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Fibroblast growth factor 18

Plays an important role in the regulation of cell proliferation, cell differentiation and cell migration. Required for normal ossification and bone development. Stimulates hepatic and intestinal proliferation.

AlphaFold DB , UniProt , Accession O76093, Species HUMAN (Homo sapiens, Human), Gene FGF18, Length 207 aa.

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(Predicted Aligned Error values between residue pairs)

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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	49.5	Very low	71.8	Confident	240 Å²	240	115.2 Å²	115.2	100%	1.182	68%	0.68	S	S	*	*				0	100.8	0	-74.8	172.6	140.7	0	0	107.8	S3	M1-S3 PolarHBondContact O-N 2.76Å
2	Y	56.1	Low	73.1	Confident	239 Å²	239	111.3 Å²	111.3	94%	0.937	66%	0.662	S	S	*	*			trans	-79.4	109.5	170.7	-69.5	-78.5	0	0	0	107.1	A4	Y2-A4 PolarHBondContact O-N 3.28Å
3	S	62.6	Low	74.2	Confident	121 Å²	121	111.2 Å²	111.2	85%	0.846	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-66.6	120.3	178.1	-151.6	0	0	0	0	108.2	M1	M1-S3 PolarHBondContact O-N 2.76Å
4	A	64.8	Low	75.1	Confident	85 Å²	85	112 Å²	112	70%	0.702	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-60.2	136.5	179.8	0	0	0	0	0	109.7	Y2 S6	Y2-A4 PolarHBondContact O-N 3.28Å; A4-S6 PolarHBondContact O-N 2.98Å
5	P	68.2	Low	75.9	Confident	102 Å²	102	113.7 Å²	113.7	66%	0.662	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-59.4	132.2	175.2	22.9	-30.1	0	0	0	109.5	T9	P5-T9 WeakPolarHBondContact CB-OG1 3.22Å
6	S	77.5	Confident	76.8	Confident	75 Å²	75	113.5 Å²	113.5	52%	0.524	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-56.6	142.4	174.2	167.8	0	0	0	0	109.7	A4 C8 T9 C10	A4-S6 PolarHBondContact O-N 2.98Å; S6-C8 PolarHBondContact O-N 2.91Å; S6-T9 PolarHBondContact N-OG1 3.28Å; S6-T9 PolarHBondContact O-N 3.29Å; S6-T9 PolarHBondContact O-OG1 2.87Å; S6-C10 PolarHBondContact O-N 2.66Å
7	A	79.2	Confident	77.4	Confident	76 Å²	76	113.1 Å²	113.1	63%	0.628	64%	0.637	S	S	*	*	H	α-helix	trans	-48.8	-33.2	178.3	0	0	0	0	0	112.7	C10 L11	A7-C10 PolarHBondContact O-N 3.03Å; A7-L11 WeakPolarHBondContact O-CG 3.21Å; A7-L11 PolarHBondContact O-N 3.38Å; A7-L11 VanDerWaalsContact O-N 3.09Å
8	C	81	Confident	78	Confident	80 Å²	80	112.8 Å²	112.8	54%	0.541	63%	0.633	S	S	.	*	H	α-helix	trans	-61.4	-45.4	175.2	-175.7	0	0	0	0	112.8	S6 C10 L11 C12	S6-C8 PolarHBondContact O-N 2.91Å; C8-C10 VanDerWaalsContact C-N 3.33Å; C8-C10 PolarHBondContact O-N 2.89Å; C8-L11 PolarHBondContact O-N 2.97Å; C8-C12 PolarHBondContact O-N 2.99Å; C8-C12 PolarHBondContact O-SG 3.15Å
9	T	82.7	Confident	78.4	Confident	68 Å²	68	109.3 Å²	109.3	42%	0.417	62%	0.616	S	S	.	*	H	α-helix	trans	-65.1	-37	179.3	59.2	0	0	0	0	112.3	P5 S6 C12 L13	P5-T9 WeakPolarHBondContact CB-OG1 3.22Å; S6-T9 PolarHBondContact N-OG1 3.28Å; S6-T9 PolarHBondContact O-N 3.29Å; S6-T9 PolarHBondContact O-OG1 2.87Å; T9-C12 PolarHBondContact O-N 3.36Å; T9-L13 WeakPolarHBondContact O-CG 3.34Å; T9-L13 PolarHBondContact O-N 2.9Å; T9-L13 VanDerWaalsContact O-N 3.1Å
10	C	83	Confident	78.6	Confident	58 Å²	58	110.7 Å²	110.7	39%	0.392	62%	0.615	S	S	.	*	H	α-helix	trans	-66.2	-44.6	176.4	-167	0	0	0	0	111.5	S6 A7 C8 C12 L13 H14	S6-C10 PolarHBondContact O-N 2.66Å; A7-C10 PolarHBondContact O-N 3.03Å; C8-C10 VanDerWaalsContact C-N 3.33Å; C8-C10 PolarHBondContact O-N 2.89Å; C10-C12 PolarHBondContact O-N 2.84Å; C10-L13 PolarHBondContact O-N 3.32Å; C10-H14 PolarHBondContact O-CD2 3.15Å; C10-H14 PolarHBondContact O-N 3.42Å
11	L	85.1	Confident	78.6	Confident	123 Å²	123	111.9 Å²	111.9	64%	0.644	62%	0.616	S	S	*	*	H	α-helix	trans	-62.5	-41.6	176.5	-71.1	170.4	0	0	0	112.3	A7 C8 H14 F15	A7-L11 WeakPolarHBondContact O-CG 3.21Å; A7-L11 PolarHBondContact O-N 3.38Å; A7-L11 VanDerWaalsContact O-N 3.09Å; C8-L11 PolarHBondContact O-N 2.97Å; L11-H14 PolarHBondContact O-N 3Å; L11-F15 WeakPolarHBondContact O-CB 3.25Å; L11-F15 PolarHBondContact O-N 2.61Å
12	C	87.1	Confident	79.9	Confident	69 Å²	69	104 Å²	104	47%	0.466	58%	0.581	S	S	.	*	H	α-helix	trans	-62.6	-43.4	176.2	-69.2	0	0	0	0	112.3	C8 T9 C10 F15 L16	C8-C12 PolarHBondContact O-N 2.99Å; C8-C12 PolarHBondContact O-SG 3.15Å; T9-C12 PolarHBondContact O-N 3.36Å; C10-C12 PolarHBondContact O-N 2.84Å; C12-F15 PolarHBondContact O-N 3.07Å; C12-L16 WeakPolarHBondContact O-CB 3.34Å; C12-L16 WeakPolarHBondContact O-CG 3.48Å; C12-L16 PolarHBondContact O-N 3.31Å
13	L	87.9	Confident	80.8	Confident	110 Å²	110	99 Å²	99	58%	0.576	57%	0.566	S	S	*	*	H	α-helix	trans	-65.2	-41.2	177.1	-71.2	173.9	0	0	0	111.9	T9 C10 L16 L17	T9-L13 WeakPolarHBondContact O-CG 3.34Å; T9-L13 PolarHBondContact O-N 2.9Å; T9-L13 VanDerWaalsContact O-N 3.1Å; C10-L13 PolarHBondContact O-N 3.32Å; L13-L16 PolarHBondContact O-N 2.82Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.5Å; L13-L17 PolarHBondContact O-N 2.89Å
14	H	86.2	Confident	81.3	Confident	122 Å²	122	96.2 Å²	96.2	57%	0.565	54%	0.544	S	S	*	.	H	α-helix	trans	-62.8	-42.5	174.5	-87.1	-63.7	0	0	0	112.4	C10 L11 L17 L18	C10-H14 PolarHBondContact O-CD2 3.15Å; C10-H14 PolarHBondContact O-N 3.42Å; L11-H14 PolarHBondContact O-N 3Å; H14-L17 PolarHBondContact O-N 3.49Å; H14-L18 VanDerWaalsContact O-CB 3.3Å; H14-L18 WeakPolarHBondContact O-CB 3.46Å; H14-L18 PolarHBondContact O-N 3.33Å
15	F	88.1	Confident	81.4	Confident	138 Å²	138	97 Å²	97	61%	0.605	54%	0.536	S	S	*	.	H	α-helix	trans	-63.6	-44.9	176.1	-173.1	-98.6	0	0	0	111.6	L11 C12 L17 L18 C19	L11-F15 WeakPolarHBondContact O-CB 3.25Å; L11-F15 PolarHBondContact O-N 2.61Å; C12-F15 PolarHBondContact O-N 3.07Å; F15-L17 PolarHBondContact O-N 3.43Å; F15-L18 PolarHBondContact O-N 2.9Å; F15-C19 WeakPolarHBondContact CE1-SG 3.5Å; F15-C19 WeakPolarHBondContact O-CB 3.25Å; F15-C19 PolarHBondContact O-N 2.76Å; F15-C19 PolarHBondContact O-SG 2.8Å
16	L	89.2	Confident	81.3	Confident	110 Å²	110	95.6 Å²	95.6	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-62.5	-42.6	175.8	-73.5	172.2	0	0	0	112.5	C12 L13 L18 C19 F20	C12-L16 WeakPolarHBondContact O-CB 3.34Å; C12-L16 WeakPolarHBondContact O-CG 3.48Å; C12-L16 PolarHBondContact O-N 3.31Å; L13-L16 PolarHBondContact O-N 2.82Å; L16-L18 VanDerWaalsContact C-N 3.31Å; L16-L18 PolarHBondContact O-N 3.27Å; L16-C19 PolarHBondContact O-N 3.04Å; L16-F20 WeakPolarHBondContact O-CB 3.23Å; L16-F20 PolarHBondContact O-N 3.19Å
17	L	88.2	Confident	80.5	Confident	107 Å²	107	95.2 Å²	95.2	56%	0.56	53%	0.527	S	S	*	.	H	α-helix	trans	-61.6	-41.2	174	-78.1	167.6	0	0	0	111.3	L13 H14 F15 F20 Q21	L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.5Å; L13-L17 PolarHBondContact O-N 2.89Å; H14-L17 PolarHBondContact O-N 3.49Å; F15-L17 PolarHBondContact O-N 3.43Å; L17-F20 PolarHBondContact O-N 3.33Å; L17-Q21 WeakPolarHBondContact O-CB 3.05Å; L17-Q21 WeakPolarHBondContact O-CG 3.42Å; L17-Q21 PolarHBondContact O-N 2.78Å
18	L	87.9	Confident	79.7	Confident	108 Å²	108	96.6 Å²	96.6	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-67.7	-43.1	177.5	-164.5	145.4	0	0	0	111.3	H14 F15 L16 F20 Q21 V22	H14-L18 VanDerWaalsContact O-CB 3.3Å; H14-L18 WeakPolarHBondContact O-CB 3.46Å; H14-L18 PolarHBondContact O-N 3.33Å; F15-L18 PolarHBondContact O-N 2.9Å; L16-L18 VanDerWaalsContact C-N 3.31Å; L16-L18 PolarHBondContact O-N 3.27Å; L18-F20 VanDerWaalsContact C-N 3.3Å; L18-F20 PolarHBondContact O-N 2.81Å; L18-Q21 PolarHBondContact O-N 3.38Å; L18-V22 HydrophobicContact CD2-CG2 3.97Å; L18-V22 WeakPolarHBondContact O-CB 3.45Å; L18-V22 VanDerWaalsContact O-CG2 3.27Å; L18-V22 WeakPolarHBondContact O-CG2 3.41Å; L18-V22 PolarHBondContact O-N 3.43Å
19	C	85.6	Confident	79	Confident	46 Å²	46	100 Å²	100	31%	0.311	53%	0.528	S	S	.	.	H	α-helix	trans	-58.5	-42.9	171.8	-71.2	0	0	0	0	111.5	F15 L16 V22 Q23	F15-C19 WeakPolarHBondContact CE1-SG 3.5Å; F15-C19 WeakPolarHBondContact O-CB 3.25Å; F15-C19 PolarHBondContact O-N 2.76Å; F15-C19 PolarHBondContact O-SG 2.8Å; L16-C19 PolarHBondContact O-N 3.04Å; C19-V22 PolarHBondContact O-N 2.85Å; C19-Q23 VanDerWaalsContact O-CB 3.26Å; C19-Q23 WeakPolarHBondContact O-CB 3.42Å; C19-Q23 PolarHBondContact O-N 3.09Å
20	F	82.8	Confident	78.2	Confident	137 Å²	137	102.8 Å²	102.8	60%	0.601	54%	0.54	S	S	*	.	H	α-helix	trans	-66.4	-42.1	177.9	-157.8	-92.6	0	0	0	111.6	L16 L17 L18 Q23 V24	L16-F20 WeakPolarHBondContact O-CB 3.23Å; L16-F20 PolarHBondContact O-N 3.19Å; L17-F20 PolarHBondContact O-N 3.33Å; L18-F20 VanDerWaalsContact C-N 3.3Å; L18-F20 PolarHBondContact O-N 2.81Å; F20-Q23 PolarHBondContact O-N 3.04Å; F20-V24 HydrophobicContact CD1-CG2 4Å; F20-V24 HydrophobicContact CE1-CG2 3.9Å; F20-V24 WeakPolarHBondContact O-CB 3.46Å; F20-V24 VanDerWaalsContact O-CG2 3.25Å; F20-V24 WeakPolarHBondContact O-CG2 3.5Å; F20-V24 PolarHBondContact O-N 2.91Å
21	Q	78.8	Confident	78	Confident	135 Å²	135	104 Å²	104	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-62.1	-44.8	174.3	-72.3	-71.8	-28.6	0	0	111.5	L17 L18 V24 L25	L17-Q21 WeakPolarHBondContact O-CB 3.05Å; L17-Q21 WeakPolarHBondContact O-CG 3.42Å; L17-Q21 PolarHBondContact O-N 2.78Å; L18-Q21 PolarHBondContact O-N 3.38Å; Q21-V24 PolarHBondContact O-N 3.26Å; Q21-L25 WeakPolarHBondContact O-CB 2.99Å; Q21-L25 PolarHBondContact O-N 2.04Å
22	V	75.9	Confident	78	Confident	74 Å²	74	102.4 Å²	102.4	45%	0.448	54%	0.538	S	S	.	.	H	α-helix	trans	-62.9	-44.8	175.8	170.9	0	0	0	0	110.6	L18 C19 V24 L25 V26	L18-V22 HydrophobicContact CD2-CG2 3.97Å; L18-V22 WeakPolarHBondContact O-CB 3.45Å; L18-V22 VanDerWaalsContact O-CG2 3.27Å; L18-V22 WeakPolarHBondContact O-CG2 3.41Å; L18-V22 PolarHBondContact O-N 3.43Å; C19-V22 PolarHBondContact O-N 2.85Å; V22-V24 PolarHBondContact O-N 3.33Å; V22-L25 WeakPolarHBondContact O-CB 3.42Å; V22-L25 PolarHBondContact O-N 2.83Å; V22-V26 HydrophobicContact CG1-CG2 4.19Å; V22-V26 WeakPolarHBondContact O-CB 3.32Å; V22-V26 VanDerWaalsContact O-CG2 3.23Å; V22-V26 WeakPolarHBondContact O-CG2 3.47Å; V22-V26 PolarHBondContact O-N 2.97Å
23	Q	75.6	Confident	78.2	Confident	135 Å²	135	105.5 Å²	105.5	63%	0.631	54%	0.544	S	S	*	.	H	α-helix	trans	-65.6	-37.8	-180	-166.5	173.5	-0.4	0	0	112.1	C19 F20 A27	C19-Q23 VanDerWaalsContact O-CB 3.26Å; C19-Q23 WeakPolarHBondContact O-CB 3.42Å; C19-Q23 PolarHBondContact O-N 3.09Å; F20-Q23 PolarHBondContact O-N 3.04Å; Q23-A27 VanDerWaalsContact O-CB 3.26Å; Q23-A27 WeakPolarHBondContact O-CB 3.28Å; Q23-A27 PolarHBondContact O-N 2.67Å
24	V	71.6	Confident	78.3	Confident	62 Å²	62	107.7 Å²	107.7	38%	0.376	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-41.2	173	170.9	0	0	0	0	111.2	F20 Q21 V22 A27 E28	F20-V24 HydrophobicContact CD1-CG2 4Å; F20-V24 HydrophobicContact CE1-CG2 3.9Å; F20-V24 WeakPolarHBondContact O-CB 3.46Å; F20-V24 VanDerWaalsContact O-CG2 3.25Å; F20-V24 WeakPolarHBondContact O-CG2 3.5Å; F20-V24 PolarHBondContact O-N 2.91Å; Q21-V24 PolarHBondContact O-N 3.26Å; V22-V24 PolarHBondContact O-N 3.33Å; V24-A27 PolarHBondContact O-N 3.05Å; V24-E28 PolarHBondContact O-N 2.73Å; V24-E28 VanDerWaalsContact O-N 3.07Å
25	L	68.3	Low	78.4	Confident	102 Å²	102	106.9 Å²	106.9	53%	0.534	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-46.8	176.3	-162.8	78.3	0	0	0	111.2	Q21 V22 A27 E28 E29	Q21-L25 WeakPolarHBondContact O-CB 2.99Å; Q21-L25 PolarHBondContact O-N 2.04Å; V22-L25 WeakPolarHBondContact O-CB 3.42Å; V22-L25 PolarHBondContact O-N 2.83Å; L25-A27 VanDerWaalsContact C-N 3.34Å; L25-A27 PolarHBondContact O-N 2.86Å; L25-E28 PolarHBondContact O-N 3.47Å; L25-E29 PolarHBondContact O-N 3.23Å
26	V	64.9	Low	78.5	Confident	72 Å²	72	105 Å²	105	44%	0.436	54%	0.536	S	S	.	.	H	α-helix	trans	-65.9	-35.5	178.2	173.5	0	0	0	0	111.8	V22 E29 N30	V22-V26 HydrophobicContact CG1-CG2 4.19Å; V22-V26 WeakPolarHBondContact O-CB 3.32Å; V22-V26 VanDerWaalsContact O-CG2 3.23Å; V22-V26 WeakPolarHBondContact O-CG2 3.47Å; V22-V26 PolarHBondContact O-N 2.97Å; V26-E29 PolarHBondContact O-N 3.11Å; V26-N30 PolarHBondContact O-ND2 2.65Å
27	A	61.9	Low	78.7	Confident	67 Å²	67	102 Å²	102	55%	0.554	52%	0.522	S	S	*	.	H	α-helix	trans	-69.9	-34.5	176.9	0	0	0	0	0	112.7	Q23 V24 L25	Q23-A27 VanDerWaalsContact O-CB 3.26Å; Q23-A27 WeakPolarHBondContact O-CB 3.28Å; Q23-A27 PolarHBondContact O-N 2.67Å; V24-A27 PolarHBondContact O-N 3.05Å; L25-A27 VanDerWaalsContact C-N 3.34Å; L25-A27 PolarHBondContact O-N 2.86Å
28	E	62.6	Low	78.8	Confident	106 Å²	106	101.4 Å²	101.4	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-70.6	-30.3	175.3	-76.3	-171.8	163	0	0	112.3	V24 L25 N30 K196	V24-E28 PolarHBondContact O-N 2.73Å; V24-E28 VanDerWaalsContact O-N 3.07Å; L25-E28 PolarHBondContact O-N 3.47Å; E28-N30 VanDerWaalsContact C-N 3.35Å; E28-N30 PolarHBondContact O-N 2.95Å; E28-K196 IonicContact OE1-NZ 3.73Å; E28-K196 WeakPolarHBondContact OE2-CE 3.14Å; E28-K196 IonicContact OE2-NZ 2.73Å; E28-K196 PolarHBondContact OE2-NZ 3.36Å
29	E	65.1	Low	78.9	Confident	152 Å²	152	100.3 Å²	100.3	71%	0.71	51%	0.511	S	S	*	.	H	α-helix	trans	-76.5	-17.4	-179.8	-71.8	-172.1	161.7	0	0	114.1	L25 V26	L25-E29 PolarHBondContact O-N 3.23Å; V26-E29 PolarHBondContact O-N 3.11Å
30	N	66.9	Low	79.1	Confident	125 Å²	125	101.2 Å²	101.2	67%	0.668	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	28.6	-173	-79	-64.9	0	0	0	115.2	V26 E28 D32	V26-N30 PolarHBondContact O-ND2 2.65Å; E28-N30 VanDerWaalsContact C-N 3.35Å; E28-N30 PolarHBondContact O-N 2.95Å; N30-D32 PolarHBondContact O-N 3.3Å
31	V	79	Confident	79.4	Confident	84 Å²	84	96.5 Å²	96.5	51%	0.509	49%	0.493	S	S	.	.			trans	-80.5	99.1	173.2	-172.4	0	0	0	0	110.1	F33	V31-F33 HydrophobicContact CB-CE2 3.97Å; V31-F33 HydrophobicContact CB-CZ 4.17Å; V31-F33 HydrophobicContact CG1-CD1 4.28Å; V31-F33 HydrophobicContact CG1-CD2 4.15Å; V31-F33 HydrophobicContact CG1-CE1 3.78Å; V31-F33 HydrophobicContact CG1-CE2 3.63Å; V31-F33 HydrophobicContact CG1-CG 4.45Å; V31-F33 HydrophobicContact CG1-CZ 3.43Å; V31-F33 VanDerWaalsContact CG1-CZ 3.43Å; V31-F33 WeakPolarHBondContact O-CD2 3.3Å; V31-F33 PolarHBondContact O-N 3.43Å
