A0A087Y960_POEFO Loading...

Ddb1 and cul4 associated factor 6

AlphaFold DB , UniProt , Accession A0A087Y960, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 577 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	31.9	Very low	46	Very low	236 Å²	236	100.8 Å²	100.8	100%	1.163	57%	0.566	S	S	*	*				0	139.4	0	-70.3	172.4	171.2	0	0	108.4	C3	M1-C3 PolarHBondContact O-N 3.22Å
2	S	33.5	Very low	46.6	Very low	99 Å²	99	97.8 Å²	97.8	69%	0.692	55%	0.547	S	S	*	.			trans	-80	115.8	179.7	-174.8	0	0	0	0	110.6	T4	S2-T4 VanDerWaalsContact C-N 3.25Å; S2-T4 PolarHBondContact O-N 3.08Å; S2-T4 WeakPolarHBondContact OG-CG2 3.43Å; S2-T4 PolarHBondContact OG-OG1 2.99Å
3	C	35.9	Very low	47.2	Very low	122 Å²	122	102 Å²	102	82%	0.824	56%	0.556	S	S	*	*			trans	-91.9	47	178.9	-60.2	0	0	0	0	111.6	M1 G5	M1-C3 PolarHBondContact O-N 3.22Å; C3-G5 PolarHBondContact O-N 3.09Å
4	T	43.9	Very low	47.8	Very low	129 Å²	129	108.2 Å²	108.2	79%	0.791	57%	0.567	S	S	*	*			trans	-77.3	53.1	173.3	44.5	0	0	0	0	111.4	S2	S2-T4 VanDerWaalsContact C-N 3.25Å; S2-T4 PolarHBondContact O-N 3.08Å; S2-T4 WeakPolarHBondContact OG-CG2 3.43Å; S2-T4 PolarHBondContact OG-OG1 2.99Å
5	G	42.7	Very low	48.3	Very low	35 Å²	35	105.9 Å²	105.9	36%	0.361	56%	0.555	S	S	.	*			trans	-99.9	125.9	170.6	0	0	0	0	0	109.8	C3 L7	C3-G5 PolarHBondContact O-N 3.09Å; G5-L7 PolarHBondContact O-N 3.12Å
6	N	53.3	Low	48.6	Very low	121 Å²	121	110.2 Å²	110.2	65%	0.647	58%	0.576	S	S	*	*			trans	-64.2	110.1	172.7	-80.5	-38	0	0	0	108.7	V8 W9 D10	N6-V8 PolarHBondContact O-N 3.13Å; N6-W9 HydrophobicContact CB-CB 4.25Å; N6-W9 HydrophobicContact CB-CG 4.26Å; N6-W9 WeakPolarHBondContact O-CA 3.46Å; N6-W9 WeakPolarHBondContact O-CB 3.38Å; N6-W9 PolarHBondContact O-N 3.46Å; N6-D10 PolarHBondContact O-N 3.34Å; N6-D10 VanDerWaalsContact O-N 3.11Å
7	L	51.7	Low	49.1	Very low	82 Å²	82	106.6 Å²	106.6	43%	0.429	57%	0.572	S	S	.	*	H	α-helix	trans	-51.5	-37.8	-170.2	-166.2	73.5	0	0	0	113.2	G5 D10 V11 Y28 F34	G5-L7 PolarHBondContact O-N 3.12Å; L7-D10 PolarHBondContact O-N 3.1Å; L7-V11 WeakPolarHBondContact O-CG2 3.46Å; L7-V11 PolarHBondContact O-N 2.97Å; L7-Y28 HydrophobicContact CD2-CE1 4.09Å; L7-F34 HydrophobicContact CD2-CE2 4.15Å
8	V	52.2	Low	49.4	Very low	43 Å²	43	114.5 Å²	114.5	26%	0.261	60%	0.595	S	S	.	*	H	α-helix	trans	-62.6	-41.4	176.5	-179.6	0	0	0	0	112.4	N6 N12 R25 L29	N6-V8 PolarHBondContact O-N 3.13Å; V8-N12 PolarHBondContact O-N 3.17Å; V8-R25 HydrophobicContact CG1-CG 4.18Å; V8-L29 HydrophobicContact CG2-CD2 4.35Å
9	W	50.3	Low	49.7	Very low	169 Å²	169	110.2 Å²	110.2	64%	0.64	58%	0.581	S	S	*	*	H	α-helix	trans	-71.2	-34.3	176.9	-74.6	84.4	0	0	0	111.9	N6 N12 K13	N6-W9 HydrophobicContact CB-CB 4.25Å; N6-W9 HydrophobicContact CB-CG 4.26Å; N6-W9 WeakPolarHBondContact O-CA 3.46Å; N6-W9 WeakPolarHBondContact O-CB 3.38Å; N6-W9 PolarHBondContact O-N 3.46Å; W9-N12 PolarHBondContact O-N 2.97Å; W9-K13 WeakPolarHBondContact O-CG 3.25Å; W9-K13 PolarHBondContact O-N 3.21Å
10	D	54.4	Low	50.3	Low	41 Å²	41	111.1 Å²	111.1	22%	0.219	58%	0.582	C	S	.	*	H	α-helix	trans	-79.6	-18.3	178.2	-70.5	-18.4	0	0	0	113.4	N6 L7 K13 R14	N6-D10 PolarHBondContact O-N 3.34Å; N6-D10 VanDerWaalsContact O-N 3.11Å; L7-D10 PolarHBondContact O-N 3.1Å; D10-K13 IonicContact OD1-NZ 3.69Å; D10-K13 PolarHBondContact OD1-NZ 3.22Å; D10-R14 VanDerWaalsContact O-CD 3.26Å; D10-R14 WeakPolarHBondContact O-CD 3.42Å; D10-R14 WeakPolarHBondContact O-CG 3.49Å; D10-R14 PolarHBondContact O-NE 3.31Å
11	V	56.1	Low	50.7	Low	32 Å²	32	108 Å²	108	19%	0.194	57%	0.569	C	S	.	*	H	α-helix	trans	-68.2	-46.7	165.3	166.7	0	0	0	0	110.4	L7 K13 R14 I24	L7-V11 WeakPolarHBondContact O-CG2 3.46Å; L7-V11 PolarHBondContact O-N 2.97Å; V11-K13 PolarHBondContact O-N 3.34Å; V11-R14 PolarHBondContact O-N 3.47Å; V11-I24 HydrophobicContact CG1-CG2 4.22Å
12	N	53.8	Low	52	Low	64 Å²	64	101 Å²	101	34%	0.342	54%	0.536	S	S	.	.	H	α-helix	trans	-59.3	-32.6	178	-71.3	2.4	0	0	0	112.8	V8 W9 R14	V8-N12 PolarHBondContact O-N 3.17Å; W9-N12 PolarHBondContact O-N 2.97Å; N12-R14 VanDerWaalsContact C-N 3.31Å; N12-R14 PolarHBondContact O-N 3Å
13	K	54.6	Low	53.4	Low	153 Å²	153	100 Å²	100	67%	0.665	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-7.9	176.9	-66.4	173.1	-163.6	158.9	0	114.9	W9 D10 V11	W9-K13 WeakPolarHBondContact O-CG 3.25Å; W9-K13 PolarHBondContact O-N 3.21Å; D10-K13 IonicContact OD1-NZ 3.69Å; D10-K13 PolarHBondContact OD1-NZ 3.22Å; V11-K13 PolarHBondContact O-N 3.34Å
14	R	55.5	Low	54.8	Low	189 Å²	189	97.8 Å²	97.8	71%	0.713	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	13.2	-178.5	-69.1	167.7	-164.6	-145.5	1.3	113.1	D10 V11 N12	D10-R14 VanDerWaalsContact O-CD 3.26Å; D10-R14 WeakPolarHBondContact O-CD 3.42Å; D10-R14 WeakPolarHBondContact O-CG 3.49Å; D10-R14 PolarHBondContact O-NE 3.31Å; V11-R14 PolarHBondContact O-N 3.47Å; N12-R14 VanDerWaalsContact C-N 3.31Å; N12-R14 PolarHBondContact O-N 3Å
15	L	54.9	Low	55.8	Low	73 Å²	73	96.8 Å²	96.8	38%	0.382	49%	0.49	S	S	.	.			trans	-73	129.6	-179.1	-160.3	80.6	0	0	0	111.2	G17 P21 I24	L15-G17 WeakPolarHBondContact CD2-O 3.37Å; L15-P21 HydrophobicContact CD2-CG 4.41Å; L15-I24 HydrophobicContact CD1-CD1 3.5Å
16	I	52.6	Low	56.9	Low	175 Å²	175	99.6 Å²	99.6	90%	0.897	50%	0.5	S	S	*	.			trans	-130.5	97.6	166.1	-55.9	178.3	0	0	0	106.7
17	G	57.1	Low	57.6	Low	49 Å²	49	97 Å²	97	51%	0.505	49%	0.492	S	S	.	.	S	Bend	trans	130.4	176.9	179.9	0	0	0	0	0	114.4	L15 G19	L15-G17 WeakPolarHBondContact CD2-O 3.37Å; G17-G19 PolarHBondContact O-N 3.07Å; G17-G19 VanDerWaalsContact O-N 3.15Å
18	Y	54.7	Low	58.5	Low	249 Å²	249	96.4 Å²	96.4	98%	0.976	48%	0.484	S	S	*	.	S	Bend	trans	-84.7	32.8	-173.9	-60.2	-82.7	0	0	0	114.4
19	G	55.8	Low	59.4	Low	32 Å²	32	97.2 Å²	97.2	33%	0.33	49%	0.487	S	S	.	.			trans	-85.4	126.5	-179.7	0	0	0	0	0	112.2	G17 P21	G17-G19 PolarHBondContact O-N 3.07Å; G17-G19 VanDerWaalsContact O-N 3.15Å; G19-P21 VanDerWaalsContact O-CD 3.27Å; G19-P21 WeakPolarHBondContact O-CD 3.25Å; G19-P21 VanDerWaalsContact O-N 3.13Å
20	E	60.3	Low	60.4	Low	128 Å²	128	92.1 Å²	92.1	60%	0.598	49%	0.486	S	S	*	.			trans	-53.2	113.4	174.8	-96.6	-62.6	156.3	0	0	111.7	N22 S23 I24	E20-N22 PolarHBondContact O-N 2.67Å; E20-N22 VanDerWaalsContact O-N 3.11Å; E20-S23 WeakPolarHBondContact O-CB 3.42Å; E20-S23 PolarHBondContact O-N 3.44Å; E20-I24 PolarHBondContact O-N 2.86Å
21	P	59.2	Low	61.5	Low	48 Å²	48	96.4 Å²	96.4	31%	0.312	50%	0.499	S	S	.	.	H	α-helix	trans	-59	-31.8	-172.8	-26.7	35.3	0	0	0	113.2	L15 G19 S23 I24 R25	L15-P21 HydrophobicContact CD2-CG 4.41Å; G19-P21 VanDerWaalsContact O-CD 3.27Å; G19-P21 WeakPolarHBondContact O-CD 3.25Å; G19-P21 VanDerWaalsContact O-N 3.13Å; P21-S23 VanDerWaalsContact C-N 3.33Å; P21-S23 PolarHBondContact O-N 3.45Å; P21-I24 PolarHBondContact O-N 3.35Å; P21-R25 WeakPolarHBondContact O-CB 3.4Å; P21-R25 PolarHBondContact O-N 3.05Å
22	N	60.2	Low	62.6	Low	87 Å²	87	102.8 Å²	102.8	47%	0.465	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-33.5	177.8	-69	-46.6	0	0	0	112.8	E20 T26	E20-N22 PolarHBondContact O-N 2.67Å; E20-N22 VanDerWaalsContact O-N 3.11Å; N22-T26 WeakPolarHBondContact O-CB 3.29Å; N22-T26 PolarHBondContact O-N 3.03Å; N22-T26 PolarHBondContact O-OG1 3.11Å
23	S	63.2	Low	63.9	Low	80 Å²	80	104.5 Å²	104.5	56%	0.559	53%	0.526	S	S	*	.	H	α-helix	trans	-68.9	-45.6	176.7	-175.4	0	0	0	0	111	E20 P21 T26 S27	E20-S23 WeakPolarHBondContact O-CB 3.42Å; E20-S23 PolarHBondContact O-N 3.44Å; P21-S23 VanDerWaalsContact C-N 3.33Å; P21-S23 PolarHBondContact O-N 3.45Å; S23-T26 PolarHBondContact O-N 2.91Å; S23-S27 VanDerWaalsContact O-CB 3.29Å; S23-S27 WeakPolarHBondContact O-CB 3.28Å; S23-S27 PolarHBondContact O-N 3.15Å
24	I	64.4	Low	65.2	Low	75 Å²	75	99.7 Å²	99.7	39%	0.385	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-43.5	176.4	-62.3	173.7	0	0	0	110.9	V11 L15 E20 P21 T26 S27 Y28	V11-I24 HydrophobicContact CG1-CG2 4.22Å; L15-I24 HydrophobicContact CD1-CD1 3.5Å; E20-I24 PolarHBondContact O-N 2.86Å; P21-I24 PolarHBondContact O-N 3.35Å; I24-T26 PolarHBondContact O-N 3.26Å; I24-S27 PolarHBondContact O-N 3.17Å; I24-Y28 VanDerWaalsContact O-CB 3.28Å; I24-Y28 WeakPolarHBondContact O-CB 3.26Å; I24-Y28 PolarHBondContact O-N 3.47Å
25	R	65.9	Low	66.5	Low	108 Å²	108	94.2 Å²	94.2	41%	0.408	49%	0.493	S	S	.	.	H	α-helix	trans	-57.6	-47.6	174.7	176.6	178.8	172.8	-176.5	-0.1	111.5	V8 P21 Y28 L29	V8-R25 HydrophobicContact CG1-CG 4.18Å; P21-R25 WeakPolarHBondContact O-CB 3.4Å; P21-R25 PolarHBondContact O-N 3.05Å; R25-Y28 PolarHBondContact O-N 3.02Å; R25-L29 HydrophobicContact CG-CD1 3.83Å; R25-L29 HydrophobicContact CG-CG 4.43Å; R25-L29 WeakPolarHBondContact O-CB 3.39Å; R25-L29 VanDerWaalsContact O-CG 3.28Å; R25-L29 WeakPolarHBondContact O-CG 3.47Å; R25-L29 PolarHBondContact O-N 3.24Å
26	T	64.8	Low	67.8	Low	93 Å²	93	97.2 Å²	97.2	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-66.3	-46.2	-179.6	-54.1	0	0	0	0	111.1	N22 S23 I24 Y28 L29 G30	N22-T26 WeakPolarHBondContact O-CB 3.29Å; N22-T26 PolarHBondContact O-N 3.03Å; N22-T26 PolarHBondContact O-OG1 3.11Å; S23-T26 PolarHBondContact O-N 2.91Å; I24-T26 PolarHBondContact O-N 3.26Å; T26-Y28 VanDerWaalsContact C-N 3.27Å; T26-Y28 PolarHBondContact O-N 3.4Å; T26-L29 PolarHBondContact O-N 2.86Å; T26-G30 PolarHBondContact O-N 2.88Å
27	S	67.4	Low	69.4	Low	68 Å²	68	97.9 Å²	97.9	48%	0.476	50%	0.496	S	S	.	.	H	α-helix	trans	-58.5	-35.4	174	178.6	0	0	0	0	112.9	S23 I24 R31	S23-S27 VanDerWaalsContact O-CB 3.29Å; S23-S27 WeakPolarHBondContact O-CB 3.28Å; S23-S27 PolarHBondContact O-N 3.15Å; I24-S27 PolarHBondContact O-N 3.17Å; S27-R31 WeakPolarHBondContact O-CG 3.16Å
28	Y	70.2	Confident	70.7	Confident	68 Å²	68	99.8 Å²	99.8	27%	0.267	49%	0.494	S	S	.	.	H	α-helix	trans	-75.8	-46	178.7	-174.4	-95.4	0	0	0	112.8	L7 I24 R25 T26 G30 R31 F34	L7-Y28 HydrophobicContact CD2-CE1 4.09Å; I24-Y28 VanDerWaalsContact O-CB 3.28Å; I24-Y28 WeakPolarHBondContact O-CB 3.26Å; I24-Y28 PolarHBondContact O-N 3.47Å; R25-Y28 PolarHBondContact O-N 3.02Å; T26-Y28 VanDerWaalsContact C-N 3.27Å; T26-Y28 PolarHBondContact O-N 3.4Å; Y28-G30 VanDerWaalsContact C-N 3.27Å; Y28-G30 PolarHBondContact O-N 3.43Å; Y28-R31 WeakPolarHBondContact O-CB 3.39Å; Y28-R31 WeakPolarHBondContact O-CG 3.22Å; Y28-R31 PolarHBondContact O-N 3.03Å; Y28-R31 VanDerWaalsContact O-N 3.12Å; Y28-F34 HydrophobicContact CD1-CD2 4.25Å; Y28-F34 AromaticContact CE1-CD2 3.57Å; Y28-F34 HydrophobicContact CE1-CD2 3.57Å; Y28-F34 HydrophobicContact CE1-CE2 4.04Å; Y28-F34 HydrophobicContact CE1-CG 4.29Å
29	L	71.8	Confident	72.2	Confident	61 Å²	61	96.3 Å²	96.3	32%	0.319	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-32.1	178.9	-68.8	172.6	0	0	0	112.1	V8 R25 T26 R31 F34	V8-L29 HydrophobicContact CG2-CD2 4.35Å; R25-L29 HydrophobicContact CG-CD1 3.83Å; R25-L29 HydrophobicContact CG-CG 4.43Å; R25-L29 WeakPolarHBondContact O-CB 3.39Å; R25-L29 VanDerWaalsContact O-CG 3.28Å; R25-L29 WeakPolarHBondContact O-CG 3.47Å; R25-L29 PolarHBondContact O-N 3.24Å; T26-L29 PolarHBondContact O-N 2.86Å; L29-R31 VanDerWaalsContact C-N 3.28Å; L29-R31 PolarHBondContact O-N 3.4Å; L29-F34 HydrophobicContact CD2-CD1 4.07Å; L29-F34 HydrophobicContact CD2-CE1 3.42Å; L29-F34 VanDerWaalsContact CD2-CE1 3.42Å; L29-F34 HydrophobicContact CD2-CE2 4.32Å; L29-F34 HydrophobicContact CD2-CZ 3.58Å; L29-F34 WeakPolarHBondContact O-CD1 3.21Å
30	G	70.8	Confident	73.7	Confident	61 Å²	61	100.4 Å²	100.4	63%	0.629	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-3	174	0	0	0	0	0	115.5	T26 Y28	T26-G30 PolarHBondContact O-N 2.88Å; Y28-G30 VanDerWaalsContact C-N 3.27Å; Y28-G30 PolarHBondContact O-N 3.43Å
31	R	77.6	Confident	75	Confident	131 Å²	131	102.8 Å²	102.8	49%	0.494	51%	0.509	S	S	.	.			trans	-72.5	136	-179.9	-62.1	-168.1	-177.8	-164.5	-2	111.2	S27 Y28 L29 E33 F34 V35	S27-R31 WeakPolarHBondContact O-CG 3.16Å; Y28-R31 WeakPolarHBondContact O-CB 3.39Å; Y28-R31 WeakPolarHBondContact O-CG 3.22Å; Y28-R31 PolarHBondContact O-N 3.03Å; Y28-R31 VanDerWaalsContact O-N 3.12Å; L29-R31 VanDerWaalsContact C-N 3.28Å; L29-R31 PolarHBondContact O-N 3.4Å; R31-E33 PolarHBondContact O-N 2.95Å; R31-F34 HydrophobicContact CB-CB 4.45Å; R31-F34 WeakPolarHBondContact O-CA 3.47Å; R31-F34 WeakPolarHBondContact O-CB 3.47Å; R31-F34 PolarHBondContact O-N 2.9Å; R31-V35 PolarHBondContact O-N 2.93Å
32	R	79.3	Confident	76.3	Confident	166 Å²	166	102.2 Å²	102.2	63%	0.626	51%	0.508	S	S	*	.	H	α-helix	trans	-53.1	-38.9	174.9	-174.7	-171.7	62.3	161.8	0.7	111.9	F34 V35 Q36	R32-F34 PolarHBondContact O-N 2.92Å; R32-V35 PolarHBondContact O-N 3.47Å; R32-Q36 HydrophobicContact CG-CG 4.15Å; R32-Q36 VanDerWaalsContact O-CB 3.25Å; R32-Q36 WeakPolarHBondContact O-CB 3.25Å; R32-Q36 VanDerWaalsContact O-CG 3.22Å; R32-Q36 WeakPolarHBondContact O-CG 3.32Å; R32-Q36 PolarHBondContact O-N 3.45Å
33	E	82.8	Confident	77.8	Confident	101 Å²	101	102.7 Å²	102.7	47%	0.472	51%	0.514	S	S	.	.	H	α-helix	trans	-71	-18.2	-179.9	-61	64.6	-137.7	0	0	113.1	R31 R37	R31-E33 PolarHBondContact O-N 2.95Å; E33-R37 VanDerWaalsContact O-CD 3.25Å; E33-R37 WeakPolarHBondContact O-CD 3.44Å; E33-R37 VanDerWaalsContact O-CG 3.32Å; E33-R37 WeakPolarHBondContact O-CG 3.29Å
34	F	80.1	Confident	79.2	Confident	52 Å²	52	101.6 Å²	101.6	23%	0.228	50%	0.502	C	S	.	.	H	α-helix	trans	-86.9	-46.8	169.7	-176.9	-95.1	0	0	0	110.7	L7 Y28 L29 R31 R32 Q36 R37	L7-F34 HydrophobicContact CD2-CE2 4.15Å; Y28-F34 HydrophobicContact CD1-CD2 4.25Å; Y28-F34 AromaticContact CE1-CD2 3.57Å; Y28-F34 HydrophobicContact CE1-CD2 3.57Å; Y28-F34 HydrophobicContact CE1-CE2 4.04Å; Y28-F34 HydrophobicContact CE1-CG 4.29Å; L29-F34 HydrophobicContact CD2-CD1 4.07Å; L29-F34 HydrophobicContact CD2-CE1 3.42Å; L29-F34 VanDerWaalsContact CD2-CE1 3.42Å; L29-F34 HydrophobicContact CD2-CE2 4.32Å; L29-F34 HydrophobicContact CD2-CZ 3.58Å; L29-F34 WeakPolarHBondContact O-CD1 3.21Å; R31-F34 HydrophobicContact CB-CB 4.45Å; R31-F34 WeakPolarHBondContact O-CA 3.47Å; R31-F34 WeakPolarHBondContact O-CB 3.47Å; R31-F34 PolarHBondContact O-N 2.9Å; R32-F34 PolarHBondContact O-N 2.92Å; F34-Q36 VanDerWaalsContact C-N 3.33Å; F34-Q36 PolarHBondContact O-N 3.02Å; F34-R37 WeakPolarHBondContact O-CB 3.34Å; F34-R37 PolarHBondContact O-N 3.18Å
35	V	82.8	Confident	80.5	Confident	74 Å²	74	105.2 Å²	105.2	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-59.5	-40.9	177.3	177.3	0	0	0	0	111.7	R31 R32 R37 L38	R31-V35 PolarHBondContact O-N 2.93Å; R32-V35 PolarHBondContact O-N 3.47Å; V35-R37 PolarHBondContact O-N 2.96Å; V35-R37 VanDerWaalsContact O-N 3.1Å; V35-L38 HydrophobicContact CG1-CD1 4.18Å; V35-L38 WeakPolarHBondContact O-CB 3.41Å; V35-L38 VanDerWaalsContact O-CG 3.32Å; V35-L38 WeakPolarHBondContact O-CG 3.42Å; V35-L38 PolarHBondContact O-N 2.84Å; V35-L38 VanDerWaalsContact O-N 3.13Å
36	Q	83.5	Confident	81.9	Confident	135 Å²	135	102 Å²	102	63%	0.631	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-6.1	174.7	-75.1	176.7	-33.5	0	0	114.3	R32 F34	R32-Q36 HydrophobicContact CG-CG 4.15Å; R32-Q36 VanDerWaalsContact O-CB 3.25Å; R32-Q36 WeakPolarHBondContact O-CB 3.25Å; R32-Q36 VanDerWaalsContact O-CG 3.22Å; R32-Q36 WeakPolarHBondContact O-CG 3.32Å; R32-Q36 PolarHBondContact O-N 3.45Å; F34-Q36 VanDerWaalsContact C-N 3.33Å; F34-Q36 PolarHBondContact O-N 3.02Å
37	R	85.6	Confident	83.3	Confident	189 Å²	189	99.2 Å²	99.2	71%	0.713	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	2.9	176.1	-65.9	178.1	64.5	-178.5	0.1	113.2	E33 F34 V35	E33-R37 VanDerWaalsContact O-CD 3.25Å; E33-R37 WeakPolarHBondContact O-CD 3.44Å; E33-R37 VanDerWaalsContact O-CG 3.32Å; E33-R37 WeakPolarHBondContact O-CG 3.29Å; F34-R37 WeakPolarHBondContact O-CB 3.34Å; F34-R37 PolarHBondContact O-N 3.18Å; V35-R37 PolarHBondContact O-N 2.96Å; V35-R37 VanDerWaalsContact O-N 3.1Å
38	L	84.4	Confident	84.5	Confident	89 Å²	89	103.5 Å²	103.5	47%	0.466	51%	0.512	S	S	.	.			trans	-62.5	138.2	168.4	-64.7	174.1	0	0	0	109.8	V35 F575	V35-L38 HydrophobicContact CG1-CD1 4.18Å; V35-L38 WeakPolarHBondContact O-CB 3.41Å; V35-L38 VanDerWaalsContact O-CG 3.32Å; V35-L38 WeakPolarHBondContact O-CG 3.42Å; V35-L38 PolarHBondContact O-N 2.84Å; V35-L38 VanDerWaalsContact O-N 3.13Å; L38-F575 HydrophobicContact CB-CZ 4.27Å
39	K	86.4	Confident	85.4	Confident	177 Å²	177	101.3 Å²	101.3	77%	0.77	51%	0.511	S	S	*	.			trans	-151.6	163.4	178.9	61.9	167	-172.3	165	0	109.3	E41	K39-E41 PolarHBondContact O-N 3.32Å
40	L	86.8	Confident	86.2	Confident	118 Å²	118	101.6 Å²	101.6	62%	0.618	52%	0.517	S	S	*	.			trans	-61.3	126.3	171.3	-175.9	62.3	0	0	0	110.7	A42	L40-A42 WeakPolarHBondContact CD1-O 3.38Å
41	E	87	Confident	87.3	Confident	178 Å²	178	101.3 Å²	101.3	83%	0.832	50%	0.503	S	S	*	.			trans	-109.4	-36.4	175.3	-177.8	175.9	173.3	0	0	111.9	K39	K39-E41 PolarHBondContact O-N 3.32Å
42	A	87.1	Confident	87.8	Confident	36 Å²	36	97.7 Å²	97.7	30%	0.298	49%	0.493	S	S	.	.			trans	-155.6	142	-179.5	0	0	0	0	0	111.5	L40 K80	L40-A42 WeakPolarHBondContact CD1-O 3.38Å; A42-K80 HydrophobicContact CB-CD 4.1Å; A42-K80 VanDerWaalsContact CB-CE 3.43Å
43	T	91.9	Very high	88.5	Confident	96 Å²	96	90 Å²	90	59%	0.589	47%	0.465	S	S	*	.			trans	-101	138.3	165.3	-41.3	0	0	0	0	108.5	N45	T43-N45 WeakPolarHBondContact CG2-OD1 3.43Å
44	L	92.2	Very high	89.1	Confident	58 Å²	58	87 Å²	87	30%	0.304	45%	0.452	S	S	.	.			trans	-120.5	91.4	-177	-63	176.5	0	0	0	109.7	V46 T75 P77 K80	L44-V46 VanDerWaalsContact C-N 3.34Å; L44-V46 HydrophobicContact CB-CG1 4.34Å; L44-V46 PolarHBondContact O-N 3.11Å; L44-T75 HydrophobicContact CD1-CG2 4.14Å; L44-T75 HydrophobicContact CD2-CG2 4.48Å; L44-P77 HydrophobicContact CD1-CB 4.05Å; L44-K80 HydrophobicContact CD2-CB 3.83Å; L44-K80 HydrophobicContact CD2-CG 3.98Å
45	N	92.9	Very high	89.8	Confident	151 Å²	151	85 Å²	85	81%	0.807	44%	0.444	S	S	*	.			trans	-79.7	81.1	-178.9	-60.9	-1.2	0	0	0	109.6	T43	T43-N45 WeakPolarHBondContact CG2-OD1 3.43Å
46	V	94.6	Very high	90.3	Very high	41 Å²	41	84.2 Å²	84.2	25%	0.248	43%	0.433	C	S	.	.			trans	-123.5	2.3	-172.4	-56	0	0	0	0	114.4	L44 V73 T75 V82	L44-V46 VanDerWaalsContact C-N 3.34Å; L44-V46 HydrophobicContact CB-CG1 4.34Å; L44-V46 PolarHBondContact O-N 3.11Å; V46-V73 HydrophobicContact CB-CG1 4.22Å; V46-V73 HydrophobicContact CG2-CG1 4.32Å; V46-T75 HydrophobicContact CG1-CG2 4.46Å; V46-V82 HydrophobicContact CB-CG2 4.17Å; V46-V82 HydrophobicContact CG1-CG2 3.67Å
47	H	93.8	Very high	90.7	Very high	34 Å²	34	77.9 Å²	77.9	16%	0.157	40%	0.404	C	S	.	.			trans	-142.8	148.9	-177.9	-82.2	-67.5	0	0	0	110.2	V51 S65 S67 D69 F71 V73	H47-V51 HydrophobicContact CB-CG2 3.96Å; H47-S65 PolarHBondContact CD2-OG 3.45Å; H47-S65 VanDerWaalsContact CD2-OG 3.3Å; H47-S65 WeakPolarHBondContact NE2-CB 3.42Å; H47-S65 PolarHBondContact NE2-OG 3.4Å; H47-S67 VanDerWaalsContact CE1-CB 3.43Å; H47-S67 WeakPolarHBondContact CE1-CB 3.48Å; H47-S67 WeakPolarHBondContact ND1-CB 3.29Å; H47-D69 WeakPolarHBondContact CA-OD2 3.18Å; H47-D69 VanDerWaalsContact CB-OD2 3.26Å; H47-D69 WeakPolarHBondContact CB-OD2 3.28Å; H47-D69 IonicContact CE1-OD1 2.94Å; H47-D69 IonicContact CG-OD2 2.84Å; H47-D69 IonicContact ND1-OD1 3.57Å; H47-D69 PolarHBondContact ND1-OD1 2.98Å; H47-D69 IonicContact ND1-OD2 3.15Å; H47-D69 PolarHBondContact ND1-OD2 2.77Å; H47-F71 PolarHBondContact CE1-O 3.15Å; H47-V73 VanDerWaalsContact CE1-CG2 3.44Å; H47-V73 WeakPolarHBondContact CE1-CG2 3.44Å
48	D	92.3	Very high	90.7	Very high	157 Å²	157	73.5 Å²	73.5	84%	0.84	39%	0.394	S	S	*	.	S	Bend	trans	-102	-7.9	177.7	-66.4	-49.3	0	0	0	112.4	D69	D48-D69 PolarHBondContact N-OD2 3.27Å
49	G	89.3	Confident	90.9	Very high	23 Å²	23	74 Å²	74	24%	0.237	40%	0.401	C	S	.	.	S	Bend	trans	-113.8	-179	176.9	0	0	0	0	0	114.1	S67 D69	G49-S67 WeakPolarHBondContact CA-OG 3.43Å; G49-S67 PolarHBondContact O-OG 3.05Å; G49-D69 PolarHBondContact N-OD2 2.93Å
50	C	89.5	Confident	90.9	Very high	66 Å²	66	66 Å²	66	45%	0.446	37%	0.369	S	S	.	.			trans	-71	132.4	173.9	-45.2	0	0	0	0	110.1	N52 S67 D68	C50-N52 PolarHBondContact O-N 3.39Å; C50-S67 CarbonylContact O-C 3.56Å; C50-S67 VanDerWaalsContact O-CA 3.22Å; C50-S67 WeakPolarHBondContact O-CA 3.46Å; C50-S67 PolarHBondContact O-OG 3.02Å; C50-D68 WeakPolarHBondContact CB-OD2 3.43Å; C50-D68 PolarHBondContact O-N 3.41Å; C50-D68 PolarHBondContact SG-OD2 2.81Å
51	V	92.6	Very high	91.1	Very high	55 Å²	55	64.3 Å²	64.3	33%	0.333	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	102.7	177.4	-178.1	0	0	0	0	109.7	H47 T53 I54	H47-V51 HydrophobicContact CB-CG2 3.96Å; V51-T53 WeakPolarHBondContact CG1-O 3.45Å; V51-I54 HydrophobicContact CG1-CG2 3.96Å
52	N	89.8	Confident	91.4	Very high	56 Å²	56	57.6 Å²	57.6	30%	0.299	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-16.2	-177	-49	-66.3	0	0	0	113.3	C50 G66 D68 I94 F95	C50-N52 PolarHBondContact O-N 3.39Å; N52-G66 PolarHBondContact N-O 3.33Å; N52-G66 VanDerWaalsContact N-O 3.15Å; N52-D68 PolarHBondContact ND2-OD1 2.91Å; N52-I94 WeakPolarHBondContact CB-O 3.44Å; N52-I94 PolarHBondContact ND2-O 3.17Å; N52-I94 VanDerWaalsContact ND2-O 3.1Å; N52-F95 HydrophobicContact CB-CD1 4.37Å
53	T	93.4	Very high	91.8	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	135.7	-176.1	179.9	0	0	0	0	111.4	V51 S65 G66 I94 A97	V51-T53 WeakPolarHBondContact CG1-O 3.45Å; T53-S65 WeakPolarHBondContact O-CA 3.27Å; T53-G66 PolarHBondContact N-O 3.32Å; T53-G66 PolarHBondContact O-N 3.32Å; T53-I94 HydrophobicContact CG2-CG2 4.19Å; T53-A97 HydrophobicContact CG2-CB 3.81Å; T53-A97 PolarHBondContact OG1-N 2.97Å; T53-A97 PolarHBondContact OG1-O 2.93Å
54	I	95.3	Very high	92.1	Very high	39 Å²	39	52.7 Å²	52.7	20%	0.2	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.5	161.9	58.5	173.3	0	0	0	110.3	V51 I63 L64 K98 S565 C568	V51-I54 HydrophobicContact CG1-CG2 3.96Å; I54-I63 HydrophobicContact CB-CG2 4.1Å; I54-I63 HydrophobicContact CG2-CG2 4.24Å; I54-L64 CarbonylContact C-O 3.53Å; I54-L64 VanDerWaalsContact CA-O 3.25Å; I54-L64 WeakPolarHBondContact CA-O 3.42Å; I54-K98 PolarHBondContact O-NZ 3.23Å; I54-S565 PolarHBondContact O-OG 2.65Å; I54-C568 HydrophobicContact CD1-CB 3.97Å; I54-C568 HydrophobicContact CG1-CB 4.38Å
55	S	94.6	Very high	92.3	Very high	10 Å²	10	50.3 Å²	50.3	7%	0.07	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	131.6	169.9	-165.8	0	0	0	0	109.3	I63 L64	S55-I63 CarbonylContact O-C 3.57Å; S55-I63 WeakPolarHBondContact O-CA 3.38Å; S55-L64 PolarHBondContact N-O 2.93Å; S55-L64 PolarHBondContact O-N 3.14Å
56	W	93.1	Very high	92.4	Very high	58 Å²	58	43.1 Å²	43.1	22%	0.22	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	158	160.3	-68.5	93	0	0	0	109.9	G60 Y62 I63 P77 Y78 L561	W56-G60 VanDerWaalsContact CZ3-O 3.26Å; W56-G60 WeakPolarHBondContact CZ3-O 3.32Å; W56-Y62 WeakPolarHBondContact CA-O 3.26Å; W56-I63 HydrophobicContact CD2-CD1 4.46Å; W56-I63 HydrophobicContact CD2-CG1 3.85Å; W56-I63 HydrophobicContact CE3-CD1 4.45Å; W56-I63 HydrophobicContact CE3-CG1 3.69Å; W56-I63 HydrophobicContact CH2-CD1 3.79Å; W56-I63 HydrophobicContact CH2-CG1 3.91Å; W56-I63 HydrophobicContact CZ2-CD1 3.73Å; W56-I63 HydrophobicContact CZ2-CG1 4.01Å; W56-I63 HydrophobicContact CZ3-CD1 4.15Å; W56-I63 HydrophobicContact CZ3-CG1 3.73Å; W56-P77 HydrophobicContact CH2-CG 3.66Å; W56-P77 HydrophobicContact CZ3-CG 3.75Å; W56-Y78 HydrophobicContact CZ3-CE2 4.37Å; W56-L561 HydrophobicContact CB-CD2 4.49Å
57	N	91.3	Very high	92.3	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.011	23%	0.228	C	C	.	.			trans	-89.5	170.2	164.9	82.5	-42	0	0	0	111.4	T59 G60 E61 Y62 F99 D105	N57-T59 PolarHBondContact ND2-OG1 3.41Å; N57-T59 PolarHBondContact O-N 3.4Å; N57-T59 VanDerWaalsContact O-N 3.16Å; N57-T59 PolarHBondContact OD1-OG1 3.19Å; N57-G60 PolarHBondContact O-N 3.39Å; N57-G60 PolarHBondContact OD1-N 3.07Å; N57-G60 VanDerWaalsContact OD1-N 3.1Å; N57-E61 PolarHBondContact OD1-N 3.12Å; N57-Y62 PolarHBondContact N-O 2.88Å; N57-Y62 PolarHBondContact OD1-N 3.1Å; N57-Y62 PolarHBondContact OD1-O 3.33Å; N57-F99 HydrophobicContact CB-CD2 3.76Å; N57-F99 HydrophobicContact CB-CE2 3.54Å; N57-F99 HydrophobicContact CB-CG 4.49Å; N57-F99 HydrophobicContact CB-CZ 4.12Å; N57-D105 VanDerWaalsContact CB-OD1 3.3Å; N57-D105 WeakPolarHBondContact CB-OD1 3.41Å; N57-D105 PolarHBondContact ND2-OD1 3.1Å; N57-D105 PolarHBondContact ND2-OD2 3.13Å
58	D	87.4	Confident	92.3	Very high	96 Å²	96	42 Å²	42	51%	0.513	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.2	-175	-67.3	-19.1	0	0	0	114.1	L561	D58-L561 WeakPolarHBondContact O-CD1 3.5Å
59	T	87.4	Confident	92.3	Very high	99 Å²	99	36 Å²	36	61%	0.607	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-14.7	176.1	69.6	0	0	0	0	113.6	N57 E61	N57-T59 PolarHBondContact ND2-OG1 3.41Å; N57-T59 PolarHBondContact O-N 3.4Å; N57-T59 VanDerWaalsContact O-N 3.16Å; N57-T59 PolarHBondContact OD1-OG1 3.19Å; T59-E61 PolarHBondContact O-N 3.38Å; T59-E61 VanDerWaalsContact OG1-CB 3.27Å; T59-E61 WeakPolarHBondContact OG1-CB 3.37Å; T59-E61 PolarHBondContact OG1-N 2.8Å
60	G	87.8	Confident	92.6	Very high	10 Å²	10	36.1 Å²	36.1	10%	0.103	20%	0.198	C	C	.	.	S	Bend	trans	68.6	14.5	-170.2	0	0	0	0	0	114.3	W56 N57 Y78	W56-G60 VanDerWaalsContact CZ3-O 3.26Å; W56-G60 WeakPolarHBondContact CZ3-O 3.32Å; N57-G60 PolarHBondContact O-N 3.39Å; N57-G60 PolarHBondContact OD1-N 3.07Å; N57-G60 VanDerWaalsContact OD1-N 3.1Å; G60-Y78 WeakPolarHBondContact O-CE2 3.49Å; G60-Y78 PolarHBondContact O-OH 3.11Å
61	E	90.6	Very high	92.9	Very high	83 Å²	83	36.4 Å²	36.4	39%	0.388	19%	0.192	S	C	.	.	S	Bend	trans	-86.4	-30.3	178.8	-169.6	-170.6	160.3	0	0	112.5	N57 T59 N76 P77	N57-E61 PolarHBondContact OD1-N 3.12Å; T59-E61 PolarHBondContact O-N 3.38Å; T59-E61 VanDerWaalsContact OG1-CB 3.27Å; T59-E61 WeakPolarHBondContact OG1-CB 3.37Å; T59-E61 PolarHBondContact OG1-N 2.8Å; E61-N76 WeakPolarHBondContact CG-ND2 3.48Å; E61-P77 WeakPolarHBondContact O-CD 3.48Å
62	Y	93.2	Very high	93.1	Very high	37 Å²	37	33.8 Å²	33.8	15%	0.145	18%	0.176	C	C	.	.			trans	-124.6	143.5	-173.4	-63.1	-75.4	0	0	0	112.3	W56 N57 I74 T75 N76 K83 D105	W56-Y62 WeakPolarHBondContact CA-O 3.26Å; N57-Y62 PolarHBondContact N-O 2.88Å; N57-Y62 PolarHBondContact OD1-N 3.1Å; N57-Y62 PolarHBondContact OD1-O 3.33Å; Y62-I74 HydrophobicContact CD1-CG2 4.05Å; Y62-I74 HydrophobicContact CG-CG2 4.16Å; Y62-T75 WeakPolarHBondContact CA-O 3.42Å; Y62-N76 HydrophobicContact CD1-CB 3.95Å; Y62-N76 HydrophobicContact CE1-CB 3.74Å; Y62-K83 HydrophobicContact CD1-CB 4.22Å; Y62-K83 HydrophobicContact CD1-CD 3.59Å; Y62-K83 HydrophobicContact CD2-CD 4.28Å; Y62-K83 HydrophobicContact CE1-CB 3.96Å; Y62-K83 HydrophobicContact CE1-CD 3.21Å; Y62-K83 HydrophobicContact CE1-CG 4.18Å; Y62-K83 HydrophobicContact CE2-CD 4.01Å; Y62-K83 HydrophobicContact CG-CD 4.12Å; Y62-K83 VanDerWaalsContact CZ-CD 3.49Å; Y62-D105 VanDerWaalsContact CD2-OD2 3.31Å; Y62-D105 WeakPolarHBondContact CD2-OD2 3.25Å
63	I	95.6	Very high	93.5	Very high	28 Å²	28	31.2 Å²	31.2	14%	0.144	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.9	166.2	-58.1	175.9	0	0	0	108.1	I54 S55 W56 I74 T75 P77	I54-I63 HydrophobicContact CB-CG2 4.1Å; I54-I63 HydrophobicContact CG2-CG2 4.24Å; S55-I63 CarbonylContact O-C 3.57Å; S55-I63 WeakPolarHBondContact O-CA 3.38Å; W56-I63 HydrophobicContact CD2-CD1 4.46Å; W56-I63 HydrophobicContact CD2-CG1 3.85Å; W56-I63 HydrophobicContact CE3-CD1 4.45Å; W56-I63 HydrophobicContact CE3-CG1 3.69Å; W56-I63 HydrophobicContact CH2-CD1 3.79Å; W56-I63 HydrophobicContact CH2-CG1 3.91Å; W56-I63 HydrophobicContact CZ2-CD1 3.73Å; W56-I63 HydrophobicContact CZ2-CG1 4.01Å; W56-I63 HydrophobicContact CZ3-CD1 4.15Å; W56-I63 HydrophobicContact CZ3-CG1 3.73Å; I63-I74 CarbonylContact O-C 3.59Å; I63-I74 WeakPolarHBondContact O-CA 3.39Å; I63-T75 PolarHBondContact N-O 3.32Å; I63-T75 PolarHBondContact O-N 3.43Å; I63-P77 HydrophobicContact CD1-CB 3.97Å; I63-P77 HydrophobicContact CD1-CG 3.9Å; I63-P77 HydrophobicContact CG1-CG 4.14Å
64	L	97	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.5	161.4	169.6	62	0	0	0	108.9	I54 S55 L72 V73 I74 A97 F99 I108	I54-L64 CarbonylContact C-O 3.53Å; I54-L64 VanDerWaalsContact CA-O 3.25Å; I54-L64 WeakPolarHBondContact CA-O 3.42Å; S55-L64 PolarHBondContact N-O 2.93Å; S55-L64 PolarHBondContact O-N 3.14Å; L64-L72 HydrophobicContact CD1-CB 4.14Å; L64-L72 HydrophobicContact CD1-CD2 4.31Å; L64-V73 CarbonylContact C-O 3.59Å; L64-V73 WeakPolarHBondContact CA-O 3.36Å; L64-I74 HydrophobicContact CD1-CG1 4.29Å; L64-A97 HydrophobicContact CD2-CB 3.93Å; L64-A97 HydrophobicContact CG-CB 4.23Å; L64-F99 HydrophobicContact CB-CD2 4.22Å; L64-F99 HydrophobicContact CB-CE1 4.34Å; L64-F99 HydrophobicContact CB-CE2 3.48Å; L64-F99 VanDerWaalsContact CB-CE2 3.48Å; L64-F99 HydrophobicContact CB-CZ 3.57Å; L64-F99 HydrophobicContact CD2-CD2 4.42Å; L64-F99 HydrophobicContact CD2-CE2 4.4Å; L64-F99 HydrophobicContact CD2-CZ 4.46Å; L64-I108 HydrophobicContact CD1-CD1 3.92Å; L64-I108 HydrophobicContact CD2-CD1 4.07Å; L64-I108 HydrophobicContact CD2-CG1 4.07Å; L64-I108 HydrophobicContact CD2-CG2 3.69Å
65	S	96.5	Very high	93.7	Very high	9 Å²	9	29.4 Å²	29.4	6%	0.063	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150.7	170.2	52.9	0	0	0	0	111.4	H47 T53 L72 V73	H47-S65 PolarHBondContact CD2-OG 3.45Å; H47-S65 VanDerWaalsContact CD2-OG 3.3Å; H47-S65 WeakPolarHBondContact NE2-CB 3.42Å; H47-S65 PolarHBondContact NE2-OG 3.4Å; T53-S65 WeakPolarHBondContact O-CA 3.27Å; S65-L72 WeakPolarHBondContact O-CA 3.35Å; S65-V73 PolarHBondContact N-O 3.22Å; S65-V73 PolarHBondContact O-N 3.32Å; S65-V73 PolarHBondContact OG-O 2.84Å
66	G	95.6	Very high	93.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.8	175.1	0	0	0	0	0	111	N52 T53	N52-G66 PolarHBondContact N-O 3.33Å; N52-G66 VanDerWaalsContact N-O 3.15Å; T53-G66 PolarHBondContact N-O 3.32Å; T53-G66 PolarHBondContact O-N 3.32Å
