A0A087X3L3_POEFO Loading...

Histone-lysine N-methyltransferase SETD7

AlphaFold DB , UniProt , Accession A0A087X3L3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 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	25.5	Very low	25.1	Very low	200 Å²	200	144 Å²	144	99%	0.985	78%	0.783	S	S	*	*				0	110.9	0	-86.3	-175.4	-174.3	0	0	108.1	Y3	M1-Y3 PolarHBondContact O-N 3.25Å; M1-Y3 VanDerWaalsContact O-N 3.11Å
2	C	21.4	Very low	25.3	Very low	80 Å²	80	146.5 Å²	146.5	54%	0.541	80%	0.795	S	S	.	*			trans	-64.9	106.4	172.6	-60.4	0	0	0	0	109.4	H4	C2-H4 VanDerWaalsContact C-N 3.27Å; C2-H4 PolarHBondContact O-N 3.43Å; C2-H4 VanDerWaalsContact O-N 3.16Å
3	Y	26.8	Very low	25.2	Very low	169 Å²	169	144 Å²	144	66%	0.663	80%	0.795	S	S	*	*			trans	-76.9	91.2	153.2	-77.7	-84	0	0	0	106.4	M1 A5	M1-Y3 PolarHBondContact O-N 3.25Å; M1-Y3 VanDerWaalsContact O-N 3.11Å; Y3-A5 PolarHBondContact O-N 2.76Å
4	H	23.6	Very low	25.3	Very low	164 Å²	164	140.2 Å²	140.2	76%	0.759	79%	0.792	S	S	*	*			trans	-73.7	106.9	171.2	-84	-25.7	0	0	0	109.3	C2	C2-H4 VanDerWaalsContact C-N 3.27Å; C2-H4 PolarHBondContact O-N 3.43Å; C2-H4 VanDerWaalsContact O-N 3.16Å
5	A	25.6	Very low	25.2	Very low	77 Å²	77	135.3 Å²	135.3	64%	0.636	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-58.8	132.6	151	0	0	0	0	0	108.4	Y3	Y3-A5 PolarHBondContact O-N 2.76Å
6	P	26.8	Very low	25.3	Very low	124 Å²	124	133.9 Å²	133.9	81%	0.805	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68.4	135.6	-175.1	25.5	-31.3	0	0	0	111.4
7	R	24.7	Very low	25.2	Very low	245 Å²	245	129 Å²	129	93%	0.925	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69	126.8	167.1	-77.5	-176.3	176.8	-179.9	0.1	109.7
8	Q	25.7	Very low	25.3	Very low	183 Å²	183	130.9 Å²	130.9	86%	0.855	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-57.9	139.6	167.4	-70.9	-169.9	-25.3	0	0	111.6
9	P	25.3	Very low	25.2	Very low	124 Å²	124	126.8 Å²	126.8	81%	0.805	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-80.7	126	155	11	5.3	0	0	0	109.5	G11	P9-G11 PolarHBondContact O-N 3.48Å
10	T	27.6	Very low	25.3	Very low	147 Å²	147	124.2 Å²	124.2	90%	0.902	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-62.8	124	162.1	49.8	0	0	0	0	110
11	G	23.3	Very low	25.3	Very low	71 Å²	71	124.3 Å²	124.3	73%	0.732	72%	0.721	S	S	*	*			trans	164.8	115.8	168.7	0	0	0	0	0	113.8	P9 S13	P9-G11 PolarHBondContact O-N 3.48Å; G11-S13 PolarHBondContact O-N 3.27Å
12	D	27.5	Very low	25.6	Very low	174 Å²	174	121.3 Å²	121.3	93%	0.93	70%	0.699	S	S	*	*			trans	-44.2	124	179.2	-69.3	-46.3	0	0	0	115.1
13	S	23.3	Very low	25.6	Very low	114 Å²	114	125.4 Å²	125.4	80%	0.797	71%	0.71	S	S	*	*			trans	-160.9	106.6	142.5	50.7	0	0	0	0	109.1	G11 G15	G11-S13 PolarHBondContact O-N 3.27Å; S13-G15 PolarHBondContact O-N 2.77Å; S13-G15 VanDerWaalsContact O-N 3.1Å
14	A	27.2	Very low	25.7	Very low	91 Å²	91	119.6 Å²	119.6	75%	0.752	69%	0.694	S	S	*	*			trans	-67.9	104.8	168.8	0	0	0	0	0	108.2
15	G	23.8	Very low	25.9	Very low	66 Å²	66	116.8 Å²	116.8	68%	0.68	70%	0.698	S	S	*	*			trans	-138.9	106	172.8	0	0	0	0	0	107.7	S13 G17	S13-G15 PolarHBondContact O-N 2.77Å; S13-G15 VanDerWaalsContact O-N 3.1Å; G15-G17 PolarHBondContact O-N 2.69Å
16	L	27.3	Very low	26	Very low	113 Å²	113	118.7 Å²	118.7	59%	0.592	71%	0.707	S	S	*	*			trans	-65.3	84.6	170.4	-72.4	163.2	0	0	0	108.9	D300	L16-D300 HydrophobicContact CD1-CB 3.74Å
17	G	23.4	Very low	26	Very low	51 Å²	51	118 Å²	118	53%	0.526	71%	0.705	S	S	.	*			trans	-121.2	98.5	169.3	0	0	0	0	0	108.1	G15 A19	G15-G17 PolarHBondContact O-N 2.69Å; G17-A19 PolarHBondContact O-N 2.77Å
18	F	26.5	Very low	26.1	Very low	163 Å²	163	118.2 Å²	118.2	72%	0.715	71%	0.706	S	S	*	*			trans	-74.8	69.4	162	-75.1	-85.6	0	0	0	108.2
19	A	24.5	Very low	25.9	Very low	54 Å²	54	113.4 Å²	113.4	45%	0.446	71%	0.706	S	S	.	*			trans	-114.1	105.5	159.1	0	0	0	0	0	104.9	G17 H21	G17-A19 PolarHBondContact O-N 2.77Å; A19-H21 PolarHBondContact O-N 2.79Å
20	C	26.8	Very low	25.8	Very low	74 Å²	74	111 Å²	111	50%	0.5	70%	0.704	S	S	.	*			trans	-62.7	90.7	170	-61.4	0	0	0	0	107.6	Y22	C20-Y22 VanDerWaalsContact C-N 3.32Å; C20-Y22 PolarHBondContact O-N 3.11Å
21	H	25.6	Very low	25.7	Very low	127 Å²	127	112.7 Å²	112.7	59%	0.588	70%	0.704	S	S	*	*			trans	-72.5	90.1	170.5	-75.2	-69.4	0	0	0	108	A19 Q23 D191	A19-H21 PolarHBondContact O-N 2.79Å; H21-Q23 PolarHBondContact O-N 2.9Å; H21-D191 IonicContact CE1-OD2 3.75Å
22	Y	30.3	Very low	25.8	Very low	136 Å²	136	116.5 Å²	116.5	53%	0.533	71%	0.707	S	S	.	*			trans	-73.6	103.9	151	-174.3	-95.4	0	0	0	106.7	C20 N143	C20-Y22 VanDerWaalsContact C-N 3.32Å; C20-Y22 PolarHBondContact O-N 3.11Å; Y22-N143 WeakPolarHBondContact CE1-O 3.44Å
23	Q	22.2	Very low	26.3	Very low	166 Å²	166	112.8 Å²	112.8	78%	0.776	70%	0.695	S	S	*	*			trans	-84.6	123.5	170.2	-75.9	-167.7	-36.5	0	0	109.4	H21	H21-Q23 PolarHBondContact O-N 2.9Å
24	P	28.9	Very low	26.9	Very low	48 Å²	48	114.7 Å²	114.7	31%	0.312	70%	0.696	S	S	.	*			trans	-72.6	129.7	172.6	28.1	-30	0	0	0	109.9	S26 I144	P24-S26 PolarHBondContact O-N 2.81Å; P24-S26 VanDerWaalsContact O-N 3.16Å; P24-I144 HydrophobicContact CB-CG1 4.34Å
25	A	27.6	Very low	27.4	Very low	104 Å²	104	116.3 Å²	116.3	86%	0.86	69%	0.692	S	S	*	*			trans	-65.2	114	167.8	0	0	0	0	0	109.3	S27	A25-S27 PolarHBondContact O-N 3.47Å
26	S	27.1	Very low	28.4	Very low	118 Å²	118	120.9 Å²	120.9	83%	0.825	70%	0.696	S	S	*	*			trans	-57.6	129.6	179.2	61.2	0	0	0	0	112.8	P24	P24-S26 PolarHBondContact O-N 2.81Å; P24-S26 VanDerWaalsContact O-N 3.16Å
27	S	27.9	Very low	29.7	Very low	109 Å²	109	119.2 Å²	119.2	76%	0.762	69%	0.694	S	S	*	*			trans	-78.5	131.9	177.4	60.6	0	0	0	0	114	A25	A25-S27 PolarHBondContact O-N 3.47Å
28	R	26.3	Very low	31.5	Very low	249 Å²	249	121.1 Å²	121.1	94%	0.94	70%	0.695	S	S	*	*			trans	158.6	124.7	140.9	-90	171.8	-173.1	-165.5	4.8	108
29	G	22.1	Very low	33.6	Very low	83 Å²	83	117 Å²	117	86%	0.856	68%	0.678	S	S	*	*			cis	157.8	136.5	4.8	0	0	0	0	0	108.1
30	G	22.8	Very low	36	Very low	74 Å²	74	120.7 Å²	120.7	76%	0.763	69%	0.686	S	S	*	*			trans	122.2	135.8	163.7	0	0	0	0	0	116
31	M	26.4	Very low	39	Very low	182 Å²	182	120.3 Å²	120.3	90%	0.897	68%	0.681	S	S	*	*			trans	90.2	108.7	167.4	-64.5	161.9	173.7	0	0	115
32	D	24.9	Very low	42.2	Very low	151 Å²	151	116.8 Å²	116.8	81%	0.807	67%	0.668	S	S	*	*				74	118.4	78.6	-81.8	-27	0	0	0	112.7
33	S	37.9	Very low	45.3	Very low	95 Å²	95	116.3 Å²	116.3	66%	0.664	67%	0.671	S	S	*	*			trans	58.3	122.5	150.9	60.7	0	0	0	0	120.1
34	D	36.4	Very low	48.8	Very low	154 Å²	154	110.6 Å²	110.6	82%	0.824	66%	0.656	S	S	*	*			trans	68.8	86.3	142.1	-46.8	-19.4	0	0	0	117.5
35	D	37.3	Very low	52	Low	125 Å²	125	111.8 Å²	111.8	67%	0.668	66%	0.664	S	S	*	*			trans	-137.2	87.3	150.8	-158.1	21.7	0	0	0	108.4	S37	D35-S37 PolarHBondContact O-N 3.25Å
36	E	45.3	Very low	55.2	Low	163 Å²	163	111.5 Å²	111.5	76%	0.762	65%	0.648	S	S	*	*			trans	-66.4	108.4	172	-69.9	179.1	167.9	0	0	108	V38	E36-V38 WeakPolarHBondContact O-CG2 3.41Å; E36-V38 PolarHBondContact O-N 2.8Å
37	S	52.9	Low	58.5	Low	78 Å²	78	107.2 Å²	107.2	55%	0.545	62%	0.616	S	S	.	*			trans	-64.3	91.9	160.2	53.8	0	0	0	0	107.2	D35 E39	D35-S37 PolarHBondContact O-N 3.25Å; S37-E39 PolarHBondContact O-N 3.44Å; S37-E39 VanDerWaalsContact O-N 3.16Å
38	V	61.4	Low	61.7	Low	91 Å²	91	111.6 Å²	111.6	55%	0.552	62%	0.624	S	S	*	*			trans	-62.7	119.3	-175.1	-164.5	0	0	0	0	108.5	E36 E40	E36-V38 WeakPolarHBondContact O-CG2 3.41Å; E36-V38 PolarHBondContact O-N 2.8Å; V38-E40 PolarHBondContact O-N 3.15Å
39	E	70.4	Confident	64.9	Low	76 Å²	76	106 Å²	106	36%	0.355	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.4	119.8	171.3	-59.1	-173.2	161.2	0	0	108.2	S37 V42 V58 Y60	S37-E39 PolarHBondContact O-N 3.44Å; S37-E39 VanDerWaalsContact O-N 3.16Å; E39-V42 HydrophobicContact CB-CG2 4.37Å; E39-V42 WeakPolarHBondContact OE2-CG2 3.36Å; E39-V58 HydrophobicContact CB-CG1 3.99Å; E39-V58 HydrophobicContact CG-CG1 3.65Å; E39-Y60 HydrophobicContact CG-CD1 4.33Å; E39-Y60 HydrophobicContact CG-CE1 4.05Å
40	E	75.4	Confident	68.2	Low	131 Å²	131	104.2 Å²	104.2	61%	0.612	59%	0.594	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.8	-37	-177.5	-72.7	-166.6	166.8	0	0	111.4	V38 T59 S61	V38-E40 PolarHBondContact O-N 3.15Å; E40-T59 PolarHBondContact N-O 2.79Å; E40-S61 VanDerWaalsContact CD-CA 3.49Å; E40-S61 WeakPolarHBondContact OE1-CA 3.38Å; E40-S61 WeakPolarHBondContact OE1-CB 3.47Å
41	V	89.3	Confident	71.6	Confident	67 Å²	67	104.4 Å²	104.4	41%	0.406	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-145.5	121.2	-177	-172.3	0	0	0	0	109.9	E43 T59	V41-E43 HydrophobicContact CG1-CG 4.04Å; V41-T59 PolarHBondContact N-O 3.25Å; V41-T59 PolarHBondContact O-N 3.23Å
42	V	93.2	Very high	74.8	Confident	52 Å²	52	96.2 Å²	96.2	32%	0.315	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122	169	-178.6	0	0	0	0	108.6	E39 L46 P52 C56 V58	E39-V42 HydrophobicContact CB-CG2 4.37Å; E39-V42 WeakPolarHBondContact OE2-CG2 3.36Å; V42-L46 HydrophobicContact CG1-CD2 4.02Å; V42-P52 HydrophobicContact CG1-CB 4.4Å; V42-P52 HydrophobicContact CG1-CG 3.99Å; V42-P52 HydrophobicContact CG2-CG 4.34Å; V42-C56 HydrophobicContact CG1-CB 4.49Å; V42-V58 HydrophobicContact CG1-CG2 4.42Å; V42-V58 HydrophobicContact CG2-CG2 4.26Å
43	E	96	Very high	78.3	Confident	127 Å²	127	92.5 Å²	92.5	59%	0.593	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.8	172.7	-60.2	-174.8	167.4	0	0	109.4	V41 C56 T57	V41-E43 HydrophobicContact CG1-CG 4.04Å; E43-C56 CarbonylContact O-C 3.56Å; E43-C56 WeakPolarHBondContact O-CA 3.06Å; E43-T57 PolarHBondContact N-O 2.99Å; E43-T57 PolarHBondContact O-N 2.96Å
44	G	95.2	Very high	81	Confident	45 Å²	45	89 Å²	89	46%	0.464	49%	0.492	S	S	.	.	S	Bend	trans	157.2	-176.4	179.9	0	0	0	0	0	112.7
45	P	96.2	Very high	84	Confident	74 Å²	74	86.9 Å²	86.9	48%	0.481	48%	0.476	S	S	.	.			trans	-67.2	146	173.1	-5.9	21	0	0	0	110.8	H53 F55 C56	P45-H53 CarbonylContact C-O 3.54Å; P45-H53 WeakPolarHBondContact CB-O 3.4Å; P45-H53 WeakPolarHBondContact CD-O 3.43Å; P45-H53 WeakPolarHBondContact CG-O 3.44Å; P45-H53 PolarHBondContact O-N 2.83Å; P45-F55 WeakPolarHBondContact CD-O 3.46Å; P45-C56 PolarHBondContact O-SG 3.43Å
46	L	95.3	Very high	86.8	Confident	97 Å²	97	81 Å²	81	51%	0.508	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-117.6	152.4	173.6	-56.1	176.6	0	0	0	108.9	V42 Q51	V42-L46 HydrophobicContact CG1-CD2 4.02Å; L46-Q51 CarbonylContact C-O 3.48Å; L46-Q51 WeakPolarHBondContact CA-O 3.29Å
47	D	95.4	Very high	89.3	Confident	29 Å²	29	74.4 Å²	74.4	16%	0.155	42%	0.415	C	S	.	.			trans	-81.6	-173.8	171.4	70.8	9.5	0	0	0	112.7	D49 G50 Q51 H53 H72	D47-D49 PolarHBondContact O-N 2.81Å; D47-D49 PolarHBondContact OD1-N 3.47Å; D47-G50 PolarHBondContact O-N 3.07Å; D47-G50 VanDerWaalsContact O-N 3.07Å; D47-G50 PolarHBondContact OD1-N 2.97Å; D47-Q51 PolarHBondContact N-O 3.37Å; D47-Q51 WeakPolarHBondContact OD1-CB 3.45Å; D47-Q51 PolarHBondContact OD1-N 3.2Å; D47-H53 HydrophobicContact CB-CB 4.03Å; D47-H72 WeakPolarHBondContact OD2-CA 3.38Å; D47-H72 IonicContact OD2-CE1 3.34Å; D47-H72 IonicContact OD2-CG 3.01Å; D47-H72 IonicContact OD2-ND1 2.75Å; D47-H72 PolarHBondContact OD2-ND1 2.75Å
48	E	95.4	Very high	91.4	Very high	201 Å²	201	70.7 Å²	70.7	94%	0.939	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.9	-178	-61.6	-174.2	174.7	0	0	113.2	G50	E48-G50 VanDerWaalsContact C-N 3.32Å
49	D	93.3	Very high	93	Very high	132 Å²	132	68.4 Å²	68.4	71%	0.706	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	1.8	178.1	-64.7	-46.4	0	0	0	112	D47 Q51	D47-D49 PolarHBondContact O-N 2.81Å; D47-D49 PolarHBondContact OD1-N 3.47Å; D49-Q51 VanDerWaalsContact C-N 3.34Å; D49-Q51 HydrophobicContact CB-CG 4.22Å
50	G	92.4	Very high	93.9	Very high	44 Å²	44	65.5 Å²	65.5	45%	0.454	36%	0.362	S	S	.	.	S	Bend	trans	79.1	15.7	-179.4	0	0	0	0	0	113.9	D47 E48	D47-G50 PolarHBondContact O-N 3.07Å; D47-G50 VanDerWaalsContact O-N 3.07Å; D47-G50 PolarHBondContact OD1-N 2.97Å; E48-G50 VanDerWaalsContact C-N 3.32Å
51	Q	93.6	Very high	94.5	Very high	78 Å²	78	62.4 Å²	62.4	36%	0.364	36%	0.355	S	S	.	.			trans	-91.2	149.8	-179.2	-55.4	-178.9	25.8	0	0	111.1	L46 D47 D49 H53 H72	L46-Q51 CarbonylContact C-O 3.48Å; L46-Q51 WeakPolarHBondContact CA-O 3.29Å; D47-Q51 PolarHBondContact N-O 3.37Å; D47-Q51 WeakPolarHBondContact OD1-CB 3.45Å; D47-Q51 PolarHBondContact OD1-N 3.2Å; D49-Q51 VanDerWaalsContact C-N 3.34Å; D49-Q51 HydrophobicContact CB-CG 4.22Å; Q51-H53 PolarHBondContact O-N 3.3Å; Q51-H72 PolarHBondContact OE1-O 2.89Å
52	P	94.8	Very high	94.4	Very high	11 Å²	11	62.1 Å²	62.1	7%	0.071	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-48	129.6	174.1	-26.7	30.1	0	0	0	113.3	V42 F70 G73	V42-P52 HydrophobicContact CG1-CB 4.4Å; V42-P52 HydrophobicContact CG1-CG 3.99Å; V42-P52 HydrophobicContact CG2-CG 4.34Å; P52-F70 HydrophobicContact CB-CB 3.84Å; P52-F70 HydrophobicContact CB-CD1 3.71Å; P52-F70 HydrophobicContact CB-CD2 4.23Å; P52-F70 HydrophobicContact CB-CE1 4.27Å; P52-F70 HydrophobicContact CB-CG 3.67Å; P52-F70 HydrophobicContact CG-CD1 4.46Å; P52-F70 WeakPolarHBondContact O-CB 3.4Å; P52-G73 PolarHBondContact O-N 3.25Å
53	H	96.7	Very high	94.2	Very high	72 Å²	72	63.3 Å²	63.3	33%	0.333	37%	0.366	S	S	.	.			trans	-147	137.6	178.3	-165.8	96.3	0	0	0	111.9	P45 D47 Q51	P45-H53 CarbonylContact C-O 3.54Å; P45-H53 WeakPolarHBondContact CB-O 3.4Å; P45-H53 WeakPolarHBondContact CD-O 3.43Å; P45-H53 WeakPolarHBondContact CG-O 3.44Å; P45-H53 PolarHBondContact O-N 2.83Å; D47-H53 HydrophobicContact CB-CB 4.03Å; Q51-H53 PolarHBondContact O-N 3.3Å
54	G	96.3	Very high	94.2	Very high	22 Å²	22	58.7 Å²	58.7	23%	0.227	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.6	-152.3	-172.4	0	0	0	0	0	111.5	C56 H69 F70	G54-C56 PolarHBondContact O-N 2.96Å; G54-H69 CarbonylContact O-C 3.53Å; G54-H69 VanDerWaalsContact O-CA 3.29Å; G54-H69 WeakPolarHBondContact O-CA 3.4Å; G54-F70 PolarHBondContact N-O 3.11Å; G54-F70 PolarHBondContact O-N 3.1Å
55	F	97.7	Very high	94.2	Very high	109 Å²	109	60.8 Å²	60.8	48%	0.478	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.8	-179.8	-170.8	-85.1	0	0	0	110.3	P45 E67 G68 H69	P45-F55 WeakPolarHBondContact CD-O 3.46Å; F55-E67 HydrophobicContact CZ-CB 4.15Å; F55-G68 CarbonylContact C-O 3.58Å; F55-G68 WeakPolarHBondContact CA-O 3.31Å; F55-H69 AromaticContact CD2-NE2 3.96Å
56	C	97.6	Very high	94.3	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.2	179.8	-56	0	0	0	0	111.3	V42 E43 P45 G54 G68 F70	V42-C56 HydrophobicContact CG1-CB 4.49Å; E43-C56 CarbonylContact O-C 3.56Å; E43-C56 WeakPolarHBondContact O-CA 3.06Å; P45-C56 PolarHBondContact O-SG 3.43Å; G54-C56 PolarHBondContact O-N 2.96Å; C56-G68 PolarHBondContact N-O 3.08Å; C56-G68 PolarHBondContact O-N 3.48Å; C56-F70 HydrophobicContact CB-CD2 3.65Å; C56-F70 HydrophobicContact CB-CE2 3.81Å
57	T	97.6	Very high	94.4	Very high	26 Å²	26	55.2 Å²	55.2	16%	0.16	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.7	165.7	-58.5	0	0	0	0	108.2	E43 R65 F66 E67	E43-T57 PolarHBondContact N-O 2.99Å; E43-T57 PolarHBondContact O-N 2.96Å; T57-R65 HydrophobicContact CG2-CG 3.72Å; T57-F66 CarbonylContact C-O 3.45Å; T57-F66 VanDerWaalsContact CA-O 3.3Å; T57-F66 WeakPolarHBondContact CA-O 3.39Å; T57-E67 HydrophobicContact CG2-CG 3.98Å
58	V	95.5	Very high	94.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.5	176	179.2	0	0	0	0	108.3	E39 V42 Y60 R65 F66 F70	E39-V58 HydrophobicContact CB-CG1 3.99Å; E39-V58 HydrophobicContact CG-CG1 3.65Å; V42-V58 HydrophobicContact CG1-CG2 4.42Å; V42-V58 HydrophobicContact CG2-CG2 4.26Å; V58-Y60 HydrophobicContact CG1-CD1 4.29Å; V58-Y60 HydrophobicContact CG1-CE1 3.79Å; V58-Y60 HydrophobicContact CG1-CE2 4.22Å; V58-R65 CarbonylContact O-C 3.49Å; V58-R65 VanDerWaalsContact O-CA 3.3Å; V58-R65 WeakPolarHBondContact O-CA 3.49Å; V58-F66 PolarHBondContact N-O 2.56Å; V58-F66 PolarHBondContact O-N 3.08Å; V58-F70 HydrophobicContact CB-CZ 4.35Å; V58-F70 HydrophobicContact CG2-CE1 4.16Å; V58-F70 HydrophobicContact CG2-CE2 3.91Å; V58-F70 HydrophobicContact CG2-CZ 3.43Å; V58-F70 VanDerWaalsContact CG2-CZ 3.43Å
59	T	95.1	Very high	94.6	Very high	43 Å²	43	48.3 Å²	48.3	26%	0.264	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.5	173.4	-52.9	0	0	0	0	109.1	E40 V41	E40-T59 PolarHBondContact N-O 2.79Å; V41-T59 PolarHBondContact N-O 3.25Å; V41-T59 PolarHBondContact O-N 3.23Å
60	Y	90.9	Very high	94.8	Very high	15 Å²	15	42.1 Å²	42.1	6%	0.059	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	158.7	-178.6	-58.5	-79.1	0	0	0	110.7	E39 V58 S62 S63 D64 F66 K75 F81	E39-Y60 HydrophobicContact CG-CD1 4.33Å; E39-Y60 HydrophobicContact CG-CE1 4.05Å; V58-Y60 HydrophobicContact CG1-CD1 4.29Å; V58-Y60 HydrophobicContact CG1-CE1 3.79Å; V58-Y60 HydrophobicContact CG1-CE2 4.22Å; Y60-S62 PolarHBondContact O-N 3.44Å; Y60-S62 VanDerWaalsContact O-N 3.13Å; Y60-S63 WeakPolarHBondContact O-CA 3.2Å; Y60-S63 PolarHBondContact O-N 2.61Å; Y60-D64 HydrophobicContact CD2-CB 4.08Å; Y60-D64 WeakPolarHBondContact CD2-O 3.23Å; Y60-D64 PolarHBondContact N-O 3.38Å; Y60-F66 HydrophobicContact CE2-CB 3.98Å; Y60-K75 VanDerWaalsContact OH-CE 3.23Å; Y60-K75 WeakPolarHBondContact OH-CE 3.49Å; Y60-K75 PolarHBondContact OH-NZ 3Å; Y60-F81 HydrophobicContact CD2-CE2 4.38Å; Y60-F81 HydrophobicContact CD2-CZ 4.01Å; Y60-F81 AromaticContact CE2-CE2 3.65Å; Y60-F81 HydrophobicContact CE2-CE2 3.65Å; Y60-F81 AromaticContact CE2-CZ 3.74Å; Y60-F81 HydrophobicContact CE2-CZ 3.74Å
61	S	88	Confident	95.1	Very high	66 Å²	66	42.8 Å²	42.8	46%	0.462	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.4	176.5	56.9	0	0	0	0	114.4	E40 S63	E40-S61 VanDerWaalsContact CD-CA 3.49Å; E40-S61 WeakPolarHBondContact OE1-CA 3.38Å; E40-S61 WeakPolarHBondContact OE1-CB 3.47Å; S61-S63 PolarHBondContact O-N 3.36Å
62	S	86.1	Confident	95.2	Very high	60 Å²	60	44 Å²	44	42%	0.42	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-4.8	170	54.8	0	0	0	0	113.7	Y60 D64	Y60-S62 PolarHBondContact O-N 3.44Å; Y60-S62 VanDerWaalsContact O-N 3.13Å; S62-D64 WeakPolarHBondContact CB-OD2 3.24Å; S62-D64 PolarHBondContact O-N 3.4Å; S62-D64 WeakPolarHBondContact OG-CB 3.4Å; S62-D64 PolarHBondContact OG-N 2.93Å; S62-D64 PolarHBondContact OG-OD2 2.75Å
63	S	89.9	Confident	95.1	Very high	77 Å²	77	44.4 Å²	44.4	54%	0.538	25%	0.245	S	C	.	.	S	Bend	trans	66.8	7.1	-165.4	-52	0	0	0	0	114.4	Y60 S61	Y60-S63 WeakPolarHBondContact O-CA 3.2Å; Y60-S63 PolarHBondContact O-N 2.61Å; S61-S63 PolarHBondContact O-N 3.36Å
64	D	94.6	Very high	95	Very high	31 Å²	31	45 Å²	45	17%	0.166	25%	0.247	C	C	.	.			trans	-68.6	155.3	166	-60	-37.4	0	0	0	110.1	Y60 S62 F81 F82 F83 F84	Y60-D64 HydrophobicContact CD2-CB 4.08Å; Y60-D64 WeakPolarHBondContact CD2-O 3.23Å; Y60-D64 PolarHBondContact N-O 3.38Å; S62-D64 WeakPolarHBondContact CB-OD2 3.24Å; S62-D64 PolarHBondContact O-N 3.4Å; S62-D64 WeakPolarHBondContact OG-CB 3.4Å; S62-D64 PolarHBondContact OG-N 2.93Å; S62-D64 PolarHBondContact OG-OD2 2.75Å; D64-F81 HydrophobicContact CB-CE1 3.59Å; D64-F81 HydrophobicContact CB-CZ 3.94Å; D64-F82 WeakPolarHBondContact CA-O 3.39Å; D64-F83 WeakPolarHBondContact OD1-CA 3.43Å; D64-F84 PolarHBondContact OD1-N 2.82Å
65	R	96.6	Very high	95.1	Very high	88 Å²	88	45.2 Å²	45.2	33%	0.332	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133.9	-178.6	-176.2	-175.7	68.1	176.9	11.8	111.1	T57 V58 E67 F81 F82	T57-R65 HydrophobicContact CG2-CG 3.72Å; V58-R65 CarbonylContact O-C 3.49Å; V58-R65 VanDerWaalsContact O-CA 3.3Å; V58-R65 WeakPolarHBondContact O-CA 3.49Å; R65-E67 HydrophobicContact CG-CG 4.49Å; R65-E67 IonicContact CZ-OE1 3.15Å; R65-E67 IonicContact NE-OE1 3.69Å; R65-E67 PolarHBondContact NE-OE1 3.15Å; R65-E67 VanDerWaalsContact NE-OE1 3.15Å; R65-E67 IonicContact NH1-OE1 2.84Å; R65-E67 PolarHBondContact NH1-OE1 3.14Å; R65-E67 IonicContact NH2-OE1 3.8Å; R65-E67 PolarHBondContact NH2-OE1 2.84Å; R65-F81 CarbonylContact O-C 3.59Å; R65-F82 HydrophobicContact CB-CB 4.33Å; R65-F82 PolarHBondContact N-O 2.7Å; R65-F82 PolarHBondContact O-N 3.3Å
