A0A096N0D4_PAPAN Loading...

Dickkopf WNT signaling pathway inhibitor 4

AlphaFold DB , UniProt , Accession A0A096N0D4, Species PAPAN (Papio anubis, Olive baboon), Gene DKK4, Length 224 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	38.5	Very low	43.7	Very low	244 Å²	244	137.5 Å²	137.5	100%	1.202	82%	0.815	S	S	*	*				0	117.6	0	-59.2	-78.3	-92	0	0	107.4
2	A	36.6	Very low	44.3	Very low	98 Å²	98	141.1 Å²	141.1	81%	0.81	83%	0.826	S	S	*	*			cis	-165.6	130.5	-13.4	0	0	0	0	0	102.3
3	A	39.5	Very low	44.6	Very low	99 Å²	99	138.7 Å²	138.7	82%	0.818	82%	0.819	S	S	*	*			trans	-73.9	163	177.4	0	0	0	0	0	111.3
4	A	43.4	Very low	45.4	Very low	92 Å²	92	137 Å²	137	76%	0.76	82%	0.818	S	S	*	*			trans	83.4	138.8	162.1	0	0	0	0	0	114
5	V	45.5	Very low	46	Very low	115 Å²	115	135.9 Å²	135.9	70%	0.697	82%	0.816	S	S	*	*				-171.8	124.9	55.5	154	0	0	0	0	108.4
6	L	43.5	Very low	46.2	Very low	134 Å²	134	138.5 Å²	138.5	70%	0.702	82%	0.823	S	S	*	*				57.4	116.7	129.3	-47.8	179.8	0	0	0	120
7	L	42.6	Very low	46.7	Very low	163 Å²	163	134.6 Å²	134.6	85%	0.853	82%	0.819	S	S	*	*				89.6	127.4	89.8	-73.5	176.6	0	0	0	113.2
8	G	40.5	Very low	47.3	Very low	65 Å²	65	132 Å²	132	67%	0.67	81%	0.813	S	S	*	*			trans	122	141.1	140.9	0	0	0	0	0	115
9	L	47.8	Very low	47.6	Very low	174 Å²	174	133.1 Å²	133.1	91%	0.911	81%	0.812	S	S	*	*			trans	87.2	120.1	175.4	-46.7	170.4	0	0	0	113.1
10	S	48.1	Very low	47.6	Very low	93 Å²	93	133.2 Å²	133.2	65%	0.65	81%	0.813	S	S	*	*			cis	-174.8	133.3	5.6	43.4	0	0	0	0	107.7
11	W	54.6	Low	47.9	Very low	236 Å²	236	133.3 Å²	133.3	89%	0.894	81%	0.808	S	S	*	*			trans	29.9	102.5	139.6	-61.9	-33.4	0	0	0	119.1
12	L	51.5	Low	48.3	Very low	180 Å²	180	127 Å²	127	94%	0.942	78%	0.779	S	S	*	*			trans	-120.7	87.6	136.1	-77.1	164.4	0	0	0	107.7
13	C	48.2	Very low	49.2	Very low	110 Å²	110	130.6 Å²	130.6	74%	0.743	78%	0.777	S	S	*	*			trans	-66.7	125.4	156.5	-83.8	0	0	0	0	108.1
14	S	54.7	Low	49.6	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	77%	0.767	S	S	*	*				-163.4	138.6	121.3	-81.9	0	0	0	0	111.2
15	P	54.9	Low	49.9	Very low	121 Å²	121	133.5 Å²	133.5	79%	0.786	77%	0.766	S	S	*	*			trans	-91.9	127.4	-173.3	35.3	-28.5	0	0	0	110.1
16	L	49.7	Very low	49.8	Very low	177 Å²	177	134.2 Å²	134.2	93%	0.927	76%	0.764	S	S	*	*			trans	-118	90.1	157.7	-90.4	147.1	0	0	0	106.3
17	G	53.8	Low	50	Low	73 Å²	73	138.2 Å²	138.2	75%	0.753	77%	0.77	S	S	*	*			trans	-61.3	133.3	160.3	0	0	0	0	0	108.7
18	A	58.5	Low	49.8	Very low	87 Å²	87	134.3 Å²	134.3	72%	0.719	76%	0.756	S	S	*	*			trans	176.1	123	132.3	0	0	0	0	0	109.9
19	L	52.8	Low	50	Low	152 Å²	152	136.2 Å²	136.2	80%	0.796	76%	0.759	S	S	*	*			trans	62.8	86.7	146	-54.9	171.2	0	0	0	116.5	L21	L19-L21 PolarHBondContact O-N 3.29Å
20	V	47.1	Very low	49.9	Very low	136 Å²	136	130.9 Å²	130.9	82%	0.824	74%	0.741	S	S	*	*			trans	-61.6	94.2	145.4	178.6	0	0	0	0	106.9	D22	V20-D22 VanDerWaalsContact C-N 3.28Å; V20-D22 HydrophobicContact CG1-CB 4.43Å; V20-D22 PolarHBondContact O-N 3.1Å; V20-D22 VanDerWaalsContact O-N 3.16Å
21	L	53.6	Low	49.9	Very low	136 Å²	136	133 Å²	133	71%	0.712	75%	0.745	S	S	*	*			trans	-74.4	94.9	156	-72	177.5	0	0	0	106.1	L19 F23	L19-L21 PolarHBondContact O-N 3.29Å; L21-F23 VanDerWaalsContact C-N 3.29Å; L21-F23 PolarHBondContact O-N 2.79Å
22	D	47.9	Very low	49.2	Very low	110 Å²	110	129.2 Å²	129.2	59%	0.588	74%	0.741	S	S	*	*			trans	-62.3	94.4	167.9	-165.8	-41.4	0	0	0	107.8	V20 N24	V20-D22 VanDerWaalsContact C-N 3.28Å; V20-D22 HydrophobicContact CG1-CB 4.43Å; V20-D22 PolarHBondContact O-N 3.1Å; V20-D22 VanDerWaalsContact O-N 3.16Å; D22-N24 PolarHBondContact O-N 3.45Å; D22-N24 VanDerWaalsContact O-N 3.12Å; D22-N24 WeakPolarHBondContact OD1-CB 3.32Å; D22-N24 VanDerWaalsContact OD1-CG 3.26Å; D22-N24 PolarHBondContact OD1-N 2.72Å; D22-N24 PolarHBondContact OD1-ND2 3.39Å
23	F	54.6	Low	48.8	Very low	175 Å²	175	128.2 Å²	128.2	77%	0.768	74%	0.736	S	S	*	*			trans	-81.2	52.3	168.8	-110.3	-84.3	0	0	0	110	L21 N25	L21-F23 VanDerWaalsContact C-N 3.29Å; L21-F23 PolarHBondContact O-N 2.79Å; F23-N25 PolarHBondContact O-N 2.81Å
24	N	48.2	Very low	48.4	Very low	113 Å²	113	126.4 Å²	126.4	60%	0.604	74%	0.736	S	S	*	*			trans	-83.2	78.7	154.4	-80.9	-58.2	0	0	0	108.4	D22 I26	D22-N24 PolarHBondContact O-N 3.45Å; D22-N24 VanDerWaalsContact O-N 3.12Å; D22-N24 WeakPolarHBondContact OD1-CB 3.32Å; D22-N24 VanDerWaalsContact OD1-CG 3.26Å; D22-N24 PolarHBondContact OD1-N 2.72Å; D22-N24 PolarHBondContact OD1-ND2 3.39Å; N24-I26 HydrophobicContact CB-CD1 4.33Å; N24-I26 HydrophobicContact CB-CG1 4.16Å; N24-I26 PolarHBondContact O-N 3.12Å
25	N	50.6	Low	48	Very low	139 Å²	139	125.3 Å²	125.3	74%	0.743	73%	0.734	S	S	*	*			trans	-70.4	67.2	153.7	-146.7	-59.7	0	0	0	107.5	F23 R27	F23-N25 PolarHBondContact O-N 2.81Å; N25-R27 VanDerWaalsContact C-N 3.25Å; N25-R27 PolarHBondContact O-N 3.08Å
26	I	43.3	Very low	48	Very low	129 Å²	129	131 Å²	131	66%	0.662	74%	0.74	S	S	*	*			trans	-64.3	103.8	158.7	-63.9	165.2	0	0	0	102.8	N24 S28	N24-I26 HydrophobicContact CB-CD1 4.33Å; N24-I26 HydrophobicContact CB-CG1 4.16Å; N24-I26 PolarHBondContact O-N 3.12Å; I26-S28 PolarHBondContact O-N 3.04Å
27	R	47.7	Very low	48.5	Very low	218 Å²	218	129.2 Å²	129.2	82%	0.823	72%	0.724	S	S	*	*			trans	-50.3	95.4	161.3	-169.6	176.9	-156.6	175.2	7	105.9	N25 S29	N25-R27 VanDerWaalsContact C-N 3.25Å; N25-R27 PolarHBondContact O-N 3.08Å; R27-S29 PolarHBondContact O-N 3.45Å; R27-S29 VanDerWaalsContact O-N 3.1Å
28	S	37.6	Very low	49.3	Very low	81 Å²	81	126.8 Å²	126.8	57%	0.566	70%	0.699	S	S	*	*			trans	-52.8	123.2	177.9	-176.7	0	0	0	0	105.5	I26 A30	I26-S28 PolarHBondContact O-N 3.04Å; S28-A30 PolarHBondContact O-N 2.84Å
29	S	45.7	Very low	50.6	Low	105 Å²	105	126.1 Å²	126.1	73%	0.734	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-68.5	37.7	173.8	55.8	0	0	0	0	111.4	R27	R27-S29 PolarHBondContact O-N 3.45Å; R27-S29 VanDerWaalsContact O-N 3.1Å
30	A	45.4	Very low	52.4	Low	62 Å²	62	125.5 Å²	125.5	51%	0.512	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-81	0.5	171.7	0	0	0	0	0	112.4	S28	S28-A30 PolarHBondContact O-N 2.84Å
31	D	46.4	Very low	54.6	Low	138 Å²	138	119.3 Å²	119.3	74%	0.738	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-101.4	22.4	174.3	-72.6	-31.9	0	0	0	114.1
32	L	41.8	Very low	56.4	Low	156 Å²	156	120.3 Å²	120.3	82%	0.817	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-113.8	10.9	166.2	-82.2	165.9	0	0	0	113.5
33	L	42.6	Very low	58.5	Low	159 Å²	159	117.2 Å²	117.2	83%	0.832	64%	0.638	S	S	*	*	S	Bend	trans	-100.1	9.2	170.1	-74.5	170.4	0	0	0	113.5	A35	L33-A35 VanDerWaalsContact C-N 3.35Å; L33-A35 PolarHBondContact O-N 3.35Å
34	G	39.3	Very low	60.2	Low	72 Å²	72	110.8 Å²	110.8	74%	0.742	61%	0.611	S	S	*	*	S	Bend	trans	-80.5	-2.8	177.2	0	0	0	0	0	116
35	A	46.6	Very low	62.3	Low	92 Å²	92	111.3 Å²	111.3	76%	0.76	62%	0.619	S	S	*	*	S	Bend	trans	-115	25.2	-165.8	0	0	0	0	0	115.8	L33	L33-A35 VanDerWaalsContact C-N 3.35Å; L33-A35 PolarHBondContact O-N 3.35Å
36	R	54.3	Low	64.2	Low	242 Å²	242	108.6 Å²	108.6	91%	0.913	60%	0.604	S	S	*	*	S	Bend	trans	-135.2	7.8	172.4	-82.2	-167.8	-171.3	173.6	5.5	115.7
37	K	61.2	Low	66.5	Low	139 Å²	139	103.1 Å²	103.1	60%	0.604	58%	0.577	S	S	*	*			trans	-87.8	115.6	170.9	-147.2	152	-166.2	167.3	0	107.6	E59	K37-E59 IonicContact NZ-OE1 2.71Å; K37-E59 PolarHBondContact NZ-OE1 3.15Å
38	G	69.3	Low	68.3	Low	22 Å²	22	98.5 Å²	98.5	23%	0.227	57%	0.569	C	S	.	*	P	Polyproline II helix	trans	-59.6	161.3	174.2	0	0	0	0	0	110.8
39	S	85.9	Confident	70.5	Confident	73 Å²	73	101.3 Å²	101.3	51%	0.51	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-56.3	143.3	172	49	0	0	0	0	110.3	F62 C63	S39-F62 CarbonylContact O-C 3.47Å; S39-F62 WeakPolarHBondContact O-CA 3.46Å; S39-C63 PolarHBondContact O-N 2.86Å; S39-C63 PolarHBondContact OG-SG 3.44Å
40	Q	91.6	Very high	72.4	Confident	138 Å²	138	104.8 Å²	104.8	65%	0.645	58%	0.579	S	S	*	*	B	Isolated β-bridge	trans	-63.3	147.3	174	-69.9	173.7	30.7	0	0	110.2	P61	Q40-P61 VanDerWaalsContact CA-O 3.29Å; Q40-P61 WeakPolarHBondContact CA-O 3.4Å
41	C	92.6	Very high	74.7	Confident	7 Å²	7	105.7 Å²	105.7	5%	0.047	57%	0.572	C	S	.	*			trans	-145.6	154.7	-179.3	55	0	0	0	0	110.2	D46 C53 P61 F62	C41-D46 HydrophobicContact CB-CB 3.94Å; C41-C53 HydrophobicContact CB-CB 3.84Å; C41-C53 WeakPolarHBondContact CB-SG 3.13Å; C41-C53 PolarHBondContact O-SG 2.84Å; C41-C53 VanDerWaalsContact O-SG 3.39Å; C41-C53 WeakPolarHBondContact SG-CA 3.33Å; C41-C53 WeakPolarHBondContact SG-CB 3.48Å; C41-C53 CovalentContact SG-SG 2.03Å; C41-C53 PolarHBondContact SG-SG 2.91Å; C41-P61 PolarHBondContact N-O 3.49Å; C41-P61 VanDerWaalsContact O-CB 3.31Å; C41-P61 WeakPolarHBondContact O-CB 3.46Å; C41-P61 WeakPolarHBondContact O-CG 3.46Å; C41-F62 VanDerWaalsContact SG-CA 3.56Å
42	L	91.1	Very high	77	Confident	156 Å²	156	99.2 Å²	99.2	82%	0.817	54%	0.537	S	S	*	.	S	Bend	trans	-105.1	-26.2	169.6	-61.9	175.8	0	0	0	110.8	D46	L42-D46 WeakPolarHBondContact CA-OD2 3.18Å; L42-D46 PolarHBondContact N-OD2 2.78Å
43	S	91.9	Very high	79.5	Confident	46 Å²	46	92 Å²	92	32%	0.322	50%	0.5	S	S	.	.	S	Bend	trans	-147.5	165.3	-177.5	67.2	0	0	0	0	111.4	T45 D46 C53	S43-T45 PolarHBondContact O-N 3.39Å; S43-T45 PolarHBondContact OG-OG1 2.87Å; S43-D46 PolarHBondContact N-OD2 3.1Å; S43-D46 WeakPolarHBondContact O-CB 3.34Å; S43-D46 PolarHBondContact O-N 2.82Å; S43-D46 PolarHBondContact OG-OD2 3.49Å; S43-C53 VanDerWaalsContact C-CB 3.48Å; S43-C53 WeakPolarHBondContact O-CB 3.43Å
44	D	91.9	Very high	81.9	Confident	40 Å²	40	86.8 Å²	86.8	21%	0.214	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-63.5	-23.2	179.1	-61.4	-32.1	0	0	0	112.4	D46 C47 C53 R75 A77	D44-D46 VanDerWaalsContact C-N 3.28Å; D44-D46 PolarHBondContact O-N 3.26Å; D44-C47 WeakPolarHBondContact O-CB 3.19Å; D44-C47 PolarHBondContact O-N 2.88Å; D44-C53 WeakPolarHBondContact OD1-CA 3.47Å; D44-C53 WeakPolarHBondContact OD1-CB 3.36Å; D44-C53 PolarHBondContact OD1-N 2.91Å; D44-R75 IonicContact OD1-NH1 3.89Å; D44-R75 IonicContact OD1-NH2 3.59Å; D44-R75 IonicContact OD2-CZ 3.64Å; D44-R75 IonicContact OD2-NH1 2.71Å; D44-R75 PolarHBondContact OD2-NH1 3.42Å; D44-R75 IonicContact OD2-NH2 3.7Å; D44-A77 HydrophobicContact CB-CB 4.45Å; D44-A77 WeakPolarHBondContact OD2-CB 3.25Å
