A0A061II80_CRIGR Loading...

Tumor necrosis factor ligand superfamily member 15

Receptor for TNFRSF25 and TNFRSF6B. Mediates activation of NF-kappa-B. Inhibits vascular endothelial growth and angiogenesis (in vitro). Promotes activation of caspases and apoptosis. Promotes splenocyte alloactivation.

AlphaFold DB , UniProt , Accession A0A061II80, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Tnfsf15, Length 244 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	36.8	Very low	30.4	Very low	226 Å²	226	149.5 Å²	149.5	100%	1.113	80%	0.798	S	S	*	*				0	82.5	0	-164.9	175.5	-76.4	0	0	105
2	T	29.3	Very low	30.3	Very low	116 Å²	116	145.3 Å²	145.3	71%	0.712	80%	0.801	S	S	*	*				58.3	123.7	90.8	52.6	0	0	0	0	109.7
3	E	31.3	Very low	30.3	Very low	169 Å²	169	141.1 Å²	141.1	79%	0.79	80%	0.796	S	S	*	*			cis	-159.9	145.1	26	-95.9	155.2	126.1	0	0	106.8
4	E	31.8	Very low	30.6	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.752	80%	0.798	S	S	*	*				75.7	141.8	66.1	-93.2	-68.1	170.3	0	0	115.9
5	L	31.2	Very low	30.9	Very low	152 Å²	152	145.7 Å²	145.7	80%	0.796	80%	0.799	S	S	*	*			trans	74.6	135.3	161.1	-59.3	153.9	0	0	0	118.7
6	G	27.1	Very low	31.4	Very low	61 Å²	61	145.8 Å²	145.8	63%	0.629	79%	0.792	S	S	*	*			cis	136.9	126.7	10.3	0	0	0	0	0	110.6
7	L	30.7	Very low	32.5	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	78%	0.782	S	S	*	*			trans	61.6	139.7	141.3	-71.4	158.2	0	0	0	122.7
8	G	27.4	Very low	33.3	Very low	70 Å²	70	141.2 Å²	141.2	72%	0.722	77%	0.769	S	S	*	*			trans	163.2	81.8	160.9	0	0	0	0	0	107.6
9	F	27.6	Very low	34.2	Very low	164 Å²	164	140.6 Å²	140.6	72%	0.719	76%	0.76	S	S	*	*				55.4	98.3	69.7	-130.6	-80.9	0	0	0	112.8	E11	F9-E11 HydrophobicContact CD1-CB 4.45Å; F9-E11 HydrophobicContact CE1-CB 3.98Å; F9-E11 WeakPolarHBondContact CE1-OE2 3.48Å
10	E	30.7	Very low	34.8	Very low	200 Å²	200	136.6 Å²	136.6	94%	0.935	75%	0.747	S	S	*	*			trans	-144.2	131.7	139.1	-135.2	-174.5	144.3	0	0	110.3
11	E	30.6	Very low	35.4	Very low	154 Å²	154	140 Å²	140	72%	0.72	75%	0.749	S	S	*	*			trans	-112.6	127.3	-168.7	171	174.8	-176.9	0	0	108.2	F9	F9-E11 HydrophobicContact CD1-CB 4.45Å; F9-E11 HydrophobicContact CE1-CB 3.98Å; F9-E11 WeakPolarHBondContact CE1-OE2 3.48Å
12	A	28.8	Very low	35.9	Very low	100 Å²	100	132.5 Å²	132.5	83%	0.826	72%	0.723	S	S	*	*			trans	177.9	136.2	150.9	0	0	0	0	0	107.2
13	A	30.4	Very low	36.7	Very low	90 Å²	90	136.2 Å²	136.2	74%	0.744	72%	0.724	S	S	*	*			cis	-151.2	144.3	17.4	0	0	0	0	0	109.9
14	R	34.8	Very low	37.4	Very low	216 Å²	216	134.9 Å²	134.9	82%	0.815	72%	0.722	S	S	*	*			trans	-63.7	124	163.4	-173.7	-169	-89.4	-121.7	4.6	109.1	E16	R14-E16 IonicContact NH1-OE1 2.73Å
15	V	35.1	Very low	38.1	Very low	136 Å²	136	129.8 Å²	129.8	82%	0.824	71%	0.707	S	S	*	*			trans	-127.9	112.9	155.4	178.3	0	0	0	0	107.3
16	E	39.8	Very low	39	Very low	146 Å²	146	125.3 Å²	125.3	68%	0.682	69%	0.692	S	S	*	*			trans	-70.1	127.1	172.1	-98.2	169.3	173.8	0	0	111.4	R14	R14-E16 IonicContact NH1-OE1 2.73Å
17	M	49.4	Very low	40.3	Very low	126 Å²	126	126.1 Å²	126.1	62%	0.621	69%	0.688	S	S	*	*			trans	66.3	139.5	140.6	-76.6	-64.5	-121.2	0	0	120.2	E19	M17-E19 HydrophobicContact CE-CB 3.69Å; M17-E19 HydrophobicContact CE-CG 3.43Å; M17-E19 VanDerWaalsContact CE-CG 3.43Å; M17-E19 WeakPolarHBondContact CE-OE2 3.49Å; M17-E19 HydrophobicContact SD-CB 4.23Å; M17-E19 HydrophobicContact SD-CG 4.1Å
18	P	46	Very low	41.6	Very low	83 Å²	83	123.9 Å²	123.9	54%	0.539	68%	0.677	S	S	.	*				-145.8	125.9	73.6	34	-12.5	0	0	0	116.5	A20 R21	P18-A20 HydrophobicContact CB-CB 4.18Å; P18-A20 PolarHBondContact O-N 3.14Å; P18-R21 PolarHBondContact O-N 3.04Å
19	E	52	Low	43.2	Very low	130 Å²	130	128.2 Å²	128.2	61%	0.607	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.2	-8.5	159.7	-101.4	177	152.2	0	0	115.3	M17	M17-E19 HydrophobicContact CE-CB 3.69Å; M17-E19 HydrophobicContact CE-CG 3.43Å; M17-E19 VanDerWaalsContact CE-CG 3.43Å; M17-E19 WeakPolarHBondContact CE-OE2 3.49Å; M17-E19 HydrophobicContact SD-CB 4.23Å; M17-E19 HydrophobicContact SD-CG 4.1Å
20	A	46.3	Very low	44.8	Very low	61 Å²	61	124.5 Å²	124.5	50%	0.504	67%	0.667	S	S	.	*	H	α-helix	trans	-69.4	-30.4	178.6	0	0	0	0	0	113.8	P18	P18-A20 HydrophobicContact CB-CB 4.18Å; P18-A20 PolarHBondContact O-N 3.14Å
21	R	46.8	Very low	46.7	Very low	207 Å²	207	118.2 Å²	118.2	78%	0.781	64%	0.644	S	S	*	*	H	α-helix	trans	-73.2	-28.9	-177.9	-79.3	-176.7	174.4	169	-0.7	113.5	P18 A25	P18-R21 PolarHBondContact O-N 3.04Å; R21-A25 PolarHBondContact O-N 3.13Å
22	A	47.3	Very low	48.7	Very low	69 Å²	69	116.2 Å²	116.2	57%	0.57	64%	0.638	S	S	*	*	H	α-helix	trans	-69.8	-33.9	178.1	0	0	0	0	0	112.3	A26	A22-A26 WeakPolarHBondContact O-CB 3.38Å; A22-A26 PolarHBondContact O-N 3.14Å; A22-A26 VanDerWaalsContact O-N 3.16Å
23	R	46.3	Very low	51.1	Low	194 Å²	194	114 Å²	114	73%	0.732	62%	0.62	S	S	*	*	H	α-helix	trans	-71.4	-36.1	-179.8	-61.7	-167.5	-171	-166.9	4	112.9	S27	R23-S27 PolarHBondContact O-N 3.04Å
24	L	45.3	Very low	53.5	Low	141 Å²	141	113.8 Å²	113.8	74%	0.738	61%	0.609	S	S	*	*	H	α-helix	trans	-69.7	-39.6	175.8	-103.9	114.3	0	0	0	112.8	S27 N28	L24-S27 PolarHBondContact O-N 3.08Å; L24-N28 PolarHBondContact O-N 2.86Å
25	A	47.4	Very low	55.9	Low	55 Å²	55	107.4 Å²	107.4	46%	0.455	59%	0.59	S	S	.	*	H	α-helix	trans	-70.3	-33.3	178.8	0	0	0	0	0	112.8	R21 K29	R21-A25 PolarHBondContact O-N 3.13Å; A25-K29 WeakPolarHBondContact O-CG 3.41Å; A25-K29 PolarHBondContact O-N 3.05Å
26	A	50	Low	58.2	Low	58 Å²	58	104.4 Å²	104.4	48%	0.479	57%	0.574	S	S	.	*	H	α-helix	trans	-71	-36.7	174.9	0	0	0	0	0	112.5	A22 T30	A22-A26 WeakPolarHBondContact O-CB 3.38Å; A22-A26 PolarHBondContact O-N 3.14Å; A22-A26 VanDerWaalsContact O-N 3.16Å; A26-T30 PolarHBondContact O-N 2.84Å; A26-T30 PolarHBondContact O-OG1 3.02Å
27	S	54.2	Low	60.4	Low	77 Å²	77	100.9 Å²	100.9	54%	0.538	57%	0.565	S	S	.	*	H	α-helix	trans	-66.4	-34.4	177	-171.3	0	0	0	0	113	R23 L24 T30 C31	R23-S27 PolarHBondContact O-N 3.04Å; L24-S27 PolarHBondContact O-N 3.08Å; S27-T30 WeakPolarHBondContact CA-OG1 3.3Å; S27-T30 PolarHBondContact O-OG1 2.87Å; S27-T30 VanDerWaalsContact O-OG1 3.07Å; S27-C31 WeakPolarHBondContact O-CB 3.5Å; S27-C31 PolarHBondContact O-N 3.04Å
28	N	57.8	Low	62.2	Low	124 Å²	124	100 Å²	100	66%	0.663	56%	0.562	S	S	*	*	H	α-helix	trans	-78.9	-33.7	-177.3	-143.2	14.9	0	0	0	112.4	L24 L32	L24-N28 PolarHBondContact O-N 2.86Å; N28-L32 WeakPolarHBondContact O-CB 3.47Å; N28-L32 PolarHBondContact O-N 2.87Å; N28-L32 VanDerWaalsContact O-N 3.1Å
29	K	60.8	Low	64.3	Low	161 Å²	161	101 Å²	101	70%	0.7	56%	0.562	S	S	*	*	H	α-helix	trans	-71.6	-38.2	175.7	-71.2	-178.4	179.6	-177.1	0	112.8	A25 A33	A25-K29 WeakPolarHBondContact O-CG 3.41Å; A25-K29 PolarHBondContact O-N 3.05Å; K29-A33 WeakPolarHBondContact O-CB 3.28Å; K29-A33 PolarHBondContact O-N 2.8Å; K29-A33 VanDerWaalsContact O-N 3.09Å
30	T	61.2	Low	65.8	Low	87 Å²	87	97.9 Å²	97.9	53%	0.534	56%	0.555	S	S	.	*	H	α-helix	trans	-68.6	-40	175.4	42.6	0	0	0	0	111.6	A26 S27 A33 V34	A26-T30 PolarHBondContact O-N 2.84Å; A26-T30 PolarHBondContact O-OG1 3.02Å; S27-T30 WeakPolarHBondContact CA-OG1 3.3Å; S27-T30 PolarHBondContact O-OG1 2.87Å; S27-T30 VanDerWaalsContact O-OG1 3.07Å; T30-A33 PolarHBondContact O-N 3.3Å; T30-V34 VanDerWaalsContact O-CG2 3.3Å; T30-V34 WeakPolarHBondContact O-CG2 3.33Å; T30-V34 PolarHBondContact O-N 3.26Å; T30-V34 VanDerWaalsContact O-N 3.07Å
31	C	69.9	Low	67.9	Low	67 Å²	67	102.2 Å²	102.2	45%	0.453	56%	0.562	S	S	.	*	H	α-helix	trans	-61.9	-45.3	173.9	-167.4	0	0	0	0	112.3	S27 A33 V34 I35	S27-C31 WeakPolarHBondContact O-CB 3.5Å; S27-C31 PolarHBondContact O-N 3.04Å; C31-A33 PolarHBondContact O-N 3.41Å; C31-V34 PolarHBondContact O-N 2.8Å; C31-I35 VanDerWaalsContact O-CG1 3.29Å; C31-I35 WeakPolarHBondContact O-CG1 3.33Å; C31-I35 PolarHBondContact O-N 2.99Å
32	L	72.9	Confident	69.9	Low	113 Å²	113	96.2 Å²	96.2	59%	0.592	55%	0.552	S	S	*	*	H	α-helix	trans	-62.5	-42.2	177.5	-171.5	72.1	0	0	0	112.3	N28 I35 C36	N28-L32 WeakPolarHBondContact O-CB 3.47Å; N28-L32 PolarHBondContact O-N 2.87Å; N28-L32 VanDerWaalsContact O-N 3.1Å; L32-I35 PolarHBondContact O-N 3.5Å; L32-C36 PolarHBondContact O-N 3.41Å; L32-C36 PolarHBondContact O-SG 2.97Å; L32-C36 VanDerWaalsContact O-SG 3.39Å
33	A	78.6	Confident	72	Confident	53 Å²	53	98.2 Å²	98.2	44%	0.438	55%	0.552	S	S	.	*	H	α-helix	trans	-63	-42.5	177.5	0	0	0	0	0	112	K29 T30 C31 C36 C37	K29-A33 WeakPolarHBondContact O-CB 3.28Å; K29-A33 PolarHBondContact O-N 2.8Å; K29-A33 VanDerWaalsContact O-N 3.09Å; T30-A33 PolarHBondContact O-N 3.3Å; C31-A33 PolarHBondContact O-N 3.41Å; A33-C36 PolarHBondContact O-N 3.36Å; A33-C37 WeakPolarHBondContact O-CB 3.48Å; A33-C37 PolarHBondContact O-N 2.97Å; A33-C37 PolarHBondContact O-SG 2.79Å
34	V	81.9	Confident	74.2	Confident	86 Å²	86	94.6 Å²	94.6	52%	0.521	55%	0.547	S	S	.	.	H	α-helix	trans	-63.5	-42.9	176.8	172.6	0	0	0	0	111	T30 C31 C37 L38	T30-V34 VanDerWaalsContact O-CG2 3.3Å; T30-V34 WeakPolarHBondContact O-CG2 3.33Å; T30-V34 PolarHBondContact O-N 3.26Å; T30-V34 VanDerWaalsContact O-N 3.07Å; C31-V34 PolarHBondContact O-N 2.8Å; V34-C37 PolarHBondContact O-N 3.01Å; V34-L38 HydrophobicContact CG1-CD1 4.02Å; V34-L38 HydrophobicContact CG1-CG 4.39Å; V34-L38 VanDerWaalsContact O-CG 3.29Å; V34-L38 WeakPolarHBondContact O-CG 3.43Å; V34-L38 PolarHBondContact O-N 2.88Å
35	I	84.8	Confident	76.3	Confident	82 Å²	82	90.3 Å²	90.3	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-62.5	-45.2	176.7	-66.4	165	0	0	0	110.7	C31 L32 C37 L38 L39	C31-I35 VanDerWaalsContact O-CG1 3.29Å; C31-I35 WeakPolarHBondContact O-CG1 3.33Å; C31-I35 PolarHBondContact O-N 2.99Å; L32-I35 PolarHBondContact O-N 3.5Å; I35-C37 VanDerWaalsContact C-N 3.34Å; I35-C37 PolarHBondContact O-N 2.97Å; I35-L38 PolarHBondContact O-N 3.28Å; I35-L39 HydrophobicContact CG2-CD1 4.01Å; I35-L39 HydrophobicContact CG2-CG 4.44Å; I35-L39 WeakPolarHBondContact O-CG 3.29Å; I35-L39 PolarHBondContact O-N 2.91Å
36	C	83.5	Confident	78.3	Confident	73 Å²	73	89.4 Å²	89.4	49%	0.493	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-41.2	175.5	-73	0	0	0	0	112.3	L32 A33 L39 S40	L32-C36 PolarHBondContact O-N 3.41Å; L32-C36 PolarHBondContact O-SG 2.97Å; L32-C36 VanDerWaalsContact O-SG 3.39Å; A33-C36 PolarHBondContact O-N 3.36Å; C36-L39 PolarHBondContact O-N 3.38Å; C36-S40 WeakPolarHBondContact O-CB 3.4Å; C36-S40 PolarHBondContact O-N 3.5Å; C36-S40 PolarHBondContact O-OG 3.28Å
37	C	85.5	Confident	80.1	Confident	71 Å²	71	91.3 Å²	91.3	48%	0.48	53%	0.53	S	S	.	.	H	α-helix	trans	-62.2	-46.7	175.1	-71.5	0	0	0	0	111.6	A33 V34 I35 L39 S40 F41	A33-C37 WeakPolarHBondContact O-CB 3.48Å; A33-C37 PolarHBondContact O-N 2.97Å; A33-C37 PolarHBondContact O-SG 2.79Å; V34-C37 PolarHBondContact O-N 3.01Å; I35-C37 VanDerWaalsContact C-N 3.34Å; I35-C37 PolarHBondContact O-N 2.97Å; C37-L39 VanDerWaalsContact C-N 3.34Å; C37-L39 PolarHBondContact O-N 3Å; C37-S40 PolarHBondContact O-N 3.3Å; C37-S40 PolarHBondContact O-OG 3.07Å; C37-F41 WeakPolarHBondContact O-CD2 3.39Å; C37-F41 PolarHBondContact O-N 2.96Å
38	L	88.6	Confident	81.6	Confident	108 Å²	108	90.6 Å²	90.6	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-62.9	-39.3	179	-69.3	173.1	0	0	0	112.6	V34 I35 S42	V34-L38 HydrophobicContact CG1-CD1 4.02Å; V34-L38 HydrophobicContact CG1-CG 4.39Å; V34-L38 VanDerWaalsContact O-CG 3.29Å; V34-L38 WeakPolarHBondContact O-CG 3.43Å; V34-L38 PolarHBondContact O-N 2.88Å; I35-L38 PolarHBondContact O-N 3.28Å; L38-S42 WeakPolarHBondContact O-CB 3.47Å; L38-S42 PolarHBondContact O-N 2.84Å; L38-S42 PolarHBondContact O-OG 3.34Å
39	L	88.4	Confident	82.9	Confident	104 Å²	104	89 Å²	89	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-44.1	175.3	-70.4	173.1	0	0	0	111.5	I35 C36 C37 F41 S42 I43	I35-L39 HydrophobicContact CG2-CD1 4.01Å; I35-L39 HydrophobicContact CG2-CG 4.44Å; I35-L39 WeakPolarHBondContact O-CG 3.29Å; I35-L39 PolarHBondContact O-N 2.91Å; C36-L39 PolarHBondContact O-N 3.38Å; C37-L39 VanDerWaalsContact C-N 3.34Å; C37-L39 PolarHBondContact O-N 3Å; L39-F41 PolarHBondContact O-N 3.46Å; L39-S42 PolarHBondContact O-N 3.01Å; L39-I43 VanDerWaalsContact O-CG1 3.29Å; L39-I43 WeakPolarHBondContact O-CG1 3.3Å; L39-I43 PolarHBondContact O-N 3.48Å
40	S	85.2	Confident	84	Confident	64 Å²	64	88.4 Å²	88.4	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-40.6	177.8	70.6	0	0	0	0	112.4	C36 C37 I43 L44	C36-S40 WeakPolarHBondContact O-CB 3.4Å; C36-S40 PolarHBondContact O-N 3.5Å; C36-S40 PolarHBondContact O-OG 3.28Å; C37-S40 PolarHBondContact O-N 3.3Å; C37-S40 PolarHBondContact O-OG 3.07Å; S40-I43 PolarHBondContact O-N 2.97Å; S40-L44 WeakPolarHBondContact O-CB 3.49Å; S40-L44 PolarHBondContact O-N 2.88Å
41	F	90.7	Very high	85	Confident	152 Å²	152	89.8 Å²	89.8	67%	0.667	52%	0.52	S	S	*	.	H	α-helix	trans	-64.1	-41.8	175.1	-98.5	-80.1	0	0	0	112	C37 L39 I43 L44 A45	C37-F41 WeakPolarHBondContact O-CD2 3.39Å; C37-F41 PolarHBondContact O-N 2.96Å; L39-F41 PolarHBondContact O-N 3.46Å; F41-I43 VanDerWaalsContact C-N 3.34Å; F41-I43 PolarHBondContact O-N 3.25Å; F41-L44 PolarHBondContact O-N 2.84Å; F41-A45 VanDerWaalsContact O-CB 3.3Å; F41-A45 WeakPolarHBondContact O-CB 3.34Å; F41-A45 PolarHBondContact O-N 3.04Å
42	S	88.4	Confident	85.2	Confident	81 Å²	81	92.6 Å²	92.6	57%	0.566	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-41	177.9	-59.9	0	0	0	0	111.8	L38 L39 G46	L38-S42 WeakPolarHBondContact O-CB 3.47Å; L38-S42 PolarHBondContact O-N 2.84Å; L38-S42 PolarHBondContact O-OG 3.34Å; L39-S42 PolarHBondContact O-N 3.01Å; S42-G46 PolarHBondContact O-N 3.39Å
43	I	91.3	Very high	85.4	Confident	111 Å²	111	96.1 Å²	96.1	57%	0.569	53%	0.534	S	S	*	.	H	α-helix	trans	-66.4	-45.2	176.3	-65.8	164.4	0	0	0	110.6	L39 S40 F41 A45 G46 L47	L39-I43 VanDerWaalsContact O-CG1 3.29Å; L39-I43 WeakPolarHBondContact O-CG1 3.3Å; L39-I43 PolarHBondContact O-N 3.48Å; S40-I43 PolarHBondContact O-N 2.97Å; F41-I43 VanDerWaalsContact C-N 3.34Å; F41-I43 PolarHBondContact O-N 3.25Å; I43-A45 PolarHBondContact O-N 2.89Å; I43-G46 PolarHBondContact O-N 2.95Å; I43-L47 HydrophobicContact CG2-CD1 3.94Å; I43-L47 HydrophobicContact CG2-CG 4.45Å; I43-L47 WeakPolarHBondContact O-CG 3.39Å; I43-L47 PolarHBondContact O-N 2.92Å
44	L	91	Very high	84.6	Confident	118 Å²	118	95.8 Å²	95.8	62%	0.618	54%	0.536	S	S	*	.	H	α-helix	trans	-64.6	-40.9	-180	-155.9	77.6	0	0	0	111.6	S40 F41 L47 S48	S40-L44 WeakPolarHBondContact O-CB 3.49Å; S40-L44 PolarHBondContact O-N 2.88Å; F41-L44 PolarHBondContact O-N 2.84Å; L44-L47 PolarHBondContact O-N 2.59Å; L44-S48 WeakPolarHBondContact O-CB 3.47Å; L44-S48 PolarHBondContact O-N 3.33Å; L44-S48 PolarHBondContact O-OG 3.42Å
45	A	90.4	Very high	83.7	Confident	52 Å²	52	99 Å²	99	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-44.2	174	0	0	0	0	0	111.4	F41 I43 S48 T49	F41-A45 VanDerWaalsContact O-CB 3.3Å; F41-A45 WeakPolarHBondContact O-CB 3.34Å; F41-A45 PolarHBondContact O-N 3.04Å; I43-A45 PolarHBondContact O-N 2.89Å; A45-S48 PolarHBondContact O-N 3.26Å; A45-S48 PolarHBondContact O-OG 3.48Å; A45-T49 WeakPolarHBondContact O-CG2 3.41Å; A45-T49 PolarHBondContact O-N 2.91Å; A45-T49 PolarHBondContact O-OG1 3.39Å