66	F	97.1	Very high	95.1	Very high	1 Å²	1	41.6 Å²	41.6	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132.5	169.1	179.5	-96.5	0	0	0	110.3	T57 V58 Y60 F70 K75 F81 Y93	T57-F66 CarbonylContact C-O 3.45Å; T57-F66 VanDerWaalsContact CA-O 3.3Å; T57-F66 WeakPolarHBondContact CA-O 3.39Å; V58-F66 PolarHBondContact N-O 2.56Å; V58-F66 PolarHBondContact O-N 3.08Å; Y60-F66 HydrophobicContact CE2-CB 3.98Å; F66-F70 HydrophobicContact CD1-CE1 4.47Å; F66-F70 AromaticContact CD1-CE2 3.5Å; F66-F70 HydrophobicContact CD1-CE2 3.5Å; F66-F70 VanDerWaalsContact CD1-CE2 3.5Å; F66-F70 AromaticContact CD1-CZ 3.36Å; F66-F70 HydrophobicContact CD1-CZ 3.36Å; F66-F70 HydrophobicContact CE1-CD2 4.33Å; F66-F70 HydrophobicContact CE1-CE1 4.45Å; F66-F70 AromaticContact CE1-CE2 3.48Å; F66-F70 HydrophobicContact CE1-CE2 3.48Å; F66-F70 VanDerWaalsContact CE1-CE2 3.48Å; F66-F70 AromaticContact CE1-CZ 3.57Å; F66-F70 HydrophobicContact CE1-CZ 3.57Å; F66-K75 HydrophobicContact CD1-CD 4.25Å; F66-K75 HydrophobicContact CD1-CG 4.15Å; F66-K75 HydrophobicContact CD2-CD 4.19Å; F66-K75 HydrophobicContact CE1-CB 4.22Å; F66-K75 HydrophobicContact CE1-CD 3.99Å; F66-K75 HydrophobicContact CE1-CG 3.61Å; F66-K75 HydrophobicContact CE2-CD 3.91Å; F66-K75 HydrophobicContact CE2-CG 4.36Å; F66-K75 HydrophobicContact CG-CD 4.31Å; F66-K75 HydrophobicContact CZ-CB 3.99Å; F66-K75 HydrophobicContact CZ-CD 3.78Å; F66-K75 HydrophobicContact CZ-CG 3.71Å; F66-F81 HydrophobicContact CB-CD2 3.99Å; F66-F81 HydrophobicContact CB-CE2 4.16Å; F66-F81 HydrophobicContact CD2-CB 4.41Å; F66-F81 AromaticContact CD2-CD2 3.77Å; F66-F81 HydrophobicContact CD2-CD2 3.77Å; F66-F81 HydrophobicContact CG-CD2 4.34Å; F66-Y93 HydrophobicContact CE2-CD2 4.02Å; F66-Y93 HydrophobicContact CE2-CE1 4.27Å; F66-Y93 AromaticContact CE2-CE2 3.6Å; F66-Y93 HydrophobicContact CE2-CE2 3.6Å; F66-Y93 AromaticContact CE2-CZ 3.73Å; F66-Y93 HydrophobicContact CZ-CD2 4.08Å; F66-Y93 HydrophobicContact CZ-CE2 4.14Å; F66-Y93 HydrophobicContact CZ-CG 4.46Å
67	E	98.3	Very high	95	Very high	53 Å²	53	42.1 Å²	42.1	25%	0.248	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.7	170.6	-63.7	178.7	-172.3	0	0	108.2	F55 T57 R65 G79 K80 F82	F55-E67 HydrophobicContact CZ-CB 4.15Å; T57-E67 HydrophobicContact CG2-CG 3.98Å; R65-E67 HydrophobicContact CG-CG 4.49Å; R65-E67 IonicContact CZ-OE1 3.15Å; R65-E67 IonicContact NE-OE1 3.69Å; R65-E67 PolarHBondContact NE-OE1 3.15Å; R65-E67 VanDerWaalsContact NE-OE1 3.15Å; R65-E67 IonicContact NH1-OE1 2.84Å; R65-E67 PolarHBondContact NH1-OE1 3.14Å; R65-E67 IonicContact NH2-OE1 3.8Å; R65-E67 PolarHBondContact NH2-OE1 2.84Å; E67-G79 CarbonylContact O-C 3.5Å; E67-G79 VanDerWaalsContact O-CA 3.29Å; E67-G79 WeakPolarHBondContact O-CA 3.38Å; E67-K80 PolarHBondContact N-O 2.79Å; E67-K80 PolarHBondContact O-N 2.89Å; E67-F82 HydrophobicContact CB-CE2 4.11Å; E67-F82 VanDerWaalsContact CD-CE2 3.47Å; E67-F82 HydrophobicContact CG-CD2 4.34Å; E67-F82 HydrophobicContact CG-CE2 3.79Å
68	G	97.7	Very high	95.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.9	-175.3	-176.9	0	0	0	0	0	114.9	F55 C56 F70 K78	F55-G68 CarbonylContact C-O 3.58Å; F55-G68 WeakPolarHBondContact CA-O 3.31Å; C56-G68 PolarHBondContact N-O 3.08Å; C56-G68 PolarHBondContact O-N 3.48Å; G68-F70 WeakPolarHBondContact O-CD2 3.47Å; G68-K78 WeakPolarHBondContact CA-O 3.17Å
69	H	97.9	Very high	95.2	Very high	85 Å²	85	48.5 Å²	48.5	39%	0.394	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	138.2	178.2	-72.6	-91	0	0	0	112	G54 F55 K75 N76 K78	G54-H69 CarbonylContact O-C 3.53Å; G54-H69 VanDerWaalsContact O-CA 3.29Å; G54-H69 WeakPolarHBondContact O-CA 3.4Å; F55-H69 AromaticContact CD2-NE2 3.96Å; H69-K75 CarbonylContact O-C 3.48Å; H69-K75 WeakPolarHBondContact O-CA 3.29Å; H69-N76 CarbonylContact C-O 3.59Å; H69-N76 WeakPolarHBondContact CB-O 3.46Å; H69-N76 CarbonylContact O-C 3.59Å; H69-N76 PolarHBondContact O-N 2.96Å; H69-K78 PolarHBondContact N-O 3.42Å
70	F	97.6	Very high	95.3	Very high	3 Å²	3	49.3 Å²	49.3	1%	0.013	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.1	175.5	-70	-98.1	0	0	0	110.8	P52 G54 C56 V58 F66 G68 G73 E74 K75	P52-F70 HydrophobicContact CB-CB 3.84Å; P52-F70 HydrophobicContact CB-CD1 3.71Å; P52-F70 HydrophobicContact CB-CD2 4.23Å; P52-F70 HydrophobicContact CB-CE1 4.27Å; P52-F70 HydrophobicContact CB-CG 3.67Å; P52-F70 HydrophobicContact CG-CD1 4.46Å; P52-F70 WeakPolarHBondContact O-CB 3.4Å; G54-F70 PolarHBondContact N-O 3.11Å; G54-F70 PolarHBondContact O-N 3.1Å; C56-F70 HydrophobicContact CB-CD2 3.65Å; C56-F70 HydrophobicContact CB-CE2 3.81Å; V58-F70 HydrophobicContact CB-CZ 4.35Å; V58-F70 HydrophobicContact CG2-CE1 4.16Å; V58-F70 HydrophobicContact CG2-CE2 3.91Å; V58-F70 HydrophobicContact CG2-CZ 3.43Å; V58-F70 VanDerWaalsContact CG2-CZ 3.43Å; F66-F70 HydrophobicContact CD1-CE1 4.47Å; F66-F70 AromaticContact CD1-CE2 3.5Å; F66-F70 HydrophobicContact CD1-CE2 3.5Å; F66-F70 VanDerWaalsContact CD1-CE2 3.5Å; F66-F70 AromaticContact CD1-CZ 3.36Å; F66-F70 HydrophobicContact CD1-CZ 3.36Å; F66-F70 HydrophobicContact CE1-CD2 4.33Å; F66-F70 HydrophobicContact CE1-CE1 4.45Å; F66-F70 AromaticContact CE1-CE2 3.48Å; F66-F70 HydrophobicContact CE1-CE2 3.48Å; F66-F70 VanDerWaalsContact CE1-CE2 3.48Å; F66-F70 AromaticContact CE1-CZ 3.57Å; F66-F70 HydrophobicContact CE1-CZ 3.57Å; G68-F70 WeakPolarHBondContact O-CD2 3.47Å; F70-G73 WeakPolarHBondContact CD1-O 3.47Å; F70-E74 CarbonylContact C-O 3.53Å; F70-E74 VanDerWaalsContact CA-O 3.22Å; F70-E74 WeakPolarHBondContact CA-O 3.18Å; F70-K75 HydrophobicContact CD1-CG 4.12Å; F70-K75 HydrophobicContact CE1-CG 3.54Å; F70-K75 HydrophobicContact CZ-CG 3.88Å
71	T	97.6	Very high	95.6	Very high	58 Å²	58	50 Å²	50	36%	0.356	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	110.9	170.3	-64.2	0	0	0	0	107.4	G73 E74	T71-G73 PolarHBondContact O-N 3.32Å; T71-E74 PolarHBondContact N-O 3.17Å; T71-E74 PolarHBondContact O-N 3.3Å
72	H	94.9	Very high	96.1	Very high	104 Å²	104	49.2 Å²	49.2	48%	0.481	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	52.6	-179.9	-59.2	-68.3	0	0	0	112.3	D47 Q51 E74	D47-H72 WeakPolarHBondContact OD2-CA 3.38Å; D47-H72 IonicContact OD2-CE1 3.34Å; D47-H72 IonicContact OD2-CG 3.01Å; D47-H72 IonicContact OD2-ND1 2.75Å; D47-H72 PolarHBondContact OD2-ND1 2.75Å; Q51-H72 PolarHBondContact OE1-O 2.89Å; H72-E74 PolarHBondContact O-N 2.82Å; H72-E74 VanDerWaalsContact O-N 3.12Å
73	G	93.3	Very high	96.5	Very high	19 Å²	19	48.8 Å²	48.8	20%	0.196	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-17.7	178.6	0	0	0	0	0	115.7	P52 F70 T71	P52-G73 PolarHBondContact O-N 3.25Å; F70-G73 WeakPolarHBondContact CD1-O 3.47Å; T71-G73 PolarHBondContact O-N 3.32Å
74	E	95.7	Very high	96.7	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.9	-177.7	-61.3	175.3	157.8	0	0	111.5	F70 T71 H72 N76	F70-E74 CarbonylContact C-O 3.53Å; F70-E74 VanDerWaalsContact CA-O 3.22Å; F70-E74 WeakPolarHBondContact CA-O 3.18Å; T71-E74 PolarHBondContact N-O 3.17Å; T71-E74 PolarHBondContact O-N 3.3Å; H72-E74 PolarHBondContact O-N 2.82Å; H72-E74 VanDerWaalsContact O-N 3.12Å; E74-N76 WeakPolarHBondContact CB-ND2 3.44Å; E74-N76 PolarHBondContact O-N 2.96Å; E74-N76 PolarHBondContact O-ND2 3.1Å
75	K	96.7	Very high	96.7	Very high	27 Å²	27	54.1 Å²	54.1	12%	0.117	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	119.7	175.1	-57.8	161.8	-176	164	0	109.1	Y60 F66 H69 F70 Y93 D95 D96	Y60-K75 VanDerWaalsContact OH-CE 3.23Å; Y60-K75 WeakPolarHBondContact OH-CE 3.49Å; Y60-K75 PolarHBondContact OH-NZ 3Å; F66-K75 HydrophobicContact CD1-CD 4.25Å; F66-K75 HydrophobicContact CD1-CG 4.15Å; F66-K75 HydrophobicContact CD2-CD 4.19Å; F66-K75 HydrophobicContact CE1-CB 4.22Å; F66-K75 HydrophobicContact CE1-CD 3.99Å; F66-K75 HydrophobicContact CE1-CG 3.61Å; F66-K75 HydrophobicContact CE2-CD 3.91Å; F66-K75 HydrophobicContact CE2-CG 4.36Å; F66-K75 HydrophobicContact CG-CD 4.31Å; F66-K75 HydrophobicContact CZ-CB 3.99Å; F66-K75 HydrophobicContact CZ-CD 3.78Å; F66-K75 HydrophobicContact CZ-CG 3.71Å; H69-K75 CarbonylContact O-C 3.48Å; H69-K75 WeakPolarHBondContact O-CA 3.29Å; F70-K75 HydrophobicContact CD1-CG 4.12Å; F70-K75 HydrophobicContact CE1-CG 3.54Å; F70-K75 HydrophobicContact CZ-CG 3.88Å; K75-Y93 HydrophobicContact CB-CD1 4.11Å; K75-Y93 HydrophobicContact CB-CG 4.03Å; K75-Y93 HydrophobicContact CD-CD1 4.11Å; K75-Y93 HydrophobicContact CD-CE1 4.3Å; K75-Y93 WeakPolarHBondContact O-CB 3.26Å; K75-D95 PolarHBondContact O-N 2.79Å; K75-D96 WeakPolarHBondContact CB-OD1 3.44Å; K75-D96 VanDerWaalsContact CG-OD1 3.29Å; K75-D96 WeakPolarHBondContact CG-OD1 3.26Å; K75-D96 PolarHBondContact N-OD1 2.93Å; K75-D96 PolarHBondContact O-N 3.03Å; K75-D96 VanDerWaalsContact O-N 3.11Å
76	N	97.6	Very high	96.6	Very high	33 Å²	33	52.5 Å²	52.5	18%	0.176	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	102.9	-172.7	-91.2	-65.1	0	0	0	109.8	H69 E74 Y93 D95	H69-N76 CarbonylContact C-O 3.59Å; H69-N76 WeakPolarHBondContact CB-O 3.46Å; H69-N76 CarbonylContact O-C 3.59Å; H69-N76 PolarHBondContact O-N 2.96Å; E74-N76 WeakPolarHBondContact CB-ND2 3.44Å; E74-N76 PolarHBondContact O-N 2.96Å; E74-N76 PolarHBondContact O-ND2 3.1Å; N76-Y93 WeakPolarHBondContact CA-O 3.35Å; N76-D95 PolarHBondContact OD1-N 3.2Å; N76-D95 VanDerWaalsContact OD1-N 3.09Å; N76-D95 PolarHBondContact OD1-OD1 3.01Å
77	G	97.3	Very high	96.6	Very high	12 Å²	12	52.4 Å²	52.4	12%	0.124	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.1	-160.1	-175.1	0	0	0	0	0	113	F92 Y93	G77-F92 CarbonylContact O-C 3.57Å; G77-Y93 PolarHBondContact N-O 2.84Å; G77-Y93 PolarHBondContact O-N 3.01Å
78	K	97.8	Very high	96.6	Very high	153 Å²	153	50.8 Å²	50.8	67%	0.665	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	139.2	178.1	-66.6	-175.4	178.8	-173.4	0	110.6	G68 H69 G91 F92	G68-K78 WeakPolarHBondContact CA-O 3.17Å; H69-K78 PolarHBondContact N-O 3.42Å; K78-G91 WeakPolarHBondContact CA-O 3.38Å; K78-F92 HydrophobicContact CG-CD2 4.17Å
79	G	97.8	Very high	96.6	Very high	7 Å²	7	51.9 Å²	51.9	7%	0.072	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	159.8	175.6	0	0	0	0	0	112.5	E67 E90 G91	E67-G79 CarbonylContact O-C 3.5Å; E67-G79 VanDerWaalsContact O-CA 3.29Å; E67-G79 WeakPolarHBondContact O-CA 3.38Å; G79-E90 WeakPolarHBondContact O-CA 3.27Å; G79-G91 PolarHBondContact N-O 2.95Å; G79-G91 PolarHBondContact O-N 3.46Å
80	K	98.4	Very high	96.6	Very high	60 Å²	60	52.3 Å²	52.3	26%	0.261	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	122.1	175.5	-174.1	165.5	-176.3	160.4	0	109.7	E67 F82 T88 L89 E90	E67-K80 PolarHBondContact N-O 2.79Å; E67-K80 PolarHBondContact O-N 2.89Å; K80-F82 HydrophobicContact CB-CE2 4.12Å; K80-F82 HydrophobicContact CB-CZ 4.49Å; K80-F82 HydrophobicContact CD-CE1 4.18Å; K80-F82 HydrophobicContact CD-CE2 4.16Å; K80-F82 HydrophobicContact CD-CZ 3.72Å; K80-F82 HydrophobicContact CG-CD2 4.36Å; K80-F82 HydrophobicContact CG-CE1 4.48Å; K80-F82 HydrophobicContact CG-CE2 3.84Å; K80-F82 HydrophobicContact CG-CZ 3.92Å; K80-T88 VanDerWaalsContact CE-CB 3.46Å; K80-T88 WeakPolarHBondContact CE-OG1 3.38Å; K80-L89 CarbonylContact C-O 3.5Å; K80-L89 WeakPolarHBondContact CA-O 3.44Å; K80-E90 HydrophobicContact CB-CB 4.47Å; K80-E90 HydrophobicContact CB-CG 4.48Å; K80-E90 HydrophobicContact CD-CB 4.38Å; K80-E90 HydrophobicContact CG-CB 4.23Å; K80-E90 IonicContact NZ-OE2 3.48Å
81	F	97.4	Very high	96.7	Very high	29 Å²	29	52.8 Å²	52.8	13%	0.127	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	134.5	170.9	-146.4	-84.5	0	0	0	109.1	Y60 D64 R65 F66 F83 T88 L89	Y60-F81 HydrophobicContact CD2-CE2 4.38Å; Y60-F81 HydrophobicContact CD2-CZ 4.01Å; Y60-F81 AromaticContact CE2-CE2 3.65Å; Y60-F81 HydrophobicContact CE2-CE2 3.65Å; Y60-F81 AromaticContact CE2-CZ 3.74Å; Y60-F81 HydrophobicContact CE2-CZ 3.74Å; D64-F81 HydrophobicContact CB-CE1 3.59Å; D64-F81 HydrophobicContact CB-CZ 3.94Å; R65-F81 CarbonylContact O-C 3.59Å; F66-F81 HydrophobicContact CB-CD2 3.99Å; F66-F81 HydrophobicContact CB-CE2 4.16Å; F66-F81 HydrophobicContact CD2-CB 4.41Å; F66-F81 AromaticContact CD2-CD2 3.77Å; F66-F81 HydrophobicContact CD2-CD2 3.77Å; F66-F81 HydrophobicContact CG-CD2 4.34Å; F81-F83 HydrophobicContact CB-CE2 4.35Å; F81-F83 HydrophobicContact CB-CZ 4.26Å; F81-F83 AromaticContact CD1-CD1 3.58Å; F81-F83 HydrophobicContact CD1-CD1 3.58Å; F81-F83 HydrophobicContact CD1-CD2 4.21Å; F81-F83 AromaticContact CD1-CE1 3.33Å; F81-F83 HydrophobicContact CD1-CE1 3.33Å; F81-F83 HydrophobicContact CD1-CE2 4.01Å; F81-F83 HydrophobicContact CD1-CG 4.02Å; F81-F83 AromaticContact CD1-CZ 3.57Å; F81-F83 HydrophobicContact CD1-CZ 3.57Å; F81-F83 AromaticContact CE1-CD1 3.63Å; F81-F83 HydrophobicContact CE1-CD1 3.63Å; F81-F83 AromaticContact CE1-CE1 3.52Å; F81-F83 HydrophobicContact CE1-CE1 3.52Å; F81-F83 HydrophobicContact CE1-CG 4.41Å; F81-F83 HydrophobicContact CE1-CZ 4.22Å; F81-F83 HydrophobicContact CG-CE1 4.26Å; F81-F83 HydrophobicContact CG-CZ 4.15Å; F81-T88 CarbonylContact O-C 3.59Å; F81-T88 WeakPolarHBondContact O-CA 3.42Å; F81-T88 WeakPolarHBondContact O-CB 3.36Å; F81-L89 HydrophobicContact CB-CB 4.21Å; F81-L89 PolarHBondContact N-O 2.78Å; F81-L89 PolarHBondContact O-N 3.43Å
82	F	97.4	Very high	96.7	Very high	49 Å²	49	54.8 Å²	54.8	22%	0.215	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	117.6	173.1	-60.5	-97.4	0	0	0	106.6	D64 R65 E67 K80 T88	D64-F82 WeakPolarHBondContact CA-O 3.39Å; R65-F82 HydrophobicContact CB-CB 4.33Å; R65-F82 PolarHBondContact N-O 2.7Å; R65-F82 PolarHBondContact O-N 3.3Å; E67-F82 HydrophobicContact CB-CE2 4.11Å; E67-F82 VanDerWaalsContact CD-CE2 3.47Å; E67-F82 HydrophobicContact CG-CD2 4.34Å; E67-F82 HydrophobicContact CG-CE2 3.79Å; K80-F82 HydrophobicContact CB-CE2 4.12Å; K80-F82 HydrophobicContact CB-CZ 4.49Å; K80-F82 HydrophobicContact CD-CE1 4.18Å; K80-F82 HydrophobicContact CD-CE2 4.16Å; K80-F82 HydrophobicContact CD-CZ 3.72Å; K80-F82 HydrophobicContact CG-CD2 4.36Å; K80-F82 HydrophobicContact CG-CE1 4.48Å; K80-F82 HydrophobicContact CG-CE2 3.84Å; K80-F82 HydrophobicContact CG-CZ 3.92Å; F82-T88 HydrophobicContact CD1-CG2 3.67Å; F82-T88 HydrophobicContact CE1-CG2 4.14Å; F82-T88 HydrophobicContact CG-CG2 4.38Å
83	F	95.4	Very high	96.8	Very high	51 Å²	51	50.4 Å²	50.4	22%	0.224	26%	0.259	C	S	.	.			trans	-89.4	154.2	179.4	-60.3	-82.2	0	0	0	110	D64 F81 D85 G86 S87 L89 Y104	D64-F83 WeakPolarHBondContact OD1-CA 3.43Å; F81-F83 HydrophobicContact CB-CE2 4.35Å; F81-F83 HydrophobicContact CB-CZ 4.26Å; F81-F83 AromaticContact CD1-CD1 3.58Å; F81-F83 HydrophobicContact CD1-CD1 3.58Å; F81-F83 HydrophobicContact CD1-CD2 4.21Å; F81-F83 AromaticContact CD1-CE1 3.33Å; F81-F83 HydrophobicContact CD1-CE1 3.33Å; F81-F83 HydrophobicContact CD1-CE2 4.01Å; F81-F83 HydrophobicContact CD1-CG 4.02Å; F81-F83 AromaticContact CD1-CZ 3.57Å; F81-F83 HydrophobicContact CD1-CZ 3.57Å; F81-F83 AromaticContact CE1-CD1 3.63Å; F81-F83 HydrophobicContact CE1-CD1 3.63Å; F81-F83 AromaticContact CE1-CE1 3.52Å; F81-F83 HydrophobicContact CE1-CE1 3.52Å; F81-F83 HydrophobicContact CE1-CG 4.41Å; F81-F83 HydrophobicContact CE1-CZ 4.22Å; F81-F83 HydrophobicContact CG-CE1 4.26Å; F81-F83 HydrophobicContact CG-CZ 4.15Å; F83-D85 VanDerWaalsContact CB-OD1 3.26Å; F83-D85 WeakPolarHBondContact CB-OD1 3.41Å; F83-D85 PolarHBondContact O-N 3.48Å; F83-G86 PolarHBondContact O-N 2.84Å; F83-S87 WeakPolarHBondContact CB-OG 3.49Å; F83-S87 WeakPolarHBondContact CD2-O 3.37Å; F83-S87 WeakPolarHBondContact CD2-OG 3.42Å; F83-S87 PolarHBondContact N-O 2.64Å; F83-L89 HydrophobicContact CE2-CB 3.74Å; F83-L89 HydrophobicContact CZ-CB 4.13Å; F83-Y104 HydrophobicContact CD2-CE2 4.32Å; F83-Y104 HydrophobicContact CE2-CD2 4.37Å; F83-Y104 AromaticContact CE2-CE2 3.83Å; F83-Y104 HydrophobicContact CE2-CE2 3.83Å; F83-Y104 HydrophobicContact CZ-CE2 4.5Å
84	F	94.4	Very high	97.1	Very high	157 Å²	157	52.2 Å²	52.2	69%	0.689	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.2	178.9	173.3	-99.7	0	0	0	113.5	D64 G86	D64-F84 PolarHBondContact OD1-N 2.82Å; F84-G86 PolarHBondContact O-N 3.36Å
85	D	93.9	Very high	97.1	Very high	63 Å²	63	53 Å²	53	34%	0.337	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-2.7	175.7	67.8	2.1	0	0	0	113.5	F83 S87 E107	F83-D85 VanDerWaalsContact CB-OD1 3.26Å; F83-D85 WeakPolarHBondContact CB-OD1 3.41Å; F83-D85 PolarHBondContact O-N 3.48Å; D85-S87 VanDerWaalsContact C-N 3.35Å; D85-S87 VanDerWaalsContact OD1-CB 3.22Å; D85-S87 WeakPolarHBondContact OD1-CB 3.4Å; D85-S87 PolarHBondContact OD1-N 2.99Å; D85-S87 PolarHBondContact OD1-OG 2.84Å; D85-S87 PolarHBondContact OD2-OG 2.93Å; D85-E107 WeakPolarHBondContact O-CB 3.48Å; D85-E107 WeakPolarHBondContact O-CG 3.29Å
86	G	94.1	Very high	97	Very high	54 Å²	54	55.3 Å²	55.3	56%	0.557	29%	0.287	S	S	*	.	S	Bend	trans	89.9	-5.7	-179.2	0	0	0	0	0	114.4	F83 F84	F83-G86 PolarHBondContact O-N 2.84Å; F84-G86 PolarHBondContact O-N 3.36Å
87	S	97.4	Very high	96.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.285	C	S	.	.			trans	-68.9	161.7	170.7	69	0	0	0	0	111.5	F83 D85 Y104 T105	F83-S87 WeakPolarHBondContact CB-OG 3.49Å; F83-S87 WeakPolarHBondContact CD2-O 3.37Å; F83-S87 WeakPolarHBondContact CD2-OG 3.42Å; F83-S87 PolarHBondContact N-O 2.64Å; D85-S87 VanDerWaalsContact C-N 3.35Å; D85-S87 VanDerWaalsContact OD1-CB 3.22Å; D85-S87 WeakPolarHBondContact OD1-CB 3.4Å; D85-S87 PolarHBondContact OD1-N 2.99Å; D85-S87 PolarHBondContact OD1-OG 2.84Å; D85-S87 PolarHBondContact OD2-OG 2.93Å; S87-Y104 WeakPolarHBondContact CB-OH 3.4Å; S87-Y104 PolarHBondContact OG-OH 3.41Å; S87-T105 CarbonylContact C-O 3.57Å; S87-T105 WeakPolarHBondContact CA-O 3.37Å; S87-T105 WeakPolarHBondContact CB-O 3.47Å
88	T	98.3	Very high	96.7	Very high	18 Å²	18	54 Å²	54	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.4	177.4	69	0	0	0	0	112.4	K80 F81 F82 Y104 T105	K80-T88 VanDerWaalsContact CE-CB 3.46Å; K80-T88 WeakPolarHBondContact CE-OG1 3.38Å; F81-T88 CarbonylContact O-C 3.59Å; F81-T88 WeakPolarHBondContact O-CA 3.42Å; F81-T88 WeakPolarHBondContact O-CB 3.36Å; F82-T88 HydrophobicContact CD1-CG2 3.67Å; F82-T88 HydrophobicContact CE1-CG2 4.14Å; F82-T88 HydrophobicContact CG-CG2 4.38Å; T88-Y104 CarbonylContact O-C 3.53Å; T88-Y104 VanDerWaalsContact O-CA 3.3Å; T88-Y104 WeakPolarHBondContact O-CA 3.34Å; T88-T105 PolarHBondContact N-O 3.12Å; T88-T105 PolarHBondContact O-N 2.91Å
89	L	98.1	Very high	96.7	Very high	24 Å²	24	48.9 Å²	48.9	13%	0.126	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	117.2	173.3	178.3	60.1	0	0	0	109.9	K80 F81 F83 L98 L103 Y104 Y116	K80-L89 CarbonylContact C-O 3.5Å; K80-L89 WeakPolarHBondContact CA-O 3.44Å; F81-L89 HydrophobicContact CB-CB 4.21Å; F81-L89 PolarHBondContact N-O 2.78Å; F81-L89 PolarHBondContact O-N 3.43Å; F83-L89 HydrophobicContact CE2-CB 3.74Å; F83-L89 HydrophobicContact CZ-CB 4.13Å; L89-L98 HydrophobicContact CD1-CD2 3.8Å; L89-L98 HydrophobicContact CD2-CD2 3.73Å; L89-L98 HydrophobicContact CG-CD2 3.87Å; L89-L103 WeakPolarHBondContact CA-O 3.26Å; L89-Y104 HydrophobicContact CB-CD2 4.14Å; L89-Y104 HydrophobicContact CD1-CD2 4.27Å; L89-Y116 HydrophobicContact CD1-CE1 4.45Å; L89-Y116 HydrophobicContact CD1-CE2 4.48Å
90	E	98.3	Very high	96.7	Very high	93 Å²	93	49.8 Å²	49.8	44%	0.435	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.9	179.1	-176.8	178.7	161.4	0	0	111	G79 K80 G102 L103	G79-E90 WeakPolarHBondContact O-CA 3.27Å; K80-E90 HydrophobicContact CB-CB 4.47Å; K80-E90 HydrophobicContact CB-CG 4.48Å; K80-E90 HydrophobicContact CD-CB 4.38Å; K80-E90 HydrophobicContact CG-CB 4.23Å; K80-E90 IonicContact NZ-OE2 3.48Å; E90-G102 CarbonylContact O-C 3.59Å; E90-G102 VanDerWaalsContact O-CA 3.25Å; E90-G102 WeakPolarHBondContact O-CA 3.26Å; E90-L103 HydrophobicContact CB-CB 4.45Å; E90-L103 PolarHBondContact N-O 2.87Å; E90-L103 PolarHBondContact O-N 3.49Å