45	T	91	Very high	84.3	Confident	124 Å²	124	89.7 Å²	89.7	76%	0.761	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-72.3	-20.8	178.1	53.6	0	0	0	0	113.4	S43 C47	S43-T45 PolarHBondContact O-N 3.39Å; S43-T45 PolarHBondContact OG-OG1 2.87Å; T45-C47 PolarHBondContact O-N 3.31Å
46	D	91.8	Very high	85.9	Confident	82 Å²	82	87.4 Å²	87.4	44%	0.439	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-74.3	-12.1	174.5	-52.5	-35.8	0	0	0	111.5	C41 L42 S43 D44	C41-D46 HydrophobicContact CB-CB 3.94Å; L42-D46 WeakPolarHBondContact CA-OD2 3.18Å; L42-D46 PolarHBondContact N-OD2 2.78Å; S43-D46 PolarHBondContact N-OD2 3.1Å; S43-D46 WeakPolarHBondContact O-CB 3.34Å; S43-D46 PolarHBondContact O-N 2.82Å; S43-D46 PolarHBondContact OG-OD2 3.49Å; D44-D46 VanDerWaalsContact C-N 3.28Å; D44-D46 PolarHBondContact O-N 3.26Å
47	C	90.3	Very high	86.9	Confident	13 Å²	13	84.5 Å²	84.5	9%	0.088	44%	0.441	C	S	.	.	S	Bend	trans	-100	138.9	-177.6	-59.4	0	0	0	0	111.3	D44 T45 K51 C63	D44-C47 WeakPolarHBondContact O-CB 3.19Å; D44-C47 PolarHBondContact O-N 2.88Å; T45-C47 PolarHBondContact O-N 3.31Å; C47-K51 HydrophobicContact CB-CB 3.78Å; C47-C63 WeakPolarHBondContact CA-SG 3.41Å; C47-C63 HydrophobicContact CB-CB 3.84Å; C47-C63 WeakPolarHBondContact CB-SG 3Å; C47-C63 WeakPolarHBondContact SG-CA 3.48Å; C47-C63 WeakPolarHBondContact SG-CB 3.27Å; C47-C63 CovalentContact SG-SG 2.04Å; C47-C63 PolarHBondContact SG-SG 2.04Å
48	N	87	Confident	87.6	Confident	122 Å²	122	84.7 Å²	84.7	65%	0.652	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-56.3	162.3	175.3	-74.8	-25.7	0	0	0	112.6	R50 K51	N48-R50 PolarHBondContact O-N 2.84Å; N48-K51 WeakPolarHBondContact O-CB 3.46Å; N48-K51 PolarHBondContact O-N 2.86Å
49	T	82.2	Confident	88.2	Confident	139 Å²	139	88.1 Å²	88.1	85%	0.853	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	134.5	173	30.7	0	0	0	0	111.5	K51	T49-K51 VanDerWaalsContact C-N 3.35Å
50	R	86.6	Confident	88.1	Confident	178 Å²	178	91.4 Å²	91.4	67%	0.672	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	21.6	-174.4	-49.5	-178	178.1	-172.7	-0.2	115.2	N48 C66 P81	N48-R50 PolarHBondContact O-N 2.84Å; R50-C66 WeakPolarHBondContact O-CB 3.04Å; R50-C66 PolarHBondContact O-N 3.45Å; R50-C66 PolarHBondContact O-SG 3.05Å; R50-P81 HydrophobicContact CG-CG 3.99Å
51	K	94	Very high	88.1	Confident	82 Å²	82	85.9 Å²	85.9	36%	0.357	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	162	169.6	-64	-171.8	-178.9	-177.6	0	110.8	C47 N48 T49 C63 A64	C47-K51 HydrophobicContact CB-CB 3.78Å; N48-K51 WeakPolarHBondContact O-CB 3.46Å; N48-K51 PolarHBondContact O-N 2.86Å; T49-K51 VanDerWaalsContact C-N 3.35Å; K51-C63 HydrophobicContact CD-CB 4.22Å; K51-A64 CarbonylContact C-O 3.55Å; K51-A64 WeakPolarHBondContact CA-O 3.04Å; K51-A64 WeakPolarHBondContact CB-O 3.17Å
52	F	94.4	Very high	88.1	Confident	2 Å²	2	87.7 Å²	87.7	1%	0.009	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	155.8	176	73.4	-87.3	0	0	0	109.8	L54 C63 A64 T65 R67 A77 M78	F52-L54 HydrophobicContact CD2-CB 4.45Å; F52-L54 HydrophobicContact CE2-CB 3.8Å; F52-L54 HydrophobicContact CE2-CD1 3.84Å; F52-L54 HydrophobicContact CE2-CG 4.37Å; F52-L54 HydrophobicContact CZ-CB 4.4Å; F52-L54 HydrophobicContact CZ-CD1 4.34Å; F52-L54 PolarHBondContact O-N 2.95Å; F52-C63 CarbonylContact O-C 3.46Å; F52-C63 WeakPolarHBondContact O-CA 3.24Å; F52-A64 HydrophobicContact CD1-CB 4.33Å; F52-A64 HydrophobicContact CE1-CB 3.84Å; F52-A64 HydrophobicContact CE2-CB 4.26Å; F52-A64 HydrophobicContact CZ-CB 3.78Å; F52-A64 PolarHBondContact N-O 2.93Å; F52-A64 PolarHBondContact O-N 3.36Å; F52-T65 VanDerWaalsContact CE1-O 3.26Å; F52-T65 WeakPolarHBondContact CE1-O 3.43Å; F52-R67 HydrophobicContact CE1-CG 4.22Å; F52-A77 WeakPolarHBondContact CB-O 3.49Å; F52-M78 HydrophobicContact CD1-CB 4.33Å; F52-M78 HydrophobicContact CD2-CB 4.43Å; F52-M78 HydrophobicContact CD2-CG 3.89Å; F52-M78 HydrophobicContact CE1-CB 4.25Å; F52-M78 HydrophobicContact CE2-CB 4.39Å; F52-M78 HydrophobicContact CE2-CE 3.62Å; F52-M78 HydrophobicContact CE2-CG 3.88Å; F52-M78 HydrophobicContact CG-CB 4.41Å; F52-M78 HydrophobicContact CG-CG 4.29Å; F52-M78 HydrophobicContact CZ-CB 4.31Å; F52-M78 HydrophobicContact CZ-CE 3.76Å; F52-M78 HydrophobicContact CZ-CG 4.26Å
53	C	94.6	Very high	88.3	Confident	4 Å²	4	80.5 Å²	80.5	3%	0.027	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	113	177	-164.7	0	0	0	0	110.2	C41 S43 D44 R75	C41-C53 HydrophobicContact CB-CB 3.84Å; C41-C53 WeakPolarHBondContact CB-SG 3.13Å; C41-C53 PolarHBondContact O-SG 2.84Å; C41-C53 VanDerWaalsContact O-SG 3.39Å; C41-C53 WeakPolarHBondContact SG-CA 3.33Å; C41-C53 WeakPolarHBondContact SG-CB 3.48Å; C41-C53 CovalentContact SG-SG 2.03Å; C41-C53 PolarHBondContact SG-SG 2.91Å; S43-C53 VanDerWaalsContact C-CB 3.48Å; S43-C53 WeakPolarHBondContact O-CB 3.43Å; D44-C53 WeakPolarHBondContact OD1-CA 3.47Å; D44-C53 WeakPolarHBondContact OD1-CB 3.36Å; D44-C53 PolarHBondContact OD1-N 2.91Å; C53-R75 PolarHBondContact O-NH2 2.73Å
54	L	93.2	Very high	88.3	Confident	50 Å²	50	79 Å²	79	26%	0.262	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	112.8	177	-178.1	64.8	0	0	0	109.4	F52 P61 F62 A64	F52-L54 HydrophobicContact CD2-CB 4.45Å; F52-L54 HydrophobicContact CE2-CB 3.8Å; F52-L54 HydrophobicContact CE2-CD1 3.84Å; F52-L54 HydrophobicContact CE2-CG 4.37Å; F52-L54 HydrophobicContact CZ-CB 4.4Å; F52-L54 HydrophobicContact CZ-CD1 4.34Å; F52-L54 PolarHBondContact O-N 2.95Å; L54-P61 WeakPolarHBondContact O-CA 3.37Å; L54-F62 HydrophobicContact CD2-CE1 4.22Å; L54-F62 HydrophobicContact CD2-CZ 3.86Å; L54-F62 PolarHBondContact N-O 3.5Å; L54-F62 PolarHBondContact O-N 3.19Å; L54-A64 HydrophobicContact CB-CB 3.95Å; L54-A64 HydrophobicContact CD2-CB 4.38Å
55	Q	88.6	Confident	88.5	Confident	133 Å²	133	82 Å²	82	62%	0.621	42%	0.42	S	S	*	.			trans	-77	122.9	169.4	-151	79.8	5.8	0	0	109.1
56	S	80.4	Confident	88.7	Confident	44 Å²	44	76.9 Å²	76.9	31%	0.308	39%	0.39	S	S	.	.			trans	-104.5	147.8	165.8	-176	0	0	0	0	108.4
57	H	75.7	Confident	88.9	Confident	181 Å²	181	76.8 Å²	76.8	84%	0.838	38%	0.383	S	S	*	.	S	Bend	trans	-72.5	-32.4	178.2	-172	-89	0	0	0	111.9
58	D	76.2	Confident	89.1	Confident	142 Å²	142	77.7 Å²	77.7	76%	0.759	40%	0.395	S	S	*	.	S	Bend	trans	-111.4	-2.8	-172.8	-60.2	-27.1	0	0	0	113.3
59	E	80.9	Confident	89.4	Confident	95 Å²	95	76.4 Å²	76.4	44%	0.444	39%	0.388	S	S	.	.	S	Bend	trans	-133	153.3	179.7	-64	-163	104.7	0	0	112.3	K37	K37-E59 IonicContact NZ-OE1 2.71Å; K37-E59 PolarHBondContact NZ-OE1 3.15Å
60	K	85.1	Confident	90	Very high	141 Å²	141	78.9 Å²	78.9	61%	0.613	38%	0.382	S	S	*	.			trans	-57.6	137.5	173.3	-82.5	-176.9	176	-174.7	0	111.1
61	P	90.9	Very high	90.4	Very high	23 Å²	23	78.3 Å²	78.3	15%	0.149	38%	0.38	C	S	.	.			trans	-59.6	142.5	179.6	24	-34.4	0	0	0	111.7	Q40 C41 L54	Q40-P61 VanDerWaalsContact CA-O 3.29Å; Q40-P61 WeakPolarHBondContact CA-O 3.4Å; C41-P61 PolarHBondContact N-O 3.49Å; C41-P61 VanDerWaalsContact O-CB 3.31Å; C41-P61 WeakPolarHBondContact O-CB 3.46Å; C41-P61 WeakPolarHBondContact O-CG 3.46Å; L54-P61 WeakPolarHBondContact O-CA 3.37Å
62	F	93	Very high	90.5	Very high	44 Å²	44	83.5 Å²	83.5	19%	0.193	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	154.3	-178.2	70.5	-88.5	0	0	0	112.8	S39 C41 L54 A64	S39-F62 CarbonylContact O-C 3.47Å; S39-F62 WeakPolarHBondContact O-CA 3.46Å; C41-F62 VanDerWaalsContact SG-CA 3.56Å; L54-F62 HydrophobicContact CD2-CE1 4.22Å; L54-F62 HydrophobicContact CD2-CZ 3.86Å; L54-F62 PolarHBondContact N-O 3.5Å; L54-F62 PolarHBondContact O-N 3.19Å; F62-A64 HydrophobicContact CE2-CB 4.11Å; F62-A64 PolarHBondContact O-N 3.34Å; F62-A64 VanDerWaalsContact O-N 3.15Å
63	C	94.2	Very high	90.6	Very high	5 Å²	5	83.8 Å²	83.8	3%	0.034	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	106.8	177.5	-68	0	0	0	0	111	S39 C47 K51 F52	S39-C63 PolarHBondContact O-N 2.86Å; S39-C63 PolarHBondContact OG-SG 3.44Å; C47-C63 WeakPolarHBondContact CA-SG 3.41Å; C47-C63 HydrophobicContact CB-CB 3.84Å; C47-C63 WeakPolarHBondContact CB-SG 3Å; C47-C63 WeakPolarHBondContact SG-CA 3.48Å; C47-C63 WeakPolarHBondContact SG-CB 3.27Å; C47-C63 CovalentContact SG-SG 2.04Å; C47-C63 PolarHBondContact SG-SG 2.04Å; K51-C63 HydrophobicContact CD-CB 4.22Å; F52-C63 CarbonylContact O-C 3.46Å; F52-C63 WeakPolarHBondContact O-CA 3.24Å
64	A	93.6	Very high	90.6	Very high	16 Å²	16	91.2 Å²	91.2	13%	0.132	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	156.9	172.5	0	0	0	0	0	110.9	K51 F52 L54 F62	K51-A64 CarbonylContact C-O 3.55Å; K51-A64 WeakPolarHBondContact CA-O 3.04Å; K51-A64 WeakPolarHBondContact CB-O 3.17Å; F52-A64 HydrophobicContact CD1-CB 4.33Å; F52-A64 HydrophobicContact CE1-CB 3.84Å; F52-A64 HydrophobicContact CE2-CB 4.26Å; F52-A64 HydrophobicContact CZ-CB 3.78Å; F52-A64 PolarHBondContact N-O 2.93Å; F52-A64 PolarHBondContact O-N 3.36Å; L54-A64 HydrophobicContact CB-CB 3.95Å; L54-A64 HydrophobicContact CD2-CB 4.38Å; F62-A64 HydrophobicContact CE2-CB 4.11Å; F62-A64 PolarHBondContact O-N 3.34Å; F62-A64 VanDerWaalsContact O-N 3.15Å
65	T	94.9	Very high	90.6	Very high	101 Å²	101	94.2 Å²	94.2	62%	0.62	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	143.7	175.9	-51.8	0	0	0	0	110.3	F52	F52-T65 VanDerWaalsContact CE1-O 3.26Å; F52-T65 WeakPolarHBondContact CE1-O 3.43Å
66	C	95.5	Very high	90.9	Very high	18 Å²	18	92.4 Å²	92.4	12%	0.122	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-53.5	152.3	175.2	70.5	0	0	0	0	112.2	R50 M78 C80	R50-C66 WeakPolarHBondContact O-CB 3.04Å; R50-C66 PolarHBondContact O-N 3.45Å; R50-C66 PolarHBondContact O-SG 3.05Å; C66-M78 CarbonylContact C-O 3.48Å; C66-C80 HydrophobicContact CB-CB 3.94Å; C66-C80 WeakPolarHBondContact CB-SG 3.45Å; C66-C80 PolarHBondContact O-SG 3.48Å; C66-C80 WeakPolarHBondContact SG-CA 3.33Å; C66-C80 WeakPolarHBondContact SG-CB 3.06Å; C66-C80 CovalentContact SG-SG 2.05Å; C66-C80 PolarHBondContact SG-SG 3.05Å
