.09Å; N547-Q549 PolarHBondContact O-N 2.76Å; N547-Q549 VanDerWaalsContact O-N 3.08Å; N547-Q550 HydrophobicContact CB-CG 4.35Å; N547-Q550 PolarHBondContact O-N 3Å; N547-I551 PolarHBondContact O-N 3.39Å
548	E	58.4	Low	61	Low	132 Å²	132	109.3 Å²	109.3	62%	0.617	57%	0.57	S	S	*	*	H	α-helix	trans	-55	-29.1	177	-153.9	-166.5	151.7	0	0	112.7	R552	E548-R552 PolarHBondContact O-N 3.38Å; E548-R552 IonicContact OE1-CZ 2.81Å; E548-R552 IonicContact OE1-NE 2.92Å; E548-R552 IonicContact OE1-NH2 2.79Å; E548-R552 PolarHBondContact OE1-NH2 2.99Å
549	Q	58.3	Low	60.2	Low	155 Å²	155	107.7 Å²	107.7	72%	0.724	57%	0.569	S	S	*	*	H	α-helix	trans	-68.3	-35.9	174.6	-83.9	179	-26.2	0	0	113.2	N547 I553	N547-Q549 PolarHBondContact O-N 2.76Å; N547-Q549 VanDerWaalsContact O-N 3.08Å; Q549-I553 WeakPolarHBondContact O-CD1 3.11Å; Q549-I553 VanDerWaalsContact O-CG1 3.28Å; Q549-I553 WeakPolarHBondContact O-CG1 3.41Å; Q549-I553 PolarHBondContact O-N 3.05Å
550	Q	56.9	Low	59.6	Low	93 Å²	93	111.3 Å²	111.3	44%	0.435	58%	0.581	S	S	.	*	H	α-helix	trans	-71.9	-33.5	178.5	-73.9	175.3	-40	0	0	111.7	L545 N547 I553 A554	L545-Q550 HydrophobicContact CB-CB 4.49Å; L545-Q550 HydrophobicContact CD2-CB 3.8Å; L545-Q550 HydrophobicContact CD2-CG 4.23Å; N547-Q550 HydrophobicContact CB-CG 4.35Å; N547-Q550 PolarHBondContact O-N 3Å; Q550-I553 PolarHBondContact O-N 2.73Å; Q550-A554 WeakPolarHBondContact O-CB 3.21Å; Q550-A554 PolarHBondContact O-N 3.05Å; Q550-A554 VanDerWaalsContact O-N 3.14Å
551	I	56	Low	59.1	Low	48 Å²	48	116.5 Å²	116.5	25%	0.246	61%	0.605	C	S	.	*	H	α-helix	trans	-65.3	-41.6	176.1	-59.2	170.8	0	0	0	111.1	S540 L545 N547 C555	S540-I551 VanDerWaalsContact CB-CD1 3.42Å; L545-I551 HydrophobicContact CB-CG1 4.5Å; N547-I551 PolarHBondContact O-N 3.39Å; I551-C555 PolarHBondContact O-N 2.99Å
552	R	54.5	Low	58.5	Low	155 Å²	155	118.3 Å²	118.3	59%	0.585	61%	0.605	S	S	*	*	H	α-helix	trans	-70.1	-37.8	178	-69.4	-170.8	-159.6	-170.1	7.5	113	E548 A554 C555 Y556	E548-R552 PolarHBondContact O-N 3.38Å; E548-R552 IonicContact OE1-CZ 2.81Å; E548-R552 IonicContact OE1-NE 2.92Å; E548-R552 IonicContact OE1-NH2 2.79Å; E548-R552 PolarHBondContact OE1-NH2 2.99Å; R552-A554 VanDerWaalsContact C-N 3.34Å; R552-C555 PolarHBondContact O-N 2.77Å; R552-Y556 WeakPolarHBondContact O-CD2 3.49Å; R552-Y556 PolarHBondContact O-N 3.05Å
553	I	59.5	Low	58	Low	112 Å²	112	116.7 Å²	116.7	57%	0.574	60%	0.596	S	S	*	*	H	α-helix	trans	-66.9	-38.7	179.3	-65.4	166	0	0	0	110.7	Q549 Q550 C555 Y556 Q557	Q549-I553 WeakPolarHBondContact O-CD1 3.11Å; Q549-I553 VanDerWaalsContact O-CG1 3.28Å; Q549-I553 WeakPolarHBondContact O-CG1 3.41Å; Q549-I553 PolarHBondContact O-N 3.05Å; Q550-I553 PolarHBondContact O-N 2.73Å; I553-C555 VanDerWaalsContact C-N 3.31Å; I553-C555 PolarHBondContact O-N 2.75Å; I553-Y556 PolarHBondContact O-N 2.86Å; I553-Q557 PolarHBondContact O-N 3.4Å
554	A	56.8	Low	57.2	Low	58 Å²	58	116.6 Å²	116.6	48%	0.479	60%	0.595	S	S	.	*	H	α-helix	trans	-71.1	-20	177.5	0	0	0	0	0	114.4	Q550 R552	Q550-A554 WeakPolarHBondContact O-CB 3.21Å; Q550-A554 PolarHBondContact O-N 3.05Å; Q550-A554 VanDerWaalsContact O-N 3.14Å; R552-A554 VanDerWaalsContact C-N 3.34Å
555	C	57.3	Low	56.8	Low	80 Å²	80	120.7 Å²	120.7	54%	0.541	59%	0.591	S	S	.	*	H	α-helix	trans	-93.6	-13.8	176	-72.6	0	0	0	0	114	I551 R552 I553	I551-C555 PolarHBondContact O-N 2.99Å; R552-C555 PolarHBondContact O-N 2.77Å; I553-C555 VanDerWaalsContact C-N 3.31Å; I553-C555 PolarHBondContact O-N 2.75Å
556	Y	55.9	Low	56.4	Low	214 Å²	214	127.4 Å²	127.4	84%	0.839	62%	0.623	S	S	*	*	H	α-helix	trans	-92.1	-14.6	176.4	-96.5	-78	0	0	0	113.4	R552 I553	R552-Y556 WeakPolarHBondContact O-CD2 3.49Å; R552-Y556 PolarHBondContact O-N 3.05Å; I553-Y556 PolarHBondContact O-N 2.86Å
557	Q	45.3	Very low	56.1	Low	218 Å²	218	124.2 Å²	124.2	100%	1.019	60%	0.6	S	S	*	*			trans	-88.3	0	163.3	-73.8	-177	-31.3	0	0	109.4	I553	I553-Q557 PolarHBondContact O-N 3.4Å

Retrieved 557 of 557 residues in 188.4 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).