46	G	89.8	Confident	82.3	Confident	36 Å²	36	102.3 Å²	102.3	37%	0.371	56%	0.563	S	S	.	*	H	α-helix	trans	-60.3	-44.7	174.7	0	0	0	0	0	113.4	S42 I43 T49 F50	S42-G46 PolarHBondContact O-N 3.39Å; I43-G46 PolarHBondContact O-N 2.95Å; G46-T49 WeakPolarHBondContact CA-OG1 3.34Å; G46-T49 PolarHBondContact O-N 2.96Å; G46-T49 PolarHBondContact O-OG1 3.32Å; G46-F50 WeakPolarHBondContact O-CB 3.3Å; G46-F50 PolarHBondContact O-N 3.45Å
47	L	87.3	Confident	81	Confident	98 Å²	98	106.2 Å²	106.2	51%	0.513	57%	0.574	S	S	.	*	H	α-helix	trans	-65.7	-41.9	176.8	-71.9	169	0	0	0	111.9	I43 L44 T49 F50 L51	I43-L47 HydrophobicContact CG2-CD1 3.94Å; I43-L47 HydrophobicContact CG2-CG 4.45Å; I43-L47 WeakPolarHBondContact O-CG 3.39Å; I43-L47 PolarHBondContact O-N 2.92Å; L44-L47 PolarHBondContact O-N 2.59Å; L47-T49 PolarHBondContact O-N 3.42Å; L47-F50 PolarHBondContact O-N 3.02Å; L47-L51 WeakPolarHBondContact O-CB 3.29Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 2.91Å
48	S	85.3	Confident	79.1	Confident	61 Å²	61	106 Å²	106	43%	0.427	58%	0.577	S	S	.	*	H	α-helix	trans	-63.2	-42.4	177.4	73.4	0	0	0	0	112	L44 A45 L51 M52	L44-S48 WeakPolarHBondContact O-CB 3.47Å; L44-S48 PolarHBondContact O-N 3.33Å; L44-S48 PolarHBondContact O-OG 3.42Å; A45-S48 PolarHBondContact O-N 3.26Å; A45-S48 PolarHBondContact O-OG 3.48Å; S48-L51 PolarHBondContact O-N 2.69Å; S48-M52 WeakPolarHBondContact O-CB 3.32Å; S48-M52 VanDerWaalsContact O-CG 3.28Å; S48-M52 WeakPolarHBondContact O-CG 3.43Å; S48-M52 PolarHBondContact O-N 3.13Å
49	T	85.4	Confident	77.1	Confident	90 Å²	90	106.7 Å²	106.7	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-68.4	-36.8	177	52.5	0	0	0	0	112.1	A45 G46 L47 R53	A45-T49 WeakPolarHBondContact O-CG2 3.41Å; A45-T49 PolarHBondContact O-N 2.91Å; A45-T49 PolarHBondContact O-OG1 3.39Å; G46-T49 WeakPolarHBondContact CA-OG1 3.34Å; G46-T49 PolarHBondContact O-N 2.96Å; G46-T49 PolarHBondContact O-OG1 3.32Å; L47-T49 PolarHBondContact O-N 3.42Å; T49-R53 WeakPolarHBondContact O-CB 3.29Å; T49-R53 PolarHBondContact O-N 3.46Å
50	F	84.9	Confident	75	Confident	149 Å²	149	104.6 Å²	104.6	65%	0.654	59%	0.592	S	S	*	*	H	α-helix	trans	-64	-45.1	173.3	-179.8	-99.1	0	0	0	112.2	G46 L47 R53 G54	G46-F50 WeakPolarHBondContact O-CB 3.3Å; G46-F50 PolarHBondContact O-N 3.45Å; L47-F50 PolarHBondContact O-N 3.02Å; F50-R53 PolarHBondContact O-N 3.42Å; F50-G54 PolarHBondContact O-N 3.07Å
51	L	80.7	Confident	72.9	Confident	116 Å²	116	110.9 Å²	110.9	61%	0.607	61%	0.611	S	S	*	*	H	α-helix	trans	-64.3	-41.9	177.3	-70.8	172.7	0	0	0	111.7	L47 S48 R53 G54 Q55	L47-L51 WeakPolarHBondContact O-CB 3.29Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 2.91Å; S48-L51 PolarHBondContact O-N 2.69Å; L51-R53 VanDerWaalsContact C-N 3.35Å; L51-R53 PolarHBondContact O-N 3.25Å; L51-G54 PolarHBondContact O-N 3.27Å; L51-Q55 WeakPolarHBondContact O-CG 3.41Å; L51-Q55 PolarHBondContact O-N 2.91Å
52	M	75.8	Confident	70.1	Confident	127 Å²	127	110.9 Å²	110.9	63%	0.626	62%	0.618	S	S	*	*	H	α-helix	trans	-65.6	-37.4	175.2	-68.4	-59.7	-73.6	0	0	111.9	S48 Q55 L56	S48-M52 WeakPolarHBondContact O-CB 3.32Å; S48-M52 VanDerWaalsContact O-CG 3.28Å; S48-M52 WeakPolarHBondContact O-CG 3.43Å; S48-M52 PolarHBondContact O-N 3.13Å; M52-Q55 PolarHBondContact O-N 3.34Å; M52-L56 WeakPolarHBondContact O-CD1 3.45Å; M52-L56 PolarHBondContact O-N 2.96Å
53	R	75.6	Confident	68	Low	186 Å²	186	113.2 Å²	113.2	70%	0.702	63%	0.633	S	S	*	*	H	α-helix	trans	-67.8	-37.4	174.1	-164.9	174.1	-137.8	-158.2	3	112.4	T49 F50 L51 Q55 L56 Q57	T49-R53 WeakPolarHBondContact O-CB 3.29Å; T49-R53 PolarHBondContact O-N 3.46Å; F50-R53 PolarHBondContact O-N 3.42Å; L51-R53 VanDerWaalsContact C-N 3.35Å; L51-R53 PolarHBondContact O-N 3.25Å; R53-Q55 VanDerWaalsContact C-N 3.32Å; R53-L56 PolarHBondContact O-N 3.43Å; R53-Q57 PolarHBondContact O-N 3.46Å
54	G	63	Low	65.2	Low	46 Å²	46	111.7 Å²	111.7	47%	0.474	64%	0.636	S	S	.	*	H	α-helix	trans	-64.5	-34.5	174.1	0	0	0	0	0	113	F50 L51	F50-G54 PolarHBondContact O-N 3.07Å; L51-G54 PolarHBondContact O-N 3.27Å
55	Q	61.8	Low	62.8	Low	154 Å²	154	114.1 Å²	114.1	72%	0.72	65%	0.649	S	S	*	*	H	α-helix	trans	-75	-30.9	173.8	-67.1	-69.9	4.4	0	0	113	L51 M52 R53 Q57	L51-Q55 WeakPolarHBondContact O-CG 3.41Å; L51-Q55 PolarHBondContact O-N 2.91Å; M52-Q55 PolarHBondContact O-N 3.34Å; R53-Q55 VanDerWaalsContact C-N 3.32Å; Q55-Q57 PolarHBondContact O-N 3.29Å
56	L	56.4	Low	59.9	Low	152 Å²	152	121.9 Å²	121.9	80%	0.796	67%	0.667	S	S	*	*	H	α-helix	trans	-74.5	-11.7	175.1	-94.8	142.7	0	0	0	113.9	M52 R53	M52-L56 WeakPolarHBondContact O-CD1 3.45Å; M52-L56 PolarHBondContact O-N 2.96Å; R53-L56 PolarHBondContact O-N 3.43Å
57	Q	54.8	Low	57.7	Low	155 Å²	155	124.7 Å²	124.7	72%	0.724	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	27.4	-176.6	-145.5	164.4	0.4	0	0	112.7	R53 Q55 P59	R53-Q57 PolarHBondContact O-N 3.46Å; Q55-Q57 PolarHBondContact O-N 3.29Å; Q57-P59 WeakPolarHBondContact O-CD 3.44Å
58	A	45.7	Very low	55.2	Low	65 Å²	65	127.1 Å²	127.1	54%	0.537	70%	0.699	S	S	.	*	S	Bend	trans	-87.9	114.6	154.7	0	0	0	0	0	107.7	G60	A58-G60 PolarHBondContact O-N 3.44Å
59	P	46.5	Very low	52.9	Low	124 Å²	124	132 Å²	132	81%	0.805	72%	0.715	S	S	*	*			trans	-68.4	87.8	168.7	-4	19.7	0	0	0	107.6	Q57 K61	Q57-P59 WeakPolarHBondContact O-CD 3.44Å; P59-K61 VanDerWaalsContact C-N 3.35Å; P59-K61 PolarHBondContact O-N 3.35Å
60	G	45.6	Very low	50.9	Low	60 Å²	60	136.6 Å²	136.6	62%	0.619	73%	0.73	S	S	*	*			trans	-60	102.9	159.5	0	0	0	0	0	106.9	A58 D62	A58-G60 PolarHBondContact O-N 3.44Å; G60-D62 PolarHBondContact O-N 2.95Å
61	K	40.4	Very low	48.8	Very low	196 Å²	196	137.9 Å²	137.9	85%	0.852	74%	0.738	S	S	*	*			trans	-65.1	90.2	164.1	-79.7	179.7	172.9	176.9	0	106.8	P59 C63	P59-K61 VanDerWaalsContact C-N 3.35Å; P59-K61 PolarHBondContact O-N 3.35Å; K61-C63 PolarHBondContact O-N 2.73Å
62	D	32.4	Very low	47.1	Very low	152 Å²	152	140.4 Å²	140.4	81%	0.813	75%	0.752	S	S	*	*			trans	-62.2	104.1	164.2	-77.4	-31.9	0	0	0	107.8	G60 A64	G60-D62 PolarHBondContact O-N 2.95Å; D62-A64 PolarHBondContact O-N 3.36Å
63	C	43	Very low	45.2	Very low	130 Å²	130	142.3 Å²	142.3	88%	0.878	76%	0.764	S	S	*	*			trans	-69	74.1	157.4	-78.1	0	0	0	0	107.9	K61 L65	K61-C63 PolarHBondContact O-N 2.73Å; C63-L65 PolarHBondContact O-N 3.26Å; C63-L65 VanDerWaalsContact O-N 3.13Å
64	A	34.5	Very low	43.7	Very low	78 Å²	78	142.2 Å²	142.2	65%	0.645	77%	0.772	S	S	*	*			trans	-67.6	106.8	164.2	0	0	0	0	0	107.7	D62 R66	D62-A64 PolarHBondContact O-N 3.36Å; A64-R66 PolarHBondContact O-N 2.95Å
65	L	39.5	Very low	42.6	Very low	169 Å²	169	146.9 Å²	146.9	89%	0.885	79%	0.791	S	S	*	*			trans	-64.2	86.4	167.6	-165.5	127.4	0	0	0	107.8	C63 A67	C63-L65 PolarHBondContact O-N 3.26Å; C63-L65 VanDerWaalsContact O-N 3.13Å; L65-A67 PolarHBondContact O-N 3.4Å; L65-A67 VanDerWaalsContact O-N 3.14Å
66	R	30.2	Very low	41.7	Very low	216 Å²	216	144 Å²	144	82%	0.815	79%	0.788	S	S	*	*			trans	-69.4	106.2	165.3	-82	-173	174.2	-177.8	-1.3	107.1	A64 I68	A64-R66 PolarHBondContact O-N 2.95Å; R66-I68 HydrophobicContact CB-CG1 4.32Å; R66-I68 PolarHBondContact O-N 2.91Å
67	A	42.3	Very low	41.4	Very low	95 Å²	95	142.2 Å²	142.2	79%	0.785	79%	0.786	S	S	*	*			trans	-53.1	108	155	0	0	0	0	0	107.4	L65	L65-A67 PolarHBondContact O-N 3.4Å; L65-A67 VanDerWaalsContact O-N 3.14Å
68	I	36.4	Very low	41	Very low	148 Å²	148	143 Å²	143	76%	0.759	79%	0.789	S	S	*	*			trans	-98	102.3	170.6	-67	179.7	0	0	0	106.7	R66	R66-I68 HydrophobicContact CB-CG1 4.32Å; R66-I68 PolarHBondContact O-N 2.91Å
69	Q	35.7	Very low	41.3	Very low	163 Å²	163	145.6 Å²	145.6	76%	0.762	80%	0.801	S	S	*	*			trans	-16.7	126.7	144.7	-159.2	103.3	-10	0	0	113.2	Q71	Q69-Q71 PolarHBondContact O-N 2.73Å; Q69-Q71 VanDerWaalsContact O-N 3.14Å
70	E	43	Very low	41.5	Very low	188 Å²	188	145.5 Å²	145.5	88%	0.879	80%	0.798	S	S	*	*			trans	-50.1	116.3	165	-69.1	176.2	149.6	0	0	110.3
71	Q	41.5	Very low	42	Very low	176 Å²	176	152 Å²	152	82%	0.822	81%	0.805	S	S	*	*			trans	-161.3	121	152.4	-108.5	165.3	29.6	0	0	110.4	Q69	Q69-Q71 PolarHBondContact O-N 2.73Å; Q69-Q71 VanDerWaalsContact O-N 3.14Å
72	N	45.5	Very low	42.7	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	80%	0.796	S	S	*	*			trans	-20.6	124.8	175.5	-64.5	-53.4	0	0	0	116.5
73	L	35.8	Very low	44	Very low	168 Å²	168	145.8 Å²	145.8	88%	0.88	79%	0.791	S	S	*	*			trans	-132	126.3	166.5	-160.7	73.1	0	0	0	110.6
74	E	42.8	Very low	45.3	Very low	183 Å²	183	143.9 Å²	143.9	86%	0.855	78%	0.779	S	S	*	*			trans	-49.5	144.6	172.5	-71.7	170.7	127.2	0	0	112.9	S76	E74-S76 PolarHBondContact O-N 2.77Å
75	T	39.8	Very low	47.6	Very low	144 Å²	144	147.6 Å²	147.6	88%	0.883	78%	0.776	S	S	*	*			trans	-62.6	99	-176.2	-47.7	0	0	0	0	112.4
76	S	43.2	Very low	50.2	Low	93 Å²	93	142.4 Å²	142.4	65%	0.65	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.1	142.2	157.2	-179.8	0	0	0	0	109.4	E74 Q78	E74-S76 PolarHBondContact O-N 2.77Å; S76-Q78 PolarHBondContact O-N 3.44Å; S76-Q78 VanDerWaalsContact O-N 3.08Å
77	P	49.8	Very low	53.3	Low	116 Å²	116	136.1 Å²	136.1	75%	0.753	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-60.8	118.4	176.3	-11.4	23.1	0	0	0	108.8
78	Q	47.3	Very low	56	Low	171 Å²	171	131.6 Å²	131.6	80%	0.799	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-60.7	140.3	170.7	-69	-154.2	-28.5	0	0	109	S76 V80	S76-Q78 PolarHBondContact O-N 3.44Å; S76-Q78 VanDerWaalsContact O-N 3.08Å; Q78-V80 PolarHBondContact O-N 2.85Å
79	P	51.6	Low	59	Low	120 Å²	120	130 Å²	130	78%	0.779	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-58.6	117.6	164.2	25.5	-29.7	0	0	0	106.2	Y81	P79-Y81 PolarHBondContact O-N 2.87Å
80	V	52.2	Low	62	Low	122 Å²	122	122.3 Å²	122.3	74%	0.739	65%	0.648	S	S	*	*			trans	-54.1	107.8	170.2	177	0	0	0	0	105.8	Q78 T82	Q78-V80 PolarHBondContact O-N 2.85Å; V80-T82 HydrophobicContact CG1-CG2 4.34Å; V80-T82 PolarHBondContact O-N 3.4Å
81	Y	54.4	Low	64.6	Low	196 Å²	196	114.9 Å²	114.9	77%	0.769	61%	0.613	S	S	*	*			trans	-68.1	86.1	169.6	-173.5	-96.3	0	0	0	106	P79 P83	P79-Y81 PolarHBondContact O-N 2.87Å; Y81-P83 WeakPolarHBondContact O-CD 3.48Å
82	T	55.1	Low	67.4	Low	108 Å²	108	106.5 Å²	106.5	66%	0.663	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-61	121.9	163	32	0	0	0	0	105.8	V80 S84	V80-T82 HydrophobicContact CG1-CG2 4.34Å; V80-T82 PolarHBondContact O-N 3.4Å; T82-S84 PolarHBondContact O-N 3.28Å
83	P	59.8	Low	69.9	Low	109 Å²	109	98.7 Å²	98.7	71%	0.708	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-55.1	119.1	175.7	20	-29.6	0	0	0	107.5	Y81 R85	Y81-P83 WeakPolarHBondContact O-CD 3.48Å; P83-R85 PolarHBondContact O-N 3.46Å; P83-R85 VanDerWaalsContact O-N 3.07Å
84	S	71.3	Confident	72.9	Confident	90 Å²	90	91.3 Å²	91.3	63%	0.629	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-49.6	122	175.3	172.8	0	0	0	0	107.8	T82 A86	T82-S84 PolarHBondContact O-N 3.28Å; S84-A86 PolarHBondContact O-N 3.19Å
85	R	82.5	Confident	75.5	Confident	156 Å²	156	85.8 Å²	85.8	59%	0.589	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-49.1	132.3	175.3	-177.5	-175.8	179.8	173.9	8.6	108.8	P83 K87 E136	P83-R85 PolarHBondContact O-N 3.46Å; P83-R85 VanDerWaalsContact O-N 3.07Å; R85-K87 PolarHBondContact O-N 3.07Å; R85-K87 VanDerWaalsContact O-N 3.13Å; R85-E136 IonicContact CZ-OE1 3.27Å; R85-E136 IonicContact CZ-OE2 3.94Å; R85-E136 IonicContact NE-OE1 2.8Å; R85-E136 IonicContact NE-OE2 3.42Å; R85-E136 PolarHBondContact NE-OE2 3.2Å; R85-E136 IonicContact NH1-OE1 3.43Å; R85-E136 PolarHBondContact NH1-OE1 3.48Å; R85-E136 IonicContact NH1-OE2 3.55Å; R85-E136 VanDerWaalsContact NH2-CD 3.26Å; R85-E136 IonicContact NH2-OE1 2.8Å; R85-E136 PolarHBondContact NH2-OE1 2.79Å; R85-E136 IonicContact NH2-OE2 3.25Å; R85-E136 PolarHBondContact NH2-OE2 3.44Å
86	A	93.1	Very high	78.1	Confident	60 Å²	60	86.4 Å²	86.4	50%	0.496	46%	0.46	S	S	.	.			trans	-67.6	112.4	179.6	0	0	0	0	0	109.5	S84 N123	S84-A86 PolarHBondContact O-N 3.19Å; A86-N123 HydrophobicContact CB-CB 4.34Å; A86-N123 WeakPolarHBondContact CB-OD1 3.49Å
87	K	97.1	Very high	80.4	Confident	84 Å²	84	82.6 Å²	82.6	37%	0.365	43%	0.432	S	S	.	.			trans	-78.1	134.5	-174	-63.7	-165.9	-173.4	-164.5	0	112.1	R85 R89 N123 L243 L244	R85-K87 PolarHBondContact O-N 3.07Å; R85-K87 VanDerWaalsContact O-N 3.13Å; K87-R89 PolarHBondContact O-N 2.77Å; K87-N123 WeakPolarHBondContact O-CB 3.24Å; K87-N123 PolarHBondContact O-ND2 3.01Å; K87-L243 HydrophobicContact CB-CB 4.21Å; K87-L243 WeakPolarHBondContact CD-O 3.34Å; K87-L244 PolarHBondContact NZ-O 3.22Å; K87-L244 PolarHBondContact NZ-OXT 3.43Å
88	P	98.4	Very high	82.1	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	42%	0.424	C	S	.	.			trans	-52.2	132.9	173.4	-27.2	35.3	0	0	0	112.2	M125 P135 E136 Y140 F242 L243	P88-M125 HydrophobicContact CB-CB 4.39Å; P88-M125 HydrophobicContact CB-CE 3.72Å; P88-P135 HydrophobicContact CB-CG 3.69Å; P88-P135 HydrophobicContact CG-CG 3.7Å; P88-E136 HydrophobicContact CG-CB 4.14Å; P88-Y140 HydrophobicContact CB-CE1 4.19Å; P88-F242 WeakPolarHBondContact O-CA 3Å; P88-L243 HydrophobicContact CG-CD2 4.38Å; P88-L243 PolarHBondContact O-N 3Å
89	R	98.7	Very high	83.2	Confident	115 Å²	115	79.4 Å²	79.4	43%	0.434	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	146.3	-179.8	56	179.8	178.5	-175.7	-0.9	112.2	K87 F120 K122 A241 F242	K87-R89 PolarHBondContact O-N 2.77Å; R89-F120 HydrophobicContact CB-CE2 4.41Å; R89-F120 HydrophobicContact CG-CE2 3.99Å; R89-K122 HydrophobicContact CG-CB 4.05Å; R89-K122 PolarHBondContact N-O 3.1Å; R89-K122 PolarHBondContact O-N 3.09Å; R89-A241 CarbonylContact C-O 3.56Å; R89-A241 WeakPolarHBondContact CA-O 3.3Å; R89-F242 HydrophobicContact CB-CB 3.77Å
90	A	98.8	Very high	84	Confident	2 Å²	2	76.7 Å²	76.7	2%	0.017	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	150.4	170.8	0	0	0	0	0	111.9	L92 F120 T121 M125 L132 G240 A241	A90-L92 HydrophobicContact CB-CD2 4.21Å; A90-F120 CarbonylContact C-O 3.59Å; A90-F120 WeakPolarHBondContact CA-O 3.28Å; A90-F120 WeakPolarHBondContact CB-O 3.35Å; A90-T121 HydrophobicContact CB-CG2 3.97Å; A90-M125 HydrophobicContact CB-CG 3.62Å; A90-L132 HydrophobicContact CB-CD1 3.73Å; A90-L132 HydrophobicContact CB-CD2 4.17Å; A90-G240 VanDerWaalsContact O-CA 3.23Å; A90-G240 WeakPolarHBondContact O-CA 3.41Å; A90-A241 PolarHBondContact N-O 3.04Å; A90-A241 PolarHBondContact O-N 3.02Å; A90-A241 VanDerWaalsContact O-N 3.1Å
91	H	98.9	Very high	84.6	Confident	31 Å²	31	76.9 Å²	76.9	14%	0.144	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.5	164	-176.3	80.7	0	0	0	106.8	L118 A119 F120 Y143 F238	H91-L118 PolarHBondContact CD2-O 2.6Å; H91-A119 CarbonylContact O-C 3.58Å; H91-A119 WeakPolarHBondContact O-CA 3.38Å; H91-F120 HydrophobicContact CB-CD1 3.99Å; H91-F120 HydrophobicContact CB-CE1 3.55Å; H91-F120 HydrophobicContact CB-CZ 3.95Å; H91-F120 PolarHBondContact N-O 3.39Å; H91-F120 PolarHBondContact O-N 2.85Å; H91-Y143 AromaticContact ND1-CE2 3.73Å; H91-Y143 AromaticContact ND1-CZ 3.76Å; H91-Y143 PolarHBondContact ND1-OH 2.91Å; H91-F238 AromaticContact CE1-CD2 3.76Å; H91-F238 AromaticContact CE1-CG 3.73Å