67	R	95.9	Very high	91.4	Very high	79 Å²	79	92.4 Å²	92.4	30%	0.298	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-95	129.5	-177.2	-58.2	-174.1	179.8	-160.9	0.1	109.2	F52 R71 R72 M78 C79 C80	F52-R67 HydrophobicContact CE1-CG 4.22Å; R67-R71 HydrophobicContact CB-CB 3.85Å; R67-R71 HydrophobicContact CB-CG 4.44Å; R67-R72 WeakPolarHBondContact CD-O 3.44Å; R67-R72 PolarHBondContact NH1-O 2.77Å; R67-M78 WeakPolarHBondContact CA-O 3.5Å; R67-M78 WeakPolarHBondContact CB-O 3.02Å; R67-M78 VanDerWaalsContact CG-O 3.29Å; R67-M78 WeakPolarHBondContact CG-O 3.22Å; R67-M78 PolarHBondContact N-O 3.08Å; R67-M78 VanDerWaalsContact NH2-CE 3.28Å; R67-C79 WeakPolarHBondContact O-CA 3.29Å; R67-C80 VanDerWaalsContact C-SG 3.59Å; R67-C80 PolarHBondContact O-N 3.03Å; R67-C80 PolarHBondContact O-SG 2.95Å
68	G	94.2	Very high	92.4	Very high	33 Å²	33	84.2 Å²	84.2	34%	0.34	40%	0.4	S	S	.	.			trans	-71.8	175.5	178.2	0	0	0	0	0	113.4	R71 C90	G68-R71 WeakPolarHBondContact O-CB 3.37Å; G68-R71 WeakPolarHBondContact O-CG 3.37Å; G68-R71 PolarHBondContact O-N 2.97Å; G68-R71 VanDerWaalsContact O-N 3.17Å; G68-C90 WeakPolarHBondContact O-CB 3.24Å
69	L	94.4	Very high	93.3	Very high	95 Å²	95	77.9 Å²	77.9	50%	0.497	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	140.4	174.3	-106.1	129.9	0	0	0	112.8	R71 T83 T92	L69-R71 PolarHBondContact O-N 3.49Å; L69-T83 HydrophobicContact CD1-CG2 3.85Å; L69-T83 HydrophobicContact CG-CG2 3.92Å; L69-T92 HydrophobicContact CD1-CG2 4.16Å; L69-T92 HydrophobicContact CD2-CG2 3.87Å; L69-T92 HydrophobicContact CG-CG2 4.45Å
70	R	93	Very high	94	Very high	190 Å²	190	74.9 Å²	74.9	72%	0.717	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	8.3	179.8	-55.3	179.5	177.2	179.6	-1.3	115.4	V89 C90	R70-V89 VanDerWaalsContact CA-CG1 3.42Å; R70-V89 HydrophobicContact CB-CG1 4.37Å; R70-C90 PolarHBondContact N-O 3.22Å
71	R	95.9	Very high	94.4	Very high	167 Å²	167	72.9 Å²	72.9	63%	0.63	36%	0.358	S	S	*	.			trans	-82.7	150.5	172.3	-63.3	-61.3	-174.8	173	1.2	110.3	R67 G68 L69 V89 C90	R67-R71 HydrophobicContact CB-CB 3.85Å; R67-R71 HydrophobicContact CB-CG 4.44Å; G68-R71 WeakPolarHBondContact O-CB 3.37Å; G68-R71 WeakPolarHBondContact O-CG 3.37Å; G68-R71 PolarHBondContact O-N 2.97Å; G68-R71 VanDerWaalsContact O-N 3.17Å; L69-R71 PolarHBondContact O-N 3.49Å; R71-V89 CarbonylContact O-C 3.41Å; R71-V89 WeakPolarHBondContact O-CA 3.03Å; R71-C90 PolarHBondContact O-N 2.03Å
72	R	96.1	Very high	94.4	Very high	190 Å²	190	74.5 Å²	74.5	72%	0.717	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-62.1	141.3	176.1	-72.2	-177	-176.9	-100.3	3.4	110.3	R67 D88	R67-R72 WeakPolarHBondContact CD-O 3.44Å; R67-R72 PolarHBondContact NH1-O 2.77Å; R72-D88 CarbonylContact C-O 3.44Å; R72-D88 WeakPolarHBondContact CA-O 3.07Å
73	C	95.8	Very high	94.5	Very high	8 Å²	8	73.4 Å²	73.4	5%	0.054	38%	0.376	C	S	.	.			trans	-143.9	166.7	176.1	57.3	0	0	0	0	109.4	M78 C85 D88 V89 C90	C73-M78 HydrophobicContact CB-CB 4.35Å; C73-C85 HydrophobicContact CB-CB 3.87Å; C73-C85 WeakPolarHBondContact CB-SG 3.44Å; C73-C85 WeakPolarHBondContact SG-CA 3.46Å; C73-C85 WeakPolarHBondContact SG-CB 3.34Å; C73-C85 CovalentContact SG-SG 2.03Å; C73-C85 PolarHBondContact SG-SG 3.18Å; C73-D88 PolarHBondContact N-O 2.98Å; C73-D88 WeakPolarHBondContact O-CA 3.47Å; C73-V89 PolarHBondContact SG-N 3.2Å; C73-C90 PolarHBondContact SG-N 2.02Å
74	Q	94.7	Very high	94.5	Very high	161 Å²	161	74.8 Å²	74.8	75%	0.752	38%	0.383	S	S	*	.	S	Bend	trans	-127.3	-23.5	172.7	-170	173.8	7.6	0	0	111.4	M78	Q74-M78 HydrophobicContact CB-SD 3.74Å; Q74-M78 PolarHBondContact N-SD 3.07Å
75	R	93.9	Very high	94.6	Very high	113 Å²	113	75.2 Å²	75.2	43%	0.426	39%	0.385	S	S	.	.	S	Bend	trans	-140.1	151.6	179	-58.7	-176.1	-71.1	121.1	-0.2	109.2	D44 C53 A77 M78	D44-R75 IonicContact OD1-NH1 3.89Å; D44-R75 IonicContact OD1-NH2 3.59Å; D44-R75 IonicContact OD2-CZ 3.64Å; D44-R75 IonicContact OD2-NH1 2.71Å; D44-R75 PolarHBondContact OD2-NH1 3.42Å; D44-R75 IonicContact OD2-NH2 3.7Å; C53-R75 PolarHBondContact O-NH2 2.73Å; R75-A77 VanDerWaalsContact C-N 3.27Å; R75-A77 PolarHBondContact O-N 3.04Å; R75-M78 HydrophobicContact CB-CG 4.23Å; R75-M78 HydrophobicContact CB-SD 4.45Å; R75-M78 VanDerWaalsContact O-CB 3.25Å; R75-M78 WeakPolarHBondContact O-CB 3.13Å; R75-M78 WeakPolarHBondContact O-CG 2.95Å; R75-M78 PolarHBondContact O-N 2.85Å
76	D	94	Very high	94.7	Very high	94 Å²	94	73.1 Å²	73.1	50%	0.503	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-59.8	-36.6	179.7	-66.2	-19	0	0	0	113	M78 C79 C85	D76-M78 PolarHBondContact O-N 3.39Å; D76-M78 VanDerWaalsContact O-N 3.07Å; D76-C79 WeakPolarHBondContact O-CB 2.99Å; D76-C79 PolarHBondContact O-N 2.85Å; D76-C85 WeakPolarHBondContact OD1-CA 3.42Å; D76-C85 VanDerWaalsContact OD1-CB 3.25Å; D76-C85 WeakPolarHBondContact OD1-CB 3.4Å; D76-C85 PolarHBondContact OD1-N 2.98Å
77	A	92.6	Very high	94.6	Very high	44 Å²	44	79.6 Å²	79.6	36%	0.364	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-58.6	-23	176.2	0	0	0	0	0	113.2	D44 F52 R75 C79	D44-A77 HydrophobicContact CB-CB 4.45Å; D44-A77 WeakPolarHBondContact OD2-CB 3.25Å; F52-A77 WeakPolarHBondContact CB-O 3.49Å; R75-A77 VanDerWaalsContact C-N 3.27Å; R75-A77 PolarHBondContact O-N 3.04Å; A77-C79 VanDerWaalsContact C-N 3.25Å; A77-C79 PolarHBondContact O-N 2.78Å
78	M	94.9	Very high	94.6	Very high	9 Å²	9	80.8 Å²	80.8	4%	0.044	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-73.7	-19.7	175.1	-54	178.2	81.1	0	0	112.1	F52 C66 R67 C73 Q74 R75 D76	F52-M78 HydrophobicContact CD1-CB 4.33Å; F52-M78 HydrophobicContact CD2-CB 4.43Å; F52-M78 HydrophobicContact CD2-CG 3.89Å; F52-M78 HydrophobicContact CE1-CB 4.25Å; F52-M78 HydrophobicContact CE2-CB 4.39Å; F52-M78 HydrophobicContact CE2-CE 3.62Å; F52-M78 HydrophobicContact CE2-CG 3.88Å; F52-M78 HydrophobicContact CG-CB 4.41Å; F52-M78 HydrophobicContact CG-CG 4.29Å; F52-M78 HydrophobicContact CZ-CB 4.31Å; F52-M78 HydrophobicContact CZ-CE 3.76Å; F52-M78 HydrophobicContact CZ-CG 4.26Å; C66-M78 CarbonylContact C-O 3.48Å; R67-M78 WeakPolarHBondContact CA-O 3.5Å; R67-M78 WeakPolarHBondContact CB-O 3.02Å; R67-M78 VanDerWaalsContact CG-O 3.29Å; R67-M78 WeakPolarHBondContact CG-O 3.22Å; R67-M78 PolarHBondContact N-O 3.08Å; R67-M78 VanDerWaalsContact NH2-CE 3.28Å; C73-M78 HydrophobicContact CB-CB 4.35Å; Q74-M78 HydrophobicContact CB-SD 3.74Å; Q74-M78 PolarHBondContact N-SD 3.07Å; R75-M78 HydrophobicContact CB-CG 4.23Å; R75-M78 HydrophobicContact CB-SD 4.45Å; R75-M78 VanDerWaalsContact O-CB 3.25Å; R75-M78 WeakPolarHBondContact O-CB 3.13Å; R75-M78 WeakPolarHBondContact O-CG 2.95Å; R75-M78 PolarHBondContact O-N 2.85Å; D76-M78 PolarHBondContact O-N 3.39Å; D76-M78 VanDerWaalsContact O-N 3.07Å
79	C	95.6	Very high	94.7	Very high	10 Å²	10	81.5 Å²	81.5	7%	0.068	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-90.9	150	-178	-62.8	0	0	0	0	111.1	R67 D76 A77 T83 C90	R67-C79 WeakPolarHBondContact O-CA 3.29Å; D76-C79 WeakPolarHBondContact O-CB 2.99Å; D76-C79 PolarHBondContact O-N 2.85Å; A77-C79 VanDerWaalsContact C-N 3.25Å; A77-C79 PolarHBondContact O-N 2.78Å; C79-T83 WeakPolarHBondContact CB-OG1 3.39Å; C79-C90 VanDerWaalsContact CA-SG 3.51Å; C79-C90 HydrophobicContact CB-CB 3.82Å; C79-C90 WeakPolarHBondContact CB-SG 3.43Å; C79-C90 WeakPolarHBondContact SG-CA 2.96Å; C79-C90 WeakPolarHBondContact SG-CB 3.3Å; C79-C90 CovalentContact SG-SG 2.04Å; C79-C90 PolarHBondContact SG-SG 3.13Å
80	C	95.6	Very high	94.8	Very high	32 Å²	32	77 Å²	77	22%	0.216	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-69.2	158.2	179.3	-67.3	0	0	0	0	111.8	C66 R67 G82 T83	C66-C80 HydrophobicContact CB-CB 3.94Å; C66-C80 WeakPolarHBondContact CB-SG 3.45Å; C66-C80 PolarHBondContact O-SG 3.48Å; C66-C80 WeakPolarHBondContact SG-CA 3.33Å; C66-C80 WeakPolarHBondContact SG-CB 3.06Å; C66-C80 CovalentContact SG-SG 2.05Å; C66-C80 PolarHBondContact SG-SG 3.05Å; R67-C80 VanDerWaalsContact C-SG 3.59Å; R67-C80 PolarHBondContact O-N 3.03Å; R67-C80 PolarHBondContact O-SG 2.95Å; C80-G82 PolarHBondContact O-N 3.48Å; C80-T83 PolarHBondContact N-OG1 2.99Å; C80-T83 PolarHBondContact O-N 2.92Å; C80-T83 VanDerWaalsContact O-N 3.08Å; C80-T83 PolarHBondContact O-OG1 2.83Å
81	P	92.9	Very high	94.9	Very high	98 Å²	98	69.4 Å²	69.4	64%	0.636	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	136.7	180	-27.7	34.9	0	0	0	112.9	R50	R50-P81 HydrophobicContact CG-CG 3.99Å
82	G	91	Very high	94.7	Very high	58 Å²	58	62.8 Å²	62.8	60%	0.598	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	7.2	-175	0	0	0	0	0	114.8	C80	C80-G82 PolarHBondContact O-N 3.48Å
83	T	95	Very high	93.9	Very high	21 Å²	21	59.8 Å²	59.8	13%	0.129	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	150.6	174.7	60.4	0	0	0	0	111.5	L69 C79 C80 T91	L69-T83 HydrophobicContact CD1-CG2 3.85Å; L69-T83 HydrophobicContact CG-CG2 3.92Å; C79-T83 WeakPolarHBondContact CB-OG1 3.39Å; C80-T83 PolarHBondContact N-OG1 2.99Å; C80-T83 PolarHBondContact O-N 2.92Å; C80-T83 VanDerWaalsContact O-N 3.08Å; C80-T83 PolarHBondContact O-OG1 2.83Å; T83-T91 CarbonylContact C-O 3.51Å; T83-T91 WeakPolarHBondContact CA-O 3.49Å; T83-T91 WeakPolarHBondContact CB-O 3.28Å
84	L	95.4	Very high	92.8	Very high	34 Å²	34	67 Å²	67	18%	0.178	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	160.5	176.9	67.4	118.9	0	0	0	111.5	M86 C90 T91 M93 A96	L84-M86 HydrophobicContact CD1-CG 3.27Å; L84-M86 HydrophobicContact CD1-SD 3.81Å; L84-M86 HydrophobicContact CG-CG 4.12Å; L84-M86 HydrophobicContact CG-SD 4.5Å; L84-M86 PolarHBondContact O-N 3.39Å; L84-C90 CarbonylContact O-C 3.51Å; L84-C90 WeakPolarHBondContact O-CA 3.31Å; L84-T91 PolarHBondContact N-O 3.37Å; L84-T91 PolarHBondContact O-N 2.69Å; L84-T91 PolarHBondContact O-OG1 2.99Å; L84-M93 HydrophobicContact CD2-CB 4.13Å; L84-M93 HydrophobicContact CD2-CG 3.88Å; L84-M93 HydrophobicContact CD2-SD 3.77Å; L84-A96 HydrophobicContact CD1-CB 4.27Å; L84-A96 HydrophobicContact CD2-CB 4.01Å