67	S	93.6	Very high	93.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	164.8	-159.9	172.6	0	0	0	0	113.8	H47 G49 C50 D69 T70 F71 I94	H47-S67 VanDerWaalsContact CE1-CB 3.43Å; H47-S67 WeakPolarHBondContact CE1-CB 3.48Å; H47-S67 WeakPolarHBondContact ND1-CB 3.29Å; G49-S67 WeakPolarHBondContact CA-OG 3.43Å; G49-S67 PolarHBondContact O-OG 3.05Å; C50-S67 CarbonylContact O-C 3.56Å; C50-S67 VanDerWaalsContact O-CA 3.22Å; C50-S67 WeakPolarHBondContact O-CA 3.46Å; C50-S67 PolarHBondContact O-OG 3.02Å; S67-D69 WeakPolarHBondContact CB-OD1 3.28Å; S67-D69 VanDerWaalsContact CB-OD2 3.3Å; S67-D69 WeakPolarHBondContact CB-OD2 3.41Å; S67-D69 PolarHBondContact O-N 3.31Å; S67-D69 PolarHBondContact OG-N 3.12Å; S67-D69 PolarHBondContact OG-OD1 3.4Å; S67-D69 PolarHBondContact OG-OD2 3.37Å; S67-T70 PolarHBondContact O-N 2.83Å; S67-F71 PolarHBondContact N-O 2.86Å; S67-I94 PolarHBondContact O-N 3.42Å
68	D	92.3	Very high	93.4	Very high	50 Å²	50	35.3 Å²	35.3	27%	0.267	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-23.2	168.5	-65.3	-5.4	0	0	0	113.3	C50 N52 T70 N93	C50-D68 WeakPolarHBondContact CB-OD2 3.43Å; C50-D68 PolarHBondContact O-N 3.41Å; C50-D68 PolarHBondContact SG-OD2 2.81Å; N52-D68 PolarHBondContact ND2-OD1 2.91Å; D68-T70 PolarHBondContact O-N 3.39Å; D68-N93 WeakPolarHBondContact OD1-CB 3.49Å; D68-N93 PolarHBondContact OD1-ND2 3.31Å; D68-N93 PolarHBondContact OD2-ND2 2.89Å
69	D	93.3	Very high	93.6	Very high	32 Å²	32	34.8 Å²	34.8	17%	0.171	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-0.7	176.2	57.6	44.9	0	0	0	114.3	H47 D48 G49 S67 F71	H47-D69 WeakPolarHBondContact CA-OD2 3.18Å; H47-D69 VanDerWaalsContact CB-OD2 3.26Å; H47-D69 WeakPolarHBondContact CB-OD2 3.28Å; H47-D69 IonicContact CE1-OD1 2.94Å; H47-D69 IonicContact CG-OD2 2.84Å; H47-D69 IonicContact ND1-OD1 3.57Å; H47-D69 PolarHBondContact ND1-OD1 2.98Å; H47-D69 IonicContact ND1-OD2 3.15Å; H47-D69 PolarHBondContact ND1-OD2 2.77Å; D48-D69 PolarHBondContact N-OD2 3.27Å; G49-D69 PolarHBondContact N-OD2 2.93Å; S67-D69 WeakPolarHBondContact CB-OD1 3.28Å; S67-D69 VanDerWaalsContact CB-OD2 3.3Å; S67-D69 WeakPolarHBondContact CB-OD2 3.41Å; S67-D69 PolarHBondContact O-N 3.31Å; S67-D69 PolarHBondContact OG-N 3.12Å; S67-D69 PolarHBondContact OG-OD1 3.4Å; S67-D69 PolarHBondContact OG-OD2 3.37Å; D69-F71 VanDerWaalsContact C-N 3.26Å; D69-F71 HydrophobicContact CB-CD2 4.25Å; D69-F71 VanDerWaalsContact O-CD2 3.23Å; D69-F71 WeakPolarHBondContact O-CD2 3.49Å; D69-F71 PolarHBondContact O-N 3.37Å; D69-F71 WeakPolarHBondContact OD1-CB 3.24Å; D69-F71 PolarHBondContact OD1-N 3.31Å
70	T	94.7	Very high	93.8	Very high	25 Å²	25	35.6 Å²	35.6	15%	0.153	17%	0.171	C	C	.	.	S	Bend	trans	69.1	8.8	-177.2	75.1	0	0	0	0	115.7	S67 D68 S88 H90	S67-T70 PolarHBondContact O-N 2.83Å; D68-T70 PolarHBondContact O-N 3.39Å; T70-S88 WeakPolarHBondContact O-CB 3.49Å; T70-S88 PolarHBondContact O-N 3.33Å; T70-S88 VanDerWaalsContact O-N 3.12Å; T70-S88 PolarHBondContact O-OG 3.08Å; T70-H90 WeakPolarHBondContact CG2-O 3.39Å
71	F	96.4	Very high	94.1	Very high	73 Å²	73	42.1 Å²	42.1	32%	0.32	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	149.8	172.6	-66.7	-97.9	0	0	0	112.7	H47 S67 D69 V73 S85 I86 R87	H47-F71 PolarHBondContact CE1-O 3.15Å; S67-F71 PolarHBondContact N-O 2.86Å; D69-F71 VanDerWaalsContact C-N 3.26Å; D69-F71 HydrophobicContact CB-CD2 4.25Å; D69-F71 VanDerWaalsContact O-CD2 3.23Å; D69-F71 WeakPolarHBondContact O-CD2 3.49Å; D69-F71 PolarHBondContact O-N 3.37Å; D69-F71 WeakPolarHBondContact OD1-CB 3.24Å; D69-F71 PolarHBondContact OD1-N 3.31Å; F71-V73 HydrophobicContact CB-CG2 4.28Å; F71-S85 WeakPolarHBondContact CD1-OG 3.22Å; F71-I86 WeakPolarHBondContact CA-O 3.11Å; F71-R87 HydrophobicContact CD1-CB 4.05Å; F71-R87 HydrophobicContact CE1-CB 3.71Å; F71-R87 HydrophobicContact CE1-CG 4.18Å; F71-R87 HydrophobicContact CZ-CB 4.31Å; F71-R87 HydrophobicContact CZ-CG 4.29Å
72	L	97	Very high	94.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.5	163.2	-66.3	167.6	0	0	0	107.3	L64 S65 I86 I94 A97 I108	L64-L72 HydrophobicContact CD1-CB 4.14Å; L64-L72 HydrophobicContact CD1-CD2 4.31Å; S65-L72 WeakPolarHBondContact O-CA 3.35Å; L72-I86 HydrophobicContact CB-CB 4.45Å; L72-I86 PolarHBondContact N-O 2.88Å; L72-I86 PolarHBondContact O-N 3.18Å; L72-I94 HydrophobicContact CD2-CD1 3.81Å; L72-I94 HydrophobicContact CD2-CG2 4.2Å; L72-I94 HydrophobicContact CG-CD1 3.95Å; L72-A97 HydrophobicContact CD2-CB 3.66Å; L72-I108 HydrophobicContact CD1-CG2 4.09Å
73	V	97.1	Very high	94.5	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.8	-176.9	-176	0	0	0	0	110	V46 H47 L64 S65 F71 V82	V46-V73 HydrophobicContact CB-CG1 4.22Å; V46-V73 HydrophobicContact CG2-CG1 4.32Å; H47-V73 VanDerWaalsContact CE1-CG2 3.44Å; H47-V73 WeakPolarHBondContact CE1-CG2 3.44Å; L64-V73 CarbonylContact C-O 3.59Å; L64-V73 WeakPolarHBondContact CA-O 3.36Å; S65-V73 PolarHBondContact N-O 3.22Å; S65-V73 PolarHBondContact O-N 3.32Å; S65-V73 PolarHBondContact OG-O 2.84Å; F71-V73 HydrophobicContact CB-CG2 4.28Å; V73-V82 HydrophobicContact CG1-CG1 3.72Å; V73-V82 HydrophobicContact CG1-CG2 4.05Å
74	I	96.8	Very high	94.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.1	174.6	-52.5	173.9	0	0	0	107.3	Y62 I63 L64 K83 K84 I86 F99 I108 T122	Y62-I74 HydrophobicContact CD1-CG2 4.05Å; Y62-I74 HydrophobicContact CG-CG2 4.16Å; I63-I74 CarbonylContact O-C 3.59Å; I63-I74 WeakPolarHBondContact O-CA 3.39Å; L64-I74 HydrophobicContact CD1-CG1 4.29Å; I74-K83 HydrophobicContact CB-CB 4.39Å; I74-K83 HydrophobicContact CG2-CB 4.14Å; I74-K83 HydrophobicContact CG2-CD 4.05Å; I74-K83 HydrophobicContact CG2-CG 4.32Å; I74-K83 PolarHBondContact O-N 3.04Å; I74-K84 HydrophobicContact CD1-CB 4.34Å; I74-K84 PolarHBondContact N-O 3.13Å; I74-K84 PolarHBondContact O-N 3.15Å; I74-I86 HydrophobicContact CD1-CD1 4.47Å; I74-F99 HydrophobicContact CD1-CE1 4.19Å; I74-F99 HydrophobicContact CG1-CE1 4.47Å; I74-F99 HydrophobicContact CG1-CZ 4.48Å; I74-F99 HydrophobicContact CG2-CZ 4.29Å; I74-I108 HydrophobicContact CD1-CD1 3.94Å; I74-I108 HydrophobicContact CG1-CD1 4.31Å; I74-T122 HydrophobicContact CD1-CG2 3.99Å
75	T	95.9	Very high	94.4	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.7	-175.7	-58.9	0	0	0	0	110.6	L44 V46 Y62 I63	L44-T75 HydrophobicContact CD1-CG2 4.14Å; L44-T75 HydrophobicContact CD2-CG2 4.48Å; V46-T75 HydrophobicContact CG1-CG2 4.46Å; Y62-T75 WeakPolarHBondContact CA-O 3.42Å; I63-T75 PolarHBondContact N-O 3.32Å; I63-T75 PolarHBondContact O-N 3.43Å
76	N	93.8	Very high	94.3	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.059	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.3	165.7	177.3	-54.1	0	0	0	108	E61 Y62 Y78 N79 K80 K81	E61-N76 WeakPolarHBondContact CG-ND2 3.48Å; Y62-N76 HydrophobicContact CD1-CB 3.95Å; Y62-N76 HydrophobicContact CE1-CB 3.74Å; N76-Y78 VanDerWaalsContact C-N 3.34Å; N76-Y78 PolarHBondContact O-N 3.42Å; N76-Y78 PolarHBondContact OD1-N 2.97Å; N76-Y78 VanDerWaalsContact OD1-N 3.08Å; N76-N79 WeakPolarHBondContact CB-OD1 3.36Å; N76-N79 PolarHBondContact O-OD1 3.43Å; N76-N79 VanDerWaalsContact OD1-CG 3.32Å; N76-N79 PolarHBondContact OD1-N 3.46Å; N76-N79 PolarHBondContact OD1-OD1 2.86Å; N76-K80 WeakPolarHBondContact O-CA 3.45Å; N76-K80 PolarHBondContact O-N 3.33Å; N76-K81 PolarHBondContact N-O 2.95Å; N76-K81 PolarHBondContact O-N 2.97Å
77	P	90.4	Very high	94.3	Very high	22 Å²	22	58.2 Å²	58.2	14%	0.143	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-27	-172.7	29.1	-34.1	0	0	0	112.8	L44 W56 E61 I63 K80	L44-P77 HydrophobicContact CD1-CB 4.05Å; W56-P77 HydrophobicContact CH2-CG 3.66Å; W56-P77 HydrophobicContact CZ3-CG 3.75Å; E61-P77 WeakPolarHBondContact O-CD 3.48Å; I63-P77 HydrophobicContact CD1-CB 3.97Å; I63-P77 HydrophobicContact CD1-CG 3.9Å; I63-P77 HydrophobicContact CG1-CG 4.14Å; P77-K80 WeakPolarHBondContact O-CG 3.33Å
78	Y	89.9	Confident	94.3	Very high	161 Å²	161	58.3 Å²	58.3	63%	0.631	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-42.9	-176.5	-51.5	-72.6	0	0	0	112.3	W56 G60 N76	W56-Y78 HydrophobicContact CZ3-CE2 4.37Å; G60-Y78 WeakPolarHBondContact O-CE2 3.49Å; G60-Y78 PolarHBondContact O-OH 3.11Å; N76-Y78 VanDerWaalsContact C-N 3.34Å; N76-Y78 PolarHBondContact O-N 3.42Å; N76-Y78 PolarHBondContact OD1-N 2.97Å; N76-Y78 VanDerWaalsContact OD1-N 3.08Å
79	N	91.7	Very high	94.3	Very high	85 Å²	85	57.4 Å²	57.4	46%	0.455	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-5.1	175.8	72.5	28.7	0	0	0	113.5	N76 K81	N76-N79 WeakPolarHBondContact CB-OD1 3.36Å; N76-N79 PolarHBondContact O-OD1 3.43Å; N76-N79 VanDerWaalsContact OD1-CG 3.32Å; N76-N79 PolarHBondContact OD1-N 3.46Å; N76-N79 PolarHBondContact OD1-OD1 2.86Å; N79-K81 PolarHBondContact O-N 2.9Å; N79-K81 VanDerWaalsContact OD1-CB 3.24Å; N79-K81 WeakPolarHBondContact OD1-CB 3.45Å; N79-K81 WeakPolarHBondContact OD1-CG 3.43Å; N79-K81 PolarHBondContact OD1-N 3.47Å
80	K	91.4	Very high	94.3	Very high	116 Å²	116	56.2 Å²	56.2	50%	0.504	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	23.5	177.8	-47.3	-176.6	-173.1	-170.5	0	114.2	A42 L44 N76 P77	A42-K80 HydrophobicContact CB-CD 4.1Å; A42-K80 VanDerWaalsContact CB-CE 3.43Å; L44-K80 HydrophobicContact CD2-CB 3.83Å; L44-K80 HydrophobicContact CD2-CG 3.98Å; N76-K80 WeakPolarHBondContact O-CA 3.45Å; N76-K80 PolarHBondContact O-N 3.33Å; P77-K80 WeakPolarHBondContact O-CG 3.33Å
81	K	94.1	Very high	94.3	Very high	147 Å²	147	65.9 Å²	65.9	64%	0.639	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.1	179.1	-59.7	-176.2	177.7	-175.9	0	112.1	N76 N79	N76-K81 PolarHBondContact N-O 2.95Å; N76-K81 PolarHBondContact O-N 2.97Å; N79-K81 PolarHBondContact O-N 2.9Å; N79-K81 VanDerWaalsContact OD1-CB 3.24Å; N79-K81 WeakPolarHBondContact OD1-CB 3.45Å; N79-K81 WeakPolarHBondContact OD1-CG 3.43Å; N79-K81 PolarHBondContact OD1-N 3.47Å
82	V	96.2	Very high	94.1	Very high	69 Å²	69	63.7 Å²	63.7	42%	0.418	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.9	165.4	177.2	0	0	0	0	109.2	V46 V73	V46-V82 HydrophobicContact CB-CG2 4.17Å; V46-V82 HydrophobicContact CG1-CG2 3.67Å; V73-V82 HydrophobicContact CG1-CG1 3.72Å; V73-V82 HydrophobicContact CG1-CG2 4.05Å
83	K	94.3	Very high	93.8	Very high	87 Å²	87	66.7 Å²	66.7	38%	0.378	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-45.3	173.3	168.4	170.1	166.9	-174	0	110.9	Y62 I74 D105	Y62-K83 HydrophobicContact CD1-CB 4.22Å; Y62-K83 HydrophobicContact CD1-CD 3.59Å; Y62-K83 HydrophobicContact CD2-CD 4.28Å; Y62-K83 HydrophobicContact CE1-CB 3.96Å; Y62-K83 HydrophobicContact CE1-CD 3.21Å; Y62-K83 HydrophobicContact CE1-CG 4.18Å; Y62-K83 HydrophobicContact CE2-CD 4.01Å; Y62-K83 HydrophobicContact CG-CD 4.12Å; Y62-K83 VanDerWaalsContact CZ-CD 3.49Å; I74-K83 HydrophobicContact CB-CB 4.39Å; I74-K83 HydrophobicContact CG2-CB 4.14Å; I74-K83 HydrophobicContact CG2-CD 4.05Å; I74-K83 HydrophobicContact CG2-CG 4.32Å; I74-K83 PolarHBondContact O-N 3.04Å; K83-D105 IonicContact NZ-OD2 3.32Å; K83-D105 PolarHBondContact NZ-OD2 2.91Å
84	K	94.9	Very high	93.7	Very high	62 Å²	62	66.6 Å²	66.6	27%	0.27	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.8	173.4	-66.4	-176	-178.1	179.7	0	110	I74 I86 T122	I74-K84 HydrophobicContact CD1-CB 4.34Å; I74-K84 PolarHBondContact N-O 3.13Å; I74-K84 PolarHBondContact O-N 3.15Å; K84-I86 HydrophobicContact CB-CD1 4.35Å; K84-I86 HydrophobicContact CB-CG1 4.16Å; K84-T122 VanDerWaalsContact NZ-C 3.35Å; K84-T122 PolarHBondContact NZ-O 3.1Å; K84-T122 PolarHBondContact NZ-OG1 3.01Å
85	S	95.8	Very high	93.5	Very high	72 Å²	72	69.6 Å²	69.6	50%	0.503	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.8	160.7	177.1	0	0	0	0	107.9	F71	F71-S85 WeakPolarHBondContact CD1-OG 3.22Å
86	I	95.9	Very high	93.5	Very high	23 Å²	23	69.5 Å²	69.5	12%	0.118	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	118.5	-168.7	-51.1	175.2	0	0	0	108.5	F71 L72 I74 K84 S88 T120 T122	F71-I86 WeakPolarHBondContact CA-O 3.11Å; L72-I86 HydrophobicContact CB-CB 4.45Å; L72-I86 PolarHBondContact N-O 2.88Å; L72-I86 PolarHBondContact O-N 3.18Å; I74-I86 HydrophobicContact CD1-CD1 4.47Å; K84-I86 HydrophobicContact CB-CD1 4.35Å; K84-I86 HydrophobicContact CB-CG1 4.16Å; I86-S88 PolarHBondContact O-N 3.47Å; I86-T120 HydrophobicContact CD1-CG2 4.46Å; I86-T120 HydrophobicContact CG2-CG2 3.88Å; I86-T122 HydrophobicContact CD1-CG2 3.65Å
87	R	95.2	Very high	93.7	Very high	181 Å²	181	69 Å²	69	68%	0.683	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	110	172.7	-170	174.8	-177.3	178.6	1.3	108.8	F71 G89	F71-R87 HydrophobicContact CD1-CB 4.05Å; F71-R87 HydrophobicContact CE1-CB 3.71Å; F71-R87 HydrophobicContact CE1-CG 4.18Å; F71-R87 HydrophobicContact CZ-CB 4.31Å; F71-R87 HydrophobicContact CZ-CG 4.29Å; R87-G89 VanDerWaalsContact C-N 3.34Å; R87-G89 PolarHBondContact O-N 3.39Å
88	S	92.4	Very high	94	Very high	3 Å²	3	68.3 Å²	68.3	2%	0.021	32%	0.319	C	S	.	.			trans	-64.5	-32.9	-167.6	61.7	0	0	0	0	114.9	T70 I86 H90	T70-S88 WeakPolarHBondContact O-CB 3.49Å; T70-S88 PolarHBondContact O-N 3.33Å; T70-S88 VanDerWaalsContact O-N 3.12Å; T70-S88 PolarHBondContact O-OG 3.08Å; I86-S88 PolarHBondContact O-N 3.47Å; S88-H90 WeakPolarHBondContact OG-CB 3.45Å; S88-H90 PolarHBondContact OG-CD2 2.92Å; S88-H90 VanDerWaalsContact OG-CD2 3.23Å; S88-H90 PolarHBondContact OG-N 3.44Å; S88-H90 VanDerWaalsContact OG-N 3.17Å
89	G	92.4	Very high	94.2	Very high	30 Å²	30	61.3 Å²	61.3	31%	0.309	29%	0.292	S	S	.	.			trans	99.2	-14.4	-169.7	0	0	0	0	0	113.9	R87	R87-G89 VanDerWaalsContact C-N 3.34Å; R87-G89 PolarHBondContact O-N 3.39Å
90	H	94.8	Very high	94.4	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.037	27%	0.271	C	S	.	.			trans	-57.5	149.6	172.5	-67.9	-60.4	0	0	0	111.5	T70 S88 I94 S110 S112 D114 I116 F118	T70-H90 WeakPolarHBondContact CG2-O 3.39Å; S88-H90 WeakPolarHBondContact OG-CB 3.45Å; S88-H90 PolarHBondContact OG-CD2 2.92Å; S88-H90 VanDerWaalsContact OG-CD2 3.23Å; S88-H90 PolarHBondContact OG-N 3.44Å; S88-H90 VanDerWaalsContact OG-N 3.17Å; H90-I94 HydrophobicContact CB-CG1 4.39Å; H90-S110 PolarHBondContact CE1-O 3.1Å; H90-S110 VanDerWaalsContact CE1-O 3.31Å; H90-S110 PolarHBondContact NE2-O 3.41Å; H90-S110 PolarHBondContact NE2-OG 3.48Å; H90-S112 VanDerWaalsContact CG-CB 3.48Å; H90-S112 WeakPolarHBondContact ND1-CB 3.15Å; H90-D114 IonicContact ND1-OD1 3.43Å; H90-I116 PolarHBondContact CE1-O 2.97Å; H90-I116 VanDerWaalsContact CE1-O 3.32Å; H90-F118 AromaticContact CE1-CD2 3.53Å; H90-F118 AromaticContact CG-CD2 3.93Å; H90-F118 AromaticContact ND1-CD2 3.53Å; H90-F118 AromaticContact ND1-CE2 3.99Å; H90-F118 AromaticContact NE2-CD2 3.88Å
91	R	92.8	Very high	94.4	Very high	228 Å²	228	52.6 Å²	52.6	86%	0.86	25%	0.252	S	S	*	.	S	Bend	trans	-105.5	-14.6	177.5	-66	-173.5	176.1	-149.7	0.6	113.2	D114	R91-D114 PolarHBondContact N-OD2 3.44Å
92	A	92.4	Very high	94	Very high	27 Å²	27	51.2 Å²	51.2	22%	0.223	25%	0.248	C	C	.	.	S	Bend	trans	-125.1	-177.6	174.2	0	0	0	0	0	111.5	I94 S112 D114	A92-I94 PolarHBondContact O-N 3.39Å; A92-S112 VanDerWaalsContact C-OG 3.32Å; A92-S112 PolarHBondContact O-OG 2.87Å; A92-D114 HydrophobicContact CB-CB 4.19Å; A92-D114 PolarHBondContact N-OD2 2.78Å; A92-D114 VanDerWaalsContact N-OD2 3.11Å
93	N	90.8	Very high	93.7	Very high	63 Å²	63	48.9 Å²	48.9	34%	0.337	23%	0.234	S	C	.	.			trans	-55.2	127.2	-177.3	-49	49.3	0	0	0	111.3	D68 F95 S112 G113	D68-N93 WeakPolarHBondContact OD1-CB 3.49Å; D68-N93 PolarHBondContact OD1-ND2 3.31Å; D68-N93 PolarHBondContact OD2-ND2 2.89Å; N93-F95 HydrophobicContact CB-CE1 4.26Å; N93-F95 HydrophobicContact CB-CZ 4.21Å; N93-F95 PolarHBondContact O-N 2.97Å; N93-S112 VanDerWaalsContact O-CA 3.29Å; N93-S112 WeakPolarHBondContact O-CA 3.42Å; N93-S112 PolarHBondContact O-OG 2.78Å; N93-G113 PolarHBondContact O-N 3.47Å; N93-G113 VanDerWaalsContact O-N 3.14Å
94	I	95.1	Very high	93.4	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	113	172.8	-53.4	-176.4	0	0	0	108.1	N52 T53 S67 L72 H90 A92 C111	N52-I94 WeakPolarHBondContact CB-O 3.44Å; N52-I94 PolarHBondContact ND2-O 3.17Å; N52-I94 VanDerWaalsContact ND2-O 3.1Å; T53-I94 HydrophobicContact CG2-CG2 4.19Å; S67-I94 PolarHBondContact O-N 3.42Å; L72-I94 HydrophobicContact CD2-CD1 3.81Å; L72-I94 HydrophobicContact CD2-CG2 4.2Å; L72-I94 HydrophobicContact CG-CD1 3.95Å; H90-I94 HydrophobicContact CB-CG1 4.39Å; A92-I94 PolarHBondContact O-N 3.39Å; I94-C111 CarbonylContact C-O 3.59Å; I94-C111 WeakPolarHBondContact CA-O 3.35Å
95	F	93.3	Very high	93.2	Very high	64 Å²	64	49 Å²	49	28%	0.281	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-32.9	-179.2	-74.4	-53.9	0	0	0	113.3	N52 N93 C111 T140 R569	N52-F95 HydrophobicContact CB-CD1 4.37Å; N93-F95 HydrophobicContact CB-CE1 4.26Å; N93-F95 HydrophobicContact CB-CZ 4.21Å; N93-F95 PolarHBondContact O-N 2.97Å; F95-C111 PolarHBondContact N-O 2.98Å; F95-T140 HydrophobicContact CD2-CG2 3.54Å; F95-T140 HydrophobicContact CE2-CG2 3.49Å; F95-T140 VanDerWaalsContact CE2-CG2 3.49Å; F95-R569 PolarHBondContact O-NH2 3.43Å
96	S	96.1	Very high	93.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	142.2	178.5	-154.6	0	0	0	0	112.4	S110 C111 I144 R569	S96-S110 CarbonylContact O-C 3.58Å; S96-S110 VanDerWaalsContact O-CA 3.26Å; S96-S110 WeakPolarHBondContact O-CA 3.46Å; S96-C111 VanDerWaalsContact CB-SG 3.54Å; S96-C111 PolarHBondContact N-O 3.1Å; S96-C111 PolarHBondContact O-N 3.18Å; S96-I144 PolarHBondContact OG-N 3.31Å; S96-R569 PolarHBondContact OG-NH1 3.29Å; S96-R569 PolarHBondContact OG-NH2 3.07Å
97	A	97.2	Very high	93	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.4	173.6	0	0	0	0	0	110.6	T53 L64 L72 I109	T53-A97 HydrophobicContact CG2-CB 3.81Å; T53-A97 PolarHBondContact OG1-N 2.97Å; T53-A97 PolarHBondContact OG1-O 2.93Å; L64-A97 HydrophobicContact CD2-CB 3.93Å; L64-A97 HydrophobicContact CG-CB 4.23Å; L72-A97 HydrophobicContact CD2-CB 3.66Å; A97-I109 WeakPolarHBondContact CA-O 3.37Å
98	K	96.4	Very high	93.1	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.03	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	145.1	-179.1	-65.9	-72.4	159.5	-94.5	0	110.2	I54 I108 I109 I144 T146	I54-K98 PolarHBondContact O-NZ 3.23Å; K98-I108 WeakPolarHBondContact O-CA 3.36Å; K98-I109 PolarHBondContact N-O 2.98Å; K98-I109 PolarHBondContact O-N 3.34Å; K98-I144 HydrophobicContact CG-CG2 4.49Å; K98-T146 HydrophobicContact CB-CG2 4.23Å
99	F	95.6	Very high	93.3	Very high	14 Å²	14	40.1 Å²	40.1	6%	0.061	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	145.9	164.8	-65	-75.8	0	0	0	110.2	N57 L64 I74 D105 E107 I108 T146	N57-F99 HydrophobicContact CB-CD2 3.76Å; N57-F99 HydrophobicContact CB-CE2 3.54Å; N57-F99 HydrophobicContact CB-CG 4.49Å; N57-F99 HydrophobicContact CB-CZ 4.12Å; L64-F99 HydrophobicContact CB-CD2 4.22Å; L64-F99 HydrophobicContact CB-CE1 4.34Å; L64-F99 HydrophobicContact CB-CE2 3.48Å; L64-F99 VanDerWaalsContact CB-CE2 3.48Å; L64-F99 HydrophobicContact CB-CZ 3.57Å; L64-F99 HydrophobicContact CD2-CD2 4.42Å; L64-F99 HydrophobicContact CD2-CE2 4.4Å; L64-F99 HydrophobicContact CD2-CZ 4.46Å; I74-F99 HydrophobicContact CD1-CE1 4.19Å; I74-F99 HydrophobicContact CG1-CE1 4.47Å; I74-F99 HydrophobicContact CG1-CZ 4.48Å; I74-F99 HydrophobicContact CG2-CZ 4.29Å; F99-D105 HydrophobicContact CD1-CB 4.07Å; F99-D105 HydrophobicContact CE1-CB 3.78Å; F99-D105 HydrophobicContact CZ-CB 4.45Å; F99-E107 WeakPolarHBondContact CA-O 3.49Å; F99-I108 HydrophobicContact CD1-CD1 4.23Å; F99-I108 HydrophobicContact CD1-CG1 3.74Å; F99-I108 HydrophobicContact CE1-CD1 4.02Å; F99-I108 HydrophobicContact CE1-CG1 4.06Å; F99-T146 WeakPolarHBondContact O-CG2 3.46Å
100	M	94.8	Very high	93.6	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-77.8	135.9	168.6	-70.5	-57.3	-60.8	0	0	110.7	T103 E107 I109 T146 P151 F154 L168	M100-T103 HydrophobicContact CB-CG2 3.66Å; M100-T103 PolarHBondContact O-N 3.35Å; M100-T103 PolarHBondContact O-OG1 3.12Å; M100-E107 HydrophobicContact CB-CB 4.03Å; M100-E107 HydrophobicContact CG-CB 4.19Å; M100-E107 PolarHBondContact N-O 3.13Å; M100-I109 HydrophobicContact CG-CD1 4.18Å; M100-I109 HydrophobicContact CG-CG1 3.88Å; M100-I109 HydrophobicContact SD-CD1 4.02Å; M100-I109 HydrophobicContact SD-CG1 3.37Å; M100-I109 WeakPolarHBondContact SD-CG1 3.27Å; M100-T146 HydrophobicContact CE-CG2 4.33Å; M100-T146 HydrophobicContact SD-CG2 3.61Å; M100-P151 WeakPolarHBondContact CE-O 3.49Å; M100-F154 HydrophobicContact SD-CB 4.39Å; M100-F154 HydrophobicContact SD-CD1 4.44Å; M100-L168 HydrophobicContact CE-CD1 3.92Å; M100-L168 HydrophobicContact CG-CD1 4.12Å; M100-L168 HydrophobicContact SD-CD1 4.24Å
101	P	90.9	Very high	93.7	Very high	16 Å²	16	38.3 Å²	38.3	10%	0.104	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	146.6	-176	-19.7	32.6	0	0	0	112	T103 P151	P101-T103 PolarHBondContact O-N 2.87Å; P101-T103 VanDerWaalsContact O-N 3.16Å; P101-P151 WeakPolarHBondContact O-CB 3.26Å
102	H	87.7	Confident	93.7	Very high	118 Å²	118	27.4 Å²	27.4	55%	0.546	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	14.5	177.1	-49.6	-74.2	0	0	0	115.9	P151	H102-P151 HydrophobicContact CB-CB 4.32Å
103	T	88.4	Confident	93.6	Very high	20 Å²	20	27.3 Å²	27.3	12%	0.123	14%	0.143	C	C	.	.	S	Bend	trans	-97.6	11.8	179.3	68.4	0	0	0	0	114.8	M100 P101 D105 Q106 E107	M100-T103 HydrophobicContact CB-CG2 3.66Å; M100-T103 PolarHBondContact O-N 3.35Å; M100-T103 PolarHBondContact O-OG1 3.12Å; P101-T103 PolarHBondContact O-N 2.87Å; P101-T103 VanDerWaalsContact O-N 3.16Å; T103-D105 VanDerWaalsContact C-N 3.27Å; T103-D105 PolarHBondContact O-N 2.78Å; T103-Q106 WeakPolarHBondContact O-CB 3.47Å; T103-Q106 WeakPolarHBondContact O-CG 3.48Å; T103-Q106 PolarHBondContact O-N 3.33Å; T103-E107 HydrophobicContact CG2-CB 3.96Å; T103-E107 HydrophobicContact CG2-CG 4.07Å; T103-E107 PolarHBondContact OG1-N 3.13Å
104	N	89.1	Confident	93.6	Very high	132 Å²	132	26.8 Å²	26.8	71%	0.706	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	39.7	-178.6	-60.5	-34.2	0	0	0	114.3	Q106	N104-Q106 PolarHBondContact O-N 3.03Å
105	D	90.4	Very high	93.5	Very high	21 Å²	21	26.9 Å²	26.9	11%	0.112	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	9.9	-173	-41.1	-22.4	0	0	0	115	N57 Y62 K83 F99 T103	N57-D105 VanDerWaalsContact CB-OD1 3.3Å; N57-D105 WeakPolarHBondContact CB-OD1 3.41Å; N57-D105 PolarHBondContact ND2-OD1 3.1Å; N57-D105 PolarHBondContact ND2-OD2 3.13Å; Y62-D105 VanDerWaalsContact CD2-OD2 3.31Å; Y62-D105 WeakPolarHBondContact CD2-OD2 3.25Å; K83-D105 IonicContact NZ-OD2 3.32Å; K83-D105 PolarHBondContact NZ-OD2 2.91Å; F99-D105 HydrophobicContact CD1-CB 4.07Å; F99-D105 HydrophobicContact CE1-CB 3.78Å; F99-D105 HydrophobicContact CZ-CB 4.45Å; T103-D105 VanDerWaalsContact C-N 3.27Å; T103-D105 PolarHBondContact O-N 2.78Å
106	Q	92.6	Very high	93.6	Very high	62 Å²	62	25.2 Å²	25.2	29%	0.29	14%	0.135	S	C	.	.			trans	-80	-22.3	-176	-62.4	179.7	-44	0	0	113	T103 N104 H121 T122 E123	T103-Q106 WeakPolarHBondContact O-CB 3.47Å; T103-Q106 WeakPolarHBondContact O-CG 3.48Å; T103-Q106 PolarHBondContact O-N 3.33Å; N104-Q106 PolarHBondContact O-N 3.03Å; Q106-H121 CarbonylContact O-C 3.47Å; Q106-H121 WeakPolarHBondContact O-CA 3.49Å; Q106-T122 WeakPolarHBondContact O-CG2 3.4Å; Q106-T122 PolarHBondContact O-N 2.83Å; Q106-E123 PolarHBondContact NE2-OE1 2.85Å; Q106-E123 PolarHBondContact NE2-OE2 3.35Å
107	E	94.8	Very high	93.7	Very high	29 Å²	29	25.3 Å²	25.3	14%	0.136	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136	-177.5	-59.8	-165.6	155.8	0	0	113.1	F99 M100 T103 Y119 H121	F99-E107 WeakPolarHBondContact CA-O 3.49Å; M100-E107 HydrophobicContact CB-CB 4.03Å; M100-E107 HydrophobicContact CG-CB 4.19Å; M100-E107 PolarHBondContact N-O 3.13Å; T103-E107 HydrophobicContact CG2-CB 3.96Å; T103-E107 HydrophobicContact CG2-CG 4.07Å; T103-E107 PolarHBondContact OG1-N 3.13Å; E107-Y119 HydrophobicContact CB-CE2 4.1Å; E107-Y119 VanDerWaalsContact CD-OH 3.26Å; E107-Y119 HydrophobicContact CG-CE2 4.07Å; E107-Y119 PolarHBondContact OE1-OH 3.46Å; E107-Y119 WeakPolarHBondContact OE2-CE2 3.48Å; E107-H121 IonicContact OE1-CD2 3.02Å; E107-H121 PolarHBondContact OE1-CD2 3.42Å
108	I	96.6	Very high	93.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.9	-175.4	-66.1	169.7	0	0	0	109.5	L64 L72 I74 K98 F99 T120 T122	L64-I108 HydrophobicContact CD1-CD1 3.92Å; L64-I108 HydrophobicContact CD2-CD1 4.07Å; L64-I108 HydrophobicContact CD2-CG1 4.07Å; L64-I108 HydrophobicContact CD2-CG2 3.69Å; L72-I108 HydrophobicContact CD1-CG2 4.09Å; I74-I108 HydrophobicContact CD1-CD1 3.94Å; I74-I108 HydrophobicContact CG1-CD1 4.31Å; K98-I108 WeakPolarHBondContact O-CA 3.36Å; F99-I108 HydrophobicContact CD1-CD1 4.23Å; F99-I108 HydrophobicContact CD1-CG1 3.74Å; F99-I108 HydrophobicContact CE1-CD1 4.02Å; F99-I108 HydrophobicContact CE1-CG1 4.06Å; I108-T120 PolarHBondContact N-O 3.18Å; I108-T120 PolarHBondContact O-N 3.19Å; I108-T122 HydrophobicContact CD1-CG2 3.75Å; I108-T122 HydrophobicContact CG1-CG2 4.34Å
109	I	97.7	Very high	93.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137.2	166.5	-48.5	-63.9	0	0	0	108.6	A97 K98 M100 I117 Y119 I144 F154 L168	A97-I109 WeakPolarHBondContact CA-O 3.37Å; K98-I109 PolarHBondContact N-O 2.98Å; K98-I109 PolarHBondContact O-N 3.34Å; M100-I109 HydrophobicContact CG-CD1 4.18Å; M100-I109 HydrophobicContact CG-CG1 3.88Å; M100-I109 HydrophobicContact SD-CD1 4.02Å; M100-I109 HydrophobicContact SD-CG1 3.37Å; M100-I109 WeakPolarHBondContact SD-CG1 3.27Å; I109-I117 HydrophobicContact CG2-CG2 3.41Å; I109-I117 VanDerWaalsContact CG2-CG2 3.41Å; I109-Y119 HydrophobicContact CD1-CD2 3.67Å; I109-Y119 HydrophobicContact CD1-CG 4.14Å; I109-I144 HydrophobicContact CB-CD1 4.39Å; I109-I144 HydrophobicContact CB-CG2 4.19Å; I109-I144 HydrophobicContact CG2-CD1 3.74Å; I109-I144 HydrophobicContact CG2-CG1 4.28Å; I109-I144 HydrophobicContact CG2-CG2 4.01Å; I109-F154 HydrophobicContact CD1-CD1 3.94Å; I109-F154 HydrophobicContact CD1-CE1 3.77Å; I109-F154 HydrophobicContact CD1-CZ 4.38Å; I109-F154 HydrophobicContact CG1-CD1 3.9Å; I109-F154 HydrophobicContact CG1-CE1 4.17Å; I109-F154 HydrophobicContact CG1-CG 4.19Å; I109-F154 HydrophobicContact CG2-CD1 4.4Å; I109-F154 HydrophobicContact CG2-CD2 3.96Å; I109-F154 HydrophobicContact CG2-CE1 4.25Å; I109-F154 HydrophobicContact CG2-CE2 3.8Å; I109-F154 HydrophobicContact CG2-CG 4.26Å; I109-F154 HydrophobicContact CG2-CZ 3.95Å; I109-L168 HydrophobicContact CD1-CD1 4.29Å; I109-L168 HydrophobicContact CD1-CD2 4.37Å
110	S	97.7	Very high	93.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.8	178.5	63.4	0	0	0	0	112.7	H90 S96 I117 F118 I144	H90-S110 PolarHBondContact CE1-O 3.1Å; H90-S110 VanDerWaalsContact CE1-O 3.31Å; H90-S110 PolarHBondContact NE2-O 3.41Å; H90-S110 PolarHBondContact NE2-OG 3.48Å; S96-S110 CarbonylContact O-C 3.58Å; S96-S110 VanDerWaalsContact O-CA 3.26Å; S96-S110 WeakPolarHBondContact O-CA 3.46Å; S110-I117 CarbonylContact O-C 3.57Å; S110-I117 VanDerWaalsContact O-CA 3.28Å; S110-I117 WeakPolarHBondContact O-CA 3.49Å; S110-I117 WeakPolarHBondContact O-CG2 3.39Å; S110-F118 PolarHBondContact N-O 3.2Å; S110-F118 PolarHBondContact O-N 3.05Å; S110-I144 VanDerWaalsContact CA-CD1 3.47Å
111	C	96.8	Very high	93.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156	-179.1	72.5	0	0	0	0	112.6	I94 F95 S96 I116 I117 A141 I144	I94-C111 CarbonylContact C-O 3.59Å; I94-C111 WeakPolarHBondContact CA-O 3.35Å; F95-C111 PolarHBondContact N-O 2.98Å; S96-C111 VanDerWaalsContact CB-SG 3.54Å; S96-C111 PolarHBondContact N-O 3.1Å; S96-C111 PolarHBondContact O-N 3.18Å; C111-I116 WeakPolarHBondContact CA-O 3.21Å; C111-I117 HydrophobicContact CB-CG1 3.96Å; C111-A141 HydrophobicContact CB-CB 3.73Å; C111-A141 PolarHBondContact SG-O 3.17Å; C111-I144 HydrophobicContact CB-CD1 3.48Å; C111-I144 VanDerWaalsContact CB-CD1 3.48Å; C111-I144 HydrophobicContact CB-CG1 3.91Å
112	S	94.2	Very high	93.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	165.6	-167	166.7	0	0	0	0	113.8	H90 A92 N93 D114 G115 I116 A141	H90-S112 VanDerWaalsContact CG-CB 3.48Å; H90-S112 WeakPolarHBondContact ND1-CB 3.15Å; A92-S112 VanDerWaalsContact C-OG 3.32Å; A92-S112 PolarHBondContact O-OG 2.87Å; N93-S112 VanDerWaalsContact O-CA 3.29Å; N93-S112 WeakPolarHBondContact O-CA 3.42Å; N93-S112 PolarHBondContact O-OG 2.78Å; S112-D114 VanDerWaalsContact CB-OD1 3.23Å; S112-D114 WeakPolarHBondContact CB-OD1 3.4Å; S112-D114 PolarHBondContact O-N 2.54Å; S112-D114 PolarHBondContact OG-N 2.94Å; S112-D114 PolarHBondContact OG-OD1 3.13Å; S112-D114 VanDerWaalsContact OG-OD1 3.13Å; S112-D114 PolarHBondContact OG-OD2 3.22Å; S112-G115 PolarHBondContact O-N 3.06Å; S112-I116 PolarHBondContact N-O 3.01Å; S112-A141 PolarHBondContact O-N 3.47Å; S112-A141 VanDerWaalsContact O-N 3.17Å
113	G	90.3	Very high	94.1	Very high	25 Å²	25	26.4 Å²	26.4	26%	0.258	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.3	169.5	0	0	0	0	0	115.8	N93 G115	N93-G113 PolarHBondContact O-N 3.47Å; N93-G113 VanDerWaalsContact O-N 3.14Å; G113-G115 VanDerWaalsContact C-N 3.29Å
114	D	90.3	Very high	94.3	Very high	51 Å²	51	29.5 Å²	29.5	27%	0.273	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.6	172	53.4	38.6	0	0	0	113.4	H90 R91 A92 S112 I116	H90-D114 IonicContact ND1-OD1 3.43Å; R91-D114 PolarHBondContact N-OD2 3.44Å; A92-D114 HydrophobicContact CB-CB 4.19Å; A92-D114 PolarHBondContact N-OD2 2.78Å; A92-D114 VanDerWaalsContact N-OD2 3.11Å; S112-D114 VanDerWaalsContact CB-OD1 3.23Å; S112-D114 WeakPolarHBondContact CB-OD1 3.4Å; S112-D114 PolarHBondContact O-N 2.54Å; S112-D114 PolarHBondContact OG-N 2.94Å; S112-D114 PolarHBondContact OG-OD1 3.13Å; S112-D114 VanDerWaalsContact OG-OD1 3.13Å; S112-D114 PolarHBondContact OG-OD2 3.22Å; D114-I116 VanDerWaalsContact C-N 3.26Å; D114-I116 HydrophobicContact CB-CG1 4.48Å; D114-I116 PolarHBondContact O-N 3.03Å; D114-I116 VanDerWaalsContact OD1-CB 3.26Å; D114-I116 WeakPolarHBondContact OD1-CB 3.41Å; D114-I116 WeakPolarHBondContact OD1-CG1 3.48Å; D114-I116 PolarHBondContact OD1-N 3.17Å
115	G	92.1	Very high	94.4	Very high	2 Å²	2	26 Å²	26	2%	0.021	14%	0.138	C	C	.	.	S	Bend	trans	82.4	-3.2	-179.2	0	0	0	0	0	114.6	S112 G113 G139	S112-G115 PolarHBondContact O-N 3.06Å; G113-G115 VanDerWaalsContact C-N 3.29Å; G115-G139 WeakPolarHBondContact CA-O 3.49Å