91	G	98.1	Very high	96.7	Very high	13 Å²	13	54.7 Å²	54.7	13%	0.134	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	-154.7	169.1	0	0	0	0	0	113.8	K78 G79	K78-G91 WeakPolarHBondContact CA-O 3.38Å; G79-G91 PolarHBondContact N-O 2.95Å; G79-G91 PolarHBondContact O-N 3.46Å
92	F	98.3	Very high	96.7	Very high	101 Å²	101	53.6 Å²	53.6	44%	0.443	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.8	-176.4	-165.6	-88.5	0	0	0	111	G77 K78 V94 Q99	G77-F92 CarbonylContact O-C 3.57Å; K78-F92 HydrophobicContact CG-CD2 4.17Å; F92-V94 HydrophobicContact CD1-CG2 3.99Å; F92-V94 HydrophobicContact CE1-CG2 3.75Å; F92-Q99 PolarHBondContact O-N 3.26Å
93	Y	97.9	Very high	96.8	Very high	11 Å²	11	53.7 Å²	53.7	4%	0.043	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	142.3	-177.5	-67.5	-99.5	0	0	0	110.8	F66 K75 N76 G77 G97 L98	F66-Y93 HydrophobicContact CE2-CD2 4.02Å; F66-Y93 HydrophobicContact CE2-CE1 4.27Å; F66-Y93 AromaticContact CE2-CE2 3.6Å; F66-Y93 HydrophobicContact CE2-CE2 3.6Å; F66-Y93 AromaticContact CE2-CZ 3.73Å; F66-Y93 HydrophobicContact CZ-CD2 4.08Å; F66-Y93 HydrophobicContact CZ-CE2 4.14Å; F66-Y93 HydrophobicContact CZ-CG 4.46Å; K75-Y93 HydrophobicContact CB-CD1 4.11Å; K75-Y93 HydrophobicContact CB-CG 4.03Å; K75-Y93 HydrophobicContact CD-CD1 4.11Å; K75-Y93 HydrophobicContact CD-CE1 4.3Å; K75-Y93 WeakPolarHBondContact O-CB 3.26Å; N76-Y93 WeakPolarHBondContact CA-O 3.35Å; G77-Y93 PolarHBondContact N-O 2.84Å; G77-Y93 PolarHBondContact O-N 3.01Å; Y93-G97 CarbonylContact C-O 3.52Å; Y93-G97 VanDerWaalsContact CA-O 3.28Å; Y93-G97 WeakPolarHBondContact CA-O 3.39Å; Y93-L98 HydrophobicContact CD1-CB 4.3Å; Y93-L98 HydrophobicContact CD2-CD1 4.35Å; Y93-L98 HydrophobicContact CE1-CB 3.94Å; Y93-L98 HydrophobicContact CE1-CD1 4.45Å; Y93-L98 HydrophobicContact CE2-CD1 3.95Å
94	V	97.8	Very high	96.9	Very high	57 Å²	57	53.8 Å²	53.8	35%	0.345	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	119.6	170.5	-179.8	0	0	0	0	106.5	F92 D96 G97 Q99	F92-V94 HydrophobicContact CD1-CG2 3.99Å; F92-V94 HydrophobicContact CE1-CG2 3.75Å; V94-D96 VanDerWaalsContact C-N 3.32Å; V94-D96 PolarHBondContact O-N 3.27Å; V94-G97 PolarHBondContact N-O 2.9Å; V94-G97 PolarHBondContact O-N 3.24Å; V94-Q99 HydrophobicContact CB-CG 3.93Å; V94-Q99 HydrophobicContact CG2-CG 3.89Å
95	D	95.6	Very high	97.1	Very high	102 Å²	102	48.1 Å²	48.1	55%	0.545	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	53.9	179.5	-49.5	-26.4	0	0	0	111.5	K75 N76 G97	K75-D95 PolarHBondContact O-N 2.79Å; N76-D95 PolarHBondContact OD1-N 3.2Å; N76-D95 VanDerWaalsContact OD1-N 3.09Å; N76-D95 PolarHBondContact OD1-OD1 3.01Å; D95-G97 PolarHBondContact O-N 3.16Å
96	D	94.8	Very high	97.2	Very high	75 Å²	75	48 Å²	48	40%	0.401	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-15.3	-175.5	-67.3	-48.5	0	0	0	117.5	K75 V94	K75-D96 WeakPolarHBondContact CB-OD1 3.44Å; K75-D96 VanDerWaalsContact CG-OD1 3.29Å; K75-D96 WeakPolarHBondContact CG-OD1 3.26Å; K75-D96 PolarHBondContact N-OD1 2.93Å; K75-D96 PolarHBondContact O-N 3.03Å; K75-D96 VanDerWaalsContact O-N 3.11Å; V94-D96 VanDerWaalsContact C-N 3.32Å; V94-D96 PolarHBondContact O-N 3.27Å
97	G	92.9	Very high	97.3	Very high	12 Å²	12	52.4 Å²	52.4	12%	0.124	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	128.9	177.8	0	0	0	0	0	112.7	Y93 V94 D95 Q99	Y93-G97 CarbonylContact C-O 3.52Å; Y93-G97 VanDerWaalsContact CA-O 3.28Å; Y93-G97 WeakPolarHBondContact CA-O 3.39Å; V94-G97 PolarHBondContact N-O 2.9Å; V94-G97 PolarHBondContact O-N 3.24Å; D95-G97 PolarHBondContact O-N 3.16Å; G97-Q99 PolarHBondContact O-N 3.26Å
98	L	96.3	Very high	97.1	Very high	4 Å²	4	58 Å²	58	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	129.3	168.6	178.5	64.7	0	0	0	109.8	L89 Y93 Y116 D118 G119	L89-L98 HydrophobicContact CD1-CD2 3.8Å; L89-L98 HydrophobicContact CD2-CD2 3.73Å; L89-L98 HydrophobicContact CG-CD2 3.87Å; Y93-L98 HydrophobicContact CD1-CB 4.3Å; Y93-L98 HydrophobicContact CD2-CD1 4.35Å; Y93-L98 HydrophobicContact CE1-CB 3.94Å; Y93-L98 HydrophobicContact CE1-CD1 4.45Å; Y93-L98 HydrophobicContact CE2-CD1 3.95Å; L98-Y116 HydrophobicContact CD2-CD1 3.56Å; L98-Y116 HydrophobicContact CD2-CD2 3.82Å; L98-Y116 HydrophobicContact CD2-CE1 3.86Å; L98-Y116 HydrophobicContact CD2-CE2 4.13Å; L98-Y116 HydrophobicContact CD2-CG 3.52Å; L98-Y116 HydrophobicContact CG-CD1 4.27Å; L98-Y116 HydrophobicContact CG-CD2 4.35Å; L98-Y116 HydrophobicContact CG-CG 3.91Å; L98-D118 PolarHBondContact O-N 2.64Å; L98-G119 PolarHBondContact O-N 2.82Å
99	Q	98.1	Very high	96.9	Very high	46 Å²	46	58.8 Å²	58.8	22%	0.215	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.1	-175.9	-58.4	-60.6	-21.8	0	0	112.1	F92 V94 G97 Y116 D118	F92-Q99 PolarHBondContact O-N 3.26Å; V94-Q99 HydrophobicContact CB-CG 3.93Å; V94-Q99 HydrophobicContact CG2-CG 3.89Å; G97-Q99 PolarHBondContact O-N 3.26Å; Q99-Y116 CarbonylContact C-O 3.49Å; Q99-D118 PolarHBondContact NE2-OD1 2.8Å
100	G	98	Very high	96.9	Very high	27 Å²	27	57.9 Å²	57.9	28%	0.278	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	72.8	-136.6	171.9	0	0	0	0	0	111.9	M115 Y116	G100-M115 CarbonylContact O-C 3.57Å; G100-M115 WeakPolarHBondContact O-CA 3.5Å; G100-Y116 PolarHBondContact N-O 2.79Å; G100-Y116 PolarHBondContact O-N 2.91Å
101	Q	98.1	Very high	96.9	Very high	162 Å²	162	54.8 Å²	54.8	76%	0.757	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	128.3	-177.2	-69	176.8	5.2	0	0	110.7	G114 M115	Q101-G114 WeakPolarHBondContact CA-O 3.4Å; Q101-M115 HydrophobicContact CB-SD 4.47Å; Q101-M115 HydrophobicContact CG-SD 3.55Å; Q101-M115 VanDerWaalsContact CG-SD 3.55Å
102	G	97.9	Very high	96.9	Very high	6 Å²	6	54.9 Å²	54.9	6%	0.062	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	150.1	170.5	0	0	0	0	0	111.4	E90 G114 Y116	E90-G102 CarbonylContact O-C 3.59Å; E90-G102 VanDerWaalsContact O-CA 3.25Å; E90-G102 WeakPolarHBondContact O-CA 3.26Å; G102-G114 PolarHBondContact N-O 2.87Å; G102-G114 PolarHBondContact O-N 3.17Å; G102-Y116 VanDerWaalsContact CA-CE2 3.47Å
103	L	98.4	Very high	96.9	Very high	51 Å²	51	54.3 Å²	54.3	27%	0.267	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	107.9	175.8	-176.2	67.7	0	0	0	108.6	L89 E90 V111 H113	L89-L103 WeakPolarHBondContact CA-O 3.26Å; E90-L103 HydrophobicContact CB-CB 4.45Å; E90-L103 PolarHBondContact N-O 2.87Å; E90-L103 PolarHBondContact O-N 3.49Å; L103-V111 HydrophobicContact CD1-CG1 3.23Å; L103-V111 HydrophobicContact CG-CG1 4.22Å; L103-H113 WeakPolarHBondContact CD1-CE1 3.24Å
104	Y	98.3	Very high	96.9	Very high	54 Å²	54	54 Å²	54	21%	0.212	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.3	170.7	-175	-89.7	0	0	0	109	F83 S87 T88 L89 H106 V111 L112	F83-Y104 HydrophobicContact CD2-CE2 4.32Å; F83-Y104 HydrophobicContact CE2-CD2 4.37Å; F83-Y104 AromaticContact CE2-CE2 3.83Å; F83-Y104 HydrophobicContact CE2-CE2 3.83Å; F83-Y104 HydrophobicContact CZ-CE2 4.5Å; S87-Y104 WeakPolarHBondContact CB-OH 3.4Å; S87-Y104 PolarHBondContact OG-OH 3.41Å; T88-Y104 CarbonylContact O-C 3.53Å; T88-Y104 VanDerWaalsContact O-CA 3.3Å; T88-Y104 WeakPolarHBondContact O-CA 3.34Å; L89-Y104 HydrophobicContact CB-CD2 4.14Å; L89-Y104 HydrophobicContact CD1-CD2 4.27Å; Y104-H106 AromaticContact CD1-CD2 3.68Å; Y104-H106 AromaticContact CD1-CE1 3.86Å; Y104-H106 AromaticContact CD1-NE2 3.55Å; Y104-H106 HydrophobicContact CE1-CB 4.38Å; Y104-H106 AromaticContact CE1-CD2 3.81Å; Y104-H106 AromaticContact CE1-CE1 3.56Å; Y104-H106 AromaticContact CE1-CG 3.66Å; Y104-H106 AromaticContact CE1-ND1 3.52Å; Y104-H106 AromaticContact CE1-NE2 3.73Å; Y104-V111 CarbonylContact O-C 3.2Å; Y104-V111 WeakPolarHBondContact O-CA 3.49Å; Y104-L112 PolarHBondContact N-O 3.27Å; Y104-L112 PolarHBondContact O-N 2.83Å
105	T	98	Very high	96.9	Very high	38 Å²	38	54.1 Å²	54.1	23%	0.233	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.4	173.2	-52.4	0	0	0	0	107.7	S87 T88 G110 V111	S87-T105 CarbonylContact C-O 3.57Å; S87-T105 WeakPolarHBondContact CA-O 3.37Å; S87-T105 WeakPolarHBondContact CB-O 3.47Å; T88-T105 PolarHBondContact N-O 3.12Å; T88-T105 PolarHBondContact O-N 2.91Å; T105-G110 CarbonylContact C-O 3.35Å; T105-G110 WeakPolarHBondContact CA-O 3.46Å; T105-V111 HydrophobicContact CG2-CG2 4.35Å
106	H	95.9	Very high	97.1	Very high	60 Å²	60	49.9 Å²	49.9	28%	0.278	27%	0.267	S	S	.	.			trans	-69.5	160.7	176.8	-65.1	-99.5	0	0	0	110.8	Y104 D108 G109 G110	Y104-H106 AromaticContact CD1-CD2 3.68Å; Y104-H106 AromaticContact CD1-CE1 3.86Å; Y104-H106 AromaticContact CD1-NE2 3.55Å; Y104-H106 HydrophobicContact CE1-CB 4.38Å; Y104-H106 AromaticContact CE1-CD2 3.81Å; Y104-H106 AromaticContact CE1-CE1 3.56Å; Y104-H106 AromaticContact CE1-CG 3.66Å; Y104-H106 AromaticContact CE1-ND1 3.52Å; Y104-H106 AromaticContact CE1-NE2 3.73Å; H106-D108 WeakPolarHBondContact CB-OD1 3.48Å; H106-D108 PolarHBondContact O-N 2.81Å; H106-G109 PolarHBondContact O-N 2.77Å; H106-G110 PolarHBondContact CD2-O 2.82Å; H106-G110 PolarHBondContact N-O 3.31Å
107	E	96.3	Very high	97.2	Very high	147 Å²	147	49.6 Å²	49.6	69%	0.687	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.4	176.2	177.8	-176.5	-176.5	0	0	112.2	D85 G109	D85-E107 WeakPolarHBondContact O-CB 3.48Å; D85-E107 WeakPolarHBondContact O-CG 3.29Å; E107-G109 PolarHBondContact O-N 2.64Å
108	D	93.6	Very high	97.3	Very high	117 Å²	117	54.4 Å²	54.4	63%	0.626	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.6	179.6	65.6	0.2	0	0	0	113.7	H106 G110 V130	H106-D108 WeakPolarHBondContact CB-OD1 3.48Å; H106-D108 PolarHBondContact O-N 2.81Å; D108-G110 PolarHBondContact OD1-N 3.2Å; D108-V130 HydrophobicContact CB-CG1 4.27Å; D108-V130 WeakPolarHBondContact O-CG1 3.27Å
109	G	94.8	Very high	97.2	Very high	34 Å²	34	54.9 Å²	54.9	35%	0.351	30%	0.297	S	S	.	.	S	Bend	trans	95.7	-1.5	-177.3	0	0	0	0	0	114.7	H106 E107	H106-G109 PolarHBondContact O-N 2.77Å; E107-G109 PolarHBondContact O-N 2.64Å
110	G	97.3	Very high	97.1	Very high	5 Å²	5	56.6 Å²	56.6	5%	0.052	31%	0.305	C	S	.	.			trans	-60.3	154.8	168.4	0	0	0	0	0	111.2	T105 H106 D108 L128	T105-G110 CarbonylContact C-O 3.35Å; T105-G110 WeakPolarHBondContact CA-O 3.46Å; H106-G110 PolarHBondContact CD2-O 2.82Å; H106-G110 PolarHBondContact N-O 3.31Å; D108-G110 PolarHBondContact OD1-N 3.2Å; G110-L128 WeakPolarHBondContact CA-O 3.29Å
111	V	98.2	Very high	97.1	Very high	28 Å²	28	55.9 Å²	55.9	17%	0.17	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130	-172	179.4	0	0	0	0	111.6	L103 Y104 T105 E127 L128	L103-V111 HydrophobicContact CD1-CG1 3.23Å; L103-V111 HydrophobicContact CG-CG1 4.22Å; Y104-V111 CarbonylContact O-C 3.2Å; Y104-V111 WeakPolarHBondContact O-CA 3.49Å; T105-V111 HydrophobicContact CG2-CG2 4.35Å; V111-E127 CarbonylContact O-C 3.55Å; V111-E127 VanDerWaalsContact O-CA 3.29Å; V111-E127 WeakPolarHBondContact O-CA 3.42Å; V111-L128 HydrophobicContact CB-CB 4.4Å; V111-L128 PolarHBondContact N-O 3.37Å; V111-L128 PolarHBondContact O-N 3.19Å
112	L	98.3	Very high	97	Very high	16 Å²	16	50 Å²	50	8%	0.084	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.9	170.5	172.9	69.6	0	0	0	110.2	Y104 L121 A125 E127	Y104-L112 PolarHBondContact N-O 3.27Å; Y104-L112 PolarHBondContact O-N 2.83Å; L112-L121 HydrophobicContact CD2-CD1 3.77Å; L112-L121 HydrophobicContact CD2-CD2 4.34Å; L112-A125 HydrophobicContact CD1-CB 4.03Å; L112-E127 HydrophobicContact CD1-CB 4.37Å
113	H	98.4	Very high	97	Very high	89 Å²	89	50.6 Å²	50.6	41%	0.412	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114.4	165.6	-70	-94.8	0	0	0	108.7	L103 A125 Q126	L103-H113 WeakPolarHBondContact CD1-CE1 3.24Å; H113-A125 CarbonylContact O-C 3.42Å; H113-A125 WeakPolarHBondContact O-CA 3.22Å; H113-Q126 PolarHBondContact N-O 2.8Å; H113-Q126 PolarHBondContact O-N 2.82Å
114	G	98.2	Very high	97	Very high	5 Å²	5	51.6 Å²	51.6	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	158.3	-175.8	0	0	0	0	0	113.5	Q101 G102 Y116	Q101-G114 WeakPolarHBondContact CA-O 3.4Å; G102-G114 PolarHBondContact N-O 2.87Å; G102-G114 PolarHBondContact O-N 3.17Å; G114-Y116 WeakPolarHBondContact O-CD2 3.49Å
115	M	98.4	Very high	97	Very high	58 Å²	58	49.1 Å²	49.1	29%	0.286	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134	162.6	-68.8	-60.4	-58.6	0	0	109.3	G100 Q101 L121 N122 P124	G100-M115 CarbonylContact O-C 3.57Å; G100-M115 WeakPolarHBondContact O-CA 3.5Å; Q101-M115 HydrophobicContact CB-SD 4.47Å; Q101-M115 HydrophobicContact CG-SD 3.55Å; Q101-M115 VanDerWaalsContact CG-SD 3.55Å; M115-L121 CarbonylContact O-C 3.55Å; M115-L121 WeakPolarHBondContact O-CA 3.5Å; M115-N122 CarbonylContact C-O 3.51Å; M115-N122 WeakPolarHBondContact CB-O 3.22Å; M115-N122 CarbonylContact O-C 3.51Å; M115-N122 PolarHBondContact O-N 2.93Å; M115-P124 HydrophobicContact CG-CB 4.49Å; M115-P124 HydrophobicContact CG-CG 4.46Å; M115-P124 PolarHBondContact N-O 2.83Å; M115-P124 VanDerWaalsContact N-O 3.1Å
116	Y	98.1	Very high	97	Very high	13 Å²	13	51.5 Å²	51.5	5%	0.051	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143.3	-176	-65.5	-98.6	0	0	0	110.8	L89 L98 Q99 G100 G102 G114 E120 L121	L89-Y116 HydrophobicContact CD1-CE1 4.45Å; L89-Y116 HydrophobicContact CD1-CE2 4.48Å; L98-Y116 HydrophobicContact CD2-CD1 3.56Å; L98-Y116 HydrophobicContact CD2-CD2 3.82Å; L98-Y116 HydrophobicContact CD2-CE1 3.86Å; L98-Y116 HydrophobicContact CD2-CE2 4.13Å; L98-Y116 HydrophobicContact CD2-CG 3.52Å; L98-Y116 HydrophobicContact CG-CD1 4.27Å; L98-Y116 HydrophobicContact CG-CD2 4.35Å; L98-Y116 HydrophobicContact CG-CG 3.91Å; Q99-Y116 CarbonylContact C-O 3.49Å; G100-Y116 PolarHBondContact N-O 2.79Å; G100-Y116 PolarHBondContact O-N 2.91Å; G102-Y116 VanDerWaalsContact CA-CE2 3.47Å; G114-Y116 WeakPolarHBondContact O-CD2 3.49Å; Y116-E120 CarbonylContact C-O 3.55Å; Y116-E120 VanDerWaalsContact CA-O 3.26Å; Y116-E120 WeakPolarHBondContact CA-O 3.42Å; Y116-L121 HydrophobicContact CD1-CD2 4.18Å; Y116-L121 HydrophobicContact CD1-CG 4.23Å; Y116-L121 HydrophobicContact CD2-CD2 4.27Å; Y116-L121 HydrophobicContact CE1-CD2 3.64Å; Y116-L121 HydrophobicContact CE1-CG 3.67Å; Y116-L121 HydrophobicContact CE2-CD2 3.71Å; Y116-L121 HydrophobicContact CG-CD2 4.49Å
117	V	98.1	Very high	97.2	Very high	69 Å²	69	49.7 Å²	49.7	42%	0.418	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120.6	169.4	179.4	0	0	0	0	106.2	G119 E120 N122	V117-G119 PolarHBondContact O-N 3.49Å; V117-E120 PolarHBondContact N-O 3.38Å; V117-E120 PolarHBondContact O-N 2.98Å; V117-N122 HydrophobicContact CB-CB 4.09Å; V117-N122 HydrophobicContact CG2-CB 3.87Å
118	D	95.3	Very high	97.2	Very high	113 Å²	113	44.9 Å²	44.9	60%	0.604	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	39.6	-179.9	-59.5	-31	0	0	0	113.9	L98 Q99 E120	L98-D118 PolarHBondContact O-N 2.64Å; Q99-D118 PolarHBondContact NE2-OD1 2.8Å; D118-E120 VanDerWaalsContact C-N 3.32Å; D118-E120 PolarHBondContact O-N 3.45Å
119	G	93.3	Very high	97.3	Very high	15 Å²	15	41.1 Å²	41.1	16%	0.155	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	-7.1	-179.8	0	0	0	0	0	115.6	L98 V117	L98-G119 PolarHBondContact O-N 2.82Å; V117-G119 PolarHBondContact O-N 3.49Å
120	E	96.3	Very high	97.4	Very high	81 Å²	81	43.6 Å²	43.6	38%	0.379	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.2	-177.8	-61	-173.3	152.8	0	0	112	Y116 V117 D118 N122	Y116-E120 CarbonylContact C-O 3.55Å; Y116-E120 VanDerWaalsContact CA-O 3.26Å; Y116-E120 WeakPolarHBondContact CA-O 3.42Å; V117-E120 PolarHBondContact N-O 3.38Å; V117-E120 PolarHBondContact O-N 2.98Å; D118-E120 VanDerWaalsContact C-N 3.32Å; D118-E120 PolarHBondContact O-N 3.45Å; E120-N122 WeakPolarHBondContact CB-ND2 3.25Å; E120-N122 PolarHBondContact O-N 3.19Å; E120-N122 VanDerWaalsContact O-N 3.1Å; E120-N122 PolarHBondContact O-ND2 3.05Å
121	L	97.1	Very high	97.3	Very high	13 Å²	13	48.6 Å²	48.6	7%	0.068	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	112.6	173.4	-78.8	166.3	0	0	0	110.3	L112 M115 Y116 Y140 D142 N143	L112-L121 HydrophobicContact CD2-CD1 3.77Å; L112-L121 HydrophobicContact CD2-CD2 4.34Å; M115-L121 CarbonylContact O-C 3.55Å; M115-L121 WeakPolarHBondContact O-CA 3.5Å; Y116-L121 HydrophobicContact CD1-CD2 4.18Å; Y116-L121 HydrophobicContact CD1-CG 4.23Å; Y116-L121 HydrophobicContact CD2-CD2 4.27Å; Y116-L121 HydrophobicContact CE1-CD2 3.64Å; Y116-L121 HydrophobicContact CE1-CG 3.67Å; Y116-L121 HydrophobicContact CE2-CD2 3.71Å; Y116-L121 HydrophobicContact CG-CD2 4.49Å; L121-Y140 HydrophobicContact CB-CD1 4.13Å; L121-Y140 HydrophobicContact CB-CG 4.01Å; L121-Y140 HydrophobicContact CD1-CD1 4.17Å; L121-Y140 HydrophobicContact CD1-CE1 4.27Å; L121-Y140 HydrophobicContact CD1-CG 4.43Å; L121-Y140 WeakPolarHBondContact O-CB 3.48Å; L121-D142 PolarHBondContact O-N 2.85Å; L121-N143 PolarHBondContact N-OD1 2.84Å; L121-N143 PolarHBondContact O-N 2.79Å; L121-N143 VanDerWaalsContact O-N 3.13Å
122	N	98	Very high	97.1	Very high	37 Å²	37	49.6 Å²	49.6	20%	0.198	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	105.7	-176.1	-84.1	-69.9	0	0	0	109.7	M115 V117 E120 Y140 K141 D142	M115-N122 CarbonylContact C-O 3.51Å; M115-N122 WeakPolarHBondContact CB-O 3.22Å; M115-N122 CarbonylContact O-C 3.51Å; M115-N122 PolarHBondContact O-N 2.93Å; V117-N122 HydrophobicContact CB-CB 4.09Å; V117-N122 HydrophobicContact CG2-CB 3.87Å; E120-N122 WeakPolarHBondContact CB-ND2 3.25Å; E120-N122 PolarHBondContact O-N 3.19Å; E120-N122 VanDerWaalsContact O-N 3.1Å; E120-N122 PolarHBondContact O-ND2 3.05Å; N122-Y140 WeakPolarHBondContact CA-O 3.24Å; N122-K141 WeakPolarHBondContact OD1-CA 3.26Å; N122-D142 PolarHBondContact OD1-N 3.15Å
123	G	97.8	Very high	97	Very high	20 Å²	20	54.9 Å²	54.9	21%	0.206	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114	-159.1	-179.4	0	0	0	0	0	113.7	Q139 Y140	G123-Q139 CarbonylContact O-C 3.51Å; G123-Q139 VanDerWaalsContact O-CA 3.31Å; G123-Q139 WeakPolarHBondContact O-CA 3.32Å; G123-Y140 PolarHBondContact N-O 2.96Å; G123-Y140 PolarHBondContact O-N 2.99Å
124	P	98.1	Very high	96.8	Very high	71 Å²	71	53.3 Å²	53.3	46%	0.461	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	140.4	-176.3	-23.9	29	0	0	0	114	M115 Q139	M115-P124 HydrophobicContact CG-CB 4.49Å; M115-P124 HydrophobicContact CG-CG 4.46Å; M115-P124 PolarHBondContact N-O 2.83Å; M115-P124 VanDerWaalsContact N-O 3.1Å; P124-Q139 VanDerWaalsContact CA-NE2 3.34Å; P124-Q139 VanDerWaalsContact CG-OE1 3.29Å; P124-Q139 VanDerWaalsContact N-OE1 3.15Å
125	A	98.2	Very high	96.8	Very high	3 Å²	3	54.4 Å²	54.4	3%	0.025	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	152.3	171.7	0	0	0	0	0	112.8	L112 H113 F136 G138 Y140	L112-A125 HydrophobicContact CD1-CB 4.03Å; H113-A125 CarbonylContact O-C 3.42Å; H113-A125 WeakPolarHBondContact O-CA 3.22Å; A125-F136 HydrophobicContact CB-CE1 4.48Å; A125-G138 PolarHBondContact N-O 3.5Å; A125-G138 PolarHBondContact O-N 2.89Å; A125-Y140 HydrophobicContact CB-CD2 3.51Å; A125-Y140 HydrophobicContact CB-CE2 3.7Å
126	Q	98.3	Very high	96.8	Very high	87 Å²	87	51.7 Å²	51.7	41%	0.407	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	135.9	174.2	-59.5	-171	-80.6	0	0	109.8	H113 L134 F136 K137	H113-Q126 PolarHBondContact N-O 2.8Å; H113-Q126 PolarHBondContact O-N 2.82Å; Q126-L134 HydrophobicContact CB-CD1 4.03Å; Q126-L134 HydrophobicContact CG-CD1 4.48Å; Q126-F136 WeakPolarHBondContact CA-O 3.45Å; Q126-K137 HydrophobicContact CG-CG 4.29Å
127	E	98.3	Very high	96.7	Very high	23 Å²	23	55.8 Å²	55.8	11%	0.107	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.4	177.6	-160.5	-179.3	148.8	0	0	109.4	V111 L112 V135 F136 R145	V111-E127 CarbonylContact O-C 3.55Å; V111-E127 VanDerWaalsContact O-CA 3.29Å; V111-E127 WeakPolarHBondContact O-CA 3.42Å; L112-E127 HydrophobicContact CD1-CB 4.37Å; E127-V135 HydrophobicContact CB-CG2 3.88Å; E127-V135 HydrophobicContact CG-CG2 3.89Å; E127-V135 WeakPolarHBondContact O-CG2 3.47Å; E127-V135 PolarHBondContact O-N 2.99Å; E127-F136 HydrophobicContact CB-CB 3.77Å; E127-F136 PolarHBondContact N-O 2.64Å; E127-F136 PolarHBondContact O-N 2.98Å; E127-R145 IonicContact OE2-NH2 2.71Å