32	D	85.1	Confident	79.9	Confident	90 Å²	90	98.4 Å²	98.4	48%	0.481	50%	0.495	S	S	.	.			trans	-77	101.8	174.1	-174.5	4.6	0	0	0	111.2	N30 R34	N30-D32 PolarHBondContact O-N 3.3Å; D32-R34 VanDerWaalsContact C-N 3.32Å; D32-R34 WeakPolarHBondContact OD1-CB 3.38Å; D32-R34 PolarHBondContact OD1-N 3.28Å; D32-R34 IonicContact OD2-CZ 2.78Å; D32-R34 IonicContact OD2-NE 3.64Å; D32-R34 IonicContact OD2-NH2 3.59Å; D32-R34 PolarHBondContact OD2-NH2 3.3Å
33	F	90.5	Very high	80.4	Confident	134 Å²	134	97.6 Å²	97.6	59%	0.588	50%	0.496	S	S	*	.			trans	-80.9	-4.6	175.1	-68	-74.2	0	0	0	114.2	V31 I35 H36 V37	V31-F33 HydrophobicContact CB-CE2 3.97Å; V31-F33 HydrophobicContact CB-CZ 4.17Å; V31-F33 HydrophobicContact CG1-CD1 4.28Å; V31-F33 HydrophobicContact CG1-CD2 4.15Å; V31-F33 HydrophobicContact CG1-CE1 3.78Å; V31-F33 HydrophobicContact CG1-CE2 3.63Å; V31-F33 HydrophobicContact CG1-CG 4.45Å; V31-F33 HydrophobicContact CG1-CZ 3.43Å; V31-F33 VanDerWaalsContact CG1-CZ 3.43Å; V31-F33 WeakPolarHBondContact O-CD2 3.3Å; V31-F33 PolarHBondContact O-N 3.43Å; F33-I35 PolarHBondContact O-N 2.83Å; F33-H36 WeakPolarHBondContact O-CB 3.35Å; F33-H36 PolarHBondContact O-N 2.83Å; F33-H36 VanDerWaalsContact O-N 3.12Å; F33-V37 HydrophobicContact CB-CG2 4.49Å; F33-V37 WeakPolarHBondContact O-CG2 3.13Å; F33-V37 PolarHBondContact O-N 3.06Å
34	R	89.5	Confident	81	Confident	155 Å²	155	95.9 Å²	95.9	59%	0.585	48%	0.483	S	S	*	.	H	α-helix	trans	-56.4	-48.2	-175.5	177.9	176.8	49.6	168.6	-1.4	112.1	D32 H36 V37 E38	D32-R34 VanDerWaalsContact C-N 3.32Å; D32-R34 WeakPolarHBondContact OD1-CB 3.38Å; D32-R34 PolarHBondContact OD1-N 3.28Å; D32-R34 IonicContact OD2-CZ 2.78Å; D32-R34 IonicContact OD2-NE 3.64Å; D32-R34 IonicContact OD2-NH2 3.59Å; D32-R34 PolarHBondContact OD2-NH2 3.3Å; R34-H36 VanDerWaalsContact C-N 3.29Å; R34-H36 PolarHBondContact O-N 2.9Å; R34-V37 PolarHBondContact O-N 2.92Å; R34-E38 HydrophobicContact CG-CG 4.35Å; R34-E38 VanDerWaalsContact CG-OE1 3.31Å; R34-E38 WeakPolarHBondContact CG-OE1 3.26Å; R34-E38 WeakPolarHBondContact O-CB 3.09Å; R34-E38 WeakPolarHBondContact O-CG 3.43Å; R34-E38 PolarHBondContact O-N 2.83Å
35	I	89	Confident	81.9	Confident	106 Å²	106	93.7 Å²	93.7	54%	0.544	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-42.2	179.4	-61.6	172.5	0	0	0	110.5	F33 N39	F33-I35 PolarHBondContact O-N 2.83Å; I35-N39 WeakPolarHBondContact O-CB 3.44Å; I35-N39 VanDerWaalsContact O-CG 3.29Å; I35-N39 PolarHBondContact O-N 2.71Å; I35-N39 VanDerWaalsContact O-N 3.07Å; I35-N39 PolarHBondContact O-ND2 3.2Å
36	H	90.3	Very high	82.9	Confident	97 Å²	97	94.4 Å²	94.4	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-61.6	-50.6	176.8	173.7	83.8	0	0	0	111.2	F33 R34 N39 Q40	F33-H36 WeakPolarHBondContact O-CB 3.35Å; F33-H36 PolarHBondContact O-N 2.83Å; F33-H36 VanDerWaalsContact O-N 3.12Å; R34-H36 VanDerWaalsContact C-N 3.29Å; R34-H36 PolarHBondContact O-N 2.9Å; H36-N39 PolarHBondContact O-N 3.46Å; H36-Q40 WeakPolarHBondContact O-CB 3.24Å; H36-Q40 VanDerWaalsContact O-CG 3.29Å; H36-Q40 WeakPolarHBondContact O-CG 3.33Å; H36-Q40 PolarHBondContact O-N 3.18Å
37	V	92.1	Very high	84.1	Confident	48 Å²	48	97.4 Å²	97.4	29%	0.291	49%	0.492	S	S	.	.	H	α-helix	trans	-63.1	-44.3	-179.3	172.8	0	0	0	0	111.1	F33 R34 N39 Q40 T41 F93	F33-V37 HydrophobicContact CB-CG2 4.49Å; F33-V37 WeakPolarHBondContact O-CG2 3.13Å; F33-V37 PolarHBondContact O-N 3.06Å; R34-V37 PolarHBondContact O-N 2.92Å; V37-N39 VanDerWaalsContact C-N 3.34Å; V37-N39 PolarHBondContact O-N 2.89Å; V37-Q40 PolarHBondContact O-N 3.04Å; V37-T41 VanDerWaalsContact O-CB 3.28Å; V37-T41 WeakPolarHBondContact O-CB 3.46Å; V37-T41 PolarHBondContact O-N 3.36Å; V37-T41 PolarHBondContact O-OG1 2.89Å; V37-F93 HydrophobicContact CG1-CB 3.85Å; V37-F93 HydrophobicContact CG1-CD1 4.45Å; V37-F93 HydrophobicContact CG1-CD2 4.27Å; V37-F93 HydrophobicContact CG1-CG 3.96Å
38	E	90.7	Very high	85.6	Confident	95 Å²	95	97.2 Å²	97.2	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-43.3	177.8	-76.5	177.5	-171.5	0	0	112.1	R34 R42	R34-E38 HydrophobicContact CG-CG 4.35Å; R34-E38 VanDerWaalsContact CG-OE1 3.31Å; R34-E38 WeakPolarHBondContact CG-OE1 3.26Å; R34-E38 WeakPolarHBondContact O-CB 3.09Å; R34-E38 WeakPolarHBondContact O-CG 3.43Å; R34-E38 PolarHBondContact O-N 2.83Å; E38-R42 WeakPolarHBondContact O-CG 3.26Å
39	N	89.9	Confident	87	Confident	84 Å²	84	103 Å²	103	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-66.3	-45.5	177.5	-75.1	-26.4	0	0	0	111.7	I35 H36 V37 T41 R42	I35-N39 WeakPolarHBondContact O-CB 3.44Å; I35-N39 VanDerWaalsContact O-CG 3.29Å; I35-N39 PolarHBondContact O-N 2.71Å; I35-N39 VanDerWaalsContact O-N 3.07Å; I35-N39 PolarHBondContact O-ND2 3.2Å; H36-N39 PolarHBondContact O-N 3.46Å; V37-N39 VanDerWaalsContact C-N 3.34Å; V37-N39 PolarHBondContact O-N 2.89Å; N39-T41 PolarHBondContact O-N 2.95Å; N39-R42 PolarHBondContact O-N 2.74Å
40	Q	89.9	Confident	88.1	Confident	65 Å²	65	97.8 Å²	97.8	30%	0.304	48%	0.479	S	S	.	.	H	α-helix	trans	-69.3	-30	179.2	-68.7	-63	-31.7	0	0	113	H36 V37 R42 A43 T92 F93	H36-Q40 WeakPolarHBondContact O-CB 3.24Å; H36-Q40 VanDerWaalsContact O-CG 3.29Å; H36-Q40 WeakPolarHBondContact O-CG 3.33Å; H36-Q40 PolarHBondContact O-N 3.18Å; V37-Q40 PolarHBondContact O-N 3.04Å; Q40-R42 PolarHBondContact O-N 2.8Å; Q40-A43 PolarHBondContact O-N 3.5Å; Q40-T92 PolarHBondContact O-OG1 2.76Å; Q40-F93 HydrophobicContact CB-CD2 3.78Å; Q40-F93 HydrophobicContact CB-CE2 3.84Å; Q40-F93 HydrophobicContact CG-CE2 4.38Å
41	T	90.6	Very high	89.3	Confident	38 Å²	38	96.2 Å²	96.2	23%	0.233	47%	0.468	C	S	.	.	H	α-helix	trans	-64.7	-25.2	178	-59.7	0	0	0	0	112.4	V37 N39 A43 F93 Q96	V37-T41 VanDerWaalsContact O-CB 3.28Å; V37-T41 WeakPolarHBondContact O-CB 3.46Å; V37-T41 PolarHBondContact O-N 3.36Å; V37-T41 PolarHBondContact O-OG1 2.89Å; N39-T41 PolarHBondContact O-N 2.95Å; T41-A43 VanDerWaalsContact C-N 3.33Å; T41-F93 WeakPolarHBondContact OG1-CB 3.38Å; T41-Q96 VanDerWaalsContact CG2-NE2 3.29Å; T41-Q96 PolarHBondContact O-NE2 2.9Å
42	R	87.6	Confident	90	Very high	176 Å²	176	96.9 Å²	96.9	66%	0.664	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-24.6	-178	-67.3	173.6	-170	167.2	5	113	E38 N39 Q40	E38-R42 WeakPolarHBondContact O-CG 3.26Å; N39-R42 PolarHBondContact O-N 2.74Å; Q40-R42 PolarHBondContact O-N 2.8Å
43	A	87.4	Confident	90.5	Very high	56 Å²	56	97 Å²	97	46%	0.463	46%	0.462	S	S	.	.	S	Bend	trans	-120.3	164.1	-177.3	0	0	0	0	0	111.5	Q40 T41 T92	Q40-A43 PolarHBondContact O-N 3.5Å; T41-A43 VanDerWaalsContact C-N 3.33Å; A43-T92 WeakPolarHBondContact O-CB 3.31Å; A43-T92 WeakPolarHBondContact O-CG2 3.36Å; A43-T92 PolarHBondContact O-OG1 3.45Å
44	R	88.8	Confident	90.7	Very high	99 Å²	99	92.2 Å²	92.2	37%	0.374	44%	0.442	S	S	.	.			trans	-71.1	133.8	168.6	170.6	176.7	167.6	166.7	4.8	108.6	D46 D91	R44-D46 VanDerWaalsContact CD-OD1 3.31Å; R44-D46 WeakPolarHBondContact CD-OD1 3.38Å; R44-D46 WeakPolarHBondContact CG-OD1 3.29Å; R44-D46 IonicContact CZ-OD1 3.68Å; R44-D46 IonicContact NE-OD1 2.84Å; R44-D46 PolarHBondContact NE-OD1 2.81Å; R44-D46 IonicContact NH2-OD1 3.01Å; R44-D46 PolarHBondContact O-N 2.83Å; R44-D91 WeakPolarHBondContact CB-OD1 3.43Å; R44-D91 VanDerWaalsContact CG-OD1 3.23Å; R44-D91 WeakPolarHBondContact CG-OD1 3.13Å
45	D	90.7	Very high	91.1	Very high	16 Å²	16	85.2 Å²	85.2	9%	0.086	42%	0.415	C	S	.	.			trans	-82.8	90	179.3	174	-0.4	0	0	0	111.6	V47 S48 K50 D91	D45-V47 VanDerWaalsContact C-N 3.27Å; D45-V47 PolarHBondContact O-N 3.1Å; D45-V47 WeakPolarHBondContact OD1-CG2 2.98Å; D45-V47 PolarHBondContact OD1-N 2.82Å; D45-V47 VanDerWaalsContact OD1-N 3.13Å; D45-S48 PolarHBondContact OD1-N 3.49Å; D45-S48 PolarHBondContact OD1-OG 2.91Å; D45-S48 WeakPolarHBondContact OD2-CB 3.34Å; D45-S48 PolarHBondContact OD2-OG 2.72Å; D45-K50 VanDerWaalsContact C-NZ 3.29Å; D45-K50 WeakPolarHBondContact O-CE 3.46Å; D45-K50 PolarHBondContact O-NZ 3.19Å; D45-D91 PolarHBondContact N-O 2.89Å
46	D	88.7	Confident	91.5	Very high	118 Å²	118	80.1 Å²	80.1	63%	0.631	39%	0.39	S	S	*	.			trans	-82.6	0.5	-177	-67.9	-42.7	0	0	0	114.8	R44	R44-D46 VanDerWaalsContact CD-OD1 3.31Å; R44-D46 WeakPolarHBondContact CD-OD1 3.38Å; R44-D46 WeakPolarHBondContact CG-OD1 3.29Å; R44-D46 IonicContact CZ-OD1 3.68Å; R44-D46 IonicContact NE-OD1 2.84Å; R44-D46 PolarHBondContact NE-OD1 2.81Å; R44-D46 IonicContact NH2-OD1 3.01Å; R44-D46 PolarHBondContact O-N 2.83Å
47	V	90.8	Very high	91.9	Very high	135 Å²	135	75.5 Å²	75.5	82%	0.818	37%	0.368	S	S	*	.	S	Bend	trans	-103.3	-25.1	-175.7	-61.3	0	0	0	0	113.3	D45	D45-V47 VanDerWaalsContact C-N 3.27Å; D45-V47 PolarHBondContact O-N 3.1Å; D45-V47 WeakPolarHBondContact OD1-CG2 2.98Å; D45-V47 PolarHBondContact OD1-N 2.82Å; D45-V47 VanDerWaalsContact OD1-N 3.13Å
48	S	92	Very high	92.2	Very high	62 Å²	62	76.6 Å²	76.6	43%	0.434	37%	0.367	S	S	.	.	S	Bend	trans	-92.8	149.7	178.8	-53.2	0	0	0	0	112.7	D45 K50	D45-S48 PolarHBondContact OD1-N 3.49Å; D45-S48 PolarHBondContact OD1-OG 2.91Å; D45-S48 WeakPolarHBondContact OD2-CB 3.34Å; D45-S48 PolarHBondContact OD2-OG 2.72Å; S48-K50 PolarHBondContact O-N 3.06Å
49	R	91.5	Very high	92.6	Very high	229 Å²	229	72 Å²	72	86%	0.864	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-61.2	126.3	167.4	-177.3	-177.4	67.4	-165.7	-1.4	109.9
50	K	90.3	Very high	93	Very high	42 Å²	42	71.7 Å²	71.7	18%	0.183	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-73.9	134.3	177.5	-52.9	-51.2	-154.5	169.7	0	111.8	D45 S48 E89 T90 D91	D45-K50 VanDerWaalsContact C-NZ 3.29Å; D45-K50 WeakPolarHBondContact O-CE 3.46Å; D45-K50 PolarHBondContact O-NZ 3.19Å; S48-K50 PolarHBondContact O-N 3.06Å; K50-E89 HydrophobicContact CB-CG 3.62Å; K50-E89 WeakPolarHBondContact CB-OE1 3.33Å; K50-E89 HydrophobicContact CG-CG 4.24Å; K50-E89 WeakPolarHBondContact CG-OE1 3.31Å; K50-T90 WeakPolarHBondContact CD-O 3.44Å; K50-D91 PolarHBondContact NZ-O 3.3Å
51	Q	91.7	Very high	93.4	Very high	92 Å²	92	70.4 Å²	70.4	43%	0.43	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-78.6	126.2	173.7	-179.2	64.7	19.5	0	0	109.4	E89 T90	Q51-E89 WeakPolarHBondContact O-CA 3.35Å; Q51-T90 PolarHBondContact O-N 2.88Å
52	L	93.2	Very high	93.8	Very high	98 Å²	98	69.5 Å²	69.5	51%	0.513	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.6	178.9	-169.2	67.6	0	0	0	110.5	L87 V88 E89	L52-L87 HydrophobicContact CD1-CB 4.14Å; L52-L87 HydrophobicContact CD1-CD2 4.44Å; L52-L87 HydrophobicContact CD2-CD2 4.22Å; L52-L87 HydrophobicContact CG-CD2 4.38Å; L52-V88 CarbonylContact C-O 3.47Å; L52-V88 WeakPolarHBondContact CA-O 3.16Å; L52-E89 HydrophobicContact CD1-CB 4.09Å
53	R	94.9	Very high	94.3	Very high	92 Å²	92	62.6 Å²	62.6	35%	0.347	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.4	177.1	-60.2	174.2	-175.5	158.6	0.5	109.5	Y55 V88	R53-Y55 HydrophobicContact CB-CD1 3.92Å; R53-Y55 HydrophobicContact CB-CE1 3.87Å; R53-V88 PolarHBondContact N-O 2.8Å; R53-V88 PolarHBondContact O-N 3.34Å
54	L	95.5	Very high	94.8	Very high	33 Å²	33	63.1 Å²	63.1	17%	0.173	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	117	175.9	176.5	60.4	0	0	0	109.8	Q85 L86 L87 K102 P179	L54-Q85 HydrophobicContact CD1-CB 4.23Å; L54-L86 WeakPolarHBondContact CA-O 3.45Å; L54-L86 WeakPolarHBondContact CD1-O 3.26Å; L54-L87 HydrophobicContact CB-CD2 4.3Å; L54-L87 HydrophobicContact CD1-CD2 3.97Å; L54-K102 HydrophobicContact CD1-CD 3.94Å; L54-K102 HydrophobicContact CD2-CD 4.4Å; L54-P179 HydrophobicContact CD2-CG 4.46Å; L54-P179 HydrophobicContact CG-CG 4.03Å
55	Y	97.1	Very high	95.3	Very high	8 Å²	8	58.7 Å²	58.7	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	175.2	177	59.7	-97	0	0	0	112.1	R53 L57 L86 V88 K176 R177	R53-Y55 HydrophobicContact CB-CD1 3.92Å; R53-Y55 HydrophobicContact CB-CE1 3.87Å; Y55-L57 HydrophobicContact CD2-CD2 4.41Å; Y55-L57 HydrophobicContact CD2-CG 4.26Å; Y55-L57 HydrophobicContact CE2-CD1 4.37Å; Y55-L57 HydrophobicContact CE2-CD2 3.75Å; Y55-L57 HydrophobicContact CE2-CG 3.75Å; Y55-L86 PolarHBondContact N-O 3.44Å; Y55-L86 VanDerWaalsContact N-O 3.1Å; Y55-L86 WeakPolarHBondContact O-CA 3.46Å; Y55-L86 WeakPolarHBondContact O-CB 3Å; Y55-L86 PolarHBondContact O-N 2.77Å; Y55-V88 HydrophobicContact CD1-CG2 4.39Å; Y55-V88 HydrophobicContact CE1-CB 3.69Å; Y55-V88 HydrophobicContact CE1-CG1 4.31Å; Y55-V88 HydrophobicContact CE1-CG2 3.6Å; Y55-V88 HydrophobicContact CE2-CG2 3.99Å; Y55-V88 WeakPolarHBondContact OH-CG1 3.36Å; Y55-V88 WeakPolarHBondContact OH-CG2 3.49Å; Y55-K176 HydrophobicContact CD2-CB 4.14Å; Y55-K176 HydrophobicContact CD2-CG 4.09Å; Y55-K176 HydrophobicContact CE1-CD 4.44Å; Y55-K176 HydrophobicContact CE2-CB 4.34Å; Y55-K176 HydrophobicContact CE2-CD 4.11Å; Y55-K176 HydrophobicContact CE2-CG 3.77Å; Y55-R177 WeakPolarHBondContact CB-O 3.34Å
56	Q	98	Very high	95.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	144.7	172.1	-54.9	178.5	87.6	0	0	109.4	D79 R177 Y178	Q56-D79 PolarHBondContact NE2-OD1 3.1Å; Q56-R177 PolarHBondContact N-O 3.34Å; Q56-R177 PolarHBondContact O-N 2.86Å; Q56-Y178 PolarHBondContact NE2-O 3.29Å
57	L	98.5	Very high	96.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	106	173.2	-79.4	169.2	0	0	0	110.2	Y55 H65 I66 L86 I99 L141 F174 K176	Y55-L57 HydrophobicContact CD2-CD2 4.41Å; Y55-L57 HydrophobicContact CD2-CG 4.26Å; Y55-L57 HydrophobicContact CE2-CD1 4.37Å; Y55-L57 HydrophobicContact CE2-CD2 3.75Å; Y55-L57 HydrophobicContact CE2-CG 3.75Å; L57-H65 CarbonylContact O-C 3.57Å; L57-H65 VanDerWaalsContact O-CA 3.24Å; L57-H65 WeakPolarHBondContact O-CA 3.35Å; L57-I66 HydrophobicContact CB-CB 4.21Å; L57-I66 HydrophobicContact CB-CD1 3.64Å; L57-I66 HydrophobicContact CB-CG1 3.87Å; L57-I66 HydrophobicContact CD1-CD1 3.78Å; L57-I66 HydrophobicContact CG-CD1 4.35Å; L57-I66 PolarHBondContact O-N 3.34Å; L57-L86 HydrophobicContact CB-CD1 3.99Å; L57-L86 HydrophobicContact CD1-CD1 3.69Å; L57-L86 HydrophobicContact CG-CD1 3.89Å; L57-I99 HydrophobicContact CD1-CD1 4.17Å; L57-L141 HydrophobicContact CD1-CD1 3.63Å; L57-F174 HydrophobicContact CD2-CB 4.1Å; L57-K176 HydrophobicContact CD2-CG 4.14Å