116	I	96.5	Very high	94.4	Very high	30 Å²	30	28.4 Å²	28.4	15%	0.154	15%	0.154	C	C	.	.			trans	-82.3	145.7	-179.2	-52.5	179.5	0	0	0	109.7	H90 C111 S112 D114 F118 Q133 T135	H90-I116 PolarHBondContact CE1-O 2.97Å; H90-I116 VanDerWaalsContact CE1-O 3.32Å; C111-I116 WeakPolarHBondContact CA-O 3.21Å; S112-I116 PolarHBondContact N-O 3.01Å; D114-I116 VanDerWaalsContact C-N 3.26Å; D114-I116 HydrophobicContact CB-CG1 4.48Å; D114-I116 PolarHBondContact O-N 3.03Å; D114-I116 VanDerWaalsContact OD1-CB 3.26Å; D114-I116 WeakPolarHBondContact OD1-CB 3.41Å; D114-I116 WeakPolarHBondContact OD1-CG1 3.48Å; D114-I116 PolarHBondContact OD1-N 3.17Å; I116-F118 HydrophobicContact CG2-CD2 4.06Å; I116-F118 HydrophobicContact CG2-CE2 3.8Å; I116-F118 HydrophobicContact CG2-CZ 4.27Å; I116-Q133 HydrophobicContact CG2-CB 3.96Å; I116-T135 HydrophobicContact CD1-CG2 4.47Å; I116-T135 HydrophobicContact CG1-CG2 4.28Å; I116-T135 HydrophobicContact CG2-CG2 4.48Å
117	I	97.9	Very high	94.4	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.9	166.4	-53.4	179.6	0	0	0	108.3	I109 S110 C111 Q133 F134 I144 F154 S156 F166	I109-I117 HydrophobicContact CG2-CG2 3.41Å; I109-I117 VanDerWaalsContact CG2-CG2 3.41Å; S110-I117 CarbonylContact O-C 3.57Å; S110-I117 VanDerWaalsContact O-CA 3.28Å; S110-I117 WeakPolarHBondContact O-CA 3.49Å; S110-I117 WeakPolarHBondContact O-CG2 3.39Å; C111-I117 HydrophobicContact CB-CG1 3.96Å; I117-Q133 CarbonylContact O-C 3.23Å; I117-Q133 WeakPolarHBondContact O-CA 3.45Å; I117-F134 HydrophobicContact CB-CB 4.26Å; I117-F134 HydrophobicContact CB-CD2 4.43Å; I117-F134 PolarHBondContact N-O 3.1Å; I117-F134 PolarHBondContact O-N 3.4Å; I117-I144 HydrophobicContact CG2-CD1 4.35Å; I117-F154 HydrophobicContact CD1-CE2 4.21Å; I117-F154 HydrophobicContact CG2-CE2 4.05Å; I117-F154 HydrophobicContact CG2-CZ 4.22Å; I117-S156 VanDerWaalsContact CD1-CB 3.49Å; I117-S156 WeakPolarHBondContact CD1-OG 3.44Å; I117-F166 HydrophobicContact CD1-CE2 4.07Å
118	F	97.6	Very high	94.3	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.9	172.1	-84.1	-74.9	0	0	0	110.7	H90 S110 I116 N129 Q133	H90-F118 AromaticContact CE1-CD2 3.53Å; H90-F118 AromaticContact CG-CD2 3.93Å; H90-F118 AromaticContact ND1-CD2 3.53Å; H90-F118 AromaticContact ND1-CE2 3.99Å; H90-F118 AromaticContact NE2-CD2 3.88Å; S110-F118 PolarHBondContact N-O 3.2Å; S110-F118 PolarHBondContact O-N 3.05Å; I116-F118 HydrophobicContact CG2-CD2 4.06Å; I116-F118 HydrophobicContact CG2-CE2 3.8Å; I116-F118 HydrophobicContact CG2-CZ 4.27Å; F118-N129 WeakPolarHBondContact CD1-O 3.43Å; F118-Q133 HydrophobicContact CD1-CB 3.95Å; F118-Q133 HydrophobicContact CE1-CB 3.58Å; F118-Q133 HydrophobicContact CZ-CB 4Å
119	Y	97.2	Very high	94.2	Very high	12 Å²	12	32 Å²	32	5%	0.047	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.9	162.1	160.4	-120.6	0	0	0	108.1	E107 I109 C132 L168 T172	E107-Y119 HydrophobicContact CB-CE2 4.1Å; E107-Y119 VanDerWaalsContact CD-OH 3.26Å; E107-Y119 HydrophobicContact CG-CE2 4.07Å; E107-Y119 PolarHBondContact OE1-OH 3.46Å; E107-Y119 WeakPolarHBondContact OE2-CE2 3.48Å; I109-Y119 HydrophobicContact CD1-CD2 3.67Å; I109-Y119 HydrophobicContact CD1-CG 4.14Å; Y119-C132 HydrophobicContact CD1-CB 3.78Å; Y119-C132 HydrophobicContact CG-CB 4.4Å; Y119-C132 PolarHBondContact N-O 2.93Å; Y119-C132 WeakPolarHBondContact O-CB 3.3Å; Y119-L168 HydrophobicContact CD1-CD2 4.16Å; Y119-L168 HydrophobicContact CD2-CD1 4.14Å; Y119-L168 HydrophobicContact CD2-CD2 4Å; Y119-L168 HydrophobicContact CE1-CD2 4.5Å; Y119-L168 HydrophobicContact CE2-CD1 3.98Å; Y119-L168 HydrophobicContact CE2-CD2 4.32Å; Y119-L168 HydrophobicContact CG-CD2 3.91Å; Y119-T172 HydrophobicContact CD1-CG2 4.07Å; Y119-T172 HydrophobicContact CE1-CG2 3.61Å
120	T	96.6	Very high	93.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.2	-169.7	-64.2	0	0	0	0	109.9	I86 I108	I86-T120 HydrophobicContact CD1-CG2 4.46Å; I86-T120 HydrophobicContact CG2-CG2 3.88Å; I108-T120 PolarHBondContact N-O 3.18Å; I108-T120 PolarHBondContact O-N 3.19Å
121	H	94.8	Very high	93.7	Very high	22 Å²	22	45 Å²	45	10%	0.102	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.8	172.5	-168.6	-75.9	0	0	0	109.4	Q106 E107 E123 K124 N129	Q106-H121 CarbonylContact O-C 3.47Å; Q106-H121 WeakPolarHBondContact O-CA 3.49Å; E107-H121 IonicContact OE1-CD2 3.02Å; E107-H121 PolarHBondContact OE1-CD2 3.42Å; H121-E123 PolarHBondContact ND1-N 3Å; H121-E123 PolarHBondContact O-N 3.32Å; H121-K124 HydrophobicContact CB-CB 4.18Å; H121-K124 HydrophobicContact CB-CD 3.76Å; H121-K124 HydrophobicContact CB-CG 4.11Å; H121-K124 PolarHBondContact CD2-NZ 3.29Å; H121-K124 WeakPolarHBondContact ND1-CG 3.5Å; H121-K124 PolarHBondContact O-N 3Å; H121-N129 PolarHBondContact N-OD1 2.73Å; H121-N129 PolarHBondContact O-ND2 3.33Å; H121-N129 PolarHBondContact O-OD1 3.49Å
122	T	93.2	Very high	93.7	Very high	20 Å²	20	45.1 Å²	45.1	12%	0.123	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-7.4	-166.3	76.5	0	0	0	0	114.6	I74 K84 I86 Q106 I108	I74-T122 HydrophobicContact CD1-CG2 3.99Å; K84-T122 VanDerWaalsContact NZ-C 3.35Å; K84-T122 PolarHBondContact NZ-O 3.1Å; K84-T122 PolarHBondContact NZ-OG1 3.01Å; I86-T122 HydrophobicContact CD1-CG2 3.65Å; Q106-T122 WeakPolarHBondContact O-CG2 3.4Å; Q106-T122 PolarHBondContact O-N 2.83Å; I108-T122 HydrophobicContact CD1-CG2 3.75Å; I108-T122 HydrophobicContact CG1-CG2 4.34Å
123	E	92.2	Very high	93.8	Very high	121 Å²	121	47.7 Å²	47.7	57%	0.565	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-5.2	179.3	-63.2	177.2	-173.6	0	0	114	Q106 H121	Q106-E123 PolarHBondContact NE2-OE1 2.85Å; Q106-E123 PolarHBondContact NE2-OE2 3.35Å; H121-E123 PolarHBondContact ND1-N 3Å; H121-E123 PolarHBondContact O-N 3.32Å
124	K	91.9	Very high	94.1	Very high	84 Å²	84	46.6 Å²	46.6	37%	0.365	23%	0.227	S	C	.	.	S	Bend	trans	-91.8	162.9	174.8	-69.8	171.7	-163.8	164.3	0	109.8	H121 F128	H121-K124 HydrophobicContact CB-CB 4.18Å; H121-K124 HydrophobicContact CB-CD 3.76Å; H121-K124 HydrophobicContact CB-CG 4.11Å; H121-K124 PolarHBondContact CD2-NZ 3.29Å; H121-K124 WeakPolarHBondContact ND1-CG 3.5Å; H121-K124 PolarHBondContact O-N 3Å; K124-F128 HydrophobicContact CB-CB 4.17Å; K124-F128 HydrophobicContact CB-CD1 3.77Å; K124-F128 HydrophobicContact CB-CG 4.07Å; K124-F128 HydrophobicContact CD-CD1 3.47Å; K124-F128 VanDerWaalsContact CD-CD1 3.47Å; K124-F128 HydrophobicContact CD-CD2 4.28Å; K124-F128 HydrophobicContact CD-CE1 3.35Å; K124-F128 HydrophobicContact CD-CE2 4.17Å; K124-F128 HydrophobicContact CD-CG 3.96Å; K124-F128 HydrophobicContact CD-CZ 3.74Å; K124-F128 HydrophobicContact CG-CD1 4.22Å
125	S	91.9	Very high	94.4	Very high	59 Å²	59	46.4 Å²	46.4	41%	0.413	23%	0.228	S	C	.	.			trans	-61.2	151.9	179.2	61.2	0	0	0	0	112	E127 F128 N129	S125-E127 PolarHBondContact O-N 2.87Å; S125-F128 WeakPolarHBondContact O-CB 3.33Å; S125-F128 PolarHBondContact O-N 3.15Å; S125-F128 VanDerWaalsContact O-N 3.11Å; S125-F128 PolarHBondContact OG-N 3.46Å; S125-N129 PolarHBondContact O-N 3.43Å
126	P	90.2	Very high	94.5	Very high	71 Å²	71	46.7 Å²	46.7	46%	0.461	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-26.1	173.6	22	-28.3	0	0	0	112.1	N129 R130	P126-N129 PolarHBondContact O-N 3.35Å; P126-R130 VanDerWaalsContact O-CG 3.3Å; P126-R130 WeakPolarHBondContact O-CG 3.34Å; P126-R130 PolarHBondContact O-N 2.75Å
127	E	91.1	Very high	94.4	Very high	90 Å²	90	46 Å²	46	42%	0.421	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-39.6	174.3	-69.7	58.4	-124.8	0	0	112.2	S125 R130 Q131	S125-E127 PolarHBondContact O-N 2.87Å; E127-R130 IonicContact OE1-CZ 2.73Å; E127-R130 IonicContact OE1-NH1 2.76Å; E127-R130 PolarHBondContact OE1-NH1 3.45Å; E127-R130 IonicContact OE1-NH2 2.8Å; E127-Q131 WeakPolarHBondContact O-CG 3.33Å
128	F	93.2	Very high	94.1	Very high	65 Å²	65	55.1 Å²	55.1	29%	0.285	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-48.8	172.2	175.9	-86.6	0	0	0	110.6	K124 S125 R130 Q131 C132	K124-F128 HydrophobicContact CB-CB 4.17Å; K124-F128 HydrophobicContact CB-CD1 3.77Å; K124-F128 HydrophobicContact CB-CG 4.07Å; K124-F128 HydrophobicContact CD-CD1 3.47Å; K124-F128 VanDerWaalsContact CD-CD1 3.47Å; K124-F128 HydrophobicContact CD-CD2 4.28Å; K124-F128 HydrophobicContact CD-CE1 3.35Å; K124-F128 HydrophobicContact CD-CE2 4.17Å; K124-F128 HydrophobicContact CD-CG 3.96Å; K124-F128 HydrophobicContact CD-CZ 3.74Å; K124-F128 HydrophobicContact CG-CD1 4.22Å; S125-F128 WeakPolarHBondContact O-CB 3.33Å; S125-F128 PolarHBondContact O-N 3.15Å; S125-F128 VanDerWaalsContact O-N 3.11Å; S125-F128 PolarHBondContact OG-N 3.46Å; F128-R130 VanDerWaalsContact C-N 3.28Å; F128-R130 PolarHBondContact O-N 3.4Å; F128-Q131 WeakPolarHBondContact O-CB 3.21Å; F128-Q131 PolarHBondContact O-N 2.87Å; F128-C132 WeakPolarHBondContact CE1-SG 3.26Å; F128-C132 PolarHBondContact O-N 3Å
129	N	94.1	Very high	93.7	Very high	12 Å²	12	56.2 Å²	56.2	6%	0.064	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-34.2	-178	-68.4	-34.5	0	0	0	112.3	F118 H121 S125 P126 Q131 C132	F118-N129 WeakPolarHBondContact CD1-O 3.43Å; H121-N129 PolarHBondContact N-OD1 2.73Å; H121-N129 PolarHBondContact O-ND2 3.33Å; H121-N129 PolarHBondContact O-OD1 3.49Å; S125-N129 PolarHBondContact O-N 3.43Å; P126-N129 PolarHBondContact O-N 3.35Å; N129-Q131 PolarHBondContact O-N 3.23Å; N129-C132 PolarHBondContact O-N 2.86Å
130	R	92.4	Very high	93.5	Very high	136 Å²	136	56.6 Å²	56.6	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-24.7	172.3	-76.5	174.7	-168.7	139.3	8.8	114.3	P126 E127 F128	P126-R130 VanDerWaalsContact O-CG 3.3Å; P126-R130 WeakPolarHBondContact O-CG 3.34Å; P126-R130 PolarHBondContact O-N 2.75Å; E127-R130 IonicContact OE1-CZ 2.73Å; E127-R130 IonicContact OE1-NH1 2.76Å; E127-R130 PolarHBondContact OE1-NH1 3.45Å; E127-R130 IonicContact OE1-NH2 2.8Å; F128-R130 VanDerWaalsContact C-N 3.28Å; F128-R130 PolarHBondContact O-N 3.4Å
131	Q	93.4	Very high	93.5	Very high	137 Å²	137	56.5 Å²	56.5	64%	0.64	28%	0.277	S	S	*	.	H	α-helix	trans	-84.6	-22.5	177.6	-63.6	171.7	14.9	0	0	111.8	E127 F128 N129 Q133 S173	E127-Q131 WeakPolarHBondContact O-CG 3.33Å; F128-Q131 WeakPolarHBondContact O-CB 3.21Å; F128-Q131 PolarHBondContact O-N 2.87Å; N129-Q131 PolarHBondContact O-N 3.23Å; Q131-Q133 PolarHBondContact O-N 3.32Å; Q131-S173 WeakPolarHBondContact O-CB 3.43Å
132	C	96	Very high	93.4	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.02	28%	0.28	C	S	.	.			trans	-83.1	52.9	-179.3	-70.8	0	0	0	0	113.3	Y119 F128 N129 T172	Y119-C132 HydrophobicContact CD1-CB 3.78Å; Y119-C132 HydrophobicContact CG-CB 4.4Å; Y119-C132 PolarHBondContact N-O 2.93Å; Y119-C132 WeakPolarHBondContact O-CB 3.3Å; F128-C132 WeakPolarHBondContact CE1-SG 3.26Å; F128-C132 PolarHBondContact O-N 3Å; N129-C132 PolarHBondContact O-N 2.86Å; C132-T172 CarbonylContact C-O 3.55Å; C132-T172 WeakPolarHBondContact CA-O 3.35Å
133	Q	96.3	Very high	93.5	Very high	54 Å²	54	56.9 Å²	56.9	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.5	179.9	64.9	178.2	6.1	0	0	113.2	I116 I117 F118 Q131 T135 S173 C174 T175	I116-Q133 HydrophobicContact CG2-CB 3.96Å; I117-Q133 CarbonylContact O-C 3.23Å; I117-Q133 WeakPolarHBondContact O-CA 3.45Å; F118-Q133 HydrophobicContact CD1-CB 3.95Å; F118-Q133 HydrophobicContact CE1-CB 3.58Å; F118-Q133 HydrophobicContact CZ-CB 4Å; Q131-Q133 PolarHBondContact O-N 3.32Å; Q133-T135 HydrophobicContact CG-CG2 4.35Å; Q133-S173 CarbonylContact O-C 3.49Å; Q133-S173 VanDerWaalsContact O-CA 3.24Å; Q133-S173 WeakPolarHBondContact O-CA 3.5Å; Q133-S173 VanDerWaalsContact O-CB 3.27Å; Q133-S173 WeakPolarHBondContact O-CB 3.17Å; Q133-C174 PolarHBondContact O-N 2.92Å; Q133-T175 HydrophobicContact CG-CG2 4.03Å
134	F	97.3	Very high	93.7	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	110.8	167.5	-54.9	-96.8	0	0	0	108.6	I117 C136 F154 F166 L168 K171 T172 C174	I117-F134 HydrophobicContact CB-CB 4.26Å; I117-F134 HydrophobicContact CB-CD2 4.43Å; I117-F134 PolarHBondContact N-O 3.1Å; I117-F134 PolarHBondContact O-N 3.4Å; F134-C136 VanDerWaalsContact C-N 3.27Å; F134-C136 PolarHBondContact O-N 3.33Å; F134-F154 HydrophobicContact CD2-CZ 4.36Å; F134-F154 HydrophobicContact CE2-CE1 4.45Å; F134-F154 HydrophobicContact CE2-CZ 4.11Å; F134-F166 HydrophobicContact CB-CE1 4.33Å; F134-F166 HydrophobicContact CB-CZ 4.48Å; F134-F166 AromaticContact CD1-CD1 3.67Å; F134-F166 HydrophobicContact CD1-CD1 3.67Å; F134-F166 AromaticContact CD1-CE1 3.7Å; F134-F166 HydrophobicContact CD1-CE1 3.7Å; F134-F166 AromaticContact CE1-CD1 3.84Å; F134-F166 HydrophobicContact CE1-CD1 3.84Å; F134-F166 HydrophobicContact CE1-CE1 4.33Å; F134-F166 HydrophobicContact CG-CD1 4.39Å; F134-F166 HydrophobicContact CG-CE1 4.23Å; F134-L168 HydrophobicContact CZ-CD2 4.3Å; F134-K171 HydrophobicContact CE1-CD 4.45Å; F134-K171 HydrophobicContact CE1-CG 4.18Å; F134-K171 WeakPolarHBondContact CZ-O 3.41Å; F134-T172 VanDerWaalsContact CZ-C 3.44Å; F134-C174 WeakPolarHBondContact CA-O 3.14Å; F134-C174 HydrophobicContact CD1-CB 3.81Å; F134-C174 HydrophobicContact CE1-CB 4.47Å
135	T	96.4	Very high	93.8	Very high	48 Å²	48	47.7 Å²	47.7	29%	0.294	23%	0.234	S	C	.	.			trans	-97.8	34.4	177.9	68.7	0	0	0	0	110.8	I116 Q133 C174 T175	I116-T135 HydrophobicContact CD1-CG2 4.47Å; I116-T135 HydrophobicContact CG1-CG2 4.28Å; I116-T135 HydrophobicContact CG2-CG2 4.48Å; Q133-T135 HydrophobicContact CG-CG2 4.35Å; T135-C174 PolarHBondContact N-O 2.99Å; T135-T175 HydrophobicContact CG2-CG2 4.39Å; T135-T175 WeakPolarHBondContact OG1-CA 3.35Å
136	C	94.9	Very high	93.9	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.054	22%	0.217	C	C	.	.			trans	-85.3	-28.6	-165.5	-54.7	0	0	0	0	113.9	F134 R164 F166 C174 C179	F134-C136 VanDerWaalsContact C-N 3.27Å; F134-C136 PolarHBondContact O-N 3.33Å; C136-R164 PolarHBondContact O-NH1 3.37Å; C136-R164 PolarHBondContact O-NH2 3.19Å; C136-F166 HydrophobicContact CB-CE1 4.36Å; C136-F166 HydrophobicContact CB-CZ 4.16Å; C136-C174 VanDerWaalsContact SG-CB 3.57Å; C136-C179 HydrophobicContact CB-CB 4.07Å
137	H	94.6	Very high	93.9	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.069	20%	0.197	C	C	.	.	S	Bend	trans	-75.9	147.9	175.8	-84.7	-69.1	0	0	0	111	S156 D160 T162 R164	H137-S156 PolarHBondContact NE2-OG 3.19Å; H137-D160 WeakPolarHBondContact CA-OD2 3.29Å; H137-D160 IonicContact CE1-OD1 3.32Å; H137-D160 IonicContact CE1-OD2 3.71Å; H137-D160 IonicContact CG-OD2 3.82Å; H137-D160 VanDerWaalsContact ND1-CG 3.34Å; H137-D160 IonicContact ND1-OD1 2.87Å; H137-D160 PolarHBondContact ND1-OD1 3.48Å; H137-D160 VanDerWaalsContact ND1-OD1 3.12Å; H137-D160 IonicContact ND1-OD2 2.71Å; H137-D160 PolarHBondContact ND1-OD2 3.3Å; H137-T162 PolarHBondContact CE1-OG1 2.82Å; H137-T162 VanDerWaalsContact CE1-OG1 3.25Å; H137-T162 PolarHBondContact ND1-OG1 2.8Å; H137-R164 PolarHBondContact CE1-NE 2.83Å; H137-R164 PolarHBondContact ND1-NE 3.36Å
138	Y	90.8	Very high	93.6	Very high	193 Å²	193	39.5 Å²	39.5	76%	0.757	19%	0.187	S	C	*	.	S	Bend	trans	-102.8	131	167.6	178.9	-91	0	0	0	109.8	D160	Y138-D160 PolarHBondContact N-OD2 3.27Å; Y138-D160 WeakPolarHBondContact O-CB 3.43Å; Y138-D160 PolarHBondContact O-N 3Å; Y138-D160 VanDerWaalsContact O-N 3.09Å
139	G	90.3	Very high	93.1	Very high	29 Å²	29	43.1 Å²	43.1	30%	0.299	21%	0.21	S	C	.	.	S	Bend	trans	68.7	-166.1	-168.4	0	0	0	0	0	112.8	G115	G115-G139 WeakPolarHBondContact CA-O 3.49Å
140	T	92.2	Very high	92.8	Very high	19 Å²	19	44 Å²	44	12%	0.117	22%	0.215	C	C	.	.			trans	-58.8	137.5	-172.9	-55.5	0	0	0	0	113.3	F95 Y142 G158 E159	F95-T140 HydrophobicContact CD2-CG2 3.54Å; F95-T140 HydrophobicContact CE2-CG2 3.49Å; F95-T140 VanDerWaalsContact CE2-CG2 3.49Å; T140-Y142 HydrophobicContact CG2-CD1 3.38Å; T140-Y142 HydrophobicContact CG2-CE1 3.28Å; T140-Y142 HydrophobicContact CG2-CG 4.05Å; T140-G158 CarbonylContact O-C 3.56Å; T140-G158 WeakPolarHBondContact O-CA 3.45Å; T140-E159 VanDerWaalsContact CB-OE2 3.25Å; T140-E159 WeakPolarHBondContact CB-OE2 3.37Å; T140-E159 PolarHBondContact N-OE2 3.39Å; T140-E159 PolarHBondContact O-N 3.37Å; T140-E159 PolarHBondContact OG1-OE2 2.91Å
141	A	95.5	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113.6	163	0	0	0	0	0	109.6	C111 S112	C111-A141 HydrophobicContact CB-CB 3.73Å; C111-A141 PolarHBondContact SG-O 3.17Å; S112-A141 PolarHBondContact O-N 3.47Å; S112-A141 VanDerWaalsContact O-N 3.17Å
142	Y	93.4	Very high	92.6	Very high	39 Å²	39	37.8 Å²	37.8	15%	0.153	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-47.5	-167.4	-65.1	-65	0	0	0	113.9	T140 C157 E159 A190 T192	T140-Y142 HydrophobicContact CG2-CD1 3.38Å; T140-Y142 HydrophobicContact CG2-CE1 3.28Å; T140-Y142 HydrophobicContact CG2-CG 4.05Å; Y142-C157 PolarHBondContact N-O 3.08Å; Y142-E159 HydrophobicContact CE2-CB 3.9Å; Y142-E159 HydrophobicContact CE2-CG 4.49Å; Y142-A190 HydrophobicContact CE2-CB 4.42Å; Y142-T192 HydrophobicContact CD2-CG2 3.77Å; Y142-T192 HydrophobicContact CE2-CG2 3.69Å; Y142-T192 HydrophobicContact CG-CG2 4.42Å
143	E	94.8	Very high	92.5	Very high	10 Å²	10	37.6 Å²	37.6	5%	0.047	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.3	-174.8	-172.2	157	-130	0	0	111.8	S156 C157 S193 I194 R569	E143-S156 VanDerWaalsContact O-CA 3.26Å; E143-S156 WeakPolarHBondContact O-CA 3.47Å; E143-C157 PolarHBondContact O-N 3.45Å; E143-S193 WeakPolarHBondContact OE2-CA 3.43Å; E143-S193 VanDerWaalsContact OE2-CB 3.28Å; E143-S193 WeakPolarHBondContact OE2-CB 3.28Å; E143-S193 PolarHBondContact OE2-OG 2.8Å; E143-I194 HydrophobicContact CB-CG1 4.23Å; E143-I194 HydrophobicContact CG-CG1 4.01Å; E143-I194 PolarHBondContact OE2-N 3.02Å; E143-R569 IonicContact OE1-CZ 3.41Å; E143-R569 IonicContact OE1-NH1 3.17Å; E143-R569 PolarHBondContact OE1-NH1 3.37Å
144	I	96.5	Very high	92.5	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.9	169.8	-66	151.8	0	0	0	107.8	S96 K98 I109 S110 C111 I117 F154 L155	S96-I144 PolarHBondContact OG-N 3.31Å; K98-I144 HydrophobicContact CG-CG2 4.49Å; I109-I144 HydrophobicContact CB-CD1 4.39Å; I109-I144 HydrophobicContact CB-CG2 4.19Å; I109-I144 HydrophobicContact CG2-CD1 3.74Å; I109-I144 HydrophobicContact CG2-CG1 4.28Å; I109-I144 HydrophobicContact CG2-CG2 4.01Å; S110-I144 VanDerWaalsContact CA-CD1 3.47Å; C111-I144 HydrophobicContact CB-CD1 3.48Å; C111-I144 VanDerWaalsContact CB-CD1 3.48Å; C111-I144 HydrophobicContact CB-CG1 3.91Å; I117-I144 HydrophobicContact CG2-CD1 4.35Å; I144-F154 HydrophobicContact CG2-CB 4.43Å; I144-F154 HydrophobicContact CG2-CD2 4.19Å; I144-L155 WeakPolarHBondContact CA-O 3.49Å
145	M	95.1	Very high	92.5	Very high	11 Å²	11	35 Å²	35	5%	0.054	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.6	171.8	173.5	169	46.3	0	0	110.4	L155 I194 S195 I196 L204	M145-L155 HydrophobicContact CE-CD1 4.22Å; M145-L155 PolarHBondContact N-O 2.91Å; M145-L155 PolarHBondContact O-N 3.47Å; M145-I194 HydrophobicContact CB-CD1 4.02Å; M145-I194 HydrophobicContact CB-CG1 4.29Å; M145-I194 HydrophobicContact CE-CB 3.79Å; M145-I194 HydrophobicContact CE-CD1 4.04Å; M145-I194 HydrophobicContact CE-CG1 3.9Å; M145-S195 VanDerWaalsContact SD-CA 3.59Å; M145-I196 HydrophobicContact CE-CB 4.31Å; M145-I196 HydrophobicContact CE-CD1 3.96Å; M145-I196 HydrophobicContact CE-CG1 3.64Å; M145-I196 HydrophobicContact CG-CD1 4.32Å; M145-I196 HydrophobicContact SD-CB 3.87Å; M145-I196 HydrophobicContact SD-CD1 3.95Å; M145-I196 HydrophobicContact SD-CG1 3.78Å; M145-I196 PolarHBondContact SD-N 3.33Å; M145-L204 HydrophobicContact CE-CD1 3.62Å
146	T	93.4	Very high	92.5	Very high	8 Å²	8	32.7 Å²	32.7	5%	0.049	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	147.7	169.2	47.2	0	0	0	0	110.7	K98 F99 M100 Q562	K98-T146 HydrophobicContact CB-CG2 4.23Å; F99-T146 WeakPolarHBondContact O-CG2 3.46Å; M100-T146 HydrophobicContact CE-CG2 4.33Å; M100-T146 HydrophobicContact SD-CG2 3.61Å; T146-Q562 PolarHBondContact O-NE2 3.28Å
147	V	89.6	Confident	92.6	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.03	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-88.7	124.2	-175.4	173.9	0	0	0	0	110.1	N149 D150 L155 I196 R218	V147-N149 PolarHBondContact O-N 3.4Å; V147-D150 HydrophobicContact CB-CB 3.97Å; V147-D150 HydrophobicContact CG1-CB 3.71Å; V147-D150 PolarHBondContact O-N 3.06Å; V147-D150 VanDerWaalsContact O-N 3.14Å; V147-L155 HydrophobicContact CG2-CG 4.28Å; V147-I196 HydrophobicContact CG2-CD1 4.08Å; V147-R218 VanDerWaalsContact CG1-NH1 3.31Å
148	P	85	Confident	92.6	Very high	35 Å²	35	31.6 Å²	31.6	23%	0.227	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	132.3	174.4	-25.2	35	0	0	0	111.8	D150 I196 P201	P148-D150 VanDerWaalsContact C-N 3.26Å; P148-D150 PolarHBondContact O-N 3.12Å; P148-I196 HydrophobicContact CG-CG2 4.28Å; P148-P201 HydrophobicContact CB-CB 4.44Å; P148-P201 HydrophobicContact CB-CG 4.41Å
149	N	82.9	Confident	92.6	Very high	141 Å²	141	25.6 Å²	25.6	75%	0.754	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.7	12.7	-176.3	-45.7	-55.3	0	0	0	116.1	V147	V147-N149 PolarHBondContact O-N 3.4Å
150	D	88.1	Confident	92.7	Very high	31 Å²	31	26.1 Å²	26.1	17%	0.166	13%	0.131	C	C	.	.			trans	-127.4	94	172.5	-175.5	0.9	0	0	0	110.4	V147 P148 Y152 T153	V147-D150 HydrophobicContact CB-CB 3.97Å; V147-D150 HydrophobicContact CG1-CB 3.71Å; V147-D150 PolarHBondContact O-N 3.06Å; V147-D150 VanDerWaalsContact O-N 3.14Å; P148-D150 VanDerWaalsContact C-N 3.26Å; P148-D150 PolarHBondContact O-N 3.12Å; D150-Y152 PolarHBondContact O-N 2.93Å; D150-Y152 PolarHBondContact OD1-N 3Å; D150-T153 VanDerWaalsContact CG-OG1 3.3Å; D150-T153 WeakPolarHBondContact OD2-CB 3.35Å; D150-T153 WeakPolarHBondContact OD2-CG2 3.3Å; D150-T153 PolarHBondContact OD2-OG1 3.49Å
151	P	88.8	Confident	92.7	Very high	31 Å²	31	25.2 Å²	25.2	20%	0.201	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.4	-172.1	22.4	-30.9	0	0	0	114.9	M100 P101 H102	M100-P151 WeakPolarHBondContact CE-O 3.49Å; P101-P151 WeakPolarHBondContact O-CB 3.26Å; H102-P151 HydrophobicContact CB-CB 4.32Å
152	Y	92.4	Very high	92.6	Very high	111 Å²	111	25.4 Å²	25.4	44%	0.435	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-5.1	-171	-59.2	-65.2	0	0	0	114.4	D150 L168 R169	D150-Y152 PolarHBondContact O-N 2.93Å; D150-Y152 PolarHBondContact OD1-N 3Å; Y152-L168 WeakPolarHBondContact O-CB 3.32Å; Y152-L168 WeakPolarHBondContact O-CG 3.3Å; Y152-L168 PolarHBondContact O-N 3.26Å; Y152-R169 HydrophobicContact CD1-CG 4.11Å; Y152-R169 HydrophobicContact CD2-CG 4.02Å; Y152-R169 HydrophobicContact CG-CG 3.7Å
153	T	94.1	Very high	92.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.5	-178.1	86.3	0	0	0	0	114.2	D150 W165 F166 D167	D150-T153 VanDerWaalsContact CG-OG1 3.3Å; D150-T153 WeakPolarHBondContact OD2-CB 3.35Å; D150-T153 WeakPolarHBondContact OD2-CG2 3.3Å; D150-T153 PolarHBondContact OD2-OG1 3.49Å; T153-W165 HydrophobicContact CG2-CZ2 4.02Å; T153-W165 PolarHBondContact OG1-NE1 2.96Å; T153-F166 WeakPolarHBondContact CA-O 3.47Å; T153-F166 VanDerWaalsContact CB-O 3.24Å; T153-F166 WeakPolarHBondContact CB-O 3.4Å; T153-D167 HydrophobicContact CG2-CB 3.89Å
154	F	96.4	Very high	92.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	156.6	175.8	67.5	-89.6	0	0	0	110.8	M100 I109 I117 F134 I144 F166 L168	M100-F154 HydrophobicContact SD-CB 4.39Å; M100-F154 HydrophobicContact SD-CD1 4.44Å; I109-F154 HydrophobicContact CD1-CD1 3.94Å; I109-F154 HydrophobicContact CD1-CE1 3.77Å; I109-F154 HydrophobicContact CD1-CZ 4.38Å; I109-F154 HydrophobicContact CG1-CD1 3.9Å; I109-F154 HydrophobicContact CG1-CE1 4.17Å; I109-F154 HydrophobicContact CG1-CG 4.19Å; I109-F154 HydrophobicContact CG2-CD1 4.4Å; I109-F154 HydrophobicContact CG2-CD2 3.96Å; I109-F154 HydrophobicContact CG2-CE1 4.25Å; I109-F154 HydrophobicContact CG2-CE2 3.8Å; I109-F154 HydrophobicContact CG2-CG 4.26Å; I109-F154 HydrophobicContact CG2-CZ 3.95Å; I117-F154 HydrophobicContact CD1-CE2 4.21Å; I117-F154 HydrophobicContact CG2-CE2 4.05Å; I117-F154 HydrophobicContact CG2-CZ 4.22Å; F134-F154 HydrophobicContact CD2-CZ 4.36Å; F134-F154 HydrophobicContact CE2-CE1 4.45Å; F134-F154 HydrophobicContact CE2-CZ 4.11Å; I144-F154 HydrophobicContact CG2-CB 4.43Å; I144-F154 HydrophobicContact CG2-CD2 4.19Å; F154-F166 HydrophobicContact CD1-CB 4.17Å; F154-F166 HydrophobicContact CD2-CB 4.5Å; F154-F166 HydrophobicContact CD2-CD2 4.06Å; F154-F166 HydrophobicContact CE1-CB 3.63Å; F154-F166 HydrophobicContact CE1-CG 4.33Å; F154-F166 HydrophobicContact CE2-CB 4Å; F154-F166 AromaticContact CE2-CD2 3.35Å; F154-F166 HydrophobicContact CE2-CD2 3.35Å; F154-F166 HydrophobicContact CE2-CE2 4.07Å; F154-F166 AromaticContact CE2-CG 3.95Å; F154-F166 HydrophobicContact CE2-CG 3.95Å; F154-F166 HydrophobicContact CZ-CB 3.54Å; F154-F166 AromaticContact CZ-CD2 3.63Å; F154-F166 HydrophobicContact CZ-CD2 3.63Å; F154-F166 HydrophobicContact CZ-CE2 4.48Å; F154-F166 AromaticContact CZ-CG 3.72Å; F154-F166 HydrophobicContact CZ-CG 3.72Å; F154-F166 PolarHBondContact N-O 3.17Å; F154-F166 PolarHBondContact O-N 2.77Å; F154-F166 VanDerWaalsContact O-N 3.08Å; F154-L168 HydrophobicContact CE1-CD2 4.01Å; F154-L168 HydrophobicContact CE1-CG 4.34Å
155	L	96.9	Very high	92.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	145.4	172.4	-62	174.6	0	0	0	109.6	I144 M145 V147 R164 W165 L184 I194 I196 L204	I144-L155 WeakPolarHBondContact CA-O 3.49Å; M145-L155 HydrophobicContact CE-CD1 4.22Å; M145-L155 PolarHBondContact N-O 2.91Å; M145-L155 PolarHBondContact O-N 3.47Å; V147-L155 HydrophobicContact CG2-CG 4.28Å; L155-R164 VanDerWaalsContact CA-O 3.28Å; L155-R164 WeakPolarHBondContact CA-O 3.3Å; L155-R164 WeakPolarHBondContact CD2-O 3.44Å; L155-W165 HydrophobicContact CD2-CB 3.69Å; L155-W165 HydrophobicContact CD2-CG 3.95Å; L155-L184 HydrophobicContact CD2-CD2 3.89Å; L155-I194 HydrophobicContact CB-CD1 3.92Å; L155-I196 HydrophobicContact CD1-CD1 3.96Å; L155-I196 HydrophobicContact CD1-CG1 4.47Å; L155-L204 HydrophobicContact CD1-CD1 3.86Å; L155-L204 HydrophobicContact CD1-CD2 3.78Å; L155-L204 HydrophobicContact CD1-CG 4.45Å
156	S	97.5	Very high	92.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	154.5	168.6	65.4	0	0	0	0	111.4	I117 H137 E143 V163 R164 F166	I117-S156 VanDerWaalsContact CD1-CB 3.49Å; I117-S156 WeakPolarHBondContact CD1-OG 3.44Å; H137-S156 PolarHBondContact NE2-OG 3.19Å; E143-S156 VanDerWaalsContact O-CA 3.26Å; E143-S156 WeakPolarHBondContact O-CA 3.47Å; S156-V163 CarbonylContact O-C 3.54Å; S156-V163 VanDerWaalsContact O-CA 3.28Å; S156-V163 WeakPolarHBondContact O-CA 3.39Å; S156-V163 WeakPolarHBondContact O-CG1 3.39Å; S156-R164 PolarHBondContact N-O 2.86Å; S156-R164 VanDerWaalsContact N-O 3.12Å; S156-R164 PolarHBondContact O-N 2.86Å; S156-F166 WeakPolarHBondContact OG-CE2 3.31Å
157	C	96.4	Very high	92.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.1	173.8	70.9	0	0	0	0	112.1	Y142 E143 T162 V163 A191 I194	Y142-C157 PolarHBondContact N-O 3.08Å; E143-C157 PolarHBondContact O-N 3.45Å; C157-T162 WeakPolarHBondContact CA-O 3.38Å; C157-V163 HydrophobicContact CB-CG2 4.11Å; C157-A191 CarbonylContact C-O 3.57Å; C157-A191 HydrophobicContact CB-CB 3.79Å; C157-A191 WeakPolarHBondContact CB-O 3.39Å; C157-A191 PolarHBondContact SG-O 3.23Å; C157-I194 HydrophobicContact CB-CD1 4.36Å; C157-I194 HydrophobicContact CB-CG2 3.85Å
158	G	93.6	Very high	93	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	177.8	-171.3	0	0	0	0	0	116.4	T140 D160 G161 T162 A191	T140-G158 CarbonylContact O-C 3.56Å; T140-G158 WeakPolarHBondContact O-CA 3.45Å; G158-D160 VanDerWaalsContact C-N 3.29Å; G158-D160 PolarHBondContact O-N 2.66Å; G158-G161 PolarHBondContact O-N 3.05Å; G158-T162 PolarHBondContact N-O 3.31Å; G158-A191 PolarHBondContact N-O 2.75Å; G158-A191 PolarHBondContact O-N 3.36Å
159	E	92.6	Very high	93.4	Very high	66 Å²	66	33.1 Å²	33.1	31%	0.308	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.6	-178.1	-164.6	161.3	-162.1	0	0	112.6	T140 Y142 G161	T140-E159 VanDerWaalsContact CB-OE2 3.25Å; T140-E159 WeakPolarHBondContact CB-OE2 3.37Å; T140-E159 PolarHBondContact N-OE2 3.39Å; T140-E159 PolarHBondContact O-N 3.37Å; T140-E159 PolarHBondContact OG1-OE2 2.91Å; Y142-E159 HydrophobicContact CE2-CB 3.9Å; Y142-E159 HydrophobicContact CE2-CG 4.49Å; E159-G161 PolarHBondContact O-N 3.35Å
160	D	91.5	Very high	93.8	Very high	40 Å²	40	31.9 Å²	31.9	21%	0.214	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-8	167	65.3	14.2	0	0	0	115.1	H137 Y138 G158 T162 R164	H137-D160 WeakPolarHBondContact CA-OD2 3.29Å; H137-D160 IonicContact CE1-OD1 3.32Å; H137-D160 IonicContact CE1-OD2 3.71Å; H137-D160 IonicContact CG-OD2 3.82Å; H137-D160 VanDerWaalsContact ND1-CG 3.34Å; H137-D160 IonicContact ND1-OD1 2.87Å; H137-D160 PolarHBondContact ND1-OD1 3.48Å; H137-D160 VanDerWaalsContact ND1-OD1 3.12Å; H137-D160 IonicContact ND1-OD2 2.71Å; H137-D160 PolarHBondContact ND1-OD2 3.3Å; Y138-D160 PolarHBondContact N-OD2 3.27Å; Y138-D160 WeakPolarHBondContact O-CB 3.43Å; Y138-D160 PolarHBondContact O-N 3Å; Y138-D160 VanDerWaalsContact O-N 3.09Å; G158-D160 VanDerWaalsContact C-N 3.29Å; G158-D160 PolarHBondContact O-N 2.66Å; D160-T162 VanDerWaalsContact C-N 3.27Å; D160-T162 PolarHBondContact O-N 3.38Å; D160-T162 WeakPolarHBondContact OD1-CB 3.25Å; D160-T162 PolarHBondContact OD1-N 3.28Å; D160-T162 PolarHBondContact OD1-OG1 2.8Å; D160-T162 PolarHBondContact OD2-OG1 2.9Å; D160-T162 VanDerWaalsContact OD2-OG1 3.1Å; D160-R164 IonicContact OD2-CZ 2.67Å; D160-R164 IonicContact OD2-NE 3.29Å; D160-R164 IonicContact OD2-NH2 3.48Å; D160-R164 PolarHBondContact OD2-NH2 2.97Å
161	G	91.5	Very high	94.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	72.1	20.9	180	0	0	0	0	0	113.7	G158 E159 C187 R189	G158-G161 PolarHBondContact O-N 3.05Å; E159-G161 PolarHBondContact O-N 3.35Å; G161-C187 WeakPolarHBondContact O-CA 3.37Å; G161-C187 WeakPolarHBondContact O-CB 3.43Å; G161-C187 PolarHBondContact O-N 3.31Å; G161-R189 WeakPolarHBondContact CA-O 3.34Å