128	L	97.9	Very high	96.7	Very high	46 Å²	46	52.7 Å²	52.7	24%	0.241	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139	176.5	-57.2	168.1	0	0	0	108.4	G110 V111 R133 L134	G110-L128 WeakPolarHBondContact CA-O 3.29Å; V111-L128 HydrophobicContact CB-CB 4.4Å; V111-L128 PolarHBondContact N-O 3.37Å; V111-L128 PolarHBondContact O-N 3.19Å; L128-R133 CarbonylContact C-O 3.59Å; L128-R133 WeakPolarHBondContact CA-O 3.45Å; L128-L134 HydrophobicContact CD2-CB 4.27Å; L128-L134 HydrophobicContact CD2-CD1 4.23Å
129	D	96	Very high	96.8	Very high	37 Å²	37	51 Å²	51	20%	0.198	28%	0.278	C	S	.	.			trans	-73	179.7	168.6	69	15	0	0	0	111.9	D131 G132 R133 V135	D129-D131 PolarHBondContact O-N 3.22Å; D129-D131 WeakPolarHBondContact OD1-CA 3.29Å; D129-D131 WeakPolarHBondContact OD1-CB 3.44Å; D129-D131 PolarHBondContact OD1-N 2.74Å; D129-G132 WeakPolarHBondContact O-CA 3.3Å; D129-G132 PolarHBondContact O-N 2.83Å; D129-G132 PolarHBondContact OD1-N 2.95Å; D129-G132 VanDerWaalsContact OD1-N 3.08Å; D129-R133 PolarHBondContact N-O 2.88Å; D129-R133 WeakPolarHBondContact OD1-CB 3.35Å; D129-R133 PolarHBondContact OD1-N 3.48Å; D129-R133 WeakPolarHBondContact OD2-CB 3.3Å; D129-V135 HydrophobicContact CB-CG1 3.83Å
130	V	95.9	Very high	97	Very high	86 Å²	86	50.8 Å²	50.8	52%	0.521	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.7	-179.9	-53.3	0	0	0	0	113.8	D108 G132	D108-V130 HydrophobicContact CB-CG1 4.27Å; D108-V130 WeakPolarHBondContact O-CG1 3.27Å; V130-G132 VanDerWaalsContact C-N 3.31Å
131	D	94.5	Very high	97.1	Very high	110 Å²	110	52.9 Å²	52.9	59%	0.588	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.2	175.8	-76.9	-12.5	0	0	0	111.8	D129 R133	D129-D131 PolarHBondContact O-N 3.22Å; D129-D131 WeakPolarHBondContact OD1-CA 3.29Å; D129-D131 WeakPolarHBondContact OD1-CB 3.44Å; D129-D131 PolarHBondContact OD1-N 2.74Å; D131-R133 HydrophobicContact CB-CG 4.06Å; D131-R133 IonicContact OD2-CZ 3.94Å; D131-R133 IonicContact OD2-NE 2.68Å; D131-R133 IonicContact OD2-NH2 3.63Å; D131-R133 PolarHBondContact OD2-NH2 3.32Å
132	G	94.6	Very high	97.1	Very high	49 Å²	49	56.2 Å²	56.2	51%	0.505	30%	0.299	S	S	.	.	S	Bend	trans	77.7	19.3	-176.4	0	0	0	0	0	114.1	D129 V130	D129-G132 WeakPolarHBondContact O-CA 3.3Å; D129-G132 PolarHBondContact O-N 2.83Å; D129-G132 PolarHBondContact OD1-N 2.95Å; D129-G132 VanDerWaalsContact OD1-N 3.08Å; V130-G132 VanDerWaalsContact C-N 3.31Å
133	R	95.5	Very high	97	Very high	128 Å²	128	56.2 Å²	56.2	48%	0.483	30%	0.299	S	S	.	.			trans	-86.3	136.8	177	-50.8	175.3	-170.7	176.5	14.3	109.7	L128 D129 D131 V135	L128-R133 CarbonylContact C-O 3.59Å; L128-R133 WeakPolarHBondContact CA-O 3.45Å; D129-R133 PolarHBondContact N-O 2.88Å; D129-R133 WeakPolarHBondContact OD1-CB 3.35Å; D129-R133 PolarHBondContact OD1-N 3.48Å; D129-R133 WeakPolarHBondContact OD2-CB 3.3Å; D131-R133 HydrophobicContact CB-CG 4.06Å; D131-R133 IonicContact OD2-CZ 3.94Å; D131-R133 IonicContact OD2-NE 2.68Å; D131-R133 IonicContact OD2-NH2 3.63Å; D131-R133 PolarHBondContact OD2-NH2 3.32Å; R133-V135 PolarHBondContact O-N 3.28Å
134	L	95.9	Very high	97	Very high	56 Å²	56	58 Å²	58	29%	0.293	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	117.7	175.6	-173.6	72.3	0	0	0	110	Q126 L128 F136 K137 Y152	Q126-L134 HydrophobicContact CB-CD1 4.03Å; Q126-L134 HydrophobicContact CG-CD1 4.48Å; L128-L134 HydrophobicContact CD2-CB 4.27Å; L128-L134 HydrophobicContact CD2-CD1 4.23Å; L134-F136 VanDerWaalsContact CD1-O 3.27Å; L134-F136 WeakPolarHBondContact CD1-O 3.09Å; L134-K137 HydrophobicContact CD2-CB 4.38Å; L134-Y152 HydrophobicContact CD2-CD2 4.06Å; L134-Y152 HydrophobicContact CD2-CE2 3.51Å; L134-Y152 HydrophobicContact CG-CD2 3.94Å; L134-Y152 HydrophobicContact CG-CE2 3.86Å; L134-Y152 WeakPolarHBondContact O-CB 3.3Å
135	V	97.3	Very high	97	Very high	27 Å²	27	56.4 Å²	56.4	16%	0.164	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-24.1	177.3	-64.3	0	0	0	0	112.6	E127 D129 R133 I151 Y152	E127-V135 HydrophobicContact CB-CG2 3.88Å; E127-V135 HydrophobicContact CG-CG2 3.89Å; E127-V135 WeakPolarHBondContact O-CG2 3.47Å; E127-V135 PolarHBondContact O-N 2.99Å; D129-V135 HydrophobicContact CB-CG1 3.83Å; R133-V135 PolarHBondContact O-N 3.28Å; V135-I151 WeakPolarHBondContact O-CA 3.49Å; V135-Y152 PolarHBondContact O-N 2.77Å
136	F	97.8	Very high	96.9	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.009	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	144.1	174.9	172.9	-92.6	0	0	0	112.3	A125 Q126 E127 L134 Y140 R145 C149 W150 I151	A125-F136 HydrophobicContact CB-CE1 4.48Å; Q126-F136 WeakPolarHBondContact CA-O 3.45Å; E127-F136 HydrophobicContact CB-CB 3.77Å; E127-F136 PolarHBondContact N-O 2.64Å; E127-F136 PolarHBondContact O-N 2.98Å; L134-F136 VanDerWaalsContact CD1-O 3.27Å; L134-F136 WeakPolarHBondContact CD1-O 3.09Å; F136-Y140 HydrophobicContact CD1-CE2 4.46Å; F136-Y140 HydrophobicContact CE1-CD2 4.42Å; F136-Y140 AromaticContact CE1-CE2 3.6Å; F136-Y140 HydrophobicContact CE1-CE2 3.6Å; F136-Y140 HydrophobicContact CZ-CE2 4.02Å; F136-R145 HydrophobicContact CE2-CG 4.08Å; F136-R145 HydrophobicContact CZ-CG 3.85Å; F136-C149 HydrophobicContact CE2-CB 3.83Å; F136-C149 HydrophobicContact CZ-CB 4.3Å; F136-W150 WeakPolarHBondContact CA-O 3.4Å; F136-W150 WeakPolarHBondContact CD2-O 3.48Å; F136-I151 HydrophobicContact CD2-CG1 4.27Å
137	K	97.5	Very high	96.8	Very high	98 Å²	98	55.6 Å²	55.6	43%	0.426	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	121.4	167.9	178.3	-178.1	-178.5	-178.9	0	109.9	Q126 L134 C149 W150 Y152	Q126-K137 HydrophobicContact CG-CG 4.29Å; L134-K137 HydrophobicContact CD2-CB 4.38Å; K137-C149 CarbonylContact O-C 3.1Å; K137-W150 HydrophobicContact CB-CB 4.26Å; K137-W150 PolarHBondContact N-O 3.49Å; K137-W150 PolarHBondContact O-N 2.82Å; K137-Y152 HydrophobicContact CB-CE2 4.09Å
138	G	97	Very high	96.7	Very high	5 Å²	5	57.9 Å²	57.9	5%	0.052	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	-153.3	-177.4	0	0	0	0	0	112.7	A125	A125-G138 PolarHBondContact N-O 3.5Å; A125-G138 PolarHBondContact O-N 2.89Å
139	Q	97.3	Very high	96.6	Very high	77 Å²	77	55.7 Å²	55.7	36%	0.36	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	156	174.2	-50.3	-69.7	-67	0	0	109.1	G123 P124 R145 C146	G123-Q139 CarbonylContact O-C 3.51Å; G123-Q139 VanDerWaalsContact O-CA 3.31Å; G123-Q139 WeakPolarHBondContact O-CA 3.32Å; P124-Q139 VanDerWaalsContact CA-NE2 3.34Å; P124-Q139 VanDerWaalsContact CG-OE1 3.29Å; P124-Q139 VanDerWaalsContact N-OE1 3.15Å; Q139-R145 CarbonylContact O-C 3.59Å; Q139-R145 WeakPolarHBondContact O-CA 3.4Å; Q139-C146 PolarHBondContact O-N 3.19Å
140	Y	98.3	Very high	96.6	Very high	11 Å²	11	56.6 Å²	56.6	4%	0.043	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	151.5	170	-79.2	-101.2	0	0	0	110.4	L121 N122 G123 A125 F136 N143 I144 R145 C146	L121-Y140 HydrophobicContact CB-CD1 4.13Å; L121-Y140 HydrophobicContact CB-CG 4.01Å; L121-Y140 HydrophobicContact CD1-CD1 4.17Å; L121-Y140 HydrophobicContact CD1-CE1 4.27Å; L121-Y140 HydrophobicContact CD1-CG 4.43Å; L121-Y140 WeakPolarHBondContact O-CB 3.48Å; N122-Y140 WeakPolarHBondContact CA-O 3.24Å; G123-Y140 PolarHBondContact N-O 2.96Å; G123-Y140 PolarHBondContact O-N 2.99Å; A125-Y140 HydrophobicContact CB-CD2 3.51Å; A125-Y140 HydrophobicContact CB-CE2 3.7Å; F136-Y140 HydrophobicContact CD1-CE2 4.46Å; F136-Y140 HydrophobicContact CE1-CD2 4.42Å; F136-Y140 AromaticContact CE1-CE2 3.6Å; F136-Y140 HydrophobicContact CE1-CE2 3.6Å; F136-Y140 HydrophobicContact CZ-CE2 4.02Å; Y140-N143 WeakPolarHBondContact CD1-O 3.18Å; Y140-I144 CarbonylContact C-O 3.57Å; Y140-I144 VanDerWaalsContact CA-O 3.27Å; Y140-I144 WeakPolarHBondContact CA-O 3.43Å; Y140-R145 HydrophobicContact CD1-CG 4.36Å; Y140-R145 HydrophobicContact CE1-CG 3.67Å; Y140-R145 HydrophobicContact CE2-CG 4.03Å; Y140-R145 VanDerWaalsContact CZ-CG 3.47Å; Y140-R145 WeakPolarHBondContact OH-CG 3.22Å; Y140-R145 PolarHBondContact OH-NE 2.86Å; Y140-C146 VanDerWaalsContact C-SG 3.56Å
141	K	98	Very high	96.7	Very high	125 Å²	125	54.3 Å²	54.3	54%	0.543	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	125.4	166.6	179.8	-177.2	174.4	-167.7	0	107.4	N122 N143 I144 C146	N122-K141 WeakPolarHBondContact OD1-CA 3.26Å; K141-N143 PolarHBondContact O-N 3.42Å; K141-I144 PolarHBondContact N-O 3.06Å; K141-I144 PolarHBondContact O-N 3.41Å; K141-C146 HydrophobicContact CB-CB 4.24Å
142	D	96.3	Very high	96.7	Very high	83 Å²	83	52 Å²	52	44%	0.444	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	43.9	179.6	-45.7	-36.1	0	0	0	111.7	L121 N122 I144	L121-D142 PolarHBondContact O-N 2.85Å; N122-D142 PolarHBondContact OD1-N 3.15Å; D142-I144 PolarHBondContact O-N 2.75Å
143	N	96.5	Very high	96.8	Very high	37 Å²	37	51.6 Å²	51.6	20%	0.198	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	5.3	-174.9	-53.6	-61.7	0	0	0	116.8	Y22 L121 Y140 K141	Y22-N143 WeakPolarHBondContact CE1-O 3.44Å; L121-N143 PolarHBondContact N-OD1 2.84Å; L121-N143 PolarHBondContact O-N 2.79Å; L121-N143 VanDerWaalsContact O-N 3.13Å; Y140-N143 WeakPolarHBondContact CD1-O 3.18Å; K141-N143 PolarHBondContact O-N 3.42Å
144	I	97.2	Very high	96.7	Very high	57 Å²	57	49 Å²	49	29%	0.292	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.3	177.4	-58.9	169.5	0	0	0	109.8	P24 Y140 K141 D142 C146	P24-I144 HydrophobicContact CB-CG1 4.34Å; Y140-I144 CarbonylContact C-O 3.57Å; Y140-I144 VanDerWaalsContact CA-O 3.27Å; Y140-I144 WeakPolarHBondContact CA-O 3.43Å; K141-I144 PolarHBondContact N-O 3.06Å; K141-I144 PolarHBondContact O-N 3.41Å; D142-I144 PolarHBondContact O-N 2.75Å; I144-C146 PolarHBondContact O-N 3.33Å
145	R	97.8	Very high	96.5	Very high	37 Å²	37	46.9 Å²	46.9	14%	0.14	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	135.7	173.9	-69.1	175.3	176.3	168	2.2	109.1	E127 F136 Q139 Y140 V163 G167	E127-R145 IonicContact OE2-NH2 2.71Å; F136-R145 HydrophobicContact CE2-CG 4.08Å; F136-R145 HydrophobicContact CZ-CG 3.85Å; Q139-R145 CarbonylContact O-C 3.59Å; Q139-R145 WeakPolarHBondContact O-CA 3.4Å; Y140-R145 HydrophobicContact CD1-CG 4.36Å; Y140-R145 HydrophobicContact CE1-CG 3.67Å; Y140-R145 HydrophobicContact CE2-CG 4.03Å; Y140-R145 VanDerWaalsContact CZ-CG 3.47Å; Y140-R145 WeakPolarHBondContact OH-CG 3.22Å; Y140-R145 PolarHBondContact OH-NE 2.86Å; R145-V163 HydrophobicContact CB-CG2 4.37Å; R145-V163 VanDerWaalsContact O-CG2 3.31Å; R145-V163 WeakPolarHBondContact O-CG2 3.43Å; R145-G167 VanDerWaalsContact O-CA 3.28Å; R145-G167 WeakPolarHBondContact O-CA 3.42Å
146	C	97.4	Very high	96.4	Very high	41 Å²	41	47.7 Å²	47.7	28%	0.277	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.6	-178.8	72.3	0	0	0	0	113.1	Q139 Y140 K141 I144	Q139-C146 PolarHBondContact O-N 3.19Å; Y140-C146 VanDerWaalsContact C-SG 3.56Å; K141-C146 HydrophobicContact CB-CB 4.24Å; I144-C146 PolarHBondContact O-N 3.33Å
147	G	96	Very high	96.3	Very high	32 Å²	32	47.6 Å²	47.6	33%	0.33	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	70.5	-148.6	177.6	0	0	0	0	0	113.2	Q162 V163	G147-Q162 VanDerWaalsContact O-CA 3.3Å; G147-Q162 WeakPolarHBondContact O-CA 3.47Å; G147-V163 PolarHBondContact O-N 2.9Å
148	E	95.6	Very high	96.2	Very high	72 Å²	72	43.6 Å²	43.6	34%	0.336	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	121.8	179.1	-68.7	172	-179.9	0	0	110.1	F160 G161 R209	E148-F160 HydrophobicContact CB-CE2 3.95Å; E148-F160 HydrophobicContact CB-CZ 4.03Å; E148-F160 HydrophobicContact CG-CE2 4.44Å; E148-F160 HydrophobicContact CG-CZ 4Å; E148-G161 WeakPolarHBondContact CA-O 3.38Å; E148-R209 IonicContact OE1-CZ 3.92Å; E148-R209 IonicContact OE1-NE 3.84Å; E148-R209 IonicContact OE1-NH1 2.83Å; E148-R209 PolarHBondContact OE1-NH1 3.05Å; E148-R209 WeakPolarHBondContact OE2-CD 3.4Å; E148-R209 IonicContact OE2-CZ 3.55Å; E148-R209 IonicContact OE2-NE 3.52Å; E148-R209 IonicContact OE2-NH1 3.52Å
149	C	96.5	Very high	96.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.9	-179.3	-69.6	0	0	0	0	111.4	F136 K137 F160 G161 V163 M169	F136-C149 HydrophobicContact CE2-CB 3.83Å; F136-C149 HydrophobicContact CZ-CB 4.3Å; K137-C149 CarbonylContact O-C 3.1Å; C149-F160 WeakPolarHBondContact O-CA 3.34Å; C149-F160 WeakPolarHBondContact O-CD2 3.35Å; C149-G161 PolarHBondContact N-O 2.93Å; C149-G161 PolarHBondContact O-N 3.35Å; C149-V163 HydrophobicContact CB-CG1 3.93Å; C149-M169 HydrophobicContact CB-CE 3.63Å; C149-M169 WeakPolarHBondContact O-CE 3.39Å
150	W	96.6	Very high	96.2	Very high	55 Å²	55	40.5 Å²	40.5	21%	0.208	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.9	171.8	-63.6	77.7	0	0	0	109.3	F136 K137 Y152 V159 F160 I177 P210	F136-W150 WeakPolarHBondContact CA-O 3.4Å; F136-W150 WeakPolarHBondContact CD2-O 3.48Å; K137-W150 HydrophobicContact CB-CB 4.26Å; K137-W150 PolarHBondContact N-O 3.49Å; K137-W150 PolarHBondContact O-N 2.82Å; W150-Y152 HydrophobicContact CB-CD2 4.31Å; W150-Y152 HydrophobicContact CB-CE2 3.47Å; W150-Y152 VanDerWaalsContact CB-CE2 3.47Å; W150-Y152 WeakPolarHBondContact CB-OH 3.41Å; W150-Y152 HydrophobicContact CE3-CE1 4.25Å; W150-Y152 HydrophobicContact CG-CE2 4.35Å; W150-V159 CarbonylContact C-O 3.57Å; W150-V159 WeakPolarHBondContact CA-O 3.33Å; W150-F160 AromaticContact CD1-CD2 3.85Å; W150-F160 HydrophobicContact CD2-CB 4.18Å; W150-F160 AromaticContact CD2-CD2 3.6Å; W150-F160 HydrophobicContact CD2-CD2 3.6Å; W150-F160 HydrophobicContact CD2-CE2 4.49Å; W150-F160 HydrophobicContact CD2-CG 4.29Å; W150-F160 AromaticContact CE2-CD2 3.21Å; W150-F160 AromaticContact CE2-CE2 3.73Å; W150-F160 HydrophobicContact CE3-CB 3.91Å; W150-F160 HydrophobicContact CE3-CD2 4.18Å; W150-F160 HydrophobicContact CE3-CG 4.43Å; W150-F160 AromaticContact CG-CD2 4Å; W150-F160 HydrophobicContact CG-CD2 4Å; W150-F160 HydrophobicContact CH2-CB 4.22Å; W150-F160 HydrophobicContact CH2-CD2 4.09Å; W150-F160 HydrophobicContact CH2-CG 4.19Å; W150-F160 HydrophobicContact CZ2-CB 4.47Å; W150-F160 AromaticContact CZ2-CD2 3.5Å; W150-F160 HydrophobicContact CZ2-CD2 3.5Å; W150-F160 VanDerWaalsContact CZ2-CD2 3.5Å; W150-F160 AromaticContact CZ2-CE2 3.93Å; W150-F160 HydrophobicContact CZ2-CE2 3.93Å; W150-F160 HydrophobicContact CZ2-CG 4.04Å; W150-F160 HydrophobicContact CZ3-CB 3.94Å; W150-F160 HydrophobicContact CZ3-CD2 4.39Å; W150-F160 HydrophobicContact CZ3-CG 4.38Å; W150-F160 AromaticContact NE1-CD2 3.38Å; W150-F160 AromaticContact NE1-CE2 3.54Å; W150-I177 HydrophobicContact CH2-CD1 4.12Å; W150-I177 HydrophobicContact CZ3-CD1 3.61Å; W150-P210 HydrophobicContact CH2-CB 4.13Å; W150-P210 HydrophobicContact CH2-CG 4.03Å; W150-P210 HydrophobicContact CZ2-CB 4.2Å; W150-P210 HydrophobicContact CZ2-CG 3.68Å
151	I	96.7	Very high	96	Very high	38 Å²	38	40 Å²	40	20%	0.195	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.4	170	-60.5	172.9	0	0	0	106.8	V135 F136 Y153 C158 V159 M169	V135-I151 WeakPolarHBondContact O-CA 3.49Å; F136-I151 HydrophobicContact CD2-CG1 4.27Å; I151-Y153 HydrophobicContact CG2-CE1 4.12Å; I151-C158 CarbonylContact O-C 3.54Å; I151-C158 WeakPolarHBondContact O-CA 3.26Å; I151-C158 WeakPolarHBondContact O-CB 3.29Å; I151-V159 HydrophobicContact CB-CB 4.44Å; I151-V159 PolarHBondContact N-O 3.15Å; I151-V159 PolarHBondContact O-N 2.93Å; I151-M169 HydrophobicContact CD1-CE 3.75Å; I151-M169 HydrophobicContact CD1-CG 3.6Å; I151-M169 HydrophobicContact CG1-CE 3.8Å
152	Y	96	Very high	95.9	Very high	63 Å²	63	40.5 Å²	40.5	25%	0.247	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.1	-176.9	-57.2	-93.6	0	0	0	109.7	L134 V135 K137 W150 C158	L134-Y152 HydrophobicContact CD2-CD2 4.06Å; L134-Y152 HydrophobicContact CD2-CE2 3.51Å; L134-Y152 HydrophobicContact CG-CD2 3.94Å; L134-Y152 HydrophobicContact CG-CE2 3.86Å; L134-Y152 WeakPolarHBondContact O-CB 3.3Å; V135-Y152 PolarHBondContact O-N 2.77Å; K137-Y152 HydrophobicContact CB-CE2 4.09Å; W150-Y152 HydrophobicContact CB-CD2 4.31Å; W150-Y152 HydrophobicContact CB-CE2 3.47Å; W150-Y152 VanDerWaalsContact CB-CE2 3.47Å; W150-Y152 WeakPolarHBondContact CB-OH 3.41Å; W150-Y152 HydrophobicContact CE3-CE1 4.25Å; W150-Y152 HydrophobicContact CG-CE2 4.35Å; Y152-C158 HydrophobicContact CD1-CB 3.75Å; Y152-C158 HydrophobicContact CE1-CB 4.29Å; Y152-C158 HydrophobicContact CG-CB 4.28Å
153	Y	95.4	Very high	96	Very high	39 Å²	39	37.1 Å²	37.1	15%	0.153	20%	0.203	C	C	.	.			trans	-99.2	150	177.2	-58.7	-57.7	0	0	0	111.1	I151 D155 G156 G157 V159 Y176 L339	I151-Y153 HydrophobicContact CG2-CE1 4.12Å; Y153-D155 PolarHBondContact O-N 3.16Å; Y153-D155 VanDerWaalsContact O-N 3.07Å; Y153-G156 PolarHBondContact O-N 3.48Å; Y153-G157 PolarHBondContact N-O 2.99Å; Y153-V159 HydrophobicContact CE2-CG2 3.81Å; Y153-V159 WeakPolarHBondContact OH-CG2 3.31Å; Y153-Y176 HydrophobicContact CD2-CE2 4.08Å; Y153-Y176 HydrophobicContact CE2-CD2 4.24Å; Y153-Y176 AromaticContact CE2-CE2 3.96Å; Y153-Y176 HydrophobicContact CE2-CE2 3.96Å; Y153-L339 HydrophobicContact CD1-CD2 3.71Å; Y153-L339 HydrophobicContact CE1-CD2 3.48Å; Y153-L339 VanDerWaalsContact CE1-CD2 3.48Å; Y153-L339 HydrophobicContact CE2-CD2 4.3Å; Y153-L339 HydrophobicContact CG-CD2 4.22Å
154	P	92.9	Very high	96	Very high	75 Å²	75	37.4 Å²	37.4	49%	0.487	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.6	178.7	-26.9	35.3	0	0	0	114.4	G156	P154-G156 VanDerWaalsContact C-N 3.26Å; P154-G156 PolarHBondContact O-N 2.93Å
155	D	92.9	Very high	95.9	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.053	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-7.3	178.9	58.4	52.4	0	0	0	114.7	Y153 G157 F338 L339 R350	Y153-D155 PolarHBondContact O-N 3.16Å; Y153-D155 VanDerWaalsContact O-N 3.07Å; D155-G157 PolarHBondContact OD1-N 2.83Å; D155-F338 HydrophobicContact CB-CD2 3.48Å; D155-F338 VanDerWaalsContact CB-CD2 3.48Å; D155-F338 HydrophobicContact CB-CE2 3.75Å; D155-F338 HydrophobicContact CB-CG 4.2Å; D155-L339 PolarHBondContact OD2-N 2.81Å; D155-R350 PolarHBondContact O-NH2 2.81Å
156	G	94	Very high	95.8	Very high	45 Å²	45	45.9 Å²	45.9	46%	0.464	25%	0.247	S	C	.	.	S	Bend	trans	98.6	-10.2	179.7	0	0	0	0	0	114.4	Y153 P154	Y153-G156 PolarHBondContact O-N 3.48Å; P154-G156 VanDerWaalsContact C-N 3.26Å; P154-G156 PolarHBondContact O-N 2.93Å
157	G	96	Very high	95.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.			trans	-69.3	159.9	168.4	0	0	0	0	0	112	Y153 D155 I177	Y153-G157 PolarHBondContact N-O 2.99Å; D155-G157 PolarHBondContact OD1-N 2.83Å; G157-I177 CarbonylContact C-O 3.58Å; G157-I177 VanDerWaalsContact CA-O 3.3Å; G157-I177 WeakPolarHBondContact CA-O 3.46Å
158	C	96.4	Very high	95.8	Very high	13 Å²	13	46.3 Å²	46.3	9%	0.088	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	156.4	173.3	61	0	0	0	0	112.6	I151 Y152 Y176 I177	I151-C158 CarbonylContact O-C 3.54Å; I151-C158 WeakPolarHBondContact O-CA 3.26Å; I151-C158 WeakPolarHBondContact O-CB 3.29Å; Y152-C158 HydrophobicContact CD1-CB 3.75Å; Y152-C158 HydrophobicContact CE1-CB 4.29Å; Y152-C158 HydrophobicContact CG-CB 4.28Å; C158-Y176 CarbonylContact O-C 3.57Å; C158-Y176 WeakPolarHBondContact O-CA 3.33Å; C158-I177 PolarHBondContact N-O 2.78Å; C158-I177 PolarHBondContact O-N 2.82Å
159	V	97	Very high	95.8	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134	171.2	177.5	0	0	0	0	109.3	W150 I151 Y153 M169 I174 A175 Y176	W150-V159 CarbonylContact C-O 3.57Å; W150-V159 WeakPolarHBondContact CA-O 3.33Å; I151-V159 HydrophobicContact CB-CB 4.44Å; I151-V159 PolarHBondContact N-O 3.15Å; I151-V159 PolarHBondContact O-N 2.93Å; Y153-V159 HydrophobicContact CE2-CG2 3.81Å; Y153-V159 WeakPolarHBondContact OH-CG2 3.31Å; V159-M169 HydrophobicContact CG1-CB 4.39Å; V159-M169 HydrophobicContact CG1-CE 4.38Å; V159-M169 HydrophobicContact CG1-CG 4.01Å; V159-M169 HydrophobicContact CG1-SD 4.07Å; V159-I174 HydrophobicContact CG1-CG2 3.63Å; V159-A175 CarbonylContact C-O 3.55Å; V159-A175 VanDerWaalsContact CA-O 3.26Å; V159-A175 WeakPolarHBondContact CA-O 3.4Å; V159-Y176 HydrophobicContact CG2-CD2 4.15Å
