A0A087X0J1_HUMAN Loading...

WD repeat domain 38

AlphaFold DB , UniProt , Accession A0A087X0J1, Species HUMAN (Homo sapiens, Human), Gene WDR38, Length 266 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	37.7	Very low	25.7	Very low	245 Å²	245	138.6 Å²	138.6	100%	1.207	74%	0.742	S	S	*	*				0	141.9	0	-77.2	166.6	171.7	0	0	108.6
2	A	28.4	Very low	25.5	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	72%	0.723	S	S	*	*			trans	89.2	6	178.6	0	0	0	0	0	121.1
3	R	23.4	Very low	25.2	Very low	225 Å²	225	127.8 Å²	127.8	85%	0.849	72%	0.715	S	S	*	*	S	Bend	trans	-120.8	-11.9	166.1	-72.3	-172.4	-179.6	-169.6	0.9	115.9	S6	R3-S6 PolarHBondContact O-OG 2.99Å
4	C	24.3	Very low	25.2	Very low	118 Å²	118	126.2 Å²	126.2	80%	0.797	72%	0.715	S	S	*	*	S	Bend	trans	-80.7	-24	174.1	-91.8	0	0	0	0	114	S6	C4-S6 PolarHBondContact O-N 3.44Å
5	C	23.6	Very low	25.4	Very low	95 Å²	95	128.3 Å²	128.3	64%	0.642	72%	0.719	S	S	*	*	H	α-helix	trans	-71	-26.8	-179.5	-83	0	0	0	0	113.5	Q7 Q9	C5-Q7 PolarHBondContact O-N 2.74Å; C5-Q9 PolarHBondContact O-OE1 3.05Å
6	S	22.8	Very low	25.3	Very low	68 Å²	68	126.3 Å²	126.3	48%	0.476	72%	0.723	S	S	.	*	H	α-helix	trans	-79.3	-18.3	-175.6	63.4	0	0	0	0	114.1	R3 C4	R3-S6 PolarHBondContact O-OG 2.99Å; C4-S6 PolarHBondContact O-N 3.44Å
7	Q	25	Very low	25.2	Very low	148 Å²	148	122.2 Å²	122.2	69%	0.692	72%	0.715	S	S	*	*	H	α-helix	trans	-84	-34.8	179.3	-136.6	106.2	10.2	0	0	111.8	C5	C5-Q7 PolarHBondContact O-N 2.74Å
8	A	25.6	Very low	25.5	Very low	72 Å²	72	123.1 Å²	123.1	60%	0.595	70%	0.704	S	S	*	*	H	α-helix	trans	-69	-34.6	176.2	0	0	0	0	0	112.2	K10	A8-K10 PolarHBondContact O-N 2.88Å
9	Q	23.6	Very low	25.3	Very low	151 Å²	151	123.7 Å²	123.7	71%	0.706	71%	0.714	S	S	*	*	H	α-helix	trans	-76.3	-15.5	179.2	-79.1	174.8	-45.7	0	0	114.5	C5	C5-Q9 PolarHBondContact O-OE1 3.05Å
10	K	23.1	Very low	25.4	Very low	175 Å²	175	120 Å²	120	76%	0.761	70%	0.703	S	S	*	*	H	α-helix	trans	-100.6	-7.2	-179.7	-75.4	-174.2	176.2	-177	0	115.3	A8	A8-K10 PolarHBondContact O-N 2.88Å
11	M	24.7	Very low	25.8	Very low	132 Å²	132	118.2 Å²	118.2	65%	0.65	69%	0.694	S	S	*	*	H	α-helix	trans	-104.9	-16.5	172.5	-70.1	-76.2	-86.1	0	0	113	A13	M11-A13 PolarHBondContact O-N 2.74Å
12	A	23.6	Very low	25.5	Very low	62 Å²	62	107.7 Å²	107.7	51%	0.512	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-67.7	-15.4	166.7	0	0	0	0	0	113.1	C14 M15	A12-C14 VanDerWaalsContact C-N 3.28Å; A12-C14 PolarHBondContact O-N 3.43Å; A12-M15 PolarHBondContact O-N 3.12Å
13	A	22.4	Very low	26	Very low	74 Å²	74	105.5 Å²	105.5	61%	0.612	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-72.4	-11.2	-178.3	0	0	0	0	0	114.8	M11	M11-A13 PolarHBondContact O-N 2.74Å
14	C	24.2	Very low	26.7	Very low	106 Å²	106	98 Å²	98	72%	0.716	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-88.5	-7	171.9	-92.2	0	0	0	0	114	A12	A12-C14 VanDerWaalsContact C-N 3.28Å; A12-C14 PolarHBondContact O-N 3.43Å
15	M	29	Very low	27.5	Very low	158 Å²	158	93.1 Å²	93.1	78%	0.778	58%	0.576	S	S	*	*	S	Bend	trans	-102.7	-1.9	177.6	-66.1	-138.4	-70.8	0	0	113.8	A12	A12-M15 PolarHBondContact O-N 3.12Å
16	A	23	Very low	27.9	Very low	95 Å²	95	89 Å²	89	79%	0.785	55%	0.548	S	S	*	.	S	Bend	trans	-96.9	13.2	178.1	0	0	0	0	0	114.4
17	G	23.6	Very low	28.3	Very low	57 Å²	57	89.4 Å²	89.4	59%	0.588	56%	0.564	S	S	*	*			trans	-159.2	94.2	175.2	0	0	0	0	0	111.4
18	R	31	Very low	28.4	Very low	138 Å²	138	91.3 Å²	91.3	52%	0.521	57%	0.565	S	S	.	*			trans	-127.5	117.3	164.2	-76.2	-171	177.4	-153.8	-7.7	110.3	G22	R18-G22 VanDerWaalsContact CZ-O 3.27Å; R18-G22 VanDerWaalsContact NH1-C 3.26Å; R18-G22 PolarHBondContact NH1-O 3.4Å; R18-G22 PolarHBondContact NH2-O 3.35Å
19	P	22	Very low	28.5	Very low	136 Å²	136	93.6 Å²	93.6	88%	0.883	57%	0.571	S	S	*	*	S	Bend		-100.7	119.4	117.7	30.1	-19.7	0	0	0	107.7
20	G	26.8	Very low	28.8	Very low	49 Å²	49	89.1 Å²	89.1	51%	0.505	56%	0.56	S	S	.	*	S	Bend	trans	126.1	97.2	179	0	0	0	0	0	112.6	G22	G20-G22 PolarHBondContact O-N 3.19Å
21	V	33.9	Very low	28.9	Very low	82 Å²	82	86.5 Å²	86.5	50%	0.497	56%	0.559	S	S	.	*			trans	-81.4	109.5	-175	-173.7	0	0	0	0	109.4	A153	V21-A153 HydrophobicContact CB-CB 3.99Å
22	G	31.1	Very low	29	Very low	25 Å²	25	88.1 Å²	88.1	26%	0.258	57%	0.565	S	S	.	*			trans	-136.1	93.3	163.4	0	0	0	0	0	109.7	R18 G20	R18-G22 VanDerWaalsContact CZ-O 3.27Å; R18-G22 VanDerWaalsContact NH1-C 3.26Å; R18-G22 PolarHBondContact NH1-O 3.4Å; R18-G22 PolarHBondContact NH2-O 3.35Å; G20-G22 PolarHBondContact O-N 3.19Å
23	S	38.9	Very low	29.1	Very low	50 Å²	50	92.1 Å²	92.1	35%	0.35	57%	0.574	S	S	.	*			trans	-69.7	129.1	174.6	-167.2	0	0	0	0	108.8	C25	S23-C25 PolarHBondContact O-N 3.47Å
24	C	38.3	Very low	29.2	Very low	67 Å²	67	93 Å²	93	45%	0.453	57%	0.572	S	S	.	*			trans	-86.2	93.2	176.8	-67.9	0	0	0	0	108.8	G26 A234	C24-G26 PolarHBondContact O-N 3.46Å; C24-A234 HydrophobicContact CB-CB 4.29Å; C24-A234 WeakPolarHBondContact SG-CB 3.36Å
25	C	40.3	Very low	29.3	Very low	16 Å²	16	93.6 Å²	93.6	11%	0.108	57%	0.567	C	S	.	*			trans	-80.4	58.5	175.7	32.1	0	0	0	0	109.8	S23 L149 C150 S189 I190	S23-C25 PolarHBondContact O-N 3.47Å; C25-L149 WeakPolarHBondContact CB-O 3.3Å; C25-C150 HydrophobicContact CB-CB 3.82Å; C25-C150 WeakPolarHBondContact CB-SG 3.32Å; C25-C150 WeakPolarHBondContact SG-CB 3.1Å; C25-C150 CovalentContact SG-SG 2.04Å; C25-C150 PolarHBondContact SG-SG 3.5Å; C25-S189 PolarHBondContact O-OG 3.25Å; C25-I190 PolarHBondContact SG-O 3.5Å
26	G	33.2	Very low	29	Very low	7 Å²	7	90.7 Å²	90.7	7%	0.072	56%	0.562	C	S	.	*	S	Bend	trans	-114.9	110.6	165.1	0	0	0	0	0	107.8	C24 W28 T232	C24-G26 PolarHBondContact O-N 3.46Å; G26-W28 VanDerWaalsContact O-CD1 3.3Å; G26-W28 PolarHBondContact O-N 2.7Å; G26-T232 VanDerWaalsContact CA-OG1 3.32Å; G26-T232 WeakPolarHBondContact CA-OG1 3.49Å
27	G	30.1	Very low	29.4	Very low	77 Å²	77	91.3 Å²	91.3	79%	0.794	56%	0.558	S	S	*	*			trans	-47	104.2	-178.9	0	0	0	0	0	111.3	V29	G27-V29 PolarHBondContact O-N 3.01Å
28	W	27.8	Very low	29.6	Very low	188 Å²	188	95.5 Å²	95.5	71%	0.712	57%	0.572	S	S	*	*			trans	-75.3	112.2	159.1	-74	85.9	0	0	0	105.2	G26 A30	G26-W28 VanDerWaalsContact O-CD1 3.3Å; G26-W28 PolarHBondContact O-N 2.7Å; W28-A30 PolarHBondContact O-N 2.7Å
29	V	28.6	Very low	29.8	Very low	120 Å²	120	93.9 Å²	93.9	73%	0.727	58%	0.581	S	S	*	*			trans	-59.9	93	154.9	-172.8	0	0	0	0	104.7	G27 T31	G27-V29 PolarHBondContact O-N 3.01Å; V29-T31 VanDerWaalsContact CG1-OG1 3.28Å; V29-T31 WeakPolarHBondContact CG1-OG1 2.96Å; V29-T31 PolarHBondContact O-N 2.97Å
30	A	28.2	Very low	30.3	Very low	58 Å²	58	98.6 Å²	98.6	48%	0.479	58%	0.581	S	S	.	*			trans	-68.1	75.9	162.5	0	0	0	0	0	105.9	W28 Q32 V62	W28-A30 PolarHBondContact O-N 2.7Å; A30-Q32 VanDerWaalsContact C-N 3.28Å; A30-Q32 PolarHBondContact O-N 2.79Å; A30-V62 HydrophobicContact CB-CG2 4.5Å
31	T	25.8	Very low	30.4	Very low	119 Å²	119	105 Å²	105	73%	0.73	60%	0.598	S	S	*	*			trans	-65.8	104.2	163.5	-45	0	0	0	0	104.5	V29	V29-T31 VanDerWaalsContact CG1-OG1 3.28Å; V29-T31 WeakPolarHBondContact CG1-OG1 2.96Å; V29-T31 PolarHBondContact O-N 2.97Å
32	Q	27	Very low	30.7	Very low	166 Å²	166	109.4 Å²	109.4	78%	0.776	62%	0.618	S	S	*	*			trans	74.6	82.8	165.4	-153.5	160.2	58	0	0	116.1	A30 V34	A30-Q32 VanDerWaalsContact C-N 3.28Å; A30-Q32 PolarHBondContact O-N 2.79Å; Q32-V34 HydrophobicContact CG-CG2 3.52Å
33	M	25.4	Very low	30.6	Very low	146 Å²	146	112.9 Å²	112.9	72%	0.719	64%	0.638	S	S	*	*			trans	-99.8	89.9	143.3	-159.1	176.3	-66.1	0	0	107.1	L35	M33-L35 VanDerWaalsContact C-N 3.31Å; M33-L35 PolarHBondContact O-N 3.01Å
34	V	24.5	Very low	30.2	Very low	93 Å²	93	116 Å²	116	56%	0.564	66%	0.655	S	S	*	*			trans	-68.6	99.3	162.7	-172.3	0	0	0	0	105.4	Q32 C36	Q32-V34 HydrophobicContact CG-CG2 3.52Å; V34-C36 HydrophobicContact CG1-CB 4.24Å; V34-C36 WeakPolarHBondContact CG1-SG 3.27Å; V34-C36 PolarHBondContact O-N 2.9Å
35	L	27.2	Very low	30.1	Very low	118 Å²	118	122 Å²	122	62%	0.618	67%	0.674	S	S	*	*			trans	-68.6	89.4	153	-72.5	171.1	0	0	0	105.2	M33 P37	M33-L35 VanDerWaalsContact C-N 3.31Å; M33-L35 PolarHBondContact O-N 3.01Å; L35-P37 WeakPolarHBondContact O-CD 3.13Å
36	C	22.2	Very low	30.1	Very low	98 Å²	98	127 Å²	127	66%	0.662	71%	0.706	S	S	*	*			trans	-73.7	109	162.1	-87.2	0	0	0	0	106.1	V34 V38	V34-C36 HydrophobicContact CG1-CB 4.24Å; V34-C36 WeakPolarHBondContact CG1-SG 3.27Å; V34-C36 PolarHBondContact O-N 2.9Å; C36-V38 PolarHBondContact O-N 2.85Å
37	P	31	Very low	30.3	Very low	108 Å²	108	132.3 Å²	132.3	70%	0.701	73%	0.733	S	S	*	*			trans	-65.2	122.4	150.1	28.3	-28.9	0	0	0	106	L35 S39	L35-P37 WeakPolarHBondContact O-CD 3.13Å; P37-S39 PolarHBondContact O-N 2.78Å
38	V	28.9	Very low	30.7	Very low	145 Å²	145	135.2 Å²	135.2	88%	0.879	74%	0.738	S	S	*	*			trans	-52.6	106.3	164.9	176.2	0	0	0	0	106.6	C36	C36-V38 PolarHBondContact O-N 2.85Å
39	S	34.9	Very low	31.4	Very low	103 Å²	103	129.6 Å²	129.6	72%	0.72	74%	0.738	S	S	*	*			trans	-67.8	137.3	179.9	-78.3	0	0	0	0	110.3	P37	P37-S39 PolarHBondContact O-N 2.78Å
40	R	31.9	Very low	32.4	Very low	235 Å²	235	130.1 Å²	130.1	89%	0.887	74%	0.736	S	S	*	*			trans	-168.6	91.3	142.2	-101.3	169.6	-156.4	-150.5	6.7	109.9
41	H	30.2	Very low	33.8	Very low	183 Å²	183	131 Å²	131	85%	0.847	74%	0.735	S	S	*	*				-176.1	122.1	115.3	-106.7	-76.7	0	0	0	109.4
42	L	38.8	Very low	35.4	Very low	176 Å²	176	128.1 Å²	128.1	92%	0.921	72%	0.719	S	S	*	*			trans	-69.5	124.3	164.8	-79.8	156.6	0	0	0	108.6
43	S	30	Very low	37.4	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	72%	0.723	S	S	*	*			trans	-163.5	106.3	148.7	51.8	0	0	0	0	111.2
44	T	31.2	Very low	40	Very low	115 Å²	115	118.9 Å²	118.9	71%	0.706	70%	0.695	S	S	*	*			trans	61	118.3	130.7	55.3	0	0	0	0	122.1
45	F	34.8	Very low	42.9	Very low	194 Å²	194	116.3 Å²	116.3	85%	0.851	68%	0.677	S	S	*	*			trans	70.5	134.5	155.2	-56.3	-69.6	0	0	0	120
46	P	41.1	Very low	45.8	Very low	122 Å²	122	115.9 Å²	115.9	79%	0.792	67%	0.672	S	S	*	*			trans	-84.6	123.8	179.2	32.9	-29.4	0	0	0	111.2
47	D	37.7	Very low	49.1	Very low	117 Å²	117	118.4 Å²	118.4	63%	0.626	67%	0.667	S	S	*	*			trans	-73.4	125.8	164.4	-138.4	-13.1	0	0	0	108.3	G49 L50	D47-G49 PolarHBondContact O-N 2.76Å; D47-L50 HydrophobicContact CB-CD1 3.89Å; D47-L50 PolarHBondContact O-N 2.82Å
48	P	37.2	Very low	51.9	Low	139 Å²	139	116.5 Å²	116.5	90%	0.903	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	12.4	-174.4	27.5	-33.1	0	0	0	114.6
49	G	43.3	Very low	54.8	Low	69 Å²	69	112.5 Å²	112.5	71%	0.711	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	0.5	179.6	0	0	0	0	0	115.8	D47 V51	D47-G49 PolarHBondContact O-N 2.76Å; G49-V51 PolarHBondContact O-N 3.04Å
50	L	50.3	Low	57.5	Low	131 Å²	131	110.7 Å²	110.7	69%	0.686	61%	0.612	S	S	*	*			trans	-80.1	115.9	-178.7	-95.5	153.6	0	0	0	110.9	D47 P52	D47-L50 HydrophobicContact CB-CD1 3.89Å; D47-L50 PolarHBondContact O-N 2.82Å; L50-P52 WeakPolarHBondContact O-CD 3.17Å
51	V	57	Low	60.3	Low	76 Å²	76	100.2 Å²	100.2	46%	0.461	57%	0.574	S	S	.	*			trans	-57.9	120.3	165.5	-164.6	0	0	0	0	107	G49 A53 L93	G49-V51 PolarHBondContact O-N 3.04Å; V51-A53 PolarHBondContact O-N 3.13Å; V51-L93 HydrophobicContact CG1-CD2 4.09Å
52	P	58.7	Low	63.3	Low	60 Å²	60	94.7 Å²	94.7	39%	0.39	55%	0.553	S	S	.	*			trans	-60.3	139.7	-174	21.3	-31.2	0	0	0	110.5	L50 G54 Q56	L50-P52 WeakPolarHBondContact O-CD 3.17Å; P52-G54 PolarHBondContact O-N 2.73Å; P52-Q56 HydrophobicContact CG-CG 4.17Å
53	A	68.5	Low	65.8	Low	105 Å²	105	86.9 Å²	86.9	87%	0.868	51%	0.513	S	S	*	.	S	Bend	trans	-66.1	108.2	-175.5	0	0	0	0	0	110.4	V51	V51-A53 PolarHBondContact O-N 3.13Å
54	G	81.2	Confident	68.7	Low	12 Å²	12	87 Å²	87	12%	0.124	50%	0.502	C	S	.	.	S	Bend	trans	89.4	-177.2	174.2	0	0	0	0	0	115.7	P52 Q56 M81	P52-G54 PolarHBondContact O-N 2.73Å; G54-Q56 PolarHBondContact O-NE2 2.46Å; G54-M81 WeakPolarHBondContact O-CE 3.01Å
55	H	84.1	Confident	71.6	Confident	40 Å²	40	81.6 Å²	81.6	19%	0.185	47%	0.469	C	S	.	.			trans	-66.2	139.4	-174.5	-76.1	-73.2	0	0	0	112.5	V59 S73 D77 R79	H55-V59 HydrophobicContact CB-CG2 3.76Å; H55-V59 VanDerWaalsContact CD2-CG2 3.41Å; H55-V59 WeakPolarHBondContact CD2-CG2 3.48Å; H55-S73 PolarHBondContact CD2-OG 2.85Å; H55-S73 WeakPolarHBondContact NE2-CB 3.46Å; H55-S73 PolarHBondContact NE2-OG 3.46Å; H55-D77 WeakPolarHBondContact CA-OD2 3.47Å; H55-D77 WeakPolarHBondContact CB-OD2 3.33Å; H55-D77 IonicContact CE1-OD1 2.95Å; H55-D77 IonicContact CG-OD2 2.78Å; H55-D77 VanDerWaalsContact ND1-CG 3.33Å; H55-D77 IonicContact ND1-OD1 3.9Å; H55-D77 PolarHBondContact ND1-OD1 2.7Å; H55-D77 VanDerWaalsContact ND1-OD1 3.11Å; H55-D77 IonicContact ND1-OD2 3.54Å; H55-D77 PolarHBondContact ND1-OD2 3.44Å; H55-R79 PolarHBondContact CE1-O 3.29Å; H55-R79 VanDerWaalsContact CE1-O 3.3Å
56	Q	88.9	Confident	74.1	Confident	108 Å²	108	75.9 Å²	75.9	51%	0.505	45%	0.451	S	S	.	.	S	Bend	trans	-96.3	-7.1	-178.4	-59.3	-55.6	-57.2	0	0	113.1	P52 G54 D77	P52-Q56 HydrophobicContact CG-CG 4.17Å; G54-Q56 PolarHBondContact O-NE2 2.46Å; Q56-D77 HydrophobicContact CB-CB 4.29Å; Q56-D77 PolarHBondContact N-OD2 3.35Å
57	R	91.3	Very high	76.3	Confident	152 Å²	152	73.3 Å²	73.3	57%	0.574	43%	0.431	S	S	*	.	S	Bend	trans	-142.8	-178.1	178.4	-59.8	-168.2	71.6	-168.3	2.5	109.9	V59 W76 D77	R57-V59 PolarHBondContact O-N 3.16Å; R57-W76 HydrophobicContact CB-CB 3.66Å; R57-W76 HydrophobicContact CG-CB 4.49Å; R57-D77 HydrophobicContact CB-CB 4.17Å; R57-D77 HydrophobicContact CG-CB 4.22Å
58	S	89.6	Confident	78.7	Confident	68 Å²	68	71.4 Å²	71.4	48%	0.476	43%	0.427	S	S	.	.			trans	-51.9	133.7	178.2	-177.3	0	0	0	0	111.5	E60 G75 W76	S58-E60 WeakPolarHBondContact CB-OE1 3.3Å; S58-E60 PolarHBondContact OG-OE1 3.32Å; S58-G75 VanDerWaalsContact O-CA 3.28Å; S58-G75 WeakPolarHBondContact O-CA 3.37Å; S58-W76 PolarHBondContact O-N 3.01Å
59	V	91.3	Very high	81.2	Confident	61 Å²	61	73.1 Å²	73.1	37%	0.37	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.4	173.1	-178.5	0	0	0	0	107.5	H55 R57 T61 V62	H55-V59 HydrophobicContact CB-CG2 3.76Å; H55-V59 VanDerWaalsContact CD2-CG2 3.41Å; H55-V59 WeakPolarHBondContact CD2-CG2 3.48Å; R57-V59 PolarHBondContact O-N 3.16Å; V59-T61 WeakPolarHBondContact CG1-O 3.25Å; V59-V62 HydrophobicContact CG1-CG1 4.08Å
60	E	91.1	Very high	83.5	Confident	65 Å²	65	71.7 Å²	71.7	30%	0.304	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-24.3	-173.9	-63.2	-60.9	146.1	0	0	112.2	S58 G74 W76 I101	S58-E60 WeakPolarHBondContact CB-OE1 3.3Å; S58-E60 PolarHBondContact OG-OE1 3.32Å; E60-G74 PolarHBondContact N-O 3.19Å; E60-W76 VanDerWaalsContact CD-NE1 3.3Å; E60-W76 VanDerWaalsContact CG-CD1 3.42Å; E60-W76 PolarHBondContact OE1-NE1 3.3Å; E60-I101 WeakPolarHBondContact CB-O 3.26Å
61	T	90.1	Very high	85.5	Confident	14 Å²	14	66.9 Å²	66.9	9%	0.086	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.2	-179.9	-172	0	0	0	0	111.7	V59 S73 G74 I101 S104	V59-T61 WeakPolarHBondContact CG1-O 3.25Å; T61-S73 VanDerWaalsContact O-CA 3.31Å; T61-S73 WeakPolarHBondContact O-CA 3.23Å; T61-G74 PolarHBondContact N-O 2.95Å; T61-G74 PolarHBondContact O-N 3.16Å; T61-I101 HydrophobicContact CG2-CG2 3.78Å; T61-S104 WeakPolarHBondContact CG2-OG 3.27Å; T61-S104 PolarHBondContact OG1-N 2.96Å; T61-S104 PolarHBondContact OG1-OG 3.22Å
62	V	92.9	Very high	87.2	Confident	67 Å²	67	63.2 Å²	63.2	41%	0.406	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.9	167.8	-66.7	0	0	0	0	109	A30 V59 A72	A30-V62 HydrophobicContact CB-CG2 4.5Å; V59-V62 HydrophobicContact CG1-CG1 4.08Å; V62-A72 CarbonylContact C-O 3.53Å; V62-A72 VanDerWaalsContact CA-O 3.25Å; V62-A72 WeakPolarHBondContact CA-O 3.37Å
63	S	91.9	Very high	88.9	Confident	12 Å²	12	60.6 Å²	60.6	8%	0.084	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	142.3	175.2	54.2	0	0	0	0	110.1	L71 A72 S104 F106	S63-L71 CarbonylContact O-C 3.59Å; S63-L71 WeakPolarHBondContact O-CA 3.17Å; S63-A72 PolarHBondContact N-O 2.83Å; S63-A72 PolarHBondContact O-N 2.83Å; S63-S104 PolarHBondContact OG-OG 3.2Å; S63-F106 WeakPolarHBondContact O-CE2 3.09Å
64	F	91.2	Very high	90	Very high	100 Å²	100	55.6 Å²	55.6	44%	0.439	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	146.1	173.5	-74.9	-86.5	0	0	0	110.2	L71 V85 F106	F64-L71 HydrophobicContact CD1-CB 4.32Å; F64-L71 HydrophobicContact CD1-CD1 4.25Å; F64-L71 HydrophobicContact CE1-CB 4.32Å; F64-L71 HydrophobicContact CE1-CD1 3.69Å; F64-L71 HydrophobicContact CE2-CD1 4.04Å; F64-L71 HydrophobicContact CZ-CD1 3.58Å; F64-V85 HydrophobicContact CD1-CG2 3.95Å; F64-V85 HydrophobicContact CE1-CG1 4.26Å; F64-V85 HydrophobicContact CE1-CG2 3.86Å; F64-F106 VanDerWaalsContact C-CD2 3.41Å; F64-F106 VanDerWaalsContact O-CD2 3.27Å; F64-F106 WeakPolarHBondContact O-CD2 3.39Å