58	Y	98.6	Very high	96.5	Very high	70 Å²	70	46.8 Å²	46.8	28%	0.275	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	125	174.2	173.7	-94.2	0	0	0	110.2	G63 H65 F174 M175	Y58-G63 WeakPolarHBondContact CE2-O 3.26Å; Y58-G63 WeakPolarHBondContact OH-CA 3.46Å; Y58-H65 AromaticContact CD2-NE2 3.88Å; Y58-F174 CarbonylContact O-C 3.58Å; Y58-F174 WeakPolarHBondContact O-CA 3.49Å; Y58-M175 HydrophobicContact CD1-CB 4.21Å; Y58-M175 HydrophobicContact CD1-CG 4.46Å; Y58-M175 PolarHBondContact N-O 3.41Å; Y58-M175 PolarHBondContact O-N 3.38Å
59	S	98.8	Very high	96.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.3	175.9	161.7	0	0	0	0	110.2	T61 S62 G63 K64	S59-T61 PolarHBondContact O-N 3.42Å; S59-S62 WeakPolarHBondContact CB-OG 3.43Å; S59-S62 PolarHBondContact O-N 2.96Å; S59-S62 PolarHBondContact OG-N 3.41Å; S59-S62 PolarHBondContact OG-OG 3.4Å; S59-S62 VanDerWaalsContact OG-OG 3.11Å; S59-G63 PolarHBondContact O-N 3.21Å; S59-K64 PolarHBondContact N-O 3.11Å
60	R	98.6	Very high	97.2	Very high	77 Å²	77	35.8 Å²	35.8	29%	0.291	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-40.7	178.6	-174.4	-176.6	177.2	172.7	-7.4	112.2	Y138 H173	R60-Y138 HydrophobicContact CB-CD1 4.27Å; R60-Y138 HydrophobicContact CB-CE1 3.85Å; R60-Y138 VanDerWaalsContact CD-CZ 3.5Å; R60-Y138 HydrophobicContact CG-CD1 4.45Å; R60-Y138 HydrophobicContact CG-CE1 3.71Å; R60-Y138 VanDerWaalsContact NH1-CE2 3.34Å; R60-H173 HydrophobicContact CB-CB 3.9Å; R60-H173 WeakPolarHBondContact CB-O 3.41Å; R60-H173 HydrophobicContact CG-CB 4.5Å; R60-H173 PolarHBondContact N-O 3.48Å; R60-H173 PolarHBondContact NH1-ND1 2.79Å; R60-H173 VanDerWaalsContact NH1-ND1 3.19Å
61	T	98.6	Very high	97.5	Very high	37 Å²	37	43.5 Å²	43.5	23%	0.227	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-36.9	-173.9	-60.2	0	0	0	0	114.2	S59 K155 Q170 D171	S59-T61 PolarHBondContact O-N 3.42Å; T61-K155 HydrophobicContact CG2-CB 4.23Å; T61-Q170 PolarHBondContact OG1-O 3.4Å; T61-D171 HydrophobicContact CG2-CB 4.27Å; T61-D171 WeakPolarHBondContact OG1-CA 3.33Å; T61-D171 PolarHBondContact OG1-N 2.89Å
62	S	98.6	Very high	97.9	Very high	19 Å²	19	46.3 Å²	46.3	13%	0.133	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-20.1	-179.8	64.2	0	0	0	0	113.5	S59 K64 A75	S59-S62 WeakPolarHBondContact CB-OG 3.43Å; S59-S62 PolarHBondContact O-N 2.96Å; S59-S62 PolarHBondContact OG-N 3.41Å; S59-S62 PolarHBondContact OG-OG 3.4Å; S59-S62 VanDerWaalsContact OG-OG 3.11Å; S62-K64 PolarHBondContact O-N 2.79Å; S62-K64 PolarHBondContact OG-N 2.88Å; S62-A75 PolarHBondContact OG-O 3.01Å
63	G	98.5	Very high	98.1	Very high	31 Å²	31	41.9 Å²	41.9	32%	0.32	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	17.8	-174	0	0	0	0	0	113.7	Y58 S59	Y58-G63 WeakPolarHBondContact CE2-O 3.26Å; Y58-G63 WeakPolarHBondContact OH-CA 3.46Å; S59-G63 PolarHBondContact O-N 3.21Å
64	K	98.5	Very high	98.3	Very high	67 Å²	67	37.7 Å²	37.7	29%	0.291	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	172.5	-173.3	-61.3	-69.3	168.9	169.1	0	110.7	S59 S62 E78	S59-K64 PolarHBondContact N-O 3.11Å; S62-K64 PolarHBondContact O-N 2.79Å; S62-K64 PolarHBondContact OG-N 2.88Å; K64-E78 IonicContact NZ-OE1 3.53Å; K64-E78 PolarHBondContact NZ-OE1 2.85Å; K64-E78 IonicContact NZ-OE2 2.77Å; K64-E78 PolarHBondContact NZ-OE2 2.8Å
65	H	98.6	Very high	98.4	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.028	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	148.4	-175.5	-52.7	86.2	0	0	0	112.7	L57 Y58 Q67 A75 R76 G77 D79 A84 R177	L57-H65 CarbonylContact O-C 3.57Å; L57-H65 VanDerWaalsContact O-CA 3.24Å; L57-H65 WeakPolarHBondContact O-CA 3.35Å; Y58-H65 AromaticContact CD2-NE2 3.88Å; H65-Q67 PolarHBondContact O-N 2.99Å; H65-A75 CarbonylContact O-C 3.43Å; H65-A75 VanDerWaalsContact O-CA 3.26Å; H65-A75 WeakPolarHBondContact O-CA 3.24Å; H65-R76 PolarHBondContact O-N 3.03Å; H65-R76 VanDerWaalsContact O-N 3.11Å; H65-G77 PolarHBondContact N-O 3.22Å; H65-G77 PolarHBondContact ND1-O 3.37Å; H65-G77 PolarHBondContact O-N 2.73Å; H65-D79 VanDerWaalsContact CE1-CA 3.5Å; H65-D79 WeakPolarHBondContact CE1-CA 3.4Å; H65-A84 HydrophobicContact CB-CB 3.8Å; H65-R177 PolarHBondContact CE1-NH1 3.1Å; H65-R177 VanDerWaalsContact CE1-NH1 3.25Å; H65-R177 PolarHBondContact NE2-NH1 2.93Å
66	I	98.7	Very high	98.5	Very high	0 Å²	0	41 Å²	41	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	131.8	170	-59.1	-177.3	0	0	0	109.2	L57 I73 S74 A84 L86 V151 F153 F174	L57-I66 HydrophobicContact CB-CB 4.21Å; L57-I66 HydrophobicContact CB-CD1 3.64Å; L57-I66 HydrophobicContact CB-CG1 3.87Å; L57-I66 HydrophobicContact CD1-CD1 3.78Å; L57-I66 HydrophobicContact CG-CD1 4.35Å; L57-I66 PolarHBondContact O-N 3.34Å; I66-I73 HydrophobicContact CG2-CG2 4.22Å; I66-S74 CarbonylContact C-O 3.6Å; I66-S74 VanDerWaalsContact CA-O 3.31Å; I66-S74 WeakPolarHBondContact CA-O 3.43Å; I66-A84 VanDerWaalsContact O-CA 3.24Å; I66-A84 WeakPolarHBondContact O-CA 3.43Å; I66-A84 WeakPolarHBondContact O-CB 3.32Å; I66-L86 HydrophobicContact CB-CD1 4.38Å; I66-V151 HydrophobicContact CD1-CG1 4.29Å; I66-F153 HydrophobicContact CD1-CE2 3.6Å; I66-F153 HydrophobicContact CD1-CZ 4.15Å; I66-F153 HydrophobicContact CG1-CD2 4.41Å; I66-F153 HydrophobicContact CG1-CE2 3.6Å; I66-F153 HydrophobicContact CG1-CZ 3.96Å; I66-F153 HydrophobicContact CG2-CZ 4.18Å; I66-F174 HydrophobicContact CD1-CD1 4.04Å; I66-F174 HydrophobicContact CD1-CE1 3.68Å; I66-F174 HydrophobicContact CD1-CZ 4.28Å; I66-F174 HydrophobicContact CG1-CD1 4.46Å; I66-F174 HydrophobicContact CG1-CE1 4.1Å
67	Q	98.5	Very high	98.5	Very high	19 Å²	19	41 Å²	41	9%	0.089	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.5	172.3	-63.8	163.6	-54.7	0	0	110.3	H65 L69 I73 S74 G77 D81 Y83 A84	H65-Q67 PolarHBondContact O-N 2.99Å; Q67-L69 HydrophobicContact CB-CD1 4.44Å; Q67-L69 HydrophobicContact CB-CD2 4.28Å; Q67-L69 HydrophobicContact CB-CG 4.05Å; Q67-I73 WeakPolarHBondContact O-CA 3.24Å; Q67-S74 PolarHBondContact N-O 2.92Å; Q67-S74 PolarHBondContact O-N 3.26Å; Q67-S74 PolarHBondContact OE1-OG 3.43Å; Q67-S74 VanDerWaalsContact OE1-OG 3.04Å; Q67-G77 VanDerWaalsContact CD-N 3.26Å; Q67-D81 PolarHBondContact NE2-OD2 3.46Å; Q67-Y83 VanDerWaalsContact CA-O 3.26Å; Q67-Y83 WeakPolarHBondContact CA-O 3.44Å; Q67-A84 HydrophobicContact CG-CB 4.19Å
68	V	98.7	Very high	98.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	102.5	168.5	-174.9	0	0	0	0	108.4	I73 Y83 L86 T104 F106	V68-I73 HydrophobicContact CB-CD1 4.26Å; V68-I73 HydrophobicContact CG1-CD1 3.89Å; V68-I73 HydrophobicContact CG2-CD1 4.09Å; V68-Y83 PolarHBondContact N-O 3.05Å; V68-Y83 VanDerWaalsContact N-O 3.09Å; V68-L86 HydrophobicContact CG2-CD2 3.86Å; V68-T104 WeakPolarHBondContact O-CG2 3.41Å; V68-T104 PolarHBondContact O-OG1 2.64Å; V68-F106 HydrophobicContact CG1-CB 3.68Å
69	L	98.4	Very high	98.4	Very high	48 Å²	48	44.7 Å²	44.7	25%	0.251	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	59.9	-175.7	-57.4	169.3	0	0	0	109.2	Q67 R71 R72 Y83	Q67-L69 HydrophobicContact CB-CD1 4.44Å; Q67-L69 HydrophobicContact CB-CD2 4.28Å; Q67-L69 HydrophobicContact CB-CG 4.05Å; L69-R71 PolarHBondContact O-N 3.09Å; L69-R72 WeakPolarHBondContact CA-O 3.47Å; L69-R72 HydrophobicContact CB-CB 4.37Å; L69-R72 WeakPolarHBondContact CB-O 3.46Å; L69-R72 PolarHBondContact N-O 3.43Å; L69-R72 PolarHBondContact O-N 3.5Å; L69-Y83 HydrophobicContact CD2-CD1 3.9Å; L69-Y83 HydrophobicContact CD2-CD2 3.78Å; L69-Y83 HydrophobicContact CD2-CE2 4.4Å; L69-Y83 HydrophobicContact CD2-CG 3.48Å; L69-Y83 VanDerWaalsContact CD2-CG 3.48Å
70	G	98.2	Very high	98.1	Very high	13 Å²	13	46 Å²	46	13%	0.134	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	-119.7	-169.7	0	0	0	0	0	110.3	R72 F106 G118	G70-R72 VanDerWaalsContact C-N 3.27Å; G70-R72 PolarHBondContact O-N 2.86Å; G70-F106 WeakPolarHBondContact O-CD1 3.43Å; G70-G118 WeakPolarHBondContact O-CA 3.32Å
71	R	98.1	Very high	98	Very high	204 Å²	204	44.3 Å²	44.3	77%	0.77	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.6	179.1	-65.5	-177.6	178.4	178.1	-0.5	114	L69 F106 G118	L69-R71 PolarHBondContact O-N 3.09Å; R71-F106 HydrophobicContact CG-CD1 4.47Å; R71-F106 HydrophobicContact CG-CE1 3.84Å; R71-G118 PolarHBondContact O-N 3.39Å
72	R	98.5	Very high	97.9	Very high	150 Å²	150	47.1 Å²	47.1	57%	0.566	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.8	-176	-166.1	-179.9	91.7	-175.3	2.5	111.1	L69 G70	L69-R72 WeakPolarHBondContact CA-O 3.47Å; L69-R72 HydrophobicContact CB-CB 4.37Å; L69-R72 WeakPolarHBondContact CB-O 3.46Å; L69-R72 PolarHBondContact N-O 3.43Å; L69-R72 PolarHBondContact O-N 3.5Å; G70-R72 VanDerWaalsContact C-N 3.27Å; G70-R72 PolarHBondContact O-N 2.86Å
73	I	98.7	Very high	97.9	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.4	175.5	-49	-59.3	0	0	0	108.8	I66 Q67 V68 L108 L116 F153 P159	I66-I73 HydrophobicContact CG2-CG2 4.22Å; Q67-I73 WeakPolarHBondContact O-CA 3.24Å; V68-I73 HydrophobicContact CB-CD1 4.26Å; V68-I73 HydrophobicContact CG1-CD1 3.89Å; V68-I73 HydrophobicContact CG2-CD1 4.09Å; I73-L108 HydrophobicContact CB-CD1 4.33Å; I73-L108 HydrophobicContact CD1-CD1 3.84Å; I73-L108 HydrophobicContact CG1-CD1 3.69Å; I73-L108 HydrophobicContact CG2-CD1 3.78Å; I73-L116 HydrophobicContact CB-CB 4.27Å; I73-L116 HydrophobicContact CG1-CB 4.28Å; I73-L116 HydrophobicContact CG2-CB 4.46Å; I73-F153 HydrophobicContact CG2-CE1 4.02Å; I73-F153 HydrophobicContact CG2-CZ 3.83Å; I73-P159 WeakPolarHBondContact O-CG 3.5Å
74	S	98.6	Very high	97.8	Very high	4 Å²	4	48.4 Å²	48.4	3%	0.028	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.5	173	44.5	0	0	0	0	111	I66 Q67	I66-S74 CarbonylContact C-O 3.6Å; I66-S74 VanDerWaalsContact CA-O 3.31Å; I66-S74 WeakPolarHBondContact CA-O 3.43Å; Q67-S74 PolarHBondContact N-O 2.92Å; Q67-S74 PolarHBondContact O-N 3.26Å; Q67-S74 PolarHBondContact OE1-OG 3.43Å; Q67-S74 VanDerWaalsContact OE1-OG 3.04Å
75	A	98.8	Very high	97.8	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	71.3	167.7	0	0	0	0	0	109.2	S62 H65 F153 G157	S62-A75 PolarHBondContact OG-O 3.01Å; H65-A75 CarbonylContact O-C 3.43Å; H65-A75 VanDerWaalsContact O-CA 3.26Å; H65-A75 WeakPolarHBondContact O-CA 3.24Å; A75-F153 HydrophobicContact CB-CB 3.75Å; A75-F153 HydrophobicContact CB-CD1 3.48Å; A75-F153 VanDerWaalsContact CB-CD1 3.48Å; A75-F153 HydrophobicContact CB-CD2 3.72Å; A75-F153 HydrophobicContact CB-CE1 3.93Å; A75-F153 HydrophobicContact CB-CE2 4.16Å; A75-F153 HydrophobicContact CB-CG 3.36Å; A75-F153 HydrophobicContact CB-CZ 4.24Å; A75-G157 PolarHBondContact N-O 3.19Å; A75-G157 WeakPolarHBondContact O-CA 3.45Å
76	R	98.7	Very high	97.8	Very high	110 Å²	110	46.6 Å²	46.6	42%	0.415	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	3.5	-176	-64	-178.8	-179.2	165.3	-0.9	112.7	H65 E78 K156	H65-R76 PolarHBondContact O-N 3.03Å; H65-R76 VanDerWaalsContact O-N 3.11Å; R76-E78 PolarHBondContact O-N 2.53Å; R76-K156 PolarHBondContact NE-O 2.76Å; R76-K156 PolarHBondContact NH2-O 2.85Å; R76-K156 VanDerWaalsContact NH2-O 3.15Å
77	G	97.8	Very high	97.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.9	-178.4	0	0	0	0	0	110.8	H65 Q67	H65-G77 PolarHBondContact N-O 3.22Å; H65-G77 PolarHBondContact ND1-O 3.37Å; H65-G77 PolarHBondContact O-N 2.73Å; Q67-G77 VanDerWaalsContact CD-N 3.26Å
78	E	97.3	Very high	97.7	Very high	110 Å²	110	47.6 Å²	47.6	51%	0.514	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-66.8	160.2	165.8	-62.8	-55.2	152.4	0	0	110.3	K64 R76 G80 D81	K64-E78 IonicContact NZ-OE1 3.53Å; K64-E78 PolarHBondContact NZ-OE1 2.85Å; K64-E78 IonicContact NZ-OE2 2.77Å; K64-E78 PolarHBondContact NZ-OE2 2.8Å; R76-E78 PolarHBondContact O-N 2.53Å; E78-G80 PolarHBondContact O-N 3.3Å; E78-D81 VanDerWaalsContact O-CB 3.28Å; E78-D81 WeakPolarHBondContact O-CB 3.34Å; E78-D81 PolarHBondContact O-N 2.6Å; E78-D81 VanDerWaalsContact O-N 3.1Å
79	D	96.3	Very high	97.5	Very high	37 Å²	37	49.9 Å²	49.9	20%	0.198	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	117.5	177.8	-167.7	3.6	0	0	0	111.2	Q56 H65 R177 K180	Q56-D79 PolarHBondContact NE2-OD1 3.1Å; H65-D79 VanDerWaalsContact CE1-CA 3.5Å; H65-D79 WeakPolarHBondContact CE1-CA 3.4Å; D79-R177 IonicContact OD1-NH1 2.76Å; D79-R177 IonicContact OD2-CZ 3.55Å; D79-R177 VanDerWaalsContact OD2-CZ 3.25Å; D79-R177 IonicContact OD2-NH1 2.72Å; D79-R177 PolarHBondContact OD2-NH1 3.37Å; D79-R177 IonicContact OD2-NH2 3.27Å; D79-R177 PolarHBondContact OD2-NH2 2.63Å; D79-K180 WeakPolarHBondContact OD2-CE 3.35Å; D79-K180 IonicContact OD2-NZ 3.13Å
80	G	93.9	Very high	97.4	Very high	28 Å²	28	49.3 Å²	49.3	29%	0.289	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.5	0.1	-176.7	0	0	0	0	0	114.5	E78 K82	E78-G80 PolarHBondContact O-N 3.3Å; G80-K82 PolarHBondContact O-N 2.92Å
81	D	96	Very high	97.3	Very high	42 Å²	42	49.1 Å²	49.1	23%	0.225	22%	0.22	C	C	.	.			trans	-54.7	130	173.8	-177.7	-20	0	0	0	110.7	Q67 E78 Y83 A84 Q85	Q67-D81 PolarHBondContact NE2-OD2 3.46Å; E78-D81 VanDerWaalsContact O-CB 3.28Å; E78-D81 WeakPolarHBondContact O-CB 3.34Å; E78-D81 PolarHBondContact O-N 2.6Å; E78-D81 VanDerWaalsContact O-N 3.1Å; D81-Y83 PolarHBondContact O-N 2.87Å; D81-Y83 PolarHBondContact OD1-N 2.97Å; D81-A84 HydrophobicContact CB-CB 3.99Å; D81-A84 WeakPolarHBondContact O-CA 3.4Å; D81-A84 WeakPolarHBondContact O-CB 3.18Å; D81-A84 PolarHBondContact O-N 2.8Å; D81-Q85 PolarHBondContact O-N 3.25Å
82	K	96.6	Very high	97.2	Very high	95 Å²	95	39.7 Å²	39.7	41%	0.413	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-55.6	-35.2	-179.8	66	-179.5	-165.1	150.6	0	112.9	G80 A84 Q85 E103	G80-K82 PolarHBondContact O-N 2.92Å; K82-A84 VanDerWaalsContact C-N 3.28Å; K82-A84 PolarHBondContact O-N 2.81Å; K82-Q85 PolarHBondContact O-N 2.76Å; K82-E103 HydrophobicContact CB-CG 4.46Å; K82-E103 HydrophobicContact CD-CG 4.19Å; K82-E103 WeakPolarHBondContact CD-OE1 3.14Å; K82-E103 WeakPolarHBondContact CE-OE1 3.23Å; K82-E103 HydrophobicContact CG-CG 4.15Å; K82-E103 IonicContact NZ-OE1 2.76Å; K82-E103 PolarHBondContact NZ-OE1 2.88Å; K82-E103 WeakPolarHBondContact O-CB 3.44Å