162	T	94.4	Very high	94.4	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.7	171.9	68.4	0	0	0	0	111.3	H137 C157 G158 D160 R164 I183 I185	H137-T162 PolarHBondContact CE1-OG1 2.82Å; H137-T162 VanDerWaalsContact CE1-OG1 3.25Å; H137-T162 PolarHBondContact ND1-OG1 2.8Å; C157-T162 WeakPolarHBondContact CA-O 3.38Å; G158-T162 PolarHBondContact N-O 3.31Å; D160-T162 VanDerWaalsContact C-N 3.27Å; D160-T162 PolarHBondContact O-N 3.38Å; D160-T162 WeakPolarHBondContact OD1-CB 3.25Å; D160-T162 PolarHBondContact OD1-N 3.28Å; D160-T162 PolarHBondContact OD1-OG1 2.8Å; D160-T162 PolarHBondContact OD2-OG1 2.9Å; D160-T162 VanDerWaalsContact OD2-OG1 3.1Å; T162-R164 PolarHBondContact OG1-NE 2.84Å; T162-I183 HydrophobicContact CG2-CD1 3.94Å; T162-I183 HydrophobicContact CG2-CG1 4.13Å; T162-I183 HydrophobicContact CG2-CG2 4.05Å; T162-I185 CarbonylContact C-O 3.58Å; T162-I185 VanDerWaalsContact CA-O 3.32Å; T162-I185 WeakPolarHBondContact CA-O 3.24Å
163	V	95.9	Very high	94.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.9	153.5	-172.8	0	0	0	0	106.7	S156 C157 L184 I185 A191 I194 L204 V206	S156-V163 CarbonylContact O-C 3.54Å; S156-V163 VanDerWaalsContact O-CA 3.28Å; S156-V163 WeakPolarHBondContact O-CA 3.39Å; S156-V163 WeakPolarHBondContact O-CG1 3.39Å; C157-V163 HydrophobicContact CB-CG2 4.11Å; V163-L184 PolarHBondContact O-N 3.21Å; V163-I185 HydrophobicContact CB-CB 4.06Å; V163-I185 HydrophobicContact CB-CD1 4.3Å; V163-I185 HydrophobicContact CB-CG1 4.42Å; V163-I185 HydrophobicContact CG2-CB 4.32Å; V163-I185 HydrophobicContact CG2-CD1 4.4Å; V163-I185 PolarHBondContact N-O 2.91Å; V163-I185 PolarHBondContact O-N 2.88Å; V163-A191 HydrophobicContact CG2-CB 4.12Å; V163-I194 HydrophobicContact CG1-CG2 4.35Å; V163-I194 HydrophobicContact CG2-CG2 4.14Å; V163-L204 HydrophobicContact CG1-CD2 4.46Å; V163-V206 HydrophobicContact CG2-CG1 3.75Å; V163-V206 HydrophobicContact CG2-CG2 4Å
164	R	95.7	Very high	94.6	Very high	11 Å²	11	31.5 Å²	31.5	4%	0.042	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	152.8	-176.4	-61.2	-179.2	-175.1	-120.3	7	110.5	C136 H137 L155 S156 D160 T162 F166 C179 D182 I183	C136-R164 PolarHBondContact O-NH1 3.37Å; C136-R164 PolarHBondContact O-NH2 3.19Å; H137-R164 PolarHBondContact CE1-NE 2.83Å; H137-R164 PolarHBondContact ND1-NE 3.36Å; L155-R164 VanDerWaalsContact CA-O 3.28Å; L155-R164 WeakPolarHBondContact CA-O 3.3Å; L155-R164 WeakPolarHBondContact CD2-O 3.44Å; S156-R164 PolarHBondContact N-O 2.86Å; S156-R164 VanDerWaalsContact N-O 3.12Å; S156-R164 PolarHBondContact O-N 2.86Å; D160-R164 IonicContact OD2-CZ 2.67Å; D160-R164 IonicContact OD2-NE 3.29Å; D160-R164 IonicContact OD2-NH2 3.48Å; D160-R164 PolarHBondContact OD2-NH2 2.97Å; T162-R164 PolarHBondContact OG1-NE 2.84Å; R164-F166 HydrophobicContact CB-CD2 4.32Å; R164-F166 HydrophobicContact CB-CE2 3.61Å; R164-F166 HydrophobicContact CB-CZ 3.97Å; R164-C179 PolarHBondContact NH1-O 3.19Å; R164-D182 CarbonylContact C-O 3.52Å; R164-D182 VanDerWaalsContact CA-O 3.25Å; R164-D182 WeakPolarHBondContact CA-O 3.41Å; R164-D182 HydrophobicContact CB-CB 4.39Å; R164-I183 HydrophobicContact CG-CG1 4.45Å
165	W	95.2	Very high	94.6	Very high	62 Å²	62	35.8 Å²	35.8	24%	0.235	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	119.8	178.3	178.8	49.9	0	0	0	109.4	T153 L155 D182 L184 T223 T226	T153-W165 HydrophobicContact CG2-CZ2 4.02Å; T153-W165 PolarHBondContact OG1-NE1 2.96Å; L155-W165 HydrophobicContact CD2-CB 3.69Å; L155-W165 HydrophobicContact CD2-CG 3.95Å; W165-D182 PolarHBondContact N-O 3.16Å; W165-L184 HydrophobicContact CB-CB 4.06Å; W165-L184 HydrophobicContact CB-CD1 4.28Å; W165-L184 HydrophobicContact CB-CD2 4.17Å; W165-L184 HydrophobicContact CB-CG 4.39Å; W165-L184 HydrophobicContact CE3-CD1 4.38Å; W165-T223 HydrophobicContact CB-CG2 4.25Å; W165-T223 HydrophobicContact CE3-CG2 3.9Å; W165-T226 HydrophobicContact CZ3-CG2 4.12Å
166	F	95.7	Very high	94.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.8	-176.4	-62.5	-84.5	0	0	0	110.2	I117 F134 C136 T153 F154 S156 R164 D182	I117-F166 HydrophobicContact CD1-CE2 4.07Å; F134-F166 HydrophobicContact CB-CE1 4.33Å; F134-F166 HydrophobicContact CB-CZ 4.48Å; F134-F166 AromaticContact CD1-CD1 3.67Å; F134-F166 HydrophobicContact CD1-CD1 3.67Å; F134-F166 AromaticContact CD1-CE1 3.7Å; F134-F166 HydrophobicContact CD1-CE1 3.7Å; F134-F166 AromaticContact CE1-CD1 3.84Å; F134-F166 HydrophobicContact CE1-CD1 3.84Å; F134-F166 HydrophobicContact CE1-CE1 4.33Å; F134-F166 HydrophobicContact CG-CD1 4.39Å; F134-F166 HydrophobicContact CG-CE1 4.23Å; C136-F166 HydrophobicContact CB-CE1 4.36Å; C136-F166 HydrophobicContact CB-CZ 4.16Å; T153-F166 WeakPolarHBondContact CA-O 3.47Å; T153-F166 VanDerWaalsContact CB-O 3.24Å; T153-F166 WeakPolarHBondContact CB-O 3.4Å; F154-F166 HydrophobicContact CD1-CB 4.17Å; F154-F166 HydrophobicContact CD2-CB 4.5Å; F154-F166 HydrophobicContact CD2-CD2 4.06Å; F154-F166 HydrophobicContact CE1-CB 3.63Å; F154-F166 HydrophobicContact CE1-CG 4.33Å; F154-F166 HydrophobicContact CE2-CB 4Å; F154-F166 AromaticContact CE2-CD2 3.35Å; F154-F166 HydrophobicContact CE2-CD2 3.35Å; F154-F166 HydrophobicContact CE2-CE2 4.07Å; F154-F166 AromaticContact CE2-CG 3.95Å; F154-F166 HydrophobicContact CE2-CG 3.95Å; F154-F166 HydrophobicContact CZ-CB 3.54Å; F154-F166 AromaticContact CZ-CD2 3.63Å; F154-F166 HydrophobicContact CZ-CD2 3.63Å; F154-F166 HydrophobicContact CZ-CE2 4.48Å; F154-F166 AromaticContact CZ-CG 3.72Å; F154-F166 HydrophobicContact CZ-CG 3.72Å; F154-F166 PolarHBondContact N-O 3.17Å; F154-F166 PolarHBondContact O-N 2.77Å; F154-F166 VanDerWaalsContact O-N 3.08Å; S156-F166 WeakPolarHBondContact OG-CE2 3.31Å; R164-F166 HydrophobicContact CB-CD2 4.32Å; R164-F166 HydrophobicContact CB-CE2 3.61Å; R164-F166 HydrophobicContact CB-CZ 3.97Å; F166-D182 HydrophobicContact CD1-CB 3.98Å; F166-D182 HydrophobicContact CE1-CB 3.71Å; F166-D182 VanDerWaalsContact CE1-CG 3.45Å; F166-D182 WeakPolarHBondContact CE1-OD2 3.44Å; F166-D182 HydrophobicContact CZ-CB 4.16Å
167	D	94.2	Very high	94.1	Very high	26 Å²	26	48.8 Å²	48.8	14%	0.139	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.4	174	-170.9	-26.8	0	0	0	110	T153 R169 T170 K171	T153-D167 HydrophobicContact CG2-CB 3.89Å; D167-R169 PolarHBondContact O-N 2.87Å; D167-R169 WeakPolarHBondContact OD1-CB 3.39Å; D167-R169 WeakPolarHBondContact OD1-CG 3.22Å; D167-R169 IonicContact OD1-CZ 3.99Å; D167-R169 PolarHBondContact OD1-N 3.3Å; D167-R169 IonicContact OD1-NE 3.96Å; D167-R169 PolarHBondContact OD1-NE 2.98Å; D167-R169 IonicContact OD1-NH2 3.9Å; D167-R169 IonicContact OD2-CZ 2.83Å; D167-R169 VanDerWaalsContact OD2-CZ 3.32Å; D167-R169 IonicContact OD2-NE 2.67Å; D167-R169 PolarHBondContact OD2-NE 3.17Å; D167-R169 VanDerWaalsContact OD2-NE 3.15Å; D167-R169 IonicContact OD2-NH2 3.05Å; D167-R169 PolarHBondContact OD2-NH2 2.85Å; D167-T170 PolarHBondContact O-N 3.35Å; D167-K171 PolarHBondContact O-N 2.89Å
168	L	94.2	Very high	93.8	Very high	14 Å²	14	54.7 Å²	54.7	7%	0.073	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.5	-178	-65.9	172.1	0	0	0	112.8	M100 I109 Y119 F134 Y152 F154	M100-L168 HydrophobicContact CE-CD1 3.92Å; M100-L168 HydrophobicContact CG-CD1 4.12Å; M100-L168 HydrophobicContact SD-CD1 4.24Å; I109-L168 HydrophobicContact CD1-CD1 4.29Å; I109-L168 HydrophobicContact CD1-CD2 4.37Å; Y119-L168 HydrophobicContact CD1-CD2 4.16Å; Y119-L168 HydrophobicContact CD2-CD1 4.14Å; Y119-L168 HydrophobicContact CD2-CD2 4Å; Y119-L168 HydrophobicContact CE1-CD2 4.5Å; Y119-L168 HydrophobicContact CE2-CD1 3.98Å; Y119-L168 HydrophobicContact CE2-CD2 4.32Å; Y119-L168 HydrophobicContact CG-CD2 3.91Å; F134-L168 HydrophobicContact CZ-CD2 4.3Å; Y152-L168 WeakPolarHBondContact O-CB 3.32Å; Y152-L168 WeakPolarHBondContact O-CG 3.3Å; Y152-L168 PolarHBondContact O-N 3.26Å; F154-L168 HydrophobicContact CE1-CD2 4.01Å; F154-L168 HydrophobicContact CE1-CG 4.34Å
169	R	93	Very high	93.8	Very high	158 Å²	158	54.9 Å²	54.9	60%	0.596	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-30	173.5	-57.5	169.1	-69.2	-161.6	-1	111.9	Y152 D167	Y152-R169 HydrophobicContact CD1-CG 4.11Å; Y152-R169 HydrophobicContact CD2-CG 4.02Å; Y152-R169 HydrophobicContact CG-CG 3.7Å; D167-R169 PolarHBondContact O-N 2.87Å; D167-R169 WeakPolarHBondContact OD1-CB 3.39Å; D167-R169 WeakPolarHBondContact OD1-CG 3.22Å; D167-R169 IonicContact OD1-CZ 3.99Å; D167-R169 PolarHBondContact OD1-N 3.3Å; D167-R169 IonicContact OD1-NE 3.96Å; D167-R169 PolarHBondContact OD1-NE 2.98Å; D167-R169 IonicContact OD1-NH2 3.9Å; D167-R169 IonicContact OD2-CZ 2.83Å; D167-R169 VanDerWaalsContact OD2-CZ 3.32Å; D167-R169 IonicContact OD2-NE 2.67Å; D167-R169 PolarHBondContact OD2-NE 3.17Å; D167-R169 VanDerWaalsContact OD2-NE 3.15Å; D167-R169 IonicContact OD2-NH2 3.05Å; D167-R169 PolarHBondContact OD2-NH2 2.85Å
170	T	92.1	Very high	93.8	Very high	114 Å²	114	55.3 Å²	55.3	70%	0.699	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-41.2	178.6	-51	0	0	0	0	111.2	D167	D167-T170 PolarHBondContact O-N 3.35Å
171	K	93.4	Very high	93.9	Very high	47 Å²	47	55.5 Å²	55.5	20%	0.204	28%	0.278	C	S	.	.			trans	-159.9	139.2	177.2	55.4	178	-170	-175.1	0	112.8	F134 D167 C174 D182	F134-K171 HydrophobicContact CE1-CD 4.45Å; F134-K171 HydrophobicContact CE1-CG 4.18Å; F134-K171 WeakPolarHBondContact CZ-O 3.41Å; D167-K171 PolarHBondContact O-N 2.89Å; K171-C174 HydrophobicContact CD-CB 4.14Å; K171-C174 PolarHBondContact NZ-SG 2.82Å; K171-D182 WeakPolarHBondContact CE-OD1 3.5Å; K171-D182 IonicContact NZ-OD1 3.68Å; K171-D182 PolarHBondContact NZ-OD1 3.45Å; K171-D182 IonicContact NZ-OD2 3.51Å; K171-D182 PolarHBondContact NZ-OD2 3.08Å
172	T	95	Very high	94	Very high	53 Å²	53	55.8 Å²	55.8	33%	0.325	28%	0.28	S	S	.	.	S	Bend	trans	-99.1	-2.2	175.3	52.9	0	0	0	0	113.5	Y119 C132 F134	Y119-T172 HydrophobicContact CD1-CG2 4.07Å; Y119-T172 HydrophobicContact CE1-CG2 3.61Å; C132-T172 CarbonylContact C-O 3.55Å; C132-T172 WeakPolarHBondContact CA-O 3.35Å; F134-T172 VanDerWaalsContact CZ-C 3.44Å
173	S	96.1	Very high	94	Very high	48 Å²	48	56 Å²	56	34%	0.336	28%	0.281	S	S	.	.			trans	-155.3	163.3	175.1	65.4	0	0	0	0	111.2	Q131 Q133	Q131-S173 WeakPolarHBondContact O-CB 3.43Å; Q133-S173 CarbonylContact O-C 3.49Å; Q133-S173 VanDerWaalsContact O-CA 3.24Å; Q133-S173 WeakPolarHBondContact O-CA 3.5Å; Q133-S173 VanDerWaalsContact O-CB 3.27Å; Q133-S173 WeakPolarHBondContact O-CB 3.17Å
174	C	95.8	Very high	93.9	Very high	17 Å²	17	56.6 Å²	56.6	12%	0.115	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-161.4	111	170.2	-168	0	0	0	0	111	Q133 F134 T135 C136 K171	Q133-C174 PolarHBondContact O-N 2.92Å; F134-C174 WeakPolarHBondContact CA-O 3.14Å; F134-C174 HydrophobicContact CD1-CB 3.81Å; F134-C174 HydrophobicContact CE1-CB 4.47Å; T135-C174 PolarHBondContact N-O 2.99Å; C136-C174 VanDerWaalsContact SG-CB 3.57Å; K171-C174 HydrophobicContact CD-CB 4.14Å; K171-C174 PolarHBondContact NZ-SG 2.82Å
175	T	95.2	Very high	93.8	Very high	90 Å²	90	56.3 Å²	56.3	55%	0.552	28%	0.283	S	S	*	.			trans	-109.6	36.5	177.4	60.6	0	0	0	0	111.8	Q133 T135	Q133-T175 HydrophobicContact CG-CG2 4.03Å; T135-T175 HydrophobicContact CG2-CG2 4.39Å; T135-T175 WeakPolarHBondContact OG1-CA 3.35Å
176	K	93.9	Very high	93.7	Very high	102 Å²	102	55.8 Å²	55.8	44%	0.443	29%	0.285	S	S	.	.			trans	-84	119.5	-177.8	176.3	177.4	174.6	-177.9	0	109.6	D178 C179 D181	K176-D178 PolarHBondContact O-N 3.43Å; K176-C179 HydrophobicContact CB-CB 4.14Å; K176-C179 HydrophobicContact CD-CB 4.49Å; K176-C179 HydrophobicContact CG-CB 4.29Å; K176-C179 VanDerWaalsContact O-CB 3.29Å; K176-C179 WeakPolarHBondContact O-CB 3.23Å; K176-C179 PolarHBondContact O-N 3.15Å; K176-D181 WeakPolarHBondContact CD-OD2 3.2Å; K176-D181 IonicContact NZ-OD1 2.57Å; K176-D181 PolarHBondContact NZ-OD1 3.21Å; K176-D181 IonicContact NZ-OD2 2.89Å; K176-D181 PolarHBondContact NZ-OD2 3.23Å
177	E	91.3	Very high	93.4	Very high	172 Å²	172	55.8 Å²	55.8	80%	0.804	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	136.6	171.7	-67	-58.5	156.9	0	0	111.1	C179	E177-C179 PolarHBondContact O-N 2.81Å; E177-C179 VanDerWaalsContact O-N 3.08Å
178	D	89.9	Confident	93.1	Very high	124 Å²	124	63.1 Å²	63.1	66%	0.663	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	30.1	175.8	-141.9	12.6	0	0	0	113.8	K176 K180	K176-D178 PolarHBondContact O-N 3.43Å; D178-K180 VanDerWaalsContact O-CD 3.27Å; D178-K180 WeakPolarHBondContact O-CD 3.39Å; D178-K180 VanDerWaalsContact O-CE 3.23Å; D178-K180 WeakPolarHBondContact O-CE 3.34Å; D178-K180 WeakPolarHBondContact O-CG 3.49Å; D178-K180 PolarHBondContact O-N 2.93Å; D178-K180 WeakPolarHBondContact OD1-CE 3.36Å; D178-K180 IonicContact OD1-NZ 2.68Å; D178-K180 PolarHBondContact OD1-NZ 3.43Å; D178-K180 IonicContact OD2-NZ 3.96Å; D178-K180 PolarHBondContact OD2-NZ 3.1Å
179	C	93.6	Very high	92.9	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.02	32%	0.322	C	S	.	.			trans	-54.4	119.6	-174.4	-177.3	0	0	0	0	112.4	C136 R164 K176 E177 D182	C136-C179 HydrophobicContact CB-CB 4.07Å; R164-C179 PolarHBondContact NH1-O 3.19Å; K176-C179 HydrophobicContact CB-CB 4.14Å; K176-C179 HydrophobicContact CD-CB 4.49Å; K176-C179 HydrophobicContact CG-CB 4.29Å; K176-C179 VanDerWaalsContact O-CB 3.29Å; K176-C179 WeakPolarHBondContact O-CB 3.23Å; K176-C179 PolarHBondContact O-N 3.15Å; E177-C179 PolarHBondContact O-N 2.81Å; E177-C179 VanDerWaalsContact O-N 3.08Å; C179-D182 PolarHBondContact SG-OD2 2.89Å
180	K	92.9	Very high	92.7	Very high	76 Å²	76	59.6 Å²	59.6	33%	0.33	30%	0.299	S	S	.	.			trans	-115.8	8.1	177.1	-72.2	140.1	-166.6	169.8	0	112.7	D178 I183 R224	D178-K180 VanDerWaalsContact O-CD 3.27Å; D178-K180 WeakPolarHBondContact O-CD 3.39Å; D178-K180 VanDerWaalsContact O-CE 3.23Å; D178-K180 WeakPolarHBondContact O-CE 3.34Å; D178-K180 WeakPolarHBondContact O-CG 3.49Å; D178-K180 PolarHBondContact O-N 2.93Å; D178-K180 WeakPolarHBondContact OD1-CE 3.36Å; D178-K180 IonicContact OD1-NZ 2.68Å; D178-K180 PolarHBondContact OD1-NZ 3.43Å; D178-K180 IonicContact OD2-NZ 3.96Å; D178-K180 PolarHBondContact OD2-NZ 3.1Å; K180-I183 HydrophobicContact CB-CD1 3.94Å; K180-I183 HydrophobicContact CG-CD1 3.86Å; K180-R224 VanDerWaalsContact O-CD 3.3Å; K180-R224 WeakPolarHBondContact O-CD 3.34Å
181	D	93	Very high	92.8	Very high	44 Å²	44	54.1 Å²	54.1	24%	0.235	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-40.3	-165.3	-56.8	-12.2	0	0	0	111.9	K176 T223 R224 A225	K176-D181 WeakPolarHBondContact CD-OD2 3.2Å; K176-D181 IonicContact NZ-OD1 2.57Å; K176-D181 PolarHBondContact NZ-OD1 3.21Å; K176-D181 IonicContact NZ-OD2 2.89Å; K176-D181 PolarHBondContact NZ-OD2 3.23Å; D181-T223 WeakPolarHBondContact O-CB 3.5Å; D181-R224 PolarHBondContact O-N 2.84Å; D181-A225 HydrophobicContact CB-CB 4.49Å; D181-A225 PolarHBondContact O-N 3.27Å
182	D	94.1	Very high	92.7	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.032	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	3.3	-173.7	-45.7	-70.2	0	0	0	114.2	R164 W165 F166 K171 C179 L184	R164-D182 CarbonylContact C-O 3.52Å; R164-D182 VanDerWaalsContact CA-O 3.25Å; R164-D182 WeakPolarHBondContact CA-O 3.41Å; R164-D182 HydrophobicContact CB-CB 4.39Å; W165-D182 PolarHBondContact N-O 3.16Å; F166-D182 HydrophobicContact CD1-CB 3.98Å; F166-D182 HydrophobicContact CE1-CB 3.71Å; F166-D182 VanDerWaalsContact CE1-CG 3.45Å; F166-D182 WeakPolarHBondContact CE1-OD2 3.44Å; F166-D182 HydrophobicContact CZ-CB 4.16Å; K171-D182 WeakPolarHBondContact CE-OD1 3.5Å; K171-D182 IonicContact NZ-OD1 3.68Å; K171-D182 PolarHBondContact NZ-OD1 3.45Å; K171-D182 IonicContact NZ-OD2 3.51Å; K171-D182 PolarHBondContact NZ-OD2 3.08Å; C179-D182 PolarHBondContact SG-OD2 2.89Å; D182-L184 PolarHBondContact O-N 3.07Å
183	I	94.5	Very high	92.7	Very high	10 Å²	10	50 Å²	50	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	116.9	-176.3	-60.4	175.1	0	0	0	109.3	T162 R164 K180 Y229	T162-I183 HydrophobicContact CG2-CD1 3.94Å; T162-I183 HydrophobicContact CG2-CG1 4.13Å; T162-I183 HydrophobicContact CG2-CG2 4.05Å; R164-I183 HydrophobicContact CG-CG1 4.45Å; K180-I183 HydrophobicContact CB-CD1 3.94Å; K180-I183 HydrophobicContact CG-CD1 3.86Å; I183-Y229 HydrophobicContact CB-CE2 4.24Å; I183-Y229 HydrophobicContact CG2-CE2 3.94Å; I183-Y229 VanDerWaalsContact O-CD2 3.29Å; I183-Y229 WeakPolarHBondContact O-CD2 3.46Å; I183-Y229 WeakPolarHBondContact O-CE2 3.4Å
184	L	93.8	Very high	92.7	Very high	12 Å²	12	47.8 Å²	47.8	6%	0.063	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-42.6	178.1	-171.3	76.1	0	0	0	111.3	L155 V163 W165 D182 L204 L221 T223	L155-L184 HydrophobicContact CD2-CD2 3.89Å; V163-L184 PolarHBondContact O-N 3.21Å; W165-L184 HydrophobicContact CB-CB 4.06Å; W165-L184 HydrophobicContact CB-CD1 4.28Å; W165-L184 HydrophobicContact CB-CD2 4.17Å; W165-L184 HydrophobicContact CB-CG 4.39Å; W165-L184 HydrophobicContact CE3-CD1 4.38Å; D182-L184 PolarHBondContact O-N 3.07Å; L184-L204 HydrophobicContact CD2-CD2 4.47Å; L184-L221 HydrophobicContact CD1-CB 3.71Å; L184-L221 HydrophobicContact CD1-CD1 4.49Å; L184-L221 HydrophobicContact CD2-CD1 3.98Å; L184-L221 HydrophobicContact CG-CB 4Å; L184-L221 HydrophobicContact CG-CD1 3.89Å; L184-T223 HydrophobicContact CB-CG2 4.19Å; L184-T223 HydrophobicContact CD1-CG2 3.92Å
185	I	93.3	Very high	92.7	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.2	177.8	-53.7	168.9	0	0	0	108.8	T162 V163 L204 V206 Y216 L221	T162-I185 CarbonylContact C-O 3.58Å; T162-I185 VanDerWaalsContact CA-O 3.32Å; T162-I185 WeakPolarHBondContact CA-O 3.24Å; V163-I185 HydrophobicContact CB-CB 4.06Å; V163-I185 HydrophobicContact CB-CD1 4.3Å; V163-I185 HydrophobicContact CB-CG1 4.42Å; V163-I185 HydrophobicContact CG2-CB 4.32Å; V163-I185 HydrophobicContact CG2-CD1 4.4Å; V163-I185 PolarHBondContact N-O 2.91Å; V163-I185 PolarHBondContact O-N 2.88Å; I185-L204 HydrophobicContact CD1-CD2 3.78Å; I185-V206 HydrophobicContact CD1-CG2 3.97Å; I185-Y216 HydrophobicContact CD1-CD1 4.22Å; I185-Y216 HydrophobicContact CD1-CD2 3.69Å; I185-Y216 HydrophobicContact CD1-CE2 4.05Å; I185-Y216 HydrophobicContact CD1-CG 3.78Å; I185-Y216 HydrophobicContact CG2-CD1 4.49Å; I185-Y216 HydrophobicContact CG2-CE1 3.86Å; I185-Y216 HydrophobicContact CG2-CE2 3.93Å; I185-L221 HydrophobicContact CD1-CD1 3.83Å; I185-L221 HydrophobicContact CG1-CD1 3.58Å
186	N	92.3	Very high	92.7	Very high	51 Å²	51	43.5 Å²	43.5	27%	0.273	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.2	166.3	-174.4	-47.2	0	0	0	109.3	R188 G233	N186-R188 VanDerWaalsContact C-N 3.31Å; N186-R188 WeakPolarHBondContact OD1-CA 3.3Å; N186-R188 PolarHBondContact OD1-N 3.47Å; N186-G233 WeakPolarHBondContact O-CA 3.39Å
187	C	89.4	Confident	92.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.182	C	C	.	.			trans	-81.5	-8.8	-178	-64.2	0	0	0	0	113.5	G161 R189 R214	G161-C187 WeakPolarHBondContact O-CA 3.37Å; G161-C187 WeakPolarHBondContact O-CB 3.43Å; G161-C187 PolarHBondContact O-N 3.31Å; C187-R189 WeakPolarHBondContact CB-O 3.44Å; C187-R189 PolarHBondContact O-N 3.03Å; C187-R189 VanDerWaalsContact O-N 3.1Å; C187-R214 PolarHBondContact O-NH1 2.96Å; C187-R214 PolarHBondContact O-NH2 2.92Å; C187-R214 VanDerWaalsContact O-NH2 3.11Å
188	R	87.8	Confident	92.4	Very high	180 Å²	180	31.9 Å²	31.9	68%	0.679	15%	0.152	S	C	*	.	S	Bend	trans	60.9	-2	-170.7	-55.5	-179.7	175.2	-176.1	-2.5	116	N186	N186-R188 VanDerWaalsContact C-N 3.31Å; N186-R188 WeakPolarHBondContact OD1-CA 3.3Å; N186-R188 PolarHBondContact OD1-N 3.47Å
189	R	89.8	Confident	92.2	Very high	82 Å²	82	31.6 Å²	31.6	31%	0.309	15%	0.15	S	C	.	.	S	Bend	trans	-149.1	146.9	-176.9	-66.7	-68.3	-179.5	-179.6	-4.7	107.4	G161 C187 A191 D210 L298	G161-R189 WeakPolarHBondContact CA-O 3.34Å; C187-R189 WeakPolarHBondContact CB-O 3.44Å; C187-R189 PolarHBondContact O-N 3.03Å; C187-R189 VanDerWaalsContact O-N 3.1Å; R189-A191 PolarHBondContact O-N 2.86Å; R189-D210 HydrophobicContact CB-CB 4.45Å; R189-D210 HydrophobicContact CG-CB 4.12Å; R189-L298 PolarHBondContact NH1-O 2.85Å; R189-L298 PolarHBondContact NH2-O 2.85Å
190	A	90.3	Very high	91.9	Very high	16 Å²	16	33.4 Å²	33.4	13%	0.132	16%	0.16	C	C	.	.			trans	-44.3	127.5	-175.6	0	0	0	0	0	112	Y142 T192 C208 S209	Y142-A190 HydrophobicContact CE2-CB 4.42Å; A190-T192 HydrophobicContact CB-CG2 4.27Å; A190-C208 CarbonylContact O-C 3.55Å; A190-C208 WeakPolarHBondContact O-CA 3.45Å; A190-S209 PolarHBondContact N-OG 2.87Å; A190-S209 PolarHBondContact O-N 3.02Å
191	A	94.1	Very high	91.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	109.5	-179.7	0	0	0	0	0	107.5	C157 G158 V163 R189 V206	C157-A191 CarbonylContact C-O 3.57Å; C157-A191 HydrophobicContact CB-CB 3.79Å; C157-A191 WeakPolarHBondContact CB-O 3.39Å; C157-A191 PolarHBondContact SG-O 3.23Å; G158-A191 PolarHBondContact N-O 2.75Å; G158-A191 PolarHBondContact O-N 3.36Å; V163-A191 HydrophobicContact CG2-CB 4.12Å; R189-A191 PolarHBondContact O-N 2.86Å; A191-V206 HydrophobicContact CB-CG1 4Å
192	T	91.8	Very high	91.5	Very high	12 Å²	12	32.9 Å²	32.9	7%	0.074	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-15.9	-159.5	47	0	0	0	0	114.4	Y142 A190 G207 R252 V253	Y142-T192 HydrophobicContact CD2-CG2 3.77Å; Y142-T192 HydrophobicContact CE2-CG2 3.69Å; Y142-T192 HydrophobicContact CG-CG2 4.42Å; A190-T192 HydrophobicContact CB-CG2 4.27Å; T192-G207 PolarHBondContact N-O 2.66Å; T192-G207 PolarHBondContact OG1-O 3.25Å; T192-R252 HydrophobicContact CG2-CG 3.91Å; T192-V253 WeakPolarHBondContact CB-O 3.48Å; T192-V253 PolarHBondContact OG1-O 3.12Å
193	S	93.7	Very high	91.4	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.014	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	151.4	168.8	-176.3	0	0	0	0	111	E143 G207 L256	E143-S193 WeakPolarHBondContact OE2-CA 3.43Å; E143-S193 VanDerWaalsContact OE2-CB 3.28Å; E143-S193 WeakPolarHBondContact OE2-CB 3.28Å; E143-S193 PolarHBondContact OE2-OG 2.8Å; S193-G207 PolarHBondContact O-N 3.38Å; S193-L256 PolarHBondContact OG-N 2.77Å
194	I	96.4	Very high	91.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	137.7	-176.7	49.2	171.4	0	0	0	111.7	E143 M145 L155 C157 V163 L204 A205 V206	E143-I194 HydrophobicContact CB-CG1 4.23Å; E143-I194 HydrophobicContact CG-CG1 4.01Å; E143-I194 PolarHBondContact OE2-N 3.02Å; M145-I194 HydrophobicContact CB-CD1 4.02Å; M145-I194 HydrophobicContact CB-CG1 4.29Å; M145-I194 HydrophobicContact CE-CB 3.79Å; M145-I194 HydrophobicContact CE-CD1 4.04Å; M145-I194 HydrophobicContact CE-CG1 3.9Å; L155-I194 HydrophobicContact CB-CD1 3.92Å; C157-I194 HydrophobicContact CB-CD1 4.36Å; C157-I194 HydrophobicContact CB-CG2 3.85Å; V163-I194 HydrophobicContact CG1-CG2 4.35Å; V163-I194 HydrophobicContact CG2-CG2 4.14Å; I194-L204 HydrophobicContact CB-CD1 4.29Å; I194-A205 WeakPolarHBondContact CA-O 3.17Å; I194-V206 HydrophobicContact CG2-CB 4.4Å; I194-V206 HydrophobicContact CG2-CG1 4.05Å; I194-V206 HydrophobicContact CG2-CG2 4.17Å
195	S	95.8	Very high	91.5	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.028	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.1	174.4	-168.6	0	0	0	0	111.9	M145 A205 L256 Y258	M145-S195 VanDerWaalsContact SD-CA 3.59Å; S195-A205 PolarHBondContact N-O 2.99Å; S195-A205 PolarHBondContact O-N 2.8Å; S195-L256 VanDerWaalsContact CB-CD2 3.4Å; S195-Y258 WeakPolarHBondContact O-CE2 3.46Å; S195-Y258 PolarHBondContact OG-N 3Å
196	I	94.2	Very high	91.6	Very high	12 Å²	12	35 Å²	35	6%	0.062	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140.8	173.5	-76	165	0	0	0	108.7	M145 V147 P148 L155 P201 Y203 L204	M145-I196 HydrophobicContact CE-CB 4.31Å; M145-I196 HydrophobicContact CE-CD1 3.96Å; M145-I196 HydrophobicContact CE-CG1 3.64Å; M145-I196 HydrophobicContact CG-CD1 4.32Å; M145-I196 HydrophobicContact SD-CB 3.87Å; M145-I196 HydrophobicContact SD-CD1 3.95Å; M145-I196 HydrophobicContact SD-CG1 3.78Å; M145-I196 PolarHBondContact SD-N 3.33Å; V147-I196 HydrophobicContact CG2-CD1 4.08Å; P148-I196 HydrophobicContact CG-CG2 4.28Å; L155-I196 HydrophobicContact CD1-CD1 3.96Å; L155-I196 HydrophobicContact CD1-CG1 4.47Å; I196-P201 HydrophobicContact CG2-CB 3.97Å; I196-Y203 WeakPolarHBondContact CA-O 3.49Å; I196-L204 HydrophobicContact CG1-CD1 4.06Å
197	S	91.9	Very high	91.7	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.021	15%	0.151	C	C	.	.			trans	-67.8	124.9	174.8	177.7	0	0	0	0	110.7	L199 V200 P201 Y203	S197-L199 PolarHBondContact O-N 3.48Å; S197-V200 CarbonylContact O-C 3.5Å; S197-V200 VanDerWaalsContact O-C 3.23Å; S197-V200 PolarHBondContact O-N 3.44Å; S197-V200 VanDerWaalsContact O-N 3.16Å; S197-P201 WeakPolarHBondContact O-CA 3.28Å; S197-Y203 PolarHBondContact N-O 3.32Å
198	P	87.4	Confident	91.9	Very high	27 Å²	27	32.6 Å²	32.6	18%	0.175	15%	0.151	C	C	.	.	S	Bend	trans	-68.7	-32.8	-171	26.1	-34.4	0	0	0	113.2	S259 G260 I563	P198-S259 VanDerWaalsContact CG-O 3.3Å; P198-S259 WeakPolarHBondContact CG-O 3.23Å; P198-G260 WeakPolarHBondContact CG-O 3.26Å; P198-I563 HydrophobicContact CB-CD1 4.33Å; P198-I563 HydrophobicContact CG-CD1 4.33Å
199	L	85.5	Confident	91.9	Very high	119 Å²	119	25.5 Å²	25.5	62%	0.623	13%	0.13	S	C	*	.	S	Bend	trans	-85.6	-18	174.4	-60	-165.5	0	0	0	113	S197 D261	S197-L199 PolarHBondContact O-N 3.48Å; L199-D261 HydrophobicContact CD1-CB 4.34Å; L199-D261 WeakPolarHBondContact CD1-O 3.12Å
200	V	88.6	Confident	91.8	Very high	40 Å²	40	23.1 Å²	23.1	24%	0.242	12%	0.123	C	C	.	.			trans	-136.4	71.9	-171.9	-165.3	0	0	0	0	110.5	S197 Y202 Y203	S197-V200 CarbonylContact O-C 3.5Å; S197-V200 VanDerWaalsContact O-C 3.23Å; S197-V200 PolarHBondContact O-N 3.44Å; S197-V200 VanDerWaalsContact O-N 3.16Å; V200-Y202 HydrophobicContact CG1-CD1 3.88Å; V200-Y202 HydrophobicContact CG1-CD2 4.01Å; V200-Y202 HydrophobicContact CG1-CE1 3.37Å; V200-Y202 HydrophobicContact CG1-CE2 3.52Å; V200-Y202 HydrophobicContact CG1-CG 4.18Å; V200-Y202 PolarHBondContact O-N 3.15Å; V200-Y203 HydrophobicContact CB-CD2 3.97Å; V200-Y203 HydrophobicContact CG1-CD2 3.46Å; V200-Y203 VanDerWaalsContact CG1-CD2 3.46Å; V200-Y203 HydrophobicContact CG1-CE2 3.8Å; V200-Y203 HydrophobicContact CG1-CG 4.39Å; V200-Y203 PolarHBondContact O-N 3.02Å
201	P	87.5	Confident	91.7	Very high	33 Å²	33	22.4 Å²	22.4	21%	0.214	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-2.1	-163.9	-24.3	36.7	0	0	0	116.8	P148 I196 S197 R218	P148-P201 HydrophobicContact CB-CB 4.44Å; P148-P201 HydrophobicContact CB-CG 4.41Å; I196-P201 HydrophobicContact CG2-CB 3.97Å; S197-P201 WeakPolarHBondContact O-CA 3.28Å; P201-R218 PolarHBondContact O-NH1 2.95Å
202	Y	89.1	Confident	91.6	Very high	77 Å²	77	22.4 Å²	22.4	30%	0.302	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.4	169.3	56.3	-99.6	0	0	0	113.3	V200 R218 R219	V200-Y202 HydrophobicContact CG1-CD1 3.88Å; V200-Y202 HydrophobicContact CG1-CD2 4.01Å; V200-Y202 HydrophobicContact CG1-CE1 3.37Å; V200-Y202 HydrophobicContact CG1-CE2 3.52Å; V200-Y202 HydrophobicContact CG1-CG 4.18Å; V200-Y202 PolarHBondContact O-N 3.15Å; Y202-R218 WeakPolarHBondContact O-CB 3.07Å; Y202-R218 VanDerWaalsContact O-CG 3.31Å; Y202-R218 WeakPolarHBondContact O-CG 3.38Å; Y202-R218 PolarHBondContact O-N 2.83Å; Y202-R219 HydrophobicContact CG-CG 4.41Å
203	Y	92.8	Very high	91.6	Very high	76 Å²	76	21.8 Å²	21.8	30%	0.298	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122	172.8	-72.1	-49.7	0	0	0	111.7	I196 S197 V200 I215 Y216 D217	I196-Y203 WeakPolarHBondContact CA-O 3.49Å; S197-Y203 PolarHBondContact N-O 3.32Å; V200-Y203 HydrophobicContact CB-CD2 3.97Å; V200-Y203 HydrophobicContact CG1-CD2 3.46Å; V200-Y203 VanDerWaalsContact CG1-CD2 3.46Å; V200-Y203 HydrophobicContact CG1-CE2 3.8Å; V200-Y203 HydrophobicContact CG1-CG 4.39Å; V200-Y203 PolarHBondContact O-N 3.02Å; Y203-I215 HydrophobicContact CD1-CG2 4.04Å; Y203-I215 HydrophobicContact CG-CG2 4.39Å; Y203-Y216 WeakPolarHBondContact CA-O 3.33Å; Y203-D217 HydrophobicContact CD1-CB 4.33Å; Y203-D217 HydrophobicContact CE1-CB 4.15Å
204	L	94.8	Very high	91.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	114.6	178.6	171.8	61.2	0	0	0	109.2	M145 L155 V163 L184 I185 I194 I196 V206 I215 Y216 R218	M145-L204 HydrophobicContact CE-CD1 3.62Å; L155-L204 HydrophobicContact CD1-CD1 3.86Å; L155-L204 HydrophobicContact CD1-CD2 3.78Å; L155-L204 HydrophobicContact CD1-CG 4.45Å; V163-L204 HydrophobicContact CG1-CD2 4.46Å; L184-L204 HydrophobicContact CD2-CD2 4.47Å; I185-L204 HydrophobicContact CD1-CD2 3.78Å; I194-L204 HydrophobicContact CB-CD1 4.29Å; I196-L204 HydrophobicContact CG1-CD1 4.06Å; L204-V206 HydrophobicContact CD2-CG2 4.49Å; L204-V206 HydrophobicContact CG-CG2 4.08Å; L204-I215 WeakPolarHBondContact O-CA 3.46Å; L204-Y216 PolarHBondContact N-O 2.71Å; L204-Y216 PolarHBondContact O-N 3.1Å; L204-R218 HydrophobicContact CB-CG 3.75Å; L204-R218 HydrophobicContact CD2-CG 4.08Å
205	A	95.6	Very high	91.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	137	169.6	0	0	0	0	0	110	I194 S195 R214 I215 L256 Y258	I194-A205 WeakPolarHBondContact CA-O 3.17Å; S195-A205 PolarHBondContact N-O 2.99Å; S195-A205 PolarHBondContact O-N 2.8Å; A205-R214 CarbonylContact C-O 3.6Å; A205-R214 WeakPolarHBondContact CA-O 3.29Å; A205-I215 HydrophobicContact CB-CG1 4.17Å; A205-L256 HydrophobicContact CB-CD1 4.18Å; A205-L256 HydrophobicContact CB-CD2 3.52Å; A205-L256 HydrophobicContact CB-CG 4.44Å; A205-Y258 HydrophobicContact CB-CD2 4.38Å; A205-Y258 HydrophobicContact CB-CE2 3.5Å
206	V	95.8	Very high	91.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.5	-179.8	-172.5	0	0	0	0	108.8	V163 I185 A191 I194 L204 V213 R214 Y216	V163-V206 HydrophobicContact CG2-CG1 3.75Å; V163-V206 HydrophobicContact CG2-CG2 4Å; I185-V206 HydrophobicContact CD1-CG2 3.97Å; A191-V206 HydrophobicContact CB-CG1 4Å; I194-V206 HydrophobicContact CG2-CB 4.4Å; I194-V206 HydrophobicContact CG2-CG1 4.05Å; I194-V206 HydrophobicContact CG2-CG2 4.17Å; L204-V206 HydrophobicContact CD2-CG2 4.49Å; L204-V206 HydrophobicContact CG-CG2 4.08Å; V206-V213 WeakPolarHBondContact O-CA 3.26Å; V206-R214 PolarHBondContact N-O 3.21Å; V206-R214 PolarHBondContact O-N 2.73Å; V206-Y216 HydrophobicContact CB-CE2 4.47Å; V206-Y216 HydrophobicContact CG2-CD2 4.01Å; V206-Y216 HydrophobicContact CG2-CE2 4.15Å