92	L	98.9	Very high	84.9	Confident	0 Å²	0	73 Å²	73	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.5	-175.9	-46.3	-179.4	0	0	0	108.7	A90 W112 E113 H114 T121 Y127 L132 F238 F239	A90-L92 HydrophobicContact CB-CD2 4.21Å; L92-W112 HydrophobicContact CB-CB 3.73Å; L92-W112 HydrophobicContact CB-CD2 4.33Å; L92-W112 HydrophobicContact CB-CE3 4.35Å; L92-W112 HydrophobicContact CB-CG 4.1Å; L92-W112 HydrophobicContact CD1-CB 4.07Å; L92-W112 HydrophobicContact CD1-CG 4.19Å; L92-E113 VanDerWaalsContact CA-O 3.3Å; L92-E113 WeakPolarHBondContact CA-O 3.46Å; L92-E113 WeakPolarHBondContact CB-O 3.33Å; L92-H114 HydrophobicContact CD2-CB 3.61Å; L92-T121 HydrophobicContact CD2-CG2 3.91Å; L92-Y127 HydrophobicContact CD1-CD2 3.53Å; L92-Y127 HydrophobicContact CD1-CE2 3.99Å; L92-Y127 HydrophobicContact CD1-CG 4.11Å; L92-L132 HydrophobicContact CD1-CB 4.48Å; L92-L132 HydrophobicContact CD1-CD1 4.3Å; L92-F238 CarbonylContact O-C 3.55Å; L92-F238 WeakPolarHBondContact O-CA 3.38Å; L92-F238 VanDerWaalsContact O-CB 3.3Å; L92-F238 WeakPolarHBondContact O-CB 3.46Å; L92-F239 WeakPolarHBondContact CA-O 3.42Å; L92-F239 VanDerWaalsContact CB-O 3.32Å; L92-F239 WeakPolarHBondContact CB-O 3.34Å; L92-F239 HydrophobicContact CD1-CD1 3.85Å; L92-F239 HydrophobicContact CD1-CE1 4.25Å; L92-F239 PolarHBondContact N-O 3.39Å; L92-F239 PolarHBondContact O-N 2.89Å
93	T	98.8	Very high	85.3	Confident	4 Å²	4	74.5 Å²	74.5	3%	0.025	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	156.9	-175.5	64.4	0	0	0	0	110.7	L95 W112 E113 L118 A119 E234	T93-L95 PolarHBondContact O-N 2.99Å; T93-W112 CarbonylContact O-C 3.58Å; T93-W112 WeakPolarHBondContact O-CA 3.37Å; T93-E113 PolarHBondContact N-O 3.37Å; T93-E113 VanDerWaalsContact N-O 3.09Å; T93-E113 PolarHBondContact O-N 3.47Å; T93-L118 HydrophobicContact CG2-CB 4.25Å; T93-A119 HydrophobicContact CG2-CB 4.15Å; T93-E234 HydrophobicContact CG2-CB 3.82Å
94	I	98.2	Very high	85.4	Confident	13 Å²	13	78.7 Å²	78.7	7%	0.067	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	134.6	-169.9	-168.7	58.1	0	0	0	113	Q97 L110 W112 V229 T237	I94-Q97 HydrophobicContact CD1-CG 4.44Å; I94-Q97 VanDerWaalsContact CD1-NE2 3.3Å; I94-L110 HydrophobicContact CD1-CD1 4.45Å; I94-W112 HydrophobicContact CB-CZ3 4.41Å; I94-W112 HydrophobicContact CD1-CZ3 4.32Å; I94-V229 HydrophobicContact CD1-CG1 4.16Å; I94-V229 HydrophobicContact CG1-CG1 4.35Å; I94-T237 HydrophobicContact CB-CG2 3.69Å; I94-T237 WeakPolarHBondContact CB-O 3.36Å; I94-T237 HydrophobicContact CD1-CG2 3.82Å; I94-T237 HydrophobicContact CG1-CG2 3.77Å; I94-T237 HydrophobicContact CG2-CG2 4.36Å; I94-T237 PolarHBondContact N-O 3.07Å; I94-T237 VanDerWaalsContact N-O 3.09Å
95	L	96.8	Very high	85.2	Confident	67 Å²	67	82.8 Å²	82.8	35%	0.351	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-96.7	163.7	164.4	-74.8	173.2	0	0	0	111.4	T93 Q97 W112 E113 Y231	T93-L95 PolarHBondContact O-N 2.99Å; L95-Q97 PolarHBondContact O-N 2.86Å; L95-Q97 VanDerWaalsContact O-N 3.15Å; L95-Q97 PolarHBondContact O-NE2 2.89Å; L95-W112 VanDerWaalsContact CD1-C 3.45Å; L95-W112 WeakPolarHBondContact CD1-O 3.34Å; L95-E113 HydrophobicContact CD1-CB 4.43Å; L95-E113 HydrophobicContact CD2-CB 3.83Å; L95-E113 HydrophobicContact CG-CB 3.87Å; L95-Y231 WeakPolarHBondContact O-CB 3.42Å
96	K	94.9	Very high	85	Confident	157 Å²	157	81.9 Å²	81.9	68%	0.683	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-60.4	120.2	165.2	-175.5	179.2	179.8	-176.5	0	109.1	Y231	K96-Y231 HydrophobicContact CB-CD2 4.07Å; K96-Y231 HydrophobicContact CB-CE2 4.37Å; K96-Y231 HydrophobicContact CD-CE2 4.38Å; K96-Y231 HydrophobicContact CG-CD2 4.1Å; K96-Y231 HydrophobicContact CG-CE2 3.94Å
97	Q	93.1	Very high	84.9	Confident	13 Å²	13	83.1 Å²	83.1	6%	0.061	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-78.3	141.1	-179.1	-56.5	-57.5	-59.1	0	0	110.9	I94 L95 L110 H111 I226	I94-Q97 HydrophobicContact CD1-CG 4.44Å; I94-Q97 VanDerWaalsContact CD1-NE2 3.3Å; L95-Q97 PolarHBondContact O-N 2.86Å; L95-Q97 VanDerWaalsContact O-N 3.15Å; L95-Q97 PolarHBondContact O-NE2 2.89Å; Q97-L110 HydrophobicContact CG-CD2 3.9Å; Q97-H111 PolarHBondContact NE2-O 2.9Å; Q97-I226 HydrophobicContact CB-CG2 3.41Å; Q97-I226 VanDerWaalsContact CB-CG2 3.41Å; Q97-I226 HydrophobicContact CG-CG2 3.93Å
98	T	84.5	Confident	84.7	Confident	95 Å²	95	80.5 Å²	80.5	58%	0.583	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-83.3	124.5	168.3	41.9	0	0	0	0	109.1	A100	T98-A100 PolarHBondContact O-N 2.95Å
99	P	70.6	Confident	84.6	Confident	125 Å²	125	81.1 Å²	81.1	81%	0.812	42%	0.421	S	S	*	.			trans	-62.5	113.9	174.2	-19.2	31.2	0	0	0	109.2
100	A	67.1	Low	84.5	Confident	64 Å²	64	75.6 Å²	75.6	53%	0.529	40%	0.4	S	S	.	.			trans	-100	149.7	168.8	0	0	0	0	0	108.9	T98 Q102	T98-A100 PolarHBondContact O-N 2.95Å; A100-Q102 PolarHBondContact O-N 3.08Å; A100-Q102 VanDerWaalsContact O-N 3.07Å
101	P	65.1	Low	84.4	Confident	125 Å²	125	78.3 Å²	78.3	81%	0.812	41%	0.412	S	S	*	.			trans	-55	119.2	172.6	-18.3	29.3	0	0	0	108.9	M103	P101-M103 PolarHBondContact O-N 2.87Å; P101-M103 VanDerWaalsContact O-N 3.1Å
102	Q	62.3	Low	84.4	Confident	114 Å²	114	77 Å²	77	53%	0.533	41%	0.406	S	S	.	.			trans	-66.4	113.3	174.1	-76.3	-171.2	-18.9	0	0	108.4	A100	A100-Q102 PolarHBondContact O-N 3.08Å; A100-Q102 VanDerWaalsContact O-N 3.07Å
103	M	63.3	Low	84.4	Confident	141 Å²	141	78.4 Å²	78.4	70%	0.695	41%	0.413	S	S	*	.			trans	-71.3	131.7	165.2	-69.2	-148.7	169.2	0	0	108.4	P101 N105 Q106	P101-M103 PolarHBondContact O-N 2.87Å; P101-M103 VanDerWaalsContact O-N 3.1Å; M103-N105 PolarHBondContact O-N 2.96Å; M103-Q106 PolarHBondContact O-N 2.93Å
104	K	60.6	Low	84.4	Confident	197 Å²	197	80.5 Å²	80.5	86%	0.857	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	130.5	176.2	-79.8	-176.1	176.3	179.2	0	108.9
105	N	66.9	Low	84.3	Confident	175 Å²	175	86.5 Å²	86.5	94%	0.936	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	15.6	178	-50	-21.9	0	0	0	116.9	M103	M103-N105 PolarHBondContact O-N 2.96Å
106	Q	80.1	Confident	84.4	Confident	138 Å²	138	88.8 Å²	88.8	65%	0.645	46%	0.462	S	S	*	.			trans	-124.6	126.6	172.3	-161	171.7	41.6	0	0	111.9	M103 P108	M103-Q106 PolarHBondContact O-N 2.93Å; Q106-P108 WeakPolarHBondContact O-CD 3.5Å
107	F	90.5	Very high	84.5	Confident	86 Å²	86	84.6 Å²	84.6	38%	0.377	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-79.2	118.8	174.6	-68.1	-17.3	0	0	0	110.2	V171 V173 N222 V223	F107-V171 HydrophobicContact CD2-CG1 4.4Å; F107-V171 HydrophobicContact CE2-CB 3.91Å; F107-V171 HydrophobicContact CE2-CG1 3.58Å; F107-V171 HydrophobicContact CE2-CG2 4.43Å; F107-V171 HydrophobicContact CZ-CB 4.03Å; F107-V171 HydrophobicContact CZ-CG1 4.12Å; F107-V171 HydrophobicContact CZ-CG2 4.13Å; F107-V173 HydrophobicContact CD2-CG2 3.76Å; F107-V173 HydrophobicContact CE2-CG2 3.95Å; F107-N222 HydrophobicContact CB-CB 3.7Å; F107-N222 PolarHBondContact O-ND2 3.26Å; F107-V223 WeakPolarHBondContact CB-O 3.39Å
108	P	92.9	Very high	84.8	Confident	29 Å²	29	88.6 Å²	88.6	19%	0.188	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-68.3	142.8	-179	31	-41.2	0	0	0	112	Q106 N222 V223 I226	Q106-P108 WeakPolarHBondContact O-CD 3.5Å; P108-N222 WeakPolarHBondContact O-CA 3.38Å; P108-V223 VanDerWaalsContact CD-O 3.26Å; P108-V223 WeakPolarHBondContact CD-O 3.2Å; P108-V223 PolarHBondContact O-N 2.92Å; P108-V223 VanDerWaalsContact O-N 3.15Å; P108-I226 HydrophobicContact CB-CD1 3.46Å; P108-I226 VanDerWaalsContact CB-CD1 3.46Å; P108-I226 HydrophobicContact CB-CG1 4.18Å; P108-I226 HydrophobicContact CG-CB 4.48Å; P108-I226 HydrophobicContact CG-CD1 3.52Å; P108-I226 HydrophobicContact CG-CG1 3.65Å
109	A	95.1	Very high	85.5	Confident	12 Å²	12	84.4 Å²	84.4	10%	0.099	46%	0.459	C	S	.	.	B	Isolated β-bridge	trans	-83.1	138.3	177	0	0	0	0	0	111.9	K130 M220 V221	A109-K130 HydrophobicContact CB-CD 3.75Å; A109-K130 PolarHBondContact O-NZ 2.98Å; A109-M220 HydrophobicContact CB-SD 3.84Å; A109-V221 WeakPolarHBondContact CA-O 3.23Å
110	L	97	Very high	86.8	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-77.4	147.1	178.5	-65.2	176.1	0	0	0	112.5	I94 Q97 W112 I146 V221 V223 I226 V229	I94-L110 HydrophobicContact CD1-CD1 4.45Å; Q97-L110 HydrophobicContact CG-CD2 3.9Å; L110-W112 HydrophobicContact CB-CZ2 3.83Å; L110-W112 HydrophobicContact CD1-CH2 3.96Å; L110-W112 HydrophobicContact CD1-CZ2 3.71Å; L110-W112 HydrophobicContact CG-CZ2 4.42Å; L110-W112 PolarHBondContact O-NE1 3.27Å; L110-I146 HydrophobicContact CD1-CD1 3.56Å; L110-I146 HydrophobicContact CD1-CG1 4.47Å; L110-V221 HydrophobicContact CD1-CG1 4.42Å; L110-V221 PolarHBondContact N-O 2.68Å; L110-V223 HydrophobicContact CD1-CG1 3.82Å; L110-V223 HydrophobicContact CD2-CG2 4.04Å; L110-V223 HydrophobicContact CG-CG1 4.22Å; L110-V223 HydrophobicContact CG-CG2 4.34Å; L110-I226 HydrophobicContact CD2-CD1 4.43Å; L110-I226 HydrophobicContact CD2-CG1 3.96Å; L110-V229 HydrophobicContact CD2-CG2 4.25Å
111	H	97.3	Very high	88.3	Confident	58 Å²	58	80.5 Å²	80.5	27%	0.269	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-95.2	145.7	165.4	-63	96.6	0	0	0	111.2	Q97 K130	Q97-H111 PolarHBondContact NE2-O 2.9Å; H111-K130 WeakPolarHBondContact CE1-CE 3.27Å; H111-K130 PolarHBondContact CE1-NZ 3.34Å; H111-K130 WeakPolarHBondContact ND1-CE 3.49Å; H111-K130 WeakPolarHBondContact NE2-CE 3.47Å
112	W	98.4	Very high	89.9	Confident	3 Å²	3	79.4 Å²	79.4	1%	0.011	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.6	-174.3	-52.8	92.5	0	0	0	112.6	L92 T93 I94 L95 L110 Y127 I146 V221 T237 F239	L92-W112 HydrophobicContact CB-CB 3.73Å; L92-W112 HydrophobicContact CB-CD2 4.33Å; L92-W112 HydrophobicContact CB-CE3 4.35Å; L92-W112 HydrophobicContact CB-CG 4.1Å; L92-W112 HydrophobicContact CD1-CB 4.07Å; L92-W112 HydrophobicContact CD1-CG 4.19Å; T93-W112 CarbonylContact O-C 3.58Å; T93-W112 WeakPolarHBondContact O-CA 3.37Å; I94-W112 HydrophobicContact CB-CZ3 4.41Å; I94-W112 HydrophobicContact CD1-CZ3 4.32Å; L95-W112 VanDerWaalsContact CD1-C 3.45Å; L95-W112 WeakPolarHBondContact CD1-O 3.34Å; L110-W112 HydrophobicContact CB-CZ2 3.83Å; L110-W112 HydrophobicContact CD1-CH2 3.96Å; L110-W112 HydrophobicContact CD1-CZ2 3.71Å; L110-W112 HydrophobicContact CG-CZ2 4.42Å; L110-W112 PolarHBondContact O-NE1 3.27Å; W112-Y127 HydrophobicContact CB-CE1 4.35Å; W112-Y127 HydrophobicContact CB-CE2 4.04Å; W112-Y127 AromaticContact CD1-CE2 3.77Å; W112-Y127 HydrophobicContact CG-CE2 4.27Å; W112-Y127 PolarHBondContact N-OH 3.1Å; W112-Y127 WeakPolarHBondContact O-CE1 3.19Å; W112-I146 HydrophobicContact CH2-CD1 3.65Å; W112-I146 HydrophobicContact CZ2-CD1 4.21Å; W112-V221 HydrophobicContact CZ2-CB 3.87Å; W112-V221 HydrophobicContact CZ2-CG1 4.36Å; W112-V221 HydrophobicContact CZ2-CG2 3.98Å; W112-T237 HydrophobicContact CH2-CG2 4.08Å; W112-T237 HydrophobicContact CZ3-CG2 4.07Å; W112-F239 HydrophobicContact CD2-CB 4.11Å; W112-F239 HydrophobicContact CE3-CB 4.18Å; W112-F239 HydrophobicContact CH2-CB 3.7Å; W112-F239 HydrophobicContact CZ2-CB 3.6Å; W112-F239 HydrophobicContact CZ2-CG 4.4Å; W112-F239 HydrophobicContact CZ3-CB 4.01Å
113	E	98.5	Very high	91.6	Very high	31 Å²	31	76.6 Å²	76.6	15%	0.145	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	141.1	163	178	51.1	-106.2	0	0	108	L92 T93 L95 E115 L116 A119	L92-E113 VanDerWaalsContact CA-O 3.3Å; L92-E113 WeakPolarHBondContact CA-O 3.46Å; L92-E113 WeakPolarHBondContact CB-O 3.33Å; T93-E113 PolarHBondContact N-O 3.37Å; T93-E113 VanDerWaalsContact N-O 3.09Å; T93-E113 PolarHBondContact O-N 3.47Å; L95-E113 HydrophobicContact CD1-CB 4.43Å; L95-E113 HydrophobicContact CD2-CB 3.83Å; L95-E113 HydrophobicContact CG-CB 3.87Å; E113-E115 PolarHBondContact OE1-N 3.27Å; E113-L116 HydrophobicContact CG-CB 3.97Å; E113-L116 PolarHBondContact OE1-N 3.12Å; E113-A119 HydrophobicContact CB-CB 4.44Å; E113-A119 HydrophobicContact CG-CB 4Å; E113-A119 WeakPolarHBondContact O-CB 3.24Å
114	H	98.4	Very high	93.2	Very high	47 Å²	47	76.6 Å²	76.6	22%	0.218	39%	0.385	C	S	.	.			trans	-135.1	-6.1	-171	69.5	-71	0	0	0	114.2	L92 F120 T121 Y127	L92-H114 HydrophobicContact CD2-CB 3.61Å; H114-F120 CarbonylContact O-C 3.59Å; H114-F120 WeakPolarHBondContact O-CA 3.19Å; H114-F120 PolarHBondContact O-N 3.39Å; H114-T121 HydrophobicContact CB-CG2 4.07Å; H114-T121 PolarHBondContact O-N 3.16Å; H114-Y127 HydrophobicContact CB-CD1 3.78Å; H114-Y127 HydrophobicContact CB-CG 4.09Å; H114-Y127 AromaticContact CG-CD1 3.67Å; H114-Y127 AromaticContact ND1-CD1 3.68Å
115	E	97.9	Very high	95	Very high	139 Å²	139	67.6 Å²	67.6	65%	0.65	35%	0.346	S	S	*	.	S	Bend	trans	-129.8	-30.7	-176.8	-57.1	-172.3	157.8	0	0	113.5	E113	E113-E115 PolarHBondContact OE1-N 3.27Å
116	L	98.1	Very high	96.5	Very high	115 Å²	115	63.3 Å²	63.3	60%	0.602	32%	0.323	S	S	*	.	S	Bend	trans	-95	148.3	-174.3	-56.4	178.8	0	0	0	112.8	E113 L118 A119	E113-L116 HydrophobicContact CG-CB 3.97Å; E113-L116 PolarHBondContact OE1-N 3.12Å; L116-L118 PolarHBondContact O-N 3.34Å; L116-A119 VanDerWaalsContact O-CB 3.3Å; L116-A119 WeakPolarHBondContact O-CB 3.21Å; L116-A119 PolarHBondContact O-N 3.35Å
117	G	97.8	Very high	97.4	Very high	69 Å²	69	57.8 Å²	57.8	71%	0.711	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	-128.2	174.9	0	0	0	0	0	112.6
118	L	98.1	Very high	97.7	Very high	98 Å²	98	57.3 Å²	57.3	51%	0.513	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-10	175.2	-64.5	176.1	0	0	0	113.1	H91 T93 L116 E234	H91-L118 PolarHBondContact CD2-O 2.6Å; T93-L118 HydrophobicContact CG2-CB 4.25Å; L116-L118 PolarHBondContact O-N 3.34Å; L118-E234 HydrophobicContact CD1-CG 4.04Å; L118-E234 HydrophobicContact CG-CG 4.39Å; L118-E234 WeakPolarHBondContact CG-OE1 3.02Å; L118-E234 PolarHBondContact N-OE2 3.19Å
119	A	98.8	Very high	97.8	Very high	6 Å²	6	61.7 Å²	61.7	5%	0.05	32%	0.322	C	S	.	.			trans	-75.3	142.4	-179	0	0	0	0	0	111.9	H91 T93 E113 L116	H91-A119 CarbonylContact O-C 3.58Å; H91-A119 WeakPolarHBondContact O-CA 3.38Å; T93-A119 HydrophobicContact CG2-CB 4.15Å; E113-A119 HydrophobicContact CB-CB 4.44Å; E113-A119 HydrophobicContact CG-CB 4Å; E113-A119 WeakPolarHBondContact O-CB 3.24Å; L116-A119 VanDerWaalsContact O-CB 3.3Å; L116-A119 WeakPolarHBondContact O-CB 3.21Å; L116-A119 PolarHBondContact O-N 3.35Å
120	F	98.7	Very high	97.8	Very high	68 Å²	68	63.4 Å²	63.4	30%	0.298	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	153.2	171.2	66.1	-92.1	0	0	0	111.7	R89 A90 H91 H114 K122	R89-F120 HydrophobicContact CB-CE2 4.41Å; R89-F120 HydrophobicContact CG-CE2 3.99Å; A90-F120 CarbonylContact C-O 3.59Å; A90-F120 WeakPolarHBondContact CA-O 3.28Å; A90-F120 WeakPolarHBondContact CB-O 3.35Å; H91-F120 HydrophobicContact CB-CD1 3.99Å; H91-F120 HydrophobicContact CB-CE1 3.55Å; H91-F120 HydrophobicContact CB-CZ 3.95Å; H91-F120 PolarHBondContact N-O 3.39Å; H91-F120 PolarHBondContact O-N 2.85Å; H114-F120 CarbonylContact O-C 3.59Å; H114-F120 WeakPolarHBondContact O-CA 3.19Å; H114-F120 PolarHBondContact O-N 3.39Å; F120-K122 HydrophobicContact CD2-CB 4.42Å; F120-K122 HydrophobicContact CD2-CD 4.05Å; F120-K122 HydrophobicContact CD2-CG 3.9Å
121	T	98.6	Very high	97.9	Very high	39 Å²	39	65.3 Å²	65.3	24%	0.239	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.8	161.5	56.9	0	0	0	0	108.8	A90 L92 H114 M125	A90-T121 HydrophobicContact CB-CG2 3.97Å; L92-T121 HydrophobicContact CD2-CG2 3.91Å; H114-T121 HydrophobicContact CB-CG2 4.07Å; H114-T121 PolarHBondContact O-N 3.16Å; T121-M125 WeakPolarHBondContact CB-O 3.33Å