65	S	90.7	Very high	90.4	Very high	2 Å²	2	55 Å²	55	1%	0.014	28%	0.279	C	S	.	.			trans	-65.2	152.3	167.6	58.3	0	0	0	0	110.8	D67 S68 R69 Q70	S65-D67 VanDerWaalsContact CB-OD1 3.28Å; S65-D67 WeakPolarHBondContact CB-OD1 3.37Å; S65-D67 PolarHBondContact O-N 3.42Å; S65-D67 VanDerWaalsContact O-N 3.14Å; S65-D67 PolarHBondContact OG-OD1 3.22Å; S65-S68 WeakPolarHBondContact O-CA 3.28Å; S65-S68 PolarHBondContact O-N 3.42Å; S65-R69 PolarHBondContact OG-N 2.73Å; S65-Q70 PolarHBondContact N-O 3.34Å; S65-Q70 PolarHBondContact OG-N 2.8Å; S65-Q70 PolarHBondContact OG-O 2.86Å
66	P	87.7	Confident	90.9	Very high	73 Å²	73	56.8 Å²	56.8	47%	0.474	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.3	177.3	-27	29.2	0	0	0	114.7	S68 S107 V110	P66-S68 VanDerWaalsContact C-N 3.29Å; P66-S107 VanDerWaalsContact CG-O 3.28Å; P66-S107 WeakPolarHBondContact CG-O 3.39Å; P66-V110 HydrophobicContact CB-CG2 3.92Å; P66-V110 HydrophobicContact CG-CG2 3.89Å
67	D	87.3	Confident	90.9	Very high	69 Å²	69	52.7 Å²	52.7	37%	0.369	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	0.7	176	69	-4.2	0	0	0	113.7	S65 R69 V110	S65-D67 VanDerWaalsContact CB-OD1 3.28Å; S65-D67 WeakPolarHBondContact CB-OD1 3.37Å; S65-D67 PolarHBondContact O-N 3.42Å; S65-D67 VanDerWaalsContact O-N 3.14Å; S65-D67 PolarHBondContact OG-OD1 3.22Å; D67-R69 HydrophobicContact CB-CG 4.41Å; D67-R69 PolarHBondContact O-N 2.92Å; D67-R69 VanDerWaalsContact O-N 3.12Å; D67-R69 PolarHBondContact OD1-N 2.78Å; D67-R69 VanDerWaalsContact OD1-N 3.08Å; D67-R69 WeakPolarHBondContact OD2-CD 3.37Å; D67-V110 HydrophobicContact CB-CG2 4.4Å
68	S	88.6	Confident	90.9	Very high	76 Å²	76	49.8 Å²	49.8	53%	0.531	26%	0.256	S	S	.	.	S	Bend	trans	58.3	15.6	-178	-54	0	0	0	0	115.3	S65 P66	S65-S68 WeakPolarHBondContact O-CA 3.28Å; S65-S68 PolarHBondContact O-N 3.42Å; P66-S68 VanDerWaalsContact C-N 3.29Å
69	R	89.5	Confident	90.9	Very high	176 Å²	176	50.1 Å²	50.1	66%	0.664	25%	0.247	S	C	*	.	S	Bend	trans	-88.3	-28.8	179.8	-65.9	-177	174.1	178.6	-3.5	113.1	S65 D67 V85	S65-R69 PolarHBondContact OG-N 2.73Å; D67-R69 HydrophobicContact CB-CG 4.41Å; D67-R69 PolarHBondContact O-N 2.92Å; D67-R69 VanDerWaalsContact O-N 3.12Å; D67-R69 PolarHBondContact OD1-N 2.78Å; D67-R69 VanDerWaalsContact OD1-N 3.08Å; D67-R69 WeakPolarHBondContact OD2-CD 3.37Å; R69-V85 WeakPolarHBondContact O-CG2 3.48Å; R69-V85 PolarHBondContact O-N 2.76Å
70	Q	91	Very high	91	Very high	39 Å²	39	47.3 Å²	47.3	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	148.3	-177.9	-60.3	-179.3	34.9	0	0	111.1	S65 W83 L91 F106	S65-Q70 PolarHBondContact N-O 3.34Å; S65-Q70 PolarHBondContact OG-N 2.8Å; S65-Q70 PolarHBondContact OG-O 2.86Å; Q70-W83 CarbonylContact C-O 3.55Å; Q70-W83 VanDerWaalsContact CA-O 3.26Å; Q70-W83 WeakPolarHBondContact CA-O 3.38Å; Q70-L91 HydrophobicContact CG-CD1 4.05Å; Q70-F106 HydrophobicContact CB-CZ 4.25Å
71	L	92.9	Very high	91.1	Very high	29 Å²	29	44.3 Å²	44.3	15%	0.152	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	136	168.4	178.6	145.7	0	0	0	108.6	S63 F64 L82 W83 V85	S63-L71 CarbonylContact O-C 3.59Å; S63-L71 WeakPolarHBondContact O-CA 3.17Å; F64-L71 HydrophobicContact CD1-CB 4.32Å; F64-L71 HydrophobicContact CD1-CD1 4.25Å; F64-L71 HydrophobicContact CE1-CB 4.32Å; F64-L71 HydrophobicContact CE1-CD1 3.69Å; F64-L71 HydrophobicContact CE2-CD1 4.04Å; F64-L71 HydrophobicContact CZ-CD1 3.58Å; L71-L82 CarbonylContact O-C 3.56Å; L71-L82 WeakPolarHBondContact O-CA 3.44Å; L71-W83 HydrophobicContact CB-CB 4.39Å; L71-W83 HydrophobicContact CD2-CG 4.22Å; L71-W83 PolarHBondContact N-O 3.02Å; L71-W83 PolarHBondContact O-N 3.42Å; L71-V85 HydrophobicContact CB-CG2 3.98Å
72	A	93.8	Very high	91.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	138.1	168	0	0	0	0	0	109.1	V62 S63 M81 L82 F106 L113	V62-A72 CarbonylContact C-O 3.53Å; V62-A72 VanDerWaalsContact CA-O 3.25Å; V62-A72 WeakPolarHBondContact CA-O 3.37Å; S63-A72 PolarHBondContact N-O 2.83Å; S63-A72 PolarHBondContact O-N 2.83Å; A72-M81 CarbonylContact C-O 3.54Å; A72-M81 WeakPolarHBondContact CA-O 3.27Å; A72-L82 HydrophobicContact CB-CD2 3.73Å; A72-F106 HydrophobicContact CB-CE2 3.56Å; A72-F106 HydrophobicContact CB-CZ 3.84Å; A72-L113 HydrophobicContact CB-CD1 3.69Å; A72-L113 HydrophobicContact CB-CD2 3.65Å; A72-L113 HydrophobicContact CB-CG 4.34Å
73	S	93.3	Very high	91.1	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.035	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.4	170.6	62.9	0	0	0	0	110.6	H55 T61 V80 M81 W83	H55-S73 PolarHBondContact CD2-OG 2.85Å; H55-S73 WeakPolarHBondContact NE2-CB 3.46Å; H55-S73 PolarHBondContact NE2-OG 3.46Å; T61-S73 VanDerWaalsContact O-CA 3.31Å; T61-S73 WeakPolarHBondContact O-CA 3.23Å; S73-V80 CarbonylContact O-C 3.53Å; S73-V80 VanDerWaalsContact O-CA 3.31Å; S73-V80 WeakPolarHBondContact O-CA 3.49Å; S73-M81 PolarHBondContact N-O 2.9Å; S73-M81 PolarHBondContact O-N 3.13Å; S73-W83 PolarHBondContact OG-NE1 2.86Å
74	G	92.1	Very high	91	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	154.9	178.7	0	0	0	0	0	111.6	E60 T61 R79	E60-G74 PolarHBondContact N-O 3.19Å; T61-G74 PolarHBondContact N-O 2.95Å; T61-G74 PolarHBondContact O-N 3.16Å; G74-R79 WeakPolarHBondContact CA-O 3.32Å
75	G	90.3	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	-155.5	-177.2	0	0	0	0	0	115.5	S58 D77 K78 S100 I101	S58-G75 VanDerWaalsContact O-CA 3.28Å; S58-G75 WeakPolarHBondContact O-CA 3.37Å; G75-D77 PolarHBondContact O-N 2.84Å; G75-K78 PolarHBondContact O-N 2.99Å; G75-K78 VanDerWaalsContact O-N 3.15Å; G75-S100 WeakPolarHBondContact O-CA 3.46Å; G75-S100 PolarHBondContact O-OG 2.85Å; G75-I101 PolarHBondContact O-N 3.31Å; G75-I101 VanDerWaalsContact O-N 3.09Å
76	W	92.6	Very high	90.8	Very high	77 Å²	77	50.9 Å²	50.9	29%	0.292	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-11.9	-173.2	-77	84.2	0	0	0	115.1	R57 S58 E60 K78 S100 W118	R57-W76 HydrophobicContact CB-CB 3.66Å; R57-W76 HydrophobicContact CG-CB 4.49Å; S58-W76 PolarHBondContact O-N 3.01Å; E60-W76 VanDerWaalsContact CD-NE1 3.3Å; E60-W76 VanDerWaalsContact CG-CD1 3.42Å; E60-W76 PolarHBondContact OE1-NE1 3.3Å; W76-K78 PolarHBondContact O-N 2.82Å; W76-S100 WeakPolarHBondContact CA-OG 3.47Å; W76-S100 PolarHBondContact N-OG 3.26Å; W76-W118 HydrophobicContact CH2-CE3 4.29Å; W76-W118 AromaticContact CH2-CH2 3.19Å; W76-W118 HydrophobicContact CH2-CH2 3.19Å; W76-W118 HydrophobicContact CH2-CZ2 4.12Å; W76-W118 AromaticContact CH2-CZ3 3.3Å; W76-W118 HydrophobicContact CH2-CZ3 3.3Å; W76-W118 AromaticContact CZ2-CH2 3.61Å; W76-W118 HydrophobicContact CZ2-CH2 3.61Å; W76-W118 HydrophobicContact CZ2-CZ2 4.12Å; W76-W118 HydrophobicContact CZ2-CZ3 4.11Å; W76-W118 HydrophobicContact CZ3-CE3 4.3Å; W76-W118 AromaticContact CZ3-CH2 4Å; W76-W118 HydrophobicContact CZ3-CH2 4Å; W76-W118 AromaticContact CZ3-CZ3 3.61Å; W76-W118 HydrophobicContact CZ3-CZ3 3.61Å
77	D	89.4	Confident	90.9	Very high	21 Å²	21	50.6 Å²	50.6	11%	0.112	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	3.8	173.1	64.5	-3.6	0	0	0	112.6	H55 Q56 R57 G75 R79	H55-D77 WeakPolarHBondContact CA-OD2 3.47Å; H55-D77 WeakPolarHBondContact CB-OD2 3.33Å; H55-D77 IonicContact CE1-OD1 2.95Å; H55-D77 IonicContact CG-OD2 2.78Å; H55-D77 VanDerWaalsContact ND1-CG 3.33Å; H55-D77 IonicContact ND1-OD1 3.9Å; H55-D77 PolarHBondContact ND1-OD1 2.7Å; H55-D77 VanDerWaalsContact ND1-OD1 3.11Å; H55-D77 IonicContact ND1-OD2 3.54Å; H55-D77 PolarHBondContact ND1-OD2 3.44Å; Q56-D77 HydrophobicContact CB-CB 4.29Å; Q56-D77 PolarHBondContact N-OD2 3.35Å; R57-D77 HydrophobicContact CB-CB 4.17Å; R57-D77 HydrophobicContact CG-CB 4.22Å; G75-D77 PolarHBondContact O-N 2.84Å; D77-R79 WeakPolarHBondContact O-CG 3.41Å; D77-R79 PolarHBondContact O-N 3.23Å; D77-R79 PolarHBondContact OD1-N 2.89Å
78	K	92.4	Very high	90.7	Very high	91 Å²	91	49 Å²	49	40%	0.396	25%	0.245	S	C	.	.	S	Bend	trans	64.6	16.3	176.3	-42.1	-179.3	175	-165.2	0	113.1	G75 W76 R98	G75-K78 PolarHBondContact O-N 2.99Å; G75-K78 VanDerWaalsContact O-N 3.15Å; W76-K78 PolarHBondContact O-N 2.82Å; K78-R98 WeakPolarHBondContact CD-O 3.37Å; K78-R98 WeakPolarHBondContact CE-O 3.38Å; K78-R98 PolarHBondContact NZ-O 3.16Å
79	R	90	Very high	90.6	Very high	76 Å²	76	51.8 Å²	51.8	29%	0.287	25%	0.249	S	C	.	.			trans	-108.2	138.5	-177.4	-69.6	169.1	-176.5	-120.3	-0.2	109.7	H55 G74 D77 M81 L93 I101	H55-R79 PolarHBondContact CE1-O 3.29Å; H55-R79 VanDerWaalsContact CE1-O 3.3Å; G74-R79 WeakPolarHBondContact CA-O 3.32Å; D77-R79 WeakPolarHBondContact O-CG 3.41Å; D77-R79 PolarHBondContact O-N 3.23Å; D77-R79 PolarHBondContact OD1-N 2.89Å; R79-M81 HydrophobicContact CB-CE 3.98Å; R79-L93 HydrophobicContact CB-CD1 3.82Å; R79-L93 HydrophobicContact CG-CD1 3.97Å; R79-I101 VanDerWaalsContact C-CD1 3.42Å; R79-I101 VanDerWaalsContact O-CD1 3.25Å; R79-I101 WeakPolarHBondContact O-CD1 3.42Å
80	V	93.3	Very high	90.6	Very high	1 Å²	1	47 Å²	47	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.3	165.8	-176.2	0	0	0	0	107.2	S73 L94 I101 L113 T115 W125	S73-V80 CarbonylContact O-C 3.53Å; S73-V80 VanDerWaalsContact O-CA 3.31Å; S73-V80 WeakPolarHBondContact O-CA 3.49Å; V80-L94 HydrophobicContact CB-CB 4.04Å; V80-L94 HydrophobicContact CB-CD1 4.18Å; V80-L94 HydrophobicContact CB-CG 4.2Å; V80-L94 HydrophobicContact CG1-CD1 3.76Å; V80-L94 HydrophobicContact CG1-CG 4.2Å; V80-L94 PolarHBondContact N-O 3.35Å; V80-L94 PolarHBondContact O-N 3.29Å; V80-I101 HydrophobicContact CG2-CD1 3.59Å; V80-I101 HydrophobicContact CG2-CG1 3.73Å; V80-I101 HydrophobicContact CG2-CG2 4.46Å; V80-L113 HydrophobicContact CG1-CD2 3.76Å; V80-T115 HydrophobicContact CG1-CG2 4Å; V80-T115 HydrophobicContact CG2-CG2 3.84Å; V80-W125 HydrophobicContact CG2-CZ2 4.46Å
81	M	91.9	Very high	90.4	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.7	179.4	-62.4	-179.7	-169.8	0	0	109.2	G54 A72 S73 R79 W83 M90 L93	G54-M81 WeakPolarHBondContact O-CE 3.01Å; A72-M81 CarbonylContact C-O 3.54Å; A72-M81 WeakPolarHBondContact CA-O 3.27Å; S73-M81 PolarHBondContact N-O 2.9Å; S73-M81 PolarHBondContact O-N 3.13Å; R79-M81 HydrophobicContact CB-CE 3.98Å; M81-W83 HydrophobicContact CB-CZ2 3.79Å; M81-W83 HydrophobicContact CG-CZ2 4.33Å; M81-W83 PolarHBondContact O-NE1 2.75Å; M81-W83 HydrophobicContact SD-CH2 4.21Å; M81-W83 HydrophobicContact SD-CZ2 3.63Å; M81-M90 HydrophobicContact CB-SD 4.42Å; M81-M90 HydrophobicContact CG-SD 4.12Å; M81-M90 HydrophobicContact SD-SD 4.01Å; M81-L93 HydrophobicContact CE-CD1 4.02Å; M81-L93 HydrophobicContact CG-CD1 3.84Å
82	L	92.3	Very high	90.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.3	169.8	-75.2	175.2	0	0	0	109.7	L71 A72 M90 L91 R92 L94 F106 L113 L127	L71-L82 CarbonylContact O-C 3.56Å; L71-L82 WeakPolarHBondContact O-CA 3.44Å; A72-L82 HydrophobicContact CB-CD2 3.73Å; L82-M90 CarbonylContact O-C 3.58Å; L82-L91 HydrophobicContact CB-CB 4.38Å; L82-L91 PolarHBondContact O-N 3.5Å; L82-R92 HydrophobicContact CB-CB 4.29Å; L82-R92 HydrophobicContact CD1-CB 4.4Å; L82-R92 PolarHBondContact N-O 2.8Å; L82-R92 PolarHBondContact O-N 3.15Å; L82-L94 HydrophobicContact CD1-CD1 4.15Å; L82-L94 HydrophobicContact CD1-CD2 4.04Å; L82-L94 HydrophobicContact CG-CD1 4.24Å; L82-L94 HydrophobicContact CG-CD2 4.47Å; L82-F106 HydrophobicContact CD2-CE1 4.26Å; L82-F106 HydrophobicContact CD2-CZ 3.67Å; L82-L113 HydrophobicContact CD2-CD2 4.3Å; L82-L127 HydrophobicContact CD1-CD1 4.05Å; L82-L127 HydrophobicContact CD1-CD2 3.55Å; L82-L127 HydrophobicContact CD1-CG 4.42Å
83	W	91.1	Very high	90.1	Very high	42 Å²	42	52.6 Å²	52.6	16%	0.159	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.2	-175.3	-49.6	82.3	0	0	0	109.7	Q70 L71 S73 M81 Q89 M90	Q70-W83 CarbonylContact C-O 3.55Å; Q70-W83 VanDerWaalsContact CA-O 3.26Å; Q70-W83 WeakPolarHBondContact CA-O 3.38Å; L71-W83 HydrophobicContact CB-CB 4.39Å; L71-W83 HydrophobicContact CD2-CG 4.22Å; L71-W83 PolarHBondContact N-O 3.02Å; L71-W83 PolarHBondContact O-N 3.42Å; S73-W83 PolarHBondContact OG-NE1 2.86Å; M81-W83 HydrophobicContact CB-CZ2 3.79Å; M81-W83 HydrophobicContact CG-CZ2 4.33Å; M81-W83 PolarHBondContact O-NE1 2.75Å; M81-W83 HydrophobicContact SD-CH2 4.21Å; M81-W83 HydrophobicContact SD-CZ2 3.63Å; W83-Q89 WeakPolarHBondContact CA-O 3.41Å; W83-M90 HydrophobicContact CE3-CB 3.93Å; W83-M90 HydrophobicContact CH2-CB 4.37Å; W83-M90 HydrophobicContact CZ3-CB 3.84Å
84	D	90.3	Very high	89.9	Confident	39 Å²	39	52.4 Å²	52.4	21%	0.209	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.1	163.9	176.3	-100.9	0	0	0	108.8	Q86 S87 G88 Q89 L91	D84-Q86 VanDerWaalsContact C-N 3.31Å; D84-Q86 PolarHBondContact O-N 2.86Å; D84-Q86 PolarHBondContact OD1-N 3.17Å; D84-S87 WeakPolarHBondContact CB-OG 3.48Å; D84-S87 VanDerWaalsContact OD1-CB 3.25Å; D84-S87 WeakPolarHBondContact OD1-CB 3.42Å; D84-S87 PolarHBondContact OD1-N 3.36Å; D84-S87 PolarHBondContact OD1-OG 2.98Å; D84-G88 VanDerWaalsContact O-CA 3.25Å; D84-G88 WeakPolarHBondContact O-CA 3.4Å; D84-G88 PolarHBondContact O-N 3.03Å; D84-Q89 PolarHBondContact N-O 2.75Å; D84-L91 HydrophobicContact CB-CD1 3.98Å; D84-L91 HydrophobicContact CB-CD2 3.94Å; D84-L91 HydrophobicContact CB-CG 3.95Å
85	V	88	Confident	89.7	Confident	64 Å²	64	57.1 Å²	57.1	39%	0.388	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-32.8	-173.9	173.2	0	0	0	0	111.5	F64 R69 L71	F64-V85 HydrophobicContact CD1-CG2 3.95Å; F64-V85 HydrophobicContact CE1-CG1 4.26Å; F64-V85 HydrophobicContact CE1-CG2 3.86Å; R69-V85 WeakPolarHBondContact O-CG2 3.48Å; R69-V85 PolarHBondContact O-N 2.76Å; L71-V85 HydrophobicContact CB-CG2 3.98Å
86	Q	89.9	Confident	89.6	Confident	189 Å²	189	58.3 Å²	58.3	88%	0.883	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-43.6	-174.4	-174.9	174.8	2.3	0	0	112.5	D84	D84-Q86 VanDerWaalsContact C-N 3.31Å; D84-Q86 PolarHBondContact O-N 2.86Å; D84-Q86 PolarHBondContact OD1-N 3.17Å
87	S	88.3	Confident	89.6	Confident	66 Å²	66	55.3 Å²	55.3	46%	0.462	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-20.7	-177.8	65.1	0	0	0	0	113.3	D84 Q89	D84-S87 WeakPolarHBondContact CB-OG 3.48Å; D84-S87 VanDerWaalsContact OD1-CB 3.25Å; D84-S87 WeakPolarHBondContact OD1-CB 3.42Å; D84-S87 PolarHBondContact OD1-N 3.36Å; D84-S87 PolarHBondContact OD1-OG 2.98Å; S87-Q89 PolarHBondContact O-N 3.22Å; S87-Q89 PolarHBondContact OG-N 2.8Å
88	G	84.2	Confident	89.9	Confident	36 Å²	36	64.3 Å²	64.3	37%	0.371	32%	0.323	S	S	.	.			trans	70.8	10.3	-172.8	0	0	0	0	0	113.8	D84	D84-G88 VanDerWaalsContact O-CA 3.25Å; D84-G88 WeakPolarHBondContact O-CA 3.4Å; D84-G88 PolarHBondContact O-N 3.03Å
89	Q	87.4	Confident	90.1	Very high	135 Å²	135	62.7 Å²	62.7	63%	0.631	32%	0.319	S	S	*	.			trans	-81.4	144.4	-179.6	-65.9	-171.4	-2.8	0	0	111.7	W83 D84 S87 L91	W83-Q89 WeakPolarHBondContact CA-O 3.41Å; D84-Q89 PolarHBondContact N-O 2.75Å; S87-Q89 PolarHBondContact O-N 3.22Å; S87-Q89 PolarHBondContact OG-N 2.8Å; Q89-L91 PolarHBondContact O-N 3.24Å
90	M	87.6	Confident	90.2	Very high	76 Å²	76	59 Å²	59	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	117.8	172	-174.2	177.1	68	0	0	109.2	M81 L82 W83	M81-M90 HydrophobicContact CB-SD 4.42Å; M81-M90 HydrophobicContact CG-SD 4.12Å; M81-M90 HydrophobicContact SD-SD 4.01Å; L82-M90 CarbonylContact O-C 3.58Å; W83-M90 HydrophobicContact CE3-CB 3.93Å; W83-M90 HydrophobicContact CH2-CB 4.37Å; W83-M90 HydrophobicContact CZ3-CB 3.84Å
91	L	88.6	Confident	90.3	Very high	85 Å²	85	59 Å²	59	45%	0.445	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-48.4	177.9	-66.4	175.9	0	0	0	111.6	Q70 L82 D84 Q89	Q70-L91 HydrophobicContact CG-CD1 4.05Å; L82-L91 HydrophobicContact CB-CB 4.38Å; L82-L91 PolarHBondContact O-N 3.5Å; D84-L91 HydrophobicContact CB-CD1 3.98Å; D84-L91 HydrophobicContact CB-CD2 3.94Å; D84-L91 HydrophobicContact CB-CG 3.95Å; Q89-L91 PolarHBondContact O-N 3.24Å
92	R	88.8	Confident	90.4	Very high	50 Å²	50	60.9 Å²	60.9	19%	0.189	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.1	-174.5	-67.5	-173.4	-75.8	-148.2	-6.8	111.6	L82 L94 L127 M129	L82-R92 HydrophobicContact CB-CB 4.29Å; L82-R92 HydrophobicContact CD1-CB 4.4Å; L82-R92 PolarHBondContact N-O 2.8Å; L82-R92 PolarHBondContact O-N 3.15Å; R92-L94 HydrophobicContact CB-CD2 3.81Å; R92-L127 PolarHBondContact NH1-O 3.04Å; R92-L127 VanDerWaalsContact NH2-CB 3.34Å; R92-L127 PolarHBondContact NH2-O 2.87Å; R92-L127 VanDerWaalsContact NH2-O 3.1Å; R92-M129 PolarHBondContact NH1-O 3.42Å
93	L	90.1	Very high	90.5	Very high	49 Å²	49	61.6 Å²	61.6	26%	0.257	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.8	165.6	179	68.5	0	0	0	108.3	V51 R79 M81 V95	V51-L93 HydrophobicContact CG1-CD2 4.09Å; R79-L93 HydrophobicContact CB-CD1 3.82Å; R79-L93 HydrophobicContact CG-CD1 3.97Å; M81-L93 HydrophobicContact CE-CD1 4.02Å; M81-L93 HydrophobicContact CG-CD1 3.84Å; L93-V95 HydrophobicContact CD2-CG2 3.87Å; L93-V95 HydrophobicContact CG-CG2 3.76Å