207	G	94.3	Very high	91.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.5	169.3	0	0	0	0	0	111.1	T192 S193	T192-G207 PolarHBondContact N-O 2.66Å; T192-G207 PolarHBondContact OG1-O 3.25Å; S193-G207 PolarHBondContact O-N 3.38Å
208	C	92.1	Very high	91.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	165.6	-176.5	-64	0	0	0	0	112.4	A190 D210 S212 V253	A190-C208 CarbonylContact O-C 3.55Å; A190-C208 WeakPolarHBondContact O-CA 3.45Å; C208-D210 VanDerWaalsContact C-N 3.3Å; C208-D210 WeakPolarHBondContact CB-OD1 3.39Å; C208-D210 PolarHBondContact O-N 3.26Å; C208-S212 PolarHBondContact N-O 3.44Å; C208-V253 PolarHBondContact O-N 3.21Å
209	S	89.4	Confident	91.2	Very high	32 Å²	32	30.9 Å²	30.9	22%	0.224	14%	0.143	C	C	.	.	S	Bend	trans	-75.9	-9.4	174.5	64.1	0	0	0	0	115.2	A190 S211	A190-S209 PolarHBondContact N-OG 2.87Å; A190-S209 PolarHBondContact O-N 3.02Å; S209-S211 PolarHBondContact O-N 3.41Å
210	D	87.1	Confident	91.4	Very high	32 Å²	32	30.6 Å²	30.6	17%	0.171	14%	0.14	C	C	.	.	S	Bend	trans	-87.5	32	174.1	71.7	-35.8	0	0	0	113.3	R189 C208 S212 R214 R240	R189-D210 HydrophobicContact CB-CB 4.45Å; R189-D210 HydrophobicContact CG-CB 4.12Å; C208-D210 VanDerWaalsContact C-N 3.3Å; C208-D210 WeakPolarHBondContact CB-OD1 3.39Å; C208-D210 PolarHBondContact O-N 3.26Å; D210-S212 VanDerWaalsContact CG-OG 3.25Å; D210-S212 PolarHBondContact O-N 3.29Å; D210-S212 WeakPolarHBondContact OD1-CB 3.41Å; D210-S212 PolarHBondContact OD1-OG 3.49Å; D210-S212 PolarHBondContact OD2-OG 3.4Å; D210-R214 VanDerWaalsContact CG-NH2 3.33Å; D210-R214 IonicContact OD1-NH2 2.75Å; D210-R214 PolarHBondContact OD1-NH2 3.38Å; D210-R214 IonicContact OD2-CZ 2.93Å; D210-R214 IonicContact OD2-NH2 3.69Å; D210-R214 PolarHBondContact OD2-NH2 3.28Å; D210-R240 IonicContact OD2-CZ 3.66Å; D210-R240 VanDerWaalsContact OD2-CZ 3.29Å; D210-R240 IonicContact OD2-NH1 3.47Å; D210-R240 PolarHBondContact OD2-NH1 3.18Å; D210-R240 IonicContact OD2-NH2 2.91Å; D210-R240 PolarHBondContact OD2-NH2 2.89Å
211	S	88.7	Confident	91.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	53.4	8.5	-171.3	-62.2	0	0	0	0	116.2	S209 K249 C251 Y269	S209-S211 PolarHBondContact O-N 3.41Å; S211-K249 PolarHBondContact OG-O 3.23Å; S211-C251 WeakPolarHBondContact CA-O 3.33Å; S211-C251 WeakPolarHBondContact CB-O 3.5Å; S211-C251 PolarHBondContact N-O 3.47Å; S211-C251 WeakPolarHBondContact OG-CA 3.33Å; S211-C251 WeakPolarHBondContact OG-CB 3.26Å; S211-C251 PolarHBondContact OG-N 3.14Å; S211-C251 PolarHBondContact OG-O 2.66Å; S211-Y269 VanDerWaalsContact O-CE1 3.28Å; S211-Y269 WeakPolarHBondContact O-CE1 3.14Å; S211-Y269 PolarHBondContact O-OH 2.89Å
212	S	90.8	Very high	91.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.129	C	C	.	.			trans	-95	141.3	-176.6	77.3	0	0	0	0	113.4	C208 D210 R214 R240 F241	C208-S212 PolarHBondContact N-O 3.44Å; D210-S212 VanDerWaalsContact CG-OG 3.25Å; D210-S212 PolarHBondContact O-N 3.29Å; D210-S212 WeakPolarHBondContact OD1-CB 3.41Å; D210-S212 PolarHBondContact OD1-OG 3.49Å; D210-S212 PolarHBondContact OD2-OG 3.4Å; S212-R214 PolarHBondContact OG-NE 3.24Å; S212-R214 PolarHBondContact OG-NH2 2.92Å; S212-R240 PolarHBondContact OG-NH1 3.37Å; S212-R240 VanDerWaalsContact OG-NH1 3.12Å; S212-F241 WeakPolarHBondContact CA-O 3.36Å
213	V	92.9	Very high	91.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.9	163.8	167.2	0	0	0	0	107.7	V206 R240 F241 V253 L256 V267	V206-V213 WeakPolarHBondContact O-CA 3.26Å; V213-R240 CarbonylContact O-C 3.59Å; V213-R240 VanDerWaalsContact O-CA 3.31Å; V213-R240 WeakPolarHBondContact O-CA 3.37Å; V213-F241 HydrophobicContact CB-CB 4.39Å; V213-F241 HydrophobicContact CG1-CD2 4.39Å; V213-F241 PolarHBondContact N-O 3.28Å; V213-F241 PolarHBondContact O-N 3.39Å; V213-V253 HydrophobicContact CG2-CG2 3.89Å; V213-L256 HydrophobicContact CB-CD1 4.09Å; V213-L256 HydrophobicContact CG1-CD1 3.4Å; V213-L256 HydrophobicContact CG2-CD1 3.58Å; V213-V267 HydrophobicContact CG2-CB 4.41Å; V213-V267 HydrophobicContact CG2-CG1 3.6Å; V213-V267 HydrophobicContact CG2-CG2 3.92Å
214	R	92.9	Very high	91.5	Very high	17 Å²	17	27.9 Å²	27.9	6%	0.064	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.1	-173.9	-56.5	178.2	-156.9	173.1	10.3	109.4	C187 A205 V206 D210 S212 Y216 M237 V239 R240	C187-R214 PolarHBondContact O-NH1 2.96Å; C187-R214 PolarHBondContact O-NH2 2.92Å; C187-R214 VanDerWaalsContact O-NH2 3.11Å; A205-R214 CarbonylContact C-O 3.6Å; A205-R214 WeakPolarHBondContact CA-O 3.29Å; V206-R214 PolarHBondContact N-O 3.21Å; V206-R214 PolarHBondContact O-N 2.73Å; D210-R214 VanDerWaalsContact CG-NH2 3.33Å; D210-R214 IonicContact OD1-NH2 2.75Å; D210-R214 PolarHBondContact OD1-NH2 3.38Å; D210-R214 IonicContact OD2-CZ 2.93Å; D210-R214 IonicContact OD2-NH2 3.69Å; D210-R214 PolarHBondContact OD2-NH2 3.28Å; S212-R214 PolarHBondContact OG-NE 3.24Å; S212-R214 PolarHBondContact OG-NH2 2.92Å; R214-Y216 HydrophobicContact CB-CD2 4.16Å; R214-Y216 HydrophobicContact CB-CE2 3.46Å; R214-Y216 VanDerWaalsContact CB-CE2 3.46Å; R214-Y216 WeakPolarHBondContact CD-OH 3.5Å; R214-M237 HydrophobicContact CB-SD 4.3Å; R214-M237 HydrophobicContact CG-SD 4.26Å; R214-V239 CarbonylContact C-O 3.53Å; R214-V239 WeakPolarHBondContact CA-O 3.39Å; R214-R240 HydrophobicContact CG-CB 4.48Å; R214-R240 HydrophobicContact CG-CG 4.26Å
215	I	93.5	Very high	91	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.1	175.9	-59.6	179.2	0	0	0	108.3	Y203 L204 A205 M237 C238 V239 F241 Y258 V265 P279	Y203-I215 HydrophobicContact CD1-CG2 4.04Å; Y203-I215 HydrophobicContact CG-CG2 4.39Å; L204-I215 WeakPolarHBondContact O-CA 3.46Å; A205-I215 HydrophobicContact CB-CG1 4.17Å; I215-M237 CarbonylContact O-C 3.5Å; I215-M237 WeakPolarHBondContact O-CA 3.42Å; I215-C238 PolarHBondContact O-N 3.01Å; I215-V239 HydrophobicContact CB-CB 4.19Å; I215-V239 HydrophobicContact CB-CG2 4.44Å; I215-V239 HydrophobicContact CD1-CB 4.41Å; I215-V239 HydrophobicContact CG1-CB 4.5Å; I215-V239 PolarHBondContact N-O 2.69Å; I215-V239 PolarHBondContact O-N 2.95Å; I215-F241 HydrophobicContact CD1-CE2 3.98Å; I215-Y258 WeakPolarHBondContact CG2-OH 3.28Å; I215-V265 HydrophobicContact CD1-CG2 4.26Å; I215-P279 HydrophobicContact CD1-CB 3.52Å
216	Y	93	Very high	90.4	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.4	179.3	-65.9	-96.6	0	0	0	111	I185 Y203 L204 V206 R214 L221 G233 T235 G236 M237	I185-Y216 HydrophobicContact CD1-CD1 4.22Å; I185-Y216 HydrophobicContact CD1-CD2 3.69Å; I185-Y216 HydrophobicContact CD1-CE2 4.05Å; I185-Y216 HydrophobicContact CD1-CG 3.78Å; I185-Y216 HydrophobicContact CG2-CD1 4.49Å; I185-Y216 HydrophobicContact CG2-CE1 3.86Å; I185-Y216 HydrophobicContact CG2-CE2 3.93Å; Y203-Y216 WeakPolarHBondContact CA-O 3.33Å; L204-Y216 PolarHBondContact N-O 2.71Å; L204-Y216 PolarHBondContact O-N 3.1Å; V206-Y216 HydrophobicContact CB-CE2 4.47Å; V206-Y216 HydrophobicContact CG2-CD2 4.01Å; V206-Y216 HydrophobicContact CG2-CE2 4.15Å; R214-Y216 HydrophobicContact CB-CD2 4.16Å; R214-Y216 HydrophobicContact CB-CE2 3.46Å; R214-Y216 VanDerWaalsContact CB-CE2 3.46Å; R214-Y216 WeakPolarHBondContact CD-OH 3.5Å; Y216-L221 HydrophobicContact CD1-CD2 4.47Å; Y216-G233 WeakPolarHBondContact CE1-O 3.2Å; Y216-G233 PolarHBondContact OH-O 3.26Å; Y216-T235 WeakPolarHBondContact CD1-O 3.31Å; Y216-G236 CarbonylContact C-O 3.57Å; Y216-G236 WeakPolarHBondContact CA-O 3.38Å; Y216-M237 HydrophobicContact CD1-CB 3.8Å; Y216-M237 HydrophobicContact CD1-CG 4.32Å; Y216-M237 HydrophobicContact CE1-CB 3.58Å; Y216-M237 HydrophobicContact CE1-CG 3.99Å
217	D	91.8	Very high	89.7	Confident	10 Å²	10	37.4 Å²	37.4	5%	0.053	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	109.3	163.5	-172.9	-20.9	0	0	0	109.7	Y203 R219 M220 G236	Y203-D217 HydrophobicContact CD1-CB 4.33Å; Y203-D217 HydrophobicContact CE1-CB 4.15Å; D217-R219 PolarHBondContact O-N 3.05Å; D217-R219 VanDerWaalsContact O-N 3.13Å; D217-R219 VanDerWaalsContact OD1-CB 3.26Å; D217-R219 WeakPolarHBondContact OD1-CB 3.25Å; D217-R219 WeakPolarHBondContact OD1-CG 3.45Å; D217-R219 IonicContact OD1-CZ 3.24Å; D217-R219 PolarHBondContact OD1-N 3.24Å; D217-R219 IonicContact OD1-NE 2.64Å; D217-R219 PolarHBondContact OD1-NE 2.91Å; D217-R219 IonicContact OD1-NH2 3.95Å; D217-R219 IonicContact OD2-CZ 3.67Å; D217-R219 VanDerWaalsContact OD2-CZ 3.32Å; D217-R219 IonicContact OD2-NE 3.12Å; D217-R219 PolarHBondContact OD2-NE 3.06Å; D217-R219 VanDerWaalsContact OD2-NE 3.15Å; D217-R219 IonicContact OD2-NH2 3.27Å; D217-R219 PolarHBondContact OD2-NH2 3.41Å; D217-M220 HydrophobicContact CB-CG 4.21Å; D217-M220 HydrophobicContact CB-SD 4.27Å; D217-M220 WeakPolarHBondContact O-CB 3.49Å; D217-M220 PolarHBondContact O-N 3.26Å; D217-G236 PolarHBondContact N-O 2.84Å
218	R	90.5	Very high	89	Confident	45 Å²	45	42.9 Å²	42.9	17%	0.17	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-58	-23.8	180	-68.6	171.9	61.5	-144.3	-0.1	113.6	V147 P201 Y202 L204 M220 L221	V147-R218 VanDerWaalsContact CG1-NH1 3.31Å; P201-R218 PolarHBondContact O-NH1 2.95Å; Y202-R218 WeakPolarHBondContact O-CB 3.07Å; Y202-R218 VanDerWaalsContact O-CG 3.31Å; Y202-R218 WeakPolarHBondContact O-CG 3.38Å; Y202-R218 PolarHBondContact O-N 2.83Å; L204-R218 HydrophobicContact CB-CG 3.75Å; L204-R218 HydrophobicContact CD2-CG 4.08Å; R218-M220 PolarHBondContact O-N 3.45Å; R218-L221 PolarHBondContact O-N 3.24Å
219	R	89.5	Confident	88.5	Confident	162 Å²	162	45.3 Å²	45.3	61%	0.611	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-72.1	-19.9	178.1	-56.8	170.7	-61.2	171.6	5	112.5	Y202 D217 L221	Y202-R219 HydrophobicContact CG-CG 4.41Å; D217-R219 PolarHBondContact O-N 3.05Å; D217-R219 VanDerWaalsContact O-N 3.13Å; D217-R219 VanDerWaalsContact OD1-CB 3.26Å; D217-R219 WeakPolarHBondContact OD1-CB 3.25Å; D217-R219 WeakPolarHBondContact OD1-CG 3.45Å; D217-R219 IonicContact OD1-CZ 3.24Å; D217-R219 PolarHBondContact OD1-N 3.24Å; D217-R219 IonicContact OD1-NE 2.64Å; D217-R219 PolarHBondContact OD1-NE 2.91Å; D217-R219 IonicContact OD1-NH2 3.95Å; D217-R219 IonicContact OD2-CZ 3.67Å; D217-R219 VanDerWaalsContact OD2-CZ 3.32Å; D217-R219 IonicContact OD2-NE 3.12Å; D217-R219 PolarHBondContact OD2-NE 3.06Å; D217-R219 VanDerWaalsContact OD2-NE 3.15Å; D217-R219 IonicContact OD2-NH2 3.27Å; D217-R219 PolarHBondContact OD2-NH2 3.41Å; R219-L221 VanDerWaalsContact C-N 3.33Å
220	M	88.8	Confident	87.7	Confident	113 Å²	113	49.6 Å²	49.6	56%	0.557	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-92.4	6	174.2	-57.7	-177.2	72.3	0	0	112.5	D217 R218 T235	D217-M220 HydrophobicContact CB-CG 4.21Å; D217-M220 HydrophobicContact CB-SD 4.27Å; D217-M220 WeakPolarHBondContact O-CB 3.49Å; D217-M220 PolarHBondContact O-N 3.26Å; R218-M220 PolarHBondContact O-N 3.45Å; M220-T235 WeakPolarHBondContact O-CG2 3.38Å
221	L	90.4	Very high	86.6	Confident	29 Å²	29	50.3 Å²	50.3	15%	0.152	27%	0.274	C	S	.	.			trans	-112.5	158.2	-178.8	-55	-179.5	0	0	0	111	L184 I185 Y216 R218 R219 T235	L184-L221 HydrophobicContact CD1-CB 3.71Å; L184-L221 HydrophobicContact CD1-CD1 4.49Å; L184-L221 HydrophobicContact CD2-CD1 3.98Å; L184-L221 HydrophobicContact CG-CB 4Å; L184-L221 HydrophobicContact CG-CD1 3.89Å; I185-L221 HydrophobicContact CD1-CD1 3.83Å; I185-L221 HydrophobicContact CG1-CD1 3.58Å; Y216-L221 HydrophobicContact CD1-CD2 4.47Å; R218-L221 PolarHBondContact O-N 3.24Å; R219-L221 VanDerWaalsContact C-N 3.33Å; L221-T235 HydrophobicContact CD2-CG2 4.36Å; L221-T235 VanDerWaalsContact CD2-O 3.28Å; L221-T235 WeakPolarHBondContact CD2-O 3.4Å
222	G	89.2	Confident	85.7	Confident	7 Å²	7	58.8 Å²	58.8	7%	0.072	31%	0.306	C	S	.	.			trans	-160.1	154.4	175	0	0	0	0	0	110.2	Y229	G222-Y229 WeakPolarHBondContact O-CA 3.4Å
223	T	90.6	Very high	84.6	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.018	31%	0.312	C	S	.	.			trans	-99.1	171.2	178.9	66.9	0	0	0	0	110.2	W165 D181 L184 A225 T226 G227 N228 Y229	W165-T223 HydrophobicContact CB-CG2 4.25Å; W165-T223 HydrophobicContact CE3-CG2 3.9Å; D181-T223 WeakPolarHBondContact O-CB 3.5Å; L184-T223 HydrophobicContact CB-CG2 4.19Å; L184-T223 HydrophobicContact CD1-CG2 3.92Å; T223-A225 VanDerWaalsContact C-N 3.32Å; T223-T226 PolarHBondContact N-OG1 3.32Å; T223-T226 PolarHBondContact O-N 3.18Å; T223-T226 PolarHBondContact O-OG1 3.46Å; T223-G227 PolarHBondContact O-N 3.13Å; T223-N228 PolarHBondContact O-N 2.86Å; T223-Y229 PolarHBondContact O-N 2.74Å
224	R	89.8	Confident	83.8	Confident	131 Å²	131	63.7 Å²	63.7	49%	0.494	34%	0.339	S	S	.	.	S	Bend	trans	-72.1	-33	178.2	-60.7	-174.8	-178.9	-158	-2.3	110.9	K180 D181 T226 G227 Y229	K180-R224 VanDerWaalsContact O-CD 3.3Å; K180-R224 WeakPolarHBondContact O-CD 3.34Å; D181-R224 PolarHBondContact O-N 2.84Å; R224-T226 PolarHBondContact O-N 2.67Å; R224-G227 PolarHBondContact O-N 2.91Å; R224-G227 VanDerWaalsContact O-N 3.07Å; R224-Y229 HydrophobicContact CG-CD1 3.68Å; R224-Y229 HydrophobicContact CG-CD2 4.26Å; R224-Y229 HydrophobicContact CG-CE1 4.44Å; R224-Y229 HydrophobicContact CG-CG 3.57Å
225	A	85.3	Confident	83.2	Confident	69 Å²	69	64.1 Å²	64.1	57%	0.57	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-32.8	173	0	0	0	0	0	112.7	D181 T223	D181-A225 HydrophobicContact CB-CB 4.49Å; D181-A225 PolarHBondContact O-N 3.27Å; T223-A225 VanDerWaalsContact C-N 3.32Å
226	T	82.6	Confident	82.7	Confident	66 Å²	66	64.3 Å²	64.3	41%	0.405	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	14.5	176.3	70.5	0	0	0	0	113.8	W165 T223 R224 N228	W165-T226 HydrophobicContact CZ3-CG2 4.12Å; T223-T226 PolarHBondContact N-OG1 3.32Å; T223-T226 PolarHBondContact O-N 3.18Å; T223-T226 PolarHBondContact O-OG1 3.46Å; R224-T226 PolarHBondContact O-N 2.67Å; T226-N228 PolarHBondContact O-N 3.07Å
227	G	81.1	Confident	82.6	Confident	64 Å²	64	66.3 Å²	66.3	66%	0.66	36%	0.356	S	S	*	.	S	Bend	trans	70	-18	179.2	0	0	0	0	0	116.8	T223 R224 Y229	T223-G227 PolarHBondContact O-N 3.13Å; R224-G227 PolarHBondContact O-N 2.91Å; R224-G227 VanDerWaalsContact O-N 3.07Å; G227-Y229 PolarHBondContact O-N 3.07Å
228	N	79.6	Confident	82.4	Confident	116 Å²	116	68.8 Å²	68.8	62%	0.62	37%	0.373	S	S	*	.			trans	-93.5	20.7	-167.2	-68.1	-14.2	0	0	0	114.7	T223 T226 M230	T223-N228 PolarHBondContact O-N 2.86Å; T226-N228 PolarHBondContact O-N 3.07Å; N228-M230 PolarHBondContact O-N 2.63Å
229	Y	81.8	Confident	82.2	Confident	50 Å²	50	67.4 Å²	67.4	20%	0.196	37%	0.37	C	S	.	.			trans	-77.1	101.8	-176.5	-176.2	-103.9	0	0	0	113.4	I183 G222 T223 R224 G227 G231	I183-Y229 HydrophobicContact CB-CE2 4.24Å; I183-Y229 HydrophobicContact CG2-CE2 3.94Å; I183-Y229 VanDerWaalsContact O-CD2 3.29Å; I183-Y229 WeakPolarHBondContact O-CD2 3.46Å; I183-Y229 WeakPolarHBondContact O-CE2 3.4Å; G222-Y229 WeakPolarHBondContact O-CA 3.4Å; T223-Y229 PolarHBondContact O-N 2.74Å; R224-Y229 HydrophobicContact CG-CD1 3.68Å; R224-Y229 HydrophobicContact CG-CD2 4.26Å; R224-Y229 HydrophobicContact CG-CE1 4.44Å; R224-Y229 HydrophobicContact CG-CG 3.57Å; G227-Y229 PolarHBondContact O-N 3.07Å; Y229-G231 VanDerWaalsContact C-N 3.29Å; Y229-G231 VanDerWaalsContact CE1-CA 3.41Å; Y229-G231 PolarHBondContact O-N 2.64Å
230	M	71.6	Confident	82.2	Confident	123 Å²	123	62.8 Å²	62.8	61%	0.606	35%	0.352	S	S	*	.			trans	-78.2	-0	-177.8	-57.6	-168.1	80.7	0	0	115.7	N228 R232 T235	N228-M230 PolarHBondContact O-N 2.63Å; M230-R232 PolarHBondContact O-N 3.18Å; M230-T235 HydrophobicContact CB-CG2 4.03Å; M230-T235 HydrophobicContact CG-CG2 4.21Å; M230-T235 HydrophobicContact SD-CG2 3.6Å
231	G	64.6	Low	82.2	Confident	46 Å²	46	58.4 Å²	58.4	47%	0.474	33%	0.33	S	S	.	.			trans	70.1	-21.2	170.6	0	0	0	0	0	118.5	Y229	Y229-G231 VanDerWaalsContact C-N 3.29Å; Y229-G231 VanDerWaalsContact CE1-CA 3.41Å; Y229-G231 PolarHBondContact O-N 2.64Å
232	R	69.1	Low	82.2	Confident	178 Å²	178	59.2 Å²	59.2	67%	0.672	34%	0.336	S	S	*	.			trans	-93.2	124.1	-178.6	-67.6	-167.8	-80	-126.7	3.3	111.6	M230 T234 T235	M230-R232 PolarHBondContact O-N 3.18Å; R232-T234 PolarHBondContact O-N 2.81Å; R232-T235 WeakPolarHBondContact O-CB 3.34Å; R232-T235 PolarHBondContact O-N 3Å; R232-T235 PolarHBondContact O-OG1 2.86Å
233	G	68.5	Low	82	Confident	13 Å²	13	59.3 Å²	59.3	13%	0.134	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-1.6	177.3	0	0	0	0	0	116.2	N186 Y216	N186-G233 WeakPolarHBondContact O-CA 3.39Å; Y216-G233 WeakPolarHBondContact CE1-O 3.2Å; Y216-G233 PolarHBondContact OH-O 3.26Å
234	T	75.5	Confident	81.7	Confident	91 Å²	91	64.1 Å²	64.1	56%	0.558	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-8.2	172.3	51	0	0	0	0	113.1	R232 G236 M237	R232-T234 PolarHBondContact O-N 2.81Å; T234-G236 PolarHBondContact O-N 3.34Å; T234-M237 HydrophobicContact CG2-CE 4.09Å; T234-M237 VanDerWaalsContact O-CB 3.31Å; T234-M237 WeakPolarHBondContact O-CB 3.4Å; T234-M237 PolarHBondContact O-N 2.93Å; T234-M237 VanDerWaalsContact O-N 3.15Å
235	T	81.4	Confident	81.3	Confident	26 Å²	26	62.3 Å²	62.3	16%	0.16	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	134.7	172.4	-68.2	0	0	0	0	109.4	Y216 M220 L221 M230 R232 M237	Y216-T235 WeakPolarHBondContact CD1-O 3.31Å; M220-T235 WeakPolarHBondContact O-CG2 3.38Å; L221-T235 HydrophobicContact CD2-CG2 4.36Å; L221-T235 VanDerWaalsContact CD2-O 3.28Å; L221-T235 WeakPolarHBondContact CD2-O 3.4Å; M230-T235 HydrophobicContact CB-CG2 4.03Å; M230-T235 HydrophobicContact CG-CG2 4.21Å; M230-T235 HydrophobicContact SD-CG2 3.6Å; R232-T235 WeakPolarHBondContact O-CB 3.34Å; R232-T235 PolarHBondContact O-N 3Å; R232-T235 PolarHBondContact O-OG1 2.86Å; T235-M237 PolarHBondContact O-N 2.77Å
236	G	82.8	Confident	81.2	Confident	8 Å²	8	59.3 Å²	59.3	8%	0.082	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	-0.9	-178.8	0	0	0	0	0	115.4	Y216 D217 T234 C238	Y216-G236 CarbonylContact C-O 3.57Å; Y216-G236 WeakPolarHBondContact CA-O 3.38Å; D217-G236 PolarHBondContact N-O 2.84Å; T234-G236 PolarHBondContact O-N 3.34Å; G236-C238 PolarHBondContact O-N 2.96Å
237	M	89.6	Confident	81.1	Confident	43 Å²	43	58.8 Å²	58.8	21%	0.212	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	116.3	178.9	-166.9	-179.9	70.2	0	0	109.7	R214 I215 Y216 T234 T235 R240 L287	R214-M237 HydrophobicContact CB-SD 4.3Å; R214-M237 HydrophobicContact CG-SD 4.26Å; I215-M237 CarbonylContact O-C 3.5Å; I215-M237 WeakPolarHBondContact O-CA 3.42Å; Y216-M237 HydrophobicContact CD1-CB 3.8Å; Y216-M237 HydrophobicContact CD1-CG 4.32Å; Y216-M237 HydrophobicContact CE1-CB 3.58Å; Y216-M237 HydrophobicContact CE1-CG 3.99Å; T234-M237 HydrophobicContact CG2-CE 4.09Å; T234-M237 VanDerWaalsContact O-CB 3.31Å; T234-M237 WeakPolarHBondContact O-CB 3.4Å; T234-M237 PolarHBondContact O-N 2.93Å; T234-M237 VanDerWaalsContact O-N 3.15Å; T235-M237 PolarHBondContact O-N 2.77Å; M237-R240 HydrophobicContact SD-CB 4.42Å; M237-L287 HydrophobicContact CE-CD1 3.66Å
238	C	88.3	Confident	81	Confident	61 Å²	61	61.7 Å²	61.7	41%	0.412	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-40.8	179.2	-53.4	0	0	0	0	111.8	I215 G236	I215-C238 PolarHBondContact O-N 3.01Å; G236-C238 PolarHBondContact O-N 2.96Å
239	V	87.4	Confident	81	Confident	16 Å²	16	61.2 Å²	61.2	10%	0.097	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	146.2	-170.4	-163.1	0	0	0	0	110.4	R214 I215 F241 A284	R214-V239 CarbonylContact C-O 3.53Å; R214-V239 WeakPolarHBondContact CA-O 3.39Å; I215-V239 HydrophobicContact CB-CB 4.19Å; I215-V239 HydrophobicContact CB-CG2 4.44Å; I215-V239 HydrophobicContact CD1-CB 4.41Å; I215-V239 HydrophobicContact CG1-CB 4.5Å; I215-V239 PolarHBondContact N-O 2.69Å; I215-V239 PolarHBondContact O-N 2.95Å; V239-F241 HydrophobicContact CB-CE2 4.34Å; V239-F241 HydrophobicContact CB-CZ 4.49Å; V239-F241 HydrophobicContact CG1-CD1 4.5Å; V239-F241 HydrophobicContact CG1-CD2 4.24Å; V239-F241 HydrophobicContact CG1-CE1 3.89Å; V239-F241 HydrophobicContact CG1-CE2 3.6Å; V239-F241 HydrophobicContact CG1-CZ 3.39Å; V239-A284 HydrophobicContact CG1-CB 3.63Å
240	R	89.4	Confident	81	Confident	65 Å²	65	62 Å²	62	25%	0.245	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	122.6	168.4	173	177.7	169.7	119.8	-0.4	110.5	D210 S212 V213 R214 M237 V242 A284 L287	D210-R240 IonicContact OD2-CZ 3.66Å; D210-R240 VanDerWaalsContact OD2-CZ 3.29Å; D210-R240 IonicContact OD2-NH1 3.47Å; D210-R240 PolarHBondContact OD2-NH1 3.18Å; D210-R240 IonicContact OD2-NH2 2.91Å; D210-R240 PolarHBondContact OD2-NH2 2.89Å; S212-R240 PolarHBondContact OG-NH1 3.37Å; S212-R240 VanDerWaalsContact OG-NH1 3.12Å; V213-R240 CarbonylContact O-C 3.59Å; V213-R240 VanDerWaalsContact O-CA 3.31Å; V213-R240 WeakPolarHBondContact O-CA 3.37Å; R214-R240 HydrophobicContact CG-CB 4.48Å; R214-R240 HydrophobicContact CG-CG 4.26Å; M237-R240 HydrophobicContact SD-CB 4.42Å; R240-V242 HydrophobicContact CG-CG2 4.47Å; R240-A284 WeakPolarHBondContact O-CB 3.41Å; R240-L287 HydrophobicContact CB-CD1 4.28Å; R240-L287 HydrophobicContact CB-CD2 4.12Å; R240-L287 HydrophobicContact CG-CD2 4.36Å
241	F	88.3	Confident	81.7	Confident	21 Å²	21	57.1 Å²	57.1	9%	0.092	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.7	172.9	-59.5	-68.9	0	0	0	111.2	S212 V213 I215 V239 F277 N278	S212-F241 WeakPolarHBondContact CA-O 3.36Å; V213-F241 HydrophobicContact CB-CB 4.39Å; V213-F241 HydrophobicContact CG1-CD2 4.39Å; V213-F241 PolarHBondContact N-O 3.28Å; V213-F241 PolarHBondContact O-N 3.39Å; I215-F241 HydrophobicContact CD1-CE2 3.98Å; V239-F241 HydrophobicContact CB-CE2 4.34Å; V239-F241 HydrophobicContact CB-CZ 4.49Å; V239-F241 HydrophobicContact CG1-CD1 4.5Å; V239-F241 HydrophobicContact CG1-CD2 4.24Å; V239-F241 HydrophobicContact CG1-CE1 3.89Å; V239-F241 HydrophobicContact CG1-CE2 3.6Å; V239-F241 HydrophobicContact CG1-CZ 3.39Å; F241-F277 HydrophobicContact CB-CD1 3.85Å; F241-F277 HydrophobicContact CB-CD2 4.16Å; F241-F277 HydrophobicContact CB-CE1 3.87Å; F241-F277 HydrophobicContact CB-CE2 4.18Å; F241-F277 HydrophobicContact CB-CG 3.99Å; F241-F277 HydrophobicContact CB-CZ 4.03Å; F241-F277 HydrophobicContact CD1-CB 4.19Å; F241-F277 AromaticContact CD1-CD1 3.8Å; F241-F277 HydrophobicContact CD1-CD1 3.8Å; F241-F277 HydrophobicContact CD1-CE1 4.46Å; F241-F277 HydrophobicContact CD1-CG 4.13Å; F241-F277 HydrophobicContact CD2-CB 3.9Å; F241-F277 HydrophobicContact CD2-CD2 4.46Å; F241-F277 HydrophobicContact CD2-CG 4.07Å; F241-F277 HydrophobicContact CE1-CB 4.28Å; F241-F277 HydrophobicContact CE2-CB 3.99Å; F241-F277 HydrophobicContact CG-CB 4Å; F241-F277 AromaticContact CG-CD1 3.8Å; F241-F277 HydrophobicContact CG-CD1 3.8Å; F241-F277 HydrophobicContact CG-CD2 4.33Å; F241-F277 HydrophobicContact CG-CE1 4.34Å; F241-F277 AromaticContact CG-CG 3.79Å; F241-F277 HydrophobicContact CG-CG 3.79Å; F241-F277 HydrophobicContact CZ-CB 4.18Å; F241-N278 VanDerWaalsContact CZ-O 3.24Å; F241-N278 WeakPolarHBondContact CZ-O 3.49Å
242	V	89	Confident	82.7	Confident	46 Å²	46	59.8 Å²	59.8	28%	0.279	32%	0.319	S	S	.	.			trans	-147.6	129.7	166.3	-169.7	0	0	0	0	106.7	R240 L246	R240-V242 HydrophobicContact CG-CG2 4.47Å; V242-L246 HydrophobicContact CG1-CB 4.33Å
243	P	86	Confident	83.7	Confident	10 Å²	10	51.3 Å²	51.3	7%	0.065	29%	0.287	C	S	.	.			trans	-58.5	140	170.5	-24.9	34.9	0	0	0	111.3	H245 L246 S247 Y269 Y275 F277	P243-H245 VanDerWaalsContact C-N 3.33Å; P243-H245 WeakPolarHBondContact CB-CE1 3.35Å; P243-H245 PolarHBondContact O-N 3.47Å; P243-L246 HydrophobicContact CB-CB 4.24Å; P243-L246 HydrophobicContact CB-CD1 4.2Å; P243-L246 HydrophobicContact CB-CG 4.09Å; P243-L246 HydrophobicContact CG-CD1 3.93Å; P243-L246 HydrophobicContact CG-CG 4.37Å; P243-L246 CarbonylContact O-C 3.51Å; P243-L246 WeakPolarHBondContact O-CA 3.47Å; P243-L246 PolarHBondContact O-N 2.67Å; P243-S247 PolarHBondContact O-N 3.34Å; P243-S247 VanDerWaalsContact O-N 3.13Å; P243-Y269 WeakPolarHBondContact CD-OH 3.45Å; P243-Y269 HydrophobicContact CG-CE2 4.16Å; P243-Y275 HydrophobicContact CB-CE1 4.32Å; P243-Y275 HydrophobicContact CG-CD1 4.3Å; P243-Y275 HydrophobicContact CG-CD2 4.21Å; P243-Y275 HydrophobicContact CG-CE1 4.33Å; P243-Y275 HydrophobicContact CG-CE2 4.23Å; P243-Y275 HydrophobicContact CG-CG 4.26Å; P243-F277 HydrophobicContact CG-CZ 4.01Å
244	S	83.8	Confident	84.7	Confident	104 Å²	104	53.7 Å²	53.7	73%	0.727	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-60.8	-37.8	-170	53.1	0	0	0	0	113.5	L246 S247	S244-L246 VanDerWaalsContact C-N 3.29Å; S244-L246 PolarHBondContact O-N 3.37Å; S244-S247 VanDerWaalsContact O-CB 3.3Å; S244-S247 WeakPolarHBondContact O-CB 3.05Å; S244-S247 PolarHBondContact O-N 2.91Å; S244-S247 PolarHBondContact O-OG 3.23Å
245	H	81.8	Confident	85.4	Confident	93 Å²	93	50 Å²	50	43%	0.431	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-72.8	-18.4	174.6	65.8	-64.7	0	0	0	113.8	P243 D272 Y275	P243-H245 VanDerWaalsContact C-N 3.33Å; P243-H245 WeakPolarHBondContact CB-CE1 3.35Å; P243-H245 PolarHBondContact O-N 3.47Å; H245-D272 IonicContact CD2-OD2 2.68Å; H245-D272 IonicContact CE1-OD2 3.54Å; H245-D272 IonicContact NE2-OD1 3.67Å; H245-D272 IonicContact NE2-OD2 3.77Å; H245-D272 PolarHBondContact NE2-OD2 2.9Å; H245-Y275 AromaticContact CE1-CZ 3.74Å; H245-Y275 PolarHBondContact CE1-OH 2.92Å; H245-Y275 PolarHBondContact NE2-OH 2.92Å
246	L	83.6	Confident	85.9	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.026	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-92.8	-5.1	173.5	-59.5	-172.3	0	0	0	113.3	V242 P243 S244 N248 K249 C251 Y269	V242-L246 HydrophobicContact CG1-CB 4.33Å; P243-L246 HydrophobicContact CB-CB 4.24Å; P243-L246 HydrophobicContact CB-CD1 4.2Å; P243-L246 HydrophobicContact CB-CG 4.09Å; P243-L246 HydrophobicContact CG-CD1 3.93Å; P243-L246 HydrophobicContact CG-CG 4.37Å; P243-L246 CarbonylContact O-C 3.51Å; P243-L246 WeakPolarHBondContact O-CA 3.47Å; P243-L246 PolarHBondContact O-N 2.67Å; S244-L246 VanDerWaalsContact C-N 3.29Å; S244-L246 PolarHBondContact O-N 3.37Å; L246-N248 PolarHBondContact O-N 2.83Å; L246-K249 HydrophobicContact CD2-CB 4.34Å; L246-K249 PolarHBondContact O-N 3.38Å; L246-C251 HydrophobicContact CD1-CB 4.16Å; L246-C251 HydrophobicContact CD2-CB 4.25Å; L246-Y269 HydrophobicContact CD1-CD1 3.61Å; L246-Y269 HydrophobicContact CD1-CE1 3.78Å; L246-Y269 HydrophobicContact CD1-CG 4.14Å
247	S	79.8	Confident	86.5	Confident	56 Å²	56	49.1 Å²	49.1	39%	0.392	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-22.8	179.1	62	0	0	0	0	114.7	P243 S244 R294	P243-S247 PolarHBondContact O-N 3.34Å; P243-S247 VanDerWaalsContact O-N 3.13Å; S244-S247 VanDerWaalsContact O-CB 3.3Å; S244-S247 WeakPolarHBondContact O-CB 3.05Å; S244-S247 PolarHBondContact O-N 2.91Å; S244-S247 PolarHBondContact O-OG 3.23Å; S247-R294 PolarHBondContact O-NH1 2.78Å
248	N	78.8	Confident	86.6	Confident	125 Å²	125	47.5 Å²	47.5	67%	0.668	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	6	178.6	-64.4	-24.6	0	0	0	113.9	L246 R294	L246-N248 PolarHBondContact O-N 2.83Å; N248-R294 PolarHBondContact OD1-NH2 3.27Å
249	K	81.2	Confident	86.6	Confident	105 Å²	105	45.7 Å²	45.7	46%	0.457	25%	0.25	S	S	.	.	S	Bend	trans	-114.5	156	174.9	-68.6	-167.2	175.2	-168.7	0	109.7	S211 L246 E326	S211-K249 PolarHBondContact OG-O 3.23Å; L246-K249 HydrophobicContact CD2-CB 4.34Å; L246-K249 PolarHBondContact O-N 3.38Å; K249-E326 IonicContact NZ-OE1 3.75Å; K249-E326 PolarHBondContact NZ-OE1 2.93Å; K249-E326 IonicContact NZ-OE2 2.76Å
250	S	81.4	Confident	86.3	Confident	66 Å²	66	47 Å²	47	46%	0.462	27%	0.267	S	S	.	.			trans	-109	63.1	176.1	61	0	0	0	0	111.7
251	C	85.1	Confident	85.9	Confident	21 Å²	21	47.4 Å²	47.4	14%	0.142	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-80	134.5	172.8	-61	0	0	0	0	109.8	S211 L246 Y269	S211-C251 WeakPolarHBondContact CA-O 3.33Å; S211-C251 WeakPolarHBondContact CB-O 3.5Å; S211-C251 PolarHBondContact N-O 3.47Å; S211-C251 WeakPolarHBondContact OG-CA 3.33Å; S211-C251 WeakPolarHBondContact OG-CB 3.26Å; S211-C251 PolarHBondContact OG-N 3.14Å; S211-C251 PolarHBondContact OG-O 2.66Å; L246-C251 HydrophobicContact CD1-CB 4.16Å; L246-C251 HydrophobicContact CD2-CB 4.25Å; C251-Y269 HydrophobicContact CB-CD1 4.39Å
252	R	86.6	Confident	85.8	Confident	102 Å²	102	47 Å²	47	39%	0.385	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-83.8	132.7	-175.2	170.8	176.8	63.8	156	1.2	111.3	T192 T254 Y269 S270	T192-R252 HydrophobicContact CG2-CG 3.91Å; R252-T254 PolarHBondContact O-N 3.39Å; R252-Y269 CarbonylContact O-C 3.55Å; R252-S270 PolarHBondContact N-OG 3.17Å; R252-S270 PolarHBondContact O-N 2.93Å; R252-S270 PolarHBondContact O-OG 3.23Å
253	V	89.6	Confident	85.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	119.7	165.8	177.6	0	0	0	0	109.2	T192 C208 V213 L256 V267 S268 Y269	T192-V253 WeakPolarHBondContact CB-O 3.48Å; T192-V253 PolarHBondContact OG1-O 3.12Å; C208-V253 PolarHBondContact O-N 3.21Å; V213-V253 HydrophobicContact CG2-CG2 3.89Å; V253-L256 HydrophobicContact CG1-CB 4.19Å; V253-V267 HydrophobicContact CG1-CG1 3.69Å; V253-V267 HydrophobicContact CG2-CG1 4.1Å; V253-S268 CarbonylContact C-O 3.59Å; V253-S268 WeakPolarHBondContact CA-O 3.24Å; V253-Y269 HydrophobicContact CG2-CD1 4.22Å; V253-Y269 HydrophobicContact CG2-CE1 3.72Å
254	T	89.6	Confident	85.8	Confident	63 Å²	63	52.8 Å²	52.8	39%	0.387	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-31.6	-175.6	46.7	0	0	0	0	113.1	R252 S268	R252-T254 PolarHBondContact O-N 3.39Å; T254-S268 PolarHBondContact N-O 3.23Å; T254-S268 VanDerWaalsContact OG1-CB 3.29Å; T254-S268 WeakPolarHBondContact OG1-CB 3.4Å; T254-S268 PolarHBondContact OG1-O 3.16Å; T254-S268 VanDerWaalsContact OG1-O 3.07Å; T254-S268 PolarHBondContact OG1-OG 3.5Å; T254-S268 VanDerWaalsContact OG1-OG 3.08Å