122	K	98.1	Very high	98	Very high	103 Å²	103	62.6 Å²	62.6	45%	0.448	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.6	-177.8	-69.5	-176.1	-177.7	-179.5	0	111.7	R89 F120 M125	R89-K122 HydrophobicContact CG-CB 4.05Å; R89-K122 PolarHBondContact N-O 3.1Å; R89-K122 PolarHBondContact O-N 3.09Å; F120-K122 HydrophobicContact CD2-CB 4.42Å; F120-K122 HydrophobicContact CD2-CD 4.05Å; F120-K122 HydrophobicContact CD2-CG 3.9Å; K122-M125 VanDerWaalsContact O-CB 3.24Å; K122-M125 WeakPolarHBondContact O-CB 3.38Å; K122-M125 PolarHBondContact O-N 2.91Å
123	N	97.7	Very high	98	Very high	55 Å²	55	64.1 Å²	64.1	29%	0.294	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	55.2	172.1	-55	-27.7	0	0	0	112.3	A86 K87 M125	A86-N123 HydrophobicContact CB-CB 4.34Å; A86-N123 WeakPolarHBondContact CB-OD1 3.49Å; K87-N123 WeakPolarHBondContact O-CB 3.24Å; K87-N123 PolarHBondContact O-ND2 3.01Å; N123-M125 PolarHBondContact O-N 2.92Å; N123-M125 VanDerWaalsContact O-N 3.12Å
124	R	97.9	Very high	98	Very high	141 Å²	141	62.7 Å²	62.7	53%	0.532	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-6.2	-179.6	-48.6	-177.5	-65.6	147.2	3	115.9	N126 P135 E136	R124-N126 PolarHBondContact O-N 2.89Å; R124-P135 HydrophobicContact CB-CB 3.72Å; R124-P135 HydrophobicContact CB-CG 4.05Å; R124-P135 PolarHBondContact NH1-O 2.93Å; R124-P135 PolarHBondContact NH2-O 2.92Å; R124-P135 WeakPolarHBondContact O-CB 3.42Å; R124-E136 IonicContact NH2-OE2 2.83Å; R124-E136 PolarHBondContact NH2-OE2 3.17Å
125	M	98.2	Very high	97.9	Very high	7 Å²	7	61.1 Å²	61.1	3%	0.034	32%	0.32	C	S	.	.			trans	-60.3	130.1	168.9	-168.7	63	77.5	0	0	108.4	P88 A90 T121 K122 N123 L132 I134 Y140	P88-M125 HydrophobicContact CB-CB 4.39Å; P88-M125 HydrophobicContact CB-CE 3.72Å; A90-M125 HydrophobicContact CB-CG 3.62Å; T121-M125 WeakPolarHBondContact CB-O 3.33Å; K122-M125 VanDerWaalsContact O-CB 3.24Å; K122-M125 WeakPolarHBondContact O-CB 3.38Å; K122-M125 PolarHBondContact O-N 2.91Å; N123-M125 PolarHBondContact O-N 2.92Å; N123-M125 VanDerWaalsContact O-N 3.12Å; M125-L132 HydrophobicContact CG-CD1 3.58Å; M125-L132 HydrophobicContact CG-CG 4.25Å; M125-L132 HydrophobicContact SD-CD1 3.8Å; M125-L132 HydrophobicContact SD-CD2 4.31Å; M125-L132 HydrophobicContact SD-CG 3.84Å; M125-I134 HydrophobicContact CE-CD1 4.24Å; M125-I134 HydrophobicContact SD-CD1 4.36Å; M125-Y140 HydrophobicContact CE-CD1 4.16Å; M125-Y140 HydrophobicContact CE-CE1 3.54Å
126	N	97.9	Very high	97.9	Very high	86 Å²	86	55.8 Å²	55.8	46%	0.46	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144	-174.9	-166	11.4	0	0	0	111.1	R124 V133	R124-N126 PolarHBondContact O-N 2.89Å; N126-V133 PolarHBondContact O-N 2.94Å
127	Y	98.5	Very high	97.9	Very high	22 Å²	22	53.7 Å²	53.7	9%	0.086	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123	176.2	174.2	-101.6	0	0	0	109.7	L92 W112 H114 K130 F131	L92-Y127 HydrophobicContact CD1-CD2 3.53Å; L92-Y127 HydrophobicContact CD1-CE2 3.99Å; L92-Y127 HydrophobicContact CD1-CG 4.11Å; W112-Y127 HydrophobicContact CB-CE1 4.35Å; W112-Y127 HydrophobicContact CB-CE2 4.04Å; W112-Y127 AromaticContact CD1-CE2 3.77Å; W112-Y127 HydrophobicContact CG-CE2 4.27Å; W112-Y127 PolarHBondContact N-OH 3.1Å; W112-Y127 WeakPolarHBondContact O-CE1 3.19Å; H114-Y127 HydrophobicContact CB-CD1 3.78Å; H114-Y127 HydrophobicContact CB-CG 4.09Å; H114-Y127 AromaticContact CG-CD1 3.67Å; H114-Y127 AromaticContact ND1-CD1 3.68Å; Y127-K130 WeakPolarHBondContact OH-CA 3.38Å; Y127-F131 CarbonylContact C-O 3.5Å; Y127-F131 WeakPolarHBondContact CA-O 3.26Å; Y127-F131 VanDerWaalsContact CD2-O 3.3Å; Y127-F131 WeakPolarHBondContact CD2-O 3.43Å
128	T	97.2	Very high	97.9	Very high	75 Å²	75	51.6 Å²	51.6	46%	0.46	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	135.8	-180	-173.4	0	0	0	0	110.9	K130 F131 V133	T128-K130 PolarHBondContact O-N 2.85Å; T128-F131 PolarHBondContact N-O 2.72Å; T128-F131 WeakPolarHBondContact O-CA 3.09Å; T128-F131 WeakPolarHBondContact O-CB 3.2Å; T128-F131 PolarHBondContact O-N 3.04Å; T128-V133 HydrophobicContact CG2-CG2 3.89Å
129	N	94.6	Very high	98	Very high	121 Å²	121	50.2 Å²	50.2	65%	0.647	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	51.5	175.2	-167.6	29.5	0	0	0	114.2	F131	N129-F131 WeakPolarHBondContact O-CD2 3.11Å; N129-F131 PolarHBondContact O-N 2.94Å
130	K	96.9	Very high	98	Very high	49 Å²	49	50 Å²	50	21%	0.213	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	-3.3	-176.5	-47.9	-179.5	178.1	-165.2	0	116.5	A109 H111 Y127 T128	A109-K130 HydrophobicContact CB-CD 3.75Å; A109-K130 PolarHBondContact O-NZ 2.98Å; H111-K130 WeakPolarHBondContact CE1-CE 3.27Å; H111-K130 PolarHBondContact CE1-NZ 3.34Å; H111-K130 WeakPolarHBondContact ND1-CE 3.49Å; H111-K130 WeakPolarHBondContact NE2-CE 3.47Å; Y127-K130 WeakPolarHBondContact OH-CA 3.38Å; T128-K130 PolarHBondContact O-N 2.85Å
131	F	98.2	Very high	98	Very high	40 Å²	40	49.6 Å²	49.6	18%	0.175	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.6	-179.3	-63.2	-70.9	0	0	0	111.8	Y127 T128 N129 V177 R218 L219 M220	Y127-F131 CarbonylContact C-O 3.5Å; Y127-F131 WeakPolarHBondContact CA-O 3.26Å; Y127-F131 VanDerWaalsContact CD2-O 3.3Å; Y127-F131 WeakPolarHBondContact CD2-O 3.43Å; T128-F131 PolarHBondContact N-O 2.72Å; T128-F131 WeakPolarHBondContact O-CA 3.09Å; T128-F131 WeakPolarHBondContact O-CB 3.2Å; T128-F131 PolarHBondContact O-N 3.04Å; N129-F131 WeakPolarHBondContact O-CD2 3.11Å; N129-F131 PolarHBondContact O-N 2.94Å; F131-V177 HydrophobicContact CE1-CB 4.5Å; F131-V177 HydrophobicContact CE1-CG2 3.93Å; F131-R218 HydrophobicContact CB-CB 4Å; F131-R218 HydrophobicContact CB-CG 4.36Å; F131-R218 HydrophobicContact CD1-CB 3.7Å; F131-R218 HydrophobicContact CE1-CB 4.4Å; F131-R218 HydrophobicContact CG-CB 3.96Å; F131-R218 HydrophobicContact CG-CG 4.5Å; F131-L219 CarbonylContact C-O 3.46Å; F131-L219 VanDerWaalsContact CA-O 3.29Å; F131-L219 WeakPolarHBondContact CA-O 3.32Å; F131-M220 HydrophobicContact CD1-CB 3.9Å; F131-M220 HydrophobicContact CD1-CG 4.24Å; F131-M220 HydrophobicContact CD1-SD 4.33Å; F131-M220 HydrophobicContact CE1-CB 3.98Å; F131-M220 HydrophobicContact CE1-CE 3.78Å; F131-M220 HydrophobicContact CE1-CG 3.87Å; F131-M220 HydrophobicContact CE1-SD 3.46Å; F131-M220 WeakPolarHBondContact CE1-SD 3.24Å; F131-M220 HydrophobicContact CZ-CE 4.28Å; F131-M220 HydrophobicContact CZ-SD 3.96Å
132	L	98.6	Very high	98	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.5	160.1	-174.3	64	0	0	0	108	A90 L92 M125 L219 F239 A241	A90-L132 HydrophobicContact CB-CD1 3.73Å; A90-L132 HydrophobicContact CB-CD2 4.17Å; L92-L132 HydrophobicContact CD1-CB 4.48Å; L92-L132 HydrophobicContact CD1-CD1 4.3Å; M125-L132 HydrophobicContact CG-CD1 3.58Å; M125-L132 HydrophobicContact CG-CG 4.25Å; M125-L132 HydrophobicContact SD-CD1 3.8Å; M125-L132 HydrophobicContact SD-CD2 4.31Å; M125-L132 HydrophobicContact SD-CG 3.84Å; L132-L219 HydrophobicContact CB-CB 4.35Å; L132-L219 PolarHBondContact N-O 3.4Å; L132-L219 PolarHBondContact O-N 3.45Å; L132-F239 HydrophobicContact CB-CE1 3.78Å; L132-F239 HydrophobicContact CB-CZ 4.14Å; L132-F239 HydrophobicContact CD2-CE1 4.05Å; L132-F239 HydrophobicContact CD2-CZ 3.94Å; L132-A241 HydrophobicContact CD2-CB 3.83Å
133	V	98.4	Very high	98	Very high	35 Å²	35	44.6 Å²	44.6	21%	0.212	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.9	-172.6	-172.9	0	0	0	0	110	N126 T128 P135 R218	N126-V133 PolarHBondContact O-N 2.94Å; T128-V133 HydrophobicContact CG2-CG2 3.89Å; V133-P135 WeakPolarHBondContact O-CD 3.25Å; V133-R218 HydrophobicContact CG2-CG 4.32Å
134	I	98.4	Very high	98.1	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-78.3	118.8	-179.6	-58.6	-56.4	0	0	0	110.1	M125 E136 Y140 L213 E214 G216 D217 L219	M125-I134 HydrophobicContact CE-CD1 4.24Å; M125-I134 HydrophobicContact SD-CD1 4.36Å; I134-E136 WeakPolarHBondContact CG2-O 3.42Å; I134-Y140 HydrophobicContact CD1-CD1 4.29Å; I134-Y140 HydrophobicContact CD1-CE1 4.26Å; I134-Y140 HydrophobicContact CD1-CG 4.48Å; I134-Y140 HydrophobicContact CG2-CD2 4.43Å; I134-Y140 HydrophobicContact CG2-CE2 3.68Å; I134-L213 HydrophobicContact CD1-CD1 3.56Å; I134-L213 HydrophobicContact CG1-CB 4.21Å; I134-L213 HydrophobicContact CG1-CD1 3.68Å; I134-L213 HydrophobicContact CG2-CB 4.17Å; I134-E214 WeakPolarHBondContact CG2-O 3.44Å; I134-G216 PolarHBondContact O-N 2.88Å; I134-D217 HydrophobicContact CB-CB 4.28Å; I134-D217 HydrophobicContact CG1-CB 4.08Å; I134-D217 WeakPolarHBondContact CG1-O 3.23Å; I134-D217 PolarHBondContact N-O 2.85Å; I134-L219 HydrophobicContact CD1-CD1 3.91Å; I134-L219 HydrophobicContact CD1-CG 4.36Å; I134-L219 HydrophobicContact CG1-CG 4.48Å
135	P	98	Very high	98.1	Very high	14 Å²	14	37.3 Å²	37.3	9%	0.091	20%	0.202	C	C	.	.			trans	-95.1	-0.9	-175.2	39.1	-39.4	0	0	0	114.1	P88 R124 V133	P88-P135 HydrophobicContact CB-CG 3.69Å; P88-P135 HydrophobicContact CG-CG 3.7Å; R124-P135 HydrophobicContact CB-CB 3.72Å; R124-P135 HydrophobicContact CB-CG 4.05Å; R124-P135 PolarHBondContact NH1-O 2.93Å; R124-P135 PolarHBondContact NH2-O 2.92Å; R124-P135 WeakPolarHBondContact O-CB 3.42Å; V133-P135 WeakPolarHBondContact O-CD 3.25Å
136	E	97.8	Very high	98.1	Very high	28 Å²	28	37 Å²	37	13%	0.131	20%	0.201	C	C	.	.	S	Bend	trans	-156.7	130.7	-173.6	-173.3	168.6	158.2	0	0	109.2	R85 P88 R124 I134 Y140 L243	R85-E136 IonicContact CZ-OE1 3.27Å; R85-E136 IonicContact CZ-OE2 3.94Å; R85-E136 IonicContact NE-OE1 2.8Å; R85-E136 IonicContact NE-OE2 3.42Å; R85-E136 PolarHBondContact NE-OE2 3.2Å; R85-E136 IonicContact NH1-OE1 3.43Å; R85-E136 PolarHBondContact NH1-OE1 3.48Å; R85-E136 IonicContact NH1-OE2 3.55Å; R85-E136 VanDerWaalsContact NH2-CD 3.26Å; R85-E136 IonicContact NH2-OE1 2.8Å; R85-E136 PolarHBondContact NH2-OE1 2.79Å; R85-E136 IonicContact NH2-OE2 3.25Å; R85-E136 PolarHBondContact NH2-OE2 3.44Å; P88-E136 HydrophobicContact CG-CB 4.14Å; R124-E136 IonicContact NH2-OE2 2.83Å; R124-E136 PolarHBondContact NH2-OE2 3.17Å; I134-E136 WeakPolarHBondContact CG2-O 3.42Å; E136-Y140 VanDerWaalsContact O-CE2 3.24Å; E136-Y140 WeakPolarHBondContact O-CE2 3.3Å; E136-Y140 PolarHBondContact O-OH 3.27Å; E136-L243 HydrophobicContact CG-CD2 4.43Å
137	S	98.1	Very high	98.1	Very high	71 Å²	71	33.5 Å²	33.5	50%	0.497	18%	0.183	S	C	.	.			trans	-68.1	138.9	175	-54.6	0	0	0	0	111.1	L213 E215	S137-L213 CarbonylContact C-O 3.32Å; S137-L213 VanDerWaalsContact CA-O 3.26Å; S137-L213 WeakPolarHBondContact CA-O 3.46Å; S137-E215 PolarHBondContact OG-N 3.04Å
138	G	98.1	Very high	98	Very high	25 Å²	25	32.5 Å²	32.5	26%	0.258	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	161.2	-171.7	177.9	0	0	0	0	0	113.2	Y140 S212 L213	G138-Y140 WeakPolarHBondContact O-CD2 3.32Å; G138-S212 WeakPolarHBondContact O-CA 3.3Å; G138-L213 PolarHBondContact N-O 2.84Å; G138-L213 PolarHBondContact O-N 2.86Å
139	D	98.7	Very high	97.9	Very high	69 Å²	69	33.5 Å²	33.5	37%	0.369	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.8	179.2	-62.8	-44	0	0	0	110.7	M210 S212 L244	D139-M210 HydrophobicContact CB-CG 4.18Å; D139-M210 HydrophobicContact CB-SD 4.18Å; D139-S212 WeakPolarHBondContact OD1-CA 3.44Å; D139-S212 WeakPolarHBondContact OD1-CB 3.43Å; D139-S212 PolarHBondContact OD1-OG 2.85Å; D139-L244 HydrophobicContact CB-CD1 4.27Å; D139-L244 WeakPolarHBondContact O-CB 3.49Å; D139-L244 PolarHBondContact O-N 2.69Å
140	Y	98.8	Very high	97.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.1	-180	-76.3	-97.7	0	0	0	110.4	P88 M125 I134 E136 G138 M210 F211 L213 F242 L243	P88-Y140 HydrophobicContact CB-CE1 4.19Å; M125-Y140 HydrophobicContact CE-CD1 4.16Å; M125-Y140 HydrophobicContact CE-CE1 3.54Å; I134-Y140 HydrophobicContact CD1-CD1 4.29Å; I134-Y140 HydrophobicContact CD1-CE1 4.26Å; I134-Y140 HydrophobicContact CD1-CG 4.48Å; I134-Y140 HydrophobicContact CG2-CD2 4.43Å; I134-Y140 HydrophobicContact CG2-CE2 3.68Å; E136-Y140 VanDerWaalsContact O-CE2 3.24Å; E136-Y140 WeakPolarHBondContact O-CE2 3.3Å; E136-Y140 PolarHBondContact O-OH 3.27Å; G138-Y140 WeakPolarHBondContact O-CD2 3.32Å; Y140-M210 CarbonylContact O-C 3.59Å; Y140-M210 VanDerWaalsContact O-CA 3.27Å; Y140-M210 WeakPolarHBondContact O-CA 3.27Å; Y140-F211 PolarHBondContact N-O 2.8Å; Y140-F211 PolarHBondContact O-N 3.15Å; Y140-L213 HydrophobicContact CD2-CB 3.97Å; Y140-L213 HydrophobicContact CD2-CD1 3.88Å; Y140-L213 HydrophobicContact CD2-CG 4.17Å; Y140-L213 HydrophobicContact CE2-CB 4.45Å; Y140-L213 HydrophobicContact CG-CD1 3.89Å; Y140-F242 WeakPolarHBondContact CA-O 3.35Å; Y140-L243 HydrophobicContact CD1-CB 4.14Å; Y140-L243 HydrophobicContact CD2-CD1 4.02Å; Y140-L243 HydrophobicContact CE1-CB 3.59Å; Y140-L243 HydrophobicContact CE1-CD1 4.31Å; Y140-L243 HydrophobicContact CE2-CB 4.39Å; Y140-L243 HydrophobicContact CE2-CD1 3.55Å
141	F	98.9	Very high	97	Very high	60 Å²	60	32.3 Å²	32.3	26%	0.263	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	121.2	160.6	-172.1	-94.8	0	0	0	108.8	Y143 A241 F242 L244	F141-Y143 AromaticContact CD1-CD1 3.97Å; F141-Y143 HydrophobicContact CD1-CD1 3.97Å; F141-Y143 HydrophobicContact CE1-CD1 4.04Å; F141-Y143 HydrophobicContact CE1-CG 4.32Å; F141-A241 VanDerWaalsContact O-CA 3.24Å; F141-A241 WeakPolarHBondContact O-CA 3.05Å; F141-F242 HydrophobicContact CB-CD1 4.45Å; F141-F242 HydrophobicContact CB-CE1 3.91Å; F141-F242 HydrophobicContact CB-CE2 3.97Å; F141-F242 HydrophobicContact CB-CZ 3.64Å; F141-F242 AromaticContact CD1-CE1 3.58Å; F141-F242 HydrophobicContact CD1-CE1 3.58Å; F141-F242 AromaticContact CD1-CZ 3.8Å; F141-F242 HydrophobicContact CD1-CZ 3.8Å; F141-F242 HydrophobicContact CG-CE1 4.14Å; F141-F242 AromaticContact CG-CZ 3.97Å; F141-F242 HydrophobicContact CG-CZ 3.97Å; F141-F242 PolarHBondContact N-O 3.04Å; F141-F242 PolarHBondContact O-N 3.46Å; F141-F242 VanDerWaalsContact O-N 3.08Å; F141-L244 HydrophobicContact CB-CD2 4.18Å; F141-L244 HydrophobicContact CB-CG 4.45Å
142	I	98.9	Very high	95.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.8	-179.1	-49	173.5	0	0	0	107.8	I174 L187 G208 A209 F211 L213 L219 F239 A241	I142-I174 HydrophobicContact CG2-CD1 4.19Å; I142-I174 HydrophobicContact CG2-CG2 4.07Å; I142-L187 HydrophobicContact CD1-CD1 3.6Å; I142-G208 CarbonylContact O-C 3.56Å; I142-G208 WeakPolarHBondContact O-CA 3.21Å; I142-A209 PolarHBondContact N-O 2.76Å; I142-A209 PolarHBondContact O-N 3.03Å; I142-F211 HydrophobicContact CD1-CB 4.25Å; I142-F211 HydrophobicContact CD1-CD2 3.64Å; I142-F211 HydrophobicContact CD1-CE2 4.46Å; I142-F211 HydrophobicContact CD1-CG 4.31Å; I142-F211 HydrophobicContact CG1-CD2 4.24Å; I142-L213 HydrophobicContact CD1-CD1 3.98Å; I142-L219 HydrophobicContact CD1-CD1 3.78Å; I142-L219 HydrophobicContact CD1-CD2 4.17Å; I142-L219 HydrophobicContact CG1-CD1 4.17Å; I142-L219 HydrophobicContact CG2-CD1 4.32Å; I142-F239 HydrophobicContact CG2-CE2 3.73Å; I142-A241 HydrophobicContact CG1-CB 4.38Å