160	F	96.1	Very high	95.8	Very high	16 Å²	16	44.9 Å²	44.9	7%	0.07	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.1	174.2	170.5	-92.7	0	0	0	110.4	E148 C149 W150 A175 I177 P210 F212	E148-F160 HydrophobicContact CB-CE2 3.95Å; E148-F160 HydrophobicContact CB-CZ 4.03Å; E148-F160 HydrophobicContact CG-CE2 4.44Å; E148-F160 HydrophobicContact CG-CZ 4Å; C149-F160 WeakPolarHBondContact O-CA 3.34Å; C149-F160 WeakPolarHBondContact O-CD2 3.35Å; W150-F160 AromaticContact CD1-CD2 3.85Å; W150-F160 HydrophobicContact CD2-CB 4.18Å; W150-F160 AromaticContact CD2-CD2 3.6Å; W150-F160 HydrophobicContact CD2-CD2 3.6Å; W150-F160 HydrophobicContact CD2-CE2 4.49Å; W150-F160 HydrophobicContact CD2-CG 4.29Å; W150-F160 AromaticContact CE2-CD2 3.21Å; W150-F160 AromaticContact CE2-CE2 3.73Å; W150-F160 HydrophobicContact CE3-CB 3.91Å; W150-F160 HydrophobicContact CE3-CD2 4.18Å; W150-F160 HydrophobicContact CE3-CG 4.43Å; W150-F160 AromaticContact CG-CD2 4Å; W150-F160 HydrophobicContact CG-CD2 4Å; W150-F160 HydrophobicContact CH2-CB 4.22Å; W150-F160 HydrophobicContact CH2-CD2 4.09Å; W150-F160 HydrophobicContact CH2-CG 4.19Å; W150-F160 HydrophobicContact CZ2-CB 4.47Å; W150-F160 AromaticContact CZ2-CD2 3.5Å; W150-F160 HydrophobicContact CZ2-CD2 3.5Å; W150-F160 VanDerWaalsContact CZ2-CD2 3.5Å; W150-F160 AromaticContact CZ2-CE2 3.93Å; W150-F160 HydrophobicContact CZ2-CE2 3.93Å; W150-F160 HydrophobicContact CZ2-CG 4.04Å; W150-F160 HydrophobicContact CZ3-CB 3.94Å; W150-F160 HydrophobicContact CZ3-CD2 4.39Å; W150-F160 HydrophobicContact CZ3-CG 4.38Å; W150-F160 AromaticContact NE1-CD2 3.38Å; W150-F160 AromaticContact NE1-CE2 3.54Å; F160-A175 PolarHBondContact N-O 2.95Å; F160-A175 PolarHBondContact O-N 3.19Å; F160-I177 HydrophobicContact CB-CD1 4.13Å; F160-P210 HydrophobicContact CD1-CB 4.39Å; F160-P210 HydrophobicContact CD1-CG 3.49Å; F160-P210 VanDerWaalsContact CD1-CG 3.49Å; F160-P210 HydrophobicContact CD2-CG 3.88Å; F160-P210 HydrophobicContact CE1-CB 4.35Å; F160-P210 HydrophobicContact CE1-CG 3.18Å; F160-P210 HydrophobicContact CE2-CG 3.56Å; F160-P210 HydrophobicContact CG-CG 3.82Å; F160-P210 HydrophobicContact CZ-CG 3.19Å; F160-F212 AromaticContact CD1-CE2 3.75Å; F160-F212 HydrophobicContact CD1-CE2 3.75Å; F160-F212 HydrophobicContact CD1-CZ 4.02Å; F160-F212 HydrophobicContact CE1-CE2 4.2Å
161	G	95.6	Very high	95.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.5	173.2	175.1	0	0	0	0	0	113.2	E148 C149	E148-G161 WeakPolarHBondContact CA-O 3.38Å; C149-G161 PolarHBondContact N-O 2.93Å; C149-G161 PolarHBondContact O-N 3.35Å
162	Q	96.1	Very high	95.9	Very high	136 Å²	136	45.9 Å²	45.9	64%	0.636	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	124.2	166	-175.5	169.4	-1.9	0	0	108.9	G147	G147-Q162 VanDerWaalsContact O-CA 3.3Å; G147-Q162 WeakPolarHBondContact O-CA 3.47Å
163	V	96.9	Very high	95.9	Very high	13 Å²	13	46 Å²	46	8%	0.079	27%	0.268	C	S	.	.			trans	-75	157.3	177.1	-61.5	0	0	0	0	111.8	R145 G147 C149 E168 M169	R145-V163 HydrophobicContact CB-CG2 4.37Å; R145-V163 VanDerWaalsContact O-CG2 3.31Å; R145-V163 WeakPolarHBondContact O-CG2 3.43Å; G147-V163 PolarHBondContact O-N 2.9Å; C149-V163 HydrophobicContact CB-CG1 3.93Å; V163-E168 CarbonylContact C-O 3.55Å; V163-E168 WeakPolarHBondContact CA-O 3.14Å; V163-E168 WeakPolarHBondContact CB-O 3.48Å; V163-M169 HydrophobicContact CG1-CE 4.13Å; V163-M169 HydrophobicContact CG1-SD 3.89Å
164	N	96.9	Very high	96	Very high	43 Å²	43	44.2 Å²	44.2	23%	0.23	26%	0.261	C	S	.	.			trans	-75.7	-173.8	174.1	71.6	-0.4	0	0	0	112	D166 G167 E168	N164-D166 PolarHBondContact O-N 3.07Å; N164-D166 PolarHBondContact OD1-N 3.43Å; N164-D166 VanDerWaalsContact OD1-N 3.09Å; N164-G167 PolarHBondContact O-N 3.47Å; N164-G167 VanDerWaalsContact O-N 3.12Å; N164-G167 PolarHBondContact OD1-N 2.83Å; N164-E168 PolarHBondContact N-O 3.24Å; N164-E168 PolarHBondContact ND2-OE2 3.28Å; N164-E168 WeakPolarHBondContact OD1-CB 3.35Å; N164-E168 PolarHBondContact OD1-N 2.9Å; N164-E168 PolarHBondContact OD1-O 3Å
165	E	95.9	Very high	96.2	Very high	179 Å²	179	40.6 Å²	40.6	84%	0.836	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.6	-179.9	-63.8	-179.1	-179.8	0	0	113.3
166	D	95.8	Very high	96.5	Very high	92 Å²	92	40.3 Å²	40.3	49%	0.492	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-1.1	177.6	-57.7	-55.3	0	0	0	112.5	N164 E168	N164-D166 PolarHBondContact O-N 3.07Å; N164-D166 PolarHBondContact OD1-N 3.43Å; N164-D166 VanDerWaalsContact OD1-N 3.09Å; D166-E168 HydrophobicContact CB-CG 4.16Å
167	G	95.7	Very high	96.6	Very high	8 Å²	8	38.3 Å²	38.3	8%	0.082	21%	0.214	C	C	.	.	S	Bend	trans	82.1	14.5	179.7	0	0	0	0	0	115	R145 N164	R145-G167 VanDerWaalsContact O-CA 3.28Å; R145-G167 WeakPolarHBondContact O-CA 3.42Å; N164-G167 PolarHBondContact O-N 3.47Å; N164-G167 VanDerWaalsContact O-N 3.12Å; N164-G167 PolarHBondContact OD1-N 2.83Å
168	E	96.1	Very high	96.8	Very high	74 Å²	74	38.4 Å²	38.4	35%	0.346	22%	0.215	S	C	.	.	S	Bend	trans	-92.3	154.2	-178.5	-53.6	169.1	158.4	0	0	111.7	V163 N164 D166 T170	V163-E168 CarbonylContact C-O 3.55Å; V163-E168 WeakPolarHBondContact CA-O 3.14Å; V163-E168 WeakPolarHBondContact CB-O 3.48Å; N164-E168 PolarHBondContact N-O 3.24Å; N164-E168 PolarHBondContact ND2-OE2 3.28Å; N164-E168 WeakPolarHBondContact OD1-CB 3.35Å; N164-E168 PolarHBondContact OD1-N 2.9Å; N164-E168 PolarHBondContact OD1-O 3Å; D166-E168 HydrophobicContact CB-CG 4.16Å; E168-T170 PolarHBondContact O-N 3.18Å
169	M	96.3	Very high	96.8	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.03	22%	0.222	C	C	.	.	S	Bend	trans	-77.1	63.9	174.1	-72.1	-65	-174.9	0	0	111.3	C149 I151 V159 V163 I174 D191 G192	C149-M169 HydrophobicContact CB-CE 3.63Å; C149-M169 WeakPolarHBondContact O-CE 3.39Å; I151-M169 HydrophobicContact CD1-CE 3.75Å; I151-M169 HydrophobicContact CD1-CG 3.6Å; I151-M169 HydrophobicContact CG1-CE 3.8Å; V159-M169 HydrophobicContact CG1-CB 4.39Å; V159-M169 HydrophobicContact CG1-CE 4.38Å; V159-M169 HydrophobicContact CG1-CG 4.01Å; V159-M169 HydrophobicContact CG1-SD 4.07Å; V163-M169 HydrophobicContact CG1-CE 4.13Å; V163-M169 HydrophobicContact CG1-SD 3.89Å; M169-I174 HydrophobicContact CB-CD1 4.19Å; M169-I174 VanDerWaalsContact O-CD1 3.32Å; M169-I174 WeakPolarHBondContact O-CD1 3.47Å; M169-D191 PolarHBondContact O-N 3.43Å; M169-G192 PolarHBondContact O-N 2.99Å
170	T	97.6	Very high	96.8	Very high	37 Å²	37	41.7 Å²	41.7	23%	0.227	23%	0.233	C	C	.	.			trans	-120.1	117.3	-178.4	-61.6	0	0	0	0	110.3	E168 F189 V190 D191	E168-T170 PolarHBondContact O-N 3.18Å; T170-F189 WeakPolarHBondContact CA-O 3.26Å; T170-V190 HydrophobicContact CG2-CG2 4.27Å; T170-D191 PolarHBondContact OG1-N 3.07Å
171	G	97.1	Very high	96.7	Very high	30 Å²	30	42.8 Å²	42.8	31%	0.309	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	163.5	170.8	-177.9	0	0	0	0	0	113.7	S188 F189	G171-S188 CarbonylContact O-C 3.54Å; G171-S188 VanDerWaalsContact O-CA 3.26Å; G171-S188 WeakPolarHBondContact O-CA 3.35Å; G171-F189 PolarHBondContact N-O 2.63Å; G171-F189 PolarHBondContact O-N 2.8Å
172	S	96.9	Very high	96.7	Very high	84 Å²	84	45.9 Å²	45.9	59%	0.587	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	6.9	-175.6	59.8	0	0	0	0	115.2	G187	S172-G187 CarbonylContact C-O 3.52Å
173	S	95.4	Very high	96.8	Very high	65 Å²	65	39.8 Å²	39.8	46%	0.455	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	51.8	-175.2	-68.6	0	0	0	0	110.7	Y186 G187	S173-Y186 VanDerWaalsContact CB-OH 3.26Å; S173-Y186 WeakPolarHBondContact CB-OH 3.28Å; S173-Y186 PolarHBondContact OG-OH 3.34Å; S173-G187 PolarHBondContact N-O 2.76Å
174	I	97.8	Very high	96.8	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	145	180	-59.9	-175.7	0	0	0	108.3	V159 M169 Y186 G187 F189	V159-I174 HydrophobicContact CG1-CG2 3.63Å; M169-I174 HydrophobicContact CB-CD1 4.19Å; M169-I174 VanDerWaalsContact O-CD1 3.32Å; M169-I174 WeakPolarHBondContact O-CD1 3.47Å; I174-Y186 WeakPolarHBondContact O-CA 3.14Å; I174-Y186 WeakPolarHBondContact O-CD2 3.13Å; I174-G187 PolarHBondContact N-O 2.86Å; I174-G187 PolarHBondContact O-N 3.49Å; I174-F189 HydrophobicContact CB-CB 4.01Å; I174-F189 HydrophobicContact CB-CD1 4.49Å; I174-F189 HydrophobicContact CB-CD2 3.58Å; I174-F189 HydrophobicContact CB-CE2 4.15Å; I174-F189 HydrophobicContact CB-CG 3.81Å; I174-F189 HydrophobicContact CD1-CB 4Å; I174-F189 HydrophobicContact CG1-CB 4.5Å; I174-F189 HydrophobicContact CG2-CB 4.03Å; I174-F189 HydrophobicContact CG2-CD1 3.81Å; I174-F189 HydrophobicContact CG2-CD2 3.76Å; I174-F189 HydrophobicContact CG2-CE1 4.14Å; I174-F189 HydrophobicContact CG2-CE2 4.12Å; I174-F189 HydrophobicContact CG2-CG 3.62Å; I174-F189 HydrophobicContact CG2-CZ 4.29Å; I174-F189 WeakPolarHBondContact O-CE2 3.46Å
175	A	97.7	Very high	96.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.9	178.2	0	0	0	0	0	110.6	V159 F160 I177 L185 Y186 F212	V159-A175 CarbonylContact C-O 3.55Å; V159-A175 VanDerWaalsContact CA-O 3.26Å; V159-A175 WeakPolarHBondContact CA-O 3.4Å; F160-A175 PolarHBondContact N-O 2.95Å; F160-A175 PolarHBondContact O-N 3.19Å; A175-I177 HydrophobicContact CB-CG1 4.27Å; A175-L185 CarbonylContact C-O 3.56Å; A175-L185 VanDerWaalsContact CA-O 3.3Å; A175-L185 WeakPolarHBondContact CA-O 3.3Å; A175-Y186 HydrophobicContact CB-CD2 3.94Å; A175-F212 HydrophobicContact CB-CD1 4.06Å; A175-F212 HydrophobicContact CB-CD2 4.23Å; A175-F212 HydrophobicContact CB-CE1 3.45Å; A175-F212 VanDerWaalsContact CB-CE1 3.45Å; A175-F212 HydrophobicContact CB-CE2 3.68Å; A175-F212 HydrophobicContact CB-CG 4.41Å; A175-F212 HydrophobicContact CB-CZ 3.24Å
176	Y	98.4	Very high	97	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.9	150.3	176.9	-87.3	0	0	0	108.2	Y153 C158 V159 Y178 A184 L185 F338 P341	Y153-Y176 HydrophobicContact CD2-CE2 4.08Å; Y153-Y176 HydrophobicContact CE2-CD2 4.24Å; Y153-Y176 AromaticContact CE2-CE2 3.96Å; Y153-Y176 HydrophobicContact CE2-CE2 3.96Å; C158-Y176 CarbonylContact O-C 3.57Å; C158-Y176 WeakPolarHBondContact O-CA 3.33Å; V159-Y176 HydrophobicContact CG2-CD2 4.15Å; Y176-Y178 HydrophobicContact CD1-CD2 4.07Å; Y176-Y178 HydrophobicContact CD1-CE2 4.18Å; Y176-Y178 HydrophobicContact CD1-CG 4.38Å; Y176-Y178 AromaticContact CE1-CD1 3.88Å; Y176-Y178 HydrophobicContact CE1-CD1 3.88Å; Y176-Y178 AromaticContact CE1-CD2 3.95Å; Y176-Y178 HydrophobicContact CE1-CD2 3.95Å; Y176-Y178 HydrophobicContact CE1-CE1 4.13Å; Y176-Y178 HydrophobicContact CE1-CE2 4.19Å; Y176-Y178 AromaticContact CE1-CG 3.81Å; Y176-Y178 HydrophobicContact CE1-CG 3.81Å; Y176-A184 CarbonylContact O-C 3.52Å; Y176-A184 WeakPolarHBondContact O-CA 3.23Å; Y176-A184 VanDerWaalsContact O-CB 3.3Å; Y176-A184 WeakPolarHBondContact O-CB 3.4Å; Y176-L185 PolarHBondContact N-O 2.86Å; Y176-L185 PolarHBondContact O-N 3.15Å; Y176-F338 WeakPolarHBondContact OH-CE1 3.28Å; Y176-F338 VanDerWaalsContact OH-CZ 3.28Å; Y176-F338 WeakPolarHBondContact OH-CZ 3.36Å; Y176-P341 HydrophobicContact CD1-CB 4.03Å; Y176-P341 HydrophobicContact CD1-CG 3.48Å; Y176-P341 VanDerWaalsContact CD1-CG 3.48Å; Y176-P341 HydrophobicContact CD2-CB 3.74Å; Y176-P341 HydrophobicContact CD2-CG 4Å; Y176-P341 HydrophobicContact CE1-CB 4.43Å; Y176-P341 HydrophobicContact CE1-CG 3.63Å; Y176-P341 HydrophobicContact CE2-CB 4.17Å; Y176-P341 HydrophobicContact CE2-CG 4.14Å; Y176-P341 HydrophobicContact CG-CB 3.64Å; Y176-P341 HydrophobicContact CG-CG 3.66Å; Y176-P341 VanDerWaalsContact CZ-CD 3.49Å
177	I	98.1	Very high	97.2	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.3	178.1	-57.5	155.7	0	0	0	107.3	W150 G157 C158 F160 A175 A184 L202 F212	W150-I177 HydrophobicContact CH2-CD1 4.12Å; W150-I177 HydrophobicContact CZ3-CD1 3.61Å; G157-I177 CarbonylContact C-O 3.58Å; G157-I177 VanDerWaalsContact CA-O 3.3Å; G157-I177 WeakPolarHBondContact CA-O 3.46Å; C158-I177 PolarHBondContact N-O 2.78Å; C158-I177 PolarHBondContact O-N 2.82Å; F160-I177 HydrophobicContact CB-CD1 4.13Å; A175-I177 HydrophobicContact CB-CG1 4.27Å; I177-A184 HydrophobicContact CG1-CB 4.2Å; I177-L202 HydrophobicContact CD1-CD2 4.19Å; I177-F212 HydrophobicContact CD1-CE1 4.13Å; I177-F212 HydrophobicContact CD1-CZ 4.03Å; I177-F212 HydrophobicContact CG1-CE1 3.91Å; I177-F212 HydrophobicContact CG1-CZ 4.25Å
178	Y	98.5	Very high	97.3	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.008	19%	0.19	C	C	.	.			trans	-69.7	167	179	-76.6	-93.4	0	0	0	111.9	Y176 D180 G181 T183 L185 D239 Y241 F274 H340	Y176-Y178 HydrophobicContact CD1-CD2 4.07Å; Y176-Y178 HydrophobicContact CD1-CE2 4.18Å; Y176-Y178 HydrophobicContact CD1-CG 4.38Å; Y176-Y178 AromaticContact CE1-CD1 3.88Å; Y176-Y178 HydrophobicContact CE1-CD1 3.88Å; Y176-Y178 AromaticContact CE1-CD2 3.95Å; Y176-Y178 HydrophobicContact CE1-CD2 3.95Å; Y176-Y178 HydrophobicContact CE1-CE1 4.13Å; Y176-Y178 HydrophobicContact CE1-CE2 4.19Å; Y176-Y178 AromaticContact CE1-CG 3.81Å; Y176-Y178 HydrophobicContact CE1-CG 3.81Å; Y178-D180 PolarHBondContact O-N 3.21Å; Y178-G181 PolarHBondContact O-N 2.89Å; Y178-T183 HydrophobicContact CD2-CG2 3.67Å; Y178-T183 WeakPolarHBondContact CD2-O 3.35Å; Y178-T183 HydrophobicContact CE2-CG2 4.07Å; Y178-T183 HydrophobicContact CG-CG2 4.36Å; Y178-T183 PolarHBondContact N-O 3.25Å; Y178-L185 HydrophobicContact CE2-CD1 4.39Å; Y178-L185 HydrophobicContact CE2-CD2 4.42Å; Y178-L185 HydrophobicContact CE2-CG 3.95Å; Y178-D239 PolarHBondContact OH-OD2 2.9Å; Y178-Y241 VanDerWaalsContact CB-CD2 3.45Å; Y178-Y241 HydrophobicContact CD1-CD1 4.12Å; Y178-Y241 AromaticContact CD1-CD2 3.84Å; Y178-Y241 HydrophobicContact CD1-CD2 3.84Å; Y178-Y241 AromaticContact CD1-CG 3.51Å; Y178-Y241 HydrophobicContact CD1-CG 3.51Å; Y178-Y241 VanDerWaalsContact CE1-CB 3.46Å; Y178-Y241 HydrophobicContact CE1-CG 4.07Å; Y178-Y241 AromaticContact CG-CD2 3.76Å; Y178-Y241 HydrophobicContact CG-CD2 3.76Å; Y178-Y241 AromaticContact CG-CG 3.87Å; Y178-Y241 HydrophobicContact CG-CG 3.87Å; Y178-F274 HydrophobicContact CD1-CE2 4.47Å; Y178-F274 HydrophobicContact CD1-CZ 4.01Å; Y178-F274 AromaticContact CE1-CE2 3.93Å; Y178-F274 HydrophobicContact CE1-CE2 3.93Å; Y178-F274 AromaticContact CE1-CZ 3.84Å; Y178-F274 HydrophobicContact CE1-CZ 3.84Å; Y178-H340 AromaticContact CE1-NE2 3.75Å
179	P	97.6	Very high	97.4	Very high	36 Å²	36	25.5 Å²	25.5	23%	0.234	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-14.1	-176.6	-26.3	34.7	0	0	0	116.5	G181 V271 F338	P179-G181 PolarHBondContact O-N 3.34Å; P179-V271 HydrophobicContact CB-CG2 4.29Å; P179-V271 HydrophobicContact CG-CB 4.39Å; P179-V271 HydrophobicContact CG-CG2 3.99Å; P179-F338 HydrophobicContact CG-CE2 3.77Å; P179-F338 HydrophobicContact CG-CZ 4.07Å
180	D	95.8	Very high	97.4	Very high	47 Å²	47	28.9 Å²	28.9	25%	0.251	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.9	172.5	64.3	4.8	0	0	0	113.3	Y178 C182 T183 Y241	Y178-D180 PolarHBondContact O-N 3.21Å; D180-C182 PolarHBondContact O-N 3.15Å; D180-C182 PolarHBondContact O-SG 2.91Å; D180-C182 PolarHBondContact OD1-N 2.78Å; D180-T183 PolarHBondContact OD1-N 3.39Å; D180-T183 VanDerWaalsContact OD2-CB 3.26Å; D180-T183 WeakPolarHBondContact OD2-CB 3.32Å; D180-T183 PolarHBondContact OD2-N 2.86Å; D180-T183 PolarHBondContact OD2-OG1 2.76Å; D180-Y241 HydrophobicContact CB-CE2 3.85Å
181	G	94.6	Very high	97.1	Very high	40 Å²	40	30.9 Å²	30.9	41%	0.412	20%	0.204	S	C	.	.	S	Bend	trans	65.1	13.4	-176.9	0	0	0	0	0	113.7	Y178 P179 L202	Y178-G181 PolarHBondContact O-N 2.89Å; P179-G181 PolarHBondContact O-N 3.34Å; G181-L202 WeakPolarHBondContact O-CD2 3.45Å
182	C	95.4	Very high	96.7	Very high	65 Å²	65	30.4 Å²	30.4	44%	0.439	20%	0.199	S	C	.	.	S	Bend	trans	-132.3	-48.5	-171.8	-66.2	0	0	0	0	112.4	D180 T201 L202	D180-C182 PolarHBondContact O-N 3.15Å; D180-C182 PolarHBondContact O-SG 2.91Å; D180-C182 PolarHBondContact OD1-N 2.78Å; C182-T201 CarbonylContact O-C 3.59Å; C182-T201 WeakPolarHBondContact O-CA 3.45Å; C182-L202 PolarHBondContact O-N 3.23Å
183	T	98	Very high	96.6	Very high	7 Å²	7	30.9 Å²	30.9	4%	0.043	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.2	177.4	-58.2	0	0	0	0	108.8	Y178 D180 L199 Q244	Y178-T183 HydrophobicContact CD2-CG2 3.67Å; Y178-T183 WeakPolarHBondContact CD2-O 3.35Å; Y178-T183 HydrophobicContact CE2-CG2 4.07Å; Y178-T183 HydrophobicContact CG-CG2 4.36Å; Y178-T183 PolarHBondContact N-O 3.25Å; D180-T183 PolarHBondContact OD1-N 3.39Å; D180-T183 VanDerWaalsContact OD2-CB 3.26Å; D180-T183 WeakPolarHBondContact OD2-CB 3.32Å; D180-T183 PolarHBondContact OD2-N 2.86Å; D180-T183 PolarHBondContact OD2-OG1 2.76Å; T183-L199 HydrophobicContact CG2-CD1 3.82Å; T183-Q244 PolarHBondContact OG1-NE2 3.03Å
184	A	98.3	Very high	96.7	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154	-178	0	0	0	0	0	112.5	Y176 I177 L199 A200 F212	Y176-A184 CarbonylContact O-C 3.52Å; Y176-A184 WeakPolarHBondContact O-CA 3.23Å; Y176-A184 VanDerWaalsContact O-CB 3.3Å; Y176-A184 WeakPolarHBondContact O-CB 3.4Å; I177-A184 HydrophobicContact CG1-CB 4.2Å; A184-L199 CarbonylContact O-C 3.53Å; A184-L199 WeakPolarHBondContact O-CA 3.49Å; A184-A200 PolarHBondContact N-O 3.23Å; A184-A200 PolarHBondContact O-N 3.32Å; A184-F212 HydrophobicContact CB-CD1 3.86Å; A184-F212 HydrophobicContact CB-CE1 3.91Å
185	L	98.6	Very high	96.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	112.8	162.6	-59.8	-178.2	0	0	0	107.6	A175 Y176 Y178 I194 A197 H198 Y221 P240 P341	A175-L185 CarbonylContact C-O 3.56Å; A175-L185 VanDerWaalsContact CA-O 3.3Å; A175-L185 WeakPolarHBondContact CA-O 3.3Å; Y176-L185 PolarHBondContact N-O 2.86Å; Y176-L185 PolarHBondContact O-N 3.15Å; Y178-L185 HydrophobicContact CE2-CD1 4.39Å; Y178-L185 HydrophobicContact CE2-CD2 4.42Å; Y178-L185 HydrophobicContact CE2-CG 3.95Å; L185-I194 HydrophobicContact CB-CD1 3.92Å; L185-I194 HydrophobicContact CD1-CD1 3.63Å; L185-I194 HydrophobicContact CG-CD1 4.44Å; L185-A197 HydrophobicContact CB-CB 3.96Å; L185-H198 WeakPolarHBondContact CA-O 3.3Å; L185-Y221 HydrophobicContact CD1-CG 4.28Å; L185-Y221 HydrophobicContact CD2-CD2 3.65Å; L185-Y221 HydrophobicContact CD2-CE2 4.02Å; L185-Y221 HydrophobicContact CD2-CG 3.94Å; L185-P240 HydrophobicContact CD2-CG 4.13Å; L185-P341 HydrophobicContact CD1-CB 4.5Å; L185-P341 HydrophobicContact CD1-CG 3.88Å
186	Y	98.4	Very high	96.7	Very high	55 Å²	55	37.3 Å²	37.3	22%	0.216	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.2	-174.6	-178.6	-106.7	0	0	0	111.1	S173 I174 A175 H198 F212 I214	S173-Y186 VanDerWaalsContact CB-OH 3.26Å; S173-Y186 WeakPolarHBondContact CB-OH 3.28Å; S173-Y186 PolarHBondContact OG-OH 3.34Å; I174-Y186 WeakPolarHBondContact O-CA 3.14Å; I174-Y186 WeakPolarHBondContact O-CD2 3.13Å; A175-Y186 HydrophobicContact CB-CD2 3.94Å; Y186-H198 PolarHBondContact N-O 2.99Å; Y186-H198 PolarHBondContact O-N 2.89Å; Y186-F212 HydrophobicContact CD1-CB 4.24Å; Y186-F212 HydrophobicContact CD2-CB 3.99Å; Y186-F212 AromaticContact CD2-CD2 3.6Å; Y186-F212 HydrophobicContact CD2-CD2 3.6Å; Y186-F212 HydrophobicContact CD2-CE2 4.27Å; Y186-F212 AromaticContact CD2-CG 3.78Å; Y186-F212 HydrophobicContact CD2-CG 3.78Å; Y186-F212 HydrophobicContact CE2-CB 4.4Å; Y186-F212 AromaticContact CE2-CD2 3.65Å; Y186-F212 HydrophobicContact CE2-CD2 3.65Å; Y186-F212 HydrophobicContact CE2-CE2 4.32Å; Y186-F212 HydrophobicContact CE2-CG 4.23Å; Y186-F212 HydrophobicContact CG-CB 3.87Å; Y186-F212 HydrophobicContact CG-CD2 4.35Å; Y186-F212 HydrophobicContact CG-CG 4.11Å; Y186-I214 HydrophobicContact CD1-CD1 4.02Å; Y186-I214 HydrophobicContact CD1-CG1 4.06Å; Y186-I214 HydrophobicContact CE1-CD1 4.49Å