85	C	96.1	Very high	91.2	Very high	25 Å²	25	64.5 Å²	64.5	17%	0.169	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.9	-178.6	-166.7	0	0	0	0	110.5	C73 D76	C73-C85 HydrophobicContact CB-CB 3.87Å; C73-C85 WeakPolarHBondContact CB-SG 3.44Å; C73-C85 WeakPolarHBondContact SG-CA 3.46Å; C73-C85 WeakPolarHBondContact SG-CB 3.34Å; C73-C85 CovalentContact SG-SG 2.03Å; C73-C85 PolarHBondContact SG-SG 3.18Å; D76-C85 WeakPolarHBondContact OD1-CA 3.42Å; D76-C85 VanDerWaalsContact OD1-CB 3.25Å; D76-C85 WeakPolarHBondContact OD1-CB 3.4Å; D76-C85 PolarHBondContact OD1-N 2.98Å
86	M	95.6	Very high	89.6	Confident	57 Å²	57	60.6 Å²	60.6	28%	0.281	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.3	175	-64.6	-173.5	77.7	0	0	110.3	L84 D88 V89 T91 A96	L84-M86 HydrophobicContact CD1-CG 3.27Å; L84-M86 HydrophobicContact CD1-SD 3.81Å; L84-M86 HydrophobicContact CG-CG 4.12Å; L84-M86 HydrophobicContact CG-SD 4.5Å; L84-M86 PolarHBondContact O-N 3.39Å; M86-D88 PolarHBondContact O-N 3.43Å; M86-V89 PolarHBondContact N-O 2.04Å; M86-V89 PolarHBondContact O-N 2.02Å; M86-T91 HydrophobicContact CB-CG2 4.11Å; M86-T91 WeakPolarHBondContact CG-OG1 3.48Å; M86-T91 PolarHBondContact SD-OG1 3.02Å; M86-T91 VanDerWaalsContact SD-OG1 3.38Å; M86-A96 HydrophobicContact CE-CB 3.92Å; M86-A96 WeakPolarHBondContact SD-CA 2.96Å; M86-A96 HydrophobicContact SD-CB 3.26Å; M86-A96 WeakPolarHBondContact SD-CB 3.3Å
87	N	94.5	Very high	87.7	Confident	154 Å²	154	61 Å²	61	82%	0.824	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	47.7	-178.3	-58.8	-45.9	0	0	0	111.6	V89	N87-V89 PolarHBondContact O-N 2.81Å; N87-V89 VanDerWaalsContact O-N 3.13Å
88	D	96.1	Very high	85.6	Confident	103 Å²	103	64.5 Å²	64.5	55%	0.551	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	19.8	-176.6	-53.6	-55.9	0	0	0	115	R72 C73 M86	R72-D88 CarbonylContact C-O 3.44Å; R72-D88 WeakPolarHBondContact CA-O 3.07Å; C73-D88 PolarHBondContact N-O 2.98Å; C73-D88 WeakPolarHBondContact O-CA 3.47Å; M86-D88 PolarHBondContact O-N 3.43Å
89	V	95.8	Very high	83.3	Confident	49 Å²	49	72.4 Å²	72.4	30%	0.297	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.8	-177	178.7	0	0	0	0	110.9	R70 R71 C73 M86 N87 T91	R70-V89 VanDerWaalsContact CA-CG1 3.42Å; R70-V89 HydrophobicContact CB-CG1 4.37Å; R71-V89 CarbonylContact O-C 3.41Å; R71-V89 WeakPolarHBondContact O-CA 3.03Å; C73-V89 PolarHBondContact SG-N 3.2Å; M86-V89 PolarHBondContact N-O 2.04Å; M86-V89 PolarHBondContact O-N 2.02Å; N87-V89 PolarHBondContact O-N 2.81Å; N87-V89 VanDerWaalsContact O-N 3.13Å; V89-T91 PolarHBondContact O-N 3.41Å
90	C	96.6	Very high	81.2	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	119.2	173.9	-61.8	0	0	0	0	110.4	G68 R70 R71 C73 C79 L84	G68-C90 WeakPolarHBondContact O-CB 3.24Å; R70-C90 PolarHBondContact N-O 3.22Å; R71-C90 PolarHBondContact O-N 2.03Å; C73-C90 PolarHBondContact SG-N 2.02Å; C79-C90 VanDerWaalsContact CA-SG 3.51Å; C79-C90 HydrophobicContact CB-CB 3.82Å; C79-C90 WeakPolarHBondContact CB-SG 3.43Å; C79-C90 WeakPolarHBondContact SG-CA 2.96Å; C79-C90 WeakPolarHBondContact SG-CB 3.3Å; C79-C90 CovalentContact SG-SG 2.04Å; C79-C90 PolarHBondContact SG-SG 3.13Å; L84-C90 CarbonylContact O-C 3.51Å; L84-C90 WeakPolarHBondContact O-CA 3.31Å
91	T	94.8	Very high	78.5	Confident	31 Å²	31	86.2 Å²	86.2	19%	0.19	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	163.7	-177.4	60.4	0	0	0	0	111.1	T83 L84 M86 V89	T83-T91 CarbonylContact C-O 3.51Å; T83-T91 WeakPolarHBondContact CA-O 3.49Å; T83-T91 WeakPolarHBondContact CB-O 3.28Å; L84-T91 PolarHBondContact N-O 3.37Å; L84-T91 PolarHBondContact O-N 2.69Å; L84-T91 PolarHBondContact O-OG1 2.99Å; M86-T91 HydrophobicContact CB-CG2 4.11Å; M86-T91 WeakPolarHBondContact CG-OG1 3.48Å; M86-T91 PolarHBondContact SD-OG1 3.02Å; M86-T91 VanDerWaalsContact SD-OG1 3.38Å; V89-T91 PolarHBondContact O-N 3.41Å
92	T	92.8	Very high	76.6	Confident	28 Å²	28	91.8 Å²	91.8	17%	0.172	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	154	175.9	71.7	0	0	0	0	110.3	L69 E94 D95	L69-T92 HydrophobicContact CD1-CG2 4.16Å; L69-T92 HydrophobicContact CD2-CG2 3.87Å; L69-T92 HydrophobicContact CG-CG2 4.45Å; T92-E94 PolarHBondContact O-N 3.02Å; T92-D95 PolarHBondContact O-N 3.46Å; T92-D95 PolarHBondContact OG1-N 3.27Å; T92-D95 PolarHBondContact OG1-OD2 2.97Å
93	M	78.4	Confident	74.7	Confident	126 Å²	126	98.1 Å²	98.1	62%	0.621	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-22.9	177	-56.3	-113.2	-69.4	0	0	113	L84	L84-M93 HydrophobicContact CD2-CB 4.13Å; L84-M93 HydrophobicContact CD2-CG 3.88Å; L84-M93 HydrophobicContact CD2-SD 3.77Å
94	E	72.5	Confident	72.1	Confident	160 Å²	160	104.7 Å²	104.7	75%	0.748	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-23.8	-178.8	-59.1	166	132.9	0	0	112.9	T92 A96	T92-E94 PolarHBondContact O-N 3.02Å; E94-A96 VanDerWaalsContact C-N 3.33Å
95	D	62.3	Low	69.3	Low	108 Å²	108	109.9 Å²	109.9	58%	0.578	56%	0.561	S	S	*	*	S	Bend	trans	-87.5	-5.3	177.8	-67.9	-48.2	0	0	0	112.5	T92	T92-D95 PolarHBondContact O-N 3.46Å; T92-D95 PolarHBondContact OG1-N 3.27Å; T92-D95 PolarHBondContact OG1-OD2 2.97Å
96	A	59	Low	67	Low	32 Å²	32	116.9 Å²	116.9	26%	0.264	59%	0.591	S	S	.	*	S	Bend	trans	-81.4	-14.5	-177	0	0	0	0	0	114.5	L84 M86 E94	L84-A96 HydrophobicContact CD1-CB 4.27Å; L84-A96 HydrophobicContact CD2-CB 4.01Å; M86-A96 HydrophobicContact CE-CB 3.92Å; M86-A96 WeakPolarHBondContact SD-CA 2.96Å; M86-A96 HydrophobicContact SD-CB 3.26Å; M86-A96 WeakPolarHBondContact SD-CB 3.3Å; E94-A96 VanDerWaalsContact C-N 3.33Å
97	T	54.3	Low	64.6	Low	101 Å²	101	122.8 Å²	122.8	62%	0.62	62%	0.618	S	S	*	*	S	Bend	trans	-91.8	119.2	176.5	-12	0	0	0	0	109.5	K99	T97-K99 PolarHBondContact O-N 3.28Å
98	P	49.6	Very low	61.6	Low	119 Å²	119	122.8 Å²	122.8	77%	0.773	62%	0.618	S	S	*	*			trans	-66.3	120.6	172.4	25.9	-29.2	0	0	0	108.6	L100	P98-L100 PolarHBondContact O-N 2.83Å
99	K	46	Very low	58.6	Low	175 Å²	175	120.6 Å²	120.6	76%	0.761	62%	0.62	S	S	*	*			trans	-67.9	90.7	173	-72.8	164.9	177.8	154	0	109	T97	T97-K99 PolarHBondContact O-N 3.28Å
100	L	51.5	Low	55.6	Low	154 Å²	154	124.2 Å²	124.2	81%	0.806	64%	0.642	S	S	*	*			trans	-83.2	145.6	156.7	-166.7	65.8	0	0	0	107.9	P98	P98-L100 PolarHBondContact O-N 2.83Å
101	E	39.4	Very low	52.7	Low	177 Å²	177	132.9 Å²	132.9	83%	0.827	68%	0.683	S	S	*	*			trans	88.7	81.2	172.3	-49	-171.7	150.3	0	0	116.8
102	R	52.9	Low	49.7	Very low	216 Å²	216	136.5 Å²	136.5	82%	0.815	72%	0.715	S	S	*	*			trans	-130.6	92.4	140	-75.1	-170.8	174.2	82.9	5.8	107.9
103	Q	50.1	Low	46.9	Very low	191 Å²	191	144 Å²	144	89%	0.893	75%	0.748	S	S	*	*			trans	179.2	109.7	149.9	-109.3	176.5	-59.1	0	0	111.7
104	L	40.9	Very low	44.5	Very low	159 Å²	159	144 Å²	144	83%	0.832	76%	0.755	S	S	*	*			trans	171.9	128.1	145	-122.4	86.7	0	0	0	104.3
105	D	35.5	Very low	42.5	Very low	143 Å²	143	142 Å²	142	77%	0.765	75%	0.754	S	S	*	*			cis	-156.5	157.2	7.3	-118.9	-40	0	0	0	107.8
106	E	48.2	Very low	40.9	Very low	171 Å²	171	143.3 Å²	143.3	80%	0.799	77%	0.766	S	S	*	*			trans	-80.3	165.6	170.9	-76.7	-171	87.5	0	0	112.7
107	Q	46.2	Very low	39.5	Very low	182 Å²	182	145.3 Å²	145.3	85%	0.85	79%	0.79	S	S	*	*			trans	81.9	140.2	166.1	-50.9	-171.4	62.8	0	0	114.9
108	D	31.6	Very low	38.4	Very low	153 Å²	153	149.5 Å²	149.5	82%	0.818	80%	0.802	S	S	*	*			cis	-156.7	164.9	29.3	-179.5	29.8	0	0	0	109.6
109	G	32.3	Very low	38.2	Very low	57 Å²	57	148.9 Å²	148.9	59%	0.588	80%	0.798	S	S	*	*			trans	-85.9	-163.4	-163.2	0	0	0	0	0	118.5
110	T	33.4	Very low	37.4	Very low	125 Å²	125	145.7 Å²	145.7	77%	0.767	79%	0.793	S	S	*	*			trans	107.8	107.4	155.3	-30.6	0	0	0	0	117.9
111	H	35.4	Very low	36.8	Very low	183 Å²	183	146.5 Å²	146.5	85%	0.847	79%	0.792	S	S	*	*			trans	11.8	129.8	148.5	-57.3	-93.5	0	0	0	122
112	A	31.3	Very low	36.4	Very low	106 Å²	106	145.1 Å²	145.1	88%	0.876	79%	0.786	S	S	*	*				171.6	152.6	113.5	0	0	0	0	0	112.6
113	E	35	Very low	35.4	Very low	186 Å²	186	140.9 Å²	140.9	87%	0.869	78%	0.779	S	S	*	*			trans	-75.2	166.3	-169.4	-56.3	178.5	118.8	0	0	115.6
114	V	27.5	Very low	34.9	Very low	125 Å²	125	140.4 Å²	140.4	76%	0.758	78%	0.777	S	S	*	*				156.4	107.4	123	166.7	0	0	0	0	112.3
115	T	29.4	Very low	34.7	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.724	78%	0.775	S	S	*	*				45.5	121	129.3	-33.4	0	0	0	0	122.1
116	T	30.1	Very low	35.5	Very low	137 Å²	137	141.4 Å²	141.4	84%	0.84	78%	0.78	S	S	*	*				139	124.7	115.1	-49.3	0	0	0	0	113.5
117	G	28.8	Very low	35.2	Very low	73 Å²	73	145 Å²	145	75%	0.753	79%	0.787	S	S	*	*			trans	127.9	93.7	149.3	0	0	0	0	0	118
118	H	31.9	Very low	34.9	Very low	189 Å²	189	145.6 Å²	145.6	88%	0.875	79%	0.787	S	S	*	*			trans	-117.1	169.3	146.6	-113.7	-31.5	0	0	0	106.3
119	P	44.8	Very low	35.6	Very low	106 Å²	106	144 Å²	144	69%	0.688	79%	0.785	S	S	*	*			cis	-133.8	177.2	10.5	24.8	2.2	0	0	0	112.7
120	V	30.2	Very low	36.2	Very low	109 Å²	109	146 Å²	146	66%	0.661	79%	0.79	S	S	*	*				169.3	132	89.3	158.5	0	0	0	0	109.7
121	Q	38.3	Very low	37.2	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	79%	0.792	S	S	*	*			trans	52.4	145.6	148.9	-75	172.4	18.7	0	0	121.1
122	E	29.6	Very low	37.9	Very low	148 Å²	148	147.4 Å²	147.4	69%	0.692	79%	0.788	S	S	*	*			cis	-163.6	149.3	36.3	-136.8	-177.1	129.4	0	0	111.9
123	N	33.7	Very low	39	Very low	127 Å²	127	152.5 Å²	152.5	68%	0.679	79%	0.791	S	S	*	*			trans	65.1	105.5	149.7	-58.8	-26.5	0	0	0	123.3
124	Q	38	Very low	39.7	Very low	181 Å²	181	147.5 Å²	147.5	85%	0.846	78%	0.776	S	S	*	*			trans	-73.2	151.2	156.2	-59.3	-169.9	7.3	0	0	112.3
125	P	38.3	Very low	41	Very low	120 Å²	120	151 Å²	151	78%	0.779	78%	0.784	S	S	*	*				-128.3	120.2	125.6	14.9	4.5	0	0	0	112.5	R127	P125-R127 PolarHBondContact O-N 2.87Å
126	K	50.5	Low	42.5	Very low	204 Å²	204	148.8 Å²	148.8	89%	0.887	79%	0.785	S	S	*	*			trans	12.2	97.3	155.2	-86	163	171.5	169.9	0	116.5
127	R	42.2	Very low	44.8	Very low	246 Å²	246	150.9 Å²	150.9	93%	0.928	78%	0.778	S	S	*	*			trans	-107.9	130	155.1	-82.5	-170.5	173.8	172.4	0.4	110.8	P125	P125-R127 PolarHBondContact O-N 2.87Å
128	K	41.4	Very low	47.8	Very low	195 Å²	195	152.5 Å²	152.5	85%	0.848	76%	0.764	S	S	*	*			trans	-48	148	173.9	-70.6	169.4	174.5	178.5	0	110.9	S130	K128-S130 PolarHBondContact O-N 2.89Å