143	Y	98.9	Very high	94.6	Very high	38 Å²	38	35.6 Å²	35.6	15%	0.149	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	151.2	178	64.1	-83.7	0	0	0	112.5	H91 F141 Y206 L207 F238 F239 G240 F242	H91-Y143 AromaticContact ND1-CE2 3.73Å; H91-Y143 AromaticContact ND1-CZ 3.76Å; H91-Y143 PolarHBondContact ND1-OH 2.91Å; F141-Y143 AromaticContact CD1-CD1 3.97Å; F141-Y143 HydrophobicContact CD1-CD1 3.97Å; F141-Y143 HydrophobicContact CE1-CD1 4.04Å; F141-Y143 HydrophobicContact CE1-CG 4.32Å; Y143-Y206 WeakPolarHBondContact CB-OH 3.47Å; Y143-L207 CarbonylContact C-O 3.53Å; Y143-L207 WeakPolarHBondContact CA-O 3.18Å; Y143-F238 HydrophobicContact CD2-CD2 4.15Å; Y143-F238 HydrophobicContact CD2-CE2 4.06Å; Y143-F238 AromaticContact CE2-CD2 3.98Å; Y143-F238 HydrophobicContact CE2-CD2 3.98Å; Y143-F238 HydrophobicContact CE2-CE2 4.15Å; Y143-F239 WeakPolarHBondContact O-CA 3.24Å; Y143-F239 WeakPolarHBondContact O-CD2 3.26Å; Y143-G240 WeakPolarHBondContact CD1-O 3.37Å; Y143-G240 PolarHBondContact N-O 2.74Å; Y143-G240 PolarHBondContact O-N 3Å; Y143-F242 HydrophobicContact CD1-CE1 4.49Å; Y143-F242 HydrophobicContact CE1-CD1 4.21Å; Y143-F242 HydrophobicContact CE1-CE1 4.26Å
144	S	98.8	Very high	93.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	142.9	170.9	-176.3	0	0	0	0	110.7	Y206 L207 F238	S144-Y206 CarbonylContact O-C 3.56Å; S144-Y206 WeakPolarHBondContact O-CA 3.48Å; S144-L207 PolarHBondContact N-O 2.82Å; S144-L207 PolarHBondContact O-N 3.03Å; S144-F238 CarbonylContact C-O 3.58Å; S144-F238 VanDerWaalsContact CA-O 3.23Å; S144-F238 WeakPolarHBondContact CA-O 3.31Å; S144-F238 WeakPolarHBondContact CB-O 3.33Å; S144-F238 PolarHBondContact OG-O 3.37Å
145	Q	98.7	Very high	91.5	Very high	42 Å²	42	42.4 Å²	42.4	20%	0.196	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.8	163.4	-169.6	171.7	-89.7	0	0	109	P204 L205 Y206 K236 T237 F238	Q145-P204 HydrophobicContact CG-CB 4.17Å; Q145-L205 CarbonylContact C-O 3.58Å; Q145-L205 WeakPolarHBondContact CA-O 3.41Å; Q145-Y206 HydrophobicContact CB-CD2 4Å; Q145-K236 PolarHBondContact NE2-O 3.22Å; Q145-T237 CarbonylContact O-C 3.56Å; Q145-T237 VanDerWaalsContact O-CA 3.22Å; Q145-T237 WeakPolarHBondContact O-CA 3.37Å; Q145-F238 HydrophobicContact CB-CD1 4.23Å; Q145-F238 HydrophobicContact CB-CD2 4.17Å; Q145-F238 HydrophobicContact CB-CE1 3.71Å; Q145-F238 HydrophobicContact CB-CE2 3.65Å; Q145-F238 HydrophobicContact CB-CG 4.44Å; Q145-F238 HydrophobicContact CB-CZ 3.4Å; Q145-F238 HydrophobicContact CG-CE1 4.43Å; Q145-F238 HydrophobicContact CG-CZ 4.32Å; Q145-F238 PolarHBondContact N-O 2.73Å; Q145-F238 PolarHBondContact O-N 2.93Å
146	I	98.6	Very high	89.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119	168.6	-49.8	-59.2	0	0	0	108.8	L110 W112 F148 V172 P204 L205 V221 V223 V229 T237	L110-I146 HydrophobicContact CD1-CD1 3.56Å; L110-I146 HydrophobicContact CD1-CG1 4.47Å; W112-I146 HydrophobicContact CH2-CD1 3.65Å; W112-I146 HydrophobicContact CZ2-CD1 4.21Å; I146-F148 HydrophobicContact CB-CD2 4.41Å; I146-F148 HydrophobicContact CB-CE2 3.76Å; I146-F148 HydrophobicContact CB-CZ 4.23Å; I146-F148 HydrophobicContact CG2-CD2 3.97Å; I146-F148 HydrophobicContact CG2-CE1 4.2Å; I146-F148 HydrophobicContact CG2-CE2 3.46Å; I146-F148 VanDerWaalsContact CG2-CE2 3.46Å; I146-F148 HydrophobicContact CG2-CZ 3.6Å; I146-V172 HydrophobicContact CB-CG2 3.73Å; I146-V172 HydrophobicContact CG1-CB 4.34Å; I146-V172 HydrophobicContact CG1-CG1 3.68Å; I146-V172 HydrophobicContact CG1-CG2 3.63Å; I146-V172 HydrophobicContact CG2-CG2 4.43Å; I146-P204 CarbonylContact O-C 3.55Å; I146-P204 WeakPolarHBondContact O-CA 3.42Å; I146-L205 PolarHBondContact N-O 2.93Å; I146-L205 PolarHBondContact O-N 2.85Å; I146-V221 HydrophobicContact CD1-CG1 4.1Å; I146-V221 HydrophobicContact CG1-CG1 4.35Å; I146-V223 HydrophobicContact CG1-CG1 4.26Å; I146-V223 HydrophobicContact CG2-CG1 4.18Å; I146-V229 HydrophobicContact CG2-CG1 4.13Å; I146-V229 HydrophobicContact CG2-CG2 4.04Å; I146-T237 HydrophobicContact CD1-CG2 3.71Å; I146-T237 HydrophobicContact CG2-CG2 4.33Å
147	T	98.1	Very high	87.7	Confident	14 Å²	14	46.6 Å²	46.6	9%	0.086	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119.7	170	-63.3	0	0	0	0	109.4	D230 K236 T237	T147-D230 HydrophobicContact CG2-CB 4.03Å; T147-D230 WeakPolarHBondContact O-CB 3.36Å; T147-D230 PolarHBondContact O-N 2.79Å; T147-K236 PolarHBondContact OG1-O 3.25Å; T147-T237 PolarHBondContact N-OG1 2.79Å; T147-T237 VanDerWaalsContact N-OG1 3.17Å
148	F	96.1	Very high	85.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.9	172.3	-65.6	-93	0	0	0	110.1	I146 I170 V172 W201 F202 Q203 L205 V223 L228 V229	I146-F148 HydrophobicContact CB-CD2 4.41Å; I146-F148 HydrophobicContact CB-CE2 3.76Å; I146-F148 HydrophobicContact CB-CZ 4.23Å; I146-F148 HydrophobicContact CG2-CD2 3.97Å; I146-F148 HydrophobicContact CG2-CE1 4.2Å; I146-F148 HydrophobicContact CG2-CE2 3.46Å; I146-F148 VanDerWaalsContact CG2-CE2 3.46Å; I146-F148 HydrophobicContact CG2-CZ 3.6Å; F148-I170 HydrophobicContact CB-CD1 4.11Å; F148-I170 HydrophobicContact CB-CG2 4.12Å; F148-I170 HydrophobicContact CD1-CB 4.14Å; F148-I170 HydrophobicContact CD1-CG2 3.77Å; F148-I170 HydrophobicContact CD2-CB 4.07Å; F148-I170 HydrophobicContact CD2-CD1 3.72Å; F148-I170 HydrophobicContact CD2-CG1 4.41Å; F148-I170 HydrophobicContact CD2-CG2 4.35Å; F148-I170 HydrophobicContact CE1-CB 4.25Å; F148-I170 HydrophobicContact CE1-CG2 4.25Å; F148-I170 HydrophobicContact CE2-CB 4.17Å; F148-I170 HydrophobicContact CE2-CD1 4.38Å; F148-I170 HydrophobicContact CG-CB 4.04Å; F148-I170 HydrophobicContact CG-CD1 4.02Å; F148-I170 HydrophobicContact CG-CG2 3.82Å; F148-I170 HydrophobicContact CZ-CB 4.25Å; F148-V172 HydrophobicContact CE2-CG2 3.51Å; F148-V172 HydrophobicContact CZ-CG2 3.72Å; F148-W201 HydrophobicContact CB-CH2 3.97Å; F148-W201 HydrophobicContact CB-CZ3 3.66Å; F148-F202 CarbonylContact O-C 3.6Å; F148-F202 WeakPolarHBondContact O-CA 3.36Å; F148-Q203 PolarHBondContact N-O 2.87Å; F148-Q203 PolarHBondContact O-N 2.92Å; F148-L205 HydrophobicContact CD2-CD1 4.43Å; F148-L205 HydrophobicContact CE2-CD1 3.97Å; F148-V223 HydrophobicContact CE1-CB 4.25Å; F148-V223 HydrophobicContact CE1-CG1 4.47Å; F148-V223 HydrophobicContact CZ-CB 4.13Å; F148-V223 HydrophobicContact CZ-CG1 4.01Å; F148-L228 CarbonylContact C-O 3.6Å; F148-L228 VanDerWaalsContact CA-O 3.28Å; F148-L228 WeakPolarHBondContact CA-O 3.22Å; F148-L228 HydrophobicContact CD1-CB 3.92Å; F148-V229 HydrophobicContact CD1-CG2 4.37Å; F148-V229 HydrophobicContact CE1-CG2 4.05Å
149	R	93.6	Very high	83.7	Confident	96 Å²	96	50.6 Å²	50.6	36%	0.362	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	142.2	172.5	61.8	178.8	-176.6	148.8	1.1	109.9	W201 L228 D230	R149-W201 VanDerWaalsContact CA-O 3.24Å; R149-W201 WeakPolarHBondContact CA-O 3.47Å; R149-L228 PolarHBondContact N-O 3.02Å; R149-L228 WeakPolarHBondContact O-CA 3.47Å; R149-L228 WeakPolarHBondContact O-CD2 3.28Å; R149-D230 HydrophobicContact CG-CB 4.16Å; R149-D230 IonicContact NE-OD1 3.19Å
150	G	88.9	Confident	81.4	Confident	13 Å²	13	56.1 Å²	56.1	13%	0.134	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	166.9	179.1	0	0	0	0	0	112.2	N200 W201	G150-N200 CarbonylContact O-C 3.35Å; G150-N200 VanDerWaalsContact O-CA 3.31Å; G150-N200 WeakPolarHBondContact O-CA 3.33Å; G150-W201 PolarHBondContact N-O 3.23Å; G150-W201 PolarHBondContact O-N 2.89Å
151	L	84.6	Confident	79.4	Confident	133 Å²	133	67.6 Å²	67.6	70%	0.696	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	177.1	168	-57.4	-179	0	0	0	110	S153 N199 N200 W201	L151-S153 PolarHBondContact O-N 3.44Å; L151-N199 CarbonylContact C-O 3.55Å; L151-N199 WeakPolarHBondContact CA-O 3.43Å; L151-N200 WeakPolarHBondContact CD2-OD1 3.31Å; L151-W201 PolarHBondContact O-NE1 2.88Å
152	K	75.9	Confident	77.3	Confident	107 Å²	107	73.2 Å²	73.2	47%	0.465	35%	0.354	S	S	.	.	S	Bend	trans	-31.2	118	-179.4	-167.7	-171.6	178.6	-163.8	0	111.5	D157 N199	K152-D157 IonicContact NZ-OD1 3.74Å; K152-D157 PolarHBondContact NZ-OD1 3.44Å; K152-N199 PolarHBondContact N-O 3.15Å
153	S	69.6	Low	75.1	Confident	2 Å²	2	81.3 Å²	81.3	1%	0.014	39%	0.392	C	S	.	.			trans	-64	151.8	175.8	80	0	0	0	0	109.2	L151 C155 E196	L151-S153 PolarHBondContact O-N 3.44Å; S153-C155 PolarHBondContact O-N 2.89Å; S153-C155 VanDerWaalsContact O-N 3.11Å; S153-C155 WeakPolarHBondContact OG-CB 3.23Å; S153-C155 PolarHBondContact OG-N 2.85Å; S153-E196 WeakPolarHBondContact CB-O 3.32Å; S153-E196 PolarHBondContact OG-N 2.94Å; S153-E196 PolarHBondContact OG-O 3.36Å
154	R	67.4	Low	73.1	Confident	151 Å²	151	85.1 Å²	85.1	57%	0.57	42%	0.421	S	S	*	.	S	Bend	trans	-67.7	-9.8	176.5	-66.9	-168.2	-67.7	-95.3	-3.9	113	G156 S165 D168	R154-G156 PolarHBondContact O-N 2.85Å; R154-S165 VanDerWaalsContact C-OG 3.32Å; R154-S165 PolarHBondContact O-OG 3.09Å; R154-D168 IonicContact CZ-OD1 2.63Å; R154-D168 IonicContact NE-OD1 3Å; R154-D168 IonicContact NH1-OD1 3.86Å; R154-D168 IonicContact NH2-OD1 3.67Å; R154-D168 PolarHBondContact NH2-OD1 3.22Å
155	C	64.3	Low	71.2	Confident	28 Å²	28	87.3 Å²	87.3	19%	0.189	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	128	-176	-156.5	0	0	0	0	112.2	S153 C195	S153-C155 PolarHBondContact O-N 2.89Å; S153-C155 VanDerWaalsContact O-N 3.11Å; S153-C155 WeakPolarHBondContact OG-CB 3.23Å; S153-C155 PolarHBondContact OG-N 2.85Å; C155-C195 HydrophobicContact CB-CB 3.62Å; C155-C195 WeakPolarHBondContact CB-SG 3.3Å; C155-C195 WeakPolarHBondContact SG-CB 3.33Å; C155-C195 CovalentContact SG-SG 2.02Å; C155-C195 PolarHBondContact SG-SG 2.93Å
156	G	57.9	Low	69.3	Low	57 Å²	57	96 Å²	96	59%	0.588	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	19	171.9	0	0	0	0	0	115.9	R154 T158	R154-G156 PolarHBondContact O-N 2.85Å; G156-T158 VanDerWaalsContact C-N 3.28Å; G156-T158 PolarHBondContact O-N 2.83Å
157	D	59.8	Low	67.5	Low	72 Å²	72	99.1 Å²	99.1	39%	0.385	49%	0.488	S	S	.	.			trans	-70	86.8	169.7	-126.9	27.9	0	0	0	109.4	K152 S159	K152-D157 IonicContact NZ-OD1 3.74Å; K152-D157 PolarHBondContact NZ-OD1 3.44Å; D157-S159 PolarHBondContact O-N 3.43Å
158	T	54.3	Low	66.7	Low	129 Å²	129	100.3 Å²	100.3	79%	0.791	49%	0.494	S	S	*	.			trans	-76.5	24.8	-176.5	57.6	0	0	0	0	113.6	G156 Q160	G156-T158 VanDerWaalsContact C-N 3.28Å; G156-T158 PolarHBondContact O-N 2.83Å; T158-Q160 PolarHBondContact O-N 2.8Å
159	S	56.9	Low	66.4	Low	52 Å²	52	103.8 Å²	103.8	36%	0.364	52%	0.518	S	S	.	.			trans	-59.3	118.7	167.9	63.5	0	0	0	0	106.9	D157 W161 R162	D157-S159 PolarHBondContact O-N 3.43Å; S159-W161 PolarHBondContact O-N 2.79Å; S159-R162 PolarHBondContact O-N 3.49Å; S159-R162 PolarHBondContact OG-NE 3.09Å
160	Q	50.8	Low	66.4	Low	185 Å²	185	99.2 Å²	99.2	86%	0.864	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-1.9	-168.1	-68.9	176.5	11.1	0	0	115.6	T158	T158-Q160 PolarHBondContact O-N 2.8Å
161	W	56.4	Low	66.8	Low	241 Å²	241	99.1 Å²	99.1	91%	0.913	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	1.8	-175.4	-66.3	99.1	0	0	0	114.7	S159	S159-W161 PolarHBondContact O-N 2.79Å
162	R	54.2	Low	67.4	Low	177 Å²	177	92.8 Å²	92.8	67%	0.668	47%	0.465	S	S	*	.	S	Bend	trans	-110.5	125.3	175.4	-67	-160	-121.7	-153	5.3	111	S159	S159-R162 PolarHBondContact O-N 3.49Å; S159-R162 PolarHBondContact OG-NE 3.09Å
163	Q	54.3	Low	68.5	Low	171 Å²	171	87.9 Å²	87.9	80%	0.799	44%	0.444	S	S	*	.			trans	-46	144.9	168.1	-83.9	-81.1	-24.6	0	0	110.6	S165	Q163-S165 PolarHBondContact O-N 2.86Å
164	P	55	Low	69.8	Low	118 Å²	118	87.8 Å²	87.8	77%	0.766	44%	0.443	S	S	*	.			trans	-50.1	110.2	173.1	-22.1	30.9	0	0	0	109.3	R166	P164-R166 PolarHBondContact O-N 2.87Å
165	S	59.8	Low	71.3	Confident	45 Å²	45	80.7 Å²	80.7	32%	0.315	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-68.7	130.7	-179.8	57.6	0	0	0	0	108.5	R154 Q163	R154-S165 VanDerWaalsContact C-OG 3.32Å; R154-S165 PolarHBondContact O-OG 3.09Å; Q163-S165 PolarHBondContact O-N 2.86Å
166	R	57.9	Low	72.8	Confident	224 Å²	224	81.2 Å²	81.2	85%	0.845	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-53.9	136.8	171.7	-67.4	-178	178.7	169.7	-0.6	109.3	P164	P164-R166 PolarHBondContact O-N 2.87Å
167	P	62.6	Low	74.6	Confident	67 Å²	67	79.6 Å²	79.6	44%	0.435	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-58.4	144	176.4	24.9	-32.7	0	0	0	109.4
168	D	80.6	Confident	76.2	Confident	39 Å²	39	77.4 Å²	77.4	21%	0.209	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	147.7	171.3	-69.3	-50.3	0	0	0	108.5	R154 S193 V194	R154-D168 IonicContact CZ-OD1 2.63Å; R154-D168 IonicContact NE-OD1 3Å; R154-D168 IonicContact NH1-OD1 3.86Å; R154-D168 IonicContact NH2-OD1 3.67Å; R154-D168 PolarHBondContact NH2-OD1 3.22Å; D168-S193 CarbonylContact O-C 3.58Å; D168-V194 PolarHBondContact N-O 2.91Å; D168-V194 PolarHBondContact O-N 2.58Å
169	S	89.6	Confident	77.8	Confident	72 Å²	72	77.1 Å²	77.1	50%	0.503	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.9	177.4	61.5	0	0	0	0	110.2	K192 S224	S169-K192 WeakPolarHBondContact CA-O 3.18Å; S169-S224 PolarHBondContact O-OG 2.85Å
170	I	94.1	Very high	79	Confident	1 Å²	1	81 Å²	81	1%	0.005	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.7	172.2	53.8	173.1	0	0	0	108.2	F148 T191 K192 V194 W201 Q203 L205 S224 L228	F148-I170 HydrophobicContact CB-CD1 4.11Å; F148-I170 HydrophobicContact CB-CG2 4.12Å; F148-I170 HydrophobicContact CD1-CB 4.14Å; F148-I170 HydrophobicContact CD1-CG2 3.77Å; F148-I170 HydrophobicContact CD2-CB 4.07Å; F148-I170 HydrophobicContact CD2-CD1 3.72Å; F148-I170 HydrophobicContact CD2-CG1 4.41Å; F148-I170 HydrophobicContact CD2-CG2 4.35Å; F148-I170 HydrophobicContact CE1-CB 4.25Å; F148-I170 HydrophobicContact CE1-CG2 4.25Å; F148-I170 HydrophobicContact CE2-CB 4.17Å; F148-I170 HydrophobicContact CE2-CD1 4.38Å; F148-I170 HydrophobicContact CG-CB 4.04Å; F148-I170 HydrophobicContact CG-CD1 4.02Å; F148-I170 HydrophobicContact CG-CG2 3.82Å; F148-I170 HydrophobicContact CZ-CB 4.25Å; I170-T191 WeakPolarHBondContact O-CA 3.4Å; I170-K192 HydrophobicContact CD1-CB 4.29Å; I170-K192 HydrophobicContact CG1-CB 3.94Å; I170-K192 PolarHBondContact N-O 3.44Å; I170-K192 PolarHBondContact O-N 2.83Å; I170-V194 HydrophobicContact CD1-CG2 4.01Å; I170-V194 HydrophobicContact CG1-CG2 3.86Å; I170-V194 HydrophobicContact CG2-CG2 4.12Å; I170-W201 HydrophobicContact CG2-CH2 3.83Å; I170-W201 HydrophobicContact CG2-CZ3 4.38Å; I170-Q203 HydrophobicContact CD1-CB 4.23Å; I170-L205 HydrophobicContact CB-CD1 4.42Å; I170-L205 HydrophobicContact CD1-CD1 3.88Å; I170-L205 HydrophobicContact CD1-CG 4.2Å; I170-L205 HydrophobicContact CG1-CD1 3.86Å; I170-S224 WeakPolarHBondContact CA-OG 3.33Å; I170-L228 HydrophobicContact CG2-CD1 4.4Å
171	V	96.4	Very high	80.4	Confident	11 Å²	11	79.3 Å²	79.3	7%	0.067	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.5	-178.5	-169.5	0	0	0	0	108.9	F107 V173 T189 G190 T191 V223 S224	F107-V171 HydrophobicContact CD2-CG1 4.4Å; F107-V171 HydrophobicContact CE2-CB 3.91Å; F107-V171 HydrophobicContact CE2-CG1 3.58Å; F107-V171 HydrophobicContact CE2-CG2 4.43Å; F107-V171 HydrophobicContact CZ-CB 4.03Å; F107-V171 HydrophobicContact CZ-CG1 4.12Å; F107-V171 HydrophobicContact CZ-CG2 4.13Å; V171-V173 HydrophobicContact CG1-CG2 3.9Å; V171-T189 HydrophobicContact CG1-CG2 4.16Å; V171-G190 CarbonylContact C-O 3.55Å; V171-G190 VanDerWaalsContact CA-O 3.32Å; V171-G190 WeakPolarHBondContact CA-O 3.48Å; V171-T191 HydrophobicContact CG2-CG2 4.05Å; V171-V223 CarbonylContact O-C 3.54Å; V171-V223 VanDerWaalsContact O-CA 3.23Å; V171-V223 WeakPolarHBondContact O-CA 3.49Å; V171-S224 PolarHBondContact N-OG 2.91Å; V171-S224 PolarHBondContact O-N 2.91Å