94	L	90.1	Very high	90.7	Very high	1 Å²	1	60 Å²	60	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	114.7	178.1	-26.6	176.8	0	0	0	108.6	V80 L82 R92 L113 W125 V134	V80-L94 HydrophobicContact CB-CB 4.04Å; V80-L94 HydrophobicContact CB-CD1 4.18Å; V80-L94 HydrophobicContact CB-CG 4.2Å; V80-L94 HydrophobicContact CG1-CD1 3.76Å; V80-L94 HydrophobicContact CG1-CG 4.2Å; V80-L94 PolarHBondContact N-O 3.35Å; V80-L94 PolarHBondContact O-N 3.29Å; L82-L94 HydrophobicContact CD1-CD1 4.15Å; L82-L94 HydrophobicContact CD1-CD2 4.04Å; L82-L94 HydrophobicContact CG-CD1 4.24Å; L82-L94 HydrophobicContact CG-CD2 4.47Å; R92-L94 HydrophobicContact CB-CD2 3.81Å; L94-L113 HydrophobicContact CD1-CD2 3.85Å; L94-W125 HydrophobicContact CB-CD2 3.76Å; L94-W125 HydrophobicContact CB-CE3 3.53Å; L94-W125 HydrophobicContact CB-CH2 3.85Å; L94-W125 HydrophobicContact CB-CZ2 4.06Å; L94-W125 HydrophobicContact CB-CZ3 3.57Å; L94-W125 HydrophobicContact CD1-CB 3.97Å; L94-W125 HydrophobicContact CD1-CD2 3.72Å; L94-W125 HydrophobicContact CD1-CE3 4.18Å; L94-W125 HydrophobicContact CD1-CG 3.6Å; L94-W125 HydrophobicContact CG-CD2 4.34Å; L94-W125 HydrophobicContact CG-CE3 4.36Å; L94-V134 HydrophobicContact CD2-CB 4.35Å; L94-V134 HydrophobicContact CD2-CG1 4.08Å; L94-V134 HydrophobicContact CD2-CG2 3.77Å
95	V	87.5	Confident	91	Very high	99 Å²	99	58.8 Å²	58.8	60%	0.6	31%	0.307	S	S	*	.			trans	-115.8	131.6	-176.2	-174	0	0	0	0	108.8	L93	L93-V95 HydrophobicContact CD2-CG2 3.87Å; L93-V95 HydrophobicContact CG-CG2 3.76Å
96	G	88.1	Confident	91.2	Very high	26 Å²	26	56 Å²	56	27%	0.268	29%	0.29	S	S	.	.			trans	174.2	-38.8	-179.8	0	0	0	0	0	113.2
97	H	93	Very high	91.3	Very high	14 Å²	14	47.5 Å²	47.5	7%	0.065	25%	0.252	C	S	.	.			trans	-61.6	143.7	176.3	-80.6	-56.9	0	0	0	112.8	I101 T115 S117 D119 H123	H97-I101 HydrophobicContact CB-CG1 4.44Å; H97-T115 PolarHBondContact CD2-OG1 2.5Å; H97-T115 PolarHBondContact NE2-O 2.04Å; H97-T115 PolarHBondContact NE2-OG1 3.4Å; H97-S117 WeakPolarHBondContact CE1-CB 3.4Å; H97-S117 WeakPolarHBondContact ND1-CB 3.25Å; H97-D119 WeakPolarHBondContact CA-OD2 3.34Å; H97-D119 WeakPolarHBondContact CB-OD2 3.49Å; H97-D119 IonicContact CG-OD2 3.81Å; H97-D119 IonicContact ND1-OD1 3.79Å; H97-D119 IonicContact ND1-OD2 2.68Å; H97-D119 PolarHBondContact ND1-OD2 3.02Å; H97-H123 AromaticContact CE1-CD2 3.75Å; H97-H123 AromaticContact CE1-CE1 3.87Å; H97-H123 AromaticContact CE1-CG 3.38Å; H97-H123 AromaticContact CE1-ND1 3.48Å; H97-H123 PolarHBondContact CE1-ND1 2.97Å; H97-H123 AromaticContact CG-CD2 3.99Å; H97-H123 AromaticContact ND1-CD2 3.76Å; H97-H123 AromaticContact ND1-CE1 3.75Å; H97-H123 AromaticContact ND1-CG 3.84Å; H97-H123 AromaticContact ND1-ND1 3.84Å; H97-H123 AromaticContact ND1-NE2 3.71Å; H97-H123 AromaticContact NE2-CD2 3.98Å; H97-H123 AromaticContact NE2-CG 3.68Å
98	R	94.6	Very high	91.3	Very high	209 Å²	209	46.1 Å²	46.1	79%	0.789	24%	0.241	S	C	*	.	S	Bend	trans	-94.3	-11.7	-179.6	-59.2	-177.1	-177.6	-162.8	2.2	112.5	K78 D119	K78-R98 WeakPolarHBondContact CD-O 3.37Å; K78-R98 WeakPolarHBondContact CE-O 3.38Å; K78-R98 PolarHBondContact NZ-O 3.16Å; R98-D119 HydrophobicContact CB-CB 3.99Å; R98-D119 PolarHBondContact N-OD2 2.98Å
99	D	96.3	Very high	91.3	Very high	57 Å²	57	48.4 Å²	48.4	31%	0.305	25%	0.248	S	C	.	.	S	Bend	trans	-144.8	-175.6	179	-144.3	-28.3	0	0	0	112.7	S117 W118 D119	D99-S117 PolarHBondContact O-OG 3.46Å; D99-W118 HydrophobicContact CB-CB 3.83Å; D99-D119 HydrophobicContact CB-CB 4.08Å
100	S	93.6	Very high	90.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.			trans	-56	134.9	-177.4	-174.5	0	0	0	0	111.6	G75 W76 Q102 S117 W118	G75-S100 WeakPolarHBondContact O-CA 3.46Å; G75-S100 PolarHBondContact O-OG 2.85Å; W76-S100 WeakPolarHBondContact CA-OG 3.47Å; W76-S100 PolarHBondContact N-OG 3.26Å; S100-Q102 PolarHBondContact OG-NE2 2.88Å; S100-S117 CarbonylContact O-C 3.57Å; S100-S117 VanDerWaalsContact O-CA 3.28Å; S100-S117 WeakPolarHBondContact O-CA 3.25Å; S100-S117 PolarHBondContact O-OG 3.33Å; S100-W118 PolarHBondContact O-N 3.27Å
101	I	95.6	Very high	90.8	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.9	168.3	-55.9	109.4	0	0	0	108.6	E60 T61 G75 R79 V80 H97 T115	E60-I101 WeakPolarHBondContact CB-O 3.26Å; T61-I101 HydrophobicContact CG2-CG2 3.78Å; G75-I101 PolarHBondContact O-N 3.31Å; G75-I101 VanDerWaalsContact O-N 3.09Å; R79-I101 VanDerWaalsContact C-CD1 3.42Å; R79-I101 VanDerWaalsContact O-CD1 3.25Å; R79-I101 WeakPolarHBondContact O-CD1 3.42Å; V80-I101 HydrophobicContact CG2-CD1 3.59Å; V80-I101 HydrophobicContact CG2-CG1 3.73Å; V80-I101 HydrophobicContact CG2-CG2 4.46Å; H97-I101 HydrophobicContact CB-CG1 4.44Å; I101-T115 HydrophobicContact CG2-CG2 4.48Å
102	Q	94.1	Very high	90.9	Very high	42 Å²	42	40.3 Å²	40.3	20%	0.196	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-24.6	-179.3	-70.6	-68.2	-64.8	0	0	113.6	S100 G116 W118	S100-Q102 PolarHBondContact OG-NE2 2.88Å; Q102-G116 PolarHBondContact N-O 2.82Å; Q102-W118 HydrophobicContact CG-CG 4.27Å
103	S	93.9	Very high	91.1	Very high	14 Å²	14	37.9 Å²	37.9	10%	0.098	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	143	-176.4	-168.1	0	0	0	0	109.6	T115 G116 L149	S103-T115 CarbonylContact O-C 3.57Å; S103-T115 WeakPolarHBondContact O-CA 3.46Å; S103-G116 PolarHBondContact N-O 2.81Å; S103-G116 PolarHBondContact O-N 2.94Å; S103-L149 PolarHBondContact OG-N 2.85Å
104	S	95.1	Very high	91.4	Very high	9 Å²	9	35.6 Å²	35.6	6%	0.063	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	146.3	172.2	61.2	0	0	0	0	109.4	T61 S63 A114	T61-S104 WeakPolarHBondContact CG2-OG 3.27Å; T61-S104 PolarHBondContact OG1-N 2.96Å; T61-S104 PolarHBondContact OG1-OG 3.22Å; S63-S104 PolarHBondContact OG-OG 3.2Å; S104-A114 CarbonylContact C-O 3.57Å; S104-A114 VanDerWaalsContact CA-O 3.22Å; S104-A114 WeakPolarHBondContact CA-O 3.32Å
105	D	95.4	Very high	91.7	Very high	13 Å²	13	35.5 Å²	35.5	7%	0.07	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	141.2	171	-161	19.4	0	0	0	110.4	A114 C150 Y151	D105-A114 PolarHBondContact N-O 2.91Å; D105-A114 PolarHBondContact O-N 2.98Å; D105-C150 WeakPolarHBondContact OD2-CA 3.43Å; D105-Y151 HydrophobicContact CB-CD2 4.08Å; D105-Y151 WeakPolarHBondContact O-CE2 3.02Å; D105-Y151 PolarHBondContact OD2-N 3.34Å
106	F	93.3	Very high	92.1	Very high	7 Å²	7	30.8 Å²	30.8	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	141.6	178	-82.7	-94.2	0	0	0	110.4	S63 F64 Q70 A72 L82 L113 L127 Y151	S63-F106 WeakPolarHBondContact O-CE2 3.09Å; F64-F106 VanDerWaalsContact C-CD2 3.41Å; F64-F106 VanDerWaalsContact O-CD2 3.27Å; F64-F106 WeakPolarHBondContact O-CD2 3.39Å; Q70-F106 HydrophobicContact CB-CZ 4.25Å; A72-F106 HydrophobicContact CB-CE2 3.56Å; A72-F106 HydrophobicContact CB-CZ 3.84Å; L82-F106 HydrophobicContact CD2-CE1 4.26Å; L82-F106 HydrophobicContact CD2-CZ 3.67Å; F106-L113 HydrophobicContact CD1-CD1 4.16Å; F106-L113 HydrophobicContact CD2-CD1 3.71Å; F106-L113 HydrophobicContact CE1-CD1 4.22Å; F106-L113 HydrophobicContact CE2-CD1 3.75Å; F106-L113 HydrophobicContact CG-CD1 3.93Å; F106-L113 HydrophobicContact CZ-CD1 4.02Å; F106-L127 HydrophobicContact CD1-CD1 4.12Å; F106-L127 HydrophobicContact CE1-CD1 3.54Å; F106-Y151 VanDerWaalsContact C-CD2 3.44Å; F106-Y151 VanDerWaalsContact O-CD2 3.31Å; F106-Y151 WeakPolarHBondContact O-CD2 3.44Å
107	S	92	Very high	92.6	Very high	10 Å²	10	29.6 Å²	29.6	7%	0.07	15%	0.151	C	C	.	.			trans	-58.2	145.4	166.9	169.3	0	0	0	0	110.1	P66 T109 V110 C112	P66-S107 VanDerWaalsContact CG-O 3.28Å; P66-S107 WeakPolarHBondContact CG-O 3.39Å; S107-T109 PolarHBondContact O-N 3.45Å; S107-T109 PolarHBondContact OG-N 2.99Å; S107-T109 PolarHBondContact OG-OG1 3.06Å; S107-V110 PolarHBondContact O-N 2.92Å; S107-C112 WeakPolarHBondContact CB-O 3.42Å; S107-C112 PolarHBondContact N-O 3.29Å
108	P	88.3	Confident	92.7	Very high	37 Å²	37	31.6 Å²	31.6	24%	0.24	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.7	175.3	24.2	-35.8	0	0	0	113.3	A153	P108-A153 WeakPolarHBondContact CG-O 3.34Å
109	T	84	Confident	92.8	Very high	84 Å²	84	23.2 Å²	23.2	52%	0.515	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.5	178.9	60	0	0	0	0	114.2	S107 N111	S107-T109 PolarHBondContact O-N 3.45Å; S107-T109 PolarHBondContact OG-N 2.99Å; S107-T109 PolarHBondContact OG-OG1 3.06Å; T109-N111 PolarHBondContact O-N 2.99Å; T109-N111 PolarHBondContact O-ND2 2.94Å
110	V	77.6	Confident	92.9	Very high	32 Å²	32	21.8 Å²	21.8	19%	0.194	12%	0.123	C	C	.	.	S	Bend	trans	65.1	-17.2	-176.7	-165.8	0	0	0	0	114.7	P66 D67 S107 C112	P66-V110 HydrophobicContact CB-CG2 3.92Å; P66-V110 HydrophobicContact CG-CG2 3.89Å; D67-V110 HydrophobicContact CB-CG2 4.4Å; S107-V110 PolarHBondContact O-N 2.92Å; V110-C112 VanDerWaalsContact C-N 3.3Å; V110-C112 PolarHBondContact O-N 3.2Å
111	N	86	Confident	93	Very high	66 Å²	66	22.8 Å²	22.8	35%	0.353	13%	0.13	S	C	.	.	S	Bend	trans	-71.6	-19.6	-172.5	-68.4	-35.1	0	0	0	114.9	T109 L127 R128	T109-N111 PolarHBondContact O-N 2.99Å; T109-N111 PolarHBondContact O-ND2 2.94Å; N111-L127 WeakPolarHBondContact O-CB 3.3Å; N111-L127 PolarHBondContact O-N 3.42Å; N111-R128 HydrophobicContact CB-CG 3.82Å; N111-R128 WeakPolarHBondContact OD1-CG 3.38Å
112	C	91.1	Very high	93.1	Very high	27 Å²	27	22.9 Å²	22.9	18%	0.182	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.5	-177.6	-53.9	0	0	0	0	111	S107 V110 I124 W125	S107-C112 WeakPolarHBondContact CB-O 3.42Å; S107-C112 PolarHBondContact N-O 3.29Å; V110-C112 VanDerWaalsContact C-N 3.3Å; V110-C112 PolarHBondContact O-N 3.2Å; C112-I124 HydrophobicContact CB-CG2 4.05Å; C112-W125 WeakPolarHBondContact CA-O 3.45Å
113	L	93.9	Very high	93.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.9	166.6	177.5	74.4	0	0	0	108.3	A72 V80 L82 L94 F106 T115 I124 W125 L127	A72-L113 HydrophobicContact CB-CD1 3.69Å; A72-L113 HydrophobicContact CB-CD2 3.65Å; A72-L113 HydrophobicContact CB-CG 4.34Å; V80-L113 HydrophobicContact CG1-CD2 3.76Å; L82-L113 HydrophobicContact CD2-CD2 4.3Å; L94-L113 HydrophobicContact CD1-CD2 3.85Å; F106-L113 HydrophobicContact CD1-CD1 4.16Å; F106-L113 HydrophobicContact CD2-CD1 3.71Å; F106-L113 HydrophobicContact CE1-CD1 4.22Å; F106-L113 HydrophobicContact CE2-CD1 3.75Å; F106-L113 HydrophobicContact CG-CD1 3.93Å; F106-L113 HydrophobicContact CZ-CD1 4.02Å; L113-T115 HydrophobicContact CD2-CG2 3.86Å; L113-T115 HydrophobicContact CG-CG2 4.02Å; L113-I124 CarbonylContact O-C 3.6Å; L113-I124 WeakPolarHBondContact O-CA 2.93Å; L113-W125 HydrophobicContact CB-CB 4.31Å; L113-W125 PolarHBondContact N-O 2.7Å; L113-W125 VanDerWaalsContact O-CD1 3.28Å; L113-W125 PolarHBondContact O-N 3.31Å; L113-L127 HydrophobicContact CB-CD1 4.07Å; L113-L127 HydrophobicContact CB-CD2 4.42Å; L113-L127 HydrophobicContact CB-CG 4.39Å
114	A	96	Very high	93.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	138	167.2	0	0	0	0	0	109.8	S104 D105 V122 H123 I124 L149 Y151 L157	S104-A114 CarbonylContact C-O 3.57Å; S104-A114 VanDerWaalsContact CA-O 3.22Å; S104-A114 WeakPolarHBondContact CA-O 3.32Å; D105-A114 PolarHBondContact N-O 2.91Å; D105-A114 PolarHBondContact O-N 2.98Å; A114-V122 HydrophobicContact CB-CG1 4.48Å; A114-H123 CarbonylContact C-O 3.54Å; A114-H123 VanDerWaalsContact CA-O 3.31Å; A114-H123 WeakPolarHBondContact CA-O 3.01Å; A114-I124 HydrophobicContact CB-CD1 3.67Å; A114-L149 HydrophobicContact CB-CD1 3.94Å; A114-Y151 HydrophobicContact CB-CD2 4.4Å; A114-Y151 HydrophobicContact CB-CE2 3.46Å; A114-Y151 VanDerWaalsContact CB-CE2 3.46Å; A114-L157 HydrophobicContact CB-CD1 3.87Å; A114-L157 HydrophobicContact CB-CD2 3.66Å; A114-L157 HydrophobicContact CB-CG 4.45Å
115	T	96.6	Very high	93.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138	172.8	58.3	0	0	0	0	111.5	V80 H97 I101 S103 L113 V122 H123 W125	V80-T115 HydrophobicContact CG1-CG2 4Å; V80-T115 HydrophobicContact CG2-CG2 3.84Å; H97-T115 PolarHBondContact CD2-OG1 2.5Å; H97-T115 PolarHBondContact NE2-O 2.04Å; H97-T115 PolarHBondContact NE2-OG1 3.4Å; I101-T115 HydrophobicContact CG2-CG2 4.48Å; S103-T115 CarbonylContact O-C 3.57Å; S103-T115 WeakPolarHBondContact O-CA 3.46Å; L113-T115 HydrophobicContact CD2-CG2 3.86Å; L113-T115 HydrophobicContact CG-CG2 4.02Å; T115-V122 CarbonylContact O-C 3.45Å; T115-V122 VanDerWaalsContact O-CA 3.26Å; T115-V122 WeakPolarHBondContact O-CA 3.28Å; T115-H123 PolarHBondContact N-O 3.49Å; T115-H123 PolarHBondContact O-N 3.47Å; T115-W125 PolarHBondContact OG1-NE1 2.97Å
116	G	96.3	Very high	92.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.3	-177.5	0	0	0	0	0	109.8	Q102 S103	Q102-G116 PolarHBondContact N-O 2.82Å; S103-G116 PolarHBondContact N-O 2.81Å; S103-G116 PolarHBondContact O-N 2.94Å
117	S	96.9	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	162.1	-170.2	170.2	0	0	0	0	113.1	H97 D99 S100 D119 S120 T121 I146	H97-S117 WeakPolarHBondContact CE1-CB 3.4Å; H97-S117 WeakPolarHBondContact ND1-CB 3.25Å; D99-S117 PolarHBondContact O-OG 3.46Å; S100-S117 CarbonylContact O-C 3.57Å; S100-S117 VanDerWaalsContact O-CA 3.28Å; S100-S117 WeakPolarHBondContact O-CA 3.25Å; S100-S117 PolarHBondContact O-OG 3.33Å; S117-D119 VanDerWaalsContact CB-CG 3.49Å; S117-D119 VanDerWaalsContact CB-OD1 3.25Å; S117-D119 WeakPolarHBondContact CB-OD1 3.41Å; S117-D119 WeakPolarHBondContact CB-OD2 3.17Å; S117-D119 PolarHBondContact O-N 2.9Å; S117-D119 PolarHBondContact OG-N 2.92Å; S117-D119 VanDerWaalsContact OG-N 3.11Å; S117-D119 PolarHBondContact OG-OD1 3.39Å; S117-D119 PolarHBondContact OG-OD2 3.15Å; S117-S120 PolarHBondContact O-N 3.01Å; S117-T121 PolarHBondContact N-O 3.2Å; S117-I146 PolarHBondContact O-N 2.94Å
118	W	96.9	Very high	92.2	Very high	56 Å²	56	29.1 Å²	29.1	21%	0.212	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-13.7	169.1	-79.8	16.3	0	0	0	113.5	W76 D99 S100 Q102 S120 N145 W162	W76-W118 HydrophobicContact CH2-CE3 4.29Å; W76-W118 AromaticContact CH2-CH2 3.19Å; W76-W118 HydrophobicContact CH2-CH2 3.19Å; W76-W118 HydrophobicContact CH2-CZ2 4.12Å; W76-W118 AromaticContact CH2-CZ3 3.3Å; W76-W118 HydrophobicContact CH2-CZ3 3.3Å; W76-W118 AromaticContact CZ2-CH2 3.61Å; W76-W118 HydrophobicContact CZ2-CH2 3.61Å; W76-W118 HydrophobicContact CZ2-CZ2 4.12Å; W76-W118 HydrophobicContact CZ2-CZ3 4.11Å; W76-W118 HydrophobicContact CZ3-CE3 4.3Å; W76-W118 AromaticContact CZ3-CH2 4Å; W76-W118 HydrophobicContact CZ3-CH2 4Å; W76-W118 AromaticContact CZ3-CZ3 3.61Å; W76-W118 HydrophobicContact CZ3-CZ3 3.61Å; D99-W118 HydrophobicContact CB-CB 3.83Å; S100-W118 PolarHBondContact O-N 3.27Å; Q102-W118 HydrophobicContact CG-CG 4.27Å; W118-S120 PolarHBondContact O-N 3.09Å; W118-S120 VanDerWaalsContact O-N 3.08Å; W118-N145 HydrophobicContact CB-CB 4.44Å; W118-N145 HydrophobicContact CG-CB 4.16Å; W118-N145 PolarHBondContact O-OD1 2.88Å; W118-W162 HydrophobicContact CZ2-CH2 4.2Å; W118-W162 HydrophobicContact CZ2-CZ2 4.4Å
119	D	96.4	Very high	91.3	Very high	33 Å²	33	31.7 Å²	31.7	18%	0.176	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	7.2	170.2	62.7	30.9	0	0	0	113.9	H97 R98 D99 S117 T121	H97-D119 WeakPolarHBondContact CA-OD2 3.34Å; H97-D119 WeakPolarHBondContact CB-OD2 3.49Å; H97-D119 IonicContact CG-OD2 3.81Å; H97-D119 IonicContact ND1-OD1 3.79Å; H97-D119 IonicContact ND1-OD2 2.68Å; H97-D119 PolarHBondContact ND1-OD2 3.02Å; R98-D119 HydrophobicContact CB-CB 3.99Å; R98-D119 PolarHBondContact N-OD2 2.98Å; D99-D119 HydrophobicContact CB-CB 4.08Å; S117-D119 VanDerWaalsContact CB-CG 3.49Å; S117-D119 VanDerWaalsContact CB-OD1 3.25Å; S117-D119 WeakPolarHBondContact CB-OD1 3.41Å; S117-D119 WeakPolarHBondContact CB-OD2 3.17Å; S117-D119 PolarHBondContact O-N 2.9Å; S117-D119 PolarHBondContact OG-N 2.92Å; S117-D119 VanDerWaalsContact OG-N 3.11Å; S117-D119 PolarHBondContact OG-OD1 3.39Å; S117-D119 PolarHBondContact OG-OD2 3.15Å; D119-T121 PolarHBondContact O-N 2.94Å; D119-T121 WeakPolarHBondContact OD1-CA 3.36Å; D119-T121 WeakPolarHBondContact OD1-CB 3.19Å; D119-T121 PolarHBondContact OD1-N 3.35Å; D119-T121 PolarHBondContact OD1-OG1 2.6Å
120	S	96.9	Very high	90.2	Very high	27 Å²	27	34.6 Å²	34.6	19%	0.189	18%	0.177	C	C	.	.	S	Bend	trans	67.7	10	-179.3	-47.5	0	0	0	0	114.8	S117 W118 A144	S117-S120 PolarHBondContact O-N 3.01Å; W118-S120 PolarHBondContact O-N 3.09Å; W118-S120 VanDerWaalsContact O-N 3.08Å; S120-A144 WeakPolarHBondContact CB-O 3.16Å; S120-A144 VanDerWaalsContact OG-CA 3.23Å; S120-A144 WeakPolarHBondContact OG-CA 3.41Å; S120-A144 PolarHBondContact OG-O 2.78Å