129	P	45.2	Very low	50.8	Low	120 Å²	120	143.9 Å²	143.9	78%	0.779	73%	0.726	S	S	*	*			trans	-66	109.5	-178.8	-8.6	23.3	0	0	0	109.2	I131	P129-I131 PolarHBondContact O-N 2.89Å
130	S	45.1	Very low	53.2	Low	99 Å²	99	143.8 Å²	143.8	69%	0.692	72%	0.717	S	S	*	*			trans	-58.6	103.7	157.1	45.3	0	0	0	0	107.1	K128 K132	K128-S130 PolarHBondContact O-N 2.89Å; S130-K132 PolarHBondContact O-N 3.33Å
131	I	54.6	Low	56.4	Low	158 Å²	158	145 Å²	145	81%	0.81	72%	0.715	S	S	*	*			trans	-66.2	91.7	169.4	-62.2	172.9	0	0	0	105.9	P129 K133	P129-I131 PolarHBondContact O-N 2.89Å; I131-K133 PolarHBondContact O-N 3.5Å
132	K	50.8	Low	59.1	Low	179 Å²	179	139 Å²	139	78%	0.778	70%	0.699	S	S	*	*			trans	-49.7	133.3	159.5	-64.2	-175.8	177	-176.1	0	106	S130 S134	S130-K132 PolarHBondContact O-N 3.33Å; K132-S134 PolarHBondContact O-N 2.84Å
133	K	53.6	Low	62.3	Low	213 Å²	213	135.6 Å²	135.6	93%	0.926	68%	0.683	S	S	*	*			trans	-54.2	89.7	167.8	-87.3	173.1	173.1	171.2	0	108	I131	I131-K133 PolarHBondContact O-N 3.5Å
134	S	49.4	Very low	65.2	Low	81 Å²	81	134.4 Å²	134.4	57%	0.566	69%	0.685	S	S	*	*			trans	-64.7	131.2	158.4	54	0	0	0	0	105.5	K132 G136	K132-S134 PolarHBondContact O-N 2.84Å; S134-G136 VanDerWaalsContact O-CA 3.3Å; S134-G136 WeakPolarHBondContact O-CA 3.47Å; S134-G136 PolarHBondContact O-N 3.25Å
135	Q	55.3	Low	67.9	Low	198 Å²	198	126 Å²	126	93%	0.925	65%	0.646	S	S	*	*	S	Bend	trans	-42.4	119.3	165.2	-70.6	165.4	-43.9	0	0	108.1	R137	Q135-R137 PolarHBondContact O-N 3.03Å
136	G	59.8	Low	70.6	Confident	72 Å²	72	126.2 Å²	126.2	74%	0.742	64%	0.64	S	S	*	*			trans	-66.1	96.7	-142.3	0	0	0	0	0	114.2	S134 K138	S134-G136 VanDerWaalsContact O-CA 3.3Å; S134-G136 WeakPolarHBondContact O-CA 3.47Å; S134-G136 PolarHBondContact O-N 3.25Å; G136-K138 PolarHBondContact O-N 2.85Å; G136-K138 VanDerWaalsContact O-N 3.15Å
137	R	78.8	Confident	72.7	Confident	181 Å²	181	125 Å²	125	68%	0.683	63%	0.63	S	S	*	*			trans	-63	114.7	166	-161.3	167.5	165.7	-94	-0.2	107.2	Q135	Q135-R137 PolarHBondContact O-N 3.03Å
138	K	92.3	Very high	75.2	Confident	106 Å²	106	117 Å²	117	46%	0.461	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-62.5	145.2	178.1	-69.3	-175	168.6	-162.7	0	110	G136 C151	G136-K138 PolarHBondContact O-N 2.85Å; G136-K138 VanDerWaalsContact O-N 3.15Å; K138-C151 WeakPolarHBondContact CD-O 3.26Å
139	G	93.9	Very high	77.7	Confident	8 Å²	8	115.8 Å²	115.8	8%	0.082	60%	0.603	C	S	.	*	B	Isolated β-bridge	trans	-70.2	141.8	-173.7	0	0	0	0	0	113.3	E143 D150 G152 L155	G139-E143 WeakPolarHBondContact CA-OE2 3.44Å; G139-D150 WeakPolarHBondContact CA-O 3.42Å; G139-D150 PolarHBondContact N-O 2.81Å; G139-G152 PolarHBondContact O-N 3.02Å; G139-L155 WeakPolarHBondContact O-CD1 3.12Å
140	Q	96.1	Very high	80.1	Confident	105 Å²	105	113.1 Å²	113.1	49%	0.491	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-84	166.9	176.8	-62.1	-172.3	-18.3	0	0	111.6	G142 E143 C166	Q140-G142 PolarHBondContact O-N 3.18Å; Q140-E143 HydrophobicContact CB-CG 4.17Å; Q140-E143 VanDerWaalsContact N-CD 3.33Å; Q140-E143 PolarHBondContact N-OE2 2.95Å; Q140-E143 WeakPolarHBondContact O-CB 3.43Å; Q140-E143 PolarHBondContact O-N 3.02Å; Q140-C166 VanDerWaalsContact O-CB 3.27Å; Q140-C166 WeakPolarHBondContact O-CB 3.07Å
141	E	96.5	Very high	82.6	Confident	133 Å²	133	108.5 Å²	108.5	62%	0.621	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	133.2	174.4	-176.5	172.9	179.4	0	0	110.9	E143 L155 C166 P168	E141-E143 VanDerWaalsContact C-N 3.3Å; E141-E143 PolarHBondContact O-N 3.36Å; E141-L155 HydrophobicContact CB-CD2 4.43Å; E141-C166 WeakPolarHBondContact CA-O 3.31Å; E141-P168 VanDerWaalsContact OE1-CD 3.32Å; E141-P168 WeakPolarHBondContact OE1-CD 3.38Å
142	G	95.5	Very high	84.5	Confident	45 Å²	45	101.5 Å²	101.5	46%	0.464	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-16.2	-176.3	0	0	0	0	0	115.1	Q140 I165 C166	Q140-G142 PolarHBondContact O-N 3.18Å; G142-I165 WeakPolarHBondContact O-CG2 3.26Å; G142-C166 PolarHBondContact N-O 3.42Å
143	E	96.7	Very high	86.6	Confident	77 Å²	77	98.7 Å²	98.7	36%	0.36	52%	0.517	S	S	.	.			trans	-73.3	147.9	179.7	-66.8	-172.3	165.8	0	0	112.4	G139 Q140 E141 C145 I165 C166	G139-E143 WeakPolarHBondContact CA-OE2 3.44Å; Q140-E143 HydrophobicContact CB-CG 4.17Å; Q140-E143 VanDerWaalsContact N-CD 3.33Å; Q140-E143 PolarHBondContact N-OE2 2.95Å; Q140-E143 WeakPolarHBondContact O-CB 3.43Å; Q140-E143 PolarHBondContact O-N 3.02Å; E141-E143 VanDerWaalsContact C-N 3.3Å; E141-E143 PolarHBondContact O-N 3.36Å; E143-C145 PolarHBondContact O-N 3.32Å; E143-I165 CarbonylContact O-C 3.56Å; E143-I165 WeakPolarHBondContact O-CA 3.41Å; E143-I165 WeakPolarHBondContact O-CB 3.39Å; E143-C166 PolarHBondContact O-N 3.18Å
144	S	95	Very high	88.6	Confident	101 Å²	101	91.1 Å²	91.1	71%	0.706	50%	0.5	S	S	*	.	B	Isolated β-bridge	trans	-64.6	132.8	179.1	175.6	0	0	0	0	111.4	K164	S144-K164 WeakPolarHBondContact CA-O 3.17Å
145	C	95.8	Very high	90.9	Very high	4 Å²	4	88.6 Å²	88.6	3%	0.027	48%	0.48	C	S	.	.			trans	-132.2	154.3	179.4	64.1	0	0	0	0	111.4	E143 D150 C157 K164 I165	E143-C145 PolarHBondContact O-N 3.32Å; C145-D150 HydrophobicContact CB-CB 4.26Å; C145-C157 HydrophobicContact CB-CB 3.83Å; C145-C157 WeakPolarHBondContact CB-SG 3.18Å; C145-C157 PolarHBondContact O-SG 3.17Å; C145-C157 WeakPolarHBondContact SG-CA 3.33Å; C145-C157 WeakPolarHBondContact SG-CB 3.06Å; C145-C157 CovalentContact SG-SG 2.03Å; C145-C157 PolarHBondContact SG-SG 3.29Å; C145-K164 PolarHBondContact N-O 2.77Å; C145-K164 VanDerWaalsContact O-CB 3.26Å; C145-K164 WeakPolarHBondContact O-CB 3.07Å; C145-I165 VanDerWaalsContact SG-CA 3.6Å; C145-I165 PolarHBondContact SG-O 2.05Å; C145-I165 VanDerWaalsContact SG-O 3.39Å
146	L	94.4	Very high	92.8	Very high	126 Å²	126	79.9 Å²	79.9	66%	0.66	44%	0.44	S	S	*	.	S	Bend	trans	-103.2	-35.2	168.8	-60.4	178.8	0	0	0	110.7	D150	L146-D150 WeakPolarHBondContact CA-OD2 3.05Å; L146-D150 WeakPolarHBondContact CB-OD2 3.5Å; L146-D150 PolarHBondContact N-OD2 3.2Å
147	R	94.9	Very high	94.6	Very high	178 Å²	178	77.4 Å²	77.4	67%	0.672	41%	0.411	S	S	*	.	S	Bend	trans	-140.6	158.6	-179	-60.9	-176.6	-178	139.1	-3.7	110.6	F149 D150	R147-F149 PolarHBondContact O-N 2.75Å; R147-D150 PolarHBondContact N-OD2 2.66Å; R147-D150 VanDerWaalsContact O-CB 3.28Å; R147-D150 WeakPolarHBondContact O-CB 3.39Å; R147-D150 PolarHBondContact O-N 3.26Å
148	T	94.4	Very high	95.3	Very high	78 Å²	78	68.9 Å²	68.9	48%	0.479	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-58.8	-28.7	176.9	-61.1	0	0	0	0	113	D150 C151 C156 C157	T148-D150 PolarHBondContact O-N 3.21Å; T148-C151 WeakPolarHBondContact O-CB 3.36Å; T148-C151 PolarHBondContact O-N 3.36Å; T148-C156 HydrophobicContact CG2-CB 4.3Å; T148-C157 PolarHBondContact OG1-N 3.32Å
149	F	94.2	Very high	95.4	Very high	169 Å²	169	67.1 Å²	67.1	74%	0.741	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-64.8	-23.5	175.7	-172.8	-98.4	0	0	0	113.4	R147 C151	R147-F149 PolarHBondContact O-N 2.75Å; F149-C151 PolarHBondContact O-N 3.17Å
150	D	95.4	Very high	95.3	Very high	65 Å²	65	69.8 Å²	69.8	35%	0.348	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-71.6	-17.1	175.3	-51.8	-30.8	0	0	0	111.2	G139 C145 L146 R147 T148	G139-D150 WeakPolarHBondContact CA-O 3.42Å; G139-D150 PolarHBondContact N-O 2.81Å; C145-D150 HydrophobicContact CB-CB 4.26Å; L146-D150 WeakPolarHBondContact CA-OD2 3.05Å; L146-D150 WeakPolarHBondContact CB-OD2 3.5Å; L146-D150 PolarHBondContact N-OD2 3.2Å; R147-D150 PolarHBondContact N-OD2 2.66Å; R147-D150 VanDerWaalsContact O-CB 3.28Å; R147-D150 WeakPolarHBondContact O-CB 3.39Å; R147-D150 PolarHBondContact O-N 3.26Å; T148-D150 PolarHBondContact O-N 3.21Å
151	C	96.8	Very high	95	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.014	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-95.2	154.1	-176.1	-57.6	0	0	0	0	112.8	K138 T148 F149 L155 C166	K138-C151 WeakPolarHBondContact CD-O 3.26Å; T148-C151 WeakPolarHBondContact O-CB 3.36Å; T148-C151 PolarHBondContact O-N 3.36Å; F149-C151 PolarHBondContact O-N 3.17Å; C151-L155 HydrophobicContact CB-CB 3.72Å; C151-C166 WeakPolarHBondContact CA-SG 3.03Å; C151-C166 HydrophobicContact CB-CB 3.76Å; C151-C166 WeakPolarHBondContact CB-SG 3.11Å; C151-C166 WeakPolarHBondContact SG-CA 2.92Å; C151-C166 WeakPolarHBondContact SG-CB 2.96Å; C151-C166 CovalentContact SG-SG 2.04Å; C151-C166 PolarHBondContact SG-SG 3.46Å
152	G	95.6	Very high	94.6	Very high	10 Å²	10	73.7 Å²	73.7	10%	0.103	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-58.6	166.6	174.1	0	0	0	0	0	114	G139 G154 L155	G139-G152 PolarHBondContact O-N 3.02Å; G152-G154 PolarHBondContact O-N 2.93Å; G152-L155 WeakPolarHBondContact O-CB 3.36Å; G152-L155 PolarHBondContact O-N 2.83Å
153	P	95.1	Very high	94.4	Very high	120 Å²	120	75.3 Å²	75.3	78%	0.779	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	140.7	173.2	26.6	-34.3	0	0	0	110.9	L155	P153-L155 PolarHBondContact O-N 3.25Å
154	G	94.8	Very high	94.4	Very high	55 Å²	55	76.4 Å²	76.4	57%	0.567	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	4.6	-178.3	0	0	0	0	0	115.2	G152 V169	G152-G154 PolarHBondContact O-N 2.93Å; G154-V169 WeakPolarHBondContact O-CB 3.25Å; G154-V169 WeakPolarHBondContact O-CG2 3.37Å; G154-V169 PolarHBondContact O-N 2.04Å
155	L	96.9	Very high	94.4	Very high	28 Å²	28	72.8 Å²	72.8	15%	0.147	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	152.4	178.3	-55.5	-179.4	0	0	0	111.7	G139 E141 C151 G152 P153 C166 K167 P168	G139-L155 WeakPolarHBondContact O-CD1 3.12Å; E141-L155 HydrophobicContact CB-CD2 4.43Å; C151-L155 HydrophobicContact CB-CB 3.72Å; G152-L155 WeakPolarHBondContact O-CB 3.36Å; G152-L155 PolarHBondContact O-N 2.83Å; P153-L155 PolarHBondContact O-N 3.25Å; L155-C166 HydrophobicContact CB-CB 4.43Å; L155-C166 HydrophobicContact CD1-CB 4.06Å; L155-K167 CarbonylContact C-O 3.56Å; L155-K167 WeakPolarHBondContact CA-O 3.35Å; L155-P168 HydrophobicContact CD2-CB 4.34Å