172	V	98.1	Very high	81.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131	169.1	-178.1	0	0	0	0	107.5	I146 F148 T189 G190 L205 L207 V221 N222 V223	I146-V172 HydrophobicContact CB-CG2 3.73Å; I146-V172 HydrophobicContact CG1-CB 4.34Å; I146-V172 HydrophobicContact CG1-CG1 3.68Å; I146-V172 HydrophobicContact CG1-CG2 3.63Å; I146-V172 HydrophobicContact CG2-CG2 4.43Å; F148-V172 HydrophobicContact CE2-CG2 3.51Å; F148-V172 HydrophobicContact CZ-CG2 3.72Å; V172-T189 CarbonylContact O-C 3.5Å; V172-T189 WeakPolarHBondContact O-CA 3.41Å; V172-G190 PolarHBondContact N-O 3.44Å; V172-G190 PolarHBondContact O-N 3.41Å; V172-L205 HydrophobicContact CG2-CB 3.94Å; V172-L205 HydrophobicContact CG2-CD1 3.91Å; V172-L207 HydrophobicContact CB-CD1 4.05Å; V172-L207 HydrophobicContact CG1-CD1 3.93Å; V172-V221 HydrophobicContact CG1-CG1 3.81Å; V172-N222 CarbonylContact C-O 3.57Å; V172-N222 WeakPolarHBondContact CA-O 3.38Å; V172-V223 HydrophobicContact CG2-CG1 4.45Å
173	V	98	Very high	83	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.024	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.1	176.5	-172.4	0	0	0	0	108.9	F107 V171 H186 L188 T189 V221 N222	F107-V173 HydrophobicContact CD2-CG2 3.76Å; F107-V173 HydrophobicContact CE2-CG2 3.95Å; V171-V173 HydrophobicContact CG1-CG2 3.9Å; V173-H186 HydrophobicContact CG1-CB 3.95Å; V173-H186 WeakPolarHBondContact CG1-ND1 3.47Å; V173-L188 CarbonylContact C-O 3.53Å; V173-L188 VanDerWaalsContact CA-O 3.31Å; V173-L188 WeakPolarHBondContact CA-O 3.29Å; V173-T189 HydrophobicContact CG2-CG2 4.18Å; V173-V221 CarbonylContact O-C 3.52Å; V173-V221 WeakPolarHBondContact O-CA 3.46Å; V173-N222 HydrophobicContact CB-CB 4.35Å; V173-N222 PolarHBondContact N-O 2.85Å; V173-N222 PolarHBondContact O-N 2.89Å
174	I	98.4	Very high	84.7	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.4	167.9	-53.1	-172.1	0	0	0	107.2	I142 L187 L188 L207 V221 F239	I142-I174 HydrophobicContact CG2-CD1 4.19Å; I142-I174 HydrophobicContact CG2-CG2 4.07Å; I174-L187 PolarHBondContact O-N 2.88Å; I174-L188 HydrophobicContact CB-CB 4.22Å; I174-L188 HydrophobicContact CD1-CB 4.43Å; I174-L188 HydrophobicContact CD1-CD1 4.06Å; I174-L188 HydrophobicContact CG1-CB 4.29Å; I174-L188 PolarHBondContact N-O 3.37Å; I174-L188 PolarHBondContact O-N 2.85Å; I174-L207 HydrophobicContact CD1-CB 4.45Å; I174-V221 HydrophobicContact CG1-CG2 4.33Å; I174-F239 HydrophobicContact CG2-CE2 4.5Å
175	T	97.2	Very high	86.5	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.1	-170.8	-54	0	0	0	0	110.3	P184 A185 L219 M220 N222	T175-P184 HydrophobicContact CG2-CB 3.26Å; T175-A185 CarbonylContact C-O 3.56Å; T175-A185 WeakPolarHBondContact CA-O 3.3Å; T175-A185 WeakPolarHBondContact CG2-O 3.21Å; T175-L219 WeakPolarHBondContact O-CA 3.41Å; T175-M220 HydrophobicContact CG2-CE 3.94Å; T175-M220 PolarHBondContact N-O 2.93Å; T175-M220 PolarHBondContact O-N 2.76Å; T175-N222 WeakPolarHBondContact CB-OD1 3.44Å; T175-N222 PolarHBondContact OG1-OD1 3.38Å
176	K	97	Very high	88.2	Confident	39 Å²	39	66.1 Å²	66.1	17%	0.17	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.2	170	-168	-175.1	94.2	134.8	0	110	P184 A185 L187 L213 D217 R218 L219	K176-P184 CarbonylContact O-C 3.47Å; K176-P184 WeakPolarHBondContact O-CA 3.16Å; K176-A185 HydrophobicContact CB-CB 4.49Å; K176-A185 PolarHBondContact N-O 2.8Å; K176-A185 PolarHBondContact O-N 2.82Å; K176-L187 HydrophobicContact CB-CD1 3.99Å; K176-L187 HydrophobicContact CB-CD2 4.03Å; K176-L187 HydrophobicContact CB-CG 3.93Å; K176-L187 HydrophobicContact CD-CD2 4.47Å; K176-L213 HydrophobicContact CD-CD2 3.74Å; K176-L213 HydrophobicContact CG-CD2 4.45Å; K176-D217 HydrophobicContact CD-CB 4.36Å; K176-D217 WeakPolarHBondContact CD-OD2 3.06Å; K176-D217 HydrophobicContact CG-CB 4.27Å; K176-D217 IonicContact NZ-OD1 3.4Å; K176-D217 PolarHBondContact NZ-OD1 3.38Å; K176-D217 IonicContact NZ-OD2 2.98Å; K176-D217 PolarHBondContact NZ-OD2 2.83Å; K176-R218 CarbonylContact C-O 3.58Å; K176-R218 WeakPolarHBondContact CA-O 3.11Å; K176-L219 HydrophobicContact CB-CD2 4.2Å; K176-L219 HydrophobicContact CG-CD2 4.16Å
177	V	95.4	Very high	90.1	Very high	23 Å²	23	57.2 Å²	57.2	14%	0.139	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.7	168.6	-175.5	0	0	0	0	107.5	F131 P184 R218 M220	F131-V177 HydrophobicContact CE1-CB 4.5Å; F131-V177 HydrophobicContact CE1-CG2 3.93Å; V177-P184 HydrophobicContact CG2-CB 4.06Å; V177-P184 HydrophobicContact CG2-CG 4.27Å; V177-R218 HydrophobicContact CB-CB 4.27Å; V177-R218 PolarHBondContact N-O 3.08Å; V177-R218 PolarHBondContact O-N 3.47Å; V177-M220 HydrophobicContact CG2-CE 3.49Å; V177-M220 VanDerWaalsContact CG2-CE 3.49Å
178	T	93.4	Very high	91.8	Very high	26 Å²	26	55.5 Å²	55.5	16%	0.16	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	150.6	178.4	-172.4	0	0	0	0	108.4	N180 D217	T178-N180 HydrophobicContact CG2-CB 4.42Å; T178-N180 PolarHBondContact O-N 2.79Å; T178-D217 WeakPolarHBondContact CB-OD1 3.37Å; T178-D217 PolarHBondContact OG1-OD1 3.25Å
179	D	87.5	Confident	92.6	Very high	123 Å²	123	57.3 Å²	57.3	66%	0.658	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-19.6	179.8	-63.3	-28.5	0	0	0	112	Y181 R218	D179-Y181 VanDerWaalsContact C-N 3.3Å; D179-Y181 PolarHBondContact O-N 2.83Å; D179-R218 IonicContact OD1-CZ 3.09Å; D179-R218 VanDerWaalsContact OD1-CZ 3.25Å; D179-R218 IonicContact OD1-NH1 2.73Å; D179-R218 PolarHBondContact OD1-NH1 2.9Å; D179-R218 IonicContact OD1-NH2 2.87Å; D179-R218 PolarHBondContact OD1-NH2 2.9Å; D179-R218 IonicContact OD2-NH1 3.68Å; D179-R218 PolarHBondContact OD2-NH1 3.5Å
180	N	82.7	Confident	93	Very high	132 Å²	132	54.3 Å²	54.3	71%	0.706	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-14.2	179.9	-68.5	-14.4	0	0	0	113.7	T178	T178-N180 HydrophobicContact CG2-CB 4.42Å; T178-N180 PolarHBondContact O-N 2.79Å
181	Y	79.9	Confident	93.1	Very high	150 Å²	150	58.6 Å²	58.6	59%	0.588	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	126.1	-176.6	-155.6	-104.3	0	0	0	111.1	D179 E183	D179-Y181 VanDerWaalsContact C-N 3.3Å; D179-Y181 PolarHBondContact O-N 2.83Å; Y181-E183 VanDerWaalsContact C-N 3.32Å; Y181-E183 HydrophobicContact CD1-CB 3.99Å; Y181-E183 WeakPolarHBondContact CD1-O 3.43Å; Y181-E183 HydrophobicContact CE1-CB 3.78Å; Y181-E183 HydrophobicContact CE1-CG 4.37Å; Y181-E183 PolarHBondContact O-N 3.44Å
182	P	78.4	Confident	93	Very high	117 Å²	117	61.9 Å²	61.9	76%	0.76	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	-28.1	-172.5	26.5	-33.7	0	0	0	113.2
183	E	86.8	Confident	92.7	Very high	130 Å²	130	65.7 Å²	65.7	61%	0.607	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.2	-178	-63.9	-62.9	147.8	0	0	111.7	Y181 A185	Y181-E183 VanDerWaalsContact C-N 3.32Å; Y181-E183 HydrophobicContact CD1-CB 3.99Å; Y181-E183 WeakPolarHBondContact CD1-O 3.43Å; Y181-E183 HydrophobicContact CE1-CB 3.78Å; Y181-E183 HydrophobicContact CE1-CG 4.37Å; Y181-E183 PolarHBondContact O-N 3.44Å; E183-A185 PolarHBondContact O-N 3.17Å
184	P	89.6	Confident	92.2	Very high	55 Å²	55	65.5 Å²	65.5	36%	0.357	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	132.7	174.6	-20.6	31.9	0	0	0	112.4	T175 K176 V177 M220	T175-P184 HydrophobicContact CG2-CB 3.26Å; K176-P184 CarbonylContact O-C 3.47Å; K176-P184 WeakPolarHBondContact O-CA 3.16Å; V177-P184 HydrophobicContact CG2-CB 4.06Å; V177-P184 HydrophobicContact CG2-CG 4.27Å; P184-M220 HydrophobicContact CB-CE 4.48Å
185	A	93.1	Very high	91.5	Very high	46 Å²	46	68.9 Å²	68.9	38%	0.38	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.3	178.3	0	0	0	0	0	111.5	T175 K176 E183 L187	T175-A185 CarbonylContact C-O 3.56Å; T175-A185 WeakPolarHBondContact CA-O 3.3Å; T175-A185 WeakPolarHBondContact CG2-O 3.21Å; K176-A185 HydrophobicContact CB-CB 4.49Å; K176-A185 PolarHBondContact N-O 2.8Å; K176-A185 PolarHBondContact O-N 2.82Å; E183-A185 PolarHBondContact O-N 3.17Å; A185-L187 PolarHBondContact O-N 2.97Å
186	H	95.6	Very high	90.8	Very high	128 Å²	128	72 Å²	72	59%	0.593	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.9	174.3	-59.3	-30	0	0	0	110.5	V173	V173-H186 HydrophobicContact CG1-CB 3.95Å; V173-H186 WeakPolarHBondContact CG1-ND1 3.47Å
187	L	97.2	Very high	89.7	Confident	36 Å²	36	77.1 Å²	77.1	19%	0.188	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-48.5	177.6	-61.4	-175.2	0	0	0	111.3	I142 I174 K176 A185 F211 L213 L219	I142-L187 HydrophobicContact CD1-CD1 3.6Å; I174-L187 PolarHBondContact O-N 2.88Å; K176-L187 HydrophobicContact CB-CD1 3.99Å; K176-L187 HydrophobicContact CB-CD2 4.03Å; K176-L187 HydrophobicContact CB-CG 3.93Å; K176-L187 HydrophobicContact CD-CD2 4.47Å; A185-L187 PolarHBondContact O-N 2.97Å; L187-F211 HydrophobicContact CB-CD1 4.41Å; L187-F211 HydrophobicContact CB-CD2 4.38Å; L187-F211 HydrophobicContact CB-CE1 4.02Å; L187-F211 HydrophobicContact CB-CE2 3.98Å; L187-F211 HydrophobicContact CB-CZ 3.8Å; L187-F211 HydrophobicContact CD1-CD2 4.26Å; L187-F211 HydrophobicContact CD1-CG 4.29Å; L187-F211 HydrophobicContact CD2-CD1 4Å; L187-F211 HydrophobicContact CD2-CE1 4.24Å; L187-F211 HydrophobicContact CD2-CG 4.36Å; L187-F211 VanDerWaalsContact O-CZ 3.24Å; L187-F211 WeakPolarHBondContact O-CZ 3.34Å; L187-L213 HydrophobicContact CD1-CD2 4.42Å; L187-L219 HydrophobicContact CD1-CD2 3.75Å
188	L	98.1	Very high	89	Confident	31 Å²	31	78.5 Å²	78.5	16%	0.162	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141	-179.4	-70.4	168.5	0	0	0	109.6	V173 I174 L207 A209 F211	V173-L188 CarbonylContact C-O 3.53Å; V173-L188 VanDerWaalsContact CA-O 3.31Å; V173-L188 WeakPolarHBondContact CA-O 3.29Å; I174-L188 HydrophobicContact CB-CB 4.22Å; I174-L188 HydrophobicContact CD1-CB 4.43Å; I174-L188 HydrophobicContact CD1-CD1 4.06Å; I174-L188 HydrophobicContact CG1-CB 4.29Å; I174-L188 PolarHBondContact N-O 3.37Å; I174-L188 PolarHBondContact O-N 2.85Å; L188-L207 HydrophobicContact CB-CB 4.34Å; L188-L207 HydrophobicContact CB-CD1 4.18Å; L188-L207 HydrophobicContact CD1-CB 4.2Å; L188-A209 HydrophobicContact CD1-CB 4.09Å; L188-A209 HydrophobicContact CD2-CB 3.89Å; L188-A209 HydrophobicContact CG-CB 4.45Å; L188-F211 HydrophobicContact CD1-CE2 3.86Å; L188-F211 HydrophobicContact CD1-CZ 4.34Å; L188-F211 HydrophobicContact CD2-CE2 4.24Å; L188-F211 HydrophobicContact CD2-CZ 3.91Å; L188-F211 HydrophobicContact CG-CE2 3.76Å; L188-F211 HydrophobicContact CG-CZ 3.73Å
189	T	98.1	Very high	88.5	Confident	78 Å²	78	83.2 Å²	83.2	48%	0.479	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	125.6	173.9	-62.7	0	0	0	0	109.5	V171 V172 V173	V171-T189 HydrophobicContact CG1-CG2 4.16Å; V172-T189 CarbonylContact O-C 3.5Å; V172-T189 WeakPolarHBondContact O-CA 3.41Å; V173-T189 HydrophobicContact CG2-CG2 4.18Å
190	G	97.8	Very high	88.5	Confident	8 Å²	8	81.8 Å²	81.8	8%	0.082	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.5	173.1	0	0	0	0	0	109.3	V171 V172	V171-G190 CarbonylContact C-O 3.55Å; V171-G190 VanDerWaalsContact CA-O 3.32Å; V171-G190 WeakPolarHBondContact CA-O 3.48Å; V172-G190 PolarHBondContact N-O 3.44Å; V172-G190 PolarHBondContact O-N 3.41Å
191	T	96.8	Very high	89	Confident	91 Å²	91	76 Å²	76	56%	0.558	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.4	179.2	-62.1	0	0	0	0	109.5	I170 V171	I170-T191 WeakPolarHBondContact O-CA 3.4Å; V171-T191 HydrophobicContact CG2-CG2 4.05Å
192	K	94.3	Very high	89.6	Confident	81 Å²	81	76.6 Å²	76.6	35%	0.352	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135.4	174.1	-173.7	173.4	-178.3	-165.7	0	110.9	S169 I170 Q203 L205	S169-K192 WeakPolarHBondContact CA-O 3.18Å; I170-K192 HydrophobicContact CD1-CB 4.29Å; I170-K192 HydrophobicContact CG1-CB 3.94Å; I170-K192 PolarHBondContact N-O 3.44Å; I170-K192 PolarHBondContact O-N 2.83Å; K192-Q203 VanDerWaalsContact CD-OE1 3.24Å; K192-L205 HydrophobicContact CB-CD1 4.46Å; K192-L205 HydrophobicContact CB-CD2 4.06Å; K192-L205 HydrophobicContact CD-CD2 4.43Å
193	S	90.6	Very high	90.3	Very high	80 Å²	80	71.7 Å²	71.7	56%	0.559	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.3	167.8	49.8	0	0	0	0	109.7	D168	D168-S193 CarbonylContact O-C 3.58Å
194	V	87.3	Confident	90.8	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.2	178.4	-174.9	0	0	0	0	108.2	D168 I170 E196 W201	D168-V194 PolarHBondContact N-O 2.91Å; D168-V194 PolarHBondContact O-N 2.58Å; I170-V194 HydrophobicContact CD1-CG2 4.01Å; I170-V194 HydrophobicContact CG1-CG2 3.86Å; I170-V194 HydrophobicContact CG2-CG2 4.12Å; V194-E196 HydrophobicContact CG1-CG 4.01Å; V194-W201 HydrophobicContact CG1-CD2 3.72Å; V194-W201 HydrophobicContact CG1-CE3 4.02Å; V194-W201 HydrophobicContact CG1-CG 4.14Å; V194-W201 HydrophobicContact CG1-CH2 4.37Å; V194-W201 HydrophobicContact CG1-CZ2 4.1Å; V194-W201 HydrophobicContact CG1-CZ3 4.32Å; V194-W201 HydrophobicContact CG2-CH2 4.19Å; V194-W201 HydrophobicContact CG2-CZ3 4.2Å
195	C	84.4	Confident	91.2	Very high	70 Å²	70	67.6 Å²	67.6	47%	0.473	37%	0.374	S	S	.	.			trans	-137.2	88.4	172.6	176.3	0	0	0	0	107.1	C155	C155-C195 HydrophobicContact CB-CB 3.62Å; C155-C195 WeakPolarHBondContact CB-SG 3.3Å; C155-C195 WeakPolarHBondContact SG-CB 3.33Å; C155-C195 CovalentContact SG-SG 2.02Å; C155-C195 PolarHBondContact SG-SG 2.93Å
196	E	81.9	Confident	91.5	Very high	67 Å²	67	71.2 Å²	71.2	31%	0.313	38%	0.379	S	S	.	.			trans	-119.2	125	-176.9	-68.2	-75.3	-172.7	0	0	108.9	S153 V194 S198 W201 Q203	S153-E196 WeakPolarHBondContact CB-O 3.32Å; S153-E196 PolarHBondContact OG-N 2.94Å; S153-E196 PolarHBondContact OG-O 3.36Å; V194-E196 HydrophobicContact CG1-CG 4.01Å; E196-S198 VanDerWaalsContact C-N 3.28Å; E196-W201 HydrophobicContact CB-CB 3.85Å; E196-W201 HydrophobicContact CB-CG 4.22Å; E196-W201 HydrophobicContact CG-CB 3.7Å; E196-W201 HydrophobicContact CG-CG 4.19Å; E196-Q203 PolarHBondContact OE1-NE2 2.73Å
197	I	75.4	Confident	91.6	Very high	147 Å²	147	66.4 Å²	66.4	75%	0.754	36%	0.357	S	S	*	.			trans	-80	-18.2	-179.5	-57.7	172.2	0	0	0	110.4
198	S	80.5	Confident	91.7	Very high	53 Å²	53	66.2 Å²	66.2	37%	0.371	36%	0.364	S	S	.	.	S	Bend	trans	-64.8	152.6	177.2	58.8	0	0	0	0	112.2	E196 N200	E196-S198 VanDerWaalsContact C-N 3.28Å; S198-N200 WeakPolarHBondContact CB-O 3.36Å; S198-N200 PolarHBondContact O-N 2.84Å; S198-N200 PolarHBondContact OG-O 2.77Å
199	N	81.9	Confident	91.7	Very high	125 Å²	125	66.1 Å²	66.1	67%	0.668	37%	0.368	S	S	*	.	S	Bend	trans	-63.9	-25.4	177.4	-73.9	-20.2	0	0	0	113.2	L151 K152	L151-N199 CarbonylContact C-O 3.55Å; L151-N199 WeakPolarHBondContact CA-O 3.43Å; K152-N199 PolarHBondContact N-O 3.15Å
200	N	88.5	Confident	91.7	Very high	93 Å²	93	67.6 Å²	67.6	50%	0.497	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.8	176.5	-60.1	-35.4	0	0	0	109	G150 L151 S198	G150-N200 CarbonylContact O-C 3.35Å; G150-N200 VanDerWaalsContact O-CA 3.31Å; G150-N200 WeakPolarHBondContact O-CA 3.33Å; L151-N200 WeakPolarHBondContact CD2-OD1 3.31Å; S198-N200 WeakPolarHBondContact CB-O 3.36Å; S198-N200 PolarHBondContact O-N 2.84Å; S198-N200 PolarHBondContact OG-O 2.77Å