83	Y	98.1	Very high	97	Very high	78 Å²	78	36.6 Å²	36.6	31%	0.306	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-78.8	-11.2	178	-61.2	-68.2	0	0	0	113.6	Q67 V68 L69 D81 E103 T104	Q67-Y83 VanDerWaalsContact CA-O 3.26Å; Q67-Y83 WeakPolarHBondContact CA-O 3.44Å; V68-Y83 PolarHBondContact N-O 3.05Å; V68-Y83 VanDerWaalsContact N-O 3.09Å; L69-Y83 HydrophobicContact CD2-CD1 3.9Å; L69-Y83 HydrophobicContact CD2-CD2 3.78Å; L69-Y83 HydrophobicContact CD2-CE2 4.4Å; L69-Y83 HydrophobicContact CD2-CG 3.48Å; L69-Y83 VanDerWaalsContact CD2-CG 3.48Å; D81-Y83 PolarHBondContact O-N 2.87Å; D81-Y83 PolarHBondContact OD1-N 2.97Å; Y83-E103 HydrophobicContact CD1-CB 3.97Å; Y83-E103 HydrophobicContact CD1-CG 3.65Å; Y83-E103 HydrophobicContact CE1-CB 4.3Å; Y83-E103 HydrophobicContact CE1-CG 3.49Å; Y83-E103 VanDerWaalsContact CE1-CG 3.49Å; Y83-T104 HydrophobicContact CD1-CG2 3.8Å; Y83-T104 HydrophobicContact CE1-CG2 3.89Å
84	A	97.9	Very high	96.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-95.1	-2.4	176.6	0	0	0	0	0	113.8	H65 I66 Q67 D81 K82 L86	H65-A84 HydrophobicContact CB-CB 3.8Å; I66-A84 VanDerWaalsContact O-CA 3.24Å; I66-A84 WeakPolarHBondContact O-CA 3.43Å; I66-A84 WeakPolarHBondContact O-CB 3.32Å; Q67-A84 HydrophobicContact CG-CB 4.19Å; D81-A84 HydrophobicContact CB-CB 3.99Å; D81-A84 WeakPolarHBondContact O-CA 3.4Å; D81-A84 WeakPolarHBondContact O-CB 3.18Å; D81-A84 PolarHBondContact O-N 2.8Å; K82-A84 VanDerWaalsContact C-N 3.28Å; K82-A84 PolarHBondContact O-N 2.81Å; A84-L86 PolarHBondContact O-N 2.8Å
85	Q	97.1	Very high	96.6	Very high	35 Å²	35	41.8 Å²	41.8	16%	0.164	22%	0.221	C	C	.	.			trans	-78.2	119.1	173.1	-62.5	-174	22.5	0	0	109.9	L54 D81 K82 K102	L54-Q85 HydrophobicContact CD1-CB 4.23Å; D81-Q85 PolarHBondContact O-N 3.25Å; K82-Q85 PolarHBondContact O-N 2.76Å; Q85-K102 HydrophobicContact CB-CB 4.02Å; Q85-K102 HydrophobicContact CB-CD 4.05Å; Q85-K102 WeakPolarHBondContact O-CB 3.47Å; Q85-K102 PolarHBondContact O-N 3.04Å; Q85-K102 VanDerWaalsContact OE1-CD 3.31Å
86	L	98.3	Very high	96.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.4	-175.7	-53.6	175	0	0	0	110.8	L54 Y55 L57 I66 V68 A84 V88 I99 K100	L54-L86 WeakPolarHBondContact CA-O 3.45Å; L54-L86 WeakPolarHBondContact CD1-O 3.26Å; Y55-L86 PolarHBondContact N-O 3.44Å; Y55-L86 VanDerWaalsContact N-O 3.1Å; Y55-L86 WeakPolarHBondContact O-CA 3.46Å; Y55-L86 WeakPolarHBondContact O-CB 3Å; Y55-L86 PolarHBondContact O-N 2.77Å; L57-L86 HydrophobicContact CB-CD1 3.99Å; L57-L86 HydrophobicContact CD1-CD1 3.69Å; L57-L86 HydrophobicContact CG-CD1 3.89Å; I66-L86 HydrophobicContact CB-CD1 4.38Å; V68-L86 HydrophobicContact CG2-CD2 3.86Å; A84-L86 PolarHBondContact O-N 2.8Å; L86-V88 HydrophobicContact CB-CG2 4.25Å; L86-I99 HydrophobicContact CB-CG2 4.1Å; L86-I99 HydrophobicContact CD1-CG2 3.89Å; L86-I99 HydrophobicContact CD2-CG2 4.16Å; L86-I99 HydrophobicContact CG-CG2 4.27Å; L86-K100 CarbonylContact C-O 3.51Å; L86-K100 WeakPolarHBondContact CA-O 3.36Å
87	L	97.2	Very high	96.6	Very high	38 Å²	38	37.3 Å²	37.3	20%	0.199	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.3	166.6	-69.4	174.8	0	0	0	108.1	L52 L54 K100 K102	L52-L87 HydrophobicContact CD1-CB 4.14Å; L52-L87 HydrophobicContact CD1-CD2 4.44Å; L52-L87 HydrophobicContact CD2-CD2 4.22Å; L52-L87 HydrophobicContact CG-CD2 4.38Å; L54-L87 HydrophobicContact CB-CD2 4.3Å; L54-L87 HydrophobicContact CD1-CD2 3.97Å; L87-K100 HydrophobicContact CB-CB 4.28Å; L87-K100 PolarHBondContact N-O 3.45Å; L87-K100 PolarHBondContact O-N 3.11Å; L87-K102 HydrophobicContact CD1-CB 4.28Å; L87-K102 HydrophobicContact CD1-CG 4.21Å; L87-K102 HydrophobicContact CG-CB 4.06Å; L87-K102 HydrophobicContact CG-CG 4.26Å
88	V	97.8	Very high	96.6	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	114.7	-178.6	-174.9	0	0	0	0	109.6	L52 R53 Y55 L86 V97 R98 I99	L52-V88 CarbonylContact C-O 3.47Å; L52-V88 WeakPolarHBondContact CA-O 3.16Å; R53-V88 PolarHBondContact N-O 2.8Å; R53-V88 PolarHBondContact O-N 3.34Å; Y55-V88 HydrophobicContact CD1-CG2 4.39Å; Y55-V88 HydrophobicContact CE1-CB 3.69Å; Y55-V88 HydrophobicContact CE1-CG1 4.31Å; Y55-V88 HydrophobicContact CE1-CG2 3.6Å; Y55-V88 HydrophobicContact CE2-CG2 3.99Å; Y55-V88 WeakPolarHBondContact OH-CG1 3.36Å; Y55-V88 WeakPolarHBondContact OH-CG2 3.49Å; L86-V88 HydrophobicContact CB-CG2 4.25Å; V88-V97 HydrophobicContact CG1-CB 3.67Å; V88-V97 HydrophobicContact CG1-CG1 3.95Å; V88-V97 HydrophobicContact CG1-CG2 3.95Å; V88-R98 WeakPolarHBondContact CA-O 3.22Å; V88-I99 HydrophobicContact CG1-CG1 4.19Å; V88-I99 HydrophobicContact CG2-CB 4.48Å; V88-I99 HydrophobicContact CG2-CG1 4.04Å; V88-I99 HydrophobicContact CG2-CG2 4.26Å
89	E	96.1	Very high	96.6	Very high	47 Å²	47	32.5 Å²	32.5	22%	0.22	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.1	-175.4	-176.7	-176.5	-166.8	0	0	109.9	K50 Q51 L52 D91 V97 R98	K50-E89 HydrophobicContact CB-CG 3.62Å; K50-E89 WeakPolarHBondContact CB-OE1 3.33Å; K50-E89 HydrophobicContact CG-CG 4.24Å; K50-E89 WeakPolarHBondContact CG-OE1 3.31Å; Q51-E89 WeakPolarHBondContact O-CA 3.35Å; L52-E89 HydrophobicContact CD1-CB 4.09Å; E89-D91 PolarHBondContact O-N 2.89Å; E89-V97 CarbonylContact O-C 3.52Å; E89-V97 WeakPolarHBondContact O-CA 3.37Å; E89-R98 PolarHBondContact N-O 2.99Å; E89-R98 PolarHBondContact O-N 2.89Å
90	T	96.4	Very high	96.7	Very high	37 Å²	37	32.7 Å²	32.7	23%	0.227	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	126.4	173.5	-61.5	0	0	0	0	111.1	K50 Q51 T92	K50-T90 WeakPolarHBondContact CD-O 3.44Å; Q51-T90 PolarHBondContact O-N 2.88Å; T90-T92 VanDerWaalsContact CG2-O 3.29Å; T90-T92 WeakPolarHBondContact CG2-O 3.05Å
91	D	96.3	Very high	97	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.043	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	-49.1	173.9	-177.8	38.6	0	0	0	111.8	R44 D45 K50 E89 Q96 R98 V128	R44-D91 WeakPolarHBondContact CB-OD1 3.43Å; R44-D91 VanDerWaalsContact CG-OD1 3.23Å; R44-D91 WeakPolarHBondContact CG-OD1 3.13Å; D45-D91 PolarHBondContact N-O 2.89Å; K50-D91 PolarHBondContact NZ-O 3.3Å; E89-D91 PolarHBondContact O-N 2.89Å; D91-Q96 HydrophobicContact CB-CB 4.12Å; D91-Q96 PolarHBondContact N-O 2.86Å; D91-R98 VanDerWaalsContact CG-NH2 3.33Å; D91-R98 IonicContact OD1-CZ 3.93Å; D91-R98 IonicContact OD1-NH1 2.81Å; D91-R98 PolarHBondContact OD1-NH1 3.22Å; D91-R98 IonicContact OD1-NH2 3.04Å; D91-R98 PolarHBondContact OD1-NH2 3.38Å; D91-R98 IonicContact OD2-NH2 3.53Å; D91-V128 HydrophobicContact CB-CG1 4.17Å
92	T	95.4	Very high	97	Very high	6 Å²	6	33.1 Å²	33.1	4%	0.037	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	-169.2	178.7	-173.8	0	0	0	0	108.3	Q40 A43 T90 Q96	Q40-T92 PolarHBondContact O-OG1 2.76Å; A43-T92 WeakPolarHBondContact O-CB 3.31Å; A43-T92 WeakPolarHBondContact O-CG2 3.36Å; A43-T92 PolarHBondContact O-OG1 3.45Å; T90-T92 VanDerWaalsContact CG2-O 3.29Å; T90-T92 WeakPolarHBondContact CG2-O 3.05Å; T92-Q96 HydrophobicContact CG2-CB 4.03Å; T92-Q96 HydrophobicContact CG2-CG 4.39Å
93	F	94.2	Very high	97.1	Very high	85 Å²	85	33 Å²	33	37%	0.373	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	171.3	173.5	-60.7	-73	0	0	0	113.3	V37 Q40 T41 Q96	V37-F93 HydrophobicContact CG1-CB 3.85Å; V37-F93 HydrophobicContact CG1-CD1 4.45Å; V37-F93 HydrophobicContact CG1-CD2 4.27Å; V37-F93 HydrophobicContact CG1-CG 3.96Å; Q40-F93 HydrophobicContact CB-CD2 3.78Å; Q40-F93 HydrophobicContact CB-CE2 3.84Å; Q40-F93 HydrophobicContact CG-CE2 4.38Å; T41-F93 WeakPolarHBondContact OG1-CB 3.38Å; F93-Q96 PolarHBondContact O-NE2 2.81Å
94	G	93.8	Very high	97.1	Very high	49 Å²	49	30.9 Å²	30.9	51%	0.505	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	28.3	-178.8	0	0	0	0	0	113.7	Q96	G94-Q96 PolarHBondContact O-N 2.88Å; G94-Q96 VanDerWaalsContact O-N 3.16Å
95	S	95.3	Very high	97.1	Very high	70 Å²	70	34.9 Å²	34.9	49%	0.49	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	32.6	-179.8	-57.5	0	0	0	0	113.6	E131	S95-E131 VanDerWaalsContact CB-O 3.25Å; S95-E131 WeakPolarHBondContact CB-O 3.19Å; S95-E131 PolarHBondContact O-N 3.01Å
96	Q	97.8	Very high	97.2	Very high	14 Å²	14	35.5 Å²	35.5	7%	0.065	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	125.1	172.5	-73.7	-175.3	85	0	0	109.8	T41 D91 T92 F93 G94 V128 F129 I130	T41-Q96 VanDerWaalsContact CG2-NE2 3.29Å; T41-Q96 PolarHBondContact O-NE2 2.9Å; D91-Q96 HydrophobicContact CB-CB 4.12Å; D91-Q96 PolarHBondContact N-O 2.86Å; T92-Q96 HydrophobicContact CG2-CB 4.03Å; T92-Q96 HydrophobicContact CG2-CG 4.39Å; F93-Q96 PolarHBondContact O-NE2 2.81Å; G94-Q96 PolarHBondContact O-N 2.88Å; G94-Q96 VanDerWaalsContact O-N 3.16Å; Q96-V128 HydrophobicContact CB-CG1 3.93Å; Q96-V128 HydrophobicContact CG-CG1 4.32Å; Q96-F129 CarbonylContact C-O 3.55Å; Q96-F129 WeakPolarHBondContact CA-O 3.48Å; Q96-I130 HydrophobicContact CG-CG1 3.76Å
97	V	98.1	Very high	97.2	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	151.4	-173.4	-62.8	0	0	0	0	112.2	V88 E89 I99 V128 F129	V88-V97 HydrophobicContact CG1-CB 3.67Å; V88-V97 HydrophobicContact CG1-CG1 3.95Å; V88-V97 HydrophobicContact CG1-CG2 3.95Å; E89-V97 CarbonylContact O-C 3.52Å; E89-V97 WeakPolarHBondContact O-CA 3.37Å; V97-I99 HydrophobicContact CG2-CG1 4.37Å; V97-V128 WeakPolarHBondContact O-CA 3.25Å; V97-F129 WeakPolarHBondContact CG2-O 3.35Å; V97-F129 PolarHBondContact N-O 3.38Å; V97-F129 PolarHBondContact O-N 3.12Å
98	R	98.3	Very high	97.3	Very high	9 Å²	9	35.5 Å²	35.5	3%	0.034	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138.3	163.2	-67.7	-172.3	-178.2	69.3	13	109.3	V88 E89 D91 Y107 G122 V128	V88-R98 WeakPolarHBondContact CA-O 3.22Å; E89-R98 PolarHBondContact N-O 2.99Å; E89-R98 PolarHBondContact O-N 2.89Å; D91-R98 VanDerWaalsContact CG-NH2 3.33Å; D91-R98 IonicContact OD1-CZ 3.93Å; D91-R98 IonicContact OD1-NH1 2.81Å; D91-R98 PolarHBondContact OD1-NH1 3.22Å; D91-R98 IonicContact OD1-NH2 3.04Å; D91-R98 PolarHBondContact OD1-NH2 3.38Å; D91-R98 IonicContact OD2-NH2 3.53Å; R98-Y107 HydrophobicContact CB-CD1 4.09Å; R98-Y107 HydrophobicContact CB-CE1 4.16Å; R98-G122 VanDerWaalsContact CD-O 3.26Å; R98-G122 WeakPolarHBondContact CD-O 3.21Å; R98-G122 PolarHBondContact NE-O 2.85Å; R98-V128 HydrophobicContact CG-CG2 4.16Å
99	I	98.7	Very high	97.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.9	-178	-60	169.7	0	0	0	107.9	L57 L86 V88 V97 Y107 L108 F129 L141	L57-I99 HydrophobicContact CD1-CD1 4.17Å; L86-I99 HydrophobicContact CB-CG2 4.1Å; L86-I99 HydrophobicContact CD1-CG2 3.89Å; L86-I99 HydrophobicContact CD2-CG2 4.16Å; L86-I99 HydrophobicContact CG-CG2 4.27Å; V88-I99 HydrophobicContact CG1-CG1 4.19Å; V88-I99 HydrophobicContact CG2-CB 4.48Å; V88-I99 HydrophobicContact CG2-CG1 4.04Å; V88-I99 HydrophobicContact CG2-CG2 4.26Å; V97-I99 HydrophobicContact CG2-CG1 4.37Å; I99-Y107 CarbonylContact O-C 3.55Å; I99-Y107 WeakPolarHBondContact O-CA 3.38Å; I99-L108 HydrophobicContact CB-CB 4.19Å; I99-L108 HydrophobicContact CB-CD2 4.49Å; I99-L108 HydrophobicContact CD1-CD2 4.25Å; I99-L108 HydrophobicContact CG2-CB 4.34Å; I99-L108 HydrophobicContact CG2-CD2 4.43Å; I99-L108 PolarHBondContact O-N 2.97Å; I99-F129 HydrophobicContact CD1-CD2 4.2Å; I99-L141 HydrophobicContact CD1-CD1 3.67Å; I99-L141 HydrophobicContact CD1-CD2 4.21Å
100	K	98.6	Very high	97.5	Very high	41 Å²	41	33.1 Å²	33.1	18%	0.178	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.4	-179.5	-167.7	-175.1	-163.2	-176	0	110.2	L86 L87 K102 E105 F106 Y107	L86-K100 CarbonylContact C-O 3.51Å; L86-K100 WeakPolarHBondContact CA-O 3.36Å; L87-K100 HydrophobicContact CB-CB 4.28Å; L87-K100 PolarHBondContact N-O 3.45Å; L87-K100 PolarHBondContact O-N 3.11Å; K100-K102 PolarHBondContact O-N 3.11Å; K100-E105 VanDerWaalsContact CE-CD 3.5Å; K100-E105 WeakPolarHBondContact CE-O 3.49Å; K100-E105 VanDerWaalsContact CE-OE2 3.23Å; K100-E105 WeakPolarHBondContact CE-OE2 3.21Å; K100-E105 IonicContact NZ-OE1 2.87Å; K100-E105 IonicContact NZ-OE2 3.25Å; K100-E105 PolarHBondContact NZ-OE2 2.72Å; K100-F106 CarbonylContact C-O 3.55Å; K100-F106 WeakPolarHBondContact CA-O 3.48Å; K100-Y107 HydrophobicContact CB-CD1 3.97Å; K100-Y107 HydrophobicContact CB-CE1 3.92Å; K100-Y107 HydrophobicContact CB-CG 4.49Å; K100-Y107 HydrophobicContact CD-CE1 4.11Å; K100-Y107 HydrophobicContact CD-CE2 4.03Å; K100-Y107 HydrophobicContact CG-CD1 4.28Å; K100-Y107 HydrophobicContact CG-CD2 4.38Å; K100-Y107 HydrophobicContact CG-CE1 4.15Å; K100-Y107 HydrophobicContact CG-CE2 4.24Å; K100-Y107 HydrophobicContact CG-CG 4.4Å
101	G	98.4	Very high	97.6	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	117.4	170.4	0	0	0	0	0	109.9	E103 T104 E105 F106	G101-E103 VanDerWaalsContact C-N 3.27Å; G101-E103 PolarHBondContact O-N 3.19Å; G101-T104 PolarHBondContact O-N 3.37Å; G101-E105 VanDerWaalsContact O-CA 3.32Å; G101-E105 WeakPolarHBondContact O-CA 3.35Å; G101-E105 PolarHBondContact O-N 3.21Å; G101-F106 PolarHBondContact N-O 3.29Å
102	K	97.4	Very high	97.7	Very high	79 Å²	79	41.8 Å²	41.8	34%	0.343	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-38.8	-176.2	-177.9	-174.1	166.1	-168.8	0	113.1	L54 Q85 L87 K100	L54-K102 HydrophobicContact CD1-CD 3.94Å; L54-K102 HydrophobicContact CD2-CD 4.4Å; Q85-K102 HydrophobicContact CB-CB 4.02Å; Q85-K102 HydrophobicContact CB-CD 4.05Å; Q85-K102 WeakPolarHBondContact O-CB 3.47Å; Q85-K102 PolarHBondContact O-N 3.04Å; Q85-K102 VanDerWaalsContact OE1-CD 3.31Å; L87-K102 HydrophobicContact CD1-CB 4.28Å; L87-K102 HydrophobicContact CD1-CG 4.21Å; L87-K102 HydrophobicContact CG-CB 4.06Å; L87-K102 HydrophobicContact CG-CG 4.26Å; K100-K102 PolarHBondContact O-N 3.11Å