156	C	96.4	Very high	94.5	Very high	15 Å²	15	72.7 Å²	72.7	10%	0.101	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	156.1	169.4	96.6	0	0	0	0	111.5	T148 A158 C166 K167 V169 C194	T148-C156 HydrophobicContact CG2-CB 4.3Å; C156-A158 PolarHBondContact O-N 3.46Å; C156-C166 CarbonylContact O-C 3.45Å; C156-C166 WeakPolarHBondContact O-CA 3.37Å; C156-K167 PolarHBondContact N-O 2.93Å; C156-K167 PolarHBondContact O-N 3.4Å; C156-V169 HydrophobicContact CB-CG2 4.17Å; C156-C194 HydrophobicContact CB-CB 3.83Å; C156-C194 WeakPolarHBondContact CB-SG 3.42Å; C156-C194 WeakPolarHBondContact SG-CA 3.08Å; C156-C194 WeakPolarHBondContact SG-CB 3.39Å; C156-C194 CovalentContact SG-SG 2.02Å; C156-C194 PolarHBondContact SG-SG 2.79Å
157	C	96.4	Very high	94.6	Very high	20 Å²	20	68.3 Å²	68.3	14%	0.135	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	105.6	173.8	-173.6	0	0	0	0	110.6	C145 T148	C145-C157 HydrophobicContact CB-CB 3.83Å; C145-C157 WeakPolarHBondContact CB-SG 3.18Å; C145-C157 PolarHBondContact O-SG 3.17Å; C145-C157 WeakPolarHBondContact SG-CA 3.33Å; C145-C157 WeakPolarHBondContact SG-CB 3.06Å; C145-C157 CovalentContact SG-SG 2.03Å; C145-C157 PolarHBondContact SG-SG 3.29Å; T148-C157 PolarHBondContact OG1-N 3.32Å
158	A	94.9	Very high	94.8	Very high	2 Å²	2	62.3 Å²	62.3	2%	0.017	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.2	-174.8	0	0	0	0	0	112.5	C156 K164 I165 K167 Q192	C156-A158 PolarHBondContact O-N 3.46Å; A158-K164 WeakPolarHBondContact O-CA 3.42Å; A158-I165 PolarHBondContact N-O 3.45Å; A158-I165 PolarHBondContact O-N 3.29Å; A158-K167 HydrophobicContact CB-CB 4.48Å; A158-K167 HydrophobicContact CB-CD 3.94Å; A158-K167 HydrophobicContact CB-CG 4.34Å; A158-Q192 HydrophobicContact CB-CB 4.32Å
159	R	93.1	Very high	94.9	Very high	68 Å²	68	60.3 Å²	60.3	26%	0.257	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.5	-178.3	-165.5	171.5	-175	128.8	-0.4	111.8	F161 T163 K167 Q192	R159-F161 WeakPolarHBondContact CG-O 3.2Å; R159-F161 PolarHBondContact NE-O 3.38Å; R159-T163 WeakPolarHBondContact CA-O 3.48Å; R159-K167 PolarHBondContact O-NZ 2.85Å; R159-Q192 HydrophobicContact CB-CB 4.01Å; R159-Q192 HydrophobicContact CB-CG 3.85Å; R159-Q192 PolarHBondContact O-N 2.8Å
160	H	92.3	Very high	94.9	Very high	65 Å²	65	53.1 Å²	53.1	30%	0.301	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	111.9	168	-170.2	58.7	0	0	0	107.9	W162 T163 I165 I190 F191	H160-W162 PolarHBondContact O-N 2.9Å; H160-T163 PolarHBondContact N-O 2.93Å; H160-T163 PolarHBondContact O-N 2.88Å; H160-T163 VanDerWaalsContact O-N 3.07Å; H160-T163 VanDerWaalsContact O-O 3.05Å; H160-T163 PolarHBondContact O-OG1 3.13Å; H160-T163 VanDerWaalsContact O-OG1 3.08Å; H160-I165 HydrophobicContact CB-CD1 3.49Å; H160-I165 VanDerWaalsContact CB-CD1 3.49Å; H160-I165 HydrophobicContact CB-CG1 3.7Å; H160-I190 CarbonylContact C-O 3.58Å; H160-I190 WeakPolarHBondContact CA-O 3.29Å; H160-F191 AromaticContact CE1-CD1 3.94Å; H160-F191 AromaticContact CE1-CE1 3.7Å; H160-F191 AromaticContact ND1-CD1 3.47Å; H160-F191 WeakPolarHBondContact ND1-CD1 3.41Å; H160-F191 AromaticContact ND1-CE1 3.63Å
161	F	89.5	Confident	95	Very high	100 Å²	100	55.6 Å²	55.6	44%	0.439	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	-121.9	-169.2	-60.8	-82.3	0	0	0	112.2	R159 I190 F191	R159-F161 WeakPolarHBondContact CG-O 3.2Å; R159-F161 PolarHBondContact NE-O 3.38Å; F161-I190 PolarHBondContact N-O 3.47Å; F161-F191 AromaticContact CD1-CE1 3.92Å; F161-F191 HydrophobicContact CD1-CE1 3.92Å; F161-F191 AromaticContact CD1-CZ 3.86Å; F161-F191 HydrophobicContact CD1-CZ 3.86Å; F161-F191 AromaticContact CD2-CE1 3.87Å; F161-F191 HydrophobicContact CD2-CE1 3.87Å; F161-F191 AromaticContact CE1-CE1 3.72Å; F161-F191 HydrophobicContact CE1-CE1 3.72Å; F161-F191 AromaticContact CE1-CZ 3.4Å; F161-F191 HydrophobicContact CE1-CZ 3.4Å; F161-F191 AromaticContact CE2-CE1 3.67Å; F161-F191 HydrophobicContact CE2-CE1 3.67Å; F161-F191 HydrophobicContact CE2-CZ 4.14Å; F161-F191 HydrophobicContact CG-CE1 4Å; F161-F191 HydrophobicContact CG-CZ 4.41Å; F161-F191 AromaticContact CZ-CE1 3.59Å; F161-F191 HydrophobicContact CZ-CE1 3.59Å; F161-F191 AromaticContact CZ-CZ 3.55Å; F161-F191 HydrophobicContact CZ-CZ 3.55Å
162	W	87.9	Confident	94.9	Very high	219 Å²	219	60.2 Å²	60.2	83%	0.83	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.5	-178.6	-52.9	101.6	0	0	0	113.2	H160	H160-W162 PolarHBondContact O-N 2.9Å
163	T	92.4	Very high	94.6	Very high	80 Å²	80	62.2 Å²	62.2	49%	0.491	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	169.7	-174.6	66.3	0	0	0	0	111.5	R159 H160	R159-T163 WeakPolarHBondContact CA-O 3.48Å; H160-T163 PolarHBondContact N-O 2.93Å; H160-T163 PolarHBondContact O-N 2.88Å; H160-T163 VanDerWaalsContact O-N 3.07Å; H160-T163 VanDerWaalsContact O-O 3.05Å; H160-T163 PolarHBondContact O-OG1 3.13Å; H160-T163 VanDerWaalsContact O-OG1 3.08Å
164	K	95.6	Very high	94.6	Very high	99 Å²	99	60.2 Å²	60.2	43%	0.43	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.7	171	-73.1	-175.3	176.9	-174.8	0	108.6	S144 C145 A158	S144-K164 WeakPolarHBondContact CA-O 3.17Å; C145-K164 PolarHBondContact N-O 2.77Å; C145-K164 VanDerWaalsContact O-CB 3.26Å; C145-K164 WeakPolarHBondContact O-CB 3.07Å; A158-K164 WeakPolarHBondContact O-CA 3.42Å
165	I	96.4	Very high	94.4	Very high	26 Å²	26	60.2 Å²	60.2	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.9	-178.8	63.1	173.6	0	0	0	110.6	G142 E143 C145 A158 H160 K167	G142-I165 WeakPolarHBondContact O-CG2 3.26Å; E143-I165 CarbonylContact O-C 3.56Å; E143-I165 WeakPolarHBondContact O-CA 3.41Å; E143-I165 WeakPolarHBondContact O-CB 3.39Å; C145-I165 VanDerWaalsContact SG-CA 3.6Å; C145-I165 PolarHBondContact SG-O 2.05Å; C145-I165 VanDerWaalsContact SG-O 3.39Å; A158-I165 PolarHBondContact N-O 3.45Å; A158-I165 PolarHBondContact O-N 3.29Å; H160-I165 HydrophobicContact CB-CD1 3.49Å; H160-I165 VanDerWaalsContact CB-CD1 3.49Å; H160-I165 HydrophobicContact CB-CG1 3.7Å; I165-K167 HydrophobicContact CD1-CG 4.27Å; I165-K167 HydrophobicContact CG1-CG 3.95Å; I165-K167 PolarHBondContact O-N 3.08Å
166	C	97.6	Very high	94.2	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.007	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	123.6	170.4	-63.9	0	0	0	0	109.6	Q140 E141 G142 E143 C151 L155 C156	Q140-C166 VanDerWaalsContact O-CB 3.27Å; Q140-C166 WeakPolarHBondContact O-CB 3.07Å; E141-C166 WeakPolarHBondContact CA-O 3.31Å; G142-C166 PolarHBondContact N-O 3.42Å; E143-C166 PolarHBondContact O-N 3.18Å; C151-C166 WeakPolarHBondContact CA-SG 3.03Å; C151-C166 HydrophobicContact CB-CB 3.76Å; C151-C166 WeakPolarHBondContact CB-SG 3.11Å; C151-C166 WeakPolarHBondContact SG-CA 2.92Å; C151-C166 WeakPolarHBondContact SG-CB 2.96Å; C151-C166 CovalentContact SG-SG 2.04Å; C151-C166 PolarHBondContact SG-SG 3.46Å; L155-C166 HydrophobicContact CB-CB 4.43Å; L155-C166 HydrophobicContact CD1-CB 4.06Å; C156-C166 CarbonylContact O-C 3.45Å; C156-C166 WeakPolarHBondContact O-CA 3.37Å
167	K	97	Very high	93.7	Very high	35 Å²	35	60.5 Å²	60.5	15%	0.152	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	155.7	178.3	-67.1	-169	-172.8	175.1	0	110.2	L155 C156 A158 R159 I165 Q192 C194	L155-K167 CarbonylContact C-O 3.56Å; L155-K167 WeakPolarHBondContact CA-O 3.35Å; C156-K167 PolarHBondContact N-O 2.93Å; C156-K167 PolarHBondContact O-N 3.4Å; A158-K167 HydrophobicContact CB-CB 4.48Å; A158-K167 HydrophobicContact CB-CD 3.94Å; A158-K167 HydrophobicContact CB-CG 4.34Å; R159-K167 PolarHBondContact O-NZ 2.85Å; I165-K167 HydrophobicContact CD1-CG 4.27Å; I165-K167 HydrophobicContact CG1-CG 3.95Å; I165-K167 PolarHBondContact O-N 3.08Å; K167-Q192 PolarHBondContact NZ-O 2.7Å; K167-C194 PolarHBondContact O-SG 3.46Å
168	P	97.1	Very high	92.7	Very high	52 Å²	52	67.2 Å²	67.2	34%	0.338	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	137.1	176.5	26.1	-34	0	0	0	111.7	E141 L155 C194	E141-P168 VanDerWaalsContact OE1-CD 3.32Å; E141-P168 WeakPolarHBondContact OE1-CD 3.38Å; L155-P168 HydrophobicContact CD2-CB 4.34Å; P168-C194 VanDerWaalsContact O-CB 3.24Å; P168-C194 WeakPolarHBondContact O-CB 3.44Å; P168-C194 PolarHBondContact O-SG 2.71Å
169	V	96.5	Very high	91.3	Very high	36 Å²	36	73.4 Å²	73.4	22%	0.218	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-64.2	138.5	166.4	173.1	0	0	0	0	108.9	G154 C156 L171 D195	G154-V169 WeakPolarHBondContact O-CB 3.25Å; G154-V169 WeakPolarHBondContact O-CG2 3.37Å; G154-V169 PolarHBondContact O-N 2.04Å; C156-V169 HydrophobicContact CB-CG2 4.17Å; V169-L171 PolarHBondContact O-N 2.03Å; V169-D195 WeakPolarHBondContact CG1-O 3.47Å
170	L	96.1	Very high	89.5	Confident	18 Å²	18	73 Å²	73	9%	0.094	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-73.9	131.4	-170.9	-59.9	176.6	0	0	0	111.9	Q174 V175 C176 R193 C194 D195 G197 C218	L170-Q174 VanDerWaalsContact CA-OE1 3.32Å; L170-Q174 HydrophobicContact CB-CB 4.36Å; L170-Q174 HydrophobicContact CD2-CB 4.33Å; L170-V175 WeakPolarHBondContact CD1-O 3.04Å; L170-C176 HydrophobicContact CD1-CB 3.69Å; L170-R193 HydrophobicContact CD1-CB 4.33Å; L170-C194 WeakPolarHBondContact CD1-O 3.16Å; L170-C194 WeakPolarHBondContact CG-O 3.34Å; L170-D195 PolarHBondContact N-O 3.33Å; L170-D195 VanDerWaalsContact N-O 3.1Å; L170-G197 PolarHBondContact O-N 2.84Å; L170-C218 WeakPolarHBondContact CB-SG 3.3Å
171	L	95.7	Very high	87.4	Confident	116 Å²	116	77.7 Å²	77.7	61%	0.607	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-87.3	168.4	176.6	-56.3	179.8	0	0	0	111.7	V169 G173 Q174 C218	V169-L171 PolarHBondContact O-N 2.03Å; L171-G173 PolarHBondContact O-N 2.73Å; L171-Q174 HydrophobicContact CB-CG 4.29Å; L171-Q174 WeakPolarHBondContact O-CB 3.4Å; L171-Q174 PolarHBondContact O-N 2.89Å; L171-Q174 VanDerWaalsContact O-N 3.1Å; L171-C218 WeakPolarHBondContact O-CB 3.09Å
172	E	94.6	Very high	85.4	Confident	100 Å²	100	81.9 Å²	81.9	47%	0.467	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	136.3	176.4	-171.9	171.3	-160.2	0	0	111.3	Q174 L200 C218 K220	E172-Q174 PolarHBondContact O-N 2.97Å; E172-L200 HydrophobicContact CB-CD1 4.31Å; E172-L200 HydrophobicContact CB-CD2 3.99Å; E172-L200 HydrophobicContact CG-CD2 4.3Å; E172-C218 CarbonylContact C-O 3.54Å; E172-C218 WeakPolarHBondContact CA-O 3.26Å; E172-K220 WeakPolarHBondContact OE1-CD 3.37Å; E172-K220 WeakPolarHBondContact OE1-CG 3.06Å; E172-K220 IonicContact OE1-NZ 3.53Å; E172-K220 WeakPolarHBondContact OE2-CE 3.37Å; E172-K220 IonicContact OE2-NZ 2.72Å; E172-K220 PolarHBondContact OE2-NZ 2.85Å