121	T	96.6	Very high	89.2	Confident	22 Å²	22	36.6 Å²	36.6	14%	0.135	19%	0.19	C	C	.	.			trans	-110.8	156	177.8	74.2	0	0	0	0	112	S117 D119 H123 E140 I146	S117-T121 PolarHBondContact N-O 3.2Å; D119-T121 PolarHBondContact O-N 2.94Å; D119-T121 WeakPolarHBondContact OD1-CA 3.36Å; D119-T121 WeakPolarHBondContact OD1-CB 3.19Å; D119-T121 PolarHBondContact OD1-N 3.35Å; D119-T121 PolarHBondContact OD1-OG1 2.6Å; T121-H123 PolarHBondContact OG1-CE1 3.43Å; T121-H123 PolarHBondContact OG1-ND1 3.37Å; T121-E140 HydrophobicContact CG2-CG 4.29Å; T121-I146 WeakPolarHBondContact O-CG1 3.47Å
122	V	97.4	Very high	87.7	Confident	1 Å²	1	40 Å²	40	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.3	165.7	179.2	0	0	0	0	107.8	A114 T115 I124 A138 L139 I146 L149 L157	A114-V122 HydrophobicContact CB-CG1 4.48Å; T115-V122 CarbonylContact O-C 3.45Å; T115-V122 VanDerWaalsContact O-CA 3.26Å; T115-V122 WeakPolarHBondContact O-CA 3.28Å; V122-I124 HydrophobicContact CG1-CD1 4.14Å; V122-A138 CarbonylContact O-C 3.55Å; V122-A138 WeakPolarHBondContact O-CA 3.44Å; V122-L139 HydrophobicContact CB-CB 4.18Å; V122-L139 HydrophobicContact CB-CD1 4.41Å; V122-L139 HydrophobicContact CG1-CD1 4.28Å; V122-L139 PolarHBondContact N-O 3.45Å; V122-L139 PolarHBondContact O-N 3.1Å; V122-I146 HydrophobicContact CG2-CD1 4.16Å; V122-I146 HydrophobicContact CG2-CG1 3.96Å; V122-I146 HydrophobicContact CG2-CG2 4.21Å; V122-L149 HydrophobicContact CG1-CD1 4.04Å; V122-L149 HydrophobicContact CG1-CD2 4.05Å; V122-L149 HydrophobicContact CG2-CD2 3.81Å; V122-L157 HydrophobicContact CG1-CD2 3.82Å
123	H	95.7	Very high	85.9	Confident	9 Å²	9	42.3 Å²	42.3	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	133.4	172.7	-72.6	13.6	0	0	0	110.2	H97 A114 T115 T121 W125 H136 Q137	H97-H123 AromaticContact CE1-CD2 3.75Å; H97-H123 AromaticContact CE1-CE1 3.87Å; H97-H123 AromaticContact CE1-CG 3.38Å; H97-H123 AromaticContact CE1-ND1 3.48Å; H97-H123 PolarHBondContact CE1-ND1 2.97Å; H97-H123 AromaticContact CG-CD2 3.99Å; H97-H123 AromaticContact ND1-CD2 3.76Å; H97-H123 AromaticContact ND1-CE1 3.75Å; H97-H123 AromaticContact ND1-CG 3.84Å; H97-H123 AromaticContact ND1-ND1 3.84Å; H97-H123 AromaticContact ND1-NE2 3.71Å; H97-H123 AromaticContact NE2-CD2 3.98Å; H97-H123 AromaticContact NE2-CG 3.68Å; A114-H123 CarbonylContact C-O 3.54Å; A114-H123 VanDerWaalsContact CA-O 3.31Å; A114-H123 WeakPolarHBondContact CA-O 3.01Å; T115-H123 PolarHBondContact N-O 3.49Å; T115-H123 PolarHBondContact O-N 3.47Å; T121-H123 PolarHBondContact OG1-CE1 3.43Å; T121-H123 PolarHBondContact OG1-ND1 3.37Å; H123-W125 HydrophobicContact CB-CZ2 3.89Å; H123-W125 AromaticContact CD2-CZ2 3.81Å; H123-H136 AromaticContact CD2-CD2 3.22Å; H123-H136 PolarHBondContact CD2-CD2 3.25Å; H123-H136 AromaticContact CD2-CG 3.96Å; H123-H136 AromaticContact CD2-NE2 3.61Å; H123-H136 AromaticContact CG-CD2 3.72Å; H123-H136 AromaticContact NE2-CD2 3.55Å; H123-H136 AromaticContact NE2-NE2 3.5Å; H123-H136 PolarHBondContact NE2-NE2 2.87Å; H123-Q137 WeakPolarHBondContact CA-O 3.26Å
124	I	95.4	Very high	84.3	Confident	14 Å²	14	43.6 Å²	43.6	7%	0.072	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.4	171	-49.2	-58.2	0	0	0	107.7	C112 L113 A114 V122 H136 Q137 L139 L157 P171	C112-I124 HydrophobicContact CB-CG2 4.05Å; L113-I124 CarbonylContact O-C 3.6Å; L113-I124 WeakPolarHBondContact O-CA 2.93Å; A114-I124 HydrophobicContact CB-CD1 3.67Å; V122-I124 HydrophobicContact CG1-CD1 4.14Å; I124-H136 VanDerWaalsContact O-CA 3.25Å; I124-H136 WeakPolarHBondContact O-CA 3.29Å; I124-Q137 PolarHBondContact N-O 2.88Å; I124-Q137 PolarHBondContact O-N 3.35Å; I124-L139 HydrophobicContact CD1-CD1 3.95Å; I124-L139 HydrophobicContact CG1-CD1 3.92Å; I124-L139 HydrophobicContact CG1-CG 4.1Å; I124-L157 HydrophobicContact CD1-CD2 3.54Å; I124-P171 HydrophobicContact CD1-CB 4.34Å; I124-P171 HydrophobicContact CD1-CG 4.49Å; I124-P171 HydrophobicContact CG1-CB 4.25Å; I124-P171 HydrophobicContact CG2-CB 4.41Å
125	W	93.1	Very high	82.9	Confident	1 Å²	1	46.3 Å²	46.3	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.9	179.6	-51.1	91.6	0	0	0	109.5	V80 L94 C112 L113 T115 H123 L127 V134 H136	V80-W125 HydrophobicContact CG2-CZ2 4.46Å; L94-W125 HydrophobicContact CB-CD2 3.76Å; L94-W125 HydrophobicContact CB-CE3 3.53Å; L94-W125 HydrophobicContact CB-CH2 3.85Å; L94-W125 HydrophobicContact CB-CZ2 4.06Å; L94-W125 HydrophobicContact CB-CZ3 3.57Å; L94-W125 HydrophobicContact CD1-CB 3.97Å; L94-W125 HydrophobicContact CD1-CD2 3.72Å; L94-W125 HydrophobicContact CD1-CE3 4.18Å; L94-W125 HydrophobicContact CD1-CG 3.6Å; L94-W125 HydrophobicContact CG-CD2 4.34Å; L94-W125 HydrophobicContact CG-CE3 4.36Å; C112-W125 WeakPolarHBondContact CA-O 3.45Å; L113-W125 HydrophobicContact CB-CB 4.31Å; L113-W125 PolarHBondContact N-O 2.7Å; L113-W125 VanDerWaalsContact O-CD1 3.28Å; L113-W125 PolarHBondContact O-N 3.31Å; T115-W125 PolarHBondContact OG1-NE1 2.97Å; H123-W125 HydrophobicContact CB-CZ2 3.89Å; H123-W125 AromaticContact CD2-CZ2 3.81Å; W125-L127 HydrophobicContact CB-CD2 4.05Å; W125-L127 PolarHBondContact O-N 3.41Å; W125-V134 HydrophobicContact CB-CG1 4.3Å; W125-V134 HydrophobicContact CE3-CB 4.32Å; W125-V134 HydrophobicContact CE3-CG1 3.68Å; W125-V134 HydrophobicContact CZ3-CG1 4.47Å; W125-H136 HydrophobicContact CD2-CB 3.97Å; W125-H136 HydrophobicContact CE3-CB 3.45Å; W125-H136 VanDerWaalsContact CE3-CB 3.45Å; W125-H136 HydrophobicContact CH2-CB 4.21Å; W125-H136 HydrophobicContact CZ3-CB 3.6Å; W125-H136 AromaticContact CZ3-CG 3.82Å; W125-H136 AromaticContact CZ3-ND1 3.79Å
126	D	90.4	Very high	82.1	Confident	28 Å²	28	50 Å²	50	15%	0.15	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	116.6	171	-168.2	-18.3	0	0	0	109.7	R128 S135	D126-R128 VanDerWaalsContact OD1-CB 3.24Å; D126-R128 WeakPolarHBondContact OD1-CB 3.43Å; D126-R128 WeakPolarHBondContact OD1-CG 3.12Å; D126-R128 IonicContact OD1-CZ 3.81Å; D126-R128 PolarHBondContact OD1-N 2.91Å; D126-R128 IonicContact OD1-NE 2.93Å; D126-R128 PolarHBondContact OD1-NE 2.81Å; D126-R128 IonicContact OD1-NH2 3.31Å; D126-R128 IonicContact OD2-CZ 3.35Å; D126-R128 IonicContact OD2-NE 3.22Å; D126-R128 PolarHBondContact OD2-NE 3.05Å; D126-R128 IonicContact OD2-NH2 3.79Å; D126-R128 PolarHBondContact OD2-NH2 2.82Å; D126-S135 PolarHBondContact N-O 3.37Å
127	L	87.7	Confident	81.7	Confident	16 Å²	16	54.5 Å²	54.5	8%	0.084	30%	0.301	C	S	.	.			trans	-92.5	-5.7	-176.2	-59.4	-165.9	0	0	0	113.1	L82 R92 F106 N111 L113 W125	L82-L127 HydrophobicContact CD1-CD1 4.05Å; L82-L127 HydrophobicContact CD1-CD2 3.55Å; L82-L127 HydrophobicContact CD1-CG 4.42Å; R92-L127 PolarHBondContact NH1-O 3.04Å; R92-L127 VanDerWaalsContact NH2-CB 3.34Å; R92-L127 PolarHBondContact NH2-O 2.87Å; R92-L127 VanDerWaalsContact NH2-O 3.1Å; F106-L127 HydrophobicContact CD1-CD1 4.12Å; F106-L127 HydrophobicContact CE1-CD1 3.54Å; N111-L127 WeakPolarHBondContact O-CB 3.3Å; N111-L127 PolarHBondContact O-N 3.42Å; L113-L127 HydrophobicContact CB-CD1 4.07Å; L113-L127 HydrophobicContact CB-CD2 4.42Å; L113-L127 HydrophobicContact CB-CG 4.39Å; W125-L127 HydrophobicContact CB-CD2 4.05Å; W125-L127 PolarHBondContact O-N 3.41Å
128	R	82.5	Confident	81.5	Confident	158 Å²	158	56.4 Å²	56.4	60%	0.596	32%	0.317	S	S	*	.	S	Bend	trans	-74.5	-28.3	-180	-60.3	172.9	-69	179.3	1.7	112.4	N111 D126	N111-R128 HydrophobicContact CB-CG 3.82Å; N111-R128 WeakPolarHBondContact OD1-CG 3.38Å; D126-R128 VanDerWaalsContact OD1-CB 3.24Å; D126-R128 WeakPolarHBondContact OD1-CB 3.43Å; D126-R128 WeakPolarHBondContact OD1-CG 3.12Å; D126-R128 IonicContact OD1-CZ 3.81Å; D126-R128 PolarHBondContact OD1-N 2.91Å; D126-R128 IonicContact OD1-NE 2.93Å; D126-R128 PolarHBondContact OD1-NE 2.81Å; D126-R128 IonicContact OD1-NH2 3.31Å; D126-R128 IonicContact OD2-CZ 3.35Å; D126-R128 IonicContact OD2-NE 3.22Å; D126-R128 PolarHBondContact OD2-NE 3.05Å; D126-R128 IonicContact OD2-NH2 3.79Å; D126-R128 PolarHBondContact OD2-NH2 2.82Å
129	M	68.8	Low	81.4	Confident	92 Å²	92	54 Å²	54	45%	0.453	31%	0.308	S	S	.	.			trans	-78.1	126	-179.2	-57.5	-163.4	86.1	0	0	110.2	R92 T131	R92-M129 PolarHBondContact NH1-O 3.42Å; M129-T131 VanDerWaalsContact C-N 3.3Å
130	V	60.9	Low	81.3	Confident	144 Å²	144	59.6 Å²	59.6	87%	0.873	33%	0.333	S	S	*	.			trans	-86.5	-6.3	178.2	-175	0	0	0	0	111.2
131	T	58.2	Low	81.2	Confident	75 Å²	75	60.6 Å²	60.6	46%	0.46	35%	0.347	S	S	.	.	S	Bend	trans	-75.7	146.7	179.2	44.2	0	0	0	0	112.3	M129 A133	M129-T131 VanDerWaalsContact C-N 3.3Å; T131-A133 PolarHBondContact O-N 2.83Å; T131-A133 VanDerWaalsContact O-N 3.14Å
132	P	54.2	Low	81.2	Confident	138 Å²	138	60.3 Å²	60.3	90%	0.896	35%	0.345	S	S	*	.	S	Bend	trans	-66.7	-16.8	-174.2	24.8	-33.5	0	0	0	114.1	V134	P132-V134 PolarHBondContact O-N 2.88Å
133	A	52.3	Low	81.2	Confident	75 Å²	75	65.2 Å²	65.2	62%	0.62	38%	0.379	S	S	*	.	S	Bend	trans	-82.8	96.1	167.6	0	0	0	0	0	108.7	T131 S135	T131-A133 PolarHBondContact O-N 2.83Å; T131-A133 VanDerWaalsContact O-N 3.14Å; A133-S135 PolarHBondContact O-N 3.46Å; A133-S135 VanDerWaalsContact O-N 3.15Å
134	V	61.5	Low	81.3	Confident	26 Å²	26	65.8 Å²	65.8	16%	0.158	39%	0.385	C	S	.	.			trans	-70.9	109.8	170.7	-171.7	0	0	0	0	107.3	L94 W125 P132 H136	L94-V134 HydrophobicContact CD2-CB 4.35Å; L94-V134 HydrophobicContact CD2-CG1 4.08Å; L94-V134 HydrophobicContact CD2-CG2 3.77Å; W125-V134 HydrophobicContact CB-CG1 4.3Å; W125-V134 HydrophobicContact CE3-CB 4.32Å; W125-V134 HydrophobicContact CE3-CG1 3.68Å; W125-V134 HydrophobicContact CZ3-CG1 4.47Å; P132-V134 PolarHBondContact O-N 2.88Å; V134-H136 PolarHBondContact O-N 2.89Å
135	S	66.2	Low	81.3	Confident	57 Å²	57	66.7 Å²	66.7	40%	0.399	39%	0.39	S	S	.	.			trans	-67.1	128.1	169.7	52.1	0	0	0	0	108.4	D126 A133	D126-S135 PolarHBondContact N-O 3.37Å; A133-S135 PolarHBondContact O-N 3.46Å; A133-S135 VanDerWaalsContact O-N 3.15Å
136	H	79.6	Confident	81.5	Confident	78 Å²	78	66.6 Å²	66.6	36%	0.361	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.8	172.1	72.1	-86.8	0	0	0	109.6	H123 I124 W125 V134	H123-H136 AromaticContact CD2-CD2 3.22Å; H123-H136 PolarHBondContact CD2-CD2 3.25Å; H123-H136 AromaticContact CD2-CG 3.96Å; H123-H136 AromaticContact CD2-NE2 3.61Å; H123-H136 AromaticContact CG-CD2 3.72Å; H123-H136 AromaticContact NE2-CD2 3.55Å; H123-H136 AromaticContact NE2-NE2 3.5Å; H123-H136 PolarHBondContact NE2-NE2 2.87Å; I124-H136 VanDerWaalsContact O-CA 3.25Å; I124-H136 WeakPolarHBondContact O-CA 3.29Å; W125-H136 HydrophobicContact CD2-CB 3.97Å; W125-H136 HydrophobicContact CE3-CB 3.45Å; W125-H136 VanDerWaalsContact CE3-CB 3.45Å; W125-H136 HydrophobicContact CH2-CB 4.21Å; W125-H136 HydrophobicContact CZ3-CB 3.6Å; W125-H136 AromaticContact CZ3-CG 3.82Å; W125-H136 AromaticContact CZ3-ND1 3.79Å; V134-H136 PolarHBondContact O-N 2.89Å
137	Q	88.6	Confident	81.7	Confident	95 Å²	95	66.2 Å²	66.2	44%	0.444	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.7	171.1	-170.9	162.3	21.4	0	0	109.2	H123 I124 S174	H123-Q137 WeakPolarHBondContact CA-O 3.26Å; I124-Q137 PolarHBondContact N-O 2.88Å; I124-Q137 PolarHBondContact O-N 3.35Å; Q137-S174 WeakPolarHBondContact CG-OG 3.33Å; Q137-S174 PolarHBondContact NE2-OG 3.27Å; Q137-S174 PolarHBondContact OE1-OG 2.77Å
138	A	92.4	Very high	82	Confident	39 Å²	39	65.7 Å²	65.7	32%	0.322	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127.5	173.2	0	0	0	0	0	109.8	V122	V122-A138 CarbonylContact O-C 3.55Å; V122-A138 WeakPolarHBondContact O-CA 3.44Å
139	L	94.6	Very high	82.6	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	113.3	167	-49.7	178.9	0	0	0	107.5	V122 I124 L157 W169 S174	V122-L139 HydrophobicContact CB-CB 4.18Å; V122-L139 HydrophobicContact CB-CD1 4.41Å; V122-L139 HydrophobicContact CG1-CD1 4.28Å; V122-L139 PolarHBondContact N-O 3.45Å; V122-L139 PolarHBondContact O-N 3.1Å; I124-L139 HydrophobicContact CD1-CD1 3.95Å; I124-L139 HydrophobicContact CG1-CD1 3.92Å; I124-L139 HydrophobicContact CG1-CG 4.1Å; L139-L157 HydrophobicContact CD1-CD2 4.21Å; L139-W169 HydrophobicContact CB-CD2 4.26Å; L139-W169 HydrophobicContact CB-CE3 4.01Å; L139-W169 HydrophobicContact CB-CH2 4.35Å; L139-W169 HydrophobicContact CB-CZ3 4.04Å; L139-W169 HydrophobicContact CD1-CB 3.96Å; L139-W169 HydrophobicContact CD1-CD2 3.94Å; L139-W169 HydrophobicContact CD1-CE3 4.19Å; L139-W169 HydrophobicContact CD1-CG 3.83Å; L139-S174 VanDerWaalsContact CD2-CB 3.48Å; L139-S174 VanDerWaalsContact CD2-OG 3.3Å; L139-S174 WeakPolarHBondContact CD2-OG 3.46Å
140	E	94.7	Very high	83.9	Confident	151 Å²	151	53.8 Å²	53.8	71%	0.706	34%	0.337	S	S	*	.			trans	-104.7	146.5	179.4	-61.9	-176	176.9	0	0	110.1	T121 W169	T121-E140 HydrophobicContact CG2-CG 4.29Å; E140-W169 WeakPolarHBondContact O-CH2 3.32Å
141	G	93.8	Very high	85.5	Confident	47 Å²	47	47.6 Å²	47.6	49%	0.485	30%	0.298	S	S	.	.			trans	155.5	-26.7	176.8	0	0	0	0	0	114.1
142	H	97.3	Very high	87.1	Confident	17 Å²	17	44.2 Å²	44.2	8%	0.079	28%	0.277	C	S	.	.			trans	-72	146.3	169.6	-82.2	-66.9	0	0	0	111.4	I146 S159 S161 D163 T165 H167	H142-I146 HydrophobicContact CB-CD1 3.65Å; H142-I146 WeakPolarHBondContact CD2-CD1 3.45Å; H142-S159 PolarHBondContact CD2-OG 2.87Å; H142-S159 PolarHBondContact NE2-O 2.94Å; H142-S159 PolarHBondContact NE2-OG 3.45Å; H142-S161 WeakPolarHBondContact CE1-CB 3.47Å; H142-S161 WeakPolarHBondContact ND1-CB 3.25Å; H142-D163 WeakPolarHBondContact CA-OD2 3.41Å; H142-D163 IonicContact CE1-OD1 3.79Å; H142-D163 IonicContact CE1-OD2 3.67Å; H142-D163 IonicContact CG-OD2 3.13Å; H142-D163 IonicContact ND1-OD1 3.11Å; H142-D163 PolarHBondContact ND1-OD1 3.29Å; H142-D163 IonicContact ND1-OD2 3.58Å; H142-D163 PolarHBondContact ND1-OD2 2.85Å; H142-T165 PolarHBondContact CE1-OG1 3.16Å; H142-T165 PolarHBondContact ND1-OG1 2.72Å; H142-H167 AromaticContact CE1-CE1 3.54Å; H142-H167 AromaticContact CE1-CG 3.74Å; H142-H167 AromaticContact CE1-ND1 3.04Å; H142-H167 PolarHBondContact CE1-ND1 3.09Å; H142-H167 AromaticContact ND1-CE1 3.51Å; H142-H167 AromaticContact ND1-ND1 3.51Å; H142-H167 AromaticContact NE2-CG 3.61Å; H142-H167 AromaticContact NE2-ND1 3.4Å; H142-H167 PolarHBondContact NE2-ND1 3.04Å
143	S	97	Very high	88.8	Confident	103 Å²	103	39.9 Å²	39.9	72%	0.72	25%	0.253	S	S	*	.	S	Bend	trans	-102.8	0.3	-179.9	58.5	0	0	0	0	113.7	D163	S143-D163 PolarHBondContact N-OD2 3.14Å; S143-D163 WeakPolarHBondContact OG-CB 3.39Å
144	A	97.3	Very high	90.6	Very high	22 Å²	22	39.8 Å²	39.8	18%	0.182	25%	0.248	C	C	.	.	S	Bend	trans	-153.5	176.2	175.6	0	0	0	0	0	110.9	S120 S161 W162 D163	S120-A144 WeakPolarHBondContact CB-O 3.16Å; S120-A144 VanDerWaalsContact OG-CA 3.23Å; S120-A144 WeakPolarHBondContact OG-CA 3.41Å; S120-A144 PolarHBondContact OG-O 2.78Å; A144-S161 PolarHBondContact O-OG 2.87Å; A144-W162 HydrophobicContact CB-CB 4.01Å; A144-D163 HydrophobicContact CB-CB 4Å
145	N	96.4	Very high	92	Very high	32 Å²	32	39.5 Å²	39.5	17%	0.171	25%	0.25	C	S	.	.			trans	-45.7	134.5	-173.9	-55.1	28.1	0	0	0	113.3	W118 S161 W162	W118-N145 HydrophobicContact CB-CB 4.44Å; W118-N145 HydrophobicContact CG-CB 4.16Å; W118-N145 PolarHBondContact O-OD1 2.88Å; N145-S161 VanDerWaalsContact O-CA 3.26Å; N145-S161 WeakPolarHBondContact O-CA 3.4Å; N145-S161 WeakPolarHBondContact O-CB 3.42Å; N145-S161 PolarHBondContact O-OG 3.04Å; N145-W162 HydrophobicContact CB-CB 4.43Å; N145-W162 HydrophobicContact CB-CD2 4.07Å; N145-W162 HydrophobicContact CB-CE3 4.36Å; N145-W162 HydrophobicContact CB-CG 4.1Å; N145-W162 PolarHBondContact O-N 3.24Å
146	I	97.4	Very high	93.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.8	170.1	-49.8	-55.4	0	0	0	108.5	S117 T121 V122 H142 L149	S117-I146 PolarHBondContact O-N 2.94Å; T121-I146 WeakPolarHBondContact O-CG1 3.47Å; V122-I146 HydrophobicContact CG2-CD1 4.16Å; V122-I146 HydrophobicContact CG2-CG1 3.96Å; V122-I146 HydrophobicContact CG2-CG2 4.21Å; H142-I146 HydrophobicContact CB-CD1 3.65Å; H142-I146 WeakPolarHBondContact CD2-CD1 3.45Å; I146-L149 HydrophobicContact CG2-CD2 3.94Å; I146-L149 HydrophobicContact CG2-CG 4.28Å
147	S	94.3	Very high	94.1	Very high	20 Å²	20	35.1 Å²	35.1	14%	0.14	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-29.5	-176.9	57	0	0	0	0	113.6	G160 V187	S147-G160 PolarHBondContact N-O 2.83Å; S147-G160 PolarHBondContact OG-O 2.9Å; S147-V187 WeakPolarHBondContact CB-O 3.31Å; S147-V187 PolarHBondContact OG-O 3.3Å
148	C	93.8	Very high	94.6	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	143.9	-174.7	54.9	0	0	0	0	110.8	S159 G160 K188 I190	C148-S159 WeakPolarHBondContact O-CA 3.47Å; C148-G160 PolarHBondContact N-O 2.96Å; C148-G160 PolarHBondContact O-N 2.94Å; C148-K188 WeakPolarHBondContact CB-O 3.37Å; C148-I190 HydrophobicContact CB-CG1 4.29Å