103	E	97.8	Very high	97.8	Very high	91 Å²	91	48.1 Å²	48.1	43%	0.425	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-36.2	-176.9	-178.2	69.8	-179.9	0	0	112.5	K82 Y83 G101	K82-E103 HydrophobicContact CB-CG 4.46Å; K82-E103 HydrophobicContact CD-CG 4.19Å; K82-E103 WeakPolarHBondContact CD-OE1 3.14Å; K82-E103 WeakPolarHBondContact CE-OE1 3.23Å; K82-E103 HydrophobicContact CG-CG 4.15Å; K82-E103 IonicContact NZ-OE1 2.76Å; K82-E103 PolarHBondContact NZ-OE1 2.88Å; K82-E103 WeakPolarHBondContact O-CB 3.44Å; Y83-E103 HydrophobicContact CD1-CB 3.97Å; Y83-E103 HydrophobicContact CD1-CG 3.65Å; Y83-E103 HydrophobicContact CE1-CB 4.3Å; Y83-E103 HydrophobicContact CE1-CG 3.49Å; Y83-E103 VanDerWaalsContact CE1-CG 3.49Å; G101-E103 VanDerWaalsContact C-N 3.27Å; G101-E103 PolarHBondContact O-N 3.19Å
104	T	98.1	Very high	98	Very high	34 Å²	34	44.1 Å²	44.1	21%	0.209	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-19	-173.1	56.6	0	0	0	0	113.3	V68 Y83 G101 F106	V68-T104 WeakPolarHBondContact O-CG2 3.41Å; V68-T104 PolarHBondContact O-OG1 2.64Å; Y83-T104 HydrophobicContact CD1-CG2 3.8Å; Y83-T104 HydrophobicContact CE1-CG2 3.89Å; G101-T104 PolarHBondContact O-N 3.37Å; T104-F106 VanDerWaalsContact O-CD2 3.22Å; T104-F106 WeakPolarHBondContact O-CD2 3.42Å; T104-F106 PolarHBondContact O-N 3.21Å
105	E	98.4	Very high	98.2	Very high	85 Å²	85	47.6 Å²	47.6	40%	0.397	22%	0.218	S	C	.	.			trans	64.1	13.2	-171.9	-60.8	-68.8	87.5	0	0	114.7	K100 G101	K100-E105 VanDerWaalsContact CE-CD 3.5Å; K100-E105 WeakPolarHBondContact CE-O 3.49Å; K100-E105 VanDerWaalsContact CE-OE2 3.23Å; K100-E105 WeakPolarHBondContact CE-OE2 3.21Å; K100-E105 IonicContact NZ-OE1 2.87Å; K100-E105 IonicContact NZ-OE2 3.25Å; K100-E105 PolarHBondContact NZ-OE2 2.72Å; G101-E105 VanDerWaalsContact O-CA 3.32Å; G101-E105 WeakPolarHBondContact O-CA 3.35Å; G101-E105 PolarHBondContact O-N 3.21Å
106	F	98.7	Very high	98.4	Very high	47 Å²	47	44.5 Å²	44.5	21%	0.206	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-85.5	138.2	175.1	-79.4	-122.6	0	0	0	110.4	V68 G70 R71 K100 G101 T104 K119	V68-F106 HydrophobicContact CG1-CB 3.68Å; G70-F106 WeakPolarHBondContact O-CD1 3.43Å; R71-F106 HydrophobicContact CG-CD1 4.47Å; R71-F106 HydrophobicContact CG-CE1 3.84Å; K100-F106 CarbonylContact C-O 3.55Å; K100-F106 WeakPolarHBondContact CA-O 3.48Å; G101-F106 PolarHBondContact N-O 3.29Å; T104-F106 VanDerWaalsContact O-CD2 3.22Å; T104-F106 WeakPolarHBondContact O-CD2 3.42Å; T104-F106 PolarHBondContact O-N 3.21Å; F106-K119 CarbonylContact C-O 3.53Å; F106-K119 WeakPolarHBondContact CA-O 3.38Å
107	Y	98.8	Very high	98.4	Very high	38 Å²	38	44.9 Å²	44.9	15%	0.149	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	134.2	170.9	-67.7	-92.7	0	0	0	110.5	R98 I99 K100 C109 G118 K119 P120 G122	R98-Y107 HydrophobicContact CB-CD1 4.09Å; R98-Y107 HydrophobicContact CB-CE1 4.16Å; I99-Y107 CarbonylContact O-C 3.55Å; I99-Y107 WeakPolarHBondContact O-CA 3.38Å; K100-Y107 HydrophobicContact CB-CD1 3.97Å; K100-Y107 HydrophobicContact CB-CE1 3.92Å; K100-Y107 HydrophobicContact CB-CG 4.49Å; K100-Y107 HydrophobicContact CD-CE1 4.11Å; K100-Y107 HydrophobicContact CD-CE2 4.03Å; K100-Y107 HydrophobicContact CG-CD1 4.28Å; K100-Y107 HydrophobicContact CG-CD2 4.38Å; K100-Y107 HydrophobicContact CG-CE1 4.15Å; K100-Y107 HydrophobicContact CG-CE2 4.24Å; K100-Y107 HydrophobicContact CG-CG 4.4Å; Y107-C109 PolarHBondContact O-N 2.95Å; Y107-C109 PolarHBondContact O-SG 3.13Å; Y107-C109 VanDerWaalsContact O-SG 3.38Å; Y107-G118 CarbonylContact O-C 3.49Å; Y107-G118 VanDerWaalsContact O-CA 3.25Å; Y107-G118 WeakPolarHBondContact O-CA 3.45Å; Y107-K119 PolarHBondContact N-O 2.92Å; Y107-K119 PolarHBondContact O-N 3.16Å; Y107-P120 WeakPolarHBondContact CD2-O 3.33Å; Y107-G122 VanDerWaalsContact CD2-CA 3.49Å; Y107-G122 VanDerWaalsContact CG-CA 3.49Å
108	L	98.8	Very high	98.5	Very high	0 Å²	0	45 Å²	45	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	125.5	164.6	176.7	61.6	0	0	0	108.4	I73 I99 L116 F129 V151	I73-L108 HydrophobicContact CB-CD1 4.33Å; I73-L108 HydrophobicContact CD1-CD1 3.84Å; I73-L108 HydrophobicContact CG1-CD1 3.69Å; I73-L108 HydrophobicContact CG2-CD1 3.78Å; I99-L108 HydrophobicContact CB-CB 4.19Å; I99-L108 HydrophobicContact CB-CD2 4.49Å; I99-L108 HydrophobicContact CD1-CD2 4.25Å; I99-L108 HydrophobicContact CG2-CB 4.34Å; I99-L108 HydrophobicContact CG2-CD2 4.43Å; I99-L108 PolarHBondContact O-N 2.97Å; L108-L116 HydrophobicContact CD1-CB 4.22Å; L108-L116 HydrophobicContact CD1-CD2 4.32Å; L108-F129 HydrophobicContact CB-CE2 4.32Å; L108-F129 HydrophobicContact CD2-CE2 4.11Å; L108-F129 HydrophobicContact CD2-CZ 4.3Å; L108-F129 HydrophobicContact CG-CE2 3.84Å; L108-F129 HydrophobicContact CG-CZ 3.95Å; L108-F129 WeakPolarHBondContact O-CE2 3.47Å; L108-V151 HydrophobicContact CD2-CG2 4.42Å
109	C	98.8	Very high	98.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.7	177.7	-45.4	0	0	0	0	110.6	Y107 L116 V117 K119 E126 C127	Y107-C109 PolarHBondContact O-N 2.95Å; Y107-C109 PolarHBondContact O-SG 3.13Å; Y107-C109 VanDerWaalsContact O-SG 3.38Å; C109-L116 WeakPolarHBondContact O-CA 3.37Å; C109-V117 HydrophobicContact CB-CG2 4.35Å; C109-V117 PolarHBondContact N-O 3.29Å; C109-V117 PolarHBondContact O-N 3.26Å; C109-K119 HydrophobicContact CB-CD 4.24Å; C109-K119 HydrophobicContact CB-CG 4.39Å; C109-E126 CarbonylContact C-O 3.57Å; C109-E126 VanDerWaalsContact CA-O 3.24Å; C109-E126 WeakPolarHBondContact CA-O 3.36Å; C109-E126 HydrophobicContact CB-CB 4.41Å; C109-E126 WeakPolarHBondContact CB-O 3.29Å; C109-C127 HydrophobicContact CB-CB 3.98Å; C109-C127 WeakPolarHBondContact CB-SG 3.4Å; C109-C127 WeakPolarHBondContact SG-CB 3.38Å; C109-C127 CovalentContact SG-SG 2.04Å; C109-C127 PolarHBondContact SG-SG 3.25Å
110	M	98.8	Very high	98.4	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.6	172.9	-171.3	178	-68.5	0	0	109.5	L116 E126 F129 Y146 W149 Y150	M110-L116 HydrophobicContact CB-CD2 4.27Å; M110-L116 HydrophobicContact CE-CD2 3.65Å; M110-L116 HydrophobicContact CG-CD2 4.42Å; M110-E126 PolarHBondContact N-O 3.17Å; M110-E126 WeakPolarHBondContact O-CB 3.04Å; M110-E126 WeakPolarHBondContact O-CG 3.44Å; M110-F129 HydrophobicContact CB-CE1 4.39Å; M110-F129 HydrophobicContact CB-CZ 4.5Å; M110-F129 HydrophobicContact CE-CE1 4.45Å; M110-Y146 WeakPolarHBondContact O-CE2 3.16Å; M110-W149 HydrophobicContact CE-CB 4.4Å; M110-W149 HydrophobicContact SD-CB 3.72Å; M110-W149 HydrophobicContact SD-CD2 4.42Å; M110-W149 HydrophobicContact SD-CE3 3.72Å; M110-W149 HydrophobicContact SD-CG 4.49Å; M110-Y150 WeakPolarHBondContact CE-O 3.31Å
111	N	98.3	Very high	98.4	Very high	37 Å²	37	54.3 Å²	54.3	20%	0.198	26%	0.255	C	S	.	.			trans	-84.3	173.3	179.5	72.4	19.3	0	0	0	112.5	K113 G114 K115	N111-K113 PolarHBondContact O-N 2.62Å; N111-K113 WeakPolarHBondContact OD1-CA 3.29Å; N111-K113 WeakPolarHBondContact OD1-CB 3.15Å; N111-K113 PolarHBondContact OD1-N 3.35Å; N111-G114 WeakPolarHBondContact O-CA 3.1Å; N111-G114 PolarHBondContact O-N 2.83Å; N111-G114 PolarHBondContact OD1-N 3.37Å; N111-K115 PolarHBondContact N-O 2.94Å; N111-K115 VanDerWaalsContact N-O 3.07Å; N111-K115 PolarHBondContact OD1-N 3.48Å
112	R	98.4	Very high	98.3	Very high	189 Å²	189	54.5 Å²	54.5	71%	0.713	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-22.1	177.6	77.5	177.5	-172	-105	6.3	116.4	G114 Y146	R112-G114 VanDerWaalsContact C-N 3.26Å; R112-Y146 VanDerWaalsContact CA-OH 3.25Å; R112-Y146 WeakPolarHBondContact CA-OH 3.14Å; R112-Y146 WeakPolarHBondContact CB-OH 3.34Å; R112-Y146 PolarHBondContact N-OH 2.84Å
113	K	98.3	Very high	98.2	Very high	140 Å²	140	54.8 Å²	54.8	61%	0.609	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	4	177	-60.3	-176.5	178.7	-178.6	0	111.9	N111 K115	N111-K113 PolarHBondContact O-N 2.62Å; N111-K113 WeakPolarHBondContact OD1-CA 3.29Å; N111-K113 WeakPolarHBondContact OD1-CB 3.15Å; N111-K113 PolarHBondContact OD1-N 3.35Å; K113-K115 VanDerWaalsContact C-N 3.26Å; K113-K115 PolarHBondContact O-N 2.91Å
114	G	98.4	Very high	98.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	72.2	13.3	-173.9	0	0	0	0	0	114.3	N111 R112 K161 G162	N111-G114 WeakPolarHBondContact O-CA 3.1Å; N111-G114 PolarHBondContact O-N 2.83Å; N111-G114 PolarHBondContact OD1-N 3.37Å; R112-G114 VanDerWaalsContact C-N 3.26Å; G114-K161 CarbonylContact O-C 3.54Å; G114-K161 VanDerWaalsContact O-CA 3.29Å; G114-K161 WeakPolarHBondContact O-CA 3.36Å; G114-G162 PolarHBondContact O-N 2.89Å
115	K	98.6	Very high	98.1	Very high	123 Å²	123	55.5 Å²	55.5	54%	0.535	27%	0.269	S	S	.	.			trans	-85.6	131.2	-179.6	-178.5	-177.2	175.7	-176.9	0	109.7	N111 K113 V117	N111-K115 PolarHBondContact N-O 2.94Å; N111-K115 VanDerWaalsContact N-O 3.07Å; N111-K115 PolarHBondContact OD1-N 3.48Å; K113-K115 VanDerWaalsContact C-N 3.26Å; K113-K115 PolarHBondContact O-N 2.91Å; K115-V117 HydrophobicContact CD-CG1 4.18Å; K115-V117 HydrophobicContact CG-CG1 4.12Å
116	L	98.8	Very high	98.1	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.5	167.8	-58.5	-178.9	0	0	0	110.2	I73 L108 C109 M110 V151 F153 P159	I73-L116 HydrophobicContact CB-CB 4.27Å; I73-L116 HydrophobicContact CG1-CB 4.28Å; I73-L116 HydrophobicContact CG2-CB 4.46Å; L108-L116 HydrophobicContact CD1-CB 4.22Å; L108-L116 HydrophobicContact CD1-CD2 4.32Å; C109-L116 WeakPolarHBondContact O-CA 3.37Å; M110-L116 HydrophobicContact CB-CD2 4.27Å; M110-L116 HydrophobicContact CE-CD2 3.65Å; M110-L116 HydrophobicContact CG-CD2 4.42Å; L116-V151 HydrophobicContact CD1-CG1 3.81Å; L116-V151 HydrophobicContact CD2-CG2 4.27Å; L116-F153 HydrophobicContact CD1-CE1 4.33Å; L116-F153 HydrophobicContact CD1-CE2 4.39Å; L116-F153 HydrophobicContact CD1-CZ 3.92Å; L116-P159 HydrophobicContact CB-CB 4.32Å; L116-P159 HydrophobicContact CD1-CB 4.21Å
117	V	98.6	Very high	98	Very high	23 Å²	23	50.4 Å²	50.4	14%	0.139	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	149.7	-179.5	-65.1	0	0	0	0	109.2	C109 K115 K119	C109-V117 HydrophobicContact CB-CG2 4.35Å; C109-V117 PolarHBondContact N-O 3.29Å; C109-V117 PolarHBondContact O-N 3.26Å; K115-V117 HydrophobicContact CD-CG1 4.18Å; K115-V117 HydrophobicContact CG-CG1 4.12Å; V117-K119 HydrophobicContact CG2-CG 4.35Å
118	G	98.7	Very high	98	Very high	5 Å²	5	48.6 Å²	48.6	5%	0.052	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	138.9	165.3	0	0	0	0	0	111	G70 R71 Y107	G70-G118 WeakPolarHBondContact O-CA 3.32Å; R71-G118 PolarHBondContact O-N 3.39Å; Y107-G118 CarbonylContact O-C 3.49Å; Y107-G118 VanDerWaalsContact O-CA 3.25Å; Y107-G118 WeakPolarHBondContact O-CA 3.45Å
119	K	98.6	Very high	98	Very high	62 Å²	62	48.6 Å²	48.6	27%	0.27	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.2	171.6	-64.5	-175	-176.3	177.7	0	111	F106 Y107 C109 V117 D121 E126	F106-K119 CarbonylContact C-O 3.53Å; F106-K119 WeakPolarHBondContact CA-O 3.38Å; Y107-K119 PolarHBondContact N-O 2.92Å; Y107-K119 PolarHBondContact O-N 3.16Å; C109-K119 HydrophobicContact CB-CD 4.24Å; C109-K119 HydrophobicContact CB-CG 4.39Å; V117-K119 HydrophobicContact CG2-CG 4.35Å; K119-D121 VanDerWaalsContact C-N 3.34Å; K119-E126 IonicContact NZ-OE2 2.66Å; K119-E126 PolarHBondContact NZ-OE2 2.67Å
120	P	98.1	Very high	98	Very high	93 Å²	93	50.7 Å²	50.7	60%	0.604	25%	0.25	S	C	*	.	S	Bend	trans	-67.8	-36.4	174	27.8	-33.5	0	0	0	111.7	Y107	Y107-P120 WeakPolarHBondContact CD2-O 3.33Å
121	D	97.4	Very high	98	Very high	90 Å²	90	51.5 Å²	51.5	48%	0.481	25%	0.254	S	S	.	.			trans	-92.1	118.2	174.8	177	18.1	0	0	0	111	K119 T123	K119-D121 VanDerWaalsContact C-N 3.34Å; D121-T123 VanDerWaalsContact CG-OG1 3.24Å; D121-T123 VanDerWaalsContact OD1-CB 3.3Å; D121-T123 WeakPolarHBondContact OD1-CB 3.33Å; D121-T123 WeakPolarHBondContact OD1-CG2 3.37Å; D121-T123 PolarHBondContact OD1-N 2.89Å; D121-T123 PolarHBondContact OD1-OG1 3.41Å; D121-T123 PolarHBondContact OD2-OG1 2.88Å
122	G	96.3	Very high	98	Very high	5 Å²	5	52.8 Å²	52.8	5%	0.052	26%	0.257	C	S	.	.			trans	-98.4	3.8	178.7	0	0	0	0	0	115	R98 Y107 S124	R98-G122 VanDerWaalsContact CD-O 3.26Å; R98-G122 WeakPolarHBondContact CD-O 3.21Å; R98-G122 PolarHBondContact NE-O 2.85Å; Y107-G122 VanDerWaalsContact CD2-CA 3.49Å; Y107-G122 VanDerWaalsContact CG-CA 3.49Å; G122-S124 VanDerWaalsContact C-N 3.28Å; G122-S124 PolarHBondContact O-N 2.84Å
123	T	95.2	Very high	97.9	Very high	84 Å²	84	48.9 Å²	48.9	52%	0.515	26%	0.255	S	S	.	.			trans	-64.1	-32	-174.9	56.8	0	0	0	0	113.1	D121	D121-T123 VanDerWaalsContact CG-OG1 3.24Å; D121-T123 VanDerWaalsContact OD1-CB 3.3Å; D121-T123 WeakPolarHBondContact OD1-CB 3.33Å; D121-T123 WeakPolarHBondContact OD1-CG2 3.37Å; D121-T123 PolarHBondContact OD1-N 2.89Å; D121-T123 PolarHBondContact OD1-OG1 3.41Å; D121-T123 PolarHBondContact OD2-OG1 2.88Å
124	S	96.6	Very high	97.9	Very high	40 Å²	40	43 Å²	43	28%	0.28	23%	0.229	S	C	.	.	S	Bend	trans	-62.2	143.6	-178.9	-170.7	0	0	0	0	113.2	G122 E126 C127	G122-S124 VanDerWaalsContact C-N 3.28Å; G122-S124 PolarHBondContact O-N 2.84Å; S124-E126 PolarHBondContact O-N 2.58Å; S124-E126 PolarHBondContact OG-N 3.14Å; S124-C127 WeakPolarHBondContact O-CB 3.35Å; S124-C127 PolarHBondContact O-N 3.24Å
125	K	97	Very high	97.8	Very high	101 Å²	101	52.5 Å²	52.5	44%	0.439	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-59.2	-16.6	169.4	-159.7	169.2	-175.2	169.8	0	113.5	C127 V128 A144 K145	K125-C127 PolarHBondContact O-N 2.87Å; K125-V128 PolarHBondContact O-N 3.35Å; K125-A144 WeakPolarHBondContact CE-O 3.21Å; K125-A144 HydrophobicContact CG-CB 4.39Å; K125-K145 HydrophobicContact CB-CB 4.32Å; K125-K145 HydrophobicContact CG-CB 4.1Å