173	G	91.2	Very high	83.3	Confident	51 Å²	51	77.8 Å²	77.8	53%	0.526	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-14.2	-176.9	0	0	0	0	0	115.2	L171 V217 C218	L171-G173 PolarHBondContact O-N 2.73Å; G173-V217 WeakPolarHBondContact O-CG1 3.25Å; G173-C218 PolarHBondContact N-O 3.35Å
174	Q	93.8	Very high	81.3	Confident	79 Å²	79	80.3 Å²	80.3	37%	0.369	42%	0.421	S	S	.	.			trans	-75.3	146.2	178.5	-65.1	-171	-43	0	0	112.3	L170 L171 E172 C176 V217 C218	L170-Q174 VanDerWaalsContact CA-OE1 3.32Å; L170-Q174 HydrophobicContact CB-CB 4.36Å; L170-Q174 HydrophobicContact CD2-CB 4.33Å; L171-Q174 HydrophobicContact CB-CG 4.29Å; L171-Q174 WeakPolarHBondContact O-CB 3.4Å; L171-Q174 PolarHBondContact O-N 2.89Å; L171-Q174 VanDerWaalsContact O-N 3.1Å; E172-Q174 PolarHBondContact O-N 2.97Å; Q174-C176 PolarHBondContact O-N 2.84Å; Q174-V217 CarbonylContact O-C 3.57Å; Q174-V217 WeakPolarHBondContact O-CA 3.45Å; Q174-C218 PolarHBondContact O-N 3.07Å
175	V	91.8	Very high	79.3	Confident	54 Å²	54	80.4 Å²	80.4	33%	0.327	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-68.5	126.2	-178.3	177.8	0	0	0	0	111.1	L170 R193 L215 R216 V217	L170-V175 WeakPolarHBondContact CD1-O 3.04Å; V175-R193 WeakPolarHBondContact O-CD 3.16Å; V175-L215 HydrophobicContact CG1-CD2 4.32Å; V175-R216 CarbonylContact C-O 3.47Å; V175-R216 VanDerWaalsContact CA-O 3.25Å; V175-R216 WeakPolarHBondContact CA-O 3.15Å; V175-V217 HydrophobicContact CG2-CG1 4.34Å
176	C	91.4	Very high	77.4	Confident	8 Å²	8	87.3 Å²	87.3	5%	0.054	47%	0.472	C	S	.	.			trans	-116.1	149.3	177.9	59.8	0	0	0	0	110.9	L170 Q174 C202 R216 V217	L170-C176 HydrophobicContact CD1-CB 3.69Å; Q174-C176 PolarHBondContact O-N 2.84Å; C176-C202 HydrophobicContact CB-CB 3.81Å; C176-C202 WeakPolarHBondContact CB-SG 3.45Å; C176-C202 WeakPolarHBondContact SG-CA 3.42Å; C176-C202 WeakPolarHBondContact SG-CB 3.06Å; C176-C202 CovalentContact SG-SG 2.02Å; C176-C202 PolarHBondContact SG-SG 3.2Å; C176-R216 PolarHBondContact N-O 3.16Å; C176-R216 VanDerWaalsContact SG-C 3.51Å; C176-V217 PolarHBondContact SG-N 2.83Å
177	S	85.4	Confident	75.5	Confident	41 Å²	41	91.3 Å²	91.3	29%	0.287	51%	0.505	S	S	.	.			trans	-99.1	142.9	169.9	-58.6	0	0	0	0	108.7	R179 E189 R193	S177-R179 PolarHBondContact O-N 3.22Å; S177-E189 PolarHBondContact OG-OE1 3.02Å; S177-R193 PolarHBondContact OG-NH1 3.15Å
178	R	75.4	Confident	73.9	Confident	161 Å²	161	94 Å²	94	61%	0.608	53%	0.526	S	S	*	.			trans	-66.5	121.9	164.1	-88.8	-173.4	74.7	-168.5	7.5	107.5	G180	R178-G180 PolarHBondContact O-N 3.32Å
179	R	66.6	Low	72.7	Confident	132 Å²	132	95.6 Å²	95.6	50%	0.498	53%	0.529	S	S	.	.			trans	-67.4	105.5	162.5	-147.1	171.3	-74.8	-90.9	-1	106.1	S177 H181 R193 D195	S177-R179 PolarHBondContact O-N 3.22Å; R179-H181 PolarHBondContact O-N 2.7Å; R179-R193 PolarHBondContact NH2-O 3.35Å; R179-D195 IonicContact CZ-OD1 3.38Å; R179-D195 IonicContact NE-OD1 3.02Å; R179-D195 PolarHBondContact NE-OD1 2.93Å; R179-D195 IonicContact NE-OD2 3.95Å; R179-D195 IonicContact NH2-OD1 2.84Å; R179-D195 PolarHBondContact NH2-OD1 2.73Å; R179-D195 IonicContact NH2-OD2 3.95Å
180	G	54.3	Low	72	Confident	60 Å²	60	97.4 Å²	97.4	62%	0.619	54%	0.537	S	S	*	.			trans	-61.7	125.8	-175.2	0	0	0	0	0	110.7	R178 K182	R178-G180 PolarHBondContact O-N 3.32Å; G180-K182 PolarHBondContact O-N 3.1Å
181	H	49.6	Very low	71.5	Confident	164 Å²	164	101 Å²	101	76%	0.759	55%	0.551	S	S	*	*	S	Bend	trans	-57.5	117.6	162.5	-169.9	-88.9	0	0	0	106.9	R179 D183	R179-H181 PolarHBondContact O-N 2.7Å; H181-D183 VanDerWaalsContact C-N 3.31Å; H181-D183 PolarHBondContact O-N 2.82Å
182	K	48.1	Very low	71.3	Confident	188 Å²	188	97.8 Å²	97.8	82%	0.817	53%	0.534	S	S	*	.			trans	-3	75.1	175.2	-166.4	-171.4	176.9	-162.2	0	114.6	G180	G180-K182 PolarHBondContact O-N 3.1Å
183	D	43.8	Very low	71.1	Confident	133 Å²	133	98.4 Å²	98.4	71%	0.711	53%	0.531	S	S	*	.			trans	-92	117.5	165.5	-97.4	-34.2	0	0	0	107.2	H181 A185	H181-D183 VanDerWaalsContact C-N 3.31Å; H181-D183 PolarHBondContact O-N 2.82Å; D183-A185 PolarHBondContact O-N 2.73Å
184	T	49.8	Very low	71.3	Confident	132 Å²	132	96.2 Å²	96.2	81%	0.81	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	124.3	-178.7	-46.7	0	0	0	0	109.4
185	A	53	Low	71.3	Confident	101 Å²	101	96.9 Å²	96.9	84%	0.835	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	24.7	168	0	0	0	0	0	119.9	D183	D183-A185 PolarHBondContact O-N 2.73Å
186	Q	55.8	Low	71.5	Confident	171 Å²	171	95.6 Å²	95.6	80%	0.799	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-80.1	130.2	160.1	-70.8	-162.6	-21	0	0	111.1
187	A	58.6	Low	71.6	Confident	86 Å²	86	95.6 Å²	95.6	71%	0.711	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-50.4	141.7	174.6	0	0	0	0	0	110.3	E189	A187-E189 PolarHBondContact O-N 3.47Å
188	P	63.9	Low	72	Confident	90 Å²	90	100.1 Å²	100.1	58%	0.584	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-54.2	119.1	-179.1	-21	29.9	0	0	0	109.7	I190	P188-I190 PolarHBondContact O-N 2.04Å
189	E	71	Confident	72.9	Confident	87 Å²	87	94.7 Å²	94.7	41%	0.407	53%	0.532	S	S	.	.			trans	-56	106.9	175.4	-167.4	178.7	-172.2	0	0	107.7	S177 A187 F191 Q192	S177-E189 PolarHBondContact OG-OE1 3.02Å; A187-E189 PolarHBondContact O-N 3.47Å; E189-F191 PolarHBondContact O-N 3.19Å; E189-Q192 HydrophobicContact CB-CG 4.2Å; E189-Q192 WeakPolarHBondContact O-CG 3.41Å
190	I	81.8	Confident	74.2	Confident	74 Å²	74	89.7 Å²	89.7	38%	0.379	52%	0.515	S	S	.	.	S	Bend	trans	-71	-17.9	-174.9	53.2	167.8	0	0	0	111.9	H160 F161 P188	H160-I190 CarbonylContact C-O 3.58Å; H160-I190 WeakPolarHBondContact CA-O 3.29Å; F161-I190 PolarHBondContact N-O 3.47Å; P188-I190 PolarHBondContact O-N 2.04Å
191	F	86.4	Confident	76	Confident	92 Å²	92	91.2 Å²	91.2	40%	0.404	51%	0.508	S	S	.	.	B	Isolated β-bridge	trans	-122.1	75.1	177.7	-59.4	-59.8	0	0	0	110.6	H160 F161 E189	H160-F191 AromaticContact CE1-CD1 3.94Å; H160-F191 AromaticContact CE1-CE1 3.7Å; H160-F191 AromaticContact ND1-CD1 3.47Å; H160-F191 WeakPolarHBondContact ND1-CD1 3.41Å; H160-F191 AromaticContact ND1-CE1 3.63Å; F161-F191 AromaticContact CD1-CE1 3.92Å; F161-F191 HydrophobicContact CD1-CE1 3.92Å; F161-F191 AromaticContact CD1-CZ 3.86Å; F161-F191 HydrophobicContact CD1-CZ 3.86Å; F161-F191 AromaticContact CD2-CE1 3.87Å; F161-F191 HydrophobicContact CD2-CE1 3.87Å; F161-F191 AromaticContact CE1-CE1 3.72Å; F161-F191 HydrophobicContact CE1-CE1 3.72Å; F161-F191 AromaticContact CE1-CZ 3.4Å; F161-F191 HydrophobicContact CE1-CZ 3.4Å; F161-F191 AromaticContact CE2-CE1 3.67Å; F161-F191 HydrophobicContact CE2-CE1 3.67Å; F161-F191 HydrophobicContact CE2-CZ 4.14Å; F161-F191 HydrophobicContact CG-CE1 4Å; F161-F191 HydrophobicContact CG-CZ 4.41Å; F161-F191 AromaticContact CZ-CE1 3.59Å; F161-F191 HydrophobicContact CZ-CE1 3.59Å; F161-F191 AromaticContact CZ-CZ 3.55Å; F161-F191 HydrophobicContact CZ-CZ 3.55Å; E189-F191 PolarHBondContact O-N 3.19Å
192	Q	90.3	Very high	78	Confident	50 Å²	50	85.2 Å²	85.2	23%	0.234	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-74	134.6	175	-67.5	176	-3.8	0	0	110	A158 R159 K167 E189	A158-Q192 HydrophobicContact CB-CB 4.32Å; R159-Q192 HydrophobicContact CB-CB 4.01Å; R159-Q192 HydrophobicContact CB-CG 3.85Å; R159-Q192 PolarHBondContact O-N 2.8Å; K167-Q192 PolarHBondContact NZ-O 2.7Å; E189-Q192 HydrophobicContact CB-CG 4.2Å; E189-Q192 WeakPolarHBondContact O-CG 3.41Å
193	R	92.4	Very high	80	Confident	112 Å²	112	80.9 Å²	80.9	42%	0.423	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-84.7	160	167.1	-63.4	-178.4	173.8	95.2	3.2	110	L170 V175 S177 R179	L170-R193 HydrophobicContact CD1-CB 4.33Å; V175-R193 WeakPolarHBondContact O-CD 3.16Å; S177-R193 PolarHBondContact OG-NH1 3.15Å; R179-R193 PolarHBondContact NH2-O 3.35Å
194	C	94.5	Very high	82	Confident	6 Å²	6	76.5 Å²	76.5	4%	0.041	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-70.4	161	163.1	-68	0	0	0	0	110.5	C156 K167 P168 L170	C156-C194 HydrophobicContact CB-CB 3.83Å; C156-C194 WeakPolarHBondContact CB-SG 3.42Å; C156-C194 WeakPolarHBondContact SG-CA 3.08Å; C156-C194 WeakPolarHBondContact SG-CB 3.39Å; C156-C194 CovalentContact SG-SG 2.02Å; C156-C194 PolarHBondContact SG-SG 2.79Å; K167-C194 PolarHBondContact O-SG 3.46Å; P168-C194 VanDerWaalsContact O-CB 3.24Å; P168-C194 WeakPolarHBondContact O-CB 3.44Å; P168-C194 PolarHBondContact O-SG 2.71Å; L170-C194 WeakPolarHBondContact CD1-O 3.16Å; L170-C194 WeakPolarHBondContact CG-O 3.34Å
195	D	93.8	Very high	83.2	Confident	93 Å²	93	74.5 Å²	74.5	50%	0.497	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-72.8	166.8	172.3	-55.5	-34	0	0	0	109.7	V169 L170 R179	V169-D195 WeakPolarHBondContact CG1-O 3.47Å; L170-D195 PolarHBondContact N-O 3.33Å; L170-D195 VanDerWaalsContact N-O 3.1Å; R179-D195 IonicContact CZ-OD1 3.38Å; R179-D195 IonicContact NE-OD1 3.02Å; R179-D195 PolarHBondContact NE-OD1 2.93Å; R179-D195 IonicContact NE-OD2 3.95Å; R179-D195 IonicContact NH2-OD1 2.84Å; R179-D195 PolarHBondContact NH2-OD1 2.73Å; R179-D195 IonicContact NH2-OD2 3.95Å
196	C	94.9	Very high	83.8	Confident	26 Å²	26	75.9 Å²	75.9	18%	0.176	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-62.9	146.8	173.1	-60.6	0	0	0	0	110.6	L200 C218	C196-L200 HydrophobicContact CB-CB 3.73Å; C196-C218 VanDerWaalsContact CA-SG 3.52Å; C196-C218 HydrophobicContact CB-CB 3.76Å; C196-C218 WeakPolarHBondContact CB-SG 3.06Å; C196-C218 VanDerWaalsContact SG-CA 3.51Å; C196-C218 WeakPolarHBondContact SG-CB 2.97Å; C196-C218 CovalentContact SG-SG 2.04Å; C196-C218 PolarHBondContact SG-SG 3.44Å
197	G	94.5	Very high	83.9	Confident	9 Å²	9	71.7 Å²	71.7	9%	0.093	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-62.7	169.5	178.2	0	0	0	0	0	113.9	L170 G199 L200	L170-G197 PolarHBondContact O-N 2.84Å; G197-G199 PolarHBondContact O-N 3.41Å; G197-L200 WeakPolarHBondContact O-CB 3.45Å; G197-L200 PolarHBondContact O-N 2.71Å