149	L	96.1	Very high	94.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153	174.8	-68.6	-178.2	0	0	0	110.4	C25 S103 A114 V122 I146 L157 A158 S159	C25-L149 WeakPolarHBondContact CB-O 3.3Å; S103-L149 PolarHBondContact OG-N 2.85Å; A114-L149 HydrophobicContact CB-CD1 3.94Å; V122-L149 HydrophobicContact CG1-CD1 4.04Å; V122-L149 HydrophobicContact CG1-CD2 4.05Å; V122-L149 HydrophobicContact CG2-CD2 3.81Å; I146-L149 HydrophobicContact CG2-CD2 3.94Å; I146-L149 HydrophobicContact CG2-CG 4.28Å; L149-L157 HydrophobicContact CB-CD1 4.35Å; L149-L157 HydrophobicContact CD2-CD1 4.45Å; L149-A158 CarbonylContact C-O 3.53Å; L149-A158 WeakPolarHBondContact CA-O 3.33Å; L149-S159 VanDerWaalsContact CD2-CB 3.43Å
150	C	94.6	Very high	94.9	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	128.3	171.2	-141.4	0	0	0	0	112.4	C25 D105 A158 I190 F192	C25-C150 HydrophobicContact CB-CB 3.82Å; C25-C150 WeakPolarHBondContact CB-SG 3.32Å; C25-C150 WeakPolarHBondContact SG-CB 3.1Å; C25-C150 CovalentContact SG-SG 2.04Å; C25-C150 PolarHBondContact SG-SG 3.5Å; D105-C150 WeakPolarHBondContact OD2-CA 3.43Å; C150-A158 PolarHBondContact N-O 2.84Å; C150-A158 PolarHBondContact O-N 2.78Å; C150-I190 HydrophobicContact CB-CD1 3.99Å; C150-I190 HydrophobicContact CB-CG1 4.02Å; C150-F192 WeakPolarHBondContact O-CE2 3.35Å
151	Y	94.4	Very high	95	Very high	14 Å²	14	21.2 Å²	21.2	6%	0.055	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	140.9	167.9	-87.6	-76.6	0	0	0	111.6	D105 F106 A114 L156 L157 P171	D105-Y151 HydrophobicContact CB-CD2 4.08Å; D105-Y151 WeakPolarHBondContact O-CE2 3.02Å; D105-Y151 PolarHBondContact OD2-N 3.34Å; F106-Y151 VanDerWaalsContact C-CD2 3.44Å; F106-Y151 VanDerWaalsContact O-CD2 3.31Å; F106-Y151 WeakPolarHBondContact O-CD2 3.44Å; A114-Y151 HydrophobicContact CB-CD2 4.4Å; A114-Y151 HydrophobicContact CB-CE2 3.46Å; A114-Y151 VanDerWaalsContact CB-CE2 3.46Å; Y151-L156 CarbonylContact C-O 3.55Å; Y151-L156 WeakPolarHBondContact CA-O 3.18Å; Y151-L156 WeakPolarHBondContact CD1-O 3.25Å; Y151-L157 HydrophobicContact CD1-CB 4.29Å; Y151-L157 HydrophobicContact CD1-CD1 4.3Å; Y151-L157 HydrophobicContact CD2-CD1 3.9Å; Y151-L157 HydrophobicContact CE1-CB 4.08Å; Y151-L157 HydrophobicContact CE1-CD1 4.33Å; Y151-L157 HydrophobicContact CE2-CD1 3.93Å; Y151-L157 HydrophobicContact CG-CD1 4.1Å; Y151-P171 HydrophobicContact CE1-CG 3.98Å
152	S	92.8	Very high	95.1	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.021	14%	0.143	C	C	.	.			trans	-80.7	167.6	162.1	77.3	0	0	0	0	110.5	S154 G155 L156 E196	S152-S154 VanDerWaalsContact C-N 3.28Å; S152-S154 PolarHBondContact O-N 2.89Å; S152-S154 PolarHBondContact OG-N 3.35Å; S152-S154 PolarHBondContact OG-OG 2.73Å; S152-G155 PolarHBondContact O-N 2.89Å; S152-G155 VanDerWaalsContact O-N 3.16Å; S152-G155 PolarHBondContact OG-N 2.92Å; S152-L156 PolarHBondContact N-O 3.34Å; S152-L156 WeakPolarHBondContact OG-CB 3.44Å; S152-L156 PolarHBondContact OG-N 3.44Å; S152-L156 PolarHBondContact OG-O 2.94Å; S152-E196 VanDerWaalsContact CB-OE1 3.29Å; S152-E196 WeakPolarHBondContact CB-OE1 3.22Å; S152-E196 PolarHBondContact OG-OE1 3.18Å
153	A	89.3	Confident	95.1	Very high	47 Å²	47	22.7 Å²	22.7	39%	0.388	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.5	176.3	0	0	0	0	0	112.4	V21 P108 G155 E196	V21-A153 HydrophobicContact CB-CB 3.99Å; P108-A153 WeakPolarHBondContact CG-O 3.34Å; A153-G155 VanDerWaalsContact C-N 3.28Å; A153-E196 VanDerWaalsContact CA-OE1 3.29Å; A153-E196 WeakPolarHBondContact CA-OE1 3.26Å; A153-E196 VanDerWaalsContact CB-OE1 3.32Å; A153-E196 WeakPolarHBondContact CB-OE1 3.49Å; A153-E196 PolarHBondContact N-OE1 2.78Å
154	S	89.9	Confident	95	Very high	74 Å²	74	22.4 Å²	22.4	52%	0.517	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-9.1	173.9	57.8	0	0	0	0	114.1	S152 E196	S152-S154 VanDerWaalsContact C-N 3.28Å; S152-S154 PolarHBondContact O-N 2.89Å; S152-S154 PolarHBondContact OG-N 3.35Å; S152-S154 PolarHBondContact OG-OG 2.73Å; S154-E196 WeakPolarHBondContact CB-OE2 3.32Å; S154-E196 PolarHBondContact N-OE1 3.35Å; S154-E196 PolarHBondContact OG-OE1 3.4Å; S154-E196 VanDerWaalsContact OG-OE1 3.14Å; S154-E196 PolarHBondContact OG-OE2 3.33Å
155	G	91.5	Very high	95	Very high	19 Å²	19	22 Å²	22	20%	0.196	13%	0.126	C	C	.	.	S	Bend	trans	90.4	14.5	178.2	0	0	0	0	0	115	S152 A153 P171	S152-G155 PolarHBondContact O-N 2.89Å; S152-G155 VanDerWaalsContact O-N 3.16Å; S152-G155 PolarHBondContact OG-N 2.92Å; A153-G155 VanDerWaalsContact C-N 3.28Å; G155-P171 WeakPolarHBondContact O-CD 3.33Å
156	L	94.3	Very high	95.1	Very high	43 Å²	43	20.5 Å²	20.5	23%	0.225	12%	0.118	C	C	.	.			trans	-67.7	149.2	161.6	-60.2	180	0	0	0	109.3	Y151 S152 I168 L177 F192	Y151-L156 CarbonylContact C-O 3.55Å; Y151-L156 WeakPolarHBondContact CA-O 3.18Å; Y151-L156 WeakPolarHBondContact CD1-O 3.25Å; S152-L156 PolarHBondContact N-O 3.34Å; S152-L156 WeakPolarHBondContact OG-CB 3.44Å; S152-L156 PolarHBondContact OG-N 3.44Å; S152-L156 PolarHBondContact OG-O 2.94Å; L156-I168 HydrophobicContact CB-CG2 4.35Å; L156-I168 HydrophobicContact CD1-CG2 4.3Å; L156-L177 HydrophobicContact CD2-CD1 3.7Å; L156-F192 HydrophobicContact CB-CZ 4.4Å
157	L	96.2	Very high	95.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128.1	176.6	178.8	67.5	0	0	0	108.9	A114 V122 I124 L139 L149 Y151 I168 W169 P171	A114-L157 HydrophobicContact CB-CD1 3.87Å; A114-L157 HydrophobicContact CB-CD2 3.66Å; A114-L157 HydrophobicContact CB-CG 4.45Å; V122-L157 HydrophobicContact CG1-CD2 3.82Å; I124-L157 HydrophobicContact CD1-CD2 3.54Å; L139-L157 HydrophobicContact CD1-CD2 4.21Å; L149-L157 HydrophobicContact CB-CD1 4.35Å; L149-L157 HydrophobicContact CD2-CD1 4.45Å; Y151-L157 HydrophobicContact CD1-CB 4.29Å; Y151-L157 HydrophobicContact CD1-CD1 4.3Å; Y151-L157 HydrophobicContact CD2-CD1 3.9Å; Y151-L157 HydrophobicContact CE1-CB 4.08Å; Y151-L157 HydrophobicContact CE1-CD1 4.33Å; Y151-L157 HydrophobicContact CE2-CD1 3.93Å; Y151-L157 HydrophobicContact CG-CD1 4.1Å; L157-I168 CarbonylContact O-C 3.57Å; L157-I168 WeakPolarHBondContact O-CA 3.22Å; L157-W169 HydrophobicContact CB-CB 4.38Å; L157-W169 PolarHBondContact N-O 2.94Å; L157-W169 VanDerWaalsContact N-O 3.08Å; L157-W169 VanDerWaalsContact O-CD1 3.28Å; L157-W169 PolarHBondContact O-N 2.87Å; L157-P171 HydrophobicContact CB-CG 3.76Å; L157-P171 HydrophobicContact CD2-CG 4.44Å
158	A	97.4	Very high	95.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	139.9	168.4	0	0	0	0	0	110.3	L149 C150 I166 H167 I168 I190 F192 L199	L149-A158 CarbonylContact C-O 3.53Å; L149-A158 WeakPolarHBondContact CA-O 3.33Å; C150-A158 PolarHBondContact N-O 2.84Å; C150-A158 PolarHBondContact O-N 2.78Å; A158-I166 HydrophobicContact CB-CG2 4.49Å; A158-H167 CarbonylContact C-O 3.48Å; A158-H167 VanDerWaalsContact CA-O 3.29Å; A158-H167 WeakPolarHBondContact CA-O 3.29Å; A158-I168 HydrophobicContact CB-CG1 4.5Å; A158-I190 HydrophobicContact CB-CD1 3.7Å; A158-I190 WeakPolarHBondContact O-CD1 3.44Å; A158-F192 HydrophobicContact CB-CE2 3.57Å; A158-F192 HydrophobicContact CB-CZ 3.67Å; A158-L199 HydrophobicContact CB-CD1 3.48Å; A158-L199 VanDerWaalsContact CB-CD1 3.48Å
159	S	97.5	Very high	95.4	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129	172.6	62	0	0	0	0	110.9	H142 C148 L149 I166 H167 W169	H142-S159 PolarHBondContact CD2-OG 2.87Å; H142-S159 PolarHBondContact NE2-O 2.94Å; H142-S159 PolarHBondContact NE2-OG 3.45Å; C148-S159 WeakPolarHBondContact O-CA 3.47Å; L149-S159 VanDerWaalsContact CD2-CB 3.43Å; S159-I166 CarbonylContact O-C 3.58Å; S159-I166 WeakPolarHBondContact O-CA 3.47Å; S159-I166 WeakPolarHBondContact O-CG2 3.26Å; S159-H167 PolarHBondContact N-O 3.48Å; S159-H167 PolarHBondContact O-N 3.25Å; S159-W169 PolarHBondContact OG-NE1 3.02Å
160	G	96.8	Very high	95.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.6	170.3	0	0	0	0	0	110.6	S147 C148	S147-G160 PolarHBondContact N-O 2.83Å; S147-G160 PolarHBondContact OG-O 2.9Å; C148-G160 PolarHBondContact N-O 2.96Å; C148-G160 PolarHBondContact O-N 2.94Å
161	S	97.1	Very high	95.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	163.1	-176	170.4	0	0	0	0	113.1	H142 A144 N145 D163 K164 T165 V187	H142-S161 WeakPolarHBondContact CE1-CB 3.47Å; H142-S161 WeakPolarHBondContact ND1-CB 3.25Å; A144-S161 PolarHBondContact O-OG 2.87Å; N145-S161 VanDerWaalsContact O-CA 3.26Å; N145-S161 WeakPolarHBondContact O-CA 3.4Å; N145-S161 WeakPolarHBondContact O-CB 3.42Å; N145-S161 PolarHBondContact O-OG 3.04Å; S161-D163 VanDerWaalsContact CB-OD1 3.29Å; S161-D163 WeakPolarHBondContact CB-OD1 3.27Å; S161-D163 PolarHBondContact O-N 2.82Å; S161-D163 VanDerWaalsContact OG-CG 3.24Å; S161-D163 PolarHBondContact OG-N 3.08Å; S161-D163 PolarHBondContact OG-OD1 2.81Å; S161-K164 PolarHBondContact O-N 3.34Å; S161-T165 PolarHBondContact N-O 3.36Å; S161-V187 PolarHBondContact O-N 2.84Å
162	W	96.1	Very high	94.8	Very high	70 Å²	70	29.9 Å²	29.9	27%	0.265	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.4	168.5	-69.7	20.4	0	0	0	112.9	W118 A144 N145 K164 W186	W118-W162 HydrophobicContact CZ2-CH2 4.2Å; W118-W162 HydrophobicContact CZ2-CZ2 4.4Å; A144-W162 HydrophobicContact CB-CB 4.01Å; N145-W162 HydrophobicContact CB-CB 4.43Å; N145-W162 HydrophobicContact CB-CD2 4.07Å; N145-W162 HydrophobicContact CB-CE3 4.36Å; N145-W162 HydrophobicContact CB-CG 4.1Å; N145-W162 PolarHBondContact O-N 3.24Å; W162-K164 PolarHBondContact O-N 3.12Å; W162-K164 VanDerWaalsContact O-N 3.15Å; W162-W186 HydrophobicContact CB-CB 4.4Å; W162-W186 HydrophobicContact CB-CD2 4.24Å; W162-W186 HydrophobicContact CB-CG 3.91Å; W162-W186 AromaticContact CD2-CD2 3.79Å; W162-W186 HydrophobicContact CD2-CD2 3.79Å; W162-W186 AromaticContact CD2-CE3 3.78Å; W162-W186 HydrophobicContact CD2-CE3 3.78Å; W162-W186 HydrophobicContact CD2-CG 4.29Å; W162-W186 HydrophobicContact CD2-CH2 4.35Å; W162-W186 HydrophobicContact CD2-CZ2 4.36Å; W162-W186 HydrophobicContact CD2-CZ3 4.07Å; W162-W186 AromaticContact CE2-CE3 3.76Å; W162-W186 HydrophobicContact CE3-CD2 4.13Å; W162-W186 AromaticContact CE3-CE2 3.98Å; W162-W186 HydrophobicContact CE3-CE3 4.11Å; W162-W186 AromaticContact CE3-CH2 3.82Å; W162-W186 HydrophobicContact CE3-CH2 3.82Å; W162-W186 AromaticContact CE3-CZ2 3.84Å; W162-W186 HydrophobicContact CE3-CZ2 3.84Å; W162-W186 AromaticContact CE3-CZ3 3.96Å; W162-W186 HydrophobicContact CE3-CZ3 3.96Å; W162-W186 HydrophobicContact CG-CB 4.15Å; W162-W186 AromaticContact CG-CD2 3.84Å; W162-W186 HydrophobicContact CG-CD2 3.84Å; W162-W186 HydrophobicContact CG-CE3 4.2Å; W162-W186 AromaticContact CG-CG 3.82Å; W162-W186 HydrophobicContact CG-CG 3.82Å; W162-W186 HydrophobicContact CH2-CE3 4.4Å; W162-W186 HydrophobicContact CH2-CH2 4.12Å; W162-W186 AromaticContact CH2-CZ3 3.83Å; W162-W186 HydrophobicContact CH2-CZ3 3.83Å; W162-W186 HydrophobicContact CZ2-CE3 4.1Å; W162-W186 AromaticContact CZ2-CZ3 3.93Å; W162-W186 HydrophobicContact CZ2-CZ3 3.93Å; W162-W186 HydrophobicContact CZ3-CE3 4.41Å; W162-W186 AromaticContact CZ3-CH2 3.69Å; W162-W186 HydrophobicContact CZ3-CH2 3.69Å; W162-W186 HydrophobicContact CZ3-CZ2 4.14Å; W162-W186 AromaticContact CZ3-CZ3 3.84Å; W162-W186 HydrophobicContact CZ3-CZ3 3.84Å; W162-W186 PolarHBondContact O-NE1 3.32Å
163	D	96.6	Very high	94.7	Very high	25 Å²	25	33.8 Å²	33.8	13%	0.134	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	3.6	169.3	71.3	13.9	0	0	0	113.3	H142 S143 A144 S161 T165	H142-D163 WeakPolarHBondContact CA-OD2 3.41Å; H142-D163 IonicContact CE1-OD1 3.79Å; H142-D163 IonicContact CE1-OD2 3.67Å; H142-D163 IonicContact CG-OD2 3.13Å; H142-D163 IonicContact ND1-OD1 3.11Å; H142-D163 PolarHBondContact ND1-OD1 3.29Å; H142-D163 IonicContact ND1-OD2 3.58Å; H142-D163 PolarHBondContact ND1-OD2 2.85Å; S143-D163 PolarHBondContact N-OD2 3.14Å; S143-D163 WeakPolarHBondContact OG-CB 3.39Å; A144-D163 HydrophobicContact CB-CB 4Å; S161-D163 VanDerWaalsContact CB-OD1 3.29Å; S161-D163 WeakPolarHBondContact CB-OD1 3.27Å; S161-D163 PolarHBondContact O-N 2.82Å; S161-D163 VanDerWaalsContact OG-CG 3.24Å; S161-D163 PolarHBondContact OG-N 3.08Å; S161-D163 PolarHBondContact OG-OD1 2.81Å; D163-T165 VanDerWaalsContact CG-OG1 3.27Å; D163-T165 PolarHBondContact O-N 2.79Å; D163-T165 WeakPolarHBondContact OD1-CA 3.37Å; D163-T165 WeakPolarHBondContact OD1-CB 3.44Å; D163-T165 PolarHBondContact OD1-N 3.14Å; D163-T165 PolarHBondContact OD1-OG1 3.43Å; D163-T165 PolarHBondContact OD2-OG1 2.54Å
164	K	95.5	Very high	94.7	Very high	96 Å²	96	32.8 Å²	32.8	42%	0.417	18%	0.182	S	C	.	.	S	Bend	trans	70.1	16.2	176.5	-40.1	168.8	179.7	-173.7	0	112.9	S161 W162 H183 V184 T185	S161-K164 PolarHBondContact O-N 3.34Å; W162-K164 PolarHBondContact O-N 3.12Å; W162-K164 VanDerWaalsContact O-N 3.15Å; K164-H183 HydrophobicContact CB-CB 4.37Å; K164-H183 WeakPolarHBondContact CB-O 3.33Å; K164-H183 WeakPolarHBondContact O-CB 3.49Å; K164-V184 WeakPolarHBondContact CD-O 3.25Å; K164-V184 WeakPolarHBondContact CE-O 3.42Å; K164-V184 PolarHBondContact NZ-O 2.78Å; K164-T185 WeakPolarHBondContact CB-O 3.13Å; K164-T185 WeakPolarHBondContact CG-O 3.34Å
165	T	96.9	Very high	94.8	Very high	15 Å²	15	31.3 Å²	31.3	9%	0.092	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	161.8	176.1	75.3	0	0	0	0	111.1	H142 S161 D163 H167 L180 K181	H142-T165 PolarHBondContact CE1-OG1 3.16Å; H142-T165 PolarHBondContact ND1-OG1 2.72Å; S161-T165 PolarHBondContact N-O 3.36Å; D163-T165 VanDerWaalsContact CG-OG1 3.27Å; D163-T165 PolarHBondContact O-N 2.79Å; D163-T165 WeakPolarHBondContact OD1-CA 3.37Å; D163-T165 WeakPolarHBondContact OD1-CB 3.44Å; D163-T165 PolarHBondContact OD1-N 3.14Å; D163-T165 PolarHBondContact OD1-OG1 3.43Å; D163-T165 PolarHBondContact OD2-OG1 2.54Å; T165-H167 PolarHBondContact OG1-CE1 3.48Å; T165-H167 PolarHBondContact OG1-ND1 2.83Å; T165-L180 WeakPolarHBondContact CA-O 3.29Å; T165-K181 HydrophobicContact CG2-CG 4.15Å
166	I	97.8	Very high	95.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134	169	-55.3	162.9	0	0	0	106.7	A158 S159 L180 V187 I190 L199	A158-I166 HydrophobicContact CB-CG2 4.49Å; S159-I166 CarbonylContact O-C 3.58Å; S159-I166 WeakPolarHBondContact O-CA 3.47Å; S159-I166 WeakPolarHBondContact O-CG2 3.26Å; I166-L180 HydrophobicContact CB-CB 4.05Å; I166-L180 HydrophobicContact CB-CD1 4.01Å; I166-L180 HydrophobicContact CB-CG 4.34Å; I166-L180 HydrophobicContact CD1-CD1 4.43Å; I166-L180 HydrophobicContact CG2-CD1 4.03Å; I166-L180 PolarHBondContact N-O 3.36Å; I166-L180 VanDerWaalsContact N-O 3.09Å; I166-L180 PolarHBondContact O-N 3.11Å; I166-V187 HydrophobicContact CD1-CG1 4.19Å; I166-V187 HydrophobicContact CD1-CG2 4.36Å; I166-V187 HydrophobicContact CG1-CB 4.47Å; I166-V187 HydrophobicContact CG1-CG1 4.01Å; I166-V187 HydrophobicContact CG1-CG2 3.82Å; I166-I190 HydrophobicContact CD1-CG2 3.92Å; I166-I190 HydrophobicContact CG1-CG2 4.19Å; I166-I190 HydrophobicContact CG2-CG2 4.25Å; I166-L199 HydrophobicContact CD1-CD2 3.96Å; I166-L199 HydrophobicContact CG2-CD2 4.29Å
167	H	97.9	Very high	95.1	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136	175.3	-73.4	51.2	0	0	0	109.3	H142 A158 S159 T165 W169 L176 I178 Q179	H142-H167 AromaticContact CE1-CE1 3.54Å; H142-H167 AromaticContact CE1-CG 3.74Å; H142-H167 AromaticContact CE1-ND1 3.04Å; H142-H167 PolarHBondContact CE1-ND1 3.09Å; H142-H167 AromaticContact ND1-CE1 3.51Å; H142-H167 AromaticContact ND1-ND1 3.51Å; H142-H167 AromaticContact NE2-CG 3.61Å; H142-H167 AromaticContact NE2-ND1 3.4Å; H142-H167 PolarHBondContact NE2-ND1 3.04Å; A158-H167 CarbonylContact C-O 3.48Å; A158-H167 VanDerWaalsContact CA-O 3.29Å; A158-H167 WeakPolarHBondContact CA-O 3.29Å; S159-H167 PolarHBondContact N-O 3.48Å; S159-H167 PolarHBondContact O-N 3.25Å; T165-H167 PolarHBondContact OG1-CE1 3.48Å; T165-H167 PolarHBondContact OG1-ND1 2.83Å; H167-W169 HydrophobicContact CB-CD2 4.35Å; H167-W169 HydrophobicContact CB-CH2 4.35Å; H167-W169 HydrophobicContact CB-CZ2 3.4Å; H167-W169 VanDerWaalsContact CB-NE1 3.34Å; H167-W169 AromaticContact CD2-CH2 3.69Å; H167-W169 AromaticContact CD2-CZ2 3.49Å; H167-W169 VanDerWaalsContact CD2-CZ2 3.49Å; H167-W169 WeakPolarHBondContact CD2-CZ2 3.29Å; H167-W169 AromaticContact CG-CZ2 3.72Å; H167-L176 HydrophobicContact CB-CD1 3.53Å; H167-L176 WeakPolarHBondContact CD2-CD1 3.23Å; H167-L176 VanDerWaalsContact CD2-CD2 3.44Å; H167-L176 WeakPolarHBondContact CD2-CD2 3.42Å; H167-I178 WeakPolarHBondContact CA-O 3.36Å; H167-Q179 PolarHBondContact CE1-NE2 3Å; H167-Q179 VanDerWaalsContact CE1-NE2 3.32Å