187	G	98	Very high	96.7	Very high	10 Å²	10	37.1 Å²	37.1	10%	0.103	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.7	-138.1	178.8	0	0	0	0	0	113.7	S172 S173 I174 E196	S172-G187 CarbonylContact C-O 3.52Å; S173-G187 PolarHBondContact N-O 2.76Å; I174-G187 PolarHBondContact N-O 2.86Å; I174-G187 PolarHBondContact O-N 3.49Å; G187-E196 CarbonylContact C-O 3.49Å; G187-E196 WeakPolarHBondContact CA-O 3.46Å
188	S	98.2	Very high	96.8	Very high	42 Å²	42	39.4 Å²	39.4	29%	0.294	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128	-174.6	-55	0	0	0	0	112.7	G171 I195 E196	G171-S188 CarbonylContact O-C 3.54Å; G171-S188 VanDerWaalsContact O-CA 3.26Å; G171-S188 WeakPolarHBondContact O-CA 3.35Å; S188-I195 PolarHBondContact O-N 2.93Å; S188-E196 PolarHBondContact N-O 3.07Å; S188-E196 PolarHBondContact O-N 2.7Å
189	F	98.3	Very high	96.8	Very high	3 Å²	3	41.2 Å²	41.2	1%	0.013	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	152.4	-179.5	-70.7	-125.3	0	0	0	110.1	T170 G171 I174 G192 E193 I194 A197	T170-F189 WeakPolarHBondContact CA-O 3.26Å; G171-F189 PolarHBondContact N-O 2.63Å; G171-F189 PolarHBondContact O-N 2.8Å; I174-F189 HydrophobicContact CB-CB 4.01Å; I174-F189 HydrophobicContact CB-CD1 4.49Å; I174-F189 HydrophobicContact CB-CD2 3.58Å; I174-F189 HydrophobicContact CB-CE2 4.15Å; I174-F189 HydrophobicContact CB-CG 3.81Å; I174-F189 HydrophobicContact CD1-CB 4Å; I174-F189 HydrophobicContact CG1-CB 4.5Å; I174-F189 HydrophobicContact CG2-CB 4.03Å; I174-F189 HydrophobicContact CG2-CD1 3.81Å; I174-F189 HydrophobicContact CG2-CD2 3.76Å; I174-F189 HydrophobicContact CG2-CE1 4.14Å; I174-F189 HydrophobicContact CG2-CE2 4.12Å; I174-F189 HydrophobicContact CG2-CG 3.62Å; I174-F189 HydrophobicContact CG2-CZ 4.29Å; I174-F189 WeakPolarHBondContact O-CE2 3.46Å; F189-G192 WeakPolarHBondContact CD1-O 3.44Å; F189-E193 CarbonylContact C-O 3.58Å; F189-E193 WeakPolarHBondContact CA-O 3.27Å; F189-E193 WeakPolarHBondContact CB-O 3.42Å; F189-I194 HydrophobicContact CD1-CG1 4.02Å; F189-I194 HydrophobicContact CE1-CD1 4.21Å; F189-I194 HydrophobicContact CE1-CG1 3.45Å; F189-I194 VanDerWaalsContact CE1-CG1 3.45Å; F189-I194 HydrophobicContact CE2-CD1 4.49Å; F189-I194 HydrophobicContact CE2-CG1 4Å; F189-I194 HydrophobicContact CZ-CD1 3.83Å; F189-I194 HydrophobicContact CZ-CG1 3.44Å; F189-I194 VanDerWaalsContact CZ-CG1 3.44Å; F189-A197 HydrophobicContact CE2-CB 4.34Å
190	V	97.3	Very high	96.8	Very high	76 Å²	76	39.5 Å²	39.5	46%	0.461	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.1	169	173.9	0	0	0	0	107.1	T170 G192 E193 I195	T170-V190 HydrophobicContact CG2-CG2 4.27Å; V190-G192 PolarHBondContact O-N 2.88Å; V190-G192 VanDerWaalsContact O-N 3.16Å; V190-E193 PolarHBondContact N-O 2.86Å; V190-E193 WeakPolarHBondContact O-CB 3.48Å; V190-E193 PolarHBondContact O-N 3.38Å; V190-I195 HydrophobicContact CB-CD1 4.13Å; V190-I195 HydrophobicContact CB-CG1 4.15Å; V190-I195 HydrophobicContact CG2-CD1 4.01Å; V190-I195 HydrophobicContact CG2-CG1 3.66Å
191	D	91.4	Very high	96.8	Very high	80 Å²	80	40.7 Å²	40.7	43%	0.428	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	38.6	-175.1	-161.5	21.8	0	0	0	113.4	H21 M169 T170 E193	H21-D191 IonicContact CE1-OD2 3.75Å; M169-D191 PolarHBondContact O-N 3.43Å; T170-D191 PolarHBondContact OG1-N 3.07Å; D191-E193 PolarHBondContact O-N 2.94Å
192	G	88.9	Confident	96.8	Very high	20 Å²	20	40.5 Å²	40.5	21%	0.206	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	-3.2	-178.1	0	0	0	0	0	115.7	M169 F189 V190	M169-G192 PolarHBondContact O-N 2.99Å; F189-G192 WeakPolarHBondContact CD1-O 3.44Å; V190-G192 PolarHBondContact O-N 2.88Å; V190-G192 VanDerWaalsContact O-N 3.16Å
193	E	93.8	Very high	96.5	Very high	93 Å²	93	39.8 Å²	39.8	44%	0.435	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	139.2	172	-61.8	-167.1	155	0	0	111.5	F189 V190 D191 I195 Y223	F189-E193 CarbonylContact C-O 3.58Å; F189-E193 WeakPolarHBondContact CA-O 3.27Å; F189-E193 WeakPolarHBondContact CB-O 3.42Å; V190-E193 PolarHBondContact N-O 2.86Å; V190-E193 WeakPolarHBondContact O-CB 3.48Å; V190-E193 PolarHBondContact O-N 3.38Å; D191-E193 PolarHBondContact O-N 2.94Å; E193-I195 PolarHBondContact O-N 2.87Å; E193-Y223 WeakPolarHBondContact OE1-CE1 3.25Å
194	I	97.5	Very high	95.3	Very high	4 Å²	4	45 Å²	45	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.5	179.4	-59	-172.8	0	0	0	110.5	L185 F189 A197 Y221 Y223 P341	L185-I194 HydrophobicContact CB-CD1 3.92Å; L185-I194 HydrophobicContact CD1-CD1 3.63Å; L185-I194 HydrophobicContact CG-CD1 4.44Å; F189-I194 HydrophobicContact CD1-CG1 4.02Å; F189-I194 HydrophobicContact CE1-CD1 4.21Å; F189-I194 HydrophobicContact CE1-CG1 3.45Å; F189-I194 VanDerWaalsContact CE1-CG1 3.45Å; F189-I194 HydrophobicContact CE2-CD1 4.49Å; F189-I194 HydrophobicContact CE2-CG1 4Å; F189-I194 HydrophobicContact CZ-CD1 3.83Å; F189-I194 HydrophobicContact CZ-CG1 3.44Å; F189-I194 VanDerWaalsContact CZ-CG1 3.44Å; I194-A197 HydrophobicContact CD1-CB 4.12Å; I194-A197 HydrophobicContact CG2-CB 3.58Å; I194-Y221 VanDerWaalsContact CG2-O 3.29Å; I194-Y221 WeakPolarHBondContact CG2-O 3.44Å; I194-Y223 WeakPolarHBondContact O-CB 3.45Å; I194-Y223 PolarHBondContact O-N 3.07Å; I194-P341 HydrophobicContact CD1-CB 3.64Å; I194-P341 HydrophobicContact CD1-CG 4.37Å; I194-P341 HydrophobicContact CG1-CB 4.21Å
195	I	98.2	Very high	93.2	Very high	96 Å²	96	46.4 Å²	46.4	49%	0.492	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-52.5	164.6	-55.4	-53.1	0	0	0	110.1	S188 V190 E193 S222	S188-I195 PolarHBondContact O-N 2.93Å; V190-I195 HydrophobicContact CB-CD1 4.13Å; V190-I195 HydrophobicContact CB-CG1 4.15Å; V190-I195 HydrophobicContact CG2-CD1 4.01Å; V190-I195 HydrophobicContact CG2-CG1 3.66Å; E193-I195 PolarHBondContact O-N 2.87Å; I195-S222 VanDerWaalsContact O-CB 3.31Å; I195-S222 WeakPolarHBondContact O-CB 3.31Å
196	E	98.1	Very high	90.9	Very high	101 Å²	101	58.9 Å²	58.9	47%	0.472	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	114.1	-180	-172.2	-178.9	137	0	0	109.4	G187 S188 V220	G187-E196 CarbonylContact C-O 3.49Å; G187-E196 WeakPolarHBondContact CA-O 3.46Å; S188-E196 PolarHBondContact N-O 3.07Å; S188-E196 PolarHBondContact O-N 2.7Å; E196-V220 HydrophobicContact CB-CG1 4.5Å; E196-V220 HydrophobicContact CG-CG1 3.61Å; E196-V220 HydrophobicContact CG-CG2 4.23Å
197	A	98.4	Very high	88.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	154.1	177.7	0	0	0	0	0	112.3	L185 F189 I194 Y221	L185-A197 HydrophobicContact CB-CB 3.96Å; F189-A197 HydrophobicContact CE2-CB 4.34Å; I194-A197 HydrophobicContact CD1-CB 4.12Å; I194-A197 HydrophobicContact CG2-CB 3.58Å; A197-Y221 PolarHBondContact N-O 3Å; A197-Y221 PolarHBondContact O-N 3.38Å
198	H	98.6	Very high	87.5	Confident	51 Å²	51	64.1 Å²	64.1	24%	0.236	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148.3	174.8	-65.8	-72.8	0	0	0	110.4	L185 Y186 A200 I214 S218 P219 V220	L185-H198 WeakPolarHBondContact CA-O 3.3Å; Y186-H198 PolarHBondContact N-O 2.99Å; Y186-H198 PolarHBondContact O-N 2.89Å; H198-A200 PolarHBondContact O-N 3.47Å; H198-I214 HydrophobicContact CB-CG2 3.76Å; H198-S218 WeakPolarHBondContact CA-OG 3.09Å; H198-S218 PolarHBondContact ND1-O 2.87Å; H198-P219 PolarHBondContact ND1-O 3.16Å; H198-P219 VanDerWaalsContact ND1-O 3.16Å; H198-V220 VanDerWaalsContact CE1-CG2 3.48Å; H198-V220 WeakPolarHBondContact CE1-CG2 3.22Å
199	L	98.6	Very high	86.6	Confident	40 Å²	40	69.2 Å²	69.2	21%	0.209	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	129.2	167.8	177.8	60.8	0	0	0	109.4	T183 A184 A215 S218 Y221 P240	T183-L199 HydrophobicContact CG2-CD1 3.82Å; A184-L199 CarbonylContact O-C 3.53Å; A184-L199 WeakPolarHBondContact O-CA 3.49Å; L199-A215 HydrophobicContact CB-CB 4.23Å; L199-A215 HydrophobicContact CD2-CB 4.12Å; L199-A215 HydrophobicContact CG-CB 4.02Å; L199-A215 WeakPolarHBondContact O-CB 3.12Å; L199-A215 PolarHBondContact O-N 2.78Å; L199-S218 WeakPolarHBondContact CB-OG 3.47Å; L199-S218 PolarHBondContact N-OG 2.78Å; L199-Y221 HydrophobicContact CB-CE2 4.24Å; L199-P240 HydrophobicContact CD1-CB 3.67Å; L199-P240 HydrophobicContact CD1-CG 3.88Å; L199-P240 HydrophobicContact CD2-CB 3.8Å; L199-P240 HydrophobicContact CG-CB 4.24Å
200	A	98.1	Very high	86.1	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	163.6	176	0	0	0	0	0	110.2	A184 H198 F212 Q213 I214	A184-A200 PolarHBondContact N-O 3.23Å; A184-A200 PolarHBondContact O-N 3.32Å; H198-A200 PolarHBondContact O-N 3.47Å; A200-F212 HydrophobicContact CB-CB 4.08Å; A200-Q213 CarbonylContact C-O 3.47Å; A200-Q213 WeakPolarHBondContact CA-O 3.35Å; A200-Q213 WeakPolarHBondContact CB-O 3.46Å; A200-I214 HydrophobicContact CB-CG1 4.41Å
201	T	97	Very high	85.8	Confident	71 Å²	71	74 Å²	74	44%	0.436	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131	170.5	-54.1	0	0	0	0	109.2	C182 T203 F212 Q213	C182-T201 CarbonylContact O-C 3.59Å; C182-T201 WeakPolarHBondContact O-CA 3.45Å; T201-T203 PolarHBondContact O-N 2.85Å; T201-F212 WeakPolarHBondContact O-CA 3.32Å; T201-Q213 PolarHBondContact N-O 3.42Å; T201-Q213 PolarHBondContact O-N 2.93Å
202	L	94.3	Very high	85.9	Confident	37 Å²	37	71.8 Å²	71.8	19%	0.194	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	113.1	169.6	177.5	57.5	0	0	0	109.3	I177 G181 C182 P210 F212	I177-L202 HydrophobicContact CD1-CD2 4.19Å; G181-L202 WeakPolarHBondContact O-CD2 3.45Å; C182-L202 PolarHBondContact O-N 3.23Å; L202-P210 HydrophobicContact CD1-CB 3.32Å; L202-F212 HydrophobicContact CB-CD1 4.35Å; L202-F212 HydrophobicContact CB-CE1 4.08Å; L202-F212 HydrophobicContact CD1-CD1 4.28Å; L202-F212 HydrophobicContact CD1-CE1 3.78Å; L202-F212 HydrophobicContact CD1-CZ 3.97Å; L202-F212 HydrophobicContact CG-CE1 4.41Å
203	T	88.9	Confident	86.3	Confident	50 Å²	50	77 Å²	77	31%	0.307	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.3	173.9	59.6	0	0	0	0	108.9	T201 R211 Q213	T201-T203 PolarHBondContact O-N 2.85Å; T203-R211 PolarHBondContact N-O 3.43Å; T203-R211 PolarHBondContact O-N 3.46Å; T203-R211 PolarHBondContact OG1-O 3.44Å; T203-Q213 HydrophobicContact CG2-CB 4.16Å
204	S	72.8	Confident	86.5	Confident	116 Å²	116	76.7 Å²	76.7	81%	0.811	39%	0.39	S	S	*	.			trans	-73.2	139.7	173.8	-178.4	0	0	0	0	110.4
205	N	53.9	Low	86.4	Confident	29 Å²	29	77.8 Å²	77.8	16%	0.155	40%	0.399	C	S	.	.			trans	-115.1	164	167.8	72.1	20	0	0	0	110.4	T207 G208 R209 R211	N205-T207 VanDerWaalsContact CG-OG1 3.25Å; N205-T207 PolarHBondContact ND2-OG1 2.68Å; N205-T207 VanDerWaalsContact ND2-OG1 3.17Å; N205-T207 PolarHBondContact O-N 3.11Å; N205-T207 WeakPolarHBondContact OD1-CA 3.32Å; N205-T207 PolarHBondContact OD1-N 3.44Å; N205-T207 PolarHBondContact OD1-OG1 2.69Å; N205-G208 PolarHBondContact O-N 3.18Å; N205-G208 PolarHBondContact OD1-N 2.87Å; N205-R209 PolarHBondContact ND2-O 3.3Å; N205-R209 PolarHBondContact OD1-O 3.34Å; N205-R211 PolarHBondContact ND2-NE 3.04Å; N205-R211 VanDerWaalsContact ND2-NE 3.11Å
206	R	50.8	Low	86.3	Confident	263 Å²	263	78.8 Å²	78.8	99%	0.992	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-5	178.3	-63.6	-176.2	179.4	-158.8	-0.6	114.3
207	T	56	Low	86.1	Confident	105 Å²	105	82 Å²	82	64%	0.644	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	0.8	-175.4	73.2	0	0	0	0	113.3	N205 R209	N205-T207 VanDerWaalsContact CG-OG1 3.25Å; N205-T207 PolarHBondContact ND2-OG1 2.68Å; N205-T207 VanDerWaalsContact ND2-OG1 3.17Å; N205-T207 PolarHBondContact O-N 3.11Å; N205-T207 WeakPolarHBondContact OD1-CA 3.32Å; N205-T207 PolarHBondContact OD1-N 3.44Å; N205-T207 PolarHBondContact OD1-OG1 2.69Å; T207-R209 PolarHBondContact O-N 3.01Å
208	G	67.9	Low	86	Confident	70 Å²	70	82.8 Å²	82.8	72%	0.722	44%	0.438	S	S	*	.	S	Bend	trans	75.3	3.2	175.7	0	0	0	0	0	115.5	N205	N205-G208 PolarHBondContact O-N 3.18Å; N205-G208 PolarHBondContact OD1-N 2.87Å
209	R	79.9	Confident	86	Confident	149 Å²	149	83 Å²	83	56%	0.562	44%	0.444	S	S	*	.			trans	-98	130.2	173.8	-71.9	-167.8	-172.9	-162	4.3	110.4	E148 N205 T207	E148-R209 IonicContact OE1-CZ 3.92Å; E148-R209 IonicContact OE1-NE 3.84Å; E148-R209 IonicContact OE1-NH1 2.83Å; E148-R209 PolarHBondContact OE1-NH1 3.05Å; E148-R209 WeakPolarHBondContact OE2-CD 3.4Å; E148-R209 IonicContact OE2-CZ 3.55Å; E148-R209 IonicContact OE2-NE 3.52Å; E148-R209 IonicContact OE2-NH1 3.52Å; N205-R209 PolarHBondContact ND2-O 3.3Å; N205-R209 PolarHBondContact OD1-O 3.34Å; T207-R209 PolarHBondContact O-N 3.01Å
210	P	87.4	Confident	85.9	Confident	23 Å²	23	84.2 Å²	84.2	15%	0.149	45%	0.453	C	S	.	.			trans	-63.7	141.2	-179.7	29.4	-36.7	0	0	0	110.8	W150 F160 L202 F212	W150-P210 HydrophobicContact CH2-CB 4.13Å; W150-P210 HydrophobicContact CH2-CG 4.03Å; W150-P210 HydrophobicContact CZ2-CB 4.2Å; W150-P210 HydrophobicContact CZ2-CG 3.68Å; F160-P210 HydrophobicContact CD1-CB 4.39Å; F160-P210 HydrophobicContact CD1-CG 3.49Å; F160-P210 VanDerWaalsContact CD1-CG 3.49Å; F160-P210 HydrophobicContact CD2-CG 3.88Å; F160-P210 HydrophobicContact CE1-CB 4.35Å; F160-P210 HydrophobicContact CE1-CG 3.18Å; F160-P210 HydrophobicContact CE2-CG 3.56Å; F160-P210 HydrophobicContact CG-CG 3.82Å; F160-P210 HydrophobicContact CZ-CG 3.19Å; L202-P210 HydrophobicContact CD1-CB 3.32Å; P210-F212 HydrophobicContact CB-CE2 4.15Å; P210-F212 HydrophobicContact CB-CZ 4.09Å; P210-F212 HydrophobicContact CG-CE2 4.46Å
211	R	91.4	Very high	86	Confident	155 Å²	155	84.7 Å²	84.7	59%	0.585	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.5	172.8	-73.2	-173.4	175.7	177	-1.4	109.8	T203 N205	T203-R211 PolarHBondContact N-O 3.43Å; T203-R211 PolarHBondContact O-N 3.46Å; T203-R211 PolarHBondContact OG1-O 3.44Å; N205-R211 PolarHBondContact ND2-NE 3.04Å; N205-R211 VanDerWaalsContact ND2-NE 3.11Å
212	F	94.6	Very high	86	Confident	34 Å²	34	83.1 Å²	83.1	15%	0.149	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.1	-178.7	-59.1	-81	0	0	0	110.3	F160 A175 I177 A184 Y186 A200 T201 L202 P210	F160-F212 AromaticContact CD1-CE2 3.75Å; F160-F212 HydrophobicContact CD1-CE2 3.75Å; F160-F212 HydrophobicContact CD1-CZ 4.02Å; F160-F212 HydrophobicContact CE1-CE2 4.2Å; A175-F212 HydrophobicContact CB-CD1 4.06Å; A175-F212 HydrophobicContact CB-CD2 4.23Å; A175-F212 HydrophobicContact CB-CE1 3.45Å; A175-F212 VanDerWaalsContact CB-CE1 3.45Å; A175-F212 HydrophobicContact CB-CE2 3.68Å; A175-F212 HydrophobicContact CB-CG 4.41Å; A175-F212 HydrophobicContact CB-CZ 3.24Å; I177-F212 HydrophobicContact CD1-CE1 4.13Å; I177-F212 HydrophobicContact CD1-CZ 4.03Å; I177-F212 HydrophobicContact CG1-CE1 3.91Å; I177-F212 HydrophobicContact CG1-CZ 4.25Å; A184-F212 HydrophobicContact CB-CD1 3.86Å; A184-F212 HydrophobicContact CB-CE1 3.91Å; Y186-F212 HydrophobicContact CD1-CB 4.24Å; Y186-F212 HydrophobicContact CD2-CB 3.99Å; Y186-F212 AromaticContact CD2-CD2 3.6Å; Y186-F212 HydrophobicContact CD2-CD2 3.6Å; Y186-F212 HydrophobicContact CD2-CE2 4.27Å; Y186-F212 AromaticContact CD2-CG 3.78Å; Y186-F212 HydrophobicContact CD2-CG 3.78Å; Y186-F212 HydrophobicContact CE2-CB 4.4Å; Y186-F212 AromaticContact CE2-CD2 3.65Å; Y186-F212 HydrophobicContact CE2-CD2 3.65Å; Y186-F212 HydrophobicContact CE2-CE2 4.32Å; Y186-F212 HydrophobicContact CE2-CG 4.23Å; Y186-F212 HydrophobicContact CG-CB 3.87Å; Y186-F212 HydrophobicContact CG-CD2 4.35Å; Y186-F212 HydrophobicContact CG-CG 4.11Å; A200-F212 HydrophobicContact CB-CB 4.08Å; T201-F212 WeakPolarHBondContact O-CA 3.32Å; L202-F212 HydrophobicContact CB-CD1 4.35Å; L202-F212 HydrophobicContact CB-CE1 4.08Å; L202-F212 HydrophobicContact CD1-CD1 4.28Å; L202-F212 HydrophobicContact CD1-CE1 3.78Å; L202-F212 HydrophobicContact CD1-CZ 3.97Å; L202-F212 HydrophobicContact CG-CE1 4.41Å; P210-F212 HydrophobicContact CB-CE2 4.15Å; P210-F212 HydrophobicContact CB-CZ 4.09Å; P210-F212 HydrophobicContact CG-CE2 4.46Å
213	Q	96.4	Very high	86.2	Confident	131 Å²	131	84.8 Å²	84.8	61%	0.612	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	107.2	170.7	-176.5	174.9	4.8	0	0	108.6	A200 T201 T203 A215	A200-Q213 CarbonylContact C-O 3.47Å; A200-Q213 WeakPolarHBondContact CA-O 3.35Å; A200-Q213 WeakPolarHBondContact CB-O 3.46Å; T201-Q213 PolarHBondContact N-O 3.42Å; T201-Q213 PolarHBondContact O-N 2.93Å; T203-Q213 HydrophobicContact CG2-CB 4.16Å; Q213-A215 PolarHBondContact O-N 3.18Å
214	I	97.3	Very high	86.7	Confident	85 Å²	85	83.1 Å²	83.1	44%	0.436	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	132.4	178.4	-59.8	173.9	0	0	0	109.5	Y186 H198 A200	Y186-I214 HydrophobicContact CD1-CD1 4.02Å; Y186-I214 HydrophobicContact CD1-CG1 4.06Å; Y186-I214 HydrophobicContact CE1-CD1 4.49Å; H198-I214 HydrophobicContact CB-CG2 3.76Å; A200-I214 HydrophobicContact CB-CG1 4.41Å
215	A	96.9	Very high	87.9	Confident	27 Å²	27	82.1 Å²	82.1	22%	0.223	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-67.8	136.5	177.6	0	0	0	0	0	110.5	L199 Q213 N217 S218	L199-A215 HydrophobicContact CB-CB 4.23Å; L199-A215 HydrophobicContact CD2-CB 4.12Å; L199-A215 HydrophobicContact CG-CB 4.02Å; L199-A215 WeakPolarHBondContact O-CB 3.12Å; L199-A215 PolarHBondContact O-N 2.78Å; Q213-A215 PolarHBondContact O-N 3.18Å; A215-N217 PolarHBondContact O-N 2.94Å; A215-S218 PolarHBondContact O-N 2.86Å
216	P	95.5	Very high	90	Very high	117 Å²	117	81 Å²	81	76%	0.76	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	136.2	177.5	27.1	-33.9	0	0	0	110.3	S218	P216-S218 PolarHBondContact O-N 2.88Å
217	N	93.9	Very high	92.3	Very high	168 Å²	168	71.8 Å²	71.8	90%	0.898	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	27.5	-178.1	-49.2	-49.8	0	0	0	114.2	A215	A215-N217 PolarHBondContact O-N 2.94Å
218	S	96.3	Very high	94.3	Very high	17 Å²	17	70.1 Å²	70.1	12%	0.119	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-55.2	133	172.5	178.7	0	0	0	0	110.3	H198 L199 A215 P216	H198-S218 WeakPolarHBondContact CA-OG 3.09Å; H198-S218 PolarHBondContact ND1-O 2.87Å; L199-S218 WeakPolarHBondContact CB-OG 3.47Å; L199-S218 PolarHBondContact N-OG 2.78Å; A215-S218 PolarHBondContact O-N 2.86Å; P216-S218 PolarHBondContact O-N 2.88Å
219	P	97.3	Very high	95.7	Very high	57 Å²	57	72.8 Å²	72.8	37%	0.37	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-62.3	169	163.4	29.3	-32.7	0	0	0	110.1	H198 Y221 L237	H198-P219 PolarHBondContact ND1-O 3.16Å; H198-P219 VanDerWaalsContact ND1-O 3.16Å; P219-Y221 HydrophobicContact CG-CE2 3.75Å; P219-L237 HydrophobicContact CB-CD1 3.78Å; P219-L237 HydrophobicContact CG-CD1 3.58Å
220	V	98.1	Very high	96.6	Very high	65 Å²	65	68.2 Å²	68.2	39%	0.394	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.2	171.5	170.1	0	0	0	0	108.7	E196 H198	E196-V220 HydrophobicContact CB-CG1 4.5Å; E196-V220 HydrophobicContact CG-CG1 3.61Å; E196-V220 HydrophobicContact CG-CG2 4.23Å; H198-V220 VanDerWaalsContact CE1-CG2 3.48Å; H198-V220 WeakPolarHBondContact CE1-CG2 3.22Å
221	Y	98.6	Very high	97.1	Very high	9 Å²	9	67.2 Å²	67.2	4%	0.035	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.9	168.5	-59.3	-91.5	0	0	0	108.5	L185 I194 A197 L199 P219 L237 P240	L185-Y221 HydrophobicContact CD1-CG 4.28Å; L185-Y221 HydrophobicContact CD2-CD2 3.65Å; L185-Y221 HydrophobicContact CD2-CE2 4.02Å; L185-Y221 HydrophobicContact CD2-CG 3.94Å; I194-Y221 VanDerWaalsContact CG2-O 3.29Å; I194-Y221 WeakPolarHBondContact CG2-O 3.44Å; A197-Y221 PolarHBondContact N-O 3Å; A197-Y221 PolarHBondContact O-N 3.38Å; L199-Y221 HydrophobicContact CB-CE2 4.24Å; P219-Y221 HydrophobicContact CG-CE2 3.75Å; Y221-L237 HydrophobicContact CD1-CD2 4.1Å; Y221-L237 HydrophobicContact CE1-CD1 4.18Å; Y221-L237 HydrophobicContact CE1-CD2 4.04Å; Y221-L237 HydrophobicContact CE1-CG 4.05Å; Y221-P240 HydrophobicContact CE1-CG 4.24Å; Y221-P240 HydrophobicContact CE2-CG 4.41Å
222	S	98.4	Very high	97.4	Very high	38 Å²	38	60.1 Å²	60.1	27%	0.266	34%	0.342	S	S	.	.			trans	-136.5	161.9	174.2	64.6	0	0	0	0	108.8	I195 D224 R342	I195-S222 VanDerWaalsContact O-CB 3.31Å; I195-S222 WeakPolarHBondContact O-CB 3.31Å; S222-D224 PolarHBondContact O-N 2.83Å; S222-R342 WeakPolarHBondContact O-CG 3.22Å