198	P	93.8	Very high	83.8	Confident	135 Å²	135	73.8 Å²	73.8	88%	0.877	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	133.3	177.3	-24.5	34.1	0	0	0	111.6	L200	P198-L200 VanDerWaalsContact C-N 3.31Å; P198-L200 PolarHBondContact O-N 3.33Å
199	G	93.6	Very high	83.5	Confident	48 Å²	48	76.2 Å²	76.2	50%	0.495	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	6.2	-179.1	0	0	0	0	0	115.4	G197 I221	G197-G199 PolarHBondContact O-N 3.41Å; G199-I221 WeakPolarHBondContact O-CG1 3.29Å; G199-I221 PolarHBondContact O-N 2.7Å
200	L	93.9	Very high	83	Confident	27 Å²	27	83.1 Å²	83.1	14%	0.141	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.2	178.2	-56.9	175.4	0	0	0	111.8	E172 C196 G197 P198 C218 Q219 K220	E172-L200 HydrophobicContact CB-CD1 4.31Å; E172-L200 HydrophobicContact CB-CD2 3.99Å; E172-L200 HydrophobicContact CG-CD2 4.3Å; C196-L200 HydrophobicContact CB-CB 3.73Å; G197-L200 WeakPolarHBondContact O-CB 3.45Å; G197-L200 PolarHBondContact O-N 2.71Å; P198-L200 VanDerWaalsContact C-N 3.31Å; P198-L200 PolarHBondContact O-N 3.33Å; L200-C218 HydrophobicContact CB-CB 4.21Å; L200-C218 HydrophobicContact CD1-CB 4.13Å; L200-Q219 CarbonylContact C-O 3.59Å; L200-Q219 VanDerWaalsContact CA-O 3.24Å; L200-Q219 WeakPolarHBondContact CA-O 3.31Å; L200-K220 HydrophobicContact CD2-CG 3.9Å
201	L	92.4	Very high	81.8	Confident	92 Å²	92	88.6 Å²	88.6	48%	0.482	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.4	173.5	-77	169.9	0	0	0	111.2	R203 C218 Q219 I221	L201-R203 PolarHBondContact O-N 2.96Å; L201-R203 VanDerWaalsContact O-N 3.13Å; L201-C218 WeakPolarHBondContact O-CA 3.47Å; L201-Q219 PolarHBondContact N-O 3.29Å; L201-Q219 PolarHBondContact O-N 2.03Å; L201-I221 HydrophobicContact CB-CG1 4.41Å; L201-I221 HydrophobicContact CD1-CD1 4.23Å; L201-I221 HydrophobicContact CD1-CG1 3.66Å; L201-I221 HydrophobicContact CD1-CG2 4.48Å; L201-I221 HydrophobicContact CG-CD1 3.98Å; L201-I221 HydrophobicContact CG-CG1 3.6Å
202	C	91.6	Very high	80.3	Confident	37 Å²	37	92.7 Å²	92.7	25%	0.25	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	92.9	177.2	-175.4	0	0	0	0	111.5	C176	C176-C202 HydrophobicContact CB-CB 3.81Å; C176-C202 WeakPolarHBondContact CB-SG 3.45Å; C176-C202 WeakPolarHBondContact SG-CA 3.42Å; C176-C202 WeakPolarHBondContact SG-CB 3.06Å; C176-C202 CovalentContact SG-SG 2.02Å; C176-C202 PolarHBondContact SG-SG 3.2Å
203	R	89.8	Confident	78.8	Confident	97 Å²	97	94.8 Å²	94.8	37%	0.366	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	147.2	-177.1	-163.1	177.5	-64.2	150.6	-21.2	111.3	L201 R216 V217 Q219	L201-R203 PolarHBondContact O-N 2.96Å; L201-R203 VanDerWaalsContact O-N 3.13Å; R203-R216 CarbonylContact O-C 3.57Å; R203-R216 WeakPolarHBondContact O-CA 3.22Å; R203-V217 PolarHBondContact N-O 3.17Å; R203-V217 PolarHBondContact O-N 2.8Å; R203-Q219 HydrophobicContact CB-CB 4.49Å; R203-Q219 HydrophobicContact CB-CG 4.31Å; R203-Q219 VanDerWaalsContact NH1-OE1 3.15Å
204	S	86.8	Confident	77.9	Confident	41 Å²	41	96.9 Å²	96.9	29%	0.287	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	131.2	171.6	53.4	0	0	0	0	110.6	L206	S204-L206 PolarHBondContact O-N 2.97Å
205	Q	74.9	Confident	77.3	Confident	90 Å²	90	101.8 Å²	101.8	42%	0.421	55%	0.545	S	S	.	.			trans	-74.5	121.7	173.3	-155.1	173.4	12.4	0	0	109	T207 L215 V217	Q205-T207 VanDerWaalsContact C-N 3.27Å; Q205-T207 HydrophobicContact CG-CG2 4.01Å; Q205-T207 PolarHBondContact O-N 3.12Å; Q205-T207 VanDerWaalsContact O-N 3.12Å; Q205-L215 PolarHBondContact N-O 2.71Å; Q205-L215 VanDerWaalsContact N-O 3.08Å; Q205-V217 HydrophobicContact CB-CG2 4.33Å
206	L	66.2	Low	77.1	Confident	130 Å²	130	101.5 Å²	101.5	68%	0.681	54%	0.537	S	S	*	.			trans	-83.5	73.6	172.4	-65.2	175.7	0	0	0	108.6	S204	S204-L206 PolarHBondContact O-N 2.97Å
207	T	57.3	Low	76.9	Confident	84 Å²	84	100.7 Å²	100.7	52%	0.515	53%	0.531	S	S	.	.			trans	-76.1	127.3	167.4	52.7	0	0	0	0	108.6	Q205 N209	Q205-T207 VanDerWaalsContact C-N 3.27Å; Q205-T207 HydrophobicContact CG-CG2 4.01Å; Q205-T207 PolarHBondContact O-N 3.12Å; Q205-T207 VanDerWaalsContact O-N 3.12Å; T207-N209 PolarHBondContact O-N 2.9Å
208	S	56.6	Low	76.9	Confident	129 Å²	129	100.2 Å²	100.2	90%	0.902	53%	0.527	S	S	*	.	S	Bend	trans	-70.2	61.2	178.7	-178.8	0	0	0	0	111.7
209	N	56.3	Low	76.9	Confident	142 Å²	142	96.2 Å²	96.2	76%	0.759	50%	0.497	S	S	*	.			trans	-162	115.1	153.8	-136	-17.9	0	0	0	109.4	T207 Q211	T207-N209 PolarHBondContact O-N 2.9Å; N209-Q211 PolarHBondContact O-N 3.16Å
210	R	60.5	Low	76.9	Confident	232 Å²	232	99.8 Å²	99.8	88%	0.875	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	123.4	174.4	-73.3	172.4	169.2	156.3	-3.6	107
211	Q	58	Low	76.7	Confident	188 Å²	188	102.4 Å²	102.4	88%	0.879	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	169.6	-14.7	141.9	-74.5	-127.6	-2	0	0	113	N209	N209-Q211 PolarHBondContact O-N 3.16Å
212	H	54.7	Low	76.2	Confident	179 Å²	179	105.3 Å²	105.3	83%	0.829	52%	0.523	S	S	*	.	S	Bend	trans	-101.8	140.4	172.7	-67.7	-88.6	0	0	0	111.2	R214	H212-R214 PolarHBondContact O-N 2.77Å
213	A	59.2	Low	75.1	Confident	93 Å²	93	112.8 Å²	112.8	77%	0.769	55%	0.551	S	S	*	*			trans	-45.7	117.1	177.9	0	0	0	0	0	110	L215	A213-L215 PolarHBondContact O-N 3.43Å
214	R	72.4	Confident	73.4	Confident	157 Å²	157	120 Å²	120	59%	0.592	60%	0.595	S	S	*	*			trans	-57.3	101.2	-176	-80.2	174.9	149.7	159.6	-5.1	109.8	H212	H212-R214 PolarHBondContact O-N 2.77Å
215	L	81.4	Confident	72.8	Confident	109 Å²	109	123.9 Å²	123.9	57%	0.571	61%	0.611	S	S	*	*			trans	-60.4	142.1	174.1	-69	170.3	0	0	0	109	V175 Q205 A213	V175-L215 HydrophobicContact CG1-CD2 4.32Å; Q205-L215 PolarHBondContact N-O 2.71Å; Q205-L215 VanDerWaalsContact N-O 3.08Å; A213-L215 PolarHBondContact O-N 3.43Å
216	R	89.4	Confident	72.6	Confident	87 Å²	87	125.7 Å²	125.7	33%	0.328	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	143.1	173	-61	-177.6	175	-118.5	-2.4	109	V175 C176 R203	V175-R216 CarbonylContact C-O 3.47Å; V175-R216 VanDerWaalsContact CA-O 3.25Å; V175-R216 WeakPolarHBondContact CA-O 3.15Å; C176-R216 PolarHBondContact N-O 3.16Å; C176-R216 VanDerWaalsContact SG-C 3.51Å; R203-R216 CarbonylContact O-C 3.57Å; R203-R216 WeakPolarHBondContact O-CA 3.22Å
217	V	92.4	Very high	73	Confident	8 Å²	8	125.4 Å²	125.4	5%	0.048	62%	0.617	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.9	153.3	-179.2	-64.8	0	0	0	0	110.3	G173 Q174 V175 C176 R203 Q205 Q219	G173-V217 WeakPolarHBondContact O-CG1 3.25Å; Q174-V217 CarbonylContact O-C 3.57Å; Q174-V217 WeakPolarHBondContact O-CA 3.45Å; V175-V217 HydrophobicContact CG2-CG1 4.34Å; C176-V217 PolarHBondContact SG-N 2.83Å; R203-V217 PolarHBondContact N-O 3.17Å; R203-V217 PolarHBondContact O-N 2.8Å; Q205-V217 HydrophobicContact CB-CG2 4.33Å; V217-Q219 HydrophobicContact CG2-CG 3.93Å; V217-Q219 PolarHBondContact O-N 3.39Å
218	C	93.7	Very high	73.9	Confident	0 Å²	0	127.9 Å²	127.9	0%	0	62%	0.623	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.3	122.5	173.3	-63.2	0	0	0	0	109.8	L170 L171 E172 G173 Q174 C196 L200 L201	L170-C218 WeakPolarHBondContact CB-SG 3.3Å; L171-C218 WeakPolarHBondContact O-CB 3.09Å; E172-C218 CarbonylContact C-O 3.54Å; E172-C218 WeakPolarHBondContact CA-O 3.26Å; G173-C218 PolarHBondContact N-O 3.35Å; Q174-C218 PolarHBondContact O-N 3.07Å; C196-C218 VanDerWaalsContact CA-SG 3.52Å; C196-C218 HydrophobicContact CB-CB 3.76Å; C196-C218 WeakPolarHBondContact CB-SG 3.06Å; C196-C218 VanDerWaalsContact SG-CA 3.51Å; C196-C218 WeakPolarHBondContact SG-CB 2.97Å; C196-C218 CovalentContact SG-SG 2.04Å; C196-C218 PolarHBondContact SG-SG 3.44Å; L200-C218 HydrophobicContact CB-CB 4.21Å; L200-C218 HydrophobicContact CD1-CB 4.13Å; L201-C218 WeakPolarHBondContact O-CA 3.47Å
219	Q	93.1	Very high	75	Confident	51 Å²	51	127.8 Å²	127.8	24%	0.238	61%	0.606	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.1	151.5	-180	-62.5	-172	-28.6	0	0	110.2	L200 L201 R203 V217	L200-Q219 CarbonylContact C-O 3.59Å; L200-Q219 VanDerWaalsContact CA-O 3.24Å; L200-Q219 WeakPolarHBondContact CA-O 3.31Å; L201-Q219 PolarHBondContact N-O 3.29Å; L201-Q219 PolarHBondContact O-N 2.03Å; R203-Q219 HydrophobicContact CB-CB 4.49Å; R203-Q219 HydrophobicContact CB-CG 4.31Å; R203-Q219 VanDerWaalsContact NH1-OE1 3.15Å; V217-Q219 HydrophobicContact CG2-CG 3.93Å; V217-Q219 PolarHBondContact O-N 3.39Å
220	K	93.7	Very high	76.3	Confident	122 Å²	122	126.9 Å²	126.9	53%	0.53	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-56.8	141.7	176.9	-78	170.7	175.6	131.4	0	112.4	E172 L200 E222	E172-K220 WeakPolarHBondContact OE1-CD 3.37Å; E172-K220 WeakPolarHBondContact OE1-CG 3.06Å; E172-K220 IonicContact OE1-NZ 3.53Å; E172-K220 WeakPolarHBondContact OE2-CE 3.37Å; E172-K220 IonicContact OE2-NZ 2.72Å; E172-K220 PolarHBondContact OE2-NZ 2.85Å; L200-K220 HydrophobicContact CD2-CG 3.9Å; K220-E222 PolarHBondContact O-N 3.3Å
221	I	89.8	Confident	77.4	Confident	82 Å²	82	119.4 Å²	119.4	42%	0.421	58%	0.576	S	S	.	*			trans	-71.9	105.6	166.7	-57.9	173.5	0	0	0	106.8	G199 L201 K223	G199-I221 WeakPolarHBondContact O-CG1 3.29Å; G199-I221 PolarHBondContact O-N 2.7Å; L201-I221 HydrophobicContact CB-CG1 4.41Å; L201-I221 HydrophobicContact CD1-CD1 4.23Å; L201-I221 HydrophobicContact CD1-CG1 3.66Å; L201-I221 HydrophobicContact CD1-CG2 4.48Å; L201-I221 HydrophobicContact CG-CD1 3.98Å; L201-I221 HydrophobicContact CG-CG1 3.6Å; I221-K223 PolarHBondContact O-N 3.22Å
222	E	81.3	Confident	78.9	Confident	153 Å²	153	114.1 Å²	114.1	72%	0.715	55%	0.552	S	S	*	*			trans	-67.6	112.2	167.9	-70.1	169.6	164.6	0	0	107.4	K220 L224	K220-E222 PolarHBondContact O-N 3.3Å; E222-L224 PolarHBondContact O-N 2.95Å
223	K	70.2	Confident	80.9	Confident	195 Å²	195	108.7 Å²	108.7	85%	0.848	53%	0.529	S	S	*	.			trans	-76.7	116.6	168.2	-68.7	-178.7	177	-178.3	0	106.6	I221	I221-K223 PolarHBondContact O-N 3.22Å
224	L	54	Low	82.9	Confident	247 Å²	247	110.1 Å²	110.1	100%	1.293	51%	0.508	S	S	*	.			trans	-65.2	0	163	-82.6	156.3	0	0	0	109.8	E222	E222-L224 PolarHBondContact O-N 2.95Å

Retrieved 224 of 224 residues in 154.6 ms (Link to these results)

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