A0A096NRK9_PAPAN Loading...

Fibroblast growth factor

AlphaFold DB (O76093), UniProt , Accession A0A096NRK9, Species PAPAN (Papio anubis, Olive baboon), 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 172.2 ms (Link to these results)

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