223	Y	98.5	Very high	97.6	Very high	73 Å²	73	63.2 Å²	63.2	29%	0.286	36%	0.364	S	S	.	.			trans	-59.9	128.8	165.3	-173.8	-118	0	0	0	109.4	E193 I194 K225	E193-Y223 WeakPolarHBondContact OE1-CE1 3.25Å; I194-Y223 WeakPolarHBondContact O-CB 3.45Å; I194-Y223 PolarHBondContact O-N 3.07Å; Y223-K225 HydrophobicContact CE1-CB 4.07Å; Y223-K225 HydrophobicContact CE2-CB 4.13Å; Y223-K225 WeakPolarHBondContact OH-CD 3.37Å
224	D	98.3	Very high	97.6	Very high	15 Å²	15	61.8 Å²	61.8	8%	0.08	36%	0.357	C	S	.	.			trans	-152.1	52	-166.6	-173.3	31.9	0	0	0	108.3	S222 S226 T233 R342	S222-D224 PolarHBondContact O-N 2.83Å; D224-S226 PolarHBondContact O-N 2.87Å; D224-T233 VanDerWaalsContact OD1-CB 3.26Å; D224-T233 WeakPolarHBondContact OD1-CB 3.45Å; D224-T233 PolarHBondContact OD1-N 2.95Å; D224-T233 PolarHBondContact OD1-OG1 3.03Å; D224-T233 PolarHBondContact OD2-N 3.48Å; D224-R342 CarbonylContact C-O 3.41Å; D224-R342 WeakPolarHBondContact CA-O 3.47Å; D224-R342 HydrophobicContact CB-CG 4.03Å; D224-R342 PolarHBondContact N-O 3.34Å; D224-R342 IonicContact OD2-NE 3.79Å; D224-R342 IonicContact OD2-NH2 3.35Å
225	K	98.6	Very high	97.7	Very high	95 Å²	95	59.4 Å²	59.4	41%	0.413	35%	0.346	S	S	.	.			trans	-61.8	128.3	176.8	-177.9	176.1	179	-179.3	0	109.4	Y223 R342	Y223-K225 HydrophobicContact CE1-CB 4.07Å; Y223-K225 HydrophobicContact CE2-CB 4.13Å; Y223-K225 WeakPolarHBondContact OH-CD 3.37Å; K225-R342 PolarHBondContact N-O 3.19Å
226	S	98.8	Very high	97.8	Very high	6 Å²	6	62.8 Å²	62.8	4%	0.042	36%	0.36	C	S	.	.			trans	-63.8	159.4	178.1	59.4	0	0	0	0	113.1	D224 C230 I231 G277 R279	D224-S226 PolarHBondContact O-N 2.87Å; S226-C230 CarbonylContact C-O 3.56Å; S226-C230 VanDerWaalsContact CA-O 3.28Å; S226-C230 WeakPolarHBondContact CA-O 3.45Å; S226-C230 VanDerWaalsContact CB-O 3.32Å; S226-C230 WeakPolarHBondContact CB-O 3.11Å; S226-I231 WeakPolarHBondContact CB-O 3.32Å; S226-G277 WeakPolarHBondContact CB-O 3.27Å; S226-G277 PolarHBondContact OG-O 3.19Å; S226-R279 WeakPolarHBondContact O-CD 3.43Å; S226-R279 PolarHBondContact O-NE 2.83Å; S226-R279 WeakPolarHBondContact OG-CG 3.33Å; S226-R279 PolarHBondContact OG-NE 3.2Å
227	T	98.6	Very high	97.9	Very high	68 Å²	68	58.6 Å²	58.6	42%	0.417	33%	0.332	S	S	.	.			trans	-117.5	-173.5	172.1	70.7	0	0	0	0	110	T229 C230 V278 R279	T227-T229 PolarHBondContact O-N 2.98Å; T227-T229 PolarHBondContact OG1-N 2.91Å; T227-C230 PolarHBondContact N-O 3.34Å; T227-C230 WeakPolarHBondContact OG1-CB 3.39Å; T227-C230 PolarHBondContact OG1-N 3.24Å; T227-V278 CarbonylContact O-C 3.58Å; T227-V278 VanDerWaalsContact O-CA 3.24Å; T227-V278 WeakPolarHBondContact O-CA 3.47Å; T227-V278 VanDerWaalsContact O-CB 3.32Å; T227-V278 WeakPolarHBondContact O-CB 3.18Å; T227-R279 PolarHBondContact O-N 3.41Å
228	S	97.6	Very high	98.1	Very high	71 Å²	71	53 Å²	53	50%	0.497	30%	0.304	S	S	.	.	S	Bend	trans	-65.3	-18.4	172.7	56.5	0	0	0	0	114	R279	S228-R279 WeakPolarHBondContact CA-O 3.26Å; S228-R279 VanDerWaalsContact CB-O 3.25Å; S228-R279 WeakPolarHBondContact CB-O 3.21Å
229	T	97	Very high	98.3	Very high	125 Å²	125	52.2 Å²	52.2	77%	0.767	30%	0.299	S	S	*	.	S	Bend	trans	-125.5	-16.5	-175.1	55.7	0	0	0	0	114.3	T227	T227-T229 PolarHBondContact O-N 2.98Å; T227-T229 PolarHBondContact OG1-N 2.91Å
230	C	98.3	Very high	98.3	Very high	53 Å²	53	50 Å²	50	36%	0.358	28%	0.284	S	S	.	.			trans	-118.3	114.5	178.6	-172.2	0	0	0	0	110	S226 T227	S226-C230 CarbonylContact C-O 3.56Å; S226-C230 VanDerWaalsContact CA-O 3.28Å; S226-C230 WeakPolarHBondContact CA-O 3.45Å; S226-C230 VanDerWaalsContact CB-O 3.32Å; S226-C230 WeakPolarHBondContact CB-O 3.11Å; T227-C230 PolarHBondContact N-O 3.34Å; T227-C230 WeakPolarHBondContact OG1-CB 3.39Å; T227-C230 PolarHBondContact OG1-N 3.24Å
231	I	98.6	Very high	98.3	Very high	2 Å²	2	47 Å²	47	1%	0.01	27%	0.266	C	S	.	.	S	Bend	trans	-76.2	-35.2	-179.5	-167.4	167.7	0	0	0	112.9	S226 T235 N276 V278 V307 F311 Y317	S226-I231 WeakPolarHBondContact CB-O 3.32Å; I231-T235 HydrophobicContact CG2-CG2 3.87Å; I231-N276 PolarHBondContact O-ND2 2.87Å; I231-V278 HydrophobicContact CB-CG1 3.98Å; I231-V307 HydrophobicContact CD1-CG1 4.14Å; I231-V307 HydrophobicContact CD1-CG2 4.46Å; I231-F311 HydrophobicContact CB-CD2 4.25Å; I231-F311 HydrophobicContact CB-CE2 4.33Å; I231-F311 HydrophobicContact CD1-CB 3.91Å; I231-F311 HydrophobicContact CD1-CD2 4.2Å; I231-F311 HydrophobicContact CD1-CG 4.17Å; I231-F311 HydrophobicContact CG2-CD1 4.06Å; I231-F311 HydrophobicContact CG2-CD2 3.82Å; I231-F311 HydrophobicContact CG2-CE1 3.99Å; I231-F311 HydrophobicContact CG2-CE2 3.74Å; I231-F311 HydrophobicContact CG2-CG 3.97Å; I231-F311 HydrophobicContact CG2-CZ 3.83Å; I231-Y317 HydrophobicContact CD1-CD1 4.26Å; I231-Y317 HydrophobicContact CD1-CD2 3.9Å; I231-Y317 HydrophobicContact CD1-CE1 4.09Å; I231-Y317 HydrophobicContact CD1-CE2 3.71Å; I231-Y317 HydrophobicContact CD1-CG 4.18Å; I231-Y317 HydrophobicContact CG1-CD2 4.22Å; I231-Y317 HydrophobicContact CG1-CE2 3.72Å; I231-Y317 HydrophobicContact CG2-CD2 3.98Å; I231-Y317 HydrophobicContact CG2-CE2 4.11Å
232	A	98.3	Very high	98.4	Very high	6 Å²	6	46.6 Å²	46.6	5%	0.05	26%	0.264	C	S	.	.			trans	-173.3	150	176.8	0	0	0	0	0	109	H234 Y317	A232-H234 VanDerWaalsContact C-N 3.33Å; A232-Y317 HydrophobicContact CB-CE2 4.37Å
233	T	98	Very high	98.3	Very high	99 Å²	99	47 Å²	47	61%	0.607	27%	0.267	S	S	*	.	S	Bend	trans	-67.5	-36.4	172	-57.8	0	0	0	0	111.3	D224	D224-T233 VanDerWaalsContact OD1-CB 3.26Å; D224-T233 WeakPolarHBondContact OD1-CB 3.45Å; D224-T233 PolarHBondContact OD1-N 2.95Å; D224-T233 PolarHBondContact OD1-OG1 3.03Å; D224-T233 PolarHBondContact OD2-N 3.48Å
234	H	97.9	Very high	98.3	Very high	101 Å²	101	48.3 Å²	48.3	47%	0.468	28%	0.276	S	S	.	.			trans	-117.6	80.9	179.1	-60.8	95.9	0	0	0	111.2	A232 L236 L237 R342	A232-H234 VanDerWaalsContact C-N 3.33Å; H234-L236 VanDerWaalsContact C-N 3.25Å; H234-L236 PolarHBondContact O-N 2.84Å; H234-L237 HydrophobicContact CB-CB 3.71Å; H234-L237 HydrophobicContact CB-CD2 4.17Å; H234-L237 PolarHBondContact O-N 3.49Å; H234-R342 PolarHBondContact O-NH2 2.81Å
235	T	98.5	Very high	98.3	Very high	35 Å²	35	49.8 Å²	49.8	22%	0.215	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-26.5	-174.2	65.4	0	0	0	0	114	I231 F311 R316 Y317 C318 A319	I231-T235 HydrophobicContact CG2-CG2 3.87Å; T235-F311 HydrophobicContact CG2-CE1 3.99Å; T235-R316 VanDerWaalsContact CB-O 3.29Å; T235-R316 WeakPolarHBondContact CB-O 3.43Å; T235-R316 PolarHBondContact OG1-O 3.13Å; T235-Y317 HydrophobicContact CG2-CD2 4.32Å; T235-Y317 WeakPolarHBondContact O-CA 3.14Å; T235-C318 PolarHBondContact O-N 3.2Å; T235-A319 PolarHBondContact O-N 2.84Å; T235-A319 VanDerWaalsContact O-N 3.12Å
236	L	98.6	Very high	98.3	Very high	99 Å²	99	45.3 Å²	45.3	52%	0.518	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	14.5	-179.1	-60	-178.4	0	0	0	113.8	H234 P238 E315 R316	H234-L236 VanDerWaalsContact C-N 3.25Å; H234-L236 PolarHBondContact O-N 2.84Å; L236-P238 VanDerWaalsContact O-CD 3.31Å; L236-P238 WeakPolarHBondContact O-CD 3.26Å; L236-E315 WeakPolarHBondContact CD2-O 3.28Å; L236-R316 VanDerWaalsContact CD2-C 3.49Å
237	L	98.6	Very high	98.3	Very high	29 Å²	29	48 Å²	48	15%	0.152	27%	0.272	C	S	.	.			trans	-95.4	103.6	171.9	173.8	60.2	0	0	0	108.4	P219 Y221 H234 A319 R342	P219-L237 HydrophobicContact CB-CD1 3.78Å; P219-L237 HydrophobicContact CG-CD1 3.58Å; Y221-L237 HydrophobicContact CD1-CD2 4.1Å; Y221-L237 HydrophobicContact CE1-CD1 4.18Å; Y221-L237 HydrophobicContact CE1-CD2 4.04Å; Y221-L237 HydrophobicContact CE1-CG 4.05Å; H234-L237 HydrophobicContact CB-CB 3.71Å; H234-L237 HydrophobicContact CB-CD2 4.17Å; H234-L237 PolarHBondContact O-N 3.49Å; L237-A319 VanDerWaalsContact O-CA 3.26Å; L237-A319 WeakPolarHBondContact O-CA 3.39Å; L237-A319 WeakPolarHBondContact O-CB 3.48Å; L237-R342 PolarHBondContact O-NH1 3.03Å
238	P	98.6	Very high	98.3	Very high	50 Å²	50	46.5 Å²	46.5	33%	0.325	26%	0.263	S	S	.	.			trans	-67.2	150.1	-178.4	-17.7	32.6	0	0	0	112.1	L236 S243 C318	L236-P238 VanDerWaalsContact O-CD 3.31Å; L236-P238 WeakPolarHBondContact O-CD 3.26Å; P238-S243 WeakPolarHBondContact CB-OG 3.49Å; P238-C318 WeakPolarHBondContact CA-O 3.21Å
239	D	98.8	Very high	98.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.253	C	S	.	.			trans	-66.9	129.7	167	-179.7	-83.1	0	0	0	110.3	Y178 Y241 E242 S243 F274 A319 H340	Y178-D239 PolarHBondContact OH-OD2 2.9Å; D239-Y241 VanDerWaalsContact C-N 3.35Å; D239-Y241 PolarHBondContact O-N 3.07Å; D239-Y241 WeakPolarHBondContact OD1-CA 3.49Å; D239-Y241 VanDerWaalsContact OD1-CB 3.29Å; D239-Y241 WeakPolarHBondContact OD1-CB 3.35Å; D239-Y241 PolarHBondContact OD1-N 3.45Å; D239-E242 HydrophobicContact CB-CB 3.98Å; D239-E242 PolarHBondContact OD1-N 2.96Å; D239-S243 VanDerWaalsContact O-CB 3.24Å; D239-S243 WeakPolarHBondContact O-CB 3.35Å; D239-S243 PolarHBondContact O-N 2.97Å; D239-S243 PolarHBondContact O-OG 2.87Å; D239-F274 HydrophobicContact CB-CD2 4.2Å; D239-F274 HydrophobicContact CB-CE2 4.45Å; D239-F274 WeakPolarHBondContact OD1-CE2 3.14Å; D239-A319 PolarHBondContact N-O 2.94Å; D239-H340 IonicContact OD2-CE1 3.19Å; D239-H340 PolarHBondContact OD2-CE1 2.66Å; D239-H340 IonicContact OD2-NE2 2.98Å; D239-H340 PolarHBondContact OD2-NE2 2.99Å
240	P	98.3	Very high	98.4	Very high	10 Å²	10	46.8 Å²	46.8	7%	0.065	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-24.4	-173.6	29.7	-35.1	0	0	0	113.5	L185 L199 Y221 Q244	L185-P240 HydrophobicContact CD2-CG 4.13Å; L199-P240 HydrophobicContact CD1-CB 3.67Å; L199-P240 HydrophobicContact CD1-CG 3.88Å; L199-P240 HydrophobicContact CD2-CB 3.8Å; L199-P240 HydrophobicContact CG-CB 4.24Å; Y221-P240 HydrophobicContact CE1-CG 4.24Å; Y221-P240 HydrophobicContact CE2-CG 4.41Å; P240-Q244 WeakPolarHBondContact O-CG 3.45Å; P240-Q244 PolarHBondContact O-NE2 3.43Å
241	Y	98.6	Very high	98.4	Very high	3 Å²	3	44.9 Å²	44.9	1%	0.012	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-53.5	173.9	173.2	-87.7	0	0	0	109.8	Y178 D180 D239 S243 Q244 W245 V271 F274	Y178-Y241 VanDerWaalsContact CB-CD2 3.45Å; Y178-Y241 HydrophobicContact CD1-CD1 4.12Å; Y178-Y241 AromaticContact CD1-CD2 3.84Å; Y178-Y241 HydrophobicContact CD1-CD2 3.84Å; Y178-Y241 AromaticContact CD1-CG 3.51Å; Y178-Y241 HydrophobicContact CD1-CG 3.51Å; Y178-Y241 VanDerWaalsContact CE1-CB 3.46Å; Y178-Y241 HydrophobicContact CE1-CG 4.07Å; Y178-Y241 AromaticContact CG-CD2 3.76Å; Y178-Y241 HydrophobicContact CG-CD2 3.76Å; Y178-Y241 AromaticContact CG-CG 3.87Å; Y178-Y241 HydrophobicContact CG-CG 3.87Å; D180-Y241 HydrophobicContact CB-CE2 3.85Å; D239-Y241 VanDerWaalsContact C-N 3.35Å; D239-Y241 PolarHBondContact O-N 3.07Å; D239-Y241 WeakPolarHBondContact OD1-CA 3.49Å; D239-Y241 VanDerWaalsContact OD1-CB 3.29Å; D239-Y241 WeakPolarHBondContact OD1-CB 3.35Å; D239-Y241 PolarHBondContact OD1-N 3.45Å; Y241-S243 PolarHBondContact O-N 3.16Å; Y241-Q244 WeakPolarHBondContact O-CB 3.48Å; Y241-Q244 PolarHBondContact O-N 2.8Å; Y241-W245 AromaticContact CD1-CD1 3.87Å; Y241-W245 AromaticContact CD2-NE1 3.97Å; Y241-W245 AromaticContact CE1-CD1 3.48Å; Y241-W245 VanDerWaalsContact CE1-CD1 3.48Å; Y241-W245 HydrophobicContact CE1-CG 4.46Å; Y241-W245 AromaticContact CE1-NE1 3.8Å; Y241-W245 AromaticContact CE2-CD1 3.88Å; Y241-W245 AromaticContact CE2-NE1 3.39Å; Y241-W245 AromaticContact CZ-CD1 3.49Å; Y241-W245 VanDerWaalsContact CZ-CD1 3.49Å; Y241-W245 AromaticContact CZ-NE1 3.26Å; Y241-W245 VanDerWaalsContact CZ-NE1 3.26Å; Y241-W245 VanDerWaalsContact O-CD1 3.28Å; Y241-W245 PolarHBondContact OH-NE1 2.95Å; Y241-V271 HydrophobicContact CE1-CB 4.17Å; Y241-V271 HydrophobicContact CE1-CG1 4.1Å; Y241-V271 VanDerWaalsContact CE1-O 3.22Å; Y241-V271 WeakPolarHBondContact CE1-O 3.5Å; Y241-V271 PolarHBondContact OH-O 3.01Å; Y241-F274 AromaticContact CD1-CE2 3.76Å; Y241-F274 HydrophobicContact CD1-CE2 3.76Å; Y241-F274 AromaticContact CD1-CZ 3.63Å; Y241-F274 HydrophobicContact CD1-CZ 3.63Å; Y241-F274 HydrophobicContact CE1-CZ 4.16Å; Y241-F274 HydrophobicContact CG-CE2 4.48Å; Y241-F274 HydrophobicContact CG-CZ 4.41Å
242	E	98.8	Very high	98.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-56.7	-38.7	179.3	-176.1	179.8	-108.1	0	0	111.4	D239 Q244 W245 V246 A273 F274 S320 L321	D239-E242 HydrophobicContact CB-CB 3.98Å; D239-E242 PolarHBondContact OD1-N 2.96Å; E242-Q244 PolarHBondContact O-N 2.85Å; E242-Q244 VanDerWaalsContact O-N 3.1Å; E242-W245 PolarHBondContact O-N 2.92Å; E242-V246 HydrophobicContact CG-CG2 3.4Å; E242-V246 VanDerWaalsContact CG-CG2 3.4Å; E242-V246 WeakPolarHBondContact O-CG2 3.35Å; E242-V246 PolarHBondContact O-N 2.75Å; E242-A273 HydrophobicContact CG-CB 4.14Å; E242-A273 VanDerWaalsContact OE1-CA 3.29Å; E242-A273 WeakPolarHBondContact OE1-CA 3.32Å; E242-A273 VanDerWaalsContact OE1-CB 3.27Å; E242-A273 WeakPolarHBondContact OE1-CB 3.24Å; E242-F274 HydrophobicContact CB-CD2 4.06Å; E242-F274 HydrophobicContact CB-CE2 4.22Å; E242-F274 PolarHBondContact OE1-N 3.06Å; E242-S320 VanDerWaalsContact OE2-CA 3.26Å; E242-S320 WeakPolarHBondContact OE2-CA 3.32Å; E242-L321 VanDerWaalsContact CD-N 3.31Å; E242-L321 PolarHBondContact OE1-N 2.84Å; E242-L321 WeakPolarHBondContact OE2-CB 3.33Å; E242-L321 WeakPolarHBondContact OE2-CG 3.4Å; E242-L321 PolarHBondContact OE2-N 3.48Å
243	S	98.1	Very high	98.3	Very high	47 Å²	47	53.3 Å²	53.3	33%	0.329	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-20.4	177.4	-67.3	0	0	0	0	114.5	P238 D239 Y241 K263	P238-S243 WeakPolarHBondContact CB-OG 3.49Å; D239-S243 VanDerWaalsContact O-CB 3.24Å; D239-S243 WeakPolarHBondContact O-CB 3.35Å; D239-S243 PolarHBondContact O-N 2.97Å; D239-S243 PolarHBondContact O-OG 2.87Å; Y241-S243 PolarHBondContact O-N 3.16Å; S243-K263 WeakPolarHBondContact O-CD 3.39Å; S243-K263 PolarHBondContact O-NZ 3.25Å
244	Q	97.3	Very high	98.1	Very high	99 Å²	99	58.6 Å²	58.6	46%	0.463	30%	0.298	S	S	.	.	H	α-helix	trans	-84.7	-27.7	175	-64.4	173.8	70.7	0	0	112	T183 P240 Y241 E242 K263	T183-Q244 PolarHBondContact OG1-NE2 3.03Å; P240-Q244 WeakPolarHBondContact O-CG 3.45Å; P240-Q244 PolarHBondContact O-NE2 3.43Å; Y241-Q244 WeakPolarHBondContact O-CB 3.48Å; Y241-Q244 PolarHBondContact O-N 2.8Å; E242-Q244 PolarHBondContact O-N 2.85Å; E242-Q244 VanDerWaalsContact O-N 3.1Å; Q244-K263 WeakPolarHBondContact O-CB 3.29Å
245	W	98.4	Very high	97.8	Very high	47 Å²	47	57.6 Å²	57.6	18%	0.178	32%	0.316	C	S	.	.	H	α-helix	trans	-99.2	-32.1	-169.1	-73.4	108.3	0	0	0	114.4	Y241 E242 A262 K263 A264 A266 T270 M272	Y241-W245 AromaticContact CD1-CD1 3.87Å; Y241-W245 AromaticContact CD2-NE1 3.97Å; Y241-W245 AromaticContact CE1-CD1 3.48Å; Y241-W245 VanDerWaalsContact CE1-CD1 3.48Å; Y241-W245 HydrophobicContact CE1-CG 4.46Å; Y241-W245 AromaticContact CE1-NE1 3.8Å; Y241-W245 AromaticContact CE2-CD1 3.88Å; Y241-W245 AromaticContact CE2-NE1 3.39Å; Y241-W245 AromaticContact CZ-CD1 3.49Å; Y241-W245 VanDerWaalsContact CZ-CD1 3.49Å; Y241-W245 AromaticContact CZ-NE1 3.26Å; Y241-W245 VanDerWaalsContact CZ-NE1 3.26Å; Y241-W245 VanDerWaalsContact O-CD1 3.28Å; Y241-W245 PolarHBondContact OH-NE1 2.95Å; E242-W245 PolarHBondContact O-N 2.92Å; W245-A262 CarbonylContact O-C 3.57Å; W245-A262 WeakPolarHBondContact O-CA 3.32Å; W245-K263 PolarHBondContact O-N 3.48Å; W245-A264 HydrophobicContact CZ3-CB 4.46Å; W245-A266 HydrophobicContact CE3-CB 4.23Å; W245-A266 HydrophobicContact CH2-CB 4.5Å; W245-A266 HydrophobicContact CZ3-CB 3.7Å; W245-T270 HydrophobicContact CE3-CG2 4.49Å; W245-T270 HydrophobicContact CH2-CG2 4.04Å; W245-T270 HydrophobicContact CZ2-CG2 4.16Å; W245-T270 HydrophobicContact CZ3-CG2 4.23Å; W245-M272 HydrophobicContact CB-CE 4.29Å; W245-M272 WeakPolarHBondContact CB-O 3.41Å; W245-M272 HydrophobicContact CD2-SD 4.39Å; W245-M272 HydrophobicContact CE3-CE 4.02Å; W245-M272 HydrophobicContact CE3-SD 3.95Å
246	V	98.8	Very high	97.6	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	158.9	-170.2	-62.6	0	0	0	0	114.9	E242 L260 F261 K263 M272 A273 L321 L361	E242-V246 HydrophobicContact CG-CG2 3.4Å; E242-V246 VanDerWaalsContact CG-CG2 3.4Å; E242-V246 WeakPolarHBondContact O-CG2 3.35Å; E242-V246 PolarHBondContact O-N 2.75Å; V246-L260 HydrophobicContact CB-CD1 3.8Å; V246-L260 HydrophobicContact CB-CD2 4.49Å; V246-L260 HydrophobicContact CB-CG 4.06Å; V246-L260 HydrophobicContact CG1-CD1 4.41Å; V246-L260 HydrophobicContact CG1-CD2 4.24Å; V246-L260 HydrophobicContact CG1-CG 4.17Å; V246-L260 HydrophobicContact CG2-CD1 3.87Å; V246-L260 HydrophobicContact CG2-CG 4.49Å; V246-F261 CarbonylContact C-O 3.53Å; V246-F261 WeakPolarHBondContact CA-O 3.21Å; V246-K263 WeakPolarHBondContact O-CD 3.48Å; V246-K263 WeakPolarHBondContact O-CE 3.46Å; V246-K263 PolarHBondContact O-NZ 3.26Å; V246-M272 HydrophobicContact CG1-CB 4.02Å; V246-M272 HydrophobicContact CG1-CE 4.28Å; V246-M272 WeakPolarHBondContact CG1-O 3.42Å; V246-A273 HydrophobicContact CG1-CB 4.48Å; V246-A273 HydrophobicContact CG2-CB 4.22Å; V246-L321 HydrophobicContact CG2-CD1 4.35Å; V246-L361 HydrophobicContact CG1-CD1 3.6Å
247	F	98.8	Very high	97.5	Very high	62 Å²	62	55.2 Å²	55.2	27%	0.272	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.9	166.3	64	-77.3	0	0	0	111	A249 F261 K263	F247-A249 HydrophobicContact CD2-CB 4.11Å; F247-A249 HydrophobicContact CE2-CB 3.86Å; F247-F261 HydrophobicContact CD1-CB 3.92Å; F247-F261 WeakPolarHBondContact CD1-O 3.37Å; F247-F261 HydrophobicContact CD2-CB 4.19Å; F247-F261 HydrophobicContact CE1-CB 3.5Å; F247-F261 HydrophobicContact CE2-CB 3.79Å; F247-F261 HydrophobicContact CE2-CD2 4.47Å; F247-F261 HydrophobicContact CE2-CG 4.19Å; F247-F261 HydrophobicContact CG-CB 4.27Å; F247-F261 HydrophobicContact CZ-CB 3.43Å; F247-F261 VanDerWaalsContact CZ-CB 3.43Å; F247-F261 HydrophobicContact CZ-CG 4.11Å; F247-F261 PolarHBondContact N-O 2.77Å; F247-F261 PolarHBondContact O-N 2.79Å; F247-K263 HydrophobicContact CB-CG 4.48Å; F247-K263 HydrophobicContact CD1-CG 3.64Å; F247-K263 HydrophobicContact CE1-CG 4.42Å
248	V	98.8	Very high	97.5	Very high	36 Å²	36	57.5 Å²	57.5	22%	0.218	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.7	175.2	-178.4	0	0	0	0	109.2	Q258 G259 L260 T314 L321 K324	V248-Q258 HydrophobicContact CG1-CB 3.88Å; V248-Q258 HydrophobicContact CG1-CG 4.16Å; V248-G259 WeakPolarHBondContact CA-O 3.35Å; V248-L260 HydrophobicContact CG2-CD1 4.25Å; V248-T314 HydrophobicContact CB-CG2 4.38Å; V248-T314 HydrophobicContact CG1-CG2 4.41Å; V248-T314 HydrophobicContact CG2-CG2 4.07Å; V248-L321 HydrophobicContact CG2-CD1 4.25Å; V248-L321 HydrophobicContact CG2-CD2 4.03Å; V248-K324 HydrophobicContact CG1-CD 4.25Å; V248-K324 HydrophobicContact CG1-CG 4.31Å; V248-K324 HydrophobicContact CG2-CB 4.06Å; V248-K324 HydrophobicContact CG2-CG 3.82Å
249	A	98.5	Very high	97.5	Very high	35 Å²	35	55.1 Å²	55.1	29%	0.289	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	-179.4	174.1	0	0	0	0	0	110.5	F247 S251 Q258 G259 F261	F247-A249 HydrophobicContact CD2-CB 4.11Å; F247-A249 HydrophobicContact CE2-CB 3.86Å; A249-S251 PolarHBondContact O-N 2.72Å; A249-Q258 CarbonylContact O-C 3.56Å; A249-Q258 VanDerWaalsContact O-CA 3.23Å; A249-Q258 WeakPolarHBondContact O-CA 3.23Å; A249-G259 PolarHBondContact N-O 3.01Å; A249-G259 VanDerWaalsContact N-O 3.11Å; A249-G259 PolarHBondContact O-N 2.89Å; A249-F261 HydrophobicContact CB-CD2 3.82Å; A249-F261 HydrophobicContact CB-CE2 3.78Å
250	E	98.5	Very high	97.5	Very high	168 Å²	168	55.1 Å²	55.1	79%	0.785	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	131.2	170.6	-171.5	175.1	-179.6	0	0	109.9	F261	E250-F261 VanDerWaalsContact O-CZ 3.29Å; E250-F261 WeakPolarHBondContact O-CZ 3.47Å