255	S	90.9	Very high	86.2	Confident	15 Å²	15	47.9 Å²	47.9	11%	0.105	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	144.6	174.6	-174.8	0	0	0	0	109.6	S268	S255-S268 PolarHBondContact O-N 3Å
256	L	92.1	Very high	86.8	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	135.3	-179.9	175.4	146.2	0	0	0	110	S193 S195 A205 V213 V253 V265 L266 V267	S193-L256 PolarHBondContact OG-N 2.77Å; S195-L256 VanDerWaalsContact CB-CD2 3.4Å; A205-L256 HydrophobicContact CB-CD1 4.18Å; A205-L256 HydrophobicContact CB-CD2 3.52Å; A205-L256 HydrophobicContact CB-CG 4.44Å; V213-L256 HydrophobicContact CB-CD1 4.09Å; V213-L256 HydrophobicContact CG1-CD1 3.4Å; V213-L256 HydrophobicContact CG2-CD1 3.58Å; V253-L256 HydrophobicContact CG1-CB 4.19Å; L256-V265 HydrophobicContact CD1-CG1 4.05Å; L256-V265 HydrophobicContact CD2-CG1 4.25Å; L256-V265 HydrophobicContact CG-CG1 3.89Å; L256-L266 WeakPolarHBondContact CA-O 3.48Å; L256-V267 HydrophobicContact CD1-CG2 4.06Å; L256-V267 HydrophobicContact CG-CG2 4.36Å
257	C	93.4	Very high	87.2	Confident	12 Å²	12	46.2 Å²	46.2	8%	0.081	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	135.8	-179.8	-168	0	0	0	0	111.8	L266 N566	C257-L266 PolarHBondContact N-O 2.87Å; C257-L266 PolarHBondContact O-N 2.8Å; C257-N566 HydrophobicContact CB-CB 4.23Å; C257-N566 WeakPolarHBondContact SG-CB 3.43Å
258	Y	92.1	Very high	87.7	Confident	9 Å²	9	44.7 Å²	44.7	4%	0.035	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	144.2	162.6	-81	-85.5	0	0	0	111.4	S195 A205 I215 V265	S195-Y258 WeakPolarHBondContact O-CE2 3.46Å; S195-Y258 PolarHBondContact OG-N 3Å; A205-Y258 HydrophobicContact CB-CD2 4.38Å; A205-Y258 HydrophobicContact CB-CE2 3.5Å; I215-Y258 WeakPolarHBondContact CG2-OH 3.28Å; Y258-V265 HydrophobicContact CD1-CG2 3.73Å; Y258-V265 HydrophobicContact CE1-CG2 3.52Å; Y258-V265 HydrophobicContact CG-CG2 4.41Å
259	S	88.4	Confident	88.1	Confident	24 Å²	24	39 Å²	39	17%	0.168	22%	0.216	C	C	.	.			trans	-53.7	156.6	157.1	48.7	0	0	0	0	112.2	P198 D261 G262 Q263 E264	P198-S259 VanDerWaalsContact CG-O 3.3Å; P198-S259 WeakPolarHBondContact CG-O 3.23Å; S259-D261 VanDerWaalsContact C-N 3.25Å; S259-D261 WeakPolarHBondContact CB-OD1 3.31Å; S259-D261 PolarHBondContact O-N 3.11Å; S259-D261 PolarHBondContact OG-OD1 3.05Å; S259-G262 PolarHBondContact O-N 2.92Å; S259-G262 WeakPolarHBondContact OG-CA 3.42Å; S259-G262 PolarHBondContact OG-N 3.16Å; S259-Q263 PolarHBondContact OG-N 2.88Å; S259-Q263 VanDerWaalsContact OG-N 3.08Å; S259-E264 WeakPolarHBondContact CB-O 3.25Å; S259-E264 PolarHBondContact N-O 2.82Å; S259-E264 PolarHBondContact OG-N 3.3Å; S259-E264 PolarHBondContact OG-O 2.94Å
260	G	82	Confident	88.2	Confident	43 Å²	43	35.5 Å²	35.5	44%	0.443	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.1	-176.8	0	0	0	0	0	115.4	P198	P198-G260 WeakPolarHBondContact CG-O 3.26Å
261	D	81.7	Confident	88.1	Confident	74 Å²	74	35.3 Å²	35.3	40%	0.396	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	0.2	171.8	68.1	-16	0	0	0	112.8	L199 S259 Q263	L199-D261 HydrophobicContact CD1-CB 4.34Å; L199-D261 WeakPolarHBondContact CD1-O 3.12Å; S259-D261 VanDerWaalsContact C-N 3.25Å; S259-D261 WeakPolarHBondContact CB-OD1 3.31Å; S259-D261 PolarHBondContact O-N 3.11Å; S259-D261 PolarHBondContact OG-OD1 3.05Å; D261-Q263 HydrophobicContact CB-CG 4.38Å; D261-Q263 PolarHBondContact O-N 2.83Å; D261-Q263 PolarHBondContact OD1-N 3.36Å; D261-Q263 VanDerWaalsContact OD2-CG 3.3Å; D261-Q263 WeakPolarHBondContact OD2-CG 3.34Å; D261-Q263 PolarHBondContact OD2-NE2 3.38Å
262	G	85.1	Confident	88.1	Confident	11 Å²	11	35.3 Å²	35.3	11%	0.113	20%	0.202	C	C	.	.	S	Bend	trans	67.1	12.7	-179.2	0	0	0	0	0	115	S259	S259-G262 PolarHBondContact O-N 2.92Å; S259-G262 WeakPolarHBondContact OG-CA 3.42Å; S259-G262 PolarHBondContact OG-N 3.16Å
263	Q	85.3	Confident	88.1	Confident	91 Å²	91	35.5 Å²	35.5	43%	0.425	20%	0.204	S	C	.	.	S	Bend	trans	-87.2	-8	-177.7	-65.2	-158.1	94.8	0	0	114.7	S259 D261 P279	S259-Q263 PolarHBondContact OG-N 2.88Å; S259-Q263 VanDerWaalsContact OG-N 3.08Å; D261-Q263 HydrophobicContact CB-CG 4.38Å; D261-Q263 PolarHBondContact O-N 2.83Å; D261-Q263 PolarHBondContact OD1-N 3.36Å; D261-Q263 VanDerWaalsContact OD2-CG 3.3Å; D261-Q263 WeakPolarHBondContact OD2-CG 3.34Å; D261-Q263 PolarHBondContact OD2-NE2 3.38Å; Q263-P279 WeakPolarHBondContact O-CD 3.35Å
264	E	90.3	Very high	88.1	Confident	88 Å²	88	39.8 Å²	39.8	41%	0.411	23%	0.226	S	C	.	.			trans	-145.7	153.3	179.3	-54.1	-178.6	130.2	0	0	110.9	S259 L276 F277	S259-E264 WeakPolarHBondContact CB-O 3.25Å; S259-E264 PolarHBondContact N-O 2.82Å; S259-E264 PolarHBondContact OG-N 3.3Å; S259-E264 PolarHBondContact OG-O 2.94Å; E264-L276 HydrophobicContact CB-CD1 3.69Å; E264-L276 HydrophobicContact CB-CG 4.2Å; E264-L276 HydrophobicContact CG-CD1 4.44Å; E264-L276 WeakPolarHBondContact OE1-CD2 3.22Å; E264-F277 CarbonylContact C-O 3.51Å; E264-F277 WeakPolarHBondContact CA-O 3.39Å
265	V	91.6	Very high	88.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.5	172.9	-172.5	0	0	0	0	109	I215 L256 Y258 V267 F277	I215-V265 HydrophobicContact CD1-CG2 4.26Å; L256-V265 HydrophobicContact CD1-CG1 4.05Å; L256-V265 HydrophobicContact CD2-CG1 4.25Å; L256-V265 HydrophobicContact CG-CG1 3.89Å; Y258-V265 HydrophobicContact CD1-CG2 3.73Å; Y258-V265 HydrophobicContact CE1-CG2 3.52Å; Y258-V265 HydrophobicContact CG-CG2 4.41Å; V265-V267 HydrophobicContact CG1-CG2 3.9Å; V265-F277 PolarHBondContact N-O 3.12Å; V265-F277 PolarHBondContact O-N 3.01Å
266	L	93.4	Very high	88.1	Confident	64 Å²	64	42.9 Å²	42.9	34%	0.335	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.7	174	-169.5	75.7	0	0	0	109.4	L256 C257 I274 Y275 L276	L256-L266 WeakPolarHBondContact CA-O 3.48Å; C257-L266 PolarHBondContact N-O 2.87Å; C257-L266 PolarHBondContact O-N 2.8Å; L266-I274 HydrophobicContact CD1-CG2 3.61Å; L266-I274 HydrophobicContact CD2-CG2 4.42Å; L266-I274 HydrophobicContact CG-CG2 3.85Å; L266-Y275 WeakPolarHBondContact CA-O 3.28Å; L266-L276 HydrophobicContact CB-CD1 4.23Å; L266-L276 HydrophobicContact CD1-CB 4.49Å; L266-L276 HydrophobicContact CD1-CD1 3.96Å
267	V	92.2	Very high	88	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	123.5	-171.8	-172.2	0	0	0	0	110.4	V213 V253 L256 V265 Y269 I274 Y275 F277	V213-V267 HydrophobicContact CG2-CB 4.41Å; V213-V267 HydrophobicContact CG2-CG1 3.6Å; V213-V267 HydrophobicContact CG2-CG2 3.92Å; V253-V267 HydrophobicContact CG1-CG1 3.69Å; V253-V267 HydrophobicContact CG2-CG1 4.1Å; L256-V267 HydrophobicContact CD1-CG2 4.06Å; L256-V267 HydrophobicContact CG-CG2 4.36Å; V265-V267 HydrophobicContact CG1-CG2 3.9Å; V267-Y269 HydrophobicContact CB-CE2 4.08Å; V267-Y269 HydrophobicContact CG1-CD2 3.95Å; V267-Y269 HydrophobicContact CG1-CE2 3.38Å; V267-I274 CarbonylContact O-C 3.42Å; V267-I274 WeakPolarHBondContact O-CA 3.47Å; V267-I274 WeakPolarHBondContact O-CG2 3.49Å; V267-Y275 PolarHBondContact N-O 2.84Å; V267-Y275 PolarHBondContact O-N 2.96Å; V267-F277 HydrophobicContact CB-CD2 4.29Å; V267-F277 HydrophobicContact CB-CE2 4Å; V267-F277 HydrophobicContact CG1-CE2 4.49Å; V267-F277 HydrophobicContact CG2-CD2 3.61Å; V267-F277 HydrophobicContact CG2-CE2 3.76Å
268	S	90.9	Very high	87.8	Confident	23 Å²	23	47.1 Å²	47.1	16%	0.161	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	144	171.7	-173.8	0	0	0	0	110.8	V253 T254 S255	V253-S268 CarbonylContact C-O 3.59Å; V253-S268 WeakPolarHBondContact CA-O 3.24Å; T254-S268 PolarHBondContact N-O 3.23Å; T254-S268 VanDerWaalsContact OG1-CB 3.29Å; T254-S268 WeakPolarHBondContact OG1-CB 3.4Å; T254-S268 PolarHBondContact OG1-O 3.16Å; T254-S268 VanDerWaalsContact OG1-O 3.07Å; T254-S268 PolarHBondContact OG1-OG 3.5Å; T254-S268 VanDerWaalsContact OG1-OG 3.08Å; S255-S268 PolarHBondContact O-N 3Å
269	Y	87.9	Confident	87.3	Confident	5 Å²	5	48 Å²	48	2%	0.02	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	148.2	-179.4	-76.5	-99.4	0	0	0	111.1	S211 P243 L246 C251 R252 V253 V267 S271 D272 Y275 F277	S211-Y269 VanDerWaalsContact O-CE1 3.28Å; S211-Y269 WeakPolarHBondContact O-CE1 3.14Å; S211-Y269 PolarHBondContact O-OH 2.89Å; P243-Y269 WeakPolarHBondContact CD-OH 3.45Å; P243-Y269 HydrophobicContact CG-CE2 4.16Å; L246-Y269 HydrophobicContact CD1-CD1 3.61Å; L246-Y269 HydrophobicContact CD1-CE1 3.78Å; L246-Y269 HydrophobicContact CD1-CG 4.14Å; C251-Y269 HydrophobicContact CB-CD1 4.39Å; R252-Y269 CarbonylContact O-C 3.55Å; V253-Y269 HydrophobicContact CG2-CD1 4.22Å; V253-Y269 HydrophobicContact CG2-CE1 3.72Å; V267-Y269 HydrophobicContact CB-CE2 4.08Å; V267-Y269 HydrophobicContact CG1-CD2 3.95Å; V267-Y269 HydrophobicContact CG1-CE2 3.38Å; Y269-S271 PolarHBondContact O-N 2.73Å; Y269-D272 PolarHBondContact O-N 2.8Å; Y269-Y275 AromaticContact CD2-CD2 3.54Å; Y269-Y275 HydrophobicContact CD2-CD2 3.54Å; Y269-Y275 AromaticContact CD2-CE2 3.94Å; Y269-Y275 HydrophobicContact CD2-CE2 3.94Å; Y269-Y275 AromaticContact CE2-CD2 3.71Å; Y269-Y275 HydrophobicContact CE2-CD2 3.71Å; Y269-Y275 HydrophobicContact CE2-CE2 4.36Å; Y269-Y275 HydrophobicContact CE2-CG 4.47Å; Y269-F277 HydrophobicContact CE2-CE2 4.47Å
270	S	82.6	Confident	86.7	Confident	32 Å²	32	53.3 Å²	53.3	22%	0.224	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	123.5	174.5	63	0	0	0	0	110.2	R252 D272	R252-S270 PolarHBondContact N-OG 3.17Å; R252-S270 PolarHBondContact O-N 2.93Å; R252-S270 PolarHBondContact O-OG 3.23Å; S270-D272 PolarHBondContact O-N 2.82Å
271	S	78.9	Confident	86	Confident	62 Å²	62	55 Å²	55	43%	0.434	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	20.1	179.7	-46.4	0	0	0	0	115.2	Y269 P321 E322	Y269-S271 PolarHBondContact O-N 2.73Å; S271-P321 CarbonylContact O-C 3.59Å; S271-P321 WeakPolarHBondContact O-CA 3.42Å; S271-E322 PolarHBondContact O-N 2.96Å
272	D	85.3	Confident	84.6	Confident	21 Å²	21	55.3 Å²	55.3	11%	0.112	28%	0.282	C	S	.	.	S	Bend	trans	-142.7	179	178.6	-157.3	8.8	0	0	0	111.6	H245 Y269 S270 Y275	H245-D272 IonicContact CD2-OD2 2.68Å; H245-D272 IonicContact CE1-OD2 3.54Å; H245-D272 IonicContact NE2-OD1 3.67Å; H245-D272 IonicContact NE2-OD2 3.77Å; H245-D272 PolarHBondContact NE2-OD2 2.9Å; Y269-D272 PolarHBondContact O-N 2.8Å; S270-D272 PolarHBondContact O-N 2.82Å; D272-Y275 PolarHBondContact OD1-OH 3.43Å; D272-Y275 PolarHBondContact OD2-OH 2.8Å
273	Y	87.1	Confident	83	Confident	107 Å²	107	62 Å²	62	42%	0.42	31%	0.311	S	S	.	.			trans	-66.3	171.4	-177.4	-62.3	-87.1	0	0	0	114.2	Y275 P321 E324	Y273-Y275 WeakPolarHBondContact O-CD2 3.21Å; Y273-Y275 WeakPolarHBondContact O-CE2 3.1Å; Y273-P321 HydrophobicContact CD1-CG 3.94Å; Y273-P321 HydrophobicContact CD2-CB 4.4Å; Y273-P321 HydrophobicContact CD2-CG 3.96Å; Y273-P321 HydrophobicContact CE1-CG 3.83Å; Y273-P321 HydrophobicContact CE2-CB 4.12Å; Y273-P321 HydrophobicContact CE2-CG 3.83Å; Y273-P321 HydrophobicContact CG-CG 4.02Å; Y273-E324 PolarHBondContact OH-OE1 2.77Å; Y273-E324 VanDerWaalsContact OH-OE1 3.1Å
274	I	90.2	Very high	81.1	Confident	90 Å²	90	58.5 Å²	58.5	46%	0.462	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.8	166.2	-53.9	177.3	0	0	0	108.4	L266 V267 V570	L266-I274 HydrophobicContact CD1-CG2 3.61Å; L266-I274 HydrophobicContact CD2-CG2 4.42Å; L266-I274 HydrophobicContact CG-CG2 3.85Å; V267-I274 CarbonylContact O-C 3.42Å; V267-I274 WeakPolarHBondContact O-CA 3.47Å; V267-I274 WeakPolarHBondContact O-CG2 3.49Å; I274-V570 HydrophobicContact CD1-CG1 4.13Å
275	Y	89.5	Confident	78.9	Confident	51 Å²	51	63.6 Å²	63.6	20%	0.2	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	154.4	-179.3	-61.8	-90.4	0	0	0	111.1	P243 H245 L266 V267 Y269 D272 Y273 F277	P243-Y275 HydrophobicContact CB-CE1 4.32Å; P243-Y275 HydrophobicContact CG-CD1 4.3Å; P243-Y275 HydrophobicContact CG-CD2 4.21Å; P243-Y275 HydrophobicContact CG-CE1 4.33Å; P243-Y275 HydrophobicContact CG-CE2 4.23Å; P243-Y275 HydrophobicContact CG-CG 4.26Å; H245-Y275 AromaticContact CE1-CZ 3.74Å; H245-Y275 PolarHBondContact CE1-OH 2.92Å; H245-Y275 PolarHBondContact NE2-OH 2.92Å; L266-Y275 WeakPolarHBondContact CA-O 3.28Å; V267-Y275 PolarHBondContact N-O 2.84Å; V267-Y275 PolarHBondContact O-N 2.96Å; Y269-Y275 AromaticContact CD2-CD2 3.54Å; Y269-Y275 HydrophobicContact CD2-CD2 3.54Å; Y269-Y275 AromaticContact CD2-CE2 3.94Å; Y269-Y275 HydrophobicContact CD2-CE2 3.94Å; Y269-Y275 AromaticContact CE2-CD2 3.71Å; Y269-Y275 HydrophobicContact CE2-CD2 3.71Å; Y269-Y275 HydrophobicContact CE2-CE2 4.36Å; Y269-Y275 HydrophobicContact CE2-CG 4.47Å; D272-Y275 PolarHBondContact OD1-OH 3.43Å; D272-Y275 PolarHBondContact OD2-OH 2.8Å; Y273-Y275 WeakPolarHBondContact O-CD2 3.21Å; Y273-Y275 WeakPolarHBondContact O-CE2 3.1Å; Y275-F277 HydrophobicContact CG-CZ 4.46Å
276	L	90.8	Very high	76.3	Confident	92 Å²	92	72.6 Å²	72.6	48%	0.482	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	112.7	177.2	-171.9	63.3	0	0	0	107.7	E264 L266	E264-L276 HydrophobicContact CB-CD1 3.69Å; E264-L276 HydrophobicContact CB-CG 4.2Å; E264-L276 HydrophobicContact CG-CD1 4.44Å; E264-L276 WeakPolarHBondContact OE1-CD2 3.22Å; L266-L276 HydrophobicContact CB-CD1 4.23Å; L266-L276 HydrophobicContact CD1-CB 4.49Å; L266-L276 HydrophobicContact CD1-CD1 3.96Å
277	F	90.3	Very high	73.9	Confident	30 Å²	30	73.7 Å²	73.7	13%	0.132	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138	-178.9	-60.6	-73.2	0	0	0	110.9	F241 P243 E264 V265 V267 Y269 Y275 P279	F241-F277 HydrophobicContact CB-CD1 3.85Å; F241-F277 HydrophobicContact CB-CD2 4.16Å; F241-F277 HydrophobicContact CB-CE1 3.87Å; F241-F277 HydrophobicContact CB-CE2 4.18Å; F241-F277 HydrophobicContact CB-CG 3.99Å; F241-F277 HydrophobicContact CB-CZ 4.03Å; F241-F277 HydrophobicContact CD1-CB 4.19Å; F241-F277 AromaticContact CD1-CD1 3.8Å; F241-F277 HydrophobicContact CD1-CD1 3.8Å; F241-F277 HydrophobicContact CD1-CE1 4.46Å; F241-F277 HydrophobicContact CD1-CG 4.13Å; F241-F277 HydrophobicContact CD2-CB 3.9Å; F241-F277 HydrophobicContact CD2-CD2 4.46Å; F241-F277 HydrophobicContact CD2-CG 4.07Å; F241-F277 HydrophobicContact CE1-CB 4.28Å; F241-F277 HydrophobicContact CE2-CB 3.99Å; F241-F277 HydrophobicContact CG-CB 4Å; F241-F277 AromaticContact CG-CD1 3.8Å; F241-F277 HydrophobicContact CG-CD1 3.8Å; F241-F277 HydrophobicContact CG-CD2 4.33Å; F241-F277 HydrophobicContact CG-CE1 4.34Å; F241-F277 AromaticContact CG-CG 3.79Å; F241-F277 HydrophobicContact CG-CG 3.79Å; F241-F277 HydrophobicContact CZ-CB 4.18Å; P243-F277 HydrophobicContact CG-CZ 4.01Å; E264-F277 CarbonylContact C-O 3.51Å; E264-F277 WeakPolarHBondContact CA-O 3.39Å; V265-F277 PolarHBondContact N-O 3.12Å; V265-F277 PolarHBondContact O-N 3.01Å; V267-F277 HydrophobicContact CB-CD2 4.29Å; V267-F277 HydrophobicContact CB-CE2 4Å; V267-F277 HydrophobicContact CG1-CE2 4.49Å; V267-F277 HydrophobicContact CG2-CD2 3.61Å; V267-F277 HydrophobicContact CG2-CE2 3.76Å; Y269-F277 HydrophobicContact CE2-CE2 4.47Å; Y275-F277 HydrophobicContact CG-CZ 4.46Å; F277-P279 WeakPolarHBondContact O-CD 3.47Å
278	N	88.1	Confident	71.2	Confident	72 Å²	72	83.2 Å²	83.2	39%	0.385	40%	0.402	S	S	.	.			trans	-88.1	113.9	170.2	-178.8	-15.1	0	0	0	109.2	F241 K280 D281	F241-N278 VanDerWaalsContact CZ-O 3.24Å; F241-N278 WeakPolarHBondContact CZ-O 3.49Å; N278-K280 PolarHBondContact O-N 3.39Å; N278-K280 WeakPolarHBondContact OD1-CB 3.45Å; N278-K280 PolarHBondContact OD1-N 2.87Å; N278-D281 HydrophobicContact CB-CB 4.03Å; N278-D281 PolarHBondContact O-N 2.59Å
279	P	81.8	Confident	68.9	Low	27 Å²	27	85 Å²	85	18%	0.175	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.5	179.9	31.4	-36.3	0	0	0	114	I215 Q263 F277	I215-P279 HydrophobicContact CD1-CB 3.52Å; Q263-P279 WeakPolarHBondContact O-CD 3.35Å; F277-P279 WeakPolarHBondContact O-CD 3.47Å
280	K	75.9	Confident	66.6	Low	136 Å²	136	89.2 Å²	89.2	59%	0.591	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-6.9	175.4	-53.4	172.2	-175.8	169.7	0	113.3	N278 D282	N278-K280 PolarHBondContact O-N 3.39Å; N278-K280 WeakPolarHBondContact OD1-CB 3.45Å; N278-K280 PolarHBondContact OD1-N 2.87Å; K280-D282 PolarHBondContact O-N 3.25Å
281	D	67.2	Low	64.7	Low	79 Å²	79	90.6 Å²	90.6	42%	0.422	46%	0.462	S	S	.	.			trans	-82.1	99.2	178.3	-170.4	9.4	0	0	0	110	N278 Q283	N278-D281 HydrophobicContact CB-CB 4.03Å; N278-D281 PolarHBondContact O-N 2.59Å; D281-Q283 PolarHBondContact O-N 2.89Å; D281-Q283 WeakPolarHBondContact OD1-CG 3.45Å; D281-Q283 PolarHBondContact OD1-NE2 3.14Å
282	D	53.2	Low	63.1	Low	80 Å²	80	93.5 Å²	93.5	43%	0.428	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-79.8	25.9	-161.1	-149.4	-5.6	0	0	0	114	K280 A284 R285	K280-D282 PolarHBondContact O-N 3.25Å; D282-A284 PolarHBondContact O-N 2.91Å; D282-A284 VanDerWaalsContact O-N 3.11Å; D282-R285 VanDerWaalsContact OD1-CG 3.25Å; D282-R285 WeakPolarHBondContact OD1-CG 3.35Å; D282-R285 IonicContact OD1-CZ 2.63Å; D282-R285 IonicContact OD1-NE 3.57Å; D282-R285 PolarHBondContact OD1-NE 2.9Å; D282-R285 IonicContact OD2-CZ 2.77Å; D282-R285 IonicContact OD2-NE 3.54Å; D282-R285 PolarHBondContact OD2-NE 3.48Å; D282-R285 IonicContact OD2-NH2 3.45Å; D282-R285 PolarHBondContact OD2-NH2 3Å
283	Q	49.7	Very low	61.2	Low	153 Å²	153	100.2 Å²	100.2	72%	0.715	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-62.6	-14.5	174.3	-48.4	-53.9	-38.6	0	0	112.5	D281 R285	D281-Q283 PolarHBondContact O-N 2.89Å; D281-Q283 WeakPolarHBondContact OD1-CG 3.45Å; D281-Q283 PolarHBondContact OD1-NE2 3.14Å; Q283-R285 VanDerWaalsContact C-N 3.27Å; Q283-R285 PolarHBondContact O-N 2.82Å
284	A	46.2	Very low	59.4	Low	17 Å²	17	99.8 Å²	99.8	14%	0.14	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	-80.8	9.5	-175.5	0	0	0	0	0	114.9	V239 R240 D282 L287	V239-A284 HydrophobicContact CG1-CB 3.63Å; R240-A284 WeakPolarHBondContact O-CB 3.41Å; D282-A284 PolarHBondContact O-N 2.91Å; D282-A284 VanDerWaalsContact O-N 3.11Å; A284-L287 WeakPolarHBondContact O-CG 3.28Å
285	R	43.7	Very low	57.5	Low	195 Å²	195	102.4 Å²	102.4	74%	0.736	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-76.6	-29	-179.2	-69.1	-164.9	-178.6	-160.4	6.4	114.9	D282 Q283 L287	D282-R285 VanDerWaalsContact OD1-CG 3.25Å; D282-R285 WeakPolarHBondContact OD1-CG 3.35Å; D282-R285 IonicContact OD1-CZ 2.63Å; D282-R285 IonicContact OD1-NE 3.57Å; D282-R285 PolarHBondContact OD1-NE 2.9Å; D282-R285 IonicContact OD2-CZ 2.77Å; D282-R285 IonicContact OD2-NE 3.54Å; D282-R285 PolarHBondContact OD2-NE 3.48Å; D282-R285 IonicContact OD2-NH2 3.45Å; D282-R285 PolarHBondContact OD2-NH2 3Å; Q283-R285 VanDerWaalsContact C-N 3.27Å; Q283-R285 PolarHBondContact O-N 2.82Å; R285-L287 PolarHBondContact O-N 3.05Å
286	E	38.1	Very low	55.3	Low	189 Å²	189	105.8 Å²	105.8	88%	0.883	52%	0.518	S	S	*	.			trans	-80.3	55.2	-179.4	-66.4	-146.3	138.9	0	0	113.2	K288	E286-K288 VanDerWaalsContact C-N 3.32Å; E286-K288 PolarHBondContact O-N 2.8Å
287	L	43.3	Very low	53	Low	87 Å²	87	108.9 Å²	108.9	46%	0.455	53%	0.53	S	S	.	.			trans	-78.2	77.9	177.5	-72.1	172.5	0	0	0	112.3	M237 R240 A284 R285 G289	M237-L287 HydrophobicContact CE-CD1 3.66Å; R240-L287 HydrophobicContact CB-CD1 4.28Å; R240-L287 HydrophobicContact CB-CD2 4.12Å; R240-L287 HydrophobicContact CG-CD2 4.36Å; A284-L287 WeakPolarHBondContact O-CG 3.28Å; R285-L287 PolarHBondContact O-N 3.05Å; L287-G289 PolarHBondContact O-N 2.89Å
288	K	34.8	Very low	50.9	Low	200 Å²	200	110.3 Å²	110.3	87%	0.87	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-60.1	119	151.5	-73.4	179.4	-180	171.4	0	108.2	E286	E286-K288 VanDerWaalsContact C-N 3.32Å; E286-K288 PolarHBondContact O-N 2.8Å
289	G	41.4	Very low	48.8	Very low	59 Å²	59	115.8 Å²	115.8	61%	0.608	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-62.2	155.7	173.2	0	0	0	0	0	111.3	L287 S291	L287-G289 PolarHBondContact O-N 2.89Å; G289-S291 PolarHBondContact O-N 3.5Å
290	P	41.3	Very low	46.9	Very low	94 Å²	94	121.8 Å²	121.8	61%	0.61	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-59.3	132.5	172.2	26.6	-33.9	0	0	0	109.6
291	S	41.9	Very low	45	Very low	62 Å²	62	120.1 Å²	120.1	43%	0.434	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-61.1	154.1	173.3	53.2	0	0	0	0	110.9	G289 E293 R294	G289-S291 PolarHBondContact O-N 3.5Å; S291-E293 PolarHBondContact O-N 3.45Å; S291-R294 WeakPolarHBondContact O-CB 3.45Å; S291-R294 PolarHBondContact O-N 3.04Å; S291-R294 VanDerWaalsContact O-N 3.13Å
292	E	45.5	Very low	44.1	Very low	122 Å²	122	120.8 Å²	120.8	57%	0.57	59%	0.591	S	S	*	*	S	Bend	trans	-64	-27.3	-179.2	-74	-70.6	142.4	0	0	112.3	R294 R295	E292-R294 VanDerWaalsContact C-N 3.34Å; E292-R294 PolarHBondContact O-N 2.75Å; E292-R295 WeakPolarHBondContact O-CB 3.49Å; E292-R295 PolarHBondContact O-N 3.22Å; E292-R295 IonicContact OE1-CZ 3.18Å; E292-R295 IonicContact OE1-NH1 2.85Å; E292-R295 PolarHBondContact OE1-NH1 3.46Å; E292-R295 WeakPolarHBondContact OE2-CD 3.36Å; E292-R295 IonicContact OE2-CZ 2.99Å; E292-R295 IonicContact OE2-NE 3.05Å; E292-R295 IonicContact OE2-NH1 4Å; E292-R295 PolarHBondContact OE2-NH1 3.39Å
293	E	44.5	Very low	43.5	Very low	163 Å²	163	123.2 Å²	123.2	76%	0.762	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-43.2	171.5	-64	168.6	127.8	0	0	112.4	S291 R295 E296	S291-E293 PolarHBondContact O-N 3.45Å; E293-R295 PolarHBondContact O-N 3.06Å; E293-E296 PolarHBondContact O-N 2.86Å
294	R	50	Low	43.1	Very low	97 Å²	97	125 Å²	125	37%	0.366	62%	0.615	S	S	.	*	H	α-helix	trans	-64.8	-8.7	177.7	-177.6	174.6	-76.7	-144.7	-2.5	112.8	S247 N248 S291 E292 L298	S247-R294 PolarHBondContact O-NH1 2.78Å; N248-R294 PolarHBondContact OD1-NH2 3.27Å; S291-R294 WeakPolarHBondContact O-CB 3.45Å; S291-R294 PolarHBondContact O-N 3.04Å; S291-R294 VanDerWaalsContact O-N 3.13Å; E292-R294 VanDerWaalsContact C-N 3.34Å; E292-R294 PolarHBondContact O-N 2.75Å; R294-L298 HydrophobicContact CG-CD1 3.91Å
295	R	51.2	Low	43.3	Very low	146 Å²	146	128.6 Å²	128.6	55%	0.551	62%	0.624	S	S	*	*	H	α-helix	trans	-77.8	-30.7	178.8	-158	172.8	-178.4	171.9	-2.9	112.6	E292 E293	E292-R295 WeakPolarHBondContact O-CB 3.49Å; E292-R295 PolarHBondContact O-N 3.22Å; E292-R295 IonicContact OE1-CZ 3.18Å; E292-R295 IonicContact OE1-NH1 2.85Å; E292-R295 PolarHBondContact OE1-NH1 3.46Å; E292-R295 WeakPolarHBondContact OE2-CD 3.36Å; E292-R295 IonicContact OE2-CZ 2.99Å; E292-R295 IonicContact OE2-NE 3.05Å; E292-R295 IonicContact OE2-NH1 4Å; E292-R295 PolarHBondContact OE2-NH1 3.39Å; E293-R295 PolarHBondContact O-N 3.06Å
296	E	43.3	Very low	43.2	Very low	122 Å²	122	126 Å²	126	57%	0.57	62%	0.624	S	S	*	*	H	α-helix	trans	-86.3	-46.9	-173.6	-148.1	84.4	-118.4	0	0	112.2	E293 L298 R299	E293-E296 PolarHBondContact O-N 2.86Å; E296-L298 VanDerWaalsContact C-N 3.3Å; E296-L298 PolarHBondContact O-N 2.94Å; E296-R299 PolarHBondContact O-N 3.26Å; E296-R299 IonicContact OE1-CZ 3.83Å; E296-R299 IonicContact OE1-NH1 2.8Å; E296-R299 PolarHBondContact OE1-NH1 3.22Å; E296-R299 IonicContact OE1-NH2 2.65Å
297	E	40.8	Very low	43.9	Very low	157 Å²	157	123 Å²	123	73%	0.734	61%	0.605	S	S	*	*	H	α-helix	trans	-62.7	-33.8	-177	-63.1	-173.5	123.3	0	0	113.5	R299	E297-R299 PolarHBondContact O-N 2.9Å
298	L	47.2	Very low	44.1	Very low	59 Å²	59	122.6 Å²	122.6	31%	0.309	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	42.6	179.2	-69.8	176	0	0	0	112.2	R189 R294 E296	R189-L298 PolarHBondContact NH1-O 2.85Å; R189-L298 PolarHBondContact NH2-O 2.85Å; R294-L298 HydrophobicContact CG-CD1 3.91Å; E296-L298 VanDerWaalsContact C-N 3.3Å; E296-L298 PolarHBondContact O-N 2.94Å
299	R	44	Very low	44.7	Very low	187 Å²	187	124.5 Å²	124.5	71%	0.706	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	7.2	168.3	-91.5	-164	179.6	118.3	4.1	113.6	E296 E297	E296-R299 PolarHBondContact O-N 3.26Å; E296-R299 IonicContact OE1-CZ 3.83Å; E296-R299 IonicContact OE1-NH1 2.8Å; E296-R299 PolarHBondContact OE1-NH1 3.22Å; E296-R299 IonicContact OE1-NH2 2.65Å; E297-R299 PolarHBondContact O-N 2.9Å
300	Q	41.9	Very low	45.2	Very low	154 Å²	154	124 Å²	124	72%	0.72	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-55.9	123.6	171.6	-63.8	-169.8	10.1	0	0	109.8
301	P	36.6	Very low	45.7	Very low	101 Å²	101	120.9 Å²	120.9	66%	0.656	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.9	150.5	173.7	28.8	-34.2	0	0	0	109.2	V303	P301-V303 PolarHBondContact O-N 2.93Å
302	P	47.6	Very low	46.4	Very low	92 Å²	92	125.3 Å²	125.3	60%	0.597	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-59	116.2	171.7	25.8	-33	0	0	0	108.1	K304	P302-K304 PolarHBondContact O-N 2.91Å
303	V	40	Very low	46.9	Very low	132 Å²	132	121.1 Å²	121.1	80%	0.8	57%	0.569	S	S	*	*			trans	-62	102	179.1	-178.8	0	0	0	0	107.5	P301 R305	P301-V303 PolarHBondContact O-N 2.93Å; V303-R305 PolarHBondContact O-N 3.21Å
304	K	42	Very low	47.2	Very low	191 Å²	191	115.3 Å²	115.3	83%	0.83	54%	0.543	S	S	*	.			trans	-69.1	80.4	174.8	-70.6	-172.8	178.2	-177.2	0	107.9	P302 L306	P302-K304 PolarHBondContact O-N 2.91Å; K304-L306 PolarHBondContact O-N 3.17Å
305	R	49.9	Very low	47.4	Very low	92 Å²	92	112.4 Å²	112.4	35%	0.347	54%	0.536	S	S	.	.			trans	-57.2	105.3	173.2	-178.4	179.6	176.4	121.5	1	107.5	V303 R307 D311 S313 D314	V303-R305 PolarHBondContact O-N 3.21Å; R305-R307 PolarHBondContact O-N 2.81Å; R305-D311 IonicContact CZ-OD2 3.96Å; R305-D311 IonicContact NE-OD2 3.39Å; R305-D311 PolarHBondContact NE-OD2 2.88Å; R305-D311 IonicContact NH2-OD1 3.12Å; R305-D311 IonicContact NH2-OD2 3.96Å; R305-D311 PolarHBondContact NH2-OD2 3.31Å; R305-S313 PolarHBondContact NH2-OG 3.29Å; R305-D314 IonicContact NE-OD2 3.32Å
306	L	42.4	Very low	47.5	Very low	140 Å²	140	106 Å²	106	73%	0.733	52%	0.516	S	S	*	.			trans	-64.4	100.3	174.6	-178.6	69.9	0	0	0	108	K304	K304-L306 PolarHBondContact O-N 3.17Å
307	R	52.4	Low	47.9	Very low	127 Å²	127	105 Å²	105	48%	0.479	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-79.3	123.9	170.4	-64.5	-164.5	-172.4	102.1	2.5	108.7	R305 D314	R305-R307 PolarHBondContact O-N 2.81Å; R307-D314 IonicContact CZ-OD1 3.89Å; R307-D314 IonicContact CZ-OD2 3.01Å; R307-D314 VanDerWaalsContact CZ-OD2 3.27Å; R307-D314 IonicContact NE-OD1 3.92Å; R307-D314 PolarHBondContact NE-OD1 3.34Å; R307-D314 IonicContact NE-OD2 3.15Å; R307-D314 PolarHBondContact NE-OD2 3.11Å; R307-D314 IonicContact NH2-OD1 3.62Å; R307-D314 PolarHBondContact NH2-OD1 2.83Å; R307-D314 IonicContact NH2-OD2 2.91Å; R307-D314 PolarHBondContact NH2-OD2 3.13Å
308	L	47.3	Very low	48.7	Very low	78 Å²	78	108.8 Å²	108.8	41%	0.408	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-78.7	155.3	164.5	-60.9	175.4	0	0	0	108.6	G310 D311 M344	L308-G310 PolarHBondContact O-N 2.93Å; L308-G310 VanDerWaalsContact O-N 3.13Å; L308-D311 PolarHBondContact O-N 3.31Å; L308-M344 HydrophobicContact CB-CE 4.29Å; L308-M344 HydrophobicContact CB-SD 4.29Å; L308-M344 HydrophobicContact CD1-SD 3.92Å
309	R	47.8	Very low	49.5	Very low	239 Å²	239	107.9 Å²	107.9	90%	0.902	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	122.6	173.7	-81.8	-169.6	171.3	-149.8	-3.3	108.8
310	G	51.2	Low	50.6	Low	48 Å²	48	104.9 Å²	104.9	50%	0.495	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	-9.5	-175.4	0	0	0	0	0	115.9	L308 W312	L308-G310 PolarHBondContact O-N 2.93Å; L308-G310 VanDerWaalsContact O-N 3.13Å; G310-W312 PolarHBondContact O-N 2.78Å
311	D	52.5	Low	51.8	Low	29 Å²	29	98.3 Å²	98.3	16%	0.155	49%	0.488	C	S	.	.			trans	-75.7	76.5	170.2	-174.3	19.9	0	0	0	111.3	R305 L308 S313 M344	R305-D311 IonicContact CZ-OD2 3.96Å; R305-D311 IonicContact NE-OD2 3.39Å; R305-D311 PolarHBondContact NE-OD2 2.88Å; R305-D311 IonicContact NH2-OD1 3.12Å; R305-D311 IonicContact NH2-OD2 3.96Å; R305-D311 PolarHBondContact NH2-OD2 3.31Å; L308-D311 PolarHBondContact O-N 3.31Å; D311-S313 WeakPolarHBondContact OD1-CB 3.42Å; D311-S313 PolarHBondContact OD1-N 3.23Å; D311-S313 PolarHBondContact OD1-OG 3.32Å; D311-M344 HydrophobicContact CB-CE 3.78Å
312	W	56.1	Low	53.2	Low	155 Å²	155	96.8 Å²	96.8	59%	0.587	47%	0.472	S	S	*	.			trans	-86.6	15.9	169	-55.1	111.3	0	0	0	112.3	G310 D314 T315 G316	G310-W312 PolarHBondContact O-N 2.78Å; W312-D314 PolarHBondContact O-N 3.16Å; W312-D314 VanDerWaalsContact O-N 3.1Å; W312-T315 PolarHBondContact O-N 3.05Å; W312-G316 PolarHBondContact O-N 2.79Å
313	S	57.1	Low	54.1	Low	35 Å²	35	94.5 Å²	94.5	25%	0.245	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.6	-172.9	68.9	0	0	0	0	114.6	R305 D311 R325	R305-S313 PolarHBondContact NH2-OG 3.29Å; D311-S313 WeakPolarHBondContact OD1-CB 3.42Å; D311-S313 PolarHBondContact OD1-N 3.23Å; D311-S313 PolarHBondContact OD1-OG 3.32Å; S313-R325 PolarHBondContact O-NH2 3.46Å
314	D	50.1	Low	55.4	Low	41 Å²	41	91.2 Å²	91.2	22%	0.219	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-1.6	177.3	73.6	-12.4	0	0	0	114.2	R305 R307 W312	R305-D314 IonicContact NE-OD2 3.32Å; R307-D314 IonicContact CZ-OD1 3.89Å; R307-D314 IonicContact CZ-OD2 3.01Å; R307-D314 VanDerWaalsContact CZ-OD2 3.27Å; R307-D314 IonicContact NE-OD1 3.92Å; R307-D314 PolarHBondContact NE-OD1 3.34Å; R307-D314 IonicContact NE-OD2 3.15Å; R307-D314 PolarHBondContact NE-OD2 3.11Å; R307-D314 IonicContact NH2-OD1 3.62Å; R307-D314 PolarHBondContact NH2-OD1 2.83Å; R307-D314 IonicContact NH2-OD2 2.91Å; R307-D314 PolarHBondContact NH2-OD2 3.13Å; W312-D314 PolarHBondContact O-N 3.16Å; W312-D314 VanDerWaalsContact O-N 3.1Å
315	T	54.1	Low	56.5	Low	35 Å²	35	84 Å²	84	22%	0.215	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.8	-19.3	-167.1	33.5	0	0	0	0	115.2	W312 L573	W312-T315 PolarHBondContact O-N 3.05Å; T315-L573 HydrophobicContact CG2-CD2 4.17Å; T315-L573 WeakPolarHBondContact O-CD2 3.09Å
316	G	53.7	Low	57.1	Low	12 Å²	12	84.7 Å²	84.7	12%	0.124	41%	0.409	C	S	.	.	S	Bend	trans	-92.8	-178.6	177.8	0	0	0	0	0	114.1	W312 R318 A319	W312-G316 PolarHBondContact O-N 2.79Å; G316-R318 PolarHBondContact O-N 2.67Å; G316-A319 VanDerWaalsContact O-CB 3.22Å; G316-A319 WeakPolarHBondContact O-CB 3.16Å; G316-A319 PolarHBondContact O-N 2.81Å
317	P	51	Low	57.9	Low	101 Å²	101	88.2 Å²	88.2	66%	0.656	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	0	-169.1	27.6	-36.7	0	0	0	116.1