126	E	98.2	Very high	97.7	Very high	24 Å²	24	49.8 Å²	49.8	11%	0.112	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-61.6	-21.1	169.4	-74.5	-172.5	-177.8	0	0	113.6	C109 M110 K119 S124 K145 Y146	C109-E126 CarbonylContact C-O 3.57Å; C109-E126 VanDerWaalsContact CA-O 3.24Å; C109-E126 WeakPolarHBondContact CA-O 3.36Å; C109-E126 HydrophobicContact CB-CB 4.41Å; C109-E126 WeakPolarHBondContact CB-O 3.29Å; M110-E126 PolarHBondContact N-O 3.17Å; M110-E126 WeakPolarHBondContact O-CB 3.04Å; M110-E126 WeakPolarHBondContact O-CG 3.44Å; K119-E126 IonicContact NZ-OE2 2.66Å; K119-E126 PolarHBondContact NZ-OE2 2.67Å; S124-E126 PolarHBondContact O-N 2.58Å; S124-E126 PolarHBondContact OG-N 3.14Å; E126-K145 HydrophobicContact CB-CD 4.48Å; E126-K145 HydrophobicContact CG-CD 3.43Å; E126-K145 VanDerWaalsContact CG-CD 3.43Å; E126-K145 IonicContact OE1-NZ 2.6Å; E126-K145 PolarHBondContact OE1-NZ 3.1Å; E126-Y146 HydrophobicContact CG-CE2 4.18Å; E126-Y146 PolarHBondContact OE1-OH 2.96Å
127	C	98.5	Very high	97.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-102.3	7.9	-177.6	-51	0	0	0	0	112.9	C109 S124 K125	C109-C127 HydrophobicContact CB-CB 3.98Å; C109-C127 WeakPolarHBondContact CB-SG 3.4Å; C109-C127 WeakPolarHBondContact SG-CB 3.38Å; C109-C127 CovalentContact SG-SG 2.04Å; C109-C127 PolarHBondContact SG-SG 3.25Å; S124-C127 WeakPolarHBondContact O-CB 3.35Å; S124-C127 PolarHBondContact O-N 3.24Å; K125-C127 PolarHBondContact O-N 2.87Å
128	V	98.5	Very high	97.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.1	179	-175.8	0	0	0	0	109.7	D91 Q96 V97 R98 K125 A144	D91-V128 HydrophobicContact CB-CG1 4.17Å; Q96-V128 HydrophobicContact CB-CG1 3.93Å; Q96-V128 HydrophobicContact CG-CG1 4.32Å; V97-V128 WeakPolarHBondContact O-CA 3.25Å; R98-V128 HydrophobicContact CG-CG2 4.16Å; K125-V128 PolarHBondContact O-N 3.35Å; V128-A144 HydrophobicContact CB-CB 3.89Å; V128-A144 HydrophobicContact CG1-CB 3.7Å; V128-A144 WeakPolarHBondContact O-CB 3.43Å; V128-A144 PolarHBondContact O-N 2.99Å
129	F	98.7	Very high	97.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.5	175.7	-59	-85.5	0	0	0	110.6	Q96 V97 I99 L108 M110 L141 M142 V151	Q96-F129 CarbonylContact C-O 3.55Å; Q96-F129 WeakPolarHBondContact CA-O 3.48Å; V97-F129 WeakPolarHBondContact CG2-O 3.35Å; V97-F129 PolarHBondContact N-O 3.38Å; V97-F129 PolarHBondContact O-N 3.12Å; I99-F129 HydrophobicContact CD1-CD2 4.2Å; L108-F129 HydrophobicContact CB-CE2 4.32Å; L108-F129 HydrophobicContact CD2-CE2 4.11Å; L108-F129 HydrophobicContact CD2-CZ 4.3Å; L108-F129 HydrophobicContact CG-CE2 3.84Å; L108-F129 HydrophobicContact CG-CZ 3.95Å; L108-F129 WeakPolarHBondContact O-CE2 3.47Å; M110-F129 HydrophobicContact CB-CE1 4.39Å; M110-F129 HydrophobicContact CB-CZ 4.5Å; M110-F129 HydrophobicContact CE-CE1 4.45Å; F129-L141 HydrophobicContact CB-CB 4.31Å; F129-L141 HydrophobicContact CB-CD2 4.39Å; F129-M142 CarbonylContact C-O 3.53Å; F129-M142 WeakPolarHBondContact CA-O 3.42Å; F129-V151 HydrophobicContact CD1-CG2 3.66Å; F129-V151 HydrophobicContact CE1-CG2 3.41Å; F129-V151 VanDerWaalsContact CE1-CG2 3.41Å; F129-V151 HydrophobicContact CG-CG2 4.44Å; F129-V151 HydrophobicContact CZ-CG2 4Å
130	I	98.4	Very high	97.5	Very high	44 Å²	44	54.8 Å²	54.8	23%	0.226	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115	169.3	-64	160.8	0	0	0	107.1	Q96 K132 M142 A144	Q96-I130 HydrophobicContact CG-CG1 3.76Å; I130-K132 HydrophobicContact CG2-CG 4.15Å; I130-M142 HydrophobicContact CB-CE 4.42Å; I130-M142 HydrophobicContact CD1-CE 3.56Å; I130-M142 PolarHBondContact N-O 3.1Å; I130-M142 PolarHBondContact O-N 3.44Å; I130-A144 HydrophobicContact CG1-CB 4.41Å
131	E	98.2	Very high	97.6	Very high	18 Å²	18	50.4 Å²	50.4	8%	0.084	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	118.7	172.1	-174	-170.6	155.4	0	0	109.6	S95 T139 L141 K176	S95-E131 VanDerWaalsContact CB-O 3.25Å; S95-E131 WeakPolarHBondContact CB-O 3.19Å; S95-E131 PolarHBondContact O-N 3.01Å; E131-T139 HydrophobicContact CG-CG2 3.75Å; E131-L141 HydrophobicContact CB-CD2 4.09Å; E131-L141 HydrophobicContact CG-CD2 4.26Å; E131-K176 WeakPolarHBondContact OE1-CE 3.45Å; E131-K176 IonicContact OE1-NZ 3.87Å; E131-K176 PolarHBondContact OE1-NZ 3.22Å
132	K	97.8	Very high	97.6	Very high	63 Å²	63	47 Å²	47	27%	0.274	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.6	175.7	-62.2	-171.6	-176.8	-174.8	0	110.7	I130 L134 T139 A140 Y150 E167	I130-K132 HydrophobicContact CG2-CG 4.15Å; K132-L134 HydrophobicContact CB-CD2 4.39Å; K132-T139 CarbonylContact O-C 3.59Å; K132-T139 WeakPolarHBondContact O-CA 3.49Å; K132-A140 HydrophobicContact CB-CB 4.48Å; K132-A140 PolarHBondContact N-O 3.37Å; K132-A140 PolarHBondContact O-N 3.07Å; K132-Y150 PolarHBondContact NZ-OH 2.84Å; K132-E167 WeakPolarHBondContact CD-OE2 3.48Å; K132-E167 IonicContact NZ-OE2 2.85Å; K132-E167 PolarHBondContact NZ-OE2 3.15Å
133	V	97.4	Very high	97.7	Very high	108 Å²	108	46.7 Å²	46.7	66%	0.655	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.9	161	-177.8	0	0	0	0	106.8
134	L	97.5	Very high	97.8	Very high	15 Å²	15	43.6 Å²	43.6	8%	0.079	22%	0.222	C	C	.	.			trans	-82.2	161.9	180	-58.5	-175.8	0	0	0	111	K132 N136 N137 Y138 A140 E167 H173	K132-L134 HydrophobicContact CB-CD2 4.39Å; L134-N136 WeakPolarHBondContact CB-OD1 3.43Å; L134-N136 PolarHBondContact O-N 2.76Å; L134-N136 VanDerWaalsContact O-N 3.15Å; L134-N137 WeakPolarHBondContact O-CA 3.42Å; L134-N137 PolarHBondContact O-N 3.34Å; L134-Y138 WeakPolarHBondContact CB-O 3.38Å; L134-Y138 WeakPolarHBondContact CG-O 3.4Å; L134-Y138 PolarHBondContact N-O 3.35Å; L134-A140 HydrophobicContact CD1-CB 3.95Å; L134-A140 HydrophobicContact CD2-CB 3.78Å; L134-A140 HydrophobicContact CG-CB 3.91Å; L134-E167 HydrophobicContact CD1-CG 4.42Å; L134-E167 HydrophobicContact CD2-CG 3.48Å; L134-E167 VanDerWaalsContact CD2-CG 3.48Å; L134-H173 WeakPolarHBondContact CD1-CD2 3.38Å; L134-H173 WeakPolarHBondContact CD1-NE2 3.36Å
135	E	96.6	Very high	97.9	Very high	200 Å²	200	46 Å²	46	94%	0.935	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.8	175.8	-63	174.1	176.9	0	0	113.1	N137	E135-N137 PolarHBondContact O-N 2.88Å
136	N	96	Very high	98	Very high	66 Å²	66	43.1 Å²	43.1	35%	0.353	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	14.2	176	67.5	16.5	0	0	0	113.6	L134 Y138 H173	L134-N136 WeakPolarHBondContact CB-OD1 3.43Å; L134-N136 PolarHBondContact O-N 2.76Å; L134-N136 VanDerWaalsContact O-N 3.15Å; N136-Y138 WeakPolarHBondContact O-CD2 3.29Å; N136-Y138 PolarHBondContact O-N 3.2Å; N136-Y138 VanDerWaalsContact O-N 3.17Å; N136-Y138 WeakPolarHBondContact OD1-CB 3.38Å; N136-Y138 PolarHBondContact OD1-N 2.85Å; N136-Y138 VanDerWaalsContact OD1-N 3.14Å; N136-H173 PolarHBondContact ND2-CE1 3.2Å
137	N	96.6	Very high	97.9	Very high	129 Å²	129	46.6 Å²	46.6	69%	0.69	24%	0.241	S	C	*	.	S	Bend	trans	65	7.2	179.3	-55.3	-57.2	0	0	0	116	L134 E135	L134-N137 WeakPolarHBondContact O-CA 3.42Å; L134-N137 PolarHBondContact O-N 3.34Å; E135-N137 PolarHBondContact O-N 2.88Å
138	Y	98.2	Very high	97.8	Very high	61 Å²	61	48.2 Å²	48.2	24%	0.239	26%	0.258	C	S	.	.			trans	-82.2	157.2	169.8	-76.5	-93.8	0	0	0	111.5	R60 L134 N136 H173 M175	R60-Y138 HydrophobicContact CB-CD1 4.27Å; R60-Y138 HydrophobicContact CB-CE1 3.85Å; R60-Y138 VanDerWaalsContact CD-CZ 3.5Å; R60-Y138 HydrophobicContact CG-CD1 4.45Å; R60-Y138 HydrophobicContact CG-CE1 3.71Å; R60-Y138 VanDerWaalsContact NH1-CE2 3.34Å; L134-Y138 WeakPolarHBondContact CB-O 3.38Å; L134-Y138 WeakPolarHBondContact CG-O 3.4Å; L134-Y138 PolarHBondContact N-O 3.35Å; N136-Y138 WeakPolarHBondContact O-CD2 3.29Å; N136-Y138 PolarHBondContact O-N 3.2Å; N136-Y138 VanDerWaalsContact O-N 3.17Å; N136-Y138 WeakPolarHBondContact OD1-CB 3.38Å; N136-Y138 PolarHBondContact OD1-N 2.85Å; N136-Y138 VanDerWaalsContact OD1-N 3.14Å; Y138-H173 HydrophobicContact CD1-CB 3.79Å; Y138-H173 HydrophobicContact CG-CB 3.82Å; Y138-M175 HydrophobicContact CD1-CG 3.88Å; Y138-M175 HydrophobicContact CD1-SD 3.78Å; Y138-M175 HydrophobicContact CE1-CG 3.75Å; Y138-M175 HydrophobicContact CE1-SD 3.99Å; Y138-M175 HydrophobicContact CG-SD 4.39Å
139	T	98.4	Very high	97.9	Very high	10 Å²	10	51.1 Å²	51.1	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	137.7	170.3	-55.4	0	0	0	0	110.3	E131 K132 F174	E131-T139 HydrophobicContact CG-CG2 3.75Å; K132-T139 CarbonylContact O-C 3.59Å; K132-T139 WeakPolarHBondContact O-CA 3.49Å; T139-F174 WeakPolarHBondContact CB-O 3.39Å; T139-F174 PolarHBondContact N-O 3.35Å; T139-F174 PolarHBondContact O-N 2.83Å
140	A	98.6	Very high	97.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	150.6	167.6	0	0	0	0	0	110.8	K132 L134 Y150	K132-A140 HydrophobicContact CB-CB 4.48Å; K132-A140 PolarHBondContact N-O 3.37Å; K132-A140 PolarHBondContact O-N 3.07Å; L134-A140 HydrophobicContact CD1-CB 3.95Å; L134-A140 HydrophobicContact CD2-CB 3.78Å; L134-A140 HydrophobicContact CG-CB 3.91Å; A140-Y150 HydrophobicContact CB-CD1 4.06Å; A140-Y150 HydrophobicContact CB-CE1 4.14Å
141	L	98.8	Very high	97.9	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	102.7	179.7	-65.5	169.5	0	0	0	109.2	L57 I99 F129 E131 Y150 V151	L57-L141 HydrophobicContact CD1-CD1 3.63Å; I99-L141 HydrophobicContact CD1-CD1 3.67Å; I99-L141 HydrophobicContact CD1-CD2 4.21Å; F129-L141 HydrophobicContact CB-CB 4.31Å; F129-L141 HydrophobicContact CB-CD2 4.39Å; E131-L141 HydrophobicContact CB-CD2 4.09Å; E131-L141 HydrophobicContact CG-CD2 4.26Å; L141-Y150 CarbonylContact O-C 3.44Å; L141-Y150 VanDerWaalsContact O-CA 3.31Å; L141-Y150 WeakPolarHBondContact O-CA 3.28Å; L141-V151 HydrophobicContact CB-CB 4.01Å; L141-V151 HydrophobicContact CB-CG2 3.75Å; L141-V151 HydrophobicContact CD1-CG2 4.38Å; L141-V151 PolarHBondContact O-N 2.64Å
142	M	98.6	Very high	97.9	Very high	17 Å²	17	48.8 Å²	48.8	8%	0.084	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	138.6	179	-171.7	179.2	70.7	0	0	110.1	F129 I130 A144 W149 Y150	F129-M142 CarbonylContact C-O 3.53Å; F129-M142 WeakPolarHBondContact CA-O 3.42Å; I130-M142 HydrophobicContact CB-CE 4.42Å; I130-M142 HydrophobicContact CD1-CE 3.56Å; I130-M142 PolarHBondContact N-O 3.1Å; I130-M142 PolarHBondContact O-N 3.44Å; M142-A144 PolarHBondContact O-N 3.24Å; M142-W149 CarbonylContact C-O 3.48Å; M142-W149 WeakPolarHBondContact CA-O 3.41Å; M142-Y150 HydrophobicContact CB-CD1 3.95Å; M142-Y150 HydrophobicContact CB-CE1 3.76Å; M142-Y150 HydrophobicContact CG-CD1 4.44Å; M142-Y150 HydrophobicContact CG-CE1 4.14Å; M142-Y150 HydrophobicContact CG-CE2 4.31Å; M142-Y150 HydrophobicContact SD-CE2 4.49Å
143	S	98.6	Very high	98	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	130.2	174.6	-178.4	0	0	0	0	110.8	K145 Y146 W149	S143-K145 VanDerWaalsContact C-N 3.31Å; S143-K145 PolarHBondContact OG-N 3.19Å; S143-Y146 PolarHBondContact OG-N 3.31Å; S143-W149 PolarHBondContact N-O 2.69Å
144	A	97.6	Very high	98	Very high	18 Å²	18	43 Å²	43	15%	0.149	23%	0.227	C	C	.	.	S	Bend	trans	-73	-24.2	175.2	0	0	0	0	0	112.7	K125 V128 I130 M142	K125-A144 WeakPolarHBondContact CE-O 3.21Å; K125-A144 HydrophobicContact CG-CB 4.39Å; V128-A144 HydrophobicContact CB-CB 3.89Å; V128-A144 HydrophobicContact CG1-CB 3.7Å; V128-A144 WeakPolarHBondContact O-CB 3.43Å; V128-A144 PolarHBondContact O-N 2.99Å; I130-A144 HydrophobicContact CG1-CB 4.41Å; M142-A144 PolarHBondContact O-N 3.24Å
145	K	97.7	Very high	98.1	Very high	90 Å²	90	50.7 Å²	50.7	39%	0.391	26%	0.26	S	S	.	.	S	Bend	trans	-85.9	-42.1	176.6	-171.7	178.1	-179.8	-178.6	0	112.5	K125 E126 S143	K125-K145 HydrophobicContact CB-CB 4.32Å; K125-K145 HydrophobicContact CG-CB 4.1Å; E126-K145 HydrophobicContact CB-CD 4.48Å; E126-K145 HydrophobicContact CG-CD 3.43Å; E126-K145 VanDerWaalsContact CG-CD 3.43Å; E126-K145 IonicContact OE1-NZ 2.6Å; E126-K145 PolarHBondContact OE1-NZ 3.1Å; S143-K145 VanDerWaalsContact C-N 3.31Å; S143-K145 PolarHBondContact OG-N 3.19Å
146	Y	98.2	Very high	98.2	Very high	42 Å²	42	48.6 Å²	48.6	17%	0.165	25%	0.247	C	C	.	.	S	Bend	trans	-112.8	77.7	-177.3	-53.9	-68.8	0	0	0	109.5	M110 R112 E126 S143 W149	M110-Y146 WeakPolarHBondContact O-CE2 3.16Å; R112-Y146 VanDerWaalsContact CA-OH 3.25Å; R112-Y146 WeakPolarHBondContact CA-OH 3.14Å; R112-Y146 WeakPolarHBondContact CB-OH 3.34Å; R112-Y146 PolarHBondContact N-OH 2.84Å; E126-Y146 HydrophobicContact CG-CE2 4.18Å; E126-Y146 PolarHBondContact OE1-OH 2.96Å; S143-Y146 PolarHBondContact OG-N 3.31Å; Y146-W149 HydrophobicContact CD1-CE3 4.31Å; Y146-W149 HydrophobicContact CD1-CH2 4.1Å; Y146-W149 AromaticContact CD1-CZ3 3.85Å; Y146-W149 HydrophobicContact CD1-CZ3 3.85Å; Y146-W149 AromaticContact CD2-CE3 3.93Å; Y146-W149 HydrophobicContact CD2-CE3 3.93Å; Y146-W149 AromaticContact CD2-CZ3 3.88Å; Y146-W149 HydrophobicContact CD2-CZ3 3.88Å; Y146-W149 HydrophobicContact CE1-CZ3 4.45Å; Y146-W149 HydrophobicContact CE2-CZ3 4.47Å; Y146-W149 HydrophobicContact CG-CD2 4.31Å; Y146-W149 AromaticContact CG-CE3 3.59Å; Y146-W149 HydrophobicContact CG-CE3 3.59Å; Y146-W149 HydrophobicContact CG-CH2 4.21Å; Y146-W149 AromaticContact CG-CZ3 3.54Å; Y146-W149 HydrophobicContact CG-CZ3 3.54Å; Y146-W149 VanDerWaalsContact O-CB 3.32Å; Y146-W149 WeakPolarHBondContact O-CB 3.42Å; Y146-W149 PolarHBondContact O-N 3.27Å
147	S	96.4	Very high	98.3	Very high	96 Å²	96	45.5 Å²	45.5	67%	0.671	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	140.3	-176.6	-169.6	0	0	0	0	111.7	W149	S147-W149 VanDerWaalsContact C-N 3.27Å; S147-W149 PolarHBondContact O-N 2.75Å
148	G	98	Very high	98.4	Very high	35 Å²	35	46.5 Å²	46.5	36%	0.361	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	-5.6	-174.6	0	0	0	0	0	115	Y150	G148-Y150 WeakPolarHBondContact O-CD2 3.01Å; G148-Y150 WeakPolarHBondContact O-CE2 3.34Å