201	W	91.6	Very high	91.7	Very high	11 Å²	11	69.6 Å²	69.6	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	156.4	174.6	58.7	-91.9	0	0	0	111.1	F148 R149 G150 L151 I170 V194 E196 Q203 L228	F148-W201 HydrophobicContact CB-CH2 3.97Å; F148-W201 HydrophobicContact CB-CZ3 3.66Å; R149-W201 VanDerWaalsContact CA-O 3.24Å; R149-W201 WeakPolarHBondContact CA-O 3.47Å; G150-W201 PolarHBondContact N-O 3.23Å; G150-W201 PolarHBondContact O-N 2.89Å; L151-W201 PolarHBondContact O-NE1 2.88Å; I170-W201 HydrophobicContact CG2-CH2 3.83Å; I170-W201 HydrophobicContact CG2-CZ3 4.38Å; V194-W201 HydrophobicContact CG1-CD2 3.72Å; V194-W201 HydrophobicContact CG1-CE3 4.02Å; V194-W201 HydrophobicContact CG1-CG 4.14Å; V194-W201 HydrophobicContact CG1-CH2 4.37Å; V194-W201 HydrophobicContact CG1-CZ2 4.1Å; V194-W201 HydrophobicContact CG1-CZ3 4.32Å; V194-W201 HydrophobicContact CG2-CH2 4.19Å; V194-W201 HydrophobicContact CG2-CZ3 4.2Å; E196-W201 HydrophobicContact CB-CB 3.85Å; E196-W201 HydrophobicContact CB-CG 4.22Å; E196-W201 HydrophobicContact CG-CB 3.7Å; E196-W201 HydrophobicContact CG-CG 4.19Å; W201-Q203 HydrophobicContact CE3-CB 4.43Å; W201-Q203 HydrophobicContact CE3-CG 4.14Å; W201-Q203 HydrophobicContact CZ3-CB 4.49Å; W201-L228 HydrophobicContact CH2-CD1 4.23Å; W201-L228 HydrophobicContact CZ2-CD1 4.28Å; W201-L228 HydrophobicContact CZ2-CD2 4.47Å
202	F	92.6	Very high	91.8	Very high	161 Å²	161	69.6 Å²	69.6	71%	0.706	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.8	127.7	176.8	30.2	-95.7	0	0	0	109.3	F148	F148-F202 CarbonylContact O-C 3.6Å; F148-F202 WeakPolarHBondContact O-CA 3.36Å
203	Q	94.4	Very high	92	Very high	15 Å²	15	66 Å²	66	7%	0.07	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	122.8	-175.8	-63.9	-168.4	-3.3	0	0	110.7	F148 I170 K192 E196 W201	F148-Q203 PolarHBondContact N-O 2.87Å; F148-Q203 PolarHBondContact O-N 2.92Å; I170-Q203 HydrophobicContact CD1-CB 4.23Å; K192-Q203 VanDerWaalsContact CD-OE1 3.24Å; E196-Q203 PolarHBondContact OE1-NE2 2.73Å; W201-Q203 HydrophobicContact CE3-CB 4.43Å; W201-Q203 HydrophobicContact CE3-CG 4.14Å; W201-Q203 HydrophobicContact CZ3-CB 4.49Å
204	P	96.8	Very high	92.3	Very high	75 Å²	75	67 Å²	67	49%	0.487	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	146.4	171.3	32.9	-33.2	0	0	0	111.6	Q145 I146	Q145-P204 HydrophobicContact CG-CB 4.17Å; I146-P204 CarbonylContact O-C 3.55Å; I146-P204 WeakPolarHBondContact O-CA 3.42Å
205	L	97.9	Very high	92.8	Very high	23 Å²	23	73.4 Å²	73.4	12%	0.12	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	111.4	165.7	-79	176.1	0	0	0	108.7	Q145 I146 F148 I170 V172 K192	Q145-L205 CarbonylContact C-O 3.58Å; Q145-L205 WeakPolarHBondContact CA-O 3.41Å; I146-L205 PolarHBondContact N-O 2.93Å; I146-L205 PolarHBondContact O-N 2.85Å; F148-L205 HydrophobicContact CD2-CD1 4.43Å; F148-L205 HydrophobicContact CE2-CD1 3.97Å; I170-L205 HydrophobicContact CB-CD1 4.42Å; I170-L205 HydrophobicContact CD1-CD1 3.88Å; I170-L205 HydrophobicContact CD1-CG 4.2Å; I170-L205 HydrophobicContact CG1-CD1 3.86Å; V172-L205 HydrophobicContact CG2-CB 3.94Å; V172-L205 HydrophobicContact CG2-CD1 3.91Å; K192-L205 HydrophobicContact CB-CD1 4.46Å; K192-L205 HydrophobicContact CB-CD2 4.06Å; K192-L205 HydrophobicContact CD-CD2 4.43Å
206	Y	98.6	Very high	93.4	Very high	123 Å²	123	71.3 Å²	71.3	48%	0.482	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.6	174.8	-177.5	-84.5	0	0	0	110.2	Y143 S144 Q145 F238	Y143-Y206 WeakPolarHBondContact CB-OH 3.47Å; S144-Y206 CarbonylContact O-C 3.56Å; S144-Y206 WeakPolarHBondContact O-CA 3.48Å; Q145-Y206 HydrophobicContact CB-CD2 4Å; Y206-F238 HydrophobicContact CE2-CE2 4.23Å
207	L	98.7	Very high	94.1	Very high	26 Å²	26	68.2 Å²	68.2	14%	0.136	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.1	174.2	-61.5	173.7	0	0	0	108.7	Y143 S144 V172 I174 L188	Y143-L207 CarbonylContact C-O 3.53Å; Y143-L207 WeakPolarHBondContact CA-O 3.18Å; S144-L207 PolarHBondContact N-O 2.82Å; S144-L207 PolarHBondContact O-N 3.03Å; V172-L207 HydrophobicContact CB-CD1 4.05Å; V172-L207 HydrophobicContact CG1-CD1 3.93Å; I174-L207 HydrophobicContact CD1-CB 4.45Å; L188-L207 HydrophobicContact CB-CB 4.34Å; L188-L207 HydrophobicContact CB-CD1 4.18Å; L188-L207 HydrophobicContact CD1-CB 4.2Å
208	G	98.6	Very high	95.2	Very high	32 Å²	32	64 Å²	64	33%	0.33	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	139.8	168.6	0	0	0	0	0	113.1	I142	I142-G208 CarbonylContact O-C 3.56Å; I142-G208 WeakPolarHBondContact O-CA 3.21Å
209	A	98.7	Very high	96	Very high	29 Å²	29	61.5 Å²	61.5	24%	0.24	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	170.2	178.2	0	0	0	0	0	110.7	I142 L188 F211	I142-A209 PolarHBondContact N-O 2.76Å; I142-A209 PolarHBondContact O-N 3.03Å; L188-A209 HydrophobicContact CD1-CB 4.09Å; L188-A209 HydrophobicContact CD2-CB 3.89Å; L188-A209 HydrophobicContact CG-CB 4.45Å; A209-F211 HydrophobicContact CB-CE2 3.7Å; A209-F211 HydrophobicContact CB-CZ 4Å
210	M	98.6	Very high	96.8	Very high	110 Å²	110	56.6 Å²	56.6	54%	0.542	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.4	175.7	-179.4	-176.4	82.9	0	0	110.8	D139 Y140 L244	D139-M210 HydrophobicContact CB-CG 4.18Å; D139-M210 HydrophobicContact CB-SD 4.18Å; Y140-M210 CarbonylContact O-C 3.59Å; Y140-M210 VanDerWaalsContact O-CA 3.27Å; Y140-M210 WeakPolarHBondContact O-CA 3.27Å; M210-L244 HydrophobicContact CB-CD1 4.34Å; M210-L244 HydrophobicContact CG-CD1 3.53Å; M210-L244 HydrophobicContact SD-CD1 3.28Å; M210-L244 WeakPolarHBondContact SD-CD1 3.25Å
211	F	98.4	Very high	97.3	Very high	49 Å²	49	52.1 Å²	52.1	22%	0.215	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	142.3	174.1	-61.8	-85.9	0	0	0	110.7	Y140 I142 L187 L188 A209 L213	Y140-F211 PolarHBondContact N-O 2.8Å; Y140-F211 PolarHBondContact O-N 3.15Å; I142-F211 HydrophobicContact CD1-CB 4.25Å; I142-F211 HydrophobicContact CD1-CD2 3.64Å; I142-F211 HydrophobicContact CD1-CE2 4.46Å; I142-F211 HydrophobicContact CD1-CG 4.31Å; I142-F211 HydrophobicContact CG1-CD2 4.24Å; L187-F211 HydrophobicContact CB-CD1 4.41Å; L187-F211 HydrophobicContact CB-CD2 4.38Å; L187-F211 HydrophobicContact CB-CE1 4.02Å; L187-F211 HydrophobicContact CB-CE2 3.98Å; L187-F211 HydrophobicContact CB-CZ 3.8Å; L187-F211 HydrophobicContact CD1-CD2 4.26Å; L187-F211 HydrophobicContact CD1-CG 4.29Å; L187-F211 HydrophobicContact CD2-CD1 4Å; L187-F211 HydrophobicContact CD2-CE1 4.24Å; L187-F211 HydrophobicContact CD2-CG 4.36Å; L187-F211 VanDerWaalsContact O-CZ 3.24Å; L187-F211 WeakPolarHBondContact O-CZ 3.34Å; L188-F211 HydrophobicContact CD1-CE2 3.86Å; L188-F211 HydrophobicContact CD1-CZ 4.34Å; L188-F211 HydrophobicContact CD2-CE2 4.24Å; L188-F211 HydrophobicContact CD2-CZ 3.91Å; L188-F211 HydrophobicContact CG-CE2 3.76Å; L188-F211 HydrophobicContact CG-CZ 3.73Å; A209-F211 HydrophobicContact CB-CE2 3.7Å; A209-F211 HydrophobicContact CB-CZ 4Å; F211-L213 HydrophobicContact CB-CD2 4.21Å
212	S	98.1	Very high	97.5	Very high	91 Å²	91	52.5 Å²	52.5	64%	0.636	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.3	167.4	-47.7	0	0	0	0	109.2	G138 D139	G138-S212 WeakPolarHBondContact O-CA 3.3Å; D139-S212 WeakPolarHBondContact OD1-CA 3.44Å; D139-S212 WeakPolarHBondContact OD1-CB 3.43Å; D139-S212 PolarHBondContact OD1-OG 2.85Å
213	L	97.7	Very high	97.7	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	152.9	-178.3	-56.9	177.5	0	0	0	110.4	I134 S137 G138 Y140 I142 K176 L187 F211 L219	I134-L213 HydrophobicContact CD1-CD1 3.56Å; I134-L213 HydrophobicContact CG1-CB 4.21Å; I134-L213 HydrophobicContact CG1-CD1 3.68Å; I134-L213 HydrophobicContact CG2-CB 4.17Å; S137-L213 CarbonylContact C-O 3.32Å; S137-L213 VanDerWaalsContact CA-O 3.26Å; S137-L213 WeakPolarHBondContact CA-O 3.46Å; G138-L213 PolarHBondContact N-O 2.84Å; G138-L213 PolarHBondContact O-N 2.86Å; Y140-L213 HydrophobicContact CD2-CB 3.97Å; Y140-L213 HydrophobicContact CD2-CD1 3.88Å; Y140-L213 HydrophobicContact CD2-CG 4.17Å; Y140-L213 HydrophobicContact CE2-CB 4.45Å; Y140-L213 HydrophobicContact CG-CD1 3.89Å; I142-L213 HydrophobicContact CD1-CD1 3.98Å; K176-L213 HydrophobicContact CD-CD2 3.74Å; K176-L213 HydrophobicContact CG-CD2 4.45Å; L187-L213 HydrophobicContact CD1-CD2 4.42Å; F211-L213 HydrophobicContact CB-CD2 4.21Å; L213-L219 HydrophobicContact CD1-CD1 3.93Å; L213-L219 HydrophobicContact CD1-CD2 4.23Å; L213-L219 HydrophobicContact CD1-CG 4.41Å; L213-L219 HydrophobicContact CD2-CD2 4.37Å
214	E	97.4	Very high	97.6	Very high	102 Å²	102	45.2 Å²	45.2	48%	0.477	25%	0.247	S	C	.	.			trans	-100.8	152.3	175.9	-64.1	-176.9	170.6	0	0	110.9	I134 G216 D217	I134-E214 WeakPolarHBondContact CG2-O 3.44Å; E214-G216 PolarHBondContact O-N 2.86Å; E214-D217 PolarHBondContact N-OD2 2.85Å; E214-D217 VanDerWaalsContact O-CB 3.25Å; E214-D217 WeakPolarHBondContact O-CB 3.49Å; E214-D217 PolarHBondContact O-N 3.47Å
215	E	97.6	Very high	97.3	Very high	133 Å²	133	43.8 Å²	43.8	62%	0.621	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	130.8	168.4	-178.6	175.1	178.6	0	0	110.5	S137	S137-E215 PolarHBondContact OG-N 3.04Å
216	G	96.8	Very high	97.1	Very high	27 Å²	27	43.8 Å²	43.8	28%	0.278	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	-12.1	-176.2	0	0	0	0	0	114.7	I134 E214	I134-G216 PolarHBondContact O-N 2.88Å; E214-G216 PolarHBondContact O-N 2.86Å
217	D	97.6	Very high	96.7	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.243	C	C	.	.			trans	-57.6	141.3	170.7	-82.1	-23	0	0	0	110.2	I134 K176 T178 E214	I134-D217 HydrophobicContact CB-CB 4.28Å; I134-D217 HydrophobicContact CG1-CB 4.08Å; I134-D217 WeakPolarHBondContact CG1-O 3.23Å; I134-D217 PolarHBondContact N-O 2.85Å; K176-D217 HydrophobicContact CD-CB 4.36Å; K176-D217 WeakPolarHBondContact CD-OD2 3.06Å; K176-D217 HydrophobicContact CG-CB 4.27Å; K176-D217 IonicContact NZ-OD1 3.4Å; K176-D217 PolarHBondContact NZ-OD1 3.38Å; K176-D217 IonicContact NZ-OD2 2.98Å; K176-D217 PolarHBondContact NZ-OD2 2.83Å; T178-D217 WeakPolarHBondContact CB-OD1 3.37Å; T178-D217 PolarHBondContact OG1-OD1 3.25Å; E214-D217 PolarHBondContact N-OD2 2.85Å; E214-D217 VanDerWaalsContact O-CB 3.25Å; E214-D217 WeakPolarHBondContact O-CB 3.49Å; E214-D217 PolarHBondContact O-N 3.47Å
218	R	97.9	Very high	96.5	Very high	60 Å²	60	42.9 Å²	42.9	23%	0.226	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.4	-177	-65.2	-176.5	-66.1	-82.6	6.8	110.2	F131 V133 K176 V177 D179	F131-R218 HydrophobicContact CB-CB 4Å; F131-R218 HydrophobicContact CB-CG 4.36Å; F131-R218 HydrophobicContact CD1-CB 3.7Å; F131-R218 HydrophobicContact CE1-CB 4.4Å; F131-R218 HydrophobicContact CG-CB 3.96Å; F131-R218 HydrophobicContact CG-CG 4.5Å; V133-R218 HydrophobicContact CG2-CG 4.32Å; K176-R218 CarbonylContact C-O 3.58Å; K176-R218 WeakPolarHBondContact CA-O 3.11Å; V177-R218 HydrophobicContact CB-CB 4.27Å; V177-R218 PolarHBondContact N-O 3.08Å; V177-R218 PolarHBondContact O-N 3.47Å; D179-R218 IonicContact OD1-CZ 3.09Å; D179-R218 VanDerWaalsContact OD1-CZ 3.25Å; D179-R218 IonicContact OD1-NH1 2.73Å; D179-R218 PolarHBondContact OD1-NH1 2.9Å; D179-R218 IonicContact OD1-NH2 2.87Å; D179-R218 PolarHBondContact OD1-NH2 2.9Å; D179-R218 IonicContact OD2-NH1 3.68Å; D179-R218 PolarHBondContact OD2-NH1 3.5Å
219	L	98.5	Very high	96.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	137.5	179.3	-56.3	177.3	0	0	0	110.8	F131 L132 I134 I142 T175 K176 L187 L213 F239 A241	F131-L219 CarbonylContact C-O 3.46Å; F131-L219 VanDerWaalsContact CA-O 3.29Å; F131-L219 WeakPolarHBondContact CA-O 3.32Å; L132-L219 HydrophobicContact CB-CB 4.35Å; L132-L219 PolarHBondContact N-O 3.4Å; L132-L219 PolarHBondContact O-N 3.45Å; I134-L219 HydrophobicContact CD1-CD1 3.91Å; I134-L219 HydrophobicContact CD1-CG 4.36Å; I134-L219 HydrophobicContact CG1-CG 4.48Å; I142-L219 HydrophobicContact CD1-CD1 3.78Å; I142-L219 HydrophobicContact CD1-CD2 4.17Å; I142-L219 HydrophobicContact CG1-CD1 4.17Å; I142-L219 HydrophobicContact CG2-CD1 4.32Å; T175-L219 WeakPolarHBondContact O-CA 3.41Å; K176-L219 HydrophobicContact CB-CD2 4.2Å; K176-L219 HydrophobicContact CG-CD2 4.16Å; L187-L219 HydrophobicContact CD1-CD2 3.75Å; L213-L219 HydrophobicContact CD1-CD1 3.93Å; L213-L219 HydrophobicContact CD1-CD2 4.23Å; L213-L219 HydrophobicContact CD1-CG 4.41Å; L213-L219 HydrophobicContact CD2-CD2 4.37Å; L219-F239 HydrophobicContact CB-CE1 4.47Å; L219-F239 HydrophobicContact CB-CZ 3.78Å; L219-F239 HydrophobicContact CD1-CZ 4.34Å; L219-A241 HydrophobicContact CD1-CB 4.4Å
220	M	97.9	Very high	96.3	Very high	21 Å²	21	40.3 Å²	40.3	10%	0.103	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	164.6	170.6	62.6	177.4	153.8	0	0	110.9	A109 F131 T175 V177 P184	A109-M220 HydrophobicContact CB-SD 3.84Å; F131-M220 HydrophobicContact CD1-CB 3.9Å; F131-M220 HydrophobicContact CD1-CG 4.24Å; F131-M220 HydrophobicContact CD1-SD 4.33Å; F131-M220 HydrophobicContact CE1-CB 3.98Å; F131-M220 HydrophobicContact CE1-CE 3.78Å; F131-M220 HydrophobicContact CE1-CG 3.87Å; F131-M220 HydrophobicContact CE1-SD 3.46Å; F131-M220 WeakPolarHBondContact CE1-SD 3.24Å; F131-M220 HydrophobicContact CZ-CE 4.28Å; F131-M220 HydrophobicContact CZ-SD 3.96Å; T175-M220 HydrophobicContact CG2-CE 3.94Å; T175-M220 PolarHBondContact N-O 2.93Å; T175-M220 PolarHBondContact O-N 2.76Å; V177-M220 HydrophobicContact CG2-CE 3.49Å; V177-M220 VanDerWaalsContact CG2-CE 3.49Å; P184-M220 HydrophobicContact CB-CE 4.48Å
221	V	98.3	Very high	96.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.7	175.9	-176	0	0	0	0	109.3	A109 L110 W112 I146 V172 V173 I174 F239	A109-V221 WeakPolarHBondContact CA-O 3.23Å; L110-V221 HydrophobicContact CD1-CG1 4.42Å; L110-V221 PolarHBondContact N-O 2.68Å; W112-V221 HydrophobicContact CZ2-CB 3.87Å; W112-V221 HydrophobicContact CZ2-CG1 4.36Å; W112-V221 HydrophobicContact CZ2-CG2 3.98Å; I146-V221 HydrophobicContact CD1-CG1 4.1Å; I146-V221 HydrophobicContact CG1-CG1 4.35Å; V172-V221 HydrophobicContact CG1-CG1 3.81Å; V173-V221 CarbonylContact O-C 3.52Å; V173-V221 WeakPolarHBondContact O-CA 3.46Å; I174-V221 HydrophobicContact CG1-CG2 4.33Å; V221-F239 HydrophobicContact CG2-CB 4.04Å; V221-F239 HydrophobicContact CG2-CD1 3.86Å; V221-F239 HydrophobicContact CG2-CD2 3.69Å; V221-F239 HydrophobicContact CG2-CE1 4.28Å; V221-F239 HydrophobicContact CG2-CE2 4.15Å; V221-F239 HydrophobicContact CG2-CG 3.58Å; V221-F239 HydrophobicContact CG2-CZ 4.44Å
222	N	96.5	Very high	96.1	Very high	18 Å²	18	40.6 Å²	40.6	10%	0.096	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	145.9	177.9	-55.2	86.3	0	0	0	109.8	F107 P108 V172 V173 T175	F107-N222 HydrophobicContact CB-CB 3.7Å; F107-N222 PolarHBondContact O-ND2 3.26Å; P108-N222 WeakPolarHBondContact O-CA 3.38Å; V172-N222 CarbonylContact C-O 3.57Å; V172-N222 WeakPolarHBondContact CA-O 3.38Å; V173-N222 HydrophobicContact CB-CB 4.35Å; V173-N222 PolarHBondContact N-O 2.85Å; V173-N222 PolarHBondContact O-N 2.89Å; T175-N222 WeakPolarHBondContact CB-OD1 3.44Å; T175-N222 PolarHBondContact OG1-OD1 3.38Å
223	V	95.8	Very high	96	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	155.4	178.2	-63.4	0	0	0	0	111.5	F107 P108 L110 I146 F148 V171 V172 D225 I226 V229	F107-V223 WeakPolarHBondContact CB-O 3.39Å; P108-V223 VanDerWaalsContact CD-O 3.26Å; P108-V223 WeakPolarHBondContact CD-O 3.2Å; P108-V223 PolarHBondContact O-N 2.92Å; P108-V223 VanDerWaalsContact O-N 3.15Å; L110-V223 HydrophobicContact CD1-CG1 3.82Å; L110-V223 HydrophobicContact CD2-CG2 4.04Å; L110-V223 HydrophobicContact CG-CG1 4.22Å; L110-V223 HydrophobicContact CG-CG2 4.34Å; I146-V223 HydrophobicContact CG1-CG1 4.26Å; I146-V223 HydrophobicContact CG2-CG1 4.18Å; F148-V223 HydrophobicContact CE1-CB 4.25Å; F148-V223 HydrophobicContact CE1-CG1 4.47Å; F148-V223 HydrophobicContact CZ-CB 4.13Å; F148-V223 HydrophobicContact CZ-CG1 4.01Å; V171-V223 CarbonylContact O-C 3.54Å; V171-V223 VanDerWaalsContact O-CA 3.23Å; V171-V223 WeakPolarHBondContact O-CA 3.49Å; V172-V223 HydrophobicContact CG2-CG1 4.45Å; V223-D225 VanDerWaalsContact C-N 3.34Å; V223-D225 PolarHBondContact O-N 2.75Å; V223-I226 HydrophobicContact CG2-CG1 3.78Å; V223-V229 HydrophobicContact CB-CG2 4.49Å; V223-V229 HydrophobicContact CG1-CG2 4.39Å; V223-V229 HydrophobicContact CG2-CG2 4Å