318	R	58.5	Low	58.2	Low	237 Å²	237	86.7 Å²	86.7	89%	0.894	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	4.4	170.8	-64.7	-173.7	-177.1	174.8	3.3	113.2	G316 R320	G316-R318 PolarHBondContact O-N 2.67Å; R318-R320 PolarHBondContact O-N 2.67Å
319	A	63.5	Low	58.7	Low	40 Å²	40	85.8 Å²	85.8	33%	0.331	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-67.4	118.3	179	0	0	0	0	0	110.7	G316	G316-A319 VanDerWaalsContact O-CB 3.22Å; G316-A319 WeakPolarHBondContact O-CB 3.16Å; G316-A319 PolarHBondContact O-N 2.81Å
320	R	66.6	Low	59.1	Low	123 Å²	123	79.8 Å²	79.8	46%	0.464	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-101	149.8	172.6	-67.9	-173.2	-170.1	172	4.4	111.9	R318 E324 R325 D328	R318-R320 PolarHBondContact O-N 2.67Å; R320-E324 HydrophobicContact CB-CB 4.45Å; R320-E324 WeakPolarHBondContact CB-OE2 3.44Å; R320-E324 WeakPolarHBondContact CD-OE2 3.06Å; R320-E324 WeakPolarHBondContact CG-OE2 3.48Å; R320-R325 PolarHBondContact O-NE 2.93Å; R320-R325 VanDerWaalsContact O-NE 3.1Å; R320-R325 PolarHBondContact O-NH2 3.18Å; R320-D328 IonicContact NH1-OD2 2.9Å; R320-D328 PolarHBondContact NH1-OD2 2.93Å
321	P	67.3	Low	59.2	Low	16 Å²	16	81 Å²	81	10%	0.104	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-48	147.1	165.3	-30.7	38.4	0	0	0	113.4	S271 Y273 S323 E324 R325	S271-P321 CarbonylContact O-C 3.59Å; S271-P321 WeakPolarHBondContact O-CA 3.42Å; Y273-P321 HydrophobicContact CD1-CG 3.94Å; Y273-P321 HydrophobicContact CD2-CB 4.4Å; Y273-P321 HydrophobicContact CD2-CG 3.96Å; Y273-P321 HydrophobicContact CE1-CG 3.83Å; Y273-P321 HydrophobicContact CE2-CB 4.12Å; Y273-P321 HydrophobicContact CE2-CG 3.83Å; Y273-P321 HydrophobicContact CG-CG 4.02Å; P321-S323 PolarHBondContact O-N 2.89Å; P321-E324 HydrophobicContact CB-CG 4.39Å; P321-E324 PolarHBondContact O-N 2.87Å; P321-E324 VanDerWaalsContact O-N 3.13Å; P321-R325 PolarHBondContact O-N 2.86Å
322	E	66.8	Low	58.7	Low	70 Å²	70	82.6 Å²	82.6	33%	0.327	41%	0.412	S	S	.	.	H	α-helix	trans	-65	-30.8	178.4	-175.4	155.8	-135.8	0	0	111.9	S271 E324 R325 E326 H331	S271-E322 PolarHBondContact O-N 2.96Å; E322-E324 VanDerWaalsContact C-N 3.26Å; E322-E324 PolarHBondContact O-N 3.37Å; E322-R325 WeakPolarHBondContact O-CB 3.09Å; E322-R325 PolarHBondContact O-N 2.6Å; E322-R325 VanDerWaalsContact O-N 3.12Å; E322-E326 WeakPolarHBondContact O-CB 3.37Å; E322-E326 WeakPolarHBondContact O-CG 3.39Å; E322-E326 PolarHBondContact O-N 3.14Å; E322-H331 IonicContact OE1-CE1 2.77Å; E322-H331 PolarHBondContact OE1-CE1 2.99Å; E322-H331 IonicContact OE1-ND1 3.82Å; E322-H331 PolarHBondContact OE1-ND1 2.85Å
323	S	64.8	Low	58.2	Low	44 Å²	44	81.3 Å²	81.3	31%	0.308	42%	0.423	S	S	.	.	H	α-helix	trans	-66.9	-20.4	173.8	57.7	0	0	0	0	114.5	P321	P321-S323 PolarHBondContact O-N 2.89Å
324	E	69.1	Low	57.4	Low	63 Å²	63	86.5 Å²	86.5	29%	0.294	45%	0.448	S	S	.	.	H	α-helix	trans	-81.8	-39.4	168.7	-64.2	-167.3	138.7	0	0	110.8	Y273 R320 P321 E322 R327 D328	Y273-E324 PolarHBondContact OH-OE1 2.77Å; Y273-E324 VanDerWaalsContact OH-OE1 3.1Å; R320-E324 HydrophobicContact CB-CB 4.45Å; R320-E324 WeakPolarHBondContact CB-OE2 3.44Å; R320-E324 WeakPolarHBondContact CD-OE2 3.06Å; R320-E324 WeakPolarHBondContact CG-OE2 3.48Å; P321-E324 HydrophobicContact CB-CG 4.39Å; P321-E324 PolarHBondContact O-N 2.87Å; P321-E324 VanDerWaalsContact O-N 3.13Å; E322-E324 VanDerWaalsContact C-N 3.26Å; E322-E324 PolarHBondContact O-N 3.37Å; E324-R327 WeakPolarHBondContact O-CB 3.3Å; E324-R327 PolarHBondContact O-N 2.76Å; E324-R327 VanDerWaalsContact O-N 3.13Å; E324-D328 PolarHBondContact O-N 3.32Å
325	R	64.8	Low	57.5	Low	40 Å²	40	86 Å²	86	15%	0.151	45%	0.447	C	S	.	.	H	α-helix	trans	-66.3	-40.5	176.8	-59.3	177.6	-161.4	-119.8	6.1	112.9	S313 R320 P321 E322 R327 D328 G329 E330	S313-R325 PolarHBondContact O-NH2 3.46Å; R320-R325 PolarHBondContact O-NE 2.93Å; R320-R325 VanDerWaalsContact O-NE 3.1Å; R320-R325 PolarHBondContact O-NH2 3.18Å; P321-R325 PolarHBondContact O-N 2.86Å; E322-R325 WeakPolarHBondContact O-CB 3.09Å; E322-R325 PolarHBondContact O-N 2.6Å; E322-R325 VanDerWaalsContact O-N 3.12Å; R325-R327 PolarHBondContact O-N 3.08Å; R325-D328 PolarHBondContact O-N 3.18Å; R325-G329 PolarHBondContact O-N 3.48Å; R325-E330 HydrophobicContact CB-CB 4.19Å; R325-E330 PolarHBondContact O-N 2.8Å
326	E	61.6	Low	57.5	Low	105 Å²	105	87 Å²	87	49%	0.491	46%	0.455	S	S	.	.	H	α-helix	trans	-55.8	-36.6	171	-76.4	173.4	173.1	0	0	110.8	K249 E322	K249-E326 IonicContact NZ-OE1 3.75Å; K249-E326 PolarHBondContact NZ-OE1 2.93Å; K249-E326 IonicContact NZ-OE2 2.76Å; E322-E326 WeakPolarHBondContact O-CB 3.37Å; E322-E326 WeakPolarHBondContact O-CG 3.39Å; E322-E326 PolarHBondContact O-N 3.14Å
327	R	60.2	Low	57.4	Low	214 Å²	214	91.9 Å²	91.9	81%	0.808	48%	0.478	S	S	*	.	H	α-helix	trans	-82.2	-40.3	-178.9	-174.5	-176.6	-58.2	-154.5	-0.6	113.6	E324 R325 G329	E324-R327 WeakPolarHBondContact O-CB 3.3Å; E324-R327 PolarHBondContact O-N 2.76Å; E324-R327 VanDerWaalsContact O-N 3.13Å; R325-R327 PolarHBondContact O-N 3.08Å; R327-G329 PolarHBondContact O-N 3.46Å
328	D	59.1	Low	57.4	Low	96 Å²	96	93.9 Å²	93.9	51%	0.513	48%	0.48	S	S	.	.	H	α-helix	trans	-77.8	-5.2	178.1	-73.6	-4.1	0	0	0	112.1	R320 E324 R325 E330	R320-D328 IonicContact NH1-OD2 2.9Å; R320-D328 PolarHBondContact NH1-OD2 2.93Å; E324-D328 PolarHBondContact O-N 3.32Å; R325-D328 PolarHBondContact O-N 3.18Å; D328-E330 HydrophobicContact CB-CG 4.48Å
329	G	56.3	Low	57.4	Low	59 Å²	59	87.3 Å²	87.3	61%	0.608	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	8.5	175.3	0	0	0	0	0	115.1	R325 R327 H331	R325-G329 PolarHBondContact O-N 3.48Å; R327-G329 PolarHBondContact O-N 3.46Å; G329-H331 PolarHBondContact O-N 2.59Å
330	E	57.1	Low	57.2	Low	112 Å²	112	90.9 Å²	90.9	52%	0.523	47%	0.465	S	S	.	.			trans	-72.6	-8	-174.9	-64.2	-166.7	146.6	0	0	114.2	R325 D328	R325-E330 HydrophobicContact CB-CB 4.19Å; R325-E330 PolarHBondContact O-N 2.8Å; D328-E330 HydrophobicContact CB-CG 4.48Å
331	H	53	Low	56.5	Low	73 Å²	73	88.9 Å²	88.9	34%	0.338	46%	0.461	S	S	.	.			trans	-117.6	104.2	176.3	-90.3	-174.8	0	0	0	112.1	E322 G329	E322-H331 IonicContact OE1-CE1 2.77Å; E322-H331 PolarHBondContact OE1-CE1 2.99Å; E322-H331 IonicContact OE1-ND1 3.82Å; E322-H331 PolarHBondContact OE1-ND1 2.85Å; G329-H331 PolarHBondContact O-N 2.59Å
332	S	42	Very low	56.2	Low	64 Å²	64	91.1 Å²	91.1	45%	0.448	48%	0.477	S	S	.	.			trans	-95.1	141.7	138.7	70.5	0	0	0	0	108.4	N334 V335	S332-N334 PolarHBondContact O-N 3.11Å; S332-V335 PolarHBondContact O-N 3.05Å; S332-V335 WeakPolarHBondContact OG-CG2 3.48Å
333	P	44.6	Very low	55.7	Low	128 Å²	128	91.4 Å²	91.4	83%	0.831	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.4	-176.8	26.8	-34.8	0	0	0	113.6
334	N	41.4	Very low	55.3	Low	143 Å²	143	92.5 Å²	92.5	77%	0.765	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	13.6	-175.4	-64	-21.3	0	0	0	113.9	S332 S336	S332-N334 PolarHBondContact O-N 3.11Å; N334-S336 PolarHBondContact O-N 2.87Å
335	V	51.6	Low	54.9	Low	32 Å²	32	94.7 Å²	94.7	19%	0.194	50%	0.495	C	S	.	.			trans	-59.7	106.7	171.4	177.5	0	0	0	0	108.9	S332 Q339 R340	S332-V335 PolarHBondContact O-N 3.05Å; S332-V335 WeakPolarHBondContact OG-CG2 3.48Å; V335-Q339 HydrophobicContact CG1-CB 3.94Å; V335-Q339 HydrophobicContact CG1-CG 4.03Å; V335-R340 HydrophobicContact CG1-CG 4.12Å
336	S	55.1	Low	55	Low	56 Å²	56	95.9 Å²	95.9	39%	0.392	51%	0.51	S	S	.	.			trans	-62.1	157	-170.7	69.9	0	0	0	0	112.8	N334 M338 Q339 R340	N334-S336 PolarHBondContact O-N 2.87Å; S336-M338 PolarHBondContact O-N 2.89Å; S336-Q339 PolarHBondContact O-N 3.31Å; S336-Q339 PolarHBondContact OG-N 2.82Å; S336-R340 PolarHBondContact O-N 3.31Å
337	L	51.4	Low	55.2	Low	114 Å²	114	98.6 Å²	98.6	60%	0.597	52%	0.516	S	S	*	.	H	α-helix	trans	-54.8	-39.4	173.5	-178	63.1	0	0	0	111.5	Q339 R340 M341	L337-Q339 PolarHBondContact O-N 3.12Å; L337-R340 PolarHBondContact O-N 2.98Å; L337-M341 HydrophobicContact CD1-CE 4.05Å; L337-M341 HydrophobicContact CD2-CE 4.04Å; L337-M341 HydrophobicContact CG-CE 3.82Å; L337-M341 HydrophobicContact CG-SD 4.24Å; L337-M341 WeakPolarHBondContact O-CG 3.49Å; L337-M341 PolarHBondContact O-N 3.01Å
338	M	50	Low	55.2	Low	142 Å²	142	97.1 Å²	97.1	70%	0.7	51%	0.51	S	S	*	.	H	α-helix	trans	-56.9	-46.3	173.1	-79.2	167.2	51.3	0	0	112.3	S336 R340 M341 S342	S336-M338 PolarHBondContact O-N 2.89Å; M338-R340 PolarHBondContact O-N 3.03Å; M338-M341 CarbonylContact O-C 3.55Å; M338-M341 WeakPolarHBondContact O-CA 3.26Å; M338-M341 WeakPolarHBondContact O-CB 3.31Å; M338-M341 PolarHBondContact O-N 3.44Å; M338-M341 VanDerWaalsContact O-N 3.1Å; M338-S342 PolarHBondContact O-N 3.25Å; M338-S342 PolarHBondContact O-OG 2.9Å; M338-S342 VanDerWaalsContact O-OG 3.13Å
339	Q	60.1	Low	55.3	Low	100 Å²	100	100.6 Å²	100.6	47%	0.467	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-37.7	-177.2	-169.5	167.5	2.5	0	0	111.9	V335 S336 L337 M341 S342 D343	V335-Q339 HydrophobicContact CG1-CB 3.94Å; V335-Q339 HydrophobicContact CG1-CG 4.03Å; S336-Q339 PolarHBondContact O-N 3.31Å; S336-Q339 PolarHBondContact OG-N 2.82Å; L337-Q339 PolarHBondContact O-N 3.12Å; Q339-M341 VanDerWaalsContact C-N 3.31Å; Q339-M341 PolarHBondContact O-N 2.89Å; Q339-S342 WeakPolarHBondContact O-CB 3.38Å; Q339-S342 PolarHBondContact O-N 3.1Å; Q339-S342 VanDerWaalsContact O-N 3.17Å; Q339-D343 VanDerWaalsContact O-CG 3.29Å; Q339-D343 PolarHBondContact O-N 3.32Å
340	R	58.2	Low	56	Low	115 Å²	115	103.8 Å²	103.8	43%	0.434	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-34.4	171.3	-63.6	-176.6	-178.9	176.1	0.5	112.6	V335 S336 L337 M338 M344	V335-R340 HydrophobicContact CG1-CG 4.12Å; S336-R340 PolarHBondContact O-N 3.31Å; L337-R340 PolarHBondContact O-N 2.98Å; M338-R340 PolarHBondContact O-N 3.03Å; R340-M344 PolarHBondContact O-N 3.12Å; R340-M344 VanDerWaalsContact O-N 3.15Å
341	M	51.9	Low	56.2	Low	81 Å²	81	104.6 Å²	104.6	40%	0.399	52%	0.524	S	S	.	.	H	α-helix	trans	-69.2	-38.5	171.4	-70.1	170.5	171.2	0	0	111.6	L337 M338 Q339 M344 L345	L337-M341 HydrophobicContact CD1-CE 4.05Å; L337-M341 HydrophobicContact CD2-CE 4.04Å; L337-M341 HydrophobicContact CG-CE 3.82Å; L337-M341 HydrophobicContact CG-SD 4.24Å; L337-M341 WeakPolarHBondContact O-CG 3.49Å; L337-M341 PolarHBondContact O-N 3.01Å; M338-M341 CarbonylContact O-C 3.55Å; M338-M341 WeakPolarHBondContact O-CA 3.26Å; M338-M341 WeakPolarHBondContact O-CB 3.31Å; M338-M341 PolarHBondContact O-N 3.44Å; M338-M341 VanDerWaalsContact O-N 3.1Å; Q339-M341 VanDerWaalsContact C-N 3.31Å; Q339-M341 PolarHBondContact O-N 2.89Å; M341-M344 PolarHBondContact O-N 2.82Å; M341-L345 WeakPolarHBondContact O-CB 3.44Å; M341-L345 VanDerWaalsContact O-CG 3.26Å; M341-L345 WeakPolarHBondContact O-CG 3.28Å; M341-L345 PolarHBondContact O-N 3.49Å
342	S	60.8	Low	56.6	Low	62 Å²	62	103.4 Å²	103.4	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-46.4	173.9	-61.6	0	0	0	0	111.6	M338 Q339 M344 L345 S346	M338-S342 PolarHBondContact O-N 3.25Å; M338-S342 PolarHBondContact O-OG 2.9Å; M338-S342 VanDerWaalsContact O-OG 3.13Å; Q339-S342 WeakPolarHBondContact O-CB 3.38Å; Q339-S342 PolarHBondContact O-N 3.1Å; Q339-S342 VanDerWaalsContact O-N 3.17Å; S342-M344 VanDerWaalsContact C-N 3.3Å; S342-M344 PolarHBondContact O-N 3Å; S342-L345 PolarHBondContact O-N 3.3Å; S342-S346 WeakPolarHBondContact O-CB 3.41Å; S342-S346 PolarHBondContact O-N 2.91Å; S342-S346 PolarHBondContact O-OG 3.39Å; S342-S346 VanDerWaalsContact O-OG 3.07Å
343	D	57.5	Low	57.6	Low	77 Å²	77	103.5 Å²	103.5	41%	0.412	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-37.1	176.8	-63.4	-26.8	0	0	0	112	Q339 R347	Q339-D343 VanDerWaalsContact O-CG 3.29Å; Q339-D343 PolarHBondContact O-N 3.32Å; D343-R347 WeakPolarHBondContact O-CG 3.41Å; D343-R347 PolarHBondContact O-N 3.18Å
344	M	55	Low	58.4	Low	67 Å²	67	104.1 Å²	104.1	33%	0.33	52%	0.519	S	S	.	.	H	α-helix	trans	-65.8	-47.8	171.9	-103.4	-170	154.3	0	0	112.1	L308 D311 R340 M341 S342 R347 W348	L308-M344 HydrophobicContact CB-CE 4.29Å; L308-M344 HydrophobicContact CB-SD 4.29Å; L308-M344 HydrophobicContact CD1-SD 3.92Å; D311-M344 HydrophobicContact CB-CE 3.78Å; R340-M344 PolarHBondContact O-N 3.12Å; R340-M344 VanDerWaalsContact O-N 3.15Å; M341-M344 PolarHBondContact O-N 2.82Å; S342-M344 VanDerWaalsContact C-N 3.3Å; S342-M344 PolarHBondContact O-N 3Å; M344-R347 PolarHBondContact O-N 2.96Å; M344-W348 WeakPolarHBondContact O-CB 3.15Å; M344-W348 PolarHBondContact O-N 3.37Å
345	L	60.5	Low	59.2	Low	108 Å²	108	99.8 Å²	99.8	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-63.8	-40.7	179.7	-74.9	168.2	0	0	0	111.7	M341 S342 W348 F349	M341-L345 WeakPolarHBondContact O-CB 3.44Å; M341-L345 VanDerWaalsContact O-CG 3.26Å; M341-L345 WeakPolarHBondContact O-CG 3.28Å; M341-L345 PolarHBondContact O-N 3.49Å; S342-L345 PolarHBondContact O-N 3.3Å; L345-W348 PolarHBondContact O-N 3.29Å; L345-F349 WeakPolarHBondContact O-CB 3.5Å; L345-F349 PolarHBondContact O-N 3.11Å
346	S	66.9	Low	59.4	Low	66 Å²	66	105.3 Å²	105.3	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-59.2	-51	174.7	-66.9	0	0	0	0	111.3	S342 W348 F349 E350	S342-S346 WeakPolarHBondContact O-CB 3.41Å; S342-S346 PolarHBondContact O-N 2.91Å; S342-S346 PolarHBondContact O-OG 3.39Å; S342-S346 VanDerWaalsContact O-OG 3.07Å; S346-W348 VanDerWaalsContact C-N 3.31Å; S346-W348 PolarHBondContact O-N 3.18Å; S346-F349 WeakPolarHBondContact O-CB 3.21Å; S346-F349 PolarHBondContact O-N 3.29Å; S346-F349 VanDerWaalsContact O-N 3.12Å; S346-E350 WeakPolarHBondContact O-CG 3.38Å; S346-E350 PolarHBondContact O-N 3.45Å
347	R	65.8	Low	59.4	Low	162 Å²	162	106.8 Å²	106.8	61%	0.611	54%	0.538	S	S	*	.	H	α-helix	trans	-61.8	-37.6	176.9	-72.7	173.6	-178.4	166.6	5.2	112.7	D343 M344 F349 E350 E351	D343-R347 WeakPolarHBondContact O-CG 3.41Å; D343-R347 PolarHBondContact O-N 3.18Å; M344-R347 PolarHBondContact O-N 2.96Å; R347-F349 VanDerWaalsContact C-N 3.32Å; R347-E350 PolarHBondContact O-N 3.28Å; R347-E351 VanDerWaalsContact O-CB 3.29Å; R347-E351 WeakPolarHBondContact O-CB 3.48Å; R347-E351 PolarHBondContact O-N 2.83Å
348	W	60.1	Low	59.4	Low	182 Å²	182	106 Å²	106	69%	0.689	54%	0.541	S	S	*	.	H	α-helix	trans	-70.1	-30.9	176.9	-158.1	49.7	0	0	0	112.1	M344 L345 S346 A352	M344-W348 WeakPolarHBondContact O-CB 3.15Å; M344-W348 PolarHBondContact O-N 3.37Å; L345-W348 PolarHBondContact O-N 3.29Å; S346-W348 VanDerWaalsContact C-N 3.31Å; S346-W348 PolarHBondContact O-N 3.18Å; W348-A352 WeakPolarHBondContact O-CB 3.36Å; W348-A352 PolarHBondContact O-N 2.88Å
349	F	62.6	Low	59.2	Low	170 Å²	170	109.6 Å²	109.6	75%	0.746	55%	0.547	S	S	*	.	H	α-helix	trans	-71.9	-40.3	172.5	-136.4	-84.4	0	0	0	112.1	L345 S346 R347 S353	L345-F349 WeakPolarHBondContact O-CB 3.5Å; L345-F349 PolarHBondContact O-N 3.11Å; S346-F349 WeakPolarHBondContact O-CB 3.21Å; S346-F349 PolarHBondContact O-N 3.29Å; S346-F349 VanDerWaalsContact O-N 3.12Å; R347-F349 VanDerWaalsContact C-N 3.32Å; F349-S353 VanDerWaalsContact O-CB 3.28Å; F349-S353 WeakPolarHBondContact O-CB 3.46Å; F349-S353 PolarHBondContact O-N 3.21Å
350	E	69.8	Low	58.2	Low	125 Å²	125	108.1 Å²	108.1	58%	0.584	56%	0.559	S	S	*	*	H	α-helix	trans	-61.3	-52.1	172.4	-70.5	171.9	152.4	0	0	110.7	S346 R347 A352 S353 E354	S346-E350 WeakPolarHBondContact O-CG 3.38Å; S346-E350 PolarHBondContact O-N 3.45Å; R347-E350 PolarHBondContact O-N 3.28Å; E350-A352 PolarHBondContact O-N 2.75Å; E350-S353 CarbonylContact O-C 3.52Å; E350-S353 WeakPolarHBondContact O-CA 3.32Å; E350-S353 WeakPolarHBondContact O-CB 3.25Å; E350-S353 PolarHBondContact O-N 3.09Å; E350-E354 PolarHBondContact O-N 3.46Å
351	E	62.3	Low	57.2	Low	129 Å²	129	107.8 Å²	107.8	60%	0.603	57%	0.574	S	S	*	*	H	α-helix	trans	-61.3	-39.9	178.5	-173.7	172.8	-144.1	0	0	112.2	R347 A355	R347-E351 VanDerWaalsContact O-CB 3.29Å; R347-E351 WeakPolarHBondContact O-CB 3.48Å; R347-E351 PolarHBondContact O-N 2.83Å; E351-A355 VanDerWaalsContact O-CB 3.29Å; E351-A355 WeakPolarHBondContact O-CB 3.49Å; E351-A355 PolarHBondContact O-N 2.96Å
352	A	60	Low	56.2	Low	48 Å²	48	115.8 Å²	115.8	40%	0.397	60%	0.6	S	S	.	*	H	α-helix	trans	-66.2	-35.1	172.3	0	0	0	0	0	112.8	W348 E350 A355 Q356	W348-A352 WeakPolarHBondContact O-CB 3.36Å; W348-A352 PolarHBondContact O-N 2.88Å; E350-A352 PolarHBondContact O-N 2.75Å; A352-A355 PolarHBondContact O-N 2.76Å; A352-Q356 WeakPolarHBondContact O-CG 3.36Å; A352-Q356 PolarHBondContact O-N 2.86Å
353	S	63.9	Low	55	Low	67 Å²	67	118.6 Å²	118.6	47%	0.469	62%	0.617	S	S	.	*	H	α-helix	trans	-70.7	-40.2	176.7	-163.2	0	0	0	0	111.9	F349 E350 Q356 S357	F349-S353 VanDerWaalsContact O-CB 3.28Å; F349-S353 WeakPolarHBondContact O-CB 3.46Å; F349-S353 PolarHBondContact O-N 3.21Å; E350-S353 CarbonylContact O-C 3.52Å; E350-S353 WeakPolarHBondContact O-CA 3.32Å; E350-S353 WeakPolarHBondContact O-CB 3.25Å; E350-S353 PolarHBondContact O-N 3.09Å; S353-Q356 PolarHBondContact O-N 3.48Å; S353-S357 WeakPolarHBondContact O-CB 3.4Å; S353-S357 PolarHBondContact O-N 3.01Å; S353-S357 PolarHBondContact O-OG 3.02Å; S353-S357 VanDerWaalsContact O-OG 3.07Å
354	E	62.1	Low	53.9	Low	140 Å²	140	124.4 Å²	124.4	65%	0.654	64%	0.641	S	S	*	*	H	α-helix	trans	-64.4	-40.1	171.4	-68.7	-170.8	159.8	0	0	111.6	E350 Q356 S357 S358	E350-E354 PolarHBondContact O-N 3.46Å; E354-Q356 VanDerWaalsContact C-N 3.27Å; E354-Q356 PolarHBondContact O-N 3.32Å; E354-S357 WeakPolarHBondContact CA-OG 3.46Å; E354-S357 PolarHBondContact O-OG 2.9Å; E354-S358 VanDerWaalsContact O-CB 3.25Å; E354-S358 WeakPolarHBondContact O-CB 3.27Å; E354-S358 PolarHBondContact O-N 3.13Å; E354-S358 PolarHBondContact O-OG 3.41Å
355	A	56.7	Low	52.7	Low	53 Å²	53	125.9 Å²	125.9	44%	0.438	66%	0.664	S	S	.	*	H	α-helix	trans	-67.5	-21.7	174.3	0	0	0	0	0	114.1	E351 A352 S358	E351-A355 VanDerWaalsContact O-CB 3.29Å; E351-A355 WeakPolarHBondContact O-CB 3.49Å; E351-A355 PolarHBondContact O-N 2.96Å; A352-A355 PolarHBondContact O-N 2.76Å; A355-S358 PolarHBondContact O-OG 3.06Å
356	Q	57.4	Low	51.2	Low	148 Å²	148	132.3 Å²	132.3	69%	0.692	68%	0.681	S	S	*	*	H	α-helix	trans	-88.4	-45.3	173.4	-76.8	-177.3	-13.8	0	0	112.4	A352 S353 E354 S358 R359	A352-Q356 WeakPolarHBondContact O-CG 3.36Å; A352-Q356 PolarHBondContact O-N 2.86Å; S353-Q356 PolarHBondContact O-N 3.48Å; E354-Q356 VanDerWaalsContact C-N 3.27Å; E354-Q356 PolarHBondContact O-N 3.32Å; Q356-S358 VanDerWaalsContact C-N 3.34Å; Q356-S358 PolarHBondContact O-N 3.15Å; Q356-R359 PolarHBondContact O-N 3.18Å; Q356-R359 VanDerWaalsContact O-N 3.12Å
357	S	55.1	Low	49.6	Very low	87 Å²	87	135.3 Å²	135.3	61%	0.608	70%	0.699	S	S	*	*	H	α-helix	trans	-65.8	-36	-179	62.9	0	0	0	0	112.3	S353 E354 R359 G360	S353-S357 WeakPolarHBondContact O-CB 3.4Å; S353-S357 PolarHBondContact O-N 3.01Å; S353-S357 PolarHBondContact O-OG 3.02Å; S353-S357 VanDerWaalsContact O-OG 3.07Å; E354-S357 WeakPolarHBondContact CA-OG 3.46Å; E354-S357 PolarHBondContact O-OG 2.9Å; S357-R359 PolarHBondContact O-N 3.15Å; S357-R359 VanDerWaalsContact O-N 3.13Å; S357-G360 PolarHBondContact O-N 3.42Å; S357-G360 VanDerWaalsContact O-N 3.09Å
358	S	49.9	Very low	47.9	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-9.4	172.7	56.5	0	0	0	0	115.4	E354 A355 Q356	E354-S358 VanDerWaalsContact O-CB 3.25Å; E354-S358 WeakPolarHBondContact O-CB 3.27Å; E354-S358 PolarHBondContact O-N 3.13Å; E354-S358 PolarHBondContact O-OG 3.41Å; A355-S358 PolarHBondContact O-OG 3.06Å; Q356-S358 VanDerWaalsContact C-N 3.34Å; Q356-S358 PolarHBondContact O-N 3.15Å
359	R	46.1	Very low	46.4	Very low	218 Å²	218	134.2 Å²	134.2	82%	0.823	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-0.3	172.6	-67.9	-177.4	172.4	-163.7	-2.6	113.7	Q356 S357 S361	Q356-R359 PolarHBondContact O-N 3.18Å; Q356-R359 VanDerWaalsContact O-N 3.12Å; S357-R359 PolarHBondContact O-N 3.15Å; S357-R359 VanDerWaalsContact O-N 3.13Å; R359-S361 VanDerWaalsContact C-N 3.33Å; R359-S361 PolarHBondContact O-N 2.68Å
360	G	38.8	Very low	44.8	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	73%	0.726	S	S	*	*			trans	-74.5	31.9	-167.7	0	0	0	0	0	119.1	S357	S357-G360 PolarHBondContact O-N 3.42Å; S357-G360 VanDerWaalsContact O-N 3.09Å
361	S	38.4	Very low	42.8	Very low	109 Å²	109	132 Å²	132	76%	0.762	74%	0.738	S	S	*	*			trans	-159.5	104.5	170.7	64.1	0	0	0	0	116.6	R359	R359-S361 VanDerWaalsContact C-N 3.33Å; R359-S361 PolarHBondContact O-N 2.68Å
362	R	31.2	Very low	41.3	Very low	248 Å²	248	132.6 Å²	132.6	94%	0.936	75%	0.75	S	S	*	*			trans	-154.6	150.7	149.1	-123.2	-172.5	144.5	128.4	-0.8	111.1
363	P	34.5	Very low	39.7	Very low	122 Å²	122	141 Å²	141	79%	0.792	77%	0.771	S	S	*	*			trans	-76.9	161.4	-166.7	-17.7	32.5	0	0	0	116.3
364	Q	35.5	Very low	38.3	Very low	198 Å²	198	143.3 Å²	143.3	93%	0.925	79%	0.785	S	S	*	*			trans	-61.6	152.8	169.7	-69.6	-179.7	-28.1	0	0	113.3
365	A	29	Very low	36.7	Very low	98 Å²	98	146 Å²	146	81%	0.81	80%	0.797	S	S	*	*			trans	-120.3	142.4	161.4	0	0	0	0	0	110.2
366	R	29.8	Very low	35.3	Very low	244 Å²	244	146.6 Å²	146.6	92%	0.921	81%	0.808	S	S	*	*			trans	-77.2	147.9	179.2	-85.8	177.1	162.9	172.7	-6.8	112
367	P	31.8	Very low	33.9	Very low	128 Å²	128	145.6 Å²	145.6	83%	0.831	82%	0.818	S	S	*	*			trans	-72.7	158.6	169.6	32.9	-35.8	0	0	0	111.6
368	R	30.7	Very low	32.7	Very low	245 Å²	245	144.9 Å²	144.9	93%	0.925	82%	0.817	S	S	*	*			trans	-144.8	120.8	179.8	-170.3	179.9	-171	179.4	3	113
369	G	29.3	Very low	31.6	Very low	76 Å²	76	148.2 Å²	148.2	78%	0.784	83%	0.828	S	S	*	*			trans	58.8	107	146.8	0	0	0	0	0	119
370	T	28.1	Very low	30.8	Very low	148 Å²	148	144.3 Å²	144.3	91%	0.908	83%	0.828	S	S	*	*			trans	-69.1	153.2	160.7	40	0	0	0	0	112.1
371	A	29	Very low	31.2	Very low	102 Å²	102	146.8 Å²	146.8	84%	0.843	83%	0.832	S	S	*	*			trans	-112.9	161.1	168.4	0	0	0	0	0	110.5
372	V	29.6	Very low	30.8	Very low	140 Å²	140	146.1 Å²	146.1	85%	0.848	83%	0.833	S	S	*	*			trans	-100.9	154.1	-163.6	178.2	0	0	0	0	113.1
373	R	27.7	Very low	30.8	Very low	225 Å²	225	138.8 Å²	138.8	85%	0.849	83%	0.825	S	S	*	*			trans	-49.7	163.5	171.6	-98.9	177.9	155.3	165.8	-6.1	115.5
374	P	33.8	Very low	30.7	Very low	116 Å²	116	138.9 Å²	138.9	75%	0.753	83%	0.829	S	S	*	*				-110.8	179.1	120.2	34.3	-34.9	0	0	0	113.8
375	E	27.9	Very low	30.4	Very low	196 Å²	196	132.7 Å²	132.7	92%	0.916	82%	0.818	S	S	*	*			trans	-81.1	170.3	-177.9	-57.3	167.7	145.8	0	0	111.4
376	G	27.2	Very low	30.5	Very low	65 Å²	65	132.9 Å²	132.9	67%	0.67	82%	0.82	S	S	*	*			cis	167.9	171.4	-0.9	0	0	0	0	0	110.4
377	S	27.9	Very low	30.4	Very low	127 Å²	127	128.8 Å²	128.8	89%	0.888	82%	0.816	S	S	*	*			trans	71.6	140.8	177.7	-157.1	0	0	0	0	116.4
378	A	29.5	Very low	30.5	Very low	72 Å²	72	126.3 Å²	126.3	60%	0.595	80%	0.802	S	S	*	*			cis	-163.9	166.1	-21.9	0	0	0	0	0	112.3
379	N	28.5	Very low	30.5	Very low	166 Å²	166	120.3 Å²	120.3	89%	0.888	79%	0.792	S	S	*	*			trans	76.9	132.9	157.1	-62.3	-10.9	0	0	0	122.6
380	T	28.4	Very low	30.7	Very low	137 Å²	137	123.9 Å²	123.9	84%	0.84	79%	0.789	S	S	*	*			trans	-111.1	-160.6	177.6	4.1	0	0	0	0	109.2
381	P	48.2	Very low	30.7	Very low	121 Å²	121	124.2 Å²	124.2	79%	0.786	78%	0.78	S	S	*	*			cis	-135	175.9	-17.5	32.3	-11.8	0	0	0	116
382	A	28.7	Very low	30.8	Very low	94 Å²	94	125.3 Å²	125.3	78%	0.777	78%	0.781	S	S	*	*			trans	163.2	137.8	139.3	0	0	0	0	0	109.4
383	A	32.1	Very low	30.7	Very low	94 Å²	94	122 Å²	122	78%	0.777	78%	0.776	S	S	*	*			cis	72.9	136.1	30.9	0	0	0	0	0	114.2
384	S	32.6	Very low	30.7	Very low	124 Å²	124	116.1 Å²	116.1	87%	0.867	78%	0.775	S	S	*	*			cis	-172.7	169.9	-8.3	44.1	0	0	0	0	107.8
385	G	28.9	Very low	31.4	Very low	68 Å²	68	116.2 Å²	116.2	70%	0.701	78%	0.776	S	S	*	*			cis	161.7	162.8	1.8	0	0	0	0	0	110.6
386	A	31.4	Very low	31.3	Very low	102 Å²	102	116.2 Å²	116.2	84%	0.843	78%	0.776	S	S	*	*			trans	67.3	147.2	-174.5	0	0	0	0	0	115.4
387	D	27.9	Very low	31.6	Very low	158 Å²	158	124.4 Å²	124.4	85%	0.845	79%	0.787	S	S	*	*			cis	83.5	130.5	29.7	-149	39.3	0	0	0	112.4
388	S	34.3	Very low	32.6	Very low	76 Å²	76	123 Å²	123	53%	0.531	78%	0.775	S	S	.	*			cis	-162.1	176	10.7	64.9	0	0	0	0	113.4
389	T	30.7	Very low	32.7	Very low	119 Å²	119	125.5 Å²	125.5	73%	0.73	78%	0.782	S	S	*	*			trans	65.6	159.5	156.1	61.1	0	0	0	0	120.6
390	Q	32.6	Very low	32.9	Very low	152 Å²	152	125.7 Å²	125.7	71%	0.71	78%	0.778	S	S	*	*			cis	-156.3	150.3	-4.5	-131.4	167.1	-64.2	0	0	114.5
391	E	28.7	Very low	33	Very low	155 Å²	155	125.6 Å²	125.6	72%	0.724	78%	0.777	S	S	*	*			trans	52.4	146.2	143.1	-88.4	179.2	116.2	0	0	129.2
392	S	30.2	Very low	32.3	Very low	124 Å²	124	126.5 Å²	126.5	87%	0.867	78%	0.775	S	S	*	*			trans	74.8	150.8	151.1	75.1	0	0	0	0	120.6
393	G	27.1	Very low	32.4	Very low	72 Å²	72	126.6 Å²	126.6	74%	0.742	77%	0.77	S	S	*	*			cis	162.5	80.4	-13.1	0	0	0	0	0	119.2
394	A	27.6	Very low	32.5	Very low	100 Å²	100	129.2 Å²	129.2	83%	0.826	77%	0.77	S	S	*	*			trans	67.5	177.9	160.7	0	0	0	0	0	118.5
395	P	49	Very low	32.5	Very low	119 Å²	119	131 Å²	131	77%	0.773	77%	0.765	S	S	*	*				-133.9	-173.8	-55.6	36.3	-19.1	0	0	0	116.4
396	E	25.4	Very low	32.7	Very low	196 Å²	196	133 Å²	133	92%	0.916	76%	0.764	S	S	*	*			trans	93.2	178.6	159	-59	-126.2	105.7	0	0	121.8
397	R	33.3	Very low	33.3	Very low	236 Å²	236	134.2 Å²	134.2	89%	0.891	76%	0.763	S	S	*	*			trans	-127.4	-159.1	-151.8	-136.3	-175.9	160	-161.1	-5.3	110.1
398	P	48.8	Very low	33.4	Very low	99 Å²	99	132.1 Å²	132.1	64%	0.643	76%	0.761	S	S	*	*			cis	-139.2	-152.1	-16.5	27.7	0.7	0	0	0	115.1
399	V	32.3	Very low	33.2	Very low	124 Å²	124	133.5 Å²	133.5	75%	0.752	77%	0.77	S	S	*	*			trans	84.6	149.1	157.4	179.6	0	0	0	0	118.5
400	E	33.2	Very low	33.1	Very low	169 Å²	169	134.3 Å²	134.3	79%	0.79	78%	0.775	S	S	*	*			cis	-174.9	-170.2	-39.7	-130.1	167.6	-158.1	0	0	113
401	T	29.8	Very low	33	Very low	135 Å²	135	131.7 Å²	131.7	83%	0.828	78%	0.779	S	S	*	*			trans	97.3	120.7	179.3	64.3	0	0	0	0	116.5
402	D	33.6	Very low	33	Very low	140 Å²	140	129.2 Å²	129.2	75%	0.749	79%	0.785	S	S	*	*			cis	88.1	142.6	27.6	-157.4	62	0	0	0	114.1
403	S	30.8	Very low	32.9	Very low	96 Å²	96	129.6 Å²	129.6	67%	0.671	78%	0.783	S	S	*	*			cis	-141.7	-167.6	21.9	-38.3	0	0	0	0	110.7
404	L	35.6	Very low	33	Very low	149 Å²	149	131.3 Å²	131.3	78%	0.78	78%	0.783	S	S	*	*			cis	-168.5	-178.4	-32.5	-99.2	173.3	0	0	0	106.4
405	E	30.7	Very low	32.8	Very low	162 Å²	162	135.6 Å²	135.6	76%	0.757	79%	0.786	S	S	*	*			cis	-155.5	-155.9	9.2	-140.8	-151.5	127.8	0	0	114.7
406	V	33.5	Very low	31.9	Very low	111 Å²	111	134.1 Å²	134.1	67%	0.673	78%	0.784	S	S	*	*			trans	-81.7	159.1	-171.5	162.4	0	0	0	0	114.6
407	P	45.3	Very low	32.7	Very low	127 Å²	127	130.1 Å²	130.1	83%	0.825	78%	0.775	S	S	*	*				-146.7	-166.4	55.4	43.4	-20.9	0	0	0	119.4
408	S	28.9	Very low	32.5	Very low	114 Å²	114	127.3 Å²	127.3	80%	0.797	77%	0.774	S	S	*	*			trans	-148.4	155	-159.7	60.9	0	0	0	0	117.4
409	S	30.8	Very low	31.5	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	78%	0.779	S	S	*	*			trans	-173.2	139.6	159.4	35.7	0	0	0	0	109.2
410	T	29	Very low	31.2	Very low	136 Å²	136	131.8 Å²	131.8	83%	0.834	79%	0.787	S	S	*	*				61.8	134	60.2	62.5	0	0	0	0	115.4
411	A	30	Very low	31	Very low	97 Å²	97	128.9 Å²	128.9	80%	0.802	79%	0.785	S	S	*	*			cis	-169.6	-169.8	-12.2	0	0	0	0	0	110.8
412	A	28.3	Very low	30.8	Very low	103 Å²	103	129 Å²	129	85%	0.851	79%	0.786	S	S	*	*			trans	92.3	156	156	0	0	0	0	0	121.1
413	T	28.1	Very low	30.6	Very low	132 Å²	132	127.5 Å²	127.5	81%	0.81	79%	0.786	S	S	*	*			trans	-129	160	-172.7	51.4	0	0	0	0	110.5
414	S	28.1	Very low	30.5	Very low	108 Å²	108	128.1 Å²	128.1	76%	0.755	79%	0.791	S	S	*	*				162.3	162.5	123.9	53.8	0	0	0	0	115.9
415	E	24.9	Very low	30.3	Very low	190 Å²	190	126.4 Å²	126.4	89%	0.888	79%	0.791	S	S	*	*			trans	76.2	160.3	155.8	-51.2	-137.3	126.6	0	0	122
416	A	28.7	Very low	30.5	Very low	88 Å²	88	123.8 Å²	123.8	73%	0.727	79%	0.791	S	S	*	*			trans	-141.9	-161.1	-179	0	0	0	0	0	106.2
417	P	42.2	Very low	30.6	Very low	112 Å²	112	124.3 Å²	124.3	73%	0.727	80%	0.8	S	S	*	*			cis	-132.8	-174.1	-9.8	43.2	-25.9	0	0	0	114.1
418	M	30.7	Very low	30	Very low	178 Å²	178	121.8 Å²	121.8	88%	0.877	80%	0.796	S	S	*	*			trans	36.5	128.4	155.6	-63.9	179	89.3	0	0	121.1
419	S	27.5	Very low	30.2	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	80%	0.799	S	S	*	*				-178.3	151.4	107.7	50.5	0	0	0	0	116.6
420	K	25.3	Very low	30.4	Very low	210 Å²	210	121.9 Å²	121.9	91%	0.913	80%	0.797	S	S	*	*			trans	67.1	149.8	148.4	-76.3	171.6	-179.4	175.4	0	121.6
421	S	28.9	Very low	30.5	Very low	109 Å²	109	120.6 Å²	120.6	76%	0.762	79%	0.793	S	S	*	*			trans	-132.1	141.6	-166.6	53.8	0	0	0	0	111.9
422	T	26.5	Very low	30.5	Very low	138 Å²	138	121.7 Å²	121.7	85%	0.847	79%	0.79	S	S	*	*			trans	-160	161.2	159.2	37.4	0	0	0	0	109.4
423	S	28.4	Very low	30.8	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	79%	0.787	S	S	*	*				177.5	121.3	-52.5	47.4	0	0	0	0	110.3
424	S	29.7	Very low	30.9	Very low	109 Å²	109	122.8 Å²	122.8	76%	0.762	79%	0.786	S	S	*	*			trans	-162	122.8	159.5	43.5	0	0	0	0	108.2
425	S	31.1	Very low	31.1	Very low	113 Å²	113	121.8 Å²	121.8	79%	0.79	79%	0.785	S	S	*	*			cis	65.5	120.2	49.2	81.2	0	0	0	0	112.2
426	S	34.6	Very low	31.9	Very low	107 Å²	107	118.5 Å²	118.5	75%	0.748	78%	0.78	S	S	*	*			cis	-141.5	142.4	45.6	39.2	0	0	0	0	113.4
427	S	36.2	Very low	32.8	Very low	123 Å²	123	120 Å²	120	86%	0.86	78%	0.782	S	S	*	*				71.7	132.1	87.3	-41.6	0	0	0	0	114.6
428	G	31.6	Very low	32.3	Very low	73 Å²	73	121 Å²	121	75%	0.753	79%	0.786	S	S	*	*			cis	-164.2	-147.7	2.6	0	0	0	0	0	108.8
429	S	33.7	Very low	32.4	Very low	122 Å²	122	119 Å²	119	85%	0.853	79%	0.79	S	S	*	*			cis	177.6	161.9	-17.8	-90.1	0	0	0	0	107.6
430	S	34.5	Very low	32.4	Very low	99 Å²	99	117 Å²	117	69%	0.692	79%	0.785	S	S	*	*			cis	179.8	135.5	-24.3	-177.3	0	0	0	0	110.3
431	S	32.3	Very low	32.6	Very low	108 Å²	108	112.7 Å²	112.7	76%	0.755	78%	0.782	S	S	*	*			trans	170	136.8	154.3	38.2	0	0	0	0	109.4
432	T	30.1	Very low	32.6	Very low	120 Å²	120	113 Å²	113	74%	0.736	78%	0.784	S	S	*	*			cis	77.6	142.3	16	78.9	0	0	0	0	116.3
433	V	33.5	Very low	32.7	Very low	128 Å²	128	111.4 Å²	111.4	78%	0.776	78%	0.779	S	S	*	*			cis	-134	-161.5	4.3	-129	0	0	0	0	109.5