168	I	97.4	Very high	95.1	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.4	170.4	-58.5	178.1	0	0	0	107.6	L156 L157 A158 L177 I178 L180 C213	L156-I168 HydrophobicContact CB-CG2 4.35Å; L156-I168 HydrophobicContact CD1-CG2 4.3Å; L157-I168 CarbonylContact O-C 3.57Å; L157-I168 WeakPolarHBondContact O-CA 3.22Å; A158-I168 HydrophobicContact CB-CG1 4.5Å; I168-L177 WeakPolarHBondContact O-CB 3.42Å; I168-L177 PolarHBondContact O-N 3.37Å; I168-I178 HydrophobicContact CB-CB 4.32Å; I168-I178 PolarHBondContact N-O 3.08Å; I168-I178 PolarHBondContact O-N 3.43Å; I168-L180 HydrophobicContact CD1-CD1 4.27Å; I168-C213 HydrophobicContact CD1-CB 4.39Å
169	W	96.9	Very high	95.1	Very high	5 Å²	5	41.1 Å²	41.1	2%	0.019	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	154.4	-174.2	-48.1	88.9	0	0	0	110.8	L139 E140 L157 S159 H167 P171 L176	L139-W169 HydrophobicContact CB-CD2 4.26Å; L139-W169 HydrophobicContact CB-CE3 4.01Å; L139-W169 HydrophobicContact CB-CH2 4.35Å; L139-W169 HydrophobicContact CB-CZ3 4.04Å; L139-W169 HydrophobicContact CD1-CB 3.96Å; L139-W169 HydrophobicContact CD1-CD2 3.94Å; L139-W169 HydrophobicContact CD1-CE3 4.19Å; L139-W169 HydrophobicContact CD1-CG 3.83Å; E140-W169 WeakPolarHBondContact O-CH2 3.32Å; L157-W169 HydrophobicContact CB-CB 4.38Å; L157-W169 PolarHBondContact N-O 2.94Å; L157-W169 VanDerWaalsContact N-O 3.08Å; L157-W169 VanDerWaalsContact O-CD1 3.28Å; L157-W169 PolarHBondContact O-N 2.87Å; S159-W169 PolarHBondContact OG-NE1 3.02Å; H167-W169 HydrophobicContact CB-CD2 4.35Å; H167-W169 HydrophobicContact CB-CH2 4.35Å; H167-W169 HydrophobicContact CB-CZ2 3.4Å; H167-W169 VanDerWaalsContact CB-NE1 3.34Å; H167-W169 AromaticContact CD2-CH2 3.69Å; H167-W169 AromaticContact CD2-CZ2 3.49Å; H167-W169 VanDerWaalsContact CD2-CZ2 3.49Å; H167-W169 WeakPolarHBondContact CD2-CZ2 3.29Å; H167-W169 AromaticContact CG-CZ2 3.72Å; W169-P171 WeakPolarHBondContact O-CD 3.28Å; W169-L176 HydrophobicContact CD2-CD1 4.12Å; W169-L176 HydrophobicContact CE3-CB 3.87Å; W169-L176 HydrophobicContact CE3-CD1 4.02Å; W169-L176 HydrophobicContact CH2-CB 4.41Å; W169-L176 HydrophobicContact CH2-CD1 4.16Å; W169-L176 HydrophobicContact CZ2-CD1 4.25Å; W169-L176 HydrophobicContact CZ3-CB 3.69Å; W169-L176 HydrophobicContact CZ3-CD1 4.06Å; W169-L176 HydrophobicContact CZ3-CG 4.36Å
170	K	95.1	Very high	95	Very high	93 Å²	93	41.1 Å²	41.1	40%	0.404	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	98.4	161.4	-171.9	172.3	-176	176.7	0	109.1	T172 T173 S174 S175 L177	K170-T172 WeakPolarHBondContact CE-OG1 3.42Å; K170-T172 WeakPolarHBondContact CG-OG1 3.47Å; K170-T172 PolarHBondContact O-N 3.07Å; K170-T173 PolarHBondContact O-N 2.85Å; K170-T173 PolarHBondContact O-OG1 3.11Å; K170-S174 WeakPolarHBondContact O-CA 3.05Å; K170-S174 PolarHBondContact O-N 3.23Å; K170-S175 PolarHBondContact N-O 3.21Å; K170-S175 PolarHBondContact O-N 3.2Å; K170-L177 HydrophobicContact CB-CD1 4.01Å; K170-L177 HydrophobicContact CB-CD2 4.07Å; K170-L177 HydrophobicContact CB-CG 4.03Å
171	P	90.5	Very high	94.9	Very high	15 Å²	15	47.8 Å²	47.8	10%	0.097	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.5	-173.7	-29	38.5	0	0	0	114.5	I124 Y151 G155 L157 W169 T173 S174	I124-P171 HydrophobicContact CD1-CB 4.34Å; I124-P171 HydrophobicContact CD1-CG 4.49Å; I124-P171 HydrophobicContact CG1-CB 4.25Å; I124-P171 HydrophobicContact CG2-CB 4.41Å; Y151-P171 HydrophobicContact CE1-CG 3.98Å; G155-P171 WeakPolarHBondContact O-CD 3.33Å; L157-P171 HydrophobicContact CB-CG 3.76Å; L157-P171 HydrophobicContact CD2-CG 4.44Å; W169-P171 WeakPolarHBondContact O-CD 3.28Å; P171-T173 PolarHBondContact O-N 2.91Å; P171-S174 PolarHBondContact O-N 3.29Å; P171-S174 PolarHBondContact O-OG 2.82Å
172	T	88.2	Confident	94.5	Very high	119 Å²	119	49.7 Å²	49.7	73%	0.73	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-29.9	-179.9	58.5	0	0	0	0	113.5	K170	K170-T172 WeakPolarHBondContact CE-OG1 3.42Å; K170-T172 WeakPolarHBondContact CG-OG1 3.47Å; K170-T172 PolarHBondContact O-N 3.07Å
173	T	89.7	Confident	94.2	Very high	84 Å²	84	47 Å²	47	52%	0.515	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-3.7	-179.6	48.8	0	0	0	0	112	K170 P171 S175	K170-T173 PolarHBondContact O-N 2.85Å; K170-T173 PolarHBondContact O-OG1 3.11Å; P171-T173 PolarHBondContact O-N 2.91Å; T173-S175 PolarHBondContact O-N 3.23Å; T173-S175 VanDerWaalsContact O-N 3.1Å; T173-S175 PolarHBondContact OG1-OG 2.91Å
174	S	89.4	Confident	93.9	Very high	27 Å²	27	50.5 Å²	50.5	19%	0.189	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	36.4	-173.3	-69.5	0	0	0	0	114.4	Q137 L139 K170 P171	Q137-S174 WeakPolarHBondContact CG-OG 3.33Å; Q137-S174 PolarHBondContact NE2-OG 3.27Å; Q137-S174 PolarHBondContact OE1-OG 2.77Å; L139-S174 VanDerWaalsContact CD2-CB 3.48Å; L139-S174 VanDerWaalsContact CD2-OG 3.3Å; L139-S174 WeakPolarHBondContact CD2-OG 3.46Å; K170-S174 WeakPolarHBondContact O-CA 3.05Å; K170-S174 PolarHBondContact O-N 3.23Å; P171-S174 PolarHBondContact O-N 3.29Å; P171-S174 PolarHBondContact O-OG 2.82Å
175	S	92.8	Very high	93.7	Very high	42 Å²	42	47.7 Å²	47.7	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133.9	178.1	57.7	0	0	0	0	109.8	K170 T173 L177	K170-S175 PolarHBondContact N-O 3.21Å; K170-S175 PolarHBondContact O-N 3.2Å; T173-S175 PolarHBondContact O-N 3.23Å; T173-S175 VanDerWaalsContact O-N 3.1Å; T173-S175 PolarHBondContact OG1-OG 2.91Å; S175-L177 PolarHBondContact O-N 3.31Å
176	L	96.3	Very high	93.5	Very high	72 Å²	72	51.8 Å²	51.8	38%	0.377	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.1	161.3	179.3	58.2	0	0	0	108.9	H167 W169	H167-L176 HydrophobicContact CB-CD1 3.53Å; H167-L176 WeakPolarHBondContact CD2-CD1 3.23Å; H167-L176 VanDerWaalsContact CD2-CD2 3.44Å; H167-L176 WeakPolarHBondContact CD2-CD2 3.42Å; W169-L176 HydrophobicContact CD2-CD1 4.12Å; W169-L176 HydrophobicContact CE3-CB 3.87Å; W169-L176 HydrophobicContact CE3-CD1 4.02Å; W169-L176 HydrophobicContact CH2-CB 4.41Å; W169-L176 HydrophobicContact CH2-CD1 4.16Å; W169-L176 HydrophobicContact CZ2-CD1 4.25Å; W169-L176 HydrophobicContact CZ3-CB 3.69Å; W169-L176 HydrophobicContact CZ3-CD1 4.06Å; W169-L176 HydrophobicContact CZ3-CG 4.36Å
177	L	95.7	Very high	93.3	Very high	86 Å²	86	51.8 Å²	51.8	45%	0.45	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-50.7	176.6	-60.7	-176.3	0	0	0	111.1	L156 I168 K170 S175	L156-L177 HydrophobicContact CD2-CD1 3.7Å; I168-L177 WeakPolarHBondContact O-CB 3.42Å; I168-L177 PolarHBondContact O-N 3.37Å; K170-L177 HydrophobicContact CB-CD1 4.01Å; K170-L177 HydrophobicContact CB-CD2 4.07Å; K170-L177 HydrophobicContact CB-CG 4.03Å; S175-L177 PolarHBondContact O-N 3.31Å
178	I	96	Very high	92.9	Very high	33 Å²	33	55 Å²	55	17%	0.169	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	136.1	-172.1	-62.9	173.5	0	0	0	109.8	H167 I168 L180 C213	H167-I178 WeakPolarHBondContact CA-O 3.36Å; I168-I178 HydrophobicContact CB-CB 4.32Å; I168-I178 PolarHBondContact N-O 3.08Å; I168-I178 PolarHBondContact O-N 3.43Å; I178-L180 HydrophobicContact CG2-CD2 3.51Å; I178-L180 HydrophobicContact CG2-CG 4.23Å; I178-C213 WeakPolarHBondContact CD1-O 3.44Å
179	Q	96.8	Very high	92.5	Very high	77 Å²	77	55 Å²	55	36%	0.36	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.8	169.8	-171.5	-179.8	24.7	0	0	109.8	H167 K181	H167-Q179 PolarHBondContact CE1-NE2 3Å; H167-Q179 VanDerWaalsContact CE1-NE2 3.32Å; Q179-K181 HydrophobicContact CG-CG 4.23Å; Q179-K181 VanDerWaalsContact NE2-CE 3.34Å
180	L	96	Very high	92.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.8	178.1	-49.2	176.4	0	0	0	109.5	T165 I166 I168 I178 L199 W211 G216	T165-L180 WeakPolarHBondContact CA-O 3.29Å; I166-L180 HydrophobicContact CB-CB 4.05Å; I166-L180 HydrophobicContact CB-CD1 4.01Å; I166-L180 HydrophobicContact CB-CG 4.34Å; I166-L180 HydrophobicContact CD1-CD1 4.43Å; I166-L180 HydrophobicContact CG2-CD1 4.03Å; I166-L180 PolarHBondContact N-O 3.36Å; I166-L180 VanDerWaalsContact N-O 3.09Å; I166-L180 PolarHBondContact O-N 3.11Å; I168-L180 HydrophobicContact CD1-CD1 4.27Å; I178-L180 HydrophobicContact CG2-CD2 3.51Å; I178-L180 HydrophobicContact CG2-CG 4.23Å; L180-L199 HydrophobicContact CD1-CD2 4.17Å; L180-W211 HydrophobicContact CB-CD2 4.07Å; L180-W211 HydrophobicContact CB-CE3 3.87Å; L180-W211 HydrophobicContact CB-CH2 4.38Å; L180-W211 HydrophobicContact CB-CZ3 4.03Å; L180-W211 HydrophobicContact CD1-CB 3.85Å; L180-W211 HydrophobicContact CD1-CD2 3.98Å; L180-W211 HydrophobicContact CD1-CE3 4.44Å; L180-W211 HydrophobicContact CD1-CG 3.7Å; L180-W211 HydrophobicContact CD2-CB 4.3Å; L180-W211 HydrophobicContact CD2-CD2 4.41Å; L180-W211 HydrophobicContact CD2-CE3 4.1Å; L180-W211 HydrophobicContact CG-CD2 4.39Å; L180-W211 HydrophobicContact CG-CE3 4.37Å; L180-G216 WeakPolarHBondContact CD2-O 3.19Å
181	K	94.6	Very high	92.3	Very high	139 Å²	139	50.4 Å²	50.4	60%	0.604	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	138.4	178	-62.5	-176.8	-176.3	175.3	0	110	T165 Q179 W211	T165-K181 HydrophobicContact CG2-CG 4.15Å; Q179-K181 HydrophobicContact CG-CG 4.23Å; Q179-K181 VanDerWaalsContact NE2-CE 3.34Å; K181-W211 WeakPolarHBondContact O-CH2 3.42Å; K181-W211 WeakPolarHBondContact O-CZ3 2.9Å
182	G	89.1	Confident	92.3	Very high	41 Å²	41	50.4 Å²	50.4	42%	0.423	28%	0.275	S	S	.	.			trans	146.5	-7.7	174	0	0	0	0	0	115.2	K209	G182-K209 VanDerWaalsContact O-CE 3.23Å; G182-K209 WeakPolarHBondContact O-CE 3.47Å
183	H	90.1	Very high	92.4	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.056	24%	0.241	C	C	.	.			trans	-68.8	140.6	163.9	-84.2	-69.9	0	0	0	110	K164 V187 S201 W211	K164-H183 HydrophobicContact CB-CB 4.37Å; K164-H183 WeakPolarHBondContact CB-O 3.33Å; K164-H183 WeakPolarHBondContact O-CB 3.49Å; H183-V187 HydrophobicContact CB-CG2 4.39Å; H183-S201 PolarHBondContact NE2-OG 2.85Å; H183-W211 AromaticContact CD2-CZ2 3.78Å
184	V	90.3	Very high	92.1	Very high	99 Å²	99	43.6 Å²	43.6	60%	0.6	24%	0.235	S	C	*	.	S	Bend	trans	-95.1	-16.8	178.5	-67.3	0	0	0	0	112.3	K164	K164-V184 WeakPolarHBondContact CD-O 3.25Å; K164-V184 WeakPolarHBondContact CE-O 3.42Å; K164-V184 PolarHBondContact NZ-O 2.78Å
185	T	91.1	Very high	92	Very high	38 Å²	38	46.1 Å²	46.1	23%	0.233	25%	0.246	C	C	.	.	S	Bend	trans	-125.2	179	177.1	65.2	0	0	0	0	110.6	K164 Y204 S205	K164-T185 WeakPolarHBondContact CB-O 3.13Å; K164-T185 WeakPolarHBondContact CG-O 3.34Å; T185-Y204 PolarHBondContact OG1-N 3.04Å; T185-S205 WeakPolarHBondContact OG1-CB 3.35Å; T185-S205 PolarHBondContact OG1-N 2.98Å
186	W	91.9	Very high	91.9	Very high	100 Å²	100	46.4 Å²	46.4	38%	0.379	24%	0.242	S	C	.	.			trans	-56.8	137.8	172.5	-50.8	-19.7	0	0	0	111.6	W162 G203 Y204	W162-W186 HydrophobicContact CB-CB 4.4Å; W162-W186 HydrophobicContact CB-CD2 4.24Å; W162-W186 HydrophobicContact CB-CG 3.91Å; W162-W186 AromaticContact CD2-CD2 3.79Å; W162-W186 HydrophobicContact CD2-CD2 3.79Å; W162-W186 AromaticContact CD2-CE3 3.78Å; W162-W186 HydrophobicContact CD2-CE3 3.78Å; W162-W186 HydrophobicContact CD2-CG 4.29Å; W162-W186 HydrophobicContact CD2-CH2 4.35Å; W162-W186 HydrophobicContact CD2-CZ2 4.36Å; W162-W186 HydrophobicContact CD2-CZ3 4.07Å; W162-W186 AromaticContact CE2-CE3 3.76Å; W162-W186 HydrophobicContact CE3-CD2 4.13Å; W162-W186 AromaticContact CE3-CE2 3.98Å; W162-W186 HydrophobicContact CE3-CE3 4.11Å; W162-W186 AromaticContact CE3-CH2 3.82Å; W162-W186 HydrophobicContact CE3-CH2 3.82Å; W162-W186 AromaticContact CE3-CZ2 3.84Å; W162-W186 HydrophobicContact CE3-CZ2 3.84Å; W162-W186 AromaticContact CE3-CZ3 3.96Å; W162-W186 HydrophobicContact CE3-CZ3 3.96Å; W162-W186 HydrophobicContact CG-CB 4.15Å; W162-W186 AromaticContact CG-CD2 3.84Å; W162-W186 HydrophobicContact CG-CD2 3.84Å; W162-W186 HydrophobicContact CG-CE3 4.2Å; W162-W186 AromaticContact CG-CG 3.82Å; W162-W186 HydrophobicContact CG-CG 3.82Å; W162-W186 HydrophobicContact CH2-CE3 4.4Å; W162-W186 HydrophobicContact CH2-CH2 4.12Å; W162-W186 AromaticContact CH2-CZ3 3.83Å; W162-W186 HydrophobicContact CH2-CZ3 3.83Å; W162-W186 HydrophobicContact CZ2-CE3 4.1Å; W162-W186 AromaticContact CZ2-CZ3 3.93Å; W162-W186 HydrophobicContact CZ2-CZ3 3.93Å; W162-W186 HydrophobicContact CZ3-CE3 4.41Å; W162-W186 AromaticContact CZ3-CH2 3.69Å; W162-W186 HydrophobicContact CZ3-CH2 3.69Å; W162-W186 HydrophobicContact CZ3-CZ2 4.14Å; W162-W186 AromaticContact CZ3-CZ3 3.84Å; W162-W186 HydrophobicContact CZ3-CZ3 3.84Å; W162-W186 PolarHBondContact O-NE1 3.32Å; W186-G203 WeakPolarHBondContact O-CA 3.32Å; W186-Y204 HydrophobicContact CB-CD2 4.25Å; W186-Y204 HydrophobicContact CE3-CD2 4.35Å; W186-Y204 HydrophobicContact CE3-CE2 4.26Å; W186-Y204 PolarHBondContact O-N 3.31Å
187	V	92.8	Very high	91.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	141.8	166.9	-173	0	0	0	0	107.1	S147 S161 I166 H183 I190	S147-V187 WeakPolarHBondContact CB-O 3.31Å; S147-V187 PolarHBondContact OG-O 3.3Å; S161-V187 PolarHBondContact O-N 2.84Å; I166-V187 HydrophobicContact CD1-CG1 4.19Å; I166-V187 HydrophobicContact CD1-CG2 4.36Å; I166-V187 HydrophobicContact CG1-CB 4.47Å; I166-V187 HydrophobicContact CG1-CG1 4.01Å; I166-V187 HydrophobicContact CG1-CG2 3.82Å; H183-V187 HydrophobicContact CB-CG2 4.39Å; V187-I190 HydrophobicContact CG1-CG2 3.79Å
188	K	90.1	Very high	91.5	Very high	71 Å²	71	45.1 Å²	45.1	31%	0.309	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	-31.9	-179.8	-174.5	175.9	174.9	74.7	0	112.3	C148 A202 Y204	C148-K188 WeakPolarHBondContact CB-O 3.37Å; K188-A202 PolarHBondContact N-O 3.08Å; K188-Y204 HydrophobicContact CB-CE2 4.42Å; K188-Y204 HydrophobicContact CD-CE2 3.92Å; K188-Y204 HydrophobicContact CG-CE2 4.47Å
189	S	89.8	Confident	91.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	147.9	179	-177.9	0	0	0	0	109.4	C25 S201 A202 T232 C233	C25-S189 PolarHBondContact O-OG 3.25Å; S189-S201 CarbonylContact O-C 3.56Å; S189-S201 WeakPolarHBondContact O-CA 3.25Å; S189-A202 PolarHBondContact N-O 2.9Å; S189-A202 PolarHBondContact O-N 2.87Å; S189-A202 VanDerWaalsContact O-O 3.12Å; S189-T232 WeakPolarHBondContact OG-CA 3.41Å; S189-C233 PolarHBondContact OG-N 2.73Å; S189-C233 VanDerWaalsContact OG-N 3.16Å
190	I	94.1	Very high	91.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	160.1	178	52.4	176.4	0	0	0	107.1	C25 C148 C150 A158 I166 V187 L199 A200	C25-I190 PolarHBondContact SG-O 3.5Å; C148-I190 HydrophobicContact CB-CG1 4.29Å; C150-I190 HydrophobicContact CB-CD1 3.99Å; C150-I190 HydrophobicContact CB-CG1 4.02Å; A158-I190 HydrophobicContact CB-CD1 3.7Å; A158-I190 WeakPolarHBondContact O-CD1 3.44Å; I166-I190 HydrophobicContact CD1-CG2 3.92Å; I166-I190 HydrophobicContact CG1-CG2 4.19Å; I166-I190 HydrophobicContact CG2-CG2 4.25Å; V187-I190 HydrophobicContact CG1-CG2 3.79Å; I190-L199 HydrophobicContact CB-CD2 4.36Å; I190-L199 HydrophobicContact CG2-CD2 4.25Å; I190-A200 CarbonylContact C-O 3.56Å; I190-A200 VanDerWaalsContact CA-O 3.25Å; I190-A200 WeakPolarHBondContact CA-O 3.28Å
191	A	92.6	Very high	90.9	Very high	2 Å²	2	39.9 Å²	39.9	2%	0.017	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	134.6	170.7	0	0	0	0	0	110.1	L199 A200 C233 F235	A191-L199 CarbonylContact O-C 3.56Å; A191-L199 WeakPolarHBondContact O-CA 3.2Å; A191-A200 PolarHBondContact N-O 2.78Å; A191-A200 PolarHBondContact O-N 3.27Å; A191-C233 WeakPolarHBondContact CB-O 3.42Å; A191-F235 HydrophobicContact CB-CD2 4.24Å; A191-F235 WeakPolarHBondContact O-CE2 3.41Å
192	F	91.6	Very high	90.6	Very high	16 Å²	16	33.2 Å²	33.2	7%	0.07	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	145.1	168.9	-77.7	-75	0	0	0	111.1	C150 L156 A158 L199 F235	C150-F192 WeakPolarHBondContact O-CE2 3.35Å; L156-F192 HydrophobicContact CB-CZ 4.4Å; A158-F192 HydrophobicContact CB-CE2 3.57Å; A158-F192 HydrophobicContact CB-CZ 3.67Å; F192-L199 HydrophobicContact CD1-CD1 4.14Å; F192-L199 HydrophobicContact CE1-CD1 3.81Å; F192-L199 HydrophobicContact CE2-CD1 4.26Å; F192-L199 HydrophobicContact CZ-CD1 3.88Å; F192-F235 VanDerWaalsContact C-CD2 3.42Å; F192-F235 VanDerWaalsContact O-CD2 3.27Å; F192-F235 WeakPolarHBondContact O-CD2 3.48Å
193	S	89.9	Confident	90.4	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.021	16%	0.158	C	C	.	.			trans	-69.9	154.1	165.1	58.1	0	0	0	0	110.6	D195 E196 L197 W198 F235	S193-D195 WeakPolarHBondContact CB-OD1 3.31Å; S193-D195 PolarHBondContact O-N 3.41Å; S193-D195 PolarHBondContact OG-OD1 2.81Å; S193-E196 WeakPolarHBondContact O-CA 3.35Å; S193-E196 PolarHBondContact O-N 3.4Å; S193-E196 PolarHBondContact OG-N 2.79Å; S193-L197 PolarHBondContact OG-N 2.93Å; S193-W198 PolarHBondContact N-O 2.86Å; S193-W198 PolarHBondContact OG-N 2.74Å; S193-W198 PolarHBondContact OG-O 2.87Å; S193-W198 VanDerWaalsContact OG-O 3.06Å; S193-F235 VanDerWaalsContact CA-CD2 3.49Å