224	S	93.1	Very high	96	Very high	23 Å²	23	45.5 Å²	45.5	16%	0.161	23%	0.234	C	C	.	.	S	Bend	trans	-62.3	-40.4	176.8	55.1	0	0	0	0	112.8	S169 I170 V171	S169-S224 PolarHBondContact O-OG 2.85Å; I170-S224 WeakPolarHBondContact CA-OG 3.33Å; V171-S224 PolarHBondContact N-OG 2.91Å; V171-S224 PolarHBondContact O-N 2.91Å
225	D	90.9	Very high	96	Very high	45 Å²	45	45.5 Å²	45.5	24%	0.241	24%	0.237	C	C	.	.			trans	-147.5	115.9	-179.5	-167.7	-19.7	0	0	0	111.8	V223 S227 L228	V223-D225 VanDerWaalsContact C-N 3.34Å; V223-D225 PolarHBondContact O-N 2.75Å; D225-S227 VanDerWaalsContact C-N 3.3Å; D225-S227 PolarHBondContact O-N 2.91Å; D225-S227 VanDerWaalsContact OD1-CB 3.3Å; D225-S227 WeakPolarHBondContact OD1-CB 3.24Å; D225-S227 PolarHBondContact OD1-N 3.47Å; D225-S227 PolarHBondContact OD1-OG 3.18Å; D225-S227 PolarHBondContact OD2-OG 3.46Å; D225-L228 HydrophobicContact CB-CD1 4.02Å; D225-L228 HydrophobicContact CB-CG 4.12Å; D225-L228 PolarHBondContact O-N 3.45Å
226	I	92.6	Very high	96	Very high	23 Å²	23	42.7 Å²	42.7	12%	0.118	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.7	-32	177.4	-82.1	176	0	0	0	112.1	Q97 P108 L110 V223 L228 V229	Q97-I226 HydrophobicContact CB-CG2 3.41Å; Q97-I226 VanDerWaalsContact CB-CG2 3.41Å; Q97-I226 HydrophobicContact CG-CG2 3.93Å; P108-I226 HydrophobicContact CB-CD1 3.46Å; P108-I226 VanDerWaalsContact CB-CD1 3.46Å; P108-I226 HydrophobicContact CB-CG1 4.18Å; P108-I226 HydrophobicContact CG-CB 4.48Å; P108-I226 HydrophobicContact CG-CD1 3.52Å; P108-I226 HydrophobicContact CG-CG1 3.65Å; L110-I226 HydrophobicContact CD2-CD1 4.43Å; L110-I226 HydrophobicContact CD2-CG1 3.96Å; V223-I226 HydrophobicContact CG2-CG1 3.78Å; I226-L228 PolarHBondContact O-N 2.68Å; I226-V229 PolarHBondContact O-N 2.83Å; I226-V229 VanDerWaalsContact O-N 3.08Å
227	S	91.4	Very high	96.1	Very high	92 Å²	92	41.4 Å²	41.4	64%	0.643	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-65.1	-22.1	-176.5	72.4	0	0	0	0	112.6	D225	D225-S227 VanDerWaalsContact C-N 3.3Å; D225-S227 PolarHBondContact O-N 2.91Å; D225-S227 VanDerWaalsContact OD1-CB 3.3Å; D225-S227 WeakPolarHBondContact OD1-CB 3.24Å; D225-S227 PolarHBondContact OD1-N 3.47Å; D225-S227 PolarHBondContact OD1-OG 3.18Å; D225-S227 PolarHBondContact OD2-OG 3.46Å
228	L	93.6	Very high	96.1	Very high	39 Å²	39	42.8 Å²	42.8	20%	0.204	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-89.8	-9.6	178.1	-59.7	-179.8	0	0	0	113.2	F148 R149 I170 W201 D225 I226 D230	F148-L228 CarbonylContact C-O 3.6Å; F148-L228 VanDerWaalsContact CA-O 3.28Å; F148-L228 WeakPolarHBondContact CA-O 3.22Å; F148-L228 HydrophobicContact CD1-CB 3.92Å; R149-L228 PolarHBondContact N-O 3.02Å; R149-L228 WeakPolarHBondContact O-CA 3.47Å; R149-L228 WeakPolarHBondContact O-CD2 3.28Å; I170-L228 HydrophobicContact CG2-CD1 4.4Å; W201-L228 HydrophobicContact CH2-CD1 4.23Å; W201-L228 HydrophobicContact CZ2-CD1 4.28Å; W201-L228 HydrophobicContact CZ2-CD2 4.47Å; D225-L228 HydrophobicContact CB-CD1 4.02Å; D225-L228 HydrophobicContact CB-CG 4.12Å; D225-L228 PolarHBondContact O-N 3.45Å; I226-L228 PolarHBondContact O-N 2.68Å; L228-D230 PolarHBondContact O-N 2.02Å
229	V	96.1	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-73.9	128.5	-177	177.6	0	0	0	0	110.9	I94 L110 I146 F148 V223 I226 Y231 T237	I94-V229 HydrophobicContact CD1-CG1 4.16Å; I94-V229 HydrophobicContact CG1-CG1 4.35Å; L110-V229 HydrophobicContact CD2-CG2 4.25Å; I146-V229 HydrophobicContact CG2-CG1 4.13Å; I146-V229 HydrophobicContact CG2-CG2 4.04Å; F148-V229 HydrophobicContact CD1-CG2 4.37Å; F148-V229 HydrophobicContact CE1-CG2 4.05Å; V223-V229 HydrophobicContact CB-CG2 4.49Å; V223-V229 HydrophobicContact CG1-CG2 4.39Å; V223-V229 HydrophobicContact CG2-CG2 4Å; I226-V229 PolarHBondContact O-N 2.83Å; I226-V229 VanDerWaalsContact O-N 3.08Å; V229-Y231 WeakPolarHBondContact O-CD1 3.36Å; V229-Y231 PolarHBondContact O-N 3.07Å; V229-T237 HydrophobicContact CG1-CG2 4.08Å
230	D	96.8	Very high	96.2	Very high	7 Å²	7	40 Å²	40	4%	0.037	21%	0.205	C	C	.	.			trans	-76.3	106	171.9	-168.8	-7.1	0	0	0	110	T147 R149 L228 T232 K236 T237	T147-D230 HydrophobicContact CG2-CB 4.03Å; T147-D230 WeakPolarHBondContact O-CB 3.36Å; T147-D230 PolarHBondContact O-N 2.79Å; R149-D230 HydrophobicContact CG-CB 4.16Å; R149-D230 IonicContact NE-OD1 3.19Å; L228-D230 PolarHBondContact O-N 2.02Å; D230-T232 VanDerWaalsContact OD1-CB 3.25Å; D230-T232 WeakPolarHBondContact OD1-CB 3.47Å; D230-T232 VanDerWaalsContact OD1-CG2 3.27Å; D230-T232 WeakPolarHBondContact OD1-CG2 2.99Å; D230-T232 PolarHBondContact OD1-N 3.43Å; D230-T232 PolarHBondContact OD1-OG1 3.11Å; D230-T232 PolarHBondContact OD2-OG1 2.68Å; D230-K236 WeakPolarHBondContact OD2-CD 3.06Å; D230-K236 IonicContact OD2-NZ 2.85Å; D230-K236 PolarHBondContact OD2-NZ 3.1Å; D230-T237 PolarHBondContact O-OG1 2.86Å
231	Y	96.4	Very high	96.2	Very high	94 Å²	94	39 Å²	39	37%	0.369	20%	0.2	S	C	.	.			trans	-100	12.2	175.6	60.6	-97.8	0	0	0	113.3	L95 K96 V229	L95-Y231 WeakPolarHBondContact O-CB 3.42Å; K96-Y231 HydrophobicContact CB-CD2 4.07Å; K96-Y231 HydrophobicContact CB-CE2 4.37Å; K96-Y231 HydrophobicContact CD-CE2 4.38Å; K96-Y231 HydrophobicContact CG-CD2 4.1Å; K96-Y231 HydrophobicContact CG-CE2 3.94Å; V229-Y231 WeakPolarHBondContact O-CD1 3.36Å; V229-Y231 PolarHBondContact O-N 3.07Å
232	T	96.1	Very high	96.2	Very high	70 Å²	70	42.9 Å²	42.9	43%	0.429	22%	0.217	S	C	.	.	S	Bend	trans	-79.5	-25.7	-171.1	61	0	0	0	0	114.5	D230	D230-T232 VanDerWaalsContact OD1-CB 3.25Å; D230-T232 WeakPolarHBondContact OD1-CB 3.47Å; D230-T232 VanDerWaalsContact OD1-CG2 3.27Å; D230-T232 WeakPolarHBondContact OD1-CG2 2.99Å; D230-T232 PolarHBondContact OD1-N 3.43Å; D230-T232 PolarHBondContact OD1-OG1 3.11Å; D230-T232 PolarHBondContact OD2-OG1 2.68Å
233	K	96.8	Very high	96.3	Very high	129 Å²	129	43 Å²	43	56%	0.561	22%	0.217	S	C	*	.			trans	-144.3	141	-175.8	-61.8	-70.4	-176.4	176.6	0	111.1	D235 K236	K233-D235 VanDerWaalsContact C-N 3.31Å; K233-D235 WeakPolarHBondContact CB-OD1 3.35Å; K233-D235 PolarHBondContact O-N 2.63Å; K233-K236 HydrophobicContact CB-CD 4.21Å; K233-K236 HydrophobicContact CB-CG 4.24Å; K233-K236 PolarHBondContact O-N 3.2Å
234	E	97.9	Very high	96.4	Very high	72 Å²	72	47.8 Å²	47.8	34%	0.336	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-23.3	-177.8	57.4	178	177.9	0	0	114.1	T93 L118	T93-E234 HydrophobicContact CG2-CB 3.82Å; L118-E234 HydrophobicContact CD1-CG 4.04Å; L118-E234 HydrophobicContact CG-CG 4.39Å; L118-E234 WeakPolarHBondContact CG-OE1 3.02Å; L118-E234 PolarHBondContact N-OE2 3.19Å
235	D	96.9	Very high	96.5	Very high	102 Å²	102	49.1 Å²	49.1	55%	0.545	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.3	179.7	66.6	-31.8	0	0	0	113.8	K233 F238	K233-D235 VanDerWaalsContact C-N 3.31Å; K233-D235 WeakPolarHBondContact CB-OD1 3.35Å; K233-D235 PolarHBondContact O-N 2.63Å; D235-F238 WeakPolarHBondContact O-CE1 3.45Å
236	K	97.6	Very high	96.8	Very high	73 Å²	73	49.3 Å²	49.3	32%	0.317	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-36.2	-177.9	-70.9	-177.7	176.5	176.9	0	113.6	Q145 T147 D230 K233	Q145-K236 PolarHBondContact NE2-O 3.22Å; T147-K236 PolarHBondContact OG1-O 3.25Å; D230-K236 WeakPolarHBondContact OD2-CD 3.06Å; D230-K236 IonicContact OD2-NZ 2.85Å; D230-K236 PolarHBondContact OD2-NZ 3.1Å; K233-K236 HydrophobicContact CB-CD 4.21Å; K233-K236 HydrophobicContact CB-CG 4.24Å; K233-K236 PolarHBondContact O-N 3.2Å
237	T	98.5	Very high	97.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-135.7	114.5	-173.7	-59.6	0	0	0	0	109.6	I94 W112 Q145 I146 T147 V229 D230	I94-T237 HydrophobicContact CB-CG2 3.69Å; I94-T237 WeakPolarHBondContact CB-O 3.36Å; I94-T237 HydrophobicContact CD1-CG2 3.82Å; I94-T237 HydrophobicContact CG1-CG2 3.77Å; I94-T237 HydrophobicContact CG2-CG2 4.36Å; I94-T237 PolarHBondContact N-O 3.07Å; I94-T237 VanDerWaalsContact N-O 3.09Å; W112-T237 HydrophobicContact CH2-CG2 4.08Å; W112-T237 HydrophobicContact CZ3-CG2 4.07Å; Q145-T237 CarbonylContact O-C 3.56Å; Q145-T237 VanDerWaalsContact O-CA 3.22Å; Q145-T237 WeakPolarHBondContact O-CA 3.37Å; I146-T237 HydrophobicContact CD1-CG2 3.71Å; I146-T237 HydrophobicContact CG2-CG2 4.33Å; T147-T237 PolarHBondContact N-OG1 2.79Å; T147-T237 VanDerWaalsContact N-OG1 3.17Å; V229-T237 HydrophobicContact CG1-CG2 4.08Å; D230-T237 PolarHBondContact O-OG1 2.86Å
238	F	98.8	Very high	97.4	Very high	31 Å²	31	48.3 Å²	48.3	14%	0.136	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	161.3	-173	52.7	-99.6	0	0	0	112.1	H91 L92 Y143 S144 Q145 Y206 D235	H91-F238 AromaticContact CE1-CD2 3.76Å; H91-F238 AromaticContact CE1-CG 3.73Å; L92-F238 CarbonylContact O-C 3.55Å; L92-F238 WeakPolarHBondContact O-CA 3.38Å; L92-F238 VanDerWaalsContact O-CB 3.3Å; L92-F238 WeakPolarHBondContact O-CB 3.46Å; Y143-F238 HydrophobicContact CD2-CD2 4.15Å; Y143-F238 HydrophobicContact CD2-CE2 4.06Å; Y143-F238 AromaticContact CE2-CD2 3.98Å; Y143-F238 HydrophobicContact CE2-CD2 3.98Å; Y143-F238 HydrophobicContact CE2-CE2 4.15Å; S144-F238 CarbonylContact C-O 3.58Å; S144-F238 VanDerWaalsContact CA-O 3.23Å; S144-F238 WeakPolarHBondContact CA-O 3.31Å; S144-F238 WeakPolarHBondContact CB-O 3.33Å; S144-F238 PolarHBondContact OG-O 3.37Å; Q145-F238 HydrophobicContact CB-CD1 4.23Å; Q145-F238 HydrophobicContact CB-CD2 4.17Å; Q145-F238 HydrophobicContact CB-CE1 3.71Å; Q145-F238 HydrophobicContact CB-CE2 3.65Å; Q145-F238 HydrophobicContact CB-CG 4.44Å; Q145-F238 HydrophobicContact CB-CZ 3.4Å; Q145-F238 HydrophobicContact CG-CE1 4.43Å; Q145-F238 HydrophobicContact CG-CZ 4.32Å; Q145-F238 PolarHBondContact N-O 2.73Å; Q145-F238 PolarHBondContact O-N 2.93Å; Y206-F238 HydrophobicContact CE2-CE2 4.23Å; D235-F238 WeakPolarHBondContact O-CE1 3.45Å
239	F	98.9	Very high	97.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	135.1	178.6	166.4	-134.3	0	0	0	109.3	L92 W112 L132 I142 Y143 I174 L219 V221	L92-F239 WeakPolarHBondContact CA-O 3.42Å; L92-F239 VanDerWaalsContact CB-O 3.32Å; L92-F239 WeakPolarHBondContact CB-O 3.34Å; L92-F239 HydrophobicContact CD1-CD1 3.85Å; L92-F239 HydrophobicContact CD1-CE1 4.25Å; L92-F239 PolarHBondContact N-O 3.39Å; L92-F239 PolarHBondContact O-N 2.89Å; W112-F239 HydrophobicContact CD2-CB 4.11Å; W112-F239 HydrophobicContact CE3-CB 4.18Å; W112-F239 HydrophobicContact CH2-CB 3.7Å; W112-F239 HydrophobicContact CZ2-CB 3.6Å; W112-F239 HydrophobicContact CZ2-CG 4.4Å; W112-F239 HydrophobicContact CZ3-CB 4.01Å; L132-F239 HydrophobicContact CB-CE1 3.78Å; L132-F239 HydrophobicContact CB-CZ 4.14Å; L132-F239 HydrophobicContact CD2-CE1 4.05Å; L132-F239 HydrophobicContact CD2-CZ 3.94Å; I142-F239 HydrophobicContact CG2-CE2 3.73Å; Y143-F239 WeakPolarHBondContact O-CA 3.24Å; Y143-F239 WeakPolarHBondContact O-CD2 3.26Å; I174-F239 HydrophobicContact CG2-CE2 4.5Å; L219-F239 HydrophobicContact CB-CE1 4.47Å; L219-F239 HydrophobicContact CB-CZ 3.78Å; L219-F239 HydrophobicContact CD1-CZ 4.34Å; V221-F239 HydrophobicContact CG2-CB 4.04Å; V221-F239 HydrophobicContact CG2-CD1 3.86Å; V221-F239 HydrophobicContact CG2-CD2 3.69Å; V221-F239 HydrophobicContact CG2-CE1 4.28Å; V221-F239 HydrophobicContact CG2-CE2 4.15Å; V221-F239 HydrophobicContact CG2-CG 3.58Å; V221-F239 HydrophobicContact CG2-CZ 4.44Å
240	G	98.8	Very high	97.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	166	178.1	0	0	0	0	0	113.8	A90 Y143	A90-G240 VanDerWaalsContact O-CA 3.23Å; A90-G240 WeakPolarHBondContact O-CA 3.41Å; Y143-G240 WeakPolarHBondContact CD1-O 3.37Å; Y143-G240 PolarHBondContact N-O 2.74Å; Y143-G240 PolarHBondContact O-N 3Å
241	A	98.9	Very high	97.8	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	149.1	175.2	0	0	0	0	0	110.6	R89 A90 L132 F141 I142 L219	R89-A241 CarbonylContact C-O 3.56Å; R89-A241 WeakPolarHBondContact CA-O 3.3Å; A90-A241 PolarHBondContact N-O 3.04Å; A90-A241 PolarHBondContact O-N 3.02Å; A90-A241 VanDerWaalsContact O-N 3.1Å; L132-A241 HydrophobicContact CD2-CB 3.83Å; F141-A241 VanDerWaalsContact O-CA 3.24Å; F141-A241 WeakPolarHBondContact O-CA 3.05Å; I142-A241 HydrophobicContact CG1-CB 4.38Å; L219-A241 HydrophobicContact CD1-CB 4.4Å
242	F	98.8	Very high	97.9	Very high	82 Å²	82	52.4 Å²	52.4	36%	0.36	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	145.3	171.4	59.5	-88.2	0	0	0	111.6	P88 R89 Y140 F141 Y143 L244	P88-F242 WeakPolarHBondContact O-CA 3Å; R89-F242 HydrophobicContact CB-CB 3.77Å; Y140-F242 WeakPolarHBondContact CA-O 3.35Å; F141-F242 HydrophobicContact CB-CD1 4.45Å; F141-F242 HydrophobicContact CB-CE1 3.91Å; F141-F242 HydrophobicContact CB-CE2 3.97Å; F141-F242 HydrophobicContact CB-CZ 3.64Å; F141-F242 AromaticContact CD1-CE1 3.58Å; F141-F242 HydrophobicContact CD1-CE1 3.58Å; F141-F242 AromaticContact CD1-CZ 3.8Å; F141-F242 HydrophobicContact CD1-CZ 3.8Å; F141-F242 HydrophobicContact CG-CE1 4.14Å; F141-F242 AromaticContact CG-CZ 3.97Å; F141-F242 HydrophobicContact CG-CZ 3.97Å; F141-F242 PolarHBondContact N-O 3.04Å; F141-F242 PolarHBondContact O-N 3.46Å; F141-F242 VanDerWaalsContact O-N 3.08Å; Y143-F242 HydrophobicContact CD1-CE1 4.49Å; Y143-F242 HydrophobicContact CE1-CD1 4.21Å; Y143-F242 HydrophobicContact CE1-CE1 4.26Å; F242-L244 HydrophobicContact CD2-CD2 4.25Å; F242-L244 HydrophobicContact CE2-CD2 3.65Å
243	L	98.5	Very high	98.1	Very high	19 Å²	19	50.9 Å²	50.9	10%	0.099	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	134.1	174.9	-179.2	70	0	0	0	109.6	K87 P88 E136 Y140	K87-L243 HydrophobicContact CB-CB 4.21Å; K87-L243 WeakPolarHBondContact CD-O 3.34Å; P88-L243 HydrophobicContact CG-CD2 4.38Å; P88-L243 PolarHBondContact O-N 3Å; E136-L243 HydrophobicContact CG-CD2 4.43Å; Y140-L243 HydrophobicContact CD1-CB 4.14Å; Y140-L243 HydrophobicContact CD2-CD1 4.02Å; Y140-L243 HydrophobicContact CE1-CB 3.59Å; Y140-L243 HydrophobicContact CE1-CD1 4.31Å; Y140-L243 HydrophobicContact CE2-CB 4.39Å; Y140-L243 HydrophobicContact CE2-CD1 3.55Å
244	L	96.6	Very high	98.2	Very high	102 Å²	102	43.8 Å²	43.8	53%	0.534	21%	0.212	S	C	.	.			trans	-78.8	0	-177.6	-70.1	172.8	0	0	0	114.4	K87 D139 F141 M210 F242	K87-L244 PolarHBondContact NZ-O 3.22Å; K87-L244 PolarHBondContact NZ-OXT 3.43Å; D139-L244 HydrophobicContact CB-CD1 4.27Å; D139-L244 WeakPolarHBondContact O-CB 3.49Å; D139-L244 PolarHBondContact O-N 2.69Å; F141-L244 HydrophobicContact CB-CD2 4.18Å; F141-L244 HydrophobicContact CB-CG 4.45Å; M210-L244 HydrophobicContact CB-CD1 4.34Å; M210-L244 HydrophobicContact CG-CD1 3.53Å; M210-L244 HydrophobicContact SD-CD1 3.28Å; M210-L244 WeakPolarHBondContact SD-CD1 3.25Å; F242-L244 HydrophobicContact CD2-CD2 4.25Å; F242-L244 HydrophobicContact CE2-CD2 3.65Å

Retrieved 244 of 244 residues in 152.2 ms (Link to these results)

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