434	T	29.4	Very low	33	Very low	131 Å²	131	112.4 Å²	112.4	80%	0.804	78%	0.78	S	S	*	*			cis	-158.5	169.4	13.1	-18.1	0	0	0	0	111.8
435	A	32.8	Very low	33	Very low	87 Å²	87	115.6 Å²	115.6	72%	0.719	78%	0.783	S	S	*	*			trans	-147.7	177.4	160.1	0	0	0	0	0	107.7
436	P	42	Very low	33.1	Very low	120 Å²	120	114.2 Å²	114.2	78%	0.779	77%	0.773	S	S	*	*			cis	-135.4	-133.8	15.1	41	-16.4	0	0	0	111.1
437	P	46.9	Very low	32.9	Very low	120 Å²	120	114.8 Å²	114.8	78%	0.779	78%	0.777	S	S	*	*			cis	-128.2	-143.9	-25.9	38.2	-16.7	0	0	0	114.1
438	T	33	Very low	32.7	Very low	132 Å²	132	113 Å²	113	81%	0.81	77%	0.77	S	S	*	*			trans	-115.2	144	-157.3	51.3	0	0	0	0	118.5
439	S	32	Very low	33.2	Very low	137 Å²	137	116 Å²	116	96%	0.958	78%	0.777	S	S	*	*			trans	-174.9	164.9	157.3	-80.7	0	0	0	0	111.8
440	G	27.9	Very low	33.1	Very low	63 Å²	63	115.3 Å²	115.3	65%	0.649	77%	0.771	S	S	*	*			cis	167	89.3	-11.6	0	0	0	0	0	118.3
441	S	29.6	Very low	33	Very low	120 Å²	120	116.5 Å²	116.5	84%	0.839	78%	0.78	S	S	*	*			trans	74.7	160.2	155.3	78.4	0	0	0	0	123.5
442	S	29.3	Very low	33.1	Very low	115 Å²	115	116.4 Å²	116.4	80%	0.804	78%	0.779	S	S	*	*			trans	78.3	159.6	171	76.2	0	0	0	0	120
443	S	29	Very low	34.1	Very low	106 Å²	106	116.4 Å²	116.4	74%	0.741	78%	0.781	S	S	*	*				-179.8	169.8	-54.4	-93.7	0	0	0	0	111.2
444	V	33.9	Very low	33.9	Very low	127 Å²	127	118 Å²	118	77%	0.77	79%	0.785	S	S	*	*			trans	71.4	113.9	171.8	-45.9	0	0	0	0	117.1
445	E	30.6	Very low	33.8	Very low	176 Å²	176	117.2 Å²	117.2	82%	0.822	78%	0.78	S	S	*	*				92.2	149.8	87.7	-78	-151.2	77.2	0	0	113.6
446	S	32	Very low	33.6	Very low	84 Å²	84	118 Å²	118	59%	0.587	78%	0.78	S	S	*	*			cis	-159.8	149.5	-15.8	-97.1	0	0	0	0	107.1
447	S	31.3	Very low	33	Very low	119 Å²	119	117.5 Å²	117.5	83%	0.832	78%	0.779	S	S	*	*				177.8	158.5	85.6	-62.9	0	0	0	0	111.3
448	A	32	Very low	33.3	Very low	87 Å²	87	116.6 Å²	116.6	72%	0.719	77%	0.774	S	S	*	*			trans	-95.2	-172.9	168.3	0	0	0	0	0	111.9
449	P	42.1	Very low	33.1	Very low	136 Å²	136	117.4 Å²	117.4	88%	0.883	77%	0.773	S	S	*	*				-133.3	173.2	89.7	39.5	-30.7	0	0	0	114.6
450	S	30.6	Very low	33.1	Very low	106 Å²	106	115.9 Å²	115.9	74%	0.741	76%	0.762	S	S	*	*			trans	-125	169.4	-172	55.6	0	0	0	0	113
451	S	31.6	Very low	33.2	Very low	125 Å²	125	121 Å²	121	87%	0.874	77%	0.769	S	S	*	*			trans	-149.2	154.1	152.8	52.2	0	0	0	0	109.6
452	S	34.8	Very low	33.2	Very low	105 Å²	105	123.5 Å²	123.5	73%	0.734	77%	0.768	S	S	*	*			trans	-135.8	159.6	-155.4	-54.6	0	0	0	0	113.4
453	P	51.3	Low	33.2	Very low	121 Å²	121	127.9 Å²	127.9	79%	0.786	77%	0.767	S	S	*	*			trans	-94.6	165.1	-176.5	37.9	-36.5	0	0	0	114.5
454	L	29.1	Very low	33.2	Very low	161 Å²	161	128.2 Å²	128.2	84%	0.843	77%	0.769	S	S	*	*			trans	-147.4	136.2	175	-72.1	177.1	0	0	0	114.1
455	T	28.8	Very low	33.1	Very low	114 Å²	114	130.1 Å²	130.1	70%	0.699	77%	0.77	S	S	*	*			trans	30.5	134.8	140.4	62.5	0	0	0	0	122.1
456	S	28.5	Very low	33	Very low	104 Å²	104	125.4 Å²	125.4	73%	0.727	77%	0.768	S	S	*	*			cis	74.7	128.2	34.1	83.8	0	0	0	0	114.8
457	S	29.7	Very low	32.8	Very low	109 Å²	109	129 Å²	129	76%	0.762	78%	0.781	S	S	*	*			cis	-156.5	-146.4	3.3	-63.8	0	0	0	0	107.3
458	P	51.8	Low	32.7	Very low	102 Å²	102	130.1 Å²	130.1	66%	0.662	78%	0.783	S	S	*	*			cis	-138.3	-165.5	-15.2	44.7	-24.9	0	0	0	115.8
459	D	29.5	Very low	32.4	Very low	148 Å²	148	132.7 Å²	132.7	79%	0.791	79%	0.79	S	S	*	*			trans	63.2	154.1	150.4	-63.5	-30.4	0	0	0	122.2
460	S	31.4	Very low	31.8	Very low	106 Å²	106	130 Å²	130	74%	0.741	79%	0.787	S	S	*	*			cis	-136.5	169.8	7.3	-69.3	0	0	0	0	114.3
461	E	30	Very low	31.6	Very low	170 Å²	170	131.8 Å²	131.8	79%	0.794	79%	0.793	S	S	*	*			trans	-6	159.4	148.9	-56.7	-151.5	119.7	0	0	120.6
462	Q	29.2	Very low	31.4	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.804	79%	0.79	S	S	*	*			cis	-159.9	158.1	41.5	-160	173.2	39	0	0	115.2
463	R	30	Very low	31.2	Very low	207 Å²	207	131.3 Å²	131.3	78%	0.781	79%	0.791	S	S	*	*			trans	-108.2	131.5	174.3	171.9	-171.1	176.8	-164.4	-1.5	110.1
464	S	29.6	Very low	30.4	Very low	114 Å²	114	131.5 Å²	131.5	80%	0.797	79%	0.792	S	S	*	*			trans	-137.6	136.1	166.7	53.7	0	0	0	0	112.1
465	Q	31.9	Very low	30.2	Very low	167 Å²	167	130 Å²	130	78%	0.78	79%	0.79	S	S	*	*			trans	-100.9	154.8	162	-67.8	173.2	-92.7	0	0	107.6
466	G	27.8	Very low	30.1	Very low	76 Å²	76	129.2 Å²	129.2	78%	0.784	80%	0.795	S	S	*	*			trans	-172.3	101.6	175	0	0	0	0	0	111
467	D	27.9	Very low	30.1	Very low	161 Å²	161	130.4 Å²	130.4	86%	0.861	80%	0.798	S	S	*	*			trans	-68.7	147.4	173.4	-63.6	-71.2	0	0	0	111.4
468	T	28.3	Very low	30.3	Very low	142 Å²	142	131.3 Å²	131.3	87%	0.871	80%	0.801	S	S	*	*			trans	-152.2	143.2	141.6	-16.9	0	0	0	0	111.5
469	T	27.5	Very low	29.1	Very low	141 Å²	141	132.5 Å²	132.5	87%	0.865	81%	0.806	S	S	*	*			trans	-80.4	150.7	-177.2	42.8	0	0	0	0	112.5
470	G	28.3	Very low	29	Very low	80 Å²	80	130.2 Å²	130.2	83%	0.825	80%	0.802	S	S	*	*			trans	-164.3	89	178.3	0	0	0	0	0	113.1
471	T	27	Very low	28.7	Very low	143 Å²	143	133.9 Å²	133.9	88%	0.877	81%	0.808	S	S	*	*			trans	-83.1	128	-175.9	-50.9	0	0	0	0	112.8
472	A	27.9	Very low	29.2	Very low	96 Å²	96	131.1 Å²	131.1	79%	0.793	80%	0.804	S	S	*	*			trans	-162.6	114.3	153.1	0	0	0	0	0	113.1
473	T	29.4	Very low	29	Very low	124 Å²	124	128 Å²	128	76%	0.761	81%	0.808	S	S	*	*			trans	-87.4	155.4	152.9	-16.8	0	0	0	0	108.3
474	P	34.7	Very low	28.8	Very low	124 Å²	124	126.4 Å²	126.4	81%	0.805	81%	0.814	S	S	*	*				-145.2	161	99.3	37.9	-23.4	0	0	0	115.8
475	T	25.3	Very low	28.6	Very low	130 Å²	130	126 Å²	126	80%	0.798	81%	0.811	S	S	*	*			trans	-69.4	140.9	173.2	-52.2	0	0	0	0	112.7
476	A	26.8	Very low	28.3	Very low	98 Å²	98	126 Å²	126	81%	0.81	81%	0.811	S	S	*	*			trans	-152.7	112.6	155	0	0	0	0	0	112.1
477	T	28.8	Very low	28.4	Very low	129 Å²	129	131.2 Å²	131.2	79%	0.791	81%	0.808	S	S	*	*			trans	-92.1	150.4	155.7	33.5	0	0	0	0	109.6
478	P	33.3	Very low	28.4	Very low	127 Å²	127	126.2 Å²	126.2	83%	0.825	80%	0.795	S	S	*	*			trans	-134.6	177.7	132.5	37	-26.1	0	0	0	112.8
479	T	25.8	Very low	28.6	Very low	127 Å²	127	125.8 Å²	125.8	78%	0.779	79%	0.794	S	S	*	*			trans	-123.9	157.2	-162.9	-45.3	0	0	0	0	112.2
480	S	27.4	Very low	28.8	Very low	100 Å²	100	126.4 Å²	126.4	70%	0.699	79%	0.787	S	S	*	*			trans	60.4	113.4	155.8	52.7	0	0	0	0	120.7
481	E	26.5	Very low	29.2	Very low	184 Å²	184	134.3 Å²	134.3	86%	0.86	79%	0.792	S	S	*	*				46.8	162.2	122	-64.7	-157.5	155.7	0	0	122.8
482	P	39.2	Very low	29.8	Very low	112 Å²	112	132.3 Å²	132.3	73%	0.727	78%	0.775	S	S	*	*			cis	-133.3	171.3	-46.4	37.9	-22.7	0	0	0	111.9
483	A	25.3	Very low	30.4	Very low	105 Å²	105	131.7 Å²	131.7	87%	0.868	76%	0.764	S	S	*	*			trans	-134.7	140.5	173.5	0	0	0	0	0	112.4
484	L	25.7	Very low	31	Very low	175 Å²	175	132.2 Å²	132.2	92%	0.916	76%	0.76	S	S	*	*			trans	-124.6	131.3	-173	-77.6	164.8	0	0	0	112.3
485	S	25.8	Very low	31.4	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	75%	0.75	S	S	*	*			trans	-164.5	112.9	145.6	55.6	0	0	0	0	108.6
486	E	26.8	Very low	32.1	Very low	167 Å²	167	128.5 Å²	128.5	78%	0.78	74%	0.735	S	S	*	*				66.9	132.2	89	-64.7	-158.5	130.9	0	0	114.5
487	Y	29.8	Very low	33.1	Very low	184 Å²	184	126.8 Å²	126.8	72%	0.722	71%	0.714	S	S	*	*			cis	-158.7	149	-14.4	-123.4	-62.4	0	0	0	109.9
488	G	26.4	Very low	33.8	Very low	56 Å²	56	123.8 Å²	123.8	58%	0.577	70%	0.698	S	S	*	*			trans	-169.9	144.1	174.2	0	0	0	0	0	111.8
489	P	34	Very low	34.2	Very low	133 Å²	133	127 Å²	127	86%	0.864	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-76.5	146.1	-146	26.7	-35.4	0	0	0	116.6
490	H	29.8	Very low	34.8	Very low	154 Å²	154	129.5 Å²	129.5	71%	0.713	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-67.3	125.8	-167.7	-53	-82	0	0	0	115.2
491	R	38.3	Very low	35.4	Very low	247 Å²	247	129.3 Å²	129.3	93%	0.932	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-82.5	120.7	149.5	-85.1	-171.9	171.5	-166.5	-0.7	109.4
492	L	38.1	Very low	36.2	Very low	100 Å²	100	127.2 Å²	127.2	52%	0.524	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-73.4	145.9	167.3	-68.3	174.3	0	0	0	110.5	I494 V497	L492-I494 PolarHBondContact O-N 3.15Å; L492-V497 HydrophobicContact CB-CG2 4.29Å
493	P	40.6	Very low	36.1	Very low	84 Å²	84	131.4 Å²	131.4	55%	0.545	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-56.9	133.1	171.5	-25.4	34.9	0	0	0	112	S495 L496	P493-S495 PolarHBondContact O-N 2.94Å; P493-S495 VanDerWaalsContact O-N 3.14Å; P493-L496 WeakPolarHBondContact O-CB 3.24Å; P493-L496 PolarHBondContact O-N 2.89Å
494	I	43.2	Very low	36.8	Very low	134 Å²	134	132 Å²	132	69%	0.687	66%	0.659	S	S	*	*	H	α-helix	trans	-57.4	-34.2	-172.8	-64	172.5	0	0	0	111.9	L492 L496 V497 C498	L492-I494 PolarHBondContact O-N 3.15Å; I494-L496 PolarHBondContact O-N 3.25Å; I494-V497 PolarHBondContact O-N 3.02Å; I494-V497 VanDerWaalsContact O-N 3.11Å; I494-C498 PolarHBondContact O-N 3.06Å; I494-C498 PolarHBondContact O-SG 3.04Å; I494-C498 VanDerWaalsContact O-SG 3.4Å
495	S	42.7	Very low	37.5	Very low	85 Å²	85	130.3 Å²	130.3	59%	0.594	65%	0.65	S	S	*	*	H	α-helix	trans	-56.3	-33	174.9	53	0	0	0	0	113.9	P493 R499	P493-S495 PolarHBondContact O-N 2.94Å; P493-S495 VanDerWaalsContact O-N 3.14Å; S495-R499 PolarHBondContact O-N 3.23Å
496	L	39.7	Very low	38.2	Very low	91 Å²	91	135.9 Å²	135.9	48%	0.476	66%	0.655	S	S	.	*	H	α-helix	trans	-78.7	-34.1	178	-144.1	77.5	0	0	0	111.9	P493 I494 R500	P493-L496 WeakPolarHBondContact O-CB 3.24Å; P493-L496 PolarHBondContact O-N 2.89Å; I494-L496 PolarHBondContact O-N 3.25Å; L496-R500 PolarHBondContact O-N 3.01Å; L496-R500 VanDerWaalsContact O-N 3.15Å
497	V	48.4	Very low	38.8	Very low	63 Å²	63	134.9 Å²	134.9	38%	0.382	65%	0.654	S	S	.	*	H	α-helix	trans	-66.7	-45.9	176.7	-177.8	0	0	0	0	110.4	L492 I494 R499 R500 L501	L492-V497 HydrophobicContact CB-CG2 4.29Å; I494-V497 PolarHBondContact O-N 3.02Å; I494-V497 VanDerWaalsContact O-N 3.11Å; V497-R499 VanDerWaalsContact C-N 3.35Å; V497-R499 PolarHBondContact O-N 2.94Å; V497-R500 PolarHBondContact O-N 3.36Å; V497-L501 HydrophobicContact CG1-CD1 4.13Å; V497-L501 PolarHBondContact O-N 3.2Å
498	C	42.5	Very low	39	Very low	66 Å²	66	129.9 Å²	129.9	45%	0.446	65%	0.65	S	S	.	*	H	α-helix	trans	-59.1	-42.6	176.3	-65.2	0	0	0	0	112.4	I494 R500 L501 Q502	I494-C498 PolarHBondContact O-N 3.06Å; I494-C498 PolarHBondContact O-SG 3.04Å; I494-C498 VanDerWaalsContact O-SG 3.4Å; C498-R500 PolarHBondContact O-N 2.78Å; C498-L501 PolarHBondContact O-N 3.13Å; C498-Q502 PolarHBondContact O-N 2.97Å
499	R	43.1	Very low	39.7	Very low	195 Å²	195	135.2 Å²	135.2	74%	0.736	67%	0.666	S	S	*	*	H	α-helix	trans	-66.2	-32.3	176.4	-77.7	-175.6	173.1	-178.4	-0.9	113.4	S495 V497 R503	S495-R499 PolarHBondContact O-N 3.23Å; V497-R499 VanDerWaalsContact C-N 3.35Å; V497-R499 PolarHBondContact O-N 2.94Å; R499-R503 PolarHBondContact O-N 2.62Å
500	R	38.1	Very low	39.9	Very low	179 Å²	179	134.2 Å²	134.2	68%	0.675	66%	0.659	S	S	*	*	H	α-helix	trans	-71.3	-42.6	172.1	-83.5	-173.2	169.4	-175.7	-2.9	112	L496 V497 C498 R503 L504	L496-R500 PolarHBondContact O-N 3.01Å; L496-R500 VanDerWaalsContact O-N 3.15Å; V497-R500 PolarHBondContact O-N 3.36Å; C498-R500 PolarHBondContact O-N 2.78Å; R500-R503 PolarHBondContact O-N 2.91Å; R500-R503 VanDerWaalsContact O-N 3.17Å; R500-L504 PolarHBondContact O-N 2.97Å; R500-L504 VanDerWaalsContact O-N 3.1Å
501	L	39.5	Very low	40.2	Very low	96 Å²	96	133.2 Å²	133.2	50%	0.503	67%	0.667	S	S	.	*	H	α-helix	trans	-62.3	-45.3	177.7	-80.8	164.9	0	0	0	112.6	V497 C498 R503 L504 L505	V497-L501 HydrophobicContact CG1-CD1 4.13Å; V497-L501 PolarHBondContact O-N 3.2Å; C498-L501 PolarHBondContact O-N 3.13Å; L501-R503 PolarHBondContact O-N 3.29Å; L501-L504 PolarHBondContact O-N 3.1Å; L501-L505 WeakPolarHBondContact O-CB 3.13Å; L501-L505 WeakPolarHBondContact O-CG 2.98Å; L501-L505 PolarHBondContact O-N 2.77Å
502	Q	42.4	Very low	39.8	Very low	139 Å²	139	124.9 Å²	124.9	65%	0.65	66%	0.657	S	S	*	*	H	α-helix	trans	-61.3	-25.8	175	-81.4	-175.6	-30.1	0	0	113.7	C498	C498-Q502 PolarHBondContact O-N 2.97Å
503	R	38.3	Very low	39.6	Very low	201 Å²	201	129.1 Å²	129.1	76%	0.758	68%	0.679	S	S	*	*	H	α-helix	trans	-83.6	-29.8	178.3	-151.5	173.2	-167.5	174.3	3.6	112.7	R499 R500 L501	R499-R503 PolarHBondContact O-N 2.62Å; R500-R503 PolarHBondContact O-N 2.91Å; R500-R503 VanDerWaalsContact O-N 3.17Å; L501-R503 PolarHBondContact O-N 3.29Å
504	L	38.9	Very low	38.9	Very low	118 Å²	118	129 Å²	129	62%	0.618	69%	0.693	S	S	*	*	H	α-helix	trans	-77.2	-39	174.2	-70.3	167.7	0	0	0	112.1	R500 L501 R506 L507	R500-L504 PolarHBondContact O-N 2.97Å; R500-L504 VanDerWaalsContact O-N 3.1Å; L501-L504 PolarHBondContact O-N 3.1Å; L504-R506 PolarHBondContact O-N 2.86Å; L504-R506 VanDerWaalsContact O-N 3.08Å; L504-L507 PolarHBondContact O-N 3.43Å
505	L	40.9	Very low	38.2	Very low	139 Å²	139	131.4 Å²	131.4	73%	0.728	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	1.6	177.5	-69.4	168.8	0	0	0	114.5	L501	L501-L505 WeakPolarHBondContact O-CB 3.13Å; L501-L505 WeakPolarHBondContact O-CG 2.98Å; L501-L505 PolarHBondContact O-N 2.77Å
506	R	41.5	Very low	37.5	Very low	223 Å²	223	138.7 Å²	138.7	84%	0.842	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	8.5	174.2	-81.4	-171.2	170.4	-165.7	-1.7	114	L504	L504-R506 PolarHBondContact O-N 2.86Å; L504-R506 VanDerWaalsContact O-N 3.08Å
507	L	39.6	Very low	36.8	Very low	146 Å²	146	138.7 Å²	138.7	76%	0.764	73%	0.729	S	S	*	*	S	Bend	trans	-126.6	23.6	-175.3	-72.1	170.5	0	0	0	113.1	L504	L504-L507 PolarHBondContact O-N 3.43Å
508	A	32.3	Very low	35.9	Very low	78 Å²	78	142.5 Å²	142.5	65%	0.645	75%	0.753	S	S	*	*			trans	-126.6	50.6	-169.6	0	0	0	0	0	113.6	P510	A508-P510 WeakPolarHBondContact O-CD 3.46Å
509	D	41.9	Very low	35.1	Very low	169 Å²	169	144.3 Å²	144.3	90%	0.904	77%	0.773	S	S	*	*			trans	-95.8	115.5	164.2	-78	-37.5	0	0	0	110.4
510	P	38.1	Very low	34.3	Very low	112 Å²	112	140.5 Å²	140.5	73%	0.727	78%	0.776	S	S	*	*			trans	-92.5	153.5	164	34.1	-30	0	0	0	111.8	A508	A508-P510 WeakPolarHBondContact O-CD 3.46Å
511	P	35.7	Very low	33.8	Very low	133 Å²	133	139.2 Å²	139.2	86%	0.864	79%	0.788	S	S	*	*			trans	-85.2	166.2	-161.3	34.5	-38.2	0	0	0	114.9
512	G	30.4	Very low	33.2	Very low	71 Å²	71	140.3 Å²	140.3	73%	0.732	80%	0.803	S	S	*	*			trans	-104	-177.7	176.7	0	0	0	0	0	115.6
513	L	33.7	Very low	32.5	Very low	189 Å²	189	139.3 Å²	139.3	99%	0.99	81%	0.812	S	S	*	*			trans	75.9	125.8	173.3	-59.8	175.1	0	0	0	118.3
514	G	26.5	Very low	31.9	Very low	81 Å²	81	134.4 Å²	134.4	84%	0.835	81%	0.814	S	S	*	*			trans	178.9	100.9	169.7	0	0	0	0	0	111.2
515	Q	29	Very low	31.3	Very low	186 Å²	186	133.7 Å²	133.7	87%	0.869	83%	0.826	S	S	*	*			trans	-96.1	137.8	175.2	-62.9	178.4	-5	0	0	110.7
516	R	26.6	Very low	30.7	Very low	238 Å²	238	132.1 Å²	132.1	90%	0.898	83%	0.826	S	S	*	*				172	161.2	113.8	-108.3	-177.3	165.8	169.3	-4.1	115.8
517	A	25.3	Very low	30	Very low	90 Å²	90	129.5 Å²	129.5	74%	0.744	82%	0.824	S	S	*	*			trans	70.5	116.6	143.7	0	0	0	0	0	121
518	T	29.9	Very low	29.4	Very low	143 Å²	143	134.6 Å²	134.6	88%	0.877	83%	0.833	S	S	*	*			trans	-46	146.3	155.3	48.4	0	0	0	0	115.8
519	A	25.1	Very low	29.1	Very low	105 Å²	105	141.7 Å²	141.7	87%	0.868	84%	0.843	S	S	*	*			trans	-144.1	144.7	147	0	0	0	0	0	110
520	S	27.3	Very low	28.4	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	84%	0.84	S	S	*	*			trans	-126.7	136.9	-178	56.3	0	0	0	0	110.9
521	T	26.5	Very low	27.9	Very low	153 Å²	153	139 Å²	139	94%	0.939	84%	0.841	S	S	*	*			trans	-151.2	153	165.8	17.9	0	0	0	0	111.3
522	S	27.1	Very low	27.6	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	84%	0.836	S	S	*	*			trans	-140.3	132.9	-167.8	55.8	0	0	0	0	113.2
523	S	27.8	Very low	27.4	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	84%	0.838	S	S	*	*			trans	-162.4	130.1	156.7	45.4	0	0	0	0	107.5
524	A	25.7	Very low	27.1	Very low	98 Å²	98	134.9 Å²	134.9	81%	0.81	83%	0.832	S	S	*	*			cis	84.9	137.6	24.9	0	0	0	0	0	114.9
525	A	27.1	Very low	27.2	Very low	104 Å²	104	135.5 Å²	135.5	86%	0.86	83%	0.829	S	S	*	*			trans	68.7	144.9	-174.6	0	0	0	0	0	115.6
526	S	26.9	Very low	27.1	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	82%	0.822	S	S	*	*			cis	-146.5	169.5	-10.4	-154.8	0	0	0	0	113.3
527	E	26.8	Very low	27.2	Very low	169 Å²	169	125.1 Å²	125.1	79%	0.79	82%	0.819	S	S	*	*			trans	-59	159.1	-179	-50.3	154.5	111.5	0	0	114.9
528	R	27.1	Very low	27.4	Very low	253 Å²	253	125.9 Å²	125.9	96%	0.955	82%	0.818	S	S	*	*				-153	138.6	116.8	-108	164.9	-158.2	-152.4	2.8	111.7
529	R	26.8	Very low	27.3	Very low	227 Å²	227	124.2 Å²	124.2	86%	0.857	81%	0.813	S	S	*	*			trans	-120	130.9	-176.8	-173.7	-176.8	-172.1	-179.5	2.9	108	T531	R529-T531 HydrophobicContact CG-CG2 4.34Å
530	A	28.2	Very low	27.5	Very low	103 Å²	103	124.3 Å²	124.3	85%	0.851	81%	0.807	S	S	*	*			trans	-134.4	142.8	172.3	0	0	0	0	0	109
531	T	27.3	Very low	27.5	Very low	121 Å²	121	124.1 Å²	124.1	74%	0.742	81%	0.806	S	S	*	*			trans	-142	128.1	-163.8	49.7	0	0	0	0	113.2	R529	R529-T531 HydrophobicContact CG-CG2 4.34Å
532	S	28.6	Very low	27.5	Very low	110 Å²	110	123 Å²	123	77%	0.769	80%	0.804	S	S	*	*			trans	-156.9	114.5	159.4	49.8	0	0	0	0	106.6
533	A	27.4	Very low	27.5	Very low	92 Å²	92	123 Å²	123	76%	0.76	80%	0.804	S	S	*	*				62.5	104.4	81.3	0	0	0	0	0	110.8
534	A	26.8	Very low	27.5	Very low	104 Å²	104	122.6 Å²	122.6	86%	0.86	81%	0.808	S	S	*	*				79.9	145.8	77.7	0	0	0	0	0	112.1
535	A	27.5	Very low	27.5	Very low	94 Å²	94	122.5 Å²	122.5	78%	0.777	81%	0.807	S	S	*	*			cis	-151.4	160.1	12.2	0	0	0	0	0	114.7
536	A	27.8	Very low	27.4	Very low	87 Å²	87	122.6 Å²	122.6	72%	0.719	81%	0.808	S	S	*	*			trans	45.6	129.4	133.7	0	0	0	0	0	124.9
537	S	29.1	Very low	27.3	Very low	120 Å²	120	122.8 Å²	122.8	84%	0.839	82%	0.816	S	S	*	*			trans	74.2	157.9	131.7	75.5	0	0	0	0	119.4
538	S	29.6	Very low	27.3	Very low	105 Å²	105	120.6 Å²	120.6	73%	0.734	82%	0.819	S	S	*	*			cis	-147.1	-179.8	10	63.4	0	0	0	0	114.5
539	S	27.6	Very low	27.2	Very low	108 Å²	108	113.3 Å²	113.3	76%	0.755	81%	0.813	S	S	*	*			trans	-47.8	170.1	167.9	54.8	0	0	0	0	116
540	S	28.4	Very low	27.1	Very low	107 Å²	107	107 Å²	107	75%	0.748	81%	0.809	S	S	*	*			cis	-160.2	165	32.3	55.6	0	0	0	0	117.1
541	S	27.3	Very low	27	Very low	111 Å²	111	107.9 Å²	107.9	78%	0.776	81%	0.806	S	S	*	*			trans	-29.5	146.3	168.2	55.2	0	0	0	0	121.6
542	S	27.4	Very low	26.9	Very low	129 Å²	129	111.9 Å²	111.9	90%	0.902	81%	0.813	S	S	*	*				-161.3	171.4	122.3	65.6	0	0	0	0	111.6
543	S	27.1	Very low	26.7	Very low	118 Å²	118	114.6 Å²	114.6	83%	0.825	81%	0.814	S	S	*	*			trans	-117	140	-165.6	56.1	0	0	0	0	114.8
544	A	26.8	Very low	26.5	Very low	109 Å²	109	115.5 Å²	115.5	90%	0.901	81%	0.812	S	S	*	*			trans	-154.8	165.9	159.2	0	0	0	0	0	110.6
545	A	25.3	Very low	26.6	Very low	97 Å²	97	119.4 Å²	119.4	80%	0.802	81%	0.812	S	S	*	*			trans	-113	154.3	-166.1	0	0	0	0	0	115.5
546	A	25.7	Very low	26.6	Very low	105 Å²	105	119.2 Å²	119.2	87%	0.868	80%	0.802	S	S	*	*			trans	46.2	110.4	148.5	0	0	0	0	0	121
547	A	24.7	Very low	26.8	Very low	109 Å²	109	118.1 Å²	118.1	90%	0.901	80%	0.798	S	S	*	*			trans	-151.7	155.3	140.1	0	0	0	0	0	110.1
548	S	27.2	Very low	27.2	Very low	123 Å²	123	118.9 Å²	118.9	86%	0.86	78%	0.784	S	S	*	*			trans	-100.7	133.7	-172.8	48.7	0	0	0	0	113.6
549	A	24.4	Very low	27.3	Very low	100 Å²	100	117.5 Å²	117.5	83%	0.826	77%	0.772	S	S	*	*			trans	-157.6	81.9	167.3	0	0	0	0	0	111.8
550	A	25.2	Very low	27.5	Very low	94 Å²	94	115.3 Å²	115.3	78%	0.777	76%	0.757	S	S	*	*			trans	-83.3	127.6	167.3	0	0	0	0	0	109.6	K552	A550-K552 PolarHBondContact O-N 2.84Å
551	P	26.6	Very low	27.9	Very low	122 Å²	122	112.2 Å²	112.2	79%	0.792	73%	0.732	S	S	*	*			trans	-71.7	118.2	-179.8	28.2	-33.3	0	0	0	110.6	Q553	P551-Q553 PolarHBondContact O-N 3.03Å; P551-Q553 VanDerWaalsContact O-N 3.17Å
552	K	24.4	Very low	28.2	Very low	205 Å²	205	109.9 Å²	109.9	89%	0.891	71%	0.709	S	S	*	*			trans	-64.4	112.7	171.9	-69	-178.3	177.9	-179.8	0	109.6	A550	A550-K552 PolarHBondContact O-N 2.84Å
553	Q	24.3	Very low	28.5	Very low	167 Å²	167	106 Å²	106	78%	0.78	68%	0.677	S	S	*	*			trans	-78.7	143.7	160.6	-69.6	-165.8	-6.6	0	0	109.8	P551 H555	P551-Q553 PolarHBondContact O-N 3.03Å; P551-Q553 VanDerWaalsContact O-N 3.17Å; Q553-H555 PolarHBondContact O-N 2.77Å
554	P	23.7	Very low	28.7	Very low	111 Å²	111	103.4 Å²	103.4	72%	0.721	66%	0.658	S	S	*	*			trans	-73.5	119.7	176.2	29.2	-32.9	0	0	0	110.6	T556	P554-T556 PolarHBondContact O-N 3.23Å
555	H	29.2	Very low	29.1	Very low	187 Å²	187	98.3 Å²	98.3	87%	0.866	62%	0.617	S	S	*	*			trans	-71.8	90.6	173	-75	-94.3	0	0	0	110.6	Q553	Q553-H555 PolarHBondContact O-N 2.77Å
556	T	27.1	Very low	29.6	Very low	90 Å²	90	94.4 Å²	94.4	55%	0.552	58%	0.582	S	S	*	*			trans	-82.6	115.6	163.5	46.5	0	0	0	0	108.7	P554 Y558	P554-T556 PolarHBondContact O-N 3.23Å; T556-Y558 WeakPolarHBondContact O-CE2 3.33Å
557	G	31	Very low	30	Very low	63 Å²	63	91.2 Å²	91.2	65%	0.649	56%	0.556	S	S	*	*			trans	-68.1	136.9	174.1	0	0	0	0	0	110.9	P559	G557-P559 WeakPolarHBondContact O-CD 3.33Å
558	Y	37.4	Very low	30.4	Very low	137 Å²	137	87.6 Å²	87.6	54%	0.537	52%	0.523	S	S	.	.			trans	-101.7	97.3	-174.9	-66.7	-75.8	0	0	0	112	T556 S560 L561	T556-Y558 WeakPolarHBondContact O-CE2 3.33Å; Y558-S560 PolarHBondContact O-N 3.39Å; Y558-L561 PolarHBondContact O-N 3.46Å
559	P	33.4	Very low	30.9	Very low	75 Å²	75	84 Å²	84	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-17.3	-179.6	25.5	-35	0	0	0	113.8	G557 L561 Q562 I563	G557-P559 WeakPolarHBondContact O-CD 3.33Å; P559-L561 VanDerWaalsContact C-N 3.32Å; P559-L561 PolarHBondContact O-N 2.93Å; P559-Q562 PolarHBondContact O-N 2.82Å; P559-I563 WeakPolarHBondContact O-CG1 3.29Å; P559-I563 PolarHBondContact O-N 3.02Å
560	S	31.4	Very low	31.3	Very low	62 Å²	62	80.9 Å²	80.9	43%	0.434	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-31.6	178.1	51.3	0	0	0	0	114.1	Y558 I563 C564	Y558-S560 PolarHBondContact O-N 3.39Å; S560-I563 PolarHBondContact O-N 3.23Å; S560-C564 PolarHBondContact O-N 2.84Å; S560-C564 PolarHBondContact O-SG 3.48Å; S560-C564 VanDerWaalsContact O-SG 3.33Å
561	L	35.8	Very low	31.4	Very low	43 Å²	43	80.4 Å²	80.4	23%	0.225	45%	0.445	C	S	.	.	H	α-helix	trans	-71.1	-35.4	178.9	-74.1	167.1	0	0	0	112.3	W56 D58 Y558 P559 C564 S565	W56-L561 HydrophobicContact CB-CD2 4.49Å; D58-L561 WeakPolarHBondContact O-CD1 3.5Å; Y558-L561 PolarHBondContact O-N 3.46Å; P559-L561 VanDerWaalsContact C-N 3.32Å; P559-L561 PolarHBondContact O-N 2.93Å; L561-C564 WeakPolarHBondContact O-CB 3.37Å; L561-C564 PolarHBondContact O-N 2.76Å; L561-S565 PolarHBondContact O-N 3Å
562	Q	34.8	Very low	31.5	Very low	61 Å²	61	76.8 Å²	76.8	29%	0.285	42%	0.423	S	S	.	.	H	α-helix	trans	-70.7	-36.9	176.3	-163.7	167.9	2.5	0	0	111.3	T146 P559 S565 N566	T146-Q562 PolarHBondContact O-NE2 3.28Å; P559-Q562 PolarHBondContact O-N 2.82Å; Q562-S565 WeakPolarHBondContact O-CB 3.47Å; Q562-S565 PolarHBondContact O-N 3.03Å; Q562-N566 PolarHBondContact O-N 2.63Å
563	I	33.8	Very low	31.8	Very low	48 Å²	48	71.3 Å²	71.3	25%	0.246	40%	0.403	C	S	.	.	H	α-helix	trans	-61.6	-44.6	170.2	-63.6	157.6	0	0	0	110.5	P198 P559 S560 S565 N566 A567	P198-I563 HydrophobicContact CB-CD1 4.33Å; P198-I563 HydrophobicContact CG-CD1 4.33Å; P559-I563 WeakPolarHBondContact O-CG1 3.29Å; P559-I563 PolarHBondContact O-N 3.02Å; S560-I563 PolarHBondContact O-N 3.23Å; I563-S565 VanDerWaalsContact C-N 3.3Å; I563-S565 PolarHBondContact O-N 3.31Å; I563-N566 PolarHBondContact O-N 2.95Å; I563-A567 WeakPolarHBondContact O-CB 3.36Å; I563-A567 PolarHBondContact O-N 3.36Å
564	C	30.7	Very low	31.8	Very low	63 Å²	63	66.6 Å²	66.6	43%	0.426	39%	0.388	S	S	.	.	H	α-helix	trans	-59.9	-36.9	173.5	-72	0	0	0	0	112.6	S560 L561 N566 C568	S560-C564 PolarHBondContact O-N 2.84Å; S560-C564 PolarHBondContact O-SG 3.48Å; S560-C564 VanDerWaalsContact O-SG 3.33Å; L561-C564 WeakPolarHBondContact O-CB 3.37Å; L561-C564 PolarHBondContact O-N 2.76Å; C564-N566 VanDerWaalsContact C-N 3.34Å; C564-N566 PolarHBondContact O-N 3.49Å; C564-C568 VanDerWaalsContact O-CB 3.25Å; C564-C568 WeakPolarHBondContact O-CB 3.3Å; C564-C568 PolarHBondContact O-N 3.19Å; C564-C568 PolarHBondContact O-SG 2.73Å; C564-C568 VanDerWaalsContact O-SG 3.4Å
565	S	35.3	Very low	31.9	Very low	3 Å²	3	67 Å²	67	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-62.5	-39.1	175.8	-170.1	0	0	0	0	112.7	I54 L561 Q562 I563 C568 R569	I54-S565 PolarHBondContact O-OG 2.65Å; L561-S565 PolarHBondContact O-N 3Å; Q562-S565 WeakPolarHBondContact O-CB 3.47Å; Q562-S565 PolarHBondContact O-N 3.03Å; I563-S565 VanDerWaalsContact C-N 3.3Å; I563-S565 PolarHBondContact O-N 3.31Å; S565-C568 WeakPolarHBondContact O-CB 3.29Å; S565-R569 PolarHBondContact O-N 2.8Å
566	N	35.2	Very low	31.8	Very low	15 Å²	15	65.3 Å²	65.3	8%	0.08	37%	0.369	C	S	.	.	H	α-helix	trans	-80.8	-38.8	-179.9	-70.2	2.9	0	0	0	111.7	C257 Q562 I563 C564 C568 R569 V570	C257-N566 HydrophobicContact CB-CB 4.23Å; C257-N566 WeakPolarHBondContact SG-CB 3.43Å; Q562-N566 PolarHBondContact O-N 2.63Å; I563-N566 PolarHBondContact O-N 2.95Å; C564-N566 VanDerWaalsContact C-N 3.34Å; C564-N566 PolarHBondContact O-N 3.49Å; N566-C568 PolarHBondContact O-N 2.91Å; N566-R569 WeakPolarHBondContact O-CB 3.02Å; N566-R569 PolarHBondContact O-N 3.21Å; N566-V570 PolarHBondContact O-N 3.08Å
567	A	33.7	Very low	31.6	Very low	38 Å²	38	72.5 Å²	72.5	31%	0.314	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-34.6	169.8	0	0	0	0	0	111.7	I563 R569 V570 L571	I563-A567 WeakPolarHBondContact O-CB 3.36Å; I563-A567 PolarHBondContact O-N 3.36Å; A567-R569 VanDerWaalsContact C-N 3.33Å; A567-R569 PolarHBondContact O-N 3.31Å; A567-V570 PolarHBondContact O-N 3.18Å; A567-V570 VanDerWaalsContact O-N 3.15Å; A567-L571 WeakPolarHBondContact O-CB 3.46Å; A567-L571 WeakPolarHBondContact O-CG 3.46Å; A567-L571 PolarHBondContact O-N 3.46Å
568	C	34.7	Very low	31.6	Very low	32 Å²	32	73 Å²	73	22%	0.216	39%	0.387	C	S	.	.	H	α-helix	trans	-62.4	-32.2	170.3	-88.3	0	0	0	0	113.3	I54 C564 S565 N566 V570 L571 C572	I54-C568 HydrophobicContact CD1-CB 3.97Å; I54-C568 HydrophobicContact CG1-CB 4.38Å; C564-C568 VanDerWaalsContact O-CB 3.25Å; C564-C568 WeakPolarHBondContact O-CB 3.3Å; C564-C568 PolarHBondContact O-N 3.19Å; C564-C568 PolarHBondContact O-SG 2.73Å; C564-C568 VanDerWaalsContact O-SG 3.4Å; S565-C568 WeakPolarHBondContact O-CB 3.29Å; N566-C568 PolarHBondContact O-N 2.91Å; C568-V570 VanDerWaalsContact C-N 3.28Å; C568-V570 PolarHBondContact O-N 3.39Å; C568-L571 PolarHBondContact O-N 3.02Å; C568-C572 WeakPolarHBondContact O-CB 3.23Å; C568-C572 PolarHBondContact O-N 2.68Å; C568-C572 PolarHBondContact O-SG 3.33Å
569	R	37.6	Very low	31.3	Very low	49 Å²	49	69.6 Å²	69.6	19%	0.185	38%	0.379	C	S	.	.	H	α-helix	trans	-64.2	-34.7	171.9	-87.5	-174.5	158.1	142.6	-0.1	112.2	F95 S96 E143 S565 N566 A567	F95-R569 PolarHBondContact O-NH2 3.43Å; S96-R569 PolarHBondContact OG-NH1 3.29Å; S96-R569 PolarHBondContact OG-NH2 3.07Å; E143-R569 IonicContact OE1-CZ 3.41Å; E143-R569 IonicContact OE1-NH1 3.17Å; E143-R569 PolarHBondContact OE1-NH1 3.37Å; S565-R569 PolarHBondContact O-N 2.8Å; N566-R569 WeakPolarHBondContact O-CB 3.02Å; N566-R569 PolarHBondContact O-N 3.21Å; A567-R569 VanDerWaalsContact C-N 3.33Å; A567-R569 PolarHBondContact O-N 3.31Å
570	V	31	Very low	31.2	Very low	33 Å²	33	69.3 Å²	69.3	20%	0.2	37%	0.373	C	S	.	.	H	α-helix	trans	-74.7	-38.4	174.7	-174.5	0	0	0	0	111.7	I274 N566 A567 C568	I274-V570 HydrophobicContact CD1-CG1 4.13Å; N566-V570 PolarHBondContact O-N 3.08Å; A567-V570 PolarHBondContact O-N 3.18Å; A567-V570 VanDerWaalsContact O-N 3.15Å; C568-V570 VanDerWaalsContact C-N 3.28Å; C568-V570 PolarHBondContact O-N 3.39Å
571	L	28.4	Very low	31.2	Very low	84 Å²	84	69.8 Å²	69.8	44%	0.44	37%	0.369	S	S	.	.	H	α-helix	trans	-89.4	-27.4	-173.8	-73	166.1	0	0	0	115.1	A567 C568 L573 S574 F575	A567-L571 WeakPolarHBondContact O-CB 3.46Å; A567-L571 WeakPolarHBondContact O-CG 3.46Å; A567-L571 PolarHBondContact O-N 3.46Å; C568-L571 PolarHBondContact O-N 3.02Å; L571-L573 PolarHBondContact O-N 3.3Å; L571-S574 WeakPolarHBondContact O-CA 3.01Å; L571-S574 WeakPolarHBondContact O-CB 3.38Å; L571-S574 PolarHBondContact O-N 2.98Å; L571-F575 PolarHBondContact O-N 3.37Å
572	C	28.6	Very low	30.9	Very low	47 Å²	47	71.4 Å²	71.4	32%	0.318	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-66.1	-25.7	178.6	-76.6	0	0	0	0	112.6	C568 S574 F575 F576	C568-C572 WeakPolarHBondContact O-CB 3.23Å; C568-C572 PolarHBondContact O-N 2.68Å; C568-C572 PolarHBondContact O-SG 3.33Å; C572-S574 PolarHBondContact O-N 2.89Å; C572-F575 PolarHBondContact O-N 2.57Å; C572-F576 WeakPolarHBondContact O-CD2 3.27Å
573	L	31	Very low	30.7	Very low	90 Å²	90	72.1 Å²	72.1	47%	0.471	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-62.2	-16.1	168.1	-71.3	163.2	0	0	0	113.2	T315 L571	T315-L573 HydrophobicContact CG2-CD2 4.17Å; T315-L573 WeakPolarHBondContact O-CD2 3.09Å; L571-L573 PolarHBondContact O-N 3.3Å
574	S	24.6	Very low	30.5	Very low	67 Å²	67	73.9 Å²	73.9	47%	0.469	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-106.8	-3.3	-179.9	-55.5	0	0	0	0	114.5	L571 C572	L571-S574 WeakPolarHBondContact O-CA 3.01Å; L571-S574 WeakPolarHBondContact O-CB 3.38Å; L571-S574 PolarHBondContact O-N 2.98Å; C572-S574 PolarHBondContact O-N 2.89Å
575	F	25.3	Very low	30.4	Very low	121 Å²	121	74.7 Å²	74.7	53%	0.531	39%	0.392	S	S	.	.			trans	-128.6	30.1	-168.4	-86.4	-74.9	0	0	0	114.9	L38 L571 C572	L38-F575 HydrophobicContact CB-CZ 4.27Å; L571-F575 PolarHBondContact O-N 3.37Å; C572-F575 PolarHBondContact O-N 2.57Å
576	F	26.3	Very low	30	Very low	151 Å²	151	80.7 Å²	80.7	66%	0.662	42%	0.423	S	S	*	.			trans	-103.6	101.6	160.5	-78.5	-80	0	0	0	110.5	C572	C572-F576 WeakPolarHBondContact O-CD2 3.27Å
577	M	24	Very low	29.6	Very low	241 Å²	241	86.6 Å²	86.6	100%	1.187	45%	0.454	S	S	*	.			trans	-141.2	0	159.7	-67.1	-164.5	81.9	0	0	108.2

Retrieved 577 of 577 residues in 144.6 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).