194	P	84.2	Confident	90	Very high	57 Å²	57	35.4 Å²	35.4	37%	0.37	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-25.6	179.9	-23.1	33.5	0	0	0	114.1	E196 T236	P194-E196 VanDerWaalsContact C-N 3.34Å; P194-T236 WeakPolarHBondContact CG-O 3.38Å
195	D	87.1	Confident	89.1	Confident	80 Å²	80	31.1 Å²	31.1	43%	0.428	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-2	175.3	63.4	1	0	0	0	113.4	S193 L197	S193-D195 WeakPolarHBondContact CB-OD1 3.31Å; S193-D195 PolarHBondContact O-N 3.41Å; S193-D195 PolarHBondContact OG-OD1 2.81Å; D195-L197 HydrophobicContact CB-CG 4.36Å; D195-L197 PolarHBondContact O-N 3.46Å; D195-L197 PolarHBondContact OD1-N 2.82Å
196	E	89.4	Confident	88.3	Confident	47 Å²	47	36.1 Å²	36.1	22%	0.22	16%	0.163	C	C	.	.	S	Bend	trans	61.4	1.9	-180	-46.2	-163.7	143.1	0	0	116.4	S152 A153 S154 S193 P194 W198 C213	S152-E196 VanDerWaalsContact CB-OE1 3.29Å; S152-E196 WeakPolarHBondContact CB-OE1 3.22Å; S152-E196 PolarHBondContact OG-OE1 3.18Å; A153-E196 VanDerWaalsContact CA-OE1 3.29Å; A153-E196 WeakPolarHBondContact CA-OE1 3.26Å; A153-E196 VanDerWaalsContact CB-OE1 3.32Å; A153-E196 WeakPolarHBondContact CB-OE1 3.49Å; A153-E196 PolarHBondContact N-OE1 2.78Å; S154-E196 WeakPolarHBondContact CB-OE2 3.32Å; S154-E196 PolarHBondContact N-OE1 3.35Å; S154-E196 PolarHBondContact OG-OE1 3.4Å; S154-E196 VanDerWaalsContact OG-OE1 3.14Å; S154-E196 PolarHBondContact OG-OE2 3.33Å; S193-E196 WeakPolarHBondContact O-CA 3.35Å; S193-E196 PolarHBondContact O-N 3.4Å; S193-E196 PolarHBondContact OG-N 2.79Å; P194-E196 VanDerWaalsContact C-N 3.34Å; E196-W198 VanDerWaalsContact C-N 3.27Å; E196-W198 PolarHBondContact O-N 2.87Å; E196-C213 WeakPolarHBondContact O-CB 3.25Å
197	L	90.4	Very high	87.8	Confident	78 Å²	78	33.9 Å²	33.9	41%	0.408	16%	0.157	S	C	.	.	S	Bend	trans	-72.5	-26.7	179.8	-62.3	-179.5	0	0	0	111.7	S193 D195 C213	S193-L197 PolarHBondContact OG-N 2.93Å; D195-L197 HydrophobicContact CB-CG 4.36Å; D195-L197 PolarHBondContact O-N 3.46Å; D195-L197 PolarHBondContact OD1-N 2.82Å; L197-C213 PolarHBondContact O-N 3.33Å
198	W	93.6	Very high	87.5	Confident	54 Å²	54	34 Å²	34	21%	0.205	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	153.7	-174.1	-51.7	-38.4	0	0	0	113.3	S193 E196 V210 W211 F235	S193-W198 PolarHBondContact N-O 2.86Å; S193-W198 PolarHBondContact OG-N 2.74Å; S193-W198 PolarHBondContact OG-O 2.87Å; S193-W198 VanDerWaalsContact OG-O 3.06Å; E196-W198 VanDerWaalsContact C-N 3.27Å; E196-W198 PolarHBondContact O-N 2.87Å; W198-V210 HydrophobicContact CB-CG1 4.07Å; W198-V210 HydrophobicContact CG-CG1 4.34Å; W198-W211 CarbonylContact C-O 3.52Å; W198-W211 WeakPolarHBondContact CA-O 3.44Å; W198-F235 HydrophobicContact CB-CZ 4.22Å; W198-F235 HydrophobicContact CE3-CE1 4.48Å
199	L	93.8	Very high	87.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.6	169.5	-173.8	140.9	0	0	0	108.9	A158 I166 L180 I190 A191 F192 V210 W211	A158-L199 HydrophobicContact CB-CD1 3.48Å; A158-L199 VanDerWaalsContact CB-CD1 3.48Å; I166-L199 HydrophobicContact CD1-CD2 3.96Å; I166-L199 HydrophobicContact CG2-CD2 4.29Å; L180-L199 HydrophobicContact CD1-CD2 4.17Å; I190-L199 HydrophobicContact CB-CD2 4.36Å; I190-L199 HydrophobicContact CG2-CD2 4.25Å; A191-L199 CarbonylContact O-C 3.56Å; A191-L199 WeakPolarHBondContact O-CA 3.2Å; F192-L199 HydrophobicContact CD1-CD1 4.14Å; F192-L199 HydrophobicContact CE1-CD1 3.81Å; F192-L199 HydrophobicContact CE2-CD1 4.26Å; F192-L199 HydrophobicContact CZ-CD1 3.88Å; L199-V210 CarbonylContact O-C 3.57Å; L199-V210 WeakPolarHBondContact O-CA 3.4Å; L199-W211 HydrophobicContact CB-CB 4.46Å; L199-W211 PolarHBondContact N-O 2.76Å; L199-W211 VanDerWaalsContact O-CD1 3.24Å; L199-W211 PolarHBondContact O-N 2.83Å
200	A	92.1	Very high	87.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	146.2	169.3	0	0	0	0	0	108.4	I190 A191 K209 C233 F235 I241	I190-A200 CarbonylContact C-O 3.56Å; I190-A200 VanDerWaalsContact CA-O 3.25Å; I190-A200 WeakPolarHBondContact CA-O 3.28Å; A191-A200 PolarHBondContact N-O 2.78Å; A191-A200 PolarHBondContact O-N 3.27Å; A200-K209 CarbonylContact C-O 3.52Å; A200-K209 WeakPolarHBondContact CA-O 3.31Å; A200-C233 HydrophobicContact CB-CB 4.3Å; A200-F235 HydrophobicContact CB-CD2 4.11Å; A200-F235 HydrophobicContact CB-CE2 3.4Å; A200-F235 VanDerWaalsContact CB-CE2 3.4Å; A200-F235 HydrophobicContact CB-CZ 3.9Å; A200-I241 HydrophobicContact CB-CD1 4.22Å; A200-I241 HydrophobicContact CB-CG2 4.24Å
201	S	91.2	Very high	87.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	141.9	176.8	61.2	0	0	0	0	111.3	H183 S189 V208 K209 W211	H183-S201 PolarHBondContact NE2-OG 2.85Å; S189-S201 CarbonylContact O-C 3.56Å; S189-S201 WeakPolarHBondContact O-CA 3.25Å; S201-V208 CarbonylContact O-C 3.59Å; S201-V208 VanDerWaalsContact O-CA 3.3Å; S201-V208 WeakPolarHBondContact O-CA 3.36Å; S201-V208 WeakPolarHBondContact O-CG1 3.48Å; S201-K209 PolarHBondContact N-O 2.87Å; S201-K209 PolarHBondContact O-N 3.5Å; S201-K209 PolarHBondContact OG-O 3.3Å; S201-W211 PolarHBondContact OG-NE1 2.64Å
202	A	88.7	Confident	87.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.2	-179.7	0	0	0	0	0	109.3	K188 S189 V208 A230 C233	K188-A202 PolarHBondContact N-O 3.08Å; S189-A202 PolarHBondContact N-O 2.9Å; S189-A202 PolarHBondContact O-N 2.87Å; S189-A202 VanDerWaalsContact O-O 3.12Å; A202-V208 HydrophobicContact CB-CG2 4.08Å; A202-A230 HydrophobicContact CB-CB 3.73Å; A202-C233 HydrophobicContact CB-CB 4.09Å
203	G	83.9	Confident	87.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	-162.5	-179.2	0	0	0	0	0	111.9	W186 S205 A230	W186-G203 WeakPolarHBondContact O-CA 3.32Å; G203-S205 PolarHBondContact O-N 2.52Å; G203-S205 VanDerWaalsContact O-O 3.1Å; G203-A230 PolarHBondContact O-N 2.98Å
204	Y	81.4	Confident	87.9	Confident	98 Å²	98	38.4 Å²	38.4	38%	0.384	18%	0.184	S	C	.	.	S	Bend	trans	-74.9	-11.5	173.1	-76.9	-96.5	0	0	0	113.1	T185 W186 K188 V229	T185-Y204 PolarHBondContact OG1-N 3.04Å; W186-Y204 HydrophobicContact CB-CD2 4.25Å; W186-Y204 HydrophobicContact CE3-CD2 4.35Å; W186-Y204 HydrophobicContact CE3-CE2 4.26Å; W186-Y204 PolarHBondContact O-N 3.31Å; K188-Y204 HydrophobicContact CB-CE2 4.42Å; K188-Y204 HydrophobicContact CD-CE2 3.92Å; K188-Y204 HydrophobicContact CG-CE2 4.47Å; Y204-V229 HydrophobicContact CD1-CB 4.42Å; Y204-V229 HydrophobicContact CD1-CG1 3.87Å; Y204-V229 HydrophobicContact CD1-CG2 3.6Å; Y204-V229 HydrophobicContact CE1-CG1 4.02Å; Y204-V229 HydrophobicContact CE1-CG2 4.05Å; Y204-V229 HydrophobicContact CG-CG1 4.23Å; Y204-V229 HydrophobicContact CG-CG2 4.46Å
205	S	71.9	Confident	88.3	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.063	19%	0.19	C	C	.	.	S	Bend	trans	-72.2	137.5	164.1	75.1	0	0	0	0	107	T185 G203 M207	T185-S205 WeakPolarHBondContact OG1-CB 3.35Å; T185-S205 PolarHBondContact OG1-N 2.98Å; G203-S205 PolarHBondContact O-N 2.52Å; G203-S205 VanDerWaalsContact O-O 3.1Å; S205-M207 PolarHBondContact O-N 3.27Å
206	R	73.2	Confident	88.5	Confident	143 Å²	143	36.5 Å²	36.5	54%	0.54	18%	0.178	S	C	.	.	S	Bend	trans	-63.8	23.5	176.6	-49.4	-172	-177.2	158.6	2.1	113.7	Q224 L227 D228	R206-Q224 PolarHBondContact O-N 3.48Å; R206-L227 WeakPolarHBondContact CB-O 3.41Å; R206-L227 WeakPolarHBondContact CD-O 3.28Å; R206-L227 WeakPolarHBondContact CG-O 3.48Å; R206-D228 IonicContact CZ-OD1 2.85Å; R206-D228 IonicContact NE-OD1 3.79Å; R206-D228 PolarHBondContact NE-OD1 3.42Å; R206-D228 IonicContact NH2-OD1 3.49Å; R206-D228 PolarHBondContact NH2-OD1 2.82Å
207	M	82.3	Confident	88.7	Confident	54 Å²	54	41.3 Å²	41.3	27%	0.266	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.8	-167.2	-56.4	-171.1	-171.1	0	0	109.6	S205 T221 L222 K223	S205-M207 PolarHBondContact O-N 3.27Å; M207-T221 HydrophobicContact CB-CG2 3.9Å; M207-T221 HydrophobicContact CG-CG2 4.08Å; M207-T221 HydrophobicContact SD-CG2 3.51Å; M207-T221 VanDerWaalsContact SD-CG2 3.51Å; M207-L222 WeakPolarHBondContact CA-O 3.45Å; M207-K223 HydrophobicContact CE-CD 4.42Å; M207-K223 HydrophobicContact CE-CG 4.29Å; M207-K223 HydrophobicContact CG-CG 4.28Å; M207-K223 HydrophobicContact SD-CG 4.42Å
208	V	87.3	Confident	88.9	Confident	1 Å²	1	40 Å²	40	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.8	164.6	175.9	0	0	0	0	108.1	S201 A202 L222 A230 V243	S201-V208 CarbonylContact O-C 3.59Å; S201-V208 VanDerWaalsContact O-CA 3.3Å; S201-V208 WeakPolarHBondContact O-CA 3.36Å; S201-V208 WeakPolarHBondContact O-CG1 3.48Å; A202-V208 HydrophobicContact CB-CG2 4.08Å; V208-L222 HydrophobicContact CB-CB 4.37Å; V208-L222 PolarHBondContact N-O 3.18Å; V208-L222 PolarHBondContact O-N 3.39Å; V208-A230 HydrophobicContact CG2-CB 4.16Å; V208-V243 HydrophobicContact CB-CG2 4.26Å; V208-V243 HydrophobicContact CG1-CG2 4.1Å; V208-V243 HydrophobicContact CG2-CB 4.25Å; V208-V243 HydrophobicContact CG2-CG1 3.51Å; V208-V243 HydrophobicContact CG2-CG2 3.7Å
209	K	90.8	Very high	88.7	Confident	23 Å²	23	41.4 Å²	41.4	10%	0.1	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.2	178.6	-71.7	180	172.9	-74.7	0	110.2	G182 A200 S201 W211 E220 T221	G182-K209 VanDerWaalsContact O-CE 3.23Å; G182-K209 WeakPolarHBondContact O-CE 3.47Å; A200-K209 CarbonylContact C-O 3.52Å; A200-K209 WeakPolarHBondContact CA-O 3.31Å; S201-K209 PolarHBondContact N-O 2.87Å; S201-K209 PolarHBondContact O-N 3.5Å; S201-K209 PolarHBondContact OG-O 3.3Å; K209-W211 HydrophobicContact CB-CZ2 3.83Å; K209-W211 HydrophobicContact CD-CH2 3.95Å; K209-W211 HydrophobicContact CD-CZ2 3.48Å; K209-W211 VanDerWaalsContact CD-CZ2 3.48Å; K209-W211 HydrophobicContact CG-CZ2 4.3Å; K209-E220 WeakPolarHBondContact CA-O 3.43Å; K209-T221 HydrophobicContact CG-CG2 4.2Å; K209-T221 PolarHBondContact NZ-OG1 2.92Å
210	V	92.5	Very high	88.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.5	171.9	-173	0	0	0	0	107.9	W198 L199 L219 E220 I241	W198-V210 HydrophobicContact CB-CG1 4.07Å; W198-V210 HydrophobicContact CG-CG1 4.34Å; L199-V210 CarbonylContact O-C 3.57Å; L199-V210 WeakPolarHBondContact O-CA 3.4Å; V210-L219 PolarHBondContact O-N 2.95Å; V210-E220 HydrophobicContact CB-CB 4.31Å; V210-E220 HydrophobicContact CG2-CB 4.45Å; V210-E220 PolarHBondContact N-O 2.8Å; V210-E220 PolarHBondContact O-N 3.14Å; V210-I241 HydrophobicContact CG2-CD1 3.37Å
211	W	95.8	Very high	88.1	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	148.3	-176.2	-49.9	89.8	0	0	0	109.9	L180 K181 H183 W198 L199 S201 K209 K217 C218	L180-W211 HydrophobicContact CB-CD2 4.07Å; L180-W211 HydrophobicContact CB-CE3 3.87Å; L180-W211 HydrophobicContact CB-CH2 4.38Å; L180-W211 HydrophobicContact CB-CZ3 4.03Å; L180-W211 HydrophobicContact CD1-CB 3.85Å; L180-W211 HydrophobicContact CD1-CD2 3.98Å; L180-W211 HydrophobicContact CD1-CE3 4.44Å; L180-W211 HydrophobicContact CD1-CG 3.7Å; L180-W211 HydrophobicContact CD2-CB 4.3Å; L180-W211 HydrophobicContact CD2-CD2 4.41Å; L180-W211 HydrophobicContact CD2-CE3 4.1Å; L180-W211 HydrophobicContact CG-CD2 4.39Å; L180-W211 HydrophobicContact CG-CE3 4.37Å; K181-W211 WeakPolarHBondContact O-CH2 3.42Å; K181-W211 WeakPolarHBondContact O-CZ3 2.9Å; H183-W211 AromaticContact CD2-CZ2 3.78Å; W198-W211 CarbonylContact C-O 3.52Å; W198-W211 WeakPolarHBondContact CA-O 3.44Å; L199-W211 HydrophobicContact CB-CB 4.46Å; L199-W211 PolarHBondContact N-O 2.76Å; L199-W211 VanDerWaalsContact O-CD1 3.24Å; L199-W211 PolarHBondContact O-N 2.83Å; S201-W211 PolarHBondContact OG-NE1 2.64Å; K209-W211 HydrophobicContact CB-CZ2 3.83Å; K209-W211 HydrophobicContact CD-CH2 3.95Å; K209-W211 HydrophobicContact CD-CZ2 3.48Å; K209-W211 VanDerWaalsContact CD-CZ2 3.48Å; K209-W211 HydrophobicContact CG-CZ2 4.3Å; W211-K217 WeakPolarHBondContact CA-O 3.42Å; W211-C218 HydrophobicContact CD2-CB 4.45Å; W211-C218 HydrophobicContact CE3-CB 3.73Å; W211-C218 HydrophobicContact CH2-CB 4.24Å; W211-C218 HydrophobicContact CZ3-CB 3.61Å
212	D	93.9	Very high	87.7	Confident	32 Å²	32	49.1 Å²	49.1	17%	0.171	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.3	166.2	-178.1	-66	0	0	0	109.3	N214 T215 G216 K217 L219	D212-N214 PolarHBondContact O-N 2.59Å; D212-N214 WeakPolarHBondContact OD1-CA 3.26Å; D212-N214 WeakPolarHBondContact OD1-CB 3.32Å; D212-N214 PolarHBondContact OD1-N 3.38Å; D212-T215 WeakPolarHBondContact CB-OG1 3.38Å; D212-T215 VanDerWaalsContact CG-OG1 3.23Å; D212-T215 PolarHBondContact OD1-N 2.79Å; D212-T215 PolarHBondContact OD1-OG1 3.22Å; D212-T215 VanDerWaalsContact OD1-OG1 3.04Å; D212-G216 VanDerWaalsContact O-CA 3.26Å; D212-G216 WeakPolarHBondContact O-CA 3.31Å; D212-G216 PolarHBondContact O-N 3.48Å; D212-K217 PolarHBondContact N-O 3.2Å; D212-L219 HydrophobicContact CB-CD1 3.99Å; D212-L219 HydrophobicContact CB-CD2 4.09Å; D212-L219 HydrophobicContact CB-CG 3.99Å
213	C	91.2	Very high	87	Confident	9 Å²	9	56.8 Å²	56.8	6%	0.061	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.6	-176.2	-69.5	0	0	0	0	114.2	I168 I178 E196 L197	I168-C213 HydrophobicContact CD1-CB 4.39Å; I178-C213 WeakPolarHBondContact CD1-O 3.44Å; E196-C213 WeakPolarHBondContact O-CB 3.25Å; L197-C213 PolarHBondContact O-N 3.33Å
214	N	90.9	Very high	85.9	Confident	120 Å²	120	58 Å²	58	64%	0.642	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-39	179.9	-65.1	-33.9	0	0	0	111.4	D212	D212-N214 PolarHBondContact O-N 2.59Å; D212-N214 WeakPolarHBondContact OD1-CA 3.26Å; D212-N214 WeakPolarHBondContact OD1-CB 3.32Å; D212-N214 PolarHBondContact OD1-N 3.38Å
215	T	92.8	Very high	84.4	Confident	82 Å²	82	57.2 Å²	57.2	50%	0.503	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-18.8	-175.2	65.2	0	0	0	0	113.2	D212 K217	D212-T215 WeakPolarHBondContact CB-OG1 3.38Å; D212-T215 VanDerWaalsContact CG-OG1 3.23Å; D212-T215 PolarHBondContact OD1-N 2.79Å; D212-T215 PolarHBondContact OD1-OG1 3.22Å; D212-T215 VanDerWaalsContact OD1-OG1 3.04Å; T215-K217 PolarHBondContact O-N 2.87Å; T215-K217 PolarHBondContact OG1-N 2.77Å
216	G	91.9	Very high	83.3	Confident	16 Å²	16	61.5 Å²	61.5	17%	0.165	33%	0.333	C	S	.	.			trans	72	8.4	-173.9	0	0	0	0	0	114.9	L180 D212	L180-G216 WeakPolarHBondContact CD2-O 3.19Å; D212-G216 VanDerWaalsContact O-CA 3.26Å; D212-G216 WeakPolarHBondContact O-CA 3.31Å; D212-G216 PolarHBondContact O-N 3.48Å
217	K	93.4	Very high	82.3	Confident	148 Å²	148	55.5 Å²	55.5	64%	0.643	31%	0.312	S	S	*	.			trans	-77.9	140.2	-179.5	-68.9	-177.6	177.8	178.6	0	111.2	W211 D212 T215 L219	W211-K217 WeakPolarHBondContact CA-O 3.42Å; D212-K217 PolarHBondContact N-O 3.2Å; T215-K217 PolarHBondContact O-N 2.87Å; T215-K217 PolarHBondContact OG1-N 2.77Å; K217-L219 PolarHBondContact O-N 3.45Å
218	C	93.4	Very high	81.2	Confident	51 Å²	51	57.5 Å²	57.5	35%	0.345	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.7	168.1	-173	0	0	0	0	108.5	W211 E220	W211-C218 HydrophobicContact CD2-CB 4.45Å; W211-C218 HydrophobicContact CE3-CB 3.73Å; W211-C218 HydrophobicContact CH2-CB 4.24Å; W211-C218 HydrophobicContact CZ3-CB 3.61Å; C218-E220 PolarHBondContact SG-O 3.05Å
219	L	90.4	Very high	80.1	Confident	82 Å²	82	58.5 Å²	58.5	43%	0.429	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-44.8	178.8	-62.4	178.2	0	0	0	111.2	V210 D212 K217	V210-L219 PolarHBondContact O-N 2.95Å; D212-L219 HydrophobicContact CB-CD1 3.99Å; D212-L219 HydrophobicContact CB-CD2 4.09Å; D212-L219 HydrophobicContact CB-CG 3.99Å; K217-L219 PolarHBondContact O-N 3.45Å
220	E	86.6	Confident	79	Confident	67 Å²	67	57.4 Å²	57.4	31%	0.313	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	149.7	-176	-71.3	-176.4	-174.7	0	0	111.8	K209 V210 C218 R256	K209-E220 WeakPolarHBondContact CA-O 3.43Å; V210-E220 HydrophobicContact CB-CB 4.31Å; V210-E220 HydrophobicContact CG2-CB 4.45Å; V210-E220 PolarHBondContact N-O 2.8Å; V210-E220 PolarHBondContact O-N 3.14Å; C218-E220 PolarHBondContact SG-O 3.05Å; E220-R256 IonicContact OE1-CZ 2.74Å; E220-R256 VanDerWaalsContact OE1-CZ 3.29Å; E220-R256 IonicContact OE1-NE 2.73Å; E220-R256 IonicContact OE1-NH1 3.29Å; E220-R256 PolarHBondContact OE1-NH1 2.93Å; E220-R256 VanDerWaalsContact OE1-NH1 3.13Å; E220-R256 IonicContact OE1-NH2 2.7Å; E220-R256 IonicContact OE2-CZ 3.18Å; E220-R256 IonicContact OE2-NE 3.68Å; E220-R256 IonicContact OE2-NH1 3.47Å; E220-R256 PolarHBondContact OE2-NH1 2.88Å
221	T	87.3	Confident	78.1	Confident	55 Å²	55	61 Å²	61	34%	0.337	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	103.5	169.1	-59.9	0	0	0	0	108	M207 K209 K223	M207-T221 HydrophobicContact CB-CG2 3.9Å; M207-T221 HydrophobicContact CG-CG2 4.08Å; M207-T221 HydrophobicContact SD-CG2 3.51Å; M207-T221 VanDerWaalsContact SD-CG2 3.51Å; K209-T221 HydrophobicContact CG-CG2 4.2Å; K209-T221 PolarHBondContact NZ-OG1 2.92Å; T221-K223 PolarHBondContact O-N 3.18Å