251	S	98.4	Very high	97.5	Very high	13 Å²	13	55.2 Å²	55.2	9%	0.091	31%	0.312	C	S	.	.			trans	-66.7	147.3	-178.6	179.7	0	0	0	0	111.6	A249 I253 G257 N326 E360	A249-S251 PolarHBondContact O-N 2.72Å; S251-I253 WeakPolarHBondContact OG-CB 3.45Å; S251-I253 PolarHBondContact OG-N 2.94Å; S251-G257 WeakPolarHBondContact CB-O 2.98Å; S251-G257 PolarHBondContact N-O 2.95Å; S251-N326 WeakPolarHBondContact CB-ND2 3.3Å; S251-N326 PolarHBondContact OG-ND2 3.11Å; S251-N326 VanDerWaalsContact OG-ND2 3.14Å; S251-E360 VanDerWaalsContact CB-OE1 3.27Å; S251-E360 WeakPolarHBondContact CB-OE1 3.4Å; S251-E360 VanDerWaalsContact OG-CD 3.32Å; S251-E360 PolarHBondContact OG-OE1 3.24Å; S251-E360 PolarHBondContact OG-OE2 2.76Å
252	L	97.3	Very high	97.5	Very high	141 Å²	141	55 Å²	55	74%	0.738	31%	0.311	S	S	*	.	S	Bend	trans	-76.1	-16.6	169.2	-54.6	178	0	0	0	111.5	K254 F261 E360	L252-K254 PolarHBondContact O-N 3.41Å; L252-F261 HydrophobicContact CD1-CE1 4.32Å; L252-F261 HydrophobicContact CG-CE1 4.13Å; L252-F261 HydrophobicContact CG-CZ 4.29Å; L252-E360 VanDerWaalsContact CB-OE2 3.29Å; L252-E360 WeakPolarHBondContact CB-OE2 3.29Å; L252-E360 HydrophobicContact CD1-CB 4.45Å; L252-E360 PolarHBondContact N-OE2 3.48Å
253	I	95.8	Very high	97.5	Very high	43 Å²	43	58.9 Å²	58.9	22%	0.221	33%	0.328	C	S	.	.	S	Bend	trans	-78.3	115.8	175	-56	171.2	0	0	0	108.5	S251 G255 A256 N326 H327 T362	S251-I253 WeakPolarHBondContact OG-CB 3.45Å; S251-I253 PolarHBondContact OG-N 2.94Å; I253-G255 PolarHBondContact O-N 3Å; I253-G255 VanDerWaalsContact O-N 3.1Å; I253-A256 HydrophobicContact CB-CB 3.8Å; I253-A256 HydrophobicContact CG2-CB 3.89Å; I253-A256 WeakPolarHBondContact O-CB 3.46Å; I253-A256 PolarHBondContact O-N 2.92Å; I253-A256 VanDerWaalsContact O-N 3.08Å; I253-N326 HydrophobicContact CD1-CB 3.83Å; I253-H327 WeakPolarHBondContact CD1-O 3.33Å; I253-T362 HydrophobicContact CD1-CG2 4.11Å
254	K	93.9	Very high	97.5	Very high	210 Å²	210	58.5 Å²	58.5	91%	0.913	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	117.1	-174.3	-174.8	-177.2	178.1	-175.2	0	111.1	L252	L252-K254 PolarHBondContact O-N 3.41Å
255	G	93.2	Very high	97.5	Very high	81 Å²	81	58 Å²	58	84%	0.835	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-0	176.9	0	0	0	0	0	114.8	I253 G257	I253-G255 PolarHBondContact O-N 3Å; I253-G255 VanDerWaalsContact O-N 3.1Å; G255-G257 VanDerWaalsContact C-N 3.26Å; G255-G257 PolarHBondContact O-N 2.9Å
256	A	94.1	Very high	97.5	Very high	37 Å²	37	55.9 Å²	55.9	31%	0.306	32%	0.324	S	S	.	.			trans	-78.2	-9	176.1	0	0	0	0	0	113.5	I253 Q258	I253-A256 HydrophobicContact CB-CB 3.8Å; I253-A256 HydrophobicContact CG2-CB 3.89Å; I253-A256 WeakPolarHBondContact O-CB 3.46Å; I253-A256 PolarHBondContact O-N 2.92Å; I253-A256 VanDerWaalsContact O-N 3.08Å; A256-Q258 PolarHBondContact O-N 2.96Å
257	G	96.4	Very high	97.5	Very high	47 Å²	47	57.4 Å²	57.4	49%	0.485	34%	0.34	S	S	.	.			trans	78.4	-116.1	-180	0	0	0	0	0	111.6	S251 G255	S251-G257 WeakPolarHBondContact CB-O 2.98Å; S251-G257 PolarHBondContact N-O 2.95Å; G255-G257 VanDerWaalsContact C-N 3.26Å; G255-G257 PolarHBondContact O-N 2.9Å
258	Q	98.1	Very high	97.5	Very high	77 Å²	77	58.8 Å²	58.8	36%	0.36	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	155.3	178	-70.5	-179.9	-40.8	0	0	111.3	V248 A249 A256 N326	V248-Q258 HydrophobicContact CG1-CB 3.88Å; V248-Q258 HydrophobicContact CG1-CG 4.16Å; A249-Q258 CarbonylContact O-C 3.56Å; A249-Q258 VanDerWaalsContact O-CA 3.23Å; A249-Q258 WeakPolarHBondContact O-CA 3.23Å; A256-Q258 PolarHBondContact O-N 2.96Å; Q258-N326 PolarHBondContact O-ND2 3Å
259	G	98.5	Very high	97.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	166.2	173	0	0	0	0	0	111.6	V248 A249 F261 K324 N326	V248-G259 WeakPolarHBondContact CA-O 3.35Å; A249-G259 PolarHBondContact N-O 3.01Å; A249-G259 VanDerWaalsContact N-O 3.11Å; A249-G259 PolarHBondContact O-N 2.89Å; G259-F261 WeakPolarHBondContact O-CD2 3.31Å; G259-K324 CarbonylContact C-O 3.58Å; G259-K324 WeakPolarHBondContact CA-O 3.33Å; G259-N326 WeakPolarHBondContact CA-ND2 3.24Å
260	L	98.8	Very high	97.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.7	175.5	-169	70.4	0	0	0	109.5	V246 V248 A273 L321 K324 A325 I349 L361	V246-L260 HydrophobicContact CB-CD1 3.8Å; V246-L260 HydrophobicContact CB-CD2 4.49Å; V246-L260 HydrophobicContact CB-CG 4.06Å; V246-L260 HydrophobicContact CG1-CD1 4.41Å; V246-L260 HydrophobicContact CG1-CD2 4.24Å; V246-L260 HydrophobicContact CG1-CG 4.17Å; V246-L260 HydrophobicContact CG2-CD1 3.87Å; V246-L260 HydrophobicContact CG2-CG 4.49Å; V248-L260 HydrophobicContact CG2-CD1 4.25Å; L260-A273 HydrophobicContact CD2-CB 3.71Å; L260-L321 HydrophobicContact CD1-CB 3.92Å; L260-K324 HydrophobicContact CB-CB 4.25Å; L260-K324 HydrophobicContact CD1-CB 4.33Å; L260-K324 PolarHBondContact N-O 3.28Å; L260-K324 VanDerWaalsContact N-O 3.08Å; L260-A325 HydrophobicContact CB-CB 4.17Å; L260-A325 HydrophobicContact CD2-CB 4.15Å; L260-I349 HydrophobicContact CD2-CD1 3.92Å; L260-L361 HydrophobicContact CD2-CD1 4.17Å; L260-L361 HydrophobicContact CG-CD1 4.33Å; L260-L361 PolarHBondContact O-N 3.27Å
261	F	98.9	Very high	97.4	Very high	11 Å²	11	50.6 Å²	50.6	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.4	-173	-68.4	-99	0	0	0	111.5	V246 F247 A249 E250 L252 G259 E359 E360	V246-F261 CarbonylContact C-O 3.53Å; V246-F261 WeakPolarHBondContact CA-O 3.21Å; F247-F261 HydrophobicContact CD1-CB 3.92Å; F247-F261 WeakPolarHBondContact CD1-O 3.37Å; F247-F261 HydrophobicContact CD2-CB 4.19Å; F247-F261 HydrophobicContact CE1-CB 3.5Å; F247-F261 HydrophobicContact CE2-CB 3.79Å; F247-F261 HydrophobicContact CE2-CD2 4.47Å; F247-F261 HydrophobicContact CE2-CG 4.19Å; F247-F261 HydrophobicContact CG-CB 4.27Å; F247-F261 HydrophobicContact CZ-CB 3.43Å; F247-F261 VanDerWaalsContact CZ-CB 3.43Å; F247-F261 HydrophobicContact CZ-CG 4.11Å; F247-F261 PolarHBondContact N-O 2.77Å; F247-F261 PolarHBondContact O-N 2.79Å; A249-F261 HydrophobicContact CB-CD2 3.82Å; A249-F261 HydrophobicContact CB-CE2 3.78Å; E250-F261 VanDerWaalsContact O-CZ 3.29Å; E250-F261 WeakPolarHBondContact O-CZ 3.47Å; L252-F261 HydrophobicContact CD1-CE1 4.32Å; L252-F261 HydrophobicContact CG-CE1 4.13Å; L252-F261 HydrophobicContact CG-CZ 4.29Å; G259-F261 WeakPolarHBondContact O-CD2 3.31Å; F261-E359 WeakPolarHBondContact CA-O 3.46Å; F261-E360 HydrophobicContact CD1-CB 3.86Å; F261-E360 HydrophobicContact CD1-CG 4.36Å; F261-E360 HydrophobicContact CE1-CB 3.5Å; F261-E360 HydrophobicContact CE1-CG 3.92Å; F261-E360 HydrophobicContact CE2-CG 4.21Å; F261-E360 HydrophobicContact CZ-CB 3.94Å; F261-E360 HydrophobicContact CZ-CG 3.82Å
262	A	98.8	Very high	97.4	Very high	0 Å²	0	50 Å²	50	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	130.2	177.2	0	0	0	0	0	112.2	W245 M272 V355 Q356 D358 E359 L361	W245-A262 CarbonylContact O-C 3.57Å; W245-A262 WeakPolarHBondContact O-CA 3.32Å; A262-M272 HydrophobicContact CB-CE 3.84Å; A262-V355 HydrophobicContact CB-CG2 4.32Å; A262-Q356 WeakPolarHBondContact CB-O 3.38Å; A262-D358 WeakPolarHBondContact O-CA 3.41Å; A262-D358 PolarHBondContact O-N 3.24Å; A262-E359 PolarHBondContact N-O 3.11Å; A262-L361 HydrophobicContact CB-CD2 4.18Å
263	K	98.6	Very high	97.5	Very high	82 Å²	82	43.2 Å²	43.2	36%	0.357	28%	0.281	S	S	.	.	S	Bend	trans	-77.5	-23.3	173.1	-75.7	-178.4	164.4	144.8	0	113.6	S243 Q244 W245 V246 F247 K357	S243-K263 WeakPolarHBondContact O-CD 3.39Å; S243-K263 PolarHBondContact O-NZ 3.25Å; Q244-K263 WeakPolarHBondContact O-CB 3.29Å; W245-K263 PolarHBondContact O-N 3.48Å; V246-K263 WeakPolarHBondContact O-CD 3.48Å; V246-K263 WeakPolarHBondContact O-CE 3.46Å; V246-K263 PolarHBondContact O-NZ 3.26Å; F247-K263 HydrophobicContact CB-CG 4.48Å; F247-K263 HydrophobicContact CD1-CG 3.64Å; F247-K263 HydrophobicContact CE1-CG 4.42Å; K263-K357 WeakPolarHBondContact O-CD 3.37Å; K263-K357 WeakPolarHBondContact O-CG 3.29Å
264	A	97.5	Very high	97.7	Very high	39 Å²	39	41.2 Å²	41.2	32%	0.322	27%	0.27	S	S	.	.	S	Bend	trans	-145.5	164.1	-173.9	0	0	0	0	0	110.8	W245 A266	W245-A264 HydrophobicContact CZ3-CB 4.46Å; A264-A266 PolarHBondContact O-N 3.41Å
265	V	98.3	Very high	97.9	Very high	88 Å²	88	31.5 Å²	31.5	53%	0.533	23%	0.228	S	C	.	.			trans	-66.6	130.5	172.1	179.1	0	0	0	0	108.7	V355	V265-V355 WeakPolarHBondContact CA-O 3.12Å
266	A	98	Very high	98.2	Very high	3 Å²	3	27.7 Å²	27.7	3%	0.025	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-126.7	141.4	175.6	0	0	0	0	0	110.5	W245 A264 T270 M272 T351 A354 V355	W245-A266 HydrophobicContact CE3-CB 4.23Å; W245-A266 HydrophobicContact CH2-CB 4.5Å; W245-A266 HydrophobicContact CZ3-CB 3.7Å; A264-A266 PolarHBondContact O-N 3.41Å; A266-T270 HydrophobicContact CB-CG2 4Å; A266-M272 HydrophobicContact CB-CE 4.12Å; A266-M272 HydrophobicContact CB-SD 3.64Å; A266-T351 HydrophobicContact CB-CG2 4.45Å; A266-A354 CarbonylContact O-C 3.51Å; A266-A354 VanDerWaalsContact O-CA 3.24Å; A266-A354 WeakPolarHBondContact O-CA 3.26Å; A266-V355 HydrophobicContact CB-CG2 3.72Å; A266-V355 PolarHBondContact N-O 2.59Å; A266-V355 PolarHBondContact O-N 2.74Å
267	G	98.3	Very high	98.4	Very high	33 Å²	33	25.9 Å²	25.9	34%	0.34	17%	0.174	S	C	.	.			trans	-76.7	172.2	173.8	0	0	0	0	0	111.8	T270 T351	G267-T270 PolarHBondContact N-OG1 3.07Å; G267-T270 WeakPolarHBondContact O-CB 3.37Å; G267-T270 PolarHBondContact O-OG1 2.81Å; G267-T351 PolarHBondContact O-OG1 2.87Å
268	P	98.2	Very high	98.5	Very high	90 Å²	90	24 Å²	24	58%	0.584	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	147.7	168.7	-16.8	29.3	0	0	0	111.4	T270	P268-T270 VanDerWaalsContact C-N 3.31Å; P268-T270 PolarHBondContact O-N 2.91Å
269	G	97.7	Very high	98.5	Very high	37 Å²	37	21.9 Å²	21.9	38%	0.381	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	9.9	178.4	0	0	0	0	0	114.9	R350 T351	G269-R350 VanDerWaalsContact C-CG 3.47Å; G269-R350 WeakPolarHBondContact O-CD 3.42Å; G269-R350 PolarHBondContact O-NH1 2.9Å; G269-T351 PolarHBondContact N-O 3.22Å; G269-T351 PolarHBondContact N-OG1 3.32Å; G269-T351 VanDerWaalsContact N-OG1 3.16Å
270	T	98.4	Very high	98.5	Very high	29 Å²	29	22.3 Å²	22.3	18%	0.178	14%	0.144	C	C	.	.			trans	-85.1	128.9	-179.6	-52.2	0	0	0	0	110.4	W245 A266 G267 P268 M272 R350 T351	W245-T270 HydrophobicContact CE3-CG2 4.49Å; W245-T270 HydrophobicContact CH2-CG2 4.04Å; W245-T270 HydrophobicContact CZ2-CG2 4.16Å; W245-T270 HydrophobicContact CZ3-CG2 4.23Å; A266-T270 HydrophobicContact CB-CG2 4Å; G267-T270 PolarHBondContact N-OG1 3.07Å; G267-T270 WeakPolarHBondContact O-CB 3.37Å; G267-T270 PolarHBondContact O-OG1 2.81Å; P268-T270 VanDerWaalsContact C-N 3.31Å; P268-T270 PolarHBondContact O-N 2.91Å; T270-M272 HydrophobicContact CG2-SD 3.92Å; T270-M272 PolarHBondContact O-N 3.1Å; T270-R350 CarbonylContact O-C 3.51Å; T270-R350 VanDerWaalsContact O-CA 3.32Å; T270-R350 WeakPolarHBondContact O-CA 3.47Å; T270-T351 PolarHBondContact N-OG1 3.4Å; T270-T351 PolarHBondContact O-N 3.11Å; T270-T351 PolarHBondContact O-OG1 3.39Å
271	V	98.7	Very high	98.4	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	125	169.8	-178	0	0	0	0	108.7	P179 Y241 F274 F338 C348 R350	P179-V271 HydrophobicContact CB-CG2 4.29Å; P179-V271 HydrophobicContact CG-CB 4.39Å; P179-V271 HydrophobicContact CG-CG2 3.99Å; Y241-V271 HydrophobicContact CE1-CB 4.17Å; Y241-V271 HydrophobicContact CE1-CG1 4.1Å; Y241-V271 VanDerWaalsContact CE1-O 3.22Å; Y241-V271 WeakPolarHBondContact CE1-O 3.5Å; Y241-V271 PolarHBondContact OH-O 3.01Å; V271-F274 HydrophobicContact CG1-CD1 4.46Å; V271-F274 HydrophobicContact CG1-CE1 3.76Å; V271-F274 HydrophobicContact CG1-CZ 4.26Å; V271-F338 HydrophobicContact CG1-CD2 4.42Å; V271-F338 HydrophobicContact CG1-CE2 4.23Å; V271-F338 HydrophobicContact CG2-CD2 4.44Å; V271-F338 HydrophobicContact CG2-CE2 4.17Å; V271-C348 HydrophobicContact CG1-CB 3.89Å; V271-R350 VanDerWaalsContact CG2-NH1 3.31Å; V271-R350 VanDerWaalsContact CG2-NH2 3.32Å
272	M	98.7	Very high	98.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-38.9	-175.6	-60.5	-61.7	-70	0	0	112.7	W245 V246 A262 A266 T270 I349 T351 V355 L361	W245-M272 HydrophobicContact CB-CE 4.29Å; W245-M272 WeakPolarHBondContact CB-O 3.41Å; W245-M272 HydrophobicContact CD2-SD 4.39Å; W245-M272 HydrophobicContact CE3-CE 4.02Å; W245-M272 HydrophobicContact CE3-SD 3.95Å; V246-M272 HydrophobicContact CG1-CB 4.02Å; V246-M272 HydrophobicContact CG1-CE 4.28Å; V246-M272 WeakPolarHBondContact CG1-O 3.42Å; A262-M272 HydrophobicContact CB-CE 3.84Å; A266-M272 HydrophobicContact CB-CE 4.12Å; A266-M272 HydrophobicContact CB-SD 3.64Å; T270-M272 HydrophobicContact CG2-SD 3.92Å; T270-M272 PolarHBondContact O-N 3.1Å; M272-I349 PolarHBondContact N-O 2.81Å; M272-T351 HydrophobicContact CG-CG2 3.51Å; M272-T351 HydrophobicContact SD-CG2 3.81Å; M272-V355 HydrophobicContact CE-CG2 4.26Å; M272-L361 HydrophobicContact CB-CD1 3.81Å; M272-L361 HydrophobicContact CE-CD1 3.97Å; M272-L361 HydrophobicContact CG-CD1 4.07Å
273	A	98.8	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	163.8	-172.9	0	0	0	0	0	112.2	E242 V246 L260 C348 I349	E242-A273 HydrophobicContact CG-CB 4.14Å; E242-A273 VanDerWaalsContact OE1-CA 3.29Å; E242-A273 WeakPolarHBondContact OE1-CA 3.32Å; E242-A273 VanDerWaalsContact OE1-CB 3.27Å; E242-A273 WeakPolarHBondContact OE1-CB 3.24Å; V246-A273 HydrophobicContact CG1-CB 4.48Å; V246-A273 HydrophobicContact CG2-CB 4.22Å; L260-A273 HydrophobicContact CD2-CB 3.71Å; A273-C348 CarbonylContact O-C 3.49Å; A273-C348 VanDerWaalsContact O-CA 3.27Å; A273-C348 WeakPolarHBondContact O-CA 3.46Å; A273-C348 WeakPolarHBondContact O-CB 3.49Å; A273-I349 HydrophobicContact CB-CB 4.28Å; A273-I349 HydrophobicContact CB-CD1 4.34Å; A273-I349 HydrophobicContact CB-CG1 4.49Å; A273-I349 PolarHBondContact O-N 3.09Å
274	F	98.9	Very high	97.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.4	-177.9	-58.4	-59.9	0	0	0	111	Y178 D239 Y241 E242 V271 S320 G322 F338 H340 I346 C348	Y178-F274 HydrophobicContact CD1-CE2 4.47Å; Y178-F274 HydrophobicContact CD1-CZ 4.01Å; Y178-F274 AromaticContact CE1-CE2 3.93Å; Y178-F274 HydrophobicContact CE1-CE2 3.93Å; Y178-F274 AromaticContact CE1-CZ 3.84Å; Y178-F274 HydrophobicContact CE1-CZ 3.84Å; D239-F274 HydrophobicContact CB-CD2 4.2Å; D239-F274 HydrophobicContact CB-CE2 4.45Å; D239-F274 WeakPolarHBondContact OD1-CE2 3.14Å; Y241-F274 AromaticContact CD1-CE2 3.76Å; Y241-F274 HydrophobicContact CD1-CE2 3.76Å; Y241-F274 AromaticContact CD1-CZ 3.63Å; Y241-F274 HydrophobicContact CD1-CZ 3.63Å; Y241-F274 HydrophobicContact CE1-CZ 4.16Å; Y241-F274 HydrophobicContact CG-CE2 4.48Å; Y241-F274 HydrophobicContact CG-CZ 4.41Å; E242-F274 HydrophobicContact CB-CD2 4.06Å; E242-F274 HydrophobicContact CB-CE2 4.22Å; E242-F274 PolarHBondContact OE1-N 3.06Å; V271-F274 HydrophobicContact CG1-CD1 4.46Å; V271-F274 HydrophobicContact CG1-CE1 3.76Å; V271-F274 HydrophobicContact CG1-CZ 4.26Å; F274-S320 VanDerWaalsContact O-CB 3.24Å; F274-S320 WeakPolarHBondContact O-CB 3.44Å; F274-S320 PolarHBondContact O-OG 3.48Å; F274-G322 VanDerWaalsContact O-CA 3.3Å; F274-G322 WeakPolarHBondContact O-CA 3.45Å; F274-G322 PolarHBondContact O-N 2.66Å; F274-F338 AromaticContact CD1-CD1 3.95Å; F274-F338 HydrophobicContact CD1-CD1 3.95Å; F274-F338 HydrophobicContact CD1-CE1 4.09Å; F274-F338 HydrophobicContact CD1-CG 4.24Å; F274-F338 AromaticContact CE1-CD1 3.71Å; F274-F338 HydrophobicContact CE1-CD1 3.71Å; F274-F338 HydrophobicContact CE1-CD2 4.06Å; F274-F338 AromaticContact CE1-CE1 3.41Å; F274-F338 HydrophobicContact CE1-CE1 3.41Å; F274-F338 VanDerWaalsContact CE1-CE1 3.41Å; F274-F338 AromaticContact CE1-CE2 3.82Å; F274-F338 HydrophobicContact CE1-CE2 3.82Å; F274-F338 HydrophobicContact CE1-CG 4.04Å; F274-F338 AromaticContact CE1-CZ 3.49Å; F274-F338 HydrophobicContact CE1-CZ 3.49Å; F274-F338 VanDerWaalsContact CE1-CZ 3.49Å; F274-F338 HydrophobicContact CZ-CE1 4.08Å; F274-F338 HydrophobicContact CZ-CZ 4.02Å; F274-H340 AromaticContact CD1-CD2 3.79Å; F274-H340 AromaticContact CD2-CD2 3.83Å; F274-H340 AromaticContact CD2-NE2 3.64Å; F274-H340 AromaticContact CE1-CD2 3.81Å; F274-H340 AromaticContact CE2-CD2 3.84Å; F274-H340 AromaticContact CE2-NE2 3.54Å; F274-H340 AromaticContact CG-CD2 3.81Å; F274-H340 AromaticContact CZ-CD2 3.83Å; F274-H340 AromaticContact CZ-NE2 3.92Å; F274-I346 HydrophobicContact CB-CD1 3.86Å; F274-I346 HydrophobicContact CD1-CD1 4.39Å; F274-I346 HydrophobicContact CG-CD1 4.42Å; F274-C348 HydrophobicContact CD1-CB 4.03Å; F274-C348 HydrophobicContact CE1-CB 4.42Å
275	Y	98.8	Very high	97.3	Very high	7 Å²	7	31 Å²	31	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	86.1	177.3	-152.4	-52	0	0	0	108.9	N295 I297 I305 V307 H323 Y335 K347	Y275-N295 VanDerWaalsContact OH-C 3.27Å; Y275-N295 WeakPolarHBondContact OH-CA 3.22Å; Y275-N295 PolarHBondContact OH-O 2.9Å; Y275-I297 HydrophobicContact CD1-CG2 3.61Å; Y275-I297 HydrophobicContact CD2-CD1 4.35Å; Y275-I297 HydrophobicContact CD2-CG2 4.28Å; Y275-I297 HydrophobicContact CE1-CB 4.48Å; Y275-I297 HydrophobicContact CE1-CG2 3.54Å; Y275-I297 HydrophobicContact CE2-CG2 4.21Å; Y275-I297 HydrophobicContact CG-CG2 4Å; Y275-I305 HydrophobicContact CD1-CG2 3.85Å; Y275-I305 HydrophobicContact CE1-CG2 4.12Å; Y275-V307 HydrophobicContact CE1-CG2 4.06Å; Y275-H323 HydrophobicContact CE1-CB 3.98Å; Y275-H323 HydrophobicContact CE2-CB 4.08Å; Y275-Y335 HydrophobicContact CD2-CD1 4.4Å; Y275-Y335 AromaticContact CD2-CE1 3.62Å; Y275-Y335 HydrophobicContact CD2-CE1 3.62Å; Y275-Y335 HydrophobicContact CE2-CE1 4.07Å; Y275-Y335 AromaticContact CE2-CZ 4Å; Y275-K347 WeakPolarHBondContact CA-O 3.33Å; Y275-K347 PolarHBondContact N-O 2.79Å
276	N	98.9	Very high	96.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.196	C	C	.	.			trans	-104	151.6	171.8	175.6	60.2	0	0	0	109.1	I231 V307 Y317 S320 F343 I346	I231-N276 PolarHBondContact O-ND2 2.87Å; N276-V307 VanDerWaalsContact O-CG2 3.31Å; N276-V307 WeakPolarHBondContact O-CG2 3.43Å; N276-Y317 PolarHBondContact ND2-OH 3.14Å; N276-S320 WeakPolarHBondContact CB-OG 3.46Å; N276-S320 PolarHBondContact N-OG 2.85Å; N276-F343 HydrophobicContact CB-CB 4.13Å; N276-F343 HydrophobicContact CB-CD1 4.06Å; N276-F343 HydrophobicContact CB-CD2 3.98Å; N276-F343 HydrophobicContact CB-CE1 4.48Å; N276-F343 HydrophobicContact CB-CE2 4.42Å; N276-F343 HydrophobicContact CB-CG 3.8Å; N276-F343 WeakPolarHBondContact ND2-CD1 3.41Å; N276-I346 HydrophobicContact CB-CD1 4.39Å; N276-I346 HydrophobicContact CB-CG2 4.3Å
277	G	98.8	Very high	96.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.226	C	C	.	.			trans	-171.8	177.5	-175.5	0	0	0	0	0	110.3	S226 D306	S226-G277 WeakPolarHBondContact CB-O 3.27Å; S226-G277 PolarHBondContact OG-O 3.19Å; G277-D306 CarbonylContact C-O 3.5Å; G277-D306 WeakPolarHBondContact CA-O 3.37Å
278	V	98.7	Very high	95.9	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.048	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	154.8	169.1	-61.9	0	0	0	0	110.1	T227 I231 I280 I305 D306 P308	T227-V278 CarbonylContact O-C 3.58Å; T227-V278 VanDerWaalsContact O-CA 3.24Å; T227-V278 WeakPolarHBondContact O-CA 3.47Å; T227-V278 VanDerWaalsContact O-CB 3.32Å; T227-V278 WeakPolarHBondContact O-CB 3.18Å; I231-V278 HydrophobicContact CB-CG1 3.98Å; V278-I280 HydrophobicContact CG2-CG2 4.29Å; V278-I305 CarbonylContact O-C 3.45Å; V278-I305 WeakPolarHBondContact O-CA 3.5Å; V278-D306 HydrophobicContact CG2-CB 3.9Å; V278-D306 WeakPolarHBondContact CG2-O 3.47Å; V278-D306 PolarHBondContact N-O 2.83Å; V278-D306 PolarHBondContact O-N 2.85Å; V278-P308 HydrophobicContact CG2-CG 4.12Å
279	R	98.7	Very high	95.5	Very high	31 Å²	31	38.4 Å²	38.4	12%	0.117	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	108.8	-176.8	-63.3	173.2	-171.7	-89.5	-1.1	109.8	S226 T227 S228 T303 F343 P345	S226-R279 WeakPolarHBondContact O-CD 3.43Å; S226-R279 PolarHBondContact O-NE 2.83Å; S226-R279 WeakPolarHBondContact OG-CG 3.33Å; S226-R279 PolarHBondContact OG-NE 3.2Å; T227-R279 PolarHBondContact O-N 3.41Å; S228-R279 WeakPolarHBondContact CA-O 3.26Å; S228-R279 VanDerWaalsContact CB-O 3.25Å; S228-R279 WeakPolarHBondContact CB