149	W	98.7	Very high	98.4	Very high	60 Å²	60	46.1 Å²	46.1	23%	0.227	23%	0.23	C	C	.	.			trans	-96.8	133.2	171.6	-62.4	2.6	0	0	0	110.4	M110 M142 S143 Y146 S147 G162 P163	M110-W149 HydrophobicContact CE-CB 4.4Å; M110-W149 HydrophobicContact SD-CB 3.72Å; M110-W149 HydrophobicContact SD-CD2 4.42Å; M110-W149 HydrophobicContact SD-CE3 3.72Å; M110-W149 HydrophobicContact SD-CG 4.49Å; M142-W149 CarbonylContact C-O 3.48Å; M142-W149 WeakPolarHBondContact CA-O 3.41Å; S143-W149 PolarHBondContact N-O 2.69Å; Y146-W149 HydrophobicContact CD1-CE3 4.31Å; Y146-W149 HydrophobicContact CD1-CH2 4.1Å; Y146-W149 AromaticContact CD1-CZ3 3.85Å; Y146-W149 HydrophobicContact CD1-CZ3 3.85Å; Y146-W149 AromaticContact CD2-CE3 3.93Å; Y146-W149 HydrophobicContact CD2-CE3 3.93Å; Y146-W149 AromaticContact CD2-CZ3 3.88Å; Y146-W149 HydrophobicContact CD2-CZ3 3.88Å; Y146-W149 HydrophobicContact CE1-CZ3 4.45Å; Y146-W149 HydrophobicContact CE2-CZ3 4.47Å; Y146-W149 HydrophobicContact CG-CD2 4.31Å; Y146-W149 AromaticContact CG-CE3 3.59Å; Y146-W149 HydrophobicContact CG-CE3 3.59Å; Y146-W149 HydrophobicContact CG-CH2 4.21Å; Y146-W149 AromaticContact CG-CZ3 3.54Å; Y146-W149 HydrophobicContact CG-CZ3 3.54Å; Y146-W149 VanDerWaalsContact O-CB 3.32Å; Y146-W149 WeakPolarHBondContact O-CB 3.42Å; Y146-W149 PolarHBondContact O-N 3.27Å; S147-W149 VanDerWaalsContact C-N 3.27Å; S147-W149 PolarHBondContact O-N 2.75Å; W149-G162 VanDerWaalsContact CG-C 3.49Å; W149-P163 HydrophobicContact CD2-CG 4.1Å; W149-P163 HydrophobicContact CE3-CG 4.38Å; W149-P163 HydrophobicContact CH2-CG 3.88Å; W149-P163 HydrophobicContact CZ2-CB 4.4Å; W149-P163 HydrophobicContact CZ2-CG 3.56Å; W149-P163 HydrophobicContact CZ3-CG 4.28Å
150	Y	98.8	Very high	98.4	Very high	14 Å²	14	47.9 Å²	47.9	6%	0.055	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-116.3	153.8	-175.1	-65	-101.8	0	0	0	111.2	M110 K132 A140 L141 M142 G148 G152 T165 E167 V172	M110-Y150 WeakPolarHBondContact CE-O 3.31Å; K132-Y150 PolarHBondContact NZ-OH 2.84Å; A140-Y150 HydrophobicContact CB-CD1 4.06Å; A140-Y150 HydrophobicContact CB-CE1 4.14Å; L141-Y150 CarbonylContact O-C 3.44Å; L141-Y150 VanDerWaalsContact O-CA 3.31Å; L141-Y150 WeakPolarHBondContact O-CA 3.28Å; M142-Y150 HydrophobicContact CB-CD1 3.95Å; M142-Y150 HydrophobicContact CB-CE1 3.76Å; M142-Y150 HydrophobicContact CG-CD1 4.44Å; M142-Y150 HydrophobicContact CG-CE1 4.14Å; M142-Y150 HydrophobicContact CG-CE2 4.31Å; M142-Y150 HydrophobicContact SD-CE2 4.49Å; G148-Y150 WeakPolarHBondContact O-CD2 3.01Å; G148-Y150 WeakPolarHBondContact O-CE2 3.34Å; Y150-G152 PolarHBondContact O-N 3.15Å; Y150-T165 PolarHBondContact N-OG1 2.86Å; Y150-T165 WeakPolarHBondContact O-CG2 3.31Å; Y150-E167 HydrophobicContact CE1-CB 4.2Å; Y150-E167 HydrophobicContact CE1-CG 4.02Å; Y150-E167 HydrophobicContact CE2-CB 4.2Å; Y150-E167 PolarHBondContact OH-OE2 2.83Å; Y150-V172 HydrophobicContact CG-CB 4.48Å; Y150-V172 HydrophobicContact CG-CG1 4.4Å
151	V	98.9	Very high	98.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.			trans	-65.1	130.8	162.2	-179.1	0	0	0	0	107.4	I66 L108 L116 F129 L141 F153 V172 F174	I66-V151 HydrophobicContact CD1-CG1 4.29Å; L108-V151 HydrophobicContact CD2-CG2 4.42Å; L116-V151 HydrophobicContact CD1-CG1 3.81Å; L116-V151 HydrophobicContact CD2-CG2 4.27Å; F129-V151 HydrophobicContact CD1-CG2 3.66Å; F129-V151 HydrophobicContact CE1-CG2 3.41Å; F129-V151 VanDerWaalsContact CE1-CG2 3.41Å; F129-V151 HydrophobicContact CG-CG2 4.44Å; F129-V151 HydrophobicContact CZ-CG2 4Å; L141-V151 HydrophobicContact CB-CB 4.01Å; L141-V151 HydrophobicContact CB-CG2 3.75Å; L141-V151 HydrophobicContact CD1-CG2 4.38Å; L141-V151 PolarHBondContact O-N 2.64Å; V151-F153 HydrophobicContact CG1-CE2 3.71Å; V151-F153 HydrophobicContact CG1-CZ 4.33Å; V151-V172 WeakPolarHBondContact O-CA 3.43Å; V151-F174 HydrophobicContact CB-CE2 4.18Å; V151-F174 HydrophobicContact CB-CZ 4.27Å; V151-F174 HydrophobicContact CG1-CE2 4.15Å; V151-F174 HydrophobicContact CG1-CZ 3.77Å; V151-F174 VanDerWaalsContact O-CE2 3.29Å; V151-F174 WeakPolarHBondContact O-CE2 3.45Å
152	G	98.7	Very high	98.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.			trans	-158.1	154.4	177.7	0	0	0	0	0	113.8	Y150 R160 D171	Y150-G152 PolarHBondContact O-N 3.15Å; G152-R160 PolarHBondContact O-N 3.23Å; G152-D171 CarbonylContact C-O 3.36Å; G152-D171 WeakPolarHBondContact CA-O 3.44Å
153	F	98.9	Very high	98.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-138.6	140	-176.2	-61.6	-91.4	0	0	0	112.3	I66 I73 A75 L116 V151 R158 P159 D171 F174	I66-F153 HydrophobicContact CD1-CE2 3.6Å; I66-F153 HydrophobicContact CD1-CZ 4.15Å; I66-F153 HydrophobicContact CG1-CD2 4.41Å; I66-F153 HydrophobicContact CG1-CE2 3.6Å; I66-F153 HydrophobicContact CG1-CZ 3.96Å; I66-F153 HydrophobicContact CG2-CZ 4.18Å; I73-F153 HydrophobicContact CG2-CE1 4.02Å; I73-F153 HydrophobicContact CG2-CZ 3.83Å; A75-F153 HydrophobicContact CB-CB 3.75Å; A75-F153 HydrophobicContact CB-CD1 3.48Å; A75-F153 VanDerWaalsContact CB-CD1 3.48Å; A75-F153 HydrophobicContact CB-CD2 3.72Å; A75-F153 HydrophobicContact CB-CE1 3.93Å; A75-F153 HydrophobicContact CB-CE2 4.16Å; A75-F153 HydrophobicContact CB-CG 3.36Å; A75-F153 HydrophobicContact CB-CZ 4.24Å; L116-F153 HydrophobicContact CD1-CE1 4.33Å; L116-F153 HydrophobicContact CD1-CE2 4.39Å; L116-F153 HydrophobicContact CD1-CZ 3.92Å; V151-F153 HydrophobicContact CG1-CE2 3.71Å; V151-F153 HydrophobicContact CG1-CZ 4.33Å; F153-R158 WeakPolarHBondContact CA-O 3.45Å; F153-P159 HydrophobicContact CD1-CB 4.47Å; F153-P159 HydrophobicContact CD1-CG 4.29Å; F153-P159 HydrophobicContact CE1-CB 4.32Å; F153-P159 HydrophobicContact CE1-CG 3.98Å; F153-D171 PolarHBondContact N-O 3.42Å; F153-D171 VanDerWaalsContact O-CB 3.26Å; F153-D171 WeakPolarHBondContact O-CB 3.21Å; F153-F174 AromaticContact CD2-CE1 3.7Å; F153-F174 HydrophobicContact CD2-CE1 3.7Å; F153-F174 AromaticContact CD2-CZ 3.8Å; F153-F174 HydrophobicContact CD2-CZ 3.8Å; F153-F174 AromaticContact CE2-CE1 3.86Å; F153-F174 HydrophobicContact CE2-CE1 3.86Å; F153-F174 AromaticContact CE2-CZ 3.94Å; F153-F174 HydrophobicContact CE2-CZ 3.94Å
154	T	98.7	Very high	98.4	Very high	50 Å²	50	62.9 Å²	62.9	31%	0.307	31%	0.308	S	S	.	.			trans	-70	169.3	174.1	69.5	0	0	0	0	111.9	K156 G157 R158 R160	T154-K156 PolarHBondContact O-N 3.49Å; T154-K156 PolarHBondContact OG1-N 3.15Å; T154-G157 WeakPolarHBondContact O-CA 3.26Å; T154-G157 PolarHBondContact O-N 3.46Å; T154-R158 PolarHBondContact N-O 3.07Å; T154-R158 WeakPolarHBondContact OG1-CB 3.25Å; T154-R158 PolarHBondContact OG1-N 2.92Å; T154-R160 HydrophobicContact CG2-CG 3.91Å
155	K	98.6	Very high	98.4	Very high	175 Å²	175	62.4 Å²	62.4	76%	0.761	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-29.4	174	-169.9	174.7	-177.8	177.8	0	113.5	T61 G157	T61-K155 HydrophobicContact CG2-CB 4.23Å; K155-G157 VanDerWaalsContact C-N 3.28Å; K155-G157 PolarHBondContact O-N 2.78Å
156	K	98.6	Very high	98.4	Very high	156 Å²	156	66.3 Å²	66.3	68%	0.678	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	12.3	176.6	-60.6	-174.8	178.9	-177.8	0	113.6	R76 T154 R158	R76-K156 PolarHBondContact NE-O 2.76Å; R76-K156 PolarHBondContact NH2-O 2.85Å; R76-K156 VanDerWaalsContact NH2-O 3.15Å; T154-K156 PolarHBondContact O-N 3.49Å; T154-K156 PolarHBondContact OG1-N 3.15Å; K156-R158 VanDerWaalsContact C-N 3.27Å; K156-R158 HydrophobicContact CB-CG 4.48Å; K156-R158 PolarHBondContact O-N 3.31Å
157	G	98.5	Very high	98.4	Very high	1 Å²	1	67.8 Å²	67.8	1%	0.01	32%	0.324	C	S	.	.	S	Bend	trans	68.6	19.4	-179.4	0	0	0	0	0	114.9	A75 T154 K155	A75-G157 PolarHBondContact N-O 3.19Å; A75-G157 WeakPolarHBondContact O-CA 3.45Å; T154-G157 WeakPolarHBondContact O-CA 3.26Å; T154-G157 PolarHBondContact O-N 3.46Å; K155-G157 VanDerWaalsContact C-N 3.28Å; K155-G157 PolarHBondContact O-N 2.78Å
158	R	98.6	Very high	98.4	Very high	151 Å²	151	69.4 Å²	69.4	57%	0.57	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-88	135.4	179.5	-61.6	-178	-179	-172.1	-3.4	110	F153 T154 K156	F153-R158 WeakPolarHBondContact CA-O 3.45Å; T154-R158 PolarHBondContact N-O 3.07Å; T154-R158 WeakPolarHBondContact OG1-CB 3.25Å; T154-R158 PolarHBondContact OG1-N 2.92Å; K156-R158 VanDerWaalsContact C-N 3.27Å; K156-R158 HydrophobicContact CB-CG 4.48Å; K156-R158 PolarHBondContact O-N 3.31Å
159	P	98.6	Very high	98.4	Very high	53 Å²	53	70.4 Å²	70.4	34%	0.344	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-56.4	137.7	175.8	-25.2	33.5	0	0	0	112.7	I73 L116 F153	I73-P159 WeakPolarHBondContact O-CG 3.5Å; L116-P159 HydrophobicContact CB-CB 4.32Å; L116-P159 HydrophobicContact CD1-CB 4.21Å; F153-P159 HydrophobicContact CD1-CB 4.47Å; F153-P159 HydrophobicContact CD1-CG 4.29Å; F153-P159 HydrophobicContact CE1-CB 4.32Å; F153-P159 HydrophobicContact CE1-CG 3.98Å
160	R	98.4	Very high	98.4	Very high	46 Å²	46	72.9 Å²	72.9	17%	0.174	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-89.1	155.4	167.5	-62.7	-169.6	72.2	-132.3	-0.7	110.2	G152 T154 K164 T165 D171	G152-R160 PolarHBondContact O-N 3.23Å; T154-R160 HydrophobicContact CG2-CG 3.91Å; R160-K164 PolarHBondContact NH1-O 3.38Å; R160-K164 PolarHBondContact NH2-O 2.82Å; R160-T165 HydrophobicContact CB-CG2 4.2Å; R160-D171 WeakPolarHBondContact CD-OD2 3.45Å; R160-D171 IonicContact CZ-OD1 2.84Å; R160-D171 IonicContact CZ-OD2 2.61Å; R160-D171 IonicContact NE-OD2 2.65Å; R160-D171 PolarHBondContact NE-OD2 3.46Å; R160-D171 IonicContact NH1-OD1 2.67Å; R160-D171 PolarHBondContact NH1-OD1 3.34Å; R160-D171 IonicContact NH1-OD2 3.77Å; R160-D171 PolarHBondContact NH1-OD2 3.4Å; R160-D171 IonicContact NH2-OD2 3.82Å
161	K	98.6	Very high	98.3	Very high	119 Å²	119	73.5 Å²	73.5	52%	0.517	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-80.6	132.3	171.8	-69.1	-172.7	179.4	-179.4	0	109	G114 K164	G114-K161 CarbonylContact O-C 3.54Å; G114-K161 VanDerWaalsContact O-CA 3.29Å; G114-K161 WeakPolarHBondContact O-CA 3.36Å; K161-K164 WeakPolarHBondContact O-CB 3.26Å; K161-K164 PolarHBondContact O-N 3.45Å
162	G	98.5	Very high	98.3	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-44.9	-49.1	178.1	0	0	0	0	0	115.2	G114 W149 K164 T165	G114-G162 PolarHBondContact O-N 2.89Å; W149-G162 VanDerWaalsContact CG-C 3.49Å; G162-K164 PolarHBondContact O-N 3.42Å; G162-T165 PolarHBondContact O-N 2.85Å; G162-T165 PolarHBondContact O-OG1 2.91Å
163	P	98.6	Very high	98.3	Very high	74 Å²	74	73.7 Å²	73.7	48%	0.481	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-57.1	-17.4	176.6	-25.5	28.9	0	0	0	115.8	W149	W149-P163 HydrophobicContact CD2-CG 4.1Å; W149-P163 HydrophobicContact CE3-CG 4.38Å; W149-P163 HydrophobicContact CH2-CG 3.88Å; W149-P163 HydrophobicContact CZ2-CB 4.4Å; W149-P163 HydrophobicContact CZ2-CG 3.56Å; W149-P163 HydrophobicContact CZ3-CG 4.28Å
164	K	98.3	Very high	98.3	Very high	141 Å²	141	73.7 Å²	73.7	61%	0.613	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-98.7	-1.8	-180	-58.9	-167.1	178.7	-163.2	0	113	R160 K161 G162 Q169	R160-K164 PolarHBondContact NH1-O 3.38Å; R160-K164 PolarHBondContact NH2-O 2.82Å; K161-K164 WeakPolarHBondContact O-CB 3.26Å; K161-K164 PolarHBondContact O-N 3.45Å; G162-K164 PolarHBondContact O-N 3.42Å; K164-Q169 PolarHBondContact O-OE1 3.4Å
165	T	98.6	Very high	98.3	Very high	7 Å²	7	75.1 Å²	75.1	4%	0.043	34%	0.344	C	S	.	.			trans	-93.1	148.8	-179.8	64.3	0	0	0	0	111.6	Y150 R160 G162 V172	Y150-T165 PolarHBondContact N-OG1 2.86Å; Y150-T165 WeakPolarHBondContact O-CG2 3.31Å; R160-T165 HydrophobicContact CB-CG2 4.2Å; G162-T165 PolarHBondContact O-N 2.85Å; G162-T165 PolarHBondContact O-OG1 2.91Å; T165-V172 HydrophobicContact CG2-CG1 3.97Å
166	R	98	Very high	98.3	Very high	172 Å²	172	71.1 Å²	71.1	65%	0.649	33%	0.326	S	S	*	.			trans	-139.7	150.6	170.4	-58.6	-178.3	-179.3	-168.5	-1.5	108.9	N168 Q169 V172	R166-N168 WeakPolarHBondContact CB-OD1 3.37Å; R166-N168 PolarHBondContact O-N 3.27Å; R166-Q169 HydrophobicContact CB-CG 4.08Å; R166-Q169 WeakPolarHBondContact O-CB 3.23Å; R166-Q169 PolarHBondContact O-N 2.92Å; R166-V172 WeakPolarHBondContact O-CG2 3.48Å
167	E	97.7	Very high	98.2	Very high	74 Å²	74	68.1 Å²	68.1	35%	0.346	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.8	-174.6	-164.6	167.5	89.7	0	0	113.6	K132 L134 Y150 Q169 H173	K132-E167 WeakPolarHBondContact CD-OE2 3.48Å; K132-E167 IonicContact NZ-OE2 2.85Å; K132-E167 PolarHBondContact NZ-OE2 3.15Å; L134-E167 HydrophobicContact CD1-CG 4.42Å; L134-E167 HydrophobicContact CD2-CG 3.48Å; L134-E167 VanDerWaalsContact CD2-CG 3.48Å; Y150-E167 HydrophobicContact CE1-CB 4.2Å; Y150-E167 HydrophobicContact CE1-CG 4.02Å; Y150-E167 HydrophobicContact CE2-CB 4.2Å; Y150-E167 PolarHBondContact OH-OE2 2.83Å; E167-Q169 VanDerWaalsContact C-N 3.28Å; E167-Q169 PolarHBondContact O-N 3.22Å; E167-H173 PolarHBondContact O-NE2 2.88Å; E167-H173 VanDerWaalsContact O-NE2 3.11Å
168	N	96.4	Very high	97.8	Very high	130 Å²	130	74.3 Å²	74.3	70%	0.695	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.9	-179.8	66.5	-23.5	0	0	0	114.5	R166	R166-N168 WeakPolarHBondContact CB-OD1 3.37Å; R166-N168 PolarHBondContact O-N 3.27Å
169	Q	97.9	Very high	96.8	Very high	55 Å²	55	67.6 Å²	67.6	26%	0.257	31%	0.311	S	S	.	.	S	Bend	trans	-81.6	131.5	-179.1	-68.8	176.6	-27.6	0	0	110.8	K164 R166 E167 D171 V172 H173	K164-Q169 PolarHBondContact O-OE1 3.4Å; R166-Q169 HydrophobicContact CB-CG 4.08Å; R166-Q169 WeakPolarHBondContact O-CB 3.23Å; R166-Q169 PolarHBondContact O-N 2.92Å; E167-Q169 VanDerWaalsContact C-N 3.28Å; E167-Q169 PolarHBondContact O-N 3.22Å; Q169-D171 WeakPolarHBondContact CB-OD1 3.38Å; Q169-D171 PolarHBondContact O-N 3.49Å; Q169-V172 WeakPolarHBondContact O-CG2 3.44Å; Q169-V172 PolarHBondContact O-N 2.85Å; Q169-V172 VanDerWaalsContact O-N 3.09Å; Q169-H173 PolarHBondContact O-CD2 3.42Å; Q169-H173 PolarHBondContact O-NE2 2.99Å
170	Q	98	Very high	95.7	Very high	112 Å²	112	72 Å²	72	52%	0.523	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-57.8	-26.7	179.3	-65.2	-174.1	4.3	0	0	113.9	T61 V172 H173	T61-Q170 PolarHBondContact OG1-O 3.4Å; Q170-V172 PolarHBondContact O-N 2.86Å; Q170-H173 WeakPolarHBondContact O-CB 3.27Å; Q170-H173 PolarHBondContact O-N 3.39Å; Q170-H173 VanDerWaalsContact O-N 3.11Å
171	D	98.1	Very high	94.2	Very high	28 Å²	28	73.7 Å²	73.7	15%	0.15	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-73.1	-6.1	-178.3	61.6	33.8	0	0	0	115	T61 G152 F153 R160 Q169	T61-D171 HydrophobicContact CG2-CB 4.27Å; T61-D171 WeakPolarHBondContact OG1-CA 3.33Å; T61-D171 PolarHBondContact OG1-N 2.89Å; G152-D171 CarbonylContact C-O 3.36Å; G152-D171 WeakPolarHBondContact CA-O 3.44Å; F153-D171 PolarHBondContact N-O 3.42Å; F153-D171 VanDerWaalsContact O-CB 3.26Å; F153-D171 WeakPolarHBondContact O-CB 3.21Å; R160-D171 WeakPolarHBondContact CD-OD2 3.45Å; R160-D171 IonicContact CZ-OD1 2.84Å; R160-D171 IonicContact CZ-OD2 2.61Å; R160-D171 IonicContact NE-OD2 2.65Å; R160-D171 PolarHBondContact NE-OD2 3.46Å; R160-D171 IonicContact NH1-OD1 2.67Å; R160-D171 PolarHBondContact NH1-OD1 3.34Å; R160-D171 IonicContact NH1-OD2 3.77Å; R160-D171 PolarHBondContact NH1-OD2 3.4Å; R160-D171 IonicContact NH2-OD2 3.82Å; Q169-D171 WeakPolarHBondContact CB-OD1 3.38Å; Q169-D171 PolarHBondContact O-N 3.49Å
172	V	98.7	Very high	92.3	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-103.8	1.6	170	-51.4	0	0	0	0	113.3	Y150 V151 T165 R166 Q169 Q170 F174	Y150-V172 HydrophobicContact CG-CB 4.48Å; Y150-V172 HydrophobicContact CG-CG1 4.4Å; V151-V172 WeakPolarHBondContact O-CA 3.43Å; T165-V172 HydrophobicContact CG2-CG1 3.97Å; R166-V172 WeakPolarHBondContact O-CG2 3.48Å; Q169-V172 WeakPolarHBondContact O-CG2 3.44Å; Q169-V172 PolarHBondContact O-N 2.85Å; Q169-V172 VanDerWaalsContact O-N 3.09Å; Q170-V172 PolarHBondContact O-N 2.86Å; V172-F174 WeakPolarHBondContact O-CD2 3.3Å; V172-F174 WeakPolarHBondContact O-CE2 3.36Å
173	H	98.8	Very high	90.2	Very high	3 Å²	3	77.3 Å²	77.3	1%	0.014	38%	0.384	C	S	.	.			trans	-89.9	132.3	-177.8	-60.9	166.7	0	0	0	111.5	R60 L134 N136 Y138 E167 Q169 Q170	R60-H173 HydrophobicContact CB-CB 3.9Å; R60-H173 WeakPolarHBondContact CB-O 3.41Å; R60-H173 HydrophobicContact CG-CB 4.5Å; R60-H173 PolarHBondContact N-O 3.48Å; R60-H173 PolarHBondContact NH1-ND1 2.79Å; R60-H173 VanDerWaalsContact NH1-ND1 3.19Å; L134-H173 WeakPolarHBondContact CD1-CD2 3.38Å; L134-H173 WeakPolarHBondContact CD1-NE2 3.36Å; N136-H173 PolarHBondContact ND2-CE1 3.2Å; Y138-H173 HydrophobicContact CD1-CB 3.79Å; Y138-H173 HydrophobicContact CG-CB 3.82Å; E167-H173 PolarHBondContact O-NE2 2.88Å; E167-H173 VanDerWaalsContact O-NE2 3.11Å; Q169-H173 PolarHBondContact O-CD2 3.42Å; Q169-H173 PolarHBondContact O-NE2 2.99Å; Q170-H173 WeakPolarHBondContact O-CB 3.27Å; Q170-H173 PolarHBondContact O-N 3.39Å; Q170-H173 VanDerWaalsContact O-N 3.11Å
174	F	98.8	Very high	88.1	Confident	0 Å²	0	81 Å²	81	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	159.9	-179.9	-56.9	-84.3	0	0	0	112.5	L57 Y58 I66 T139 V151 F153 V172	L57-F174 HydrophobicContact CD2-CB 4.1Å; Y58-F174 CarbonylContact O-C 3.58Å; Y58-F174 WeakPolarHBondContact O-CA 3.49Å; I66-F174 HydrophobicContact CD1-CD1 4.04Å; I66-F174 HydrophobicContact CD1-CE1 3.68Å; I66-F174 HydrophobicContact CD1-CZ 4.28Å; I66-F174 HydrophobicContact CG1-CD1 4.46Å; I66-F174 HydrophobicContact CG1-CE1 4.1Å; T139-F174 WeakPolarHBondContact CB-O 3.39Å; T139-F174 PolarHBondContact N-O 3.35Å; T139-F174 PolarHBondContact O-N 2.83Å; V151-F174 HydrophobicContact CB-CE2 4.18Å; V151-F174 HydrophobicContact CB-CZ 4.27Å; V151-F174 HydrophobicContact CG1-CE2 4.15Å; V151-F174 HydrophobicContact CG1-CZ 3.77Å; V151-F174 VanDerWaalsContact O-CE2 3.29Å; V151-F174 WeakPolarHBondContact O-CE2 3.45Å; F153-F174 AromaticContact CD2-CE1 3.7Å; F153-F174 HydrophobicContact CD2-CE1 3.7Å; F153-F174 AromaticContact CD2-CZ 3.8Å; F153-F174 HydrophobicContact CD2-CZ 3.8Å; F153-F174 AromaticContact CE2-CE1 3.86Å; F153-F174 HydrophobicContact CE2-CE1 3.86Å; F153-F174 AromaticContact CE2-CZ 3.94Å; F153-F174 HydrophobicContact CE2-CZ 3.94Å; V172-F174 WeakPolarHBondContact O-CD2 3.3Å; V172-F174 WeakPolarHBondContact O-CE2 3.36Å
175	M	98.3	Very high	86.1	Confident	80 Å²	80	81.1 Å²	81.1	39%	0.394	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.7	166.3	-66.9	-62.8	-69.8	0	0	109.4	Y58 Y138	Y58-M175 HydrophobicContact CD1-CB 4.21Å; Y58-M175 HydrophobicContact CD1-CG 4.46Å; Y58-M175 PolarHBondContact N-O 3.41Å; Y58-M175 PolarHBondContact O-N 3.38Å; Y138-M175 HydrophobicContact CD1-CG 3.88Å; Y138-M175 HydrophobicContact CD1-SD 3.78Å; Y138-M175 HydrophobicContact CE1-CG 3.75Å; Y138-M175 HydrophobicContact CE1-SD 3.99Å; Y138-M175 HydrophobicContact CG-SD 4.39Å
176	K	97.6	Very high	83.9	Confident	91 Å²	91	84.8 Å²	84.8	40%	0.396	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.8	172	-63.1	178.3	-69.4	-170.9	0	108.3	Y55 L57 E131	Y55-K176 HydrophobicContact CD2-CB 4.14Å; Y55-K176 HydrophobicContact CD2-CG 4.09Å; Y55-K176 HydrophobicContact CE1-CD 4.44Å; Y55-K176 HydrophobicContact CE2-CB 4.34Å; Y55-K176 HydrophobicContact CE2-CD 4.11Å; Y55-K176 HydrophobicContact CE2-CG 3.77Å; L57-K176 HydrophobicContact CD2-CG 4.14Å; E131-K176 WeakPolarHBondContact OE1-CE 3.45Å; E131-K176 IonicContact OE1-NZ 3.87Å; E131-K176 PolarHBondContact OE1-NZ 3.22Å
177	R	96.7	Very high	81.9	Confident	93 Å²	93	85.7 Å²	85.7	35%	0.351	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.6	179.6	-62.1	-171.2	68.1	-138.2	-4.3	110.2	Y55 Q56 H65 D79	Y55-R177 WeakPolarHBondContact CB-O 3.34Å; Q56-R177 PolarHBondContact N-O 3.34Å; Q56-R177 PolarHBondContact O-N 2.86Å; H65-R177 PolarHBondContact CE1-NH1 3.1Å; H65-R177 VanDerWaalsContact CE1-NH1 3.25Å; H65-R177 PolarHBondContact NE2-NH1 2.93Å; D79-R177 IonicContact OD1-NH1 2.76Å; D79-R177 IonicContact OD2-CZ 3.55Å; D79-R177 VanDerWaalsContact OD2-CZ 3.25Å; D79-R177 IonicContact OD2-NH1 2.72Å; D79-R177 PolarHBondContact OD2-NH1 3.37Å; D79-R177 IonicContact OD2-NH2 3.27Å; D79-R177 PolarHBondContact OD2-NH2 2.63Å
178	Y	89.8	Confident	79.8	Confident	132 Å²	132	87.1 Å²	87.1	52%	0.518	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-69.4	146.9	176.1	-61.5	-69.6	0	0	0	111	Q56	Q56-Y178 PolarHBondContact NE2-O 3.29Å
179	P	78.2	Confident	78	Confident	9 Å²	9	88 Å²	88	6%	0.058	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-63.2	136.9	172	-16.4	31.3	0	0	0	110.1	L54	L54-P179 HydrophobicContact CD2-CG 4.46Å; L54-P179 HydrophobicContact CG-CG 4.03Å
180	K	75.2	Confident	76.1	Confident	146 Å²	146	93.6 Å²	93.6	64%	0.635	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	139.5	174.7	-74.4	-176	171.2	170.5	0	110.8	D79	D79-K180 WeakPolarHBondContact OD2-CE 3.35Å; D79-K180 IonicContact OD2-NZ 3.13Å
181	G	67.1	Low	74.1	Confident	82 Å²	82	97.6 Å²	97.6	85%	0.845	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	3	172.2	0	0	0	0	0	115.8
182	Q	58.8	Low	72.2	Confident	91 Å²	91	102.4 Å²	102.4	43%	0.425	51%	0.506	S	S	.	.			trans	-97.2	115.7	164.8	-69.1	-163	-18.7	0	0	109.3
183	P	54.8	Low	70.1	Confident	103 Å²	103	107.6 Å²	107.6	67%	0.669	54%	0.538	S	S	*	.			trans	-57.3	147.3	163.1	25.3	-30.5	0	0	0	107.8	L185	P183-L185 PolarHBondContact O-N 2.91Å
184	E	55.3	Low	68	Low	153 Å²	153	114.1 Å²	114.1	72%	0.715	58%	0.578	S	S	*	*			trans	-55.8	81	-176.9	-168.4	164.2	-159.7	0	0	111.2	Q186	E184-Q186 PolarHBondContact O-N 3.09Å
185	L	54.5	Low	65.8	Low	143 Å²	143	119.4 Å²	119.4	75%	0.749	61%	0.61	S	S	*	*			trans	-77.3	3.1	177.5	-85	165.2	0	0	0	111.6	P183 K187	P183-L185 PolarHBondContact O-N 2.91Å; L185-K187 VanDerWaalsContact C-N 3.26Å; L185-K187 PolarHBondContact O-N 3.32Å
186	Q	53.6	Low	63.6	Low	84 Å²	84	123.2 Å²	123.2	39%	0.393	62%	0.624	S	S	.	*			trans	-73.8	90.5	164.2	-64.8	-170.8	29.5	0	0	107	E184 P188	E184-Q186 PolarHBondContact O-N 3.09Å; Q186-P188 VanDerWaalsContact O-N 3.09Å
187	K	55.3	Low	61.3	Low	190 Å²	190	130.3 Å²	130.3	83%	0.826	65%	0.649	S	S	*	*			trans	-43.8	124.3	158.1	-80.8	-177.8	177.4	177.1	0	105.9	L185 F189	L185-K187 VanDerWaalsContact C-N 3.26Å; L185-K187 PolarHBondContact O-N 3.32Å; K187-F189 PolarHBondContact O-N 3.49Å
188	P	54.9	Low	59	Low	105 Å²	105	130.6 Å²	130.6	68%	0.682	67%	0.665	S	S	*	*			trans	-49.5	134	178.3	17.2	-29.2	0	0	0	107.5	Q186 K190	Q186-P188 VanDerWaalsContact O-N 3.09Å; P188-K190 VanDerWaalsContact C-N 3.31Å; P188-K190 PolarHBondContact O-N 3.34Å
189	F	57.4	Low	57	Low	149 Å²	149	135.8 Å²	135.8	65%	0.654	68%	0.684	S	S	*	*			trans	-56.7	102.4	177.2	177.9	-101	0	0	0	107.4	K187 Y191	K187-F189 PolarHBondContact O-N 3.49Å; F189-Y191 HydrophobicContact CD1-CD1 4.16Å; F189-Y191 HydrophobicContact CD1-CD2 4.09Å; F189-Y191 HydrophobicContact CD1-CE1 4.06Å; F189-Y191 AromaticContact CD1-CE2 4Å; F189-Y191 HydrophobicContact CD1-CE2 4Å; F189-Y191 HydrophobicContact CD1-CG 4.14Å; F189-Y191 AromaticContact CD1-CZ 3.96Å; F189-Y191 AromaticContact CE1-CD1 3.45Å; F189-Y191 HydrophobicContact CE1-CD1 3.45Å; F189-Y191 VanDerWaalsContact CE1-CD1 3.45Å; F189-Y191 HydrophobicContact CE1-CD2 4.18Å; F189-Y191 AromaticContact CE1-CE1 3.53Å; F189-Y191 HydrophobicContact CE1-CE1 3.53Å; F189-Y191 HydrophobicContact CE1-CE2 4.25Å; F189-Y191 AromaticContact CE1-CG 3.78Å; F189-Y191 HydrophobicContact CE1-CG 3.78Å; F189-Y191 AromaticContact CE1-CZ 3.93Å; F189-Y191 HydrophobicContact CZ-CD1 4.43Å; F189-Y191 PolarHBondContact O-N 3.42Å
190	K	57.6	Low	55.4	Low	171 Å²	171	146.7 Å²	146.7	74%	0.743	72%	0.724	S	S	*	*			trans	-78.8	112.9	168.6	-72	-170	177.3	-172.7	0	104.8	P188 T192	P188-K190 VanDerWaalsContact C-N 3.31Å; P188-K190 PolarHBondContact O-N 3.34Å; K190-T192 VanDerWaalsContact C-N 3.26Å; K190-T192 PolarHBondContact O-N 3.36Å
191	Y	55.5	Low	54.2	Low	197 Å²	197	147 Å²	147	77%	0.773	73%	0.73	S	S	*	*			trans	-54.4	102.4	157.9	-61.2	-92	0	0	0	105.7	F189 T193	F189-Y191 HydrophobicContact CD1-CD1 4.16Å; F189-Y191 HydrophobicContact CD1-CD2 4.09Å; F189-Y191 HydrophobicContact CD1-CE1 4.06Å; F189-Y191 AromaticContact CD1-CE2 4Å; F189-Y191 HydrophobicContact CD1-CE2 4Å; F189-Y191 HydrophobicContact CD1-CG 4.14Å; F189-Y191 AromaticContact CD1-CZ 3.96Å; F189-Y191 AromaticContact CE1-CD1 3.45Å; F189-Y191 HydrophobicContact CE1-CD1 3.45Å; F189-Y191 VanDerWaalsContact CE1-CD1 3.45Å; F189-Y191 HydrophobicContact CE1-CD2 4.18Å; F189-Y191 AromaticContact CE1-CE1 3.53Å; F189-Y191 HydrophobicContact CE1-CE1 3.53Å; F189-Y191 HydrophobicContact CE1-CE2 4.25Å; F189-Y191 AromaticContact CE1-CG 3.78Å; F189-Y191 HydrophobicContact CE1-CG 3.78Å; F189-Y191 AromaticContact CE1-CZ 3.93Å; F189-Y191 HydrophobicContact CZ-CD1 4.43Å; F189-Y191 PolarHBondContact O-N 3.42Å; Y191-T193 VanDerWaalsContact C-N 3.27Å; Y191-T193 PolarHBondContact O-N 3.42Å
192	T	58.6	Low	53.2	Low	128 Å²	128	153.8 Å²	153.8	79%	0.785	73%	0.73	S	S	*	*			trans	-65.3	103.2	158.8	30.7	0	0	0	0	104.3	K190 V194	K190-T192 VanDerWaalsContact C-N 3.26Å; K190-T192 PolarHBondContact O-N 3.36Å; T192-V194 PolarHBondContact O-N 3.29Å
193	T	54.8	Low	52.8	Low	110 Å²	110	155 Å²	155	68%	0.675	75%	0.746	S	S	*	*			trans	-50.5	134.3	157.5	47.8	0	0	0	0	105.8	Y191 T195	Y191-T193 VanDerWaalsContact C-N 3.27Å; Y191-T193 PolarHBondContact O-N 3.42Å; T193-T195 PolarHBondContact O-N 3.49Å
194	V	56.1	Low	52.7	Low	140 Å²	140	156.3 Å²	156.3	85%	0.848	75%	0.753	S	S	*	*			trans	-61.4	90.4	169.6	179.2	0	0	0	0	105	T192 K196	T192-V194 PolarHBondContact O-N 3.29Å; V194-K196 PolarHBondContact O-N 3Å; V194-K196 VanDerWaalsContact O-N 3.15Å
195	T	52.4	Low	52.4	Low	110 Å²	110	157.3 Å²	157.3	68%	0.675	76%	0.757	S	S	*	*			trans	-59.3	123.8	169.2	43.3	0	0	0	0	104.6	T193 R197	T193-T195 PolarHBondContact O-N 3.49Å; T195-R197 PolarHBondContact O-N 3.29Å
196	K	51.7	Low	52.8	Low	161 Å²	161	155.9 Å²	155.9	70%	0.7	76%	0.757	S	S	*	*			trans	-51.3	89.9	-179.3	-71.9	-172.6	170.9	-162.9	0	108.4	E28 V194 S198	E28-K196 IonicContact OE1-NZ 3.73Å; E28-K196 WeakPolarHBondContact OE2-CE 3.14Å; E28-K196 IonicContact OE2-NZ 2.73Å; E28-K196 PolarHBondContact OE2-NZ 3.36Å; V194-K196 PolarHBondContact O-N 3Å; V194-K196 VanDerWaalsContact O-N 3.15Å; K196-S198 PolarHBondContact O-N 3.33Å
197	R	49	Very low	52.7	Low	239 Å²	239	160.4 Å²	160.4	90%	0.902	81%	0.808	S	S	*	*			trans	-70.5	97	171.8	-130.4	-178.1	-175.6	-178.4	0.9	103.3	T195 R199	T195-R197 PolarHBondContact O-N 3.29Å; R197-R199 PolarHBondContact O-N 3.39Å; R197-R199 VanDerWaalsContact O-N 3.15Å
198	S	47.6	Very low	52.5	Low	99 Å²	99	158.9 Å²	158.9	69%	0.692	81%	0.807	S	S	*	*			trans	-27.3	118.1	168.1	162.5	0	0	0	0	109.5	K196 R200	K196-S198 PolarHBondContact O-N 3.33Å; S198-R200 PolarHBondContact O-N 2.68Å
199	R	48.3	Very low	52.4	Low	242 Å²	242	161.7 Å²	161.7	91%	0.913	81%	0.814	S	S	*	*			trans	-55.6	87.7	171.1	-78.3	178.3	172.2	170.3	-1.9	108.5	R197 I201	R197-R199 PolarHBondContact O-N 3.39Å; R197-R199 VanDerWaalsContact O-N 3.15Å; R199-I201 VanDerWaalsContact C-N 3.3Å
200	R	43.9	Very low	52.1	Low	238 Å²	238	162.4 Å²	162.4	90%	0.898	82%	0.822	S	S	*	*			trans	-95.4	69	149.6	-85.7	-169.2	-172.9	177.7	3.6	107.5	S198	S198-R200 PolarHBondContact O-N 2.68Å
201	I	52.1	Low	51.8	Low	151 Å²	151	161.9 Å²	161.9	77%	0.774	83%	0.827	S	S	*	*			trans	-113.8	100	156.7	-58.8	179.1	0	0	0	104.1	R199	R199-I201 VanDerWaalsContact C-N 3.3Å
202	R	45.8	Very low	51.6	Low	225 Å²	225	159.8 Å²	159.8	85%	0.849	83%	0.83	S	S	*	*			trans	-61	129.5	166.3	-82.3	178.3	172.1	178.4	-3.7	107	T204	R202-T204 PolarHBondContact O-N 2.85Å; R202-T204 VanDerWaalsContact O-N 3.1Å
203	P	50.1	Low	51.1	Low	116 Å²	116	161.9 Å²	161.9	75%	0.753	83%	0.833	S	S	*	*			trans	-68.1	107.8	164.9	-6.2	21.8	0	0	0	107.4	H205	P203-H205 PolarHBondContact O-N 2.98Å
204	T	52.1	Low	50.8	Low	132 Å²	132	165.6 Å²	165.6	81%	0.81	85%	0.845	S	S	*	*			trans	-76.7	102.7	158.7	45.4	0	0	0	0	106.9	R202	R202-T204 PolarHBondContact O-N 2.85Å; R202-T204 VanDerWaalsContact O-N 3.1Å
205	H	49.8	Very low	50.4	Low	173 Å²	173	167.5 Å²	167.5	80%	0.801	85%	0.845	S	S	*	*			trans	-75.8	126.6	160.3	-93.8	-79.3	0	0	0	108.1	P203	P203-H205 PolarHBondContact O-N 2.98Å
206	P	61.7	Low	50.3	Low	114 Å²	114	172.3 Å²	172.3	74%	0.74	86%	0.859	S	S	*	*			trans	-72	147.8	159.1	3.3	14	0	0	0	109.3
207	A	51.4	Low	50.1	Low	178 Å²	178	173.4 Å²	173.4	100%	1.471	87%	0.873	S	S	*	*			trans	-60.6	0	173.4	0	0	0	0	0	113

Retrieved 207 of 207 residues in 350.5 ms (Link to these results)

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