222	L	81.4	Confident	77.2	Confident	41 Å²	41	62.6 Å²	62.6	22%	0.215	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	108.9	178.2	-56.3	176	0	0	0	108.3	M207 V208	M207-L222 WeakPolarHBondContact CA-O 3.45Å; V208-L222 HydrophobicContact CB-CB 4.37Å; V208-L222 PolarHBondContact N-O 3.18Å; V208-L222 PolarHBondContact O-N 3.39Å
223	K	73.7	Confident	76.6	Confident	160 Å²	160	61.1 Å²	61.1	70%	0.696	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	116.7	172.6	-69	-177	-179.1	179	0	109	M207 T221	M207-K223 HydrophobicContact CE-CD 4.42Å; M207-K223 HydrophobicContact CE-CG 4.29Å; M207-K223 HydrophobicContact CG-CG 4.28Å; M207-K223 HydrophobicContact SD-CG 4.42Å; T221-K223 PolarHBondContact O-N 3.18Å
224	Q	62.2	Low	76.2	Confident	26 Å²	26	61.2 Å²	61.2	12%	0.121	35%	0.345	C	S	.	.			trans	-84.2	116.9	167.4	-93.1	162.3	-27.9	0	0	108.7	R206 V226 L227	R206-Q224 PolarHBondContact O-N 3.48Å; Q224-V226 PolarHBondContact O-N 3.35Å; Q224-L227 HydrophobicContact CB-CB 4.04Å; Q224-L227 HydrophobicContact CB-CD1 4.09Å; Q224-L227 HydrophobicContact CB-CG 4.24Å; Q224-L227 HydrophobicContact CG-CD1 4Å
225	G	48.6	Very low	75.7	Confident	82 Å²	82	56.5 Å²	56.5	85%	0.845	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-3.5	-175	0	0	0	0	0	115.9
226	V	49.3	Very low	75.1	Confident	99 Å²	99	53.6 Å²	53.6	60%	0.6	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.7	11.1	-172.9	-157.4	0	0	0	0	113.8	Q224	Q224-V226 PolarHBondContact O-N 3.35Å
227	L	53.3	Low	74.3	Confident	16 Å²	16	58.7 Å²	58.7	8%	0.084	33%	0.331	C	S	.	.			trans	-108.1	126.3	179.3	-74.2	176.4	0	0	0	110.7	R206 Q224 A246 A247	R206-L227 WeakPolarHBondContact CB-O 3.41Å; R206-L227 WeakPolarHBondContact CD-O 3.28Å; R206-L227 WeakPolarHBondContact CG-O 3.48Å; Q224-L227 HydrophobicContact CB-CB 4.04Å; Q224-L227 HydrophobicContact CB-CD1 4.09Å; Q224-L227 HydrophobicContact CB-CG 4.24Å; Q224-L227 HydrophobicContact CG-CD1 4Å; L227-A246 VanDerWaalsContact CD2-O 3.3Å; L227-A246 WeakPolarHBondContact CD2-O 3.35Å; L227-A247 VanDerWaalsContact CD2-CA 3.48Å; L227-A247 HydrophobicContact CD2-CB 3.17Å; L227-A247 HydrophobicContact CG-CB 4.2Å
228	D	59.3	Low	73.7	Confident	96 Å²	96	56.3 Å²	56.3	51%	0.513	33%	0.326	S	S	.	.	S	Bend	trans	-80.4	-32.5	179.2	-147.6	16.8	0	0	0	111.7	R206 A246	R206-D228 IonicContact CZ-OD1 2.85Å; R206-D228 IonicContact NE-OD1 3.79Å; R206-D228 PolarHBondContact NE-OD1 3.42Å; R206-D228 IonicContact NH2-OD1 3.49Å; R206-D228 PolarHBondContact NH2-OD1 2.82Å; D228-A246 PolarHBondContact N-O 3.27Å
229	V	63	Low	72.9	Confident	23 Å²	23	55 Å²	55	14%	0.139	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	128.7	176	179	0	0	0	0	110.4	Y204 G245 A246	Y204-V229 HydrophobicContact CD1-CB 4.42Å; Y204-V229 HydrophobicContact CD1-CG1 3.87Å; Y204-V229 HydrophobicContact CD1-CG2 3.6Å; Y204-V229 HydrophobicContact CE1-CG1 4.02Å; Y204-V229 HydrophobicContact CE1-CG2 4.05Å; Y204-V229 HydrophobicContact CG-CG1 4.23Å; Y204-V229 HydrophobicContact CG-CG2 4.46Å; V229-G245 CarbonylContact O-C 3.47Å; V229-G245 WeakPolarHBondContact O-CA 3.45Å; V229-A246 PolarHBondContact O-N 2.97Å
230	A	68.1	Low	72.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.6	167.7	0	0	0	0	0	108.9	A202 G203 V208 V243	A202-A230 HydrophobicContact CB-CB 3.73Å; G203-A230 PolarHBondContact O-N 2.98Å; V208-A230 HydrophobicContact CG2-CB 4.16Å; A230-V243 HydrophobicContact CB-CG1 4.14Å
231	H	73.9	Confident	71.9	Confident	74 Å²	74	50.6 Å²	50.6	34%	0.343	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-38.7	-174	-71.3	-46.5	0	0	0	113.2	S244 A246	H231-S244 WeakPolarHBondContact CA-O 3.25Å; H231-S244 PolarHBondContact N-O 2.97Å; H231-A246 PolarHBondContact CD2-N 2.99Å; H231-A246 VanDerWaalsContact CD2-N 3.35Å; H231-A246 VanDerWaalsContact NE2-CB 3.32Å; H231-A246 WeakPolarHBondContact NE2-CB 3.47Å
232	T	75.8	Confident	71.5	Confident	36 Å²	36	51.3 Å²	51.3	22%	0.221	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145	-178.9	174.9	0	0	0	0	111.5	G26 S189 V243 S244	G26-T232 VanDerWaalsContact CA-OG1 3.32Å; G26-T232 WeakPolarHBondContact CA-OG1 3.49Å; S189-T232 WeakPolarHBondContact OG-CA 3.41Å; T232-V243 WeakPolarHBondContact O-CA 3.49Å; T232-S244 PolarHBondContact N-O 2.7Å; T232-S244 PolarHBondContact O-N 3.28Å
233	C	81.9	Confident	71.1	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.3	164.9	56.5	0	0	0	0	109.6	S189 A191 A200 A202 L242	S189-C233 PolarHBondContact OG-N 2.73Å; S189-C233 VanDerWaalsContact OG-N 3.16Å; A191-C233 WeakPolarHBondContact CB-O 3.42Å; A200-C233 HydrophobicContact CB-CB 4.3Å; A202-C233 HydrophobicContact CB-CB 4.09Å; C233-L242 CarbonylContact C-O 3.5Å; C233-L242 VanDerWaalsContact CA-O 3.25Å; C233-L242 WeakPolarHBondContact CA-O 3.47Å
234	A	83.8	Confident	71	Confident	11 Å²	11	44.5 Å²	44.5	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	148.8	174.6	0	0	0	0	0	109.9	C24 I241 L242	C24-A234 HydrophobicContact CB-CB 4.29Å; C24-A234 WeakPolarHBondContact SG-CB 3.36Å; A234-I241 CarbonylContact O-C 3.5Å; A234-I241 WeakPolarHBondContact O-CA 3.39Å; A234-L242 PolarHBondContact N-O 3.28Å; A234-L242 PolarHBondContact O-N 3.15Å
235	F	80.8	Confident	71.2	Confident	22 Å²	22	44.1 Å²	44.1	10%	0.096	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.8	166.1	-77.7	-90	0	0	0	110.9	A191 F192 S193 W198 A200 K240 I241	A191-F235 HydrophobicContact CB-CD2 4.24Å; A191-F235 WeakPolarHBondContact O-CE2 3.41Å; F192-F235 VanDerWaalsContact C-CD2 3.42Å; F192-F235 VanDerWaalsContact O-CD2 3.27Å; F192-F235 WeakPolarHBondContact O-CD2 3.48Å; S193-F235 VanDerWaalsContact CA-CD2 3.49Å; W198-F235 HydrophobicContact CB-CZ 4.22Å; W198-F235 HydrophobicContact CE3-CE1 4.48Å; A200-F235 HydrophobicContact CB-CD2 4.11Å; A200-F235 HydrophobicContact CB-CE2 3.4Å; A200-F235 VanDerWaalsContact CB-CE2 3.4Å; A200-F235 HydrophobicContact CB-CZ 3.9Å; F235-K240 CarbonylContact C-O 3.58Å; F235-K240 VanDerWaalsContact CA-O 3.26Å; F235-K240 WeakPolarHBondContact CA-O 3.5Å; F235-I241 HydrophobicContact CD1-CG1 3.72Å; F235-I241 HydrophobicContact CE1-CD1 3.82Å; F235-I241 HydrophobicContact CE1-CG1 3.31Å; F235-I241 HydrophobicContact CE2-CG1 4.45Å; F235-I241 HydrophobicContact CG-CG1 4.45Å; F235-I241 HydrophobicContact CZ-CD1 3.84Å; F235-I241 HydrophobicContact CZ-CG1 3.73Å
236	T	78.6	Confident	71.3	Confident	21 Å²	21	42.5 Å²	42.5	13%	0.129	26%	0.255	C	S	.	.			trans	-79.9	160.9	164.3	50.5	0	0	0	0	110.3	P194 D238 G239 K240 L242	P194-T236 WeakPolarHBondContact CG-O 3.38Å; T236-D238 WeakPolarHBondContact CB-OD1 3.2Å; T236-D238 PolarHBondContact O-N 3.1Å; T236-D238 VanDerWaalsContact O-N 3.16Å; T236-D238 PolarHBondContact OG1-OD1 2.8Å; T236-G239 PolarHBondContact O-N 3.48Å; T236-K240 PolarHBondContact N-O 3.4Å; T236-K240 WeakPolarHBondContact OG1-CA 3.36Å; T236-K240 VanDerWaalsContact OG1-CB 3.27Å; T236-K240 WeakPolarHBondContact OG1-CB 3.46Å; T236-K240 PolarHBondContact OG1-N 3.29Å; T236-K240 PolarHBondContact OG1-O 2.91Å; T236-L242 HydrophobicContact CG2-CD1 3.56Å; T236-L242 HydrophobicContact CG2-CD2 4.32Å; T236-L242 HydrophobicContact CG2-CG 3.7Å
237	P	76.4	Confident	71.2	Confident	123 Å²	123	38.7 Å²	38.7	80%	0.799	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.7	177.3	-26.3	35.7	0	0	0	114.4	G239	P237-G239 PolarHBondContact O-N 2.86Å
238	D	80	Confident	70.7	Confident	98 Å²	98	45 Å²	45	52%	0.524	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	9.5	174.7	68.8	-25.5	0	0	0	113.5	T236 K240	T236-D238 WeakPolarHBondContact CB-OD1 3.2Å; T236-D238 PolarHBondContact O-N 3.1Å; T236-D238 VanDerWaalsContact O-N 3.16Å; T236-D238 PolarHBondContact OG1-OD1 2.8Å; D238-K240 VanDerWaalsContact OD2-CD 3.27Å; D238-K240 WeakPolarHBondContact OD2-CD 3.3Å; D238-K240 WeakPolarHBondContact OD2-CE 3.36Å; D238-K240 IonicContact OD2-NZ 2.88Å; D238-K240 PolarHBondContact OD2-NZ 3.41Å
239	G	75.9	Confident	69.7	Low	23 Å²	23	49.8 Å²	49.8	24%	0.237	29%	0.288	C	S	.	.	S	Bend	trans	80.7	10.7	174.2	0	0	0	0	0	115.2	T236 P237	T236-G239 PolarHBondContact O-N 3.48Å; P237-G239 PolarHBondContact O-N 2.86Å
240	K	79.1	Confident	68.6	Low	50 Å²	50	52.5 Å²	52.5	22%	0.217	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-81.8	155	173	-61.6	170.6	-178.8	142.7	0	110.7	F235 T236 D238 R256	F235-K240 CarbonylContact C-O 3.58Å; F235-K240 VanDerWaalsContact CA-O 3.26Å; F235-K240 WeakPolarHBondContact CA-O 3.5Å; T236-K240 PolarHBondContact N-O 3.4Å; T236-K240 WeakPolarHBondContact OG1-CA 3.36Å; T236-K240 VanDerWaalsContact OG1-CB 3.27Å; T236-K240 WeakPolarHBondContact OG1-CB 3.46Å; T236-K240 PolarHBondContact OG1-N 3.29Å; T236-K240 PolarHBondContact OG1-O 2.91Å; D238-K240 VanDerWaalsContact OD2-CD 3.27Å; D238-K240 WeakPolarHBondContact OD2-CD 3.3Å; D238-K240 WeakPolarHBondContact OD2-CE 3.36Å; D238-K240 IonicContact OD2-NZ 2.88Å; D238-K240 PolarHBondContact OD2-NZ 3.41Å; K240-R256 WeakPolarHBondContact CG-O 3.24Å
241	I	78.6	Confident	67.4	Low	7 Å²	7	62.2 Å²	62.2	4%	0.036	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121	178.7	-56.6	172.6	0	0	0	109.1	A200 V210 A234 F235 V243	A200-I241 HydrophobicContact CB-CD1 4.22Å; A200-I241 HydrophobicContact CB-CG2 4.24Å; V210-I241 HydrophobicContact CG2-CD1 3.37Å; A234-I241 CarbonylContact O-C 3.5Å; A234-I241 WeakPolarHBondContact O-CA 3.39Å; F235-I241 HydrophobicContact CD1-CG1 3.72Å; F235-I241 HydrophobicContact CE1-CD1 3.82Å; F235-I241 HydrophobicContact CE1-CG1 3.31Å; F235-I241 HydrophobicContact CE2-CG1 4.45Å; F235-I241 HydrophobicContact CG-CG1 4.45Å; F235-I241 HydrophobicContact CZ-CD1 3.84Å; F235-I241 HydrophobicContact CZ-CG1 3.73Å; I241-V243 HydrophobicContact CG2-CG2 3.75Å
242	L	77.4	Confident	66.1	Low	70 Å²	70	67 Å²	67	37%	0.366	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.7	164.9	-63.5	175.6	0	0	0	108.8	C233 A234 T236 Q253	C233-L242 CarbonylContact C-O 3.5Å; C233-L242 VanDerWaalsContact CA-O 3.25Å; C233-L242 WeakPolarHBondContact CA-O 3.47Å; A234-L242 PolarHBondContact N-O 3.28Å; A234-L242 PolarHBondContact O-N 3.15Å; T236-L242 HydrophobicContact CG2-CD1 3.56Å; T236-L242 HydrophobicContact CG2-CD2 4.32Å; T236-L242 HydrophobicContact CG2-CG 3.7Å; L242-Q253 HydrophobicContact CD2-CB 4.38Å; L242-Q253 HydrophobicContact CD2-CG 3.82Å
243	V	74.6	Confident	64.7	Low	14 Å²	14	71.8 Å²	71.8	9%	0.085	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.4	175.3	-175.8	0	0	0	0	107.5	V208 A230 T232 I241	V208-V243 HydrophobicContact CB-CG2 4.26Å; V208-V243 HydrophobicContact CG1-CG2 4.1Å; V208-V243 HydrophobicContact CG2-CB 4.25Å; V208-V243 HydrophobicContact CG2-CG1 3.51Å; V208-V243 HydrophobicContact CG2-CG2 3.7Å; A230-V243 HydrophobicContact CB-CG1 4.14Å; T232-V243 WeakPolarHBondContact O-CA 3.49Å; I241-V243 HydrophobicContact CG2-CG2 3.75Å
244	S	71.1	Confident	63.1	Low	44 Å²	44	74.6 Å²	74.6	31%	0.308	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.6	168	172.2	0	0	0	0	108.8	H231 T232	H231-S244 WeakPolarHBondContact CA-O 3.25Å; H231-S244 PolarHBondContact N-O 2.97Å; T232-S244 PolarHBondContact N-O 2.7Å; T232-S244 PolarHBondContact O-N 3.28Å
245	G	65	Low	60.8	Low	17 Å²	17	78.1 Å²	78.1	18%	0.175	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	165.2	176.7	0	0	0	0	0	110.6	V229 A247	V229-G245 CarbonylContact O-C 3.47Å; V229-G245 WeakPolarHBondContact O-CA 3.45Å; G245-A247 PolarHBondContact O-N 3.37Å; G245-A247 VanDerWaalsContact O-N 3.12Å
246	A	52.3	Low	59	Low	48 Å²	48	80.5 Å²	80.5	40%	0.397	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	100.4	168.7	0	0	0	0	0	108.8	L227 D228 V229 H231	L227-A246 VanDerWaalsContact CD2-O 3.3Å; L227-A246 WeakPolarHBondContact CD2-O 3.35Å; D228-A246 PolarHBondContact N-O 3.27Å; V229-A246 PolarHBondContact O-N 2.97Å; H231-A246 PolarHBondContact CD2-N 2.99Å; H231-A246 VanDerWaalsContact CD2-N 3.35Å; H231-A246 VanDerWaalsContact NE2-CB 3.32Å; H231-A246 WeakPolarHBondContact NE2-CB 3.47Å
247	A	47	Very low	56.8	Low	19 Å²	19	85.3 Å²	85.3	16%	0.157	45%	0.452	C	S	.	.			trans	-114	145.3	149.9	0	0	0	0	0	104.6	L227 G245 Q249	L227-A247 VanDerWaalsContact CD2-CA 3.48Å; L227-A247 HydrophobicContact CD2-CB 3.17Å; L227-A247 HydrophobicContact CG-CB 4.2Å; G245-A247 PolarHBondContact O-N 3.37Å; G245-A247 VanDerWaalsContact O-N 3.12Å; A247-Q249 VanDerWaalsContact C-N 3.27Å; A247-Q249 PolarHBondContact O-N 3.1Å
248	D	43.3	Very low	54.8	Low	150 Å²	150	83.8 Å²	83.8	80%	0.802	44%	0.444	S	S	*	.	S	Bend	trans	-31.6	94.6	149.8	-23.4	-20	0	0	0	108.6	T250	D248-T250 PolarHBondContact O-N 2.97Å
249	Q	37.3	Very low	52.5	Low	196 Å²	196	87.9 Å²	87.9	92%	0.916	46%	0.457	S	S	*	.	S	Bend	trans	51.9	14.6	168.1	-61.1	-175.1	-3	0	0	121.9	A247	A247-Q249 VanDerWaalsContact C-N 3.27Å; A247-Q249 PolarHBondContact O-N 3.1Å
250	T	39.8	Very low	50.2	Low	80 Å²	80	91.4 Å²	91.4	49%	0.491	48%	0.478	S	S	.	.			trans	-125.1	109.9	179.1	55.5	0	0	0	0	115.4	D248	D248-T250 PolarHBondContact O-N 2.97Å
251	R	44	Very low	48	Very low	204 Å²	204	95 Å²	95	77%	0.77	51%	0.506	S	S	*	.			trans	-76.2	133.5	165.2	-68	-171.4	-179.8	-148.3	-1	109.5
252	R	46.6	Very low	46	Very low	173 Å²	173	105.1 Å²	105.1	65%	0.653	54%	0.544	S	S	*	.			trans	-126.2	133.5	174.3	-71.1	-170.4	-178.4	-171.3	1.3	111.6
253	Q	44.5	Very low	43.9	Very low	137 Å²	137	108.9 Å²	108.9	64%	0.64	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.3	130.4	168.8	180	174	1.2	0	0	108.3	L242	L242-Q253 HydrophobicContact CD2-CB 4.38Å; L242-Q253 HydrophobicContact CD2-CG 3.82Å
254	I	49.3	Very low	42.2	Very low	60 Å²	60	113.9 Å²	113.9	31%	0.308	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.8	117.6	173.4	-61	169.3	0	0	0	107.4
255	S	34.8	Very low	40.6	Very low	84 Å²	84	120.9 Å²	120.9	59%	0.587	63%	0.625	S	S	*	*			trans	-87.8	122.4	174.1	55.5	0	0	0	0	110.3
256	R	43.6	Very low	39.3	Very low	73 Å²	73	130.2 Å²	130.2	28%	0.275	68%	0.679	S	S	.	*			trans	-99.8	131.1	153.6	-88.6	179.4	68.8	177.7	-5.6	108.5	E220 K240	E220-R256 IonicContact OE1-CZ 2.74Å; E220-R256 VanDerWaalsContact OE1-CZ 3.29Å; E220-R256 IonicContact OE1-NE 2.73Å; E220-R256 IonicContact OE1-NH1 3.29Å; E220-R256 PolarHBondContact OE1-NH1 2.93Å; E220-R256 VanDerWaalsContact OE1-NH1 3.13Å; E220-R256 IonicContact OE1-NH2 2.7Å; E220-R256 IonicContact OE2-CZ 3.18Å; E220-R256 IonicContact OE2-NE 3.68Å; E220-R256 IonicContact OE2-NH1 3.47Å; E220-R256 PolarHBondContact OE2-NH1 2.88Å; K240-R256 WeakPolarHBondContact CG-O 3.24Å
257	T	31.4	Very low	38.6	Very low	122 Å²	122	134.3 Å²	134.3	75%	0.748	69%	0.693	S	S	*	*			trans	-102.5	113.2	159.1	48	0	0	0	0	106.3	K259	T257-K259 PolarHBondContact O-N 2.68Å
258	S	35.8	Very low	38.2	Very low	91 Å²	91	140.4 Å²	140.4	64%	0.636	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-65.5	121.9	166	47.9	0	0	0	0	107.6
259	K	30.7	Very low	37.9	Very low	184 Å²	184	139.8 Å²	139.8	80%	0.8	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-74.8	126.9	157.8	-80.7	-178	177.2	175.6	0	105.8	T257	T257-K259 PolarHBondContact O-N 2.68Å
260	S	28.4	Very low	37.9	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-54.1	148	165.8	56.3	0	0	0	0	109.1	R262	S260-R262 PolarHBondContact O-N 3.22Å; S260-R262 VanDerWaalsContact O-N 3.16Å
261	P	32.9	Very low	37.8	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-54.2	124.4	163	-16.3	29.3	0	0	0	107	D263	P261-D263 PolarHBondContact O-N 2.93Å
262	R	36.6	Very low	37.4	Very low	220 Å²	220	135.8 Å²	135.8	83%	0.83	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-56.2	132.2	175.4	-68.3	178.4	-169.8	175.6	2.4	108.2	S260	S260-R262 PolarHBondContact O-N 3.22Å; S260-R262 VanDerWaalsContact O-N 3.16Å
263	D	33.1	Very low	36.7	Very low	150 Å²	150	133.1 Å²	133.1	80%	0.802	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-49.8	129.9	157.8	-70.3	-43.6	0	0	0	108.1	P261 Q265	P261-D263 PolarHBondContact O-N 2.93Å; D263-Q265 PolarHBondContact O-N 3.3Å
264	P	39.3	Very low	36.1	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-61.2	121.7	166.9	-14.5	27.8	0	0	0	107.7	T266	P264-T266 PolarHBondContact O-N 3.14Å; P264-T266 VanDerWaalsContact O-N 3.13Å
265	Q	36.9	Very low	35.1	Very low	191 Å²	191	138.9 Å²	138.9	89%	0.893	76%	0.761	S	S	*	*			trans	-59	114.2	160.9	-75.2	-170.3	-32.4	0	0	108.3	D263	D263-Q265 PolarHBondContact O-N 3.3Å
266	T	37.1	Very low	35.1	Very low	213 Å²	213	143.9 Å²	143.9	100%	1.307	78%	0.776	S	S	*	*			trans	-168.3	0	132.7	42.1	0	0	0	0	108.6	P264	P264-T266 PolarHBondContact O-N 3.14Å; P264-T266 VanDerWaalsContact O-N 3.13Å

Retrieved 266 of 266 residues in 569.4 ms (Link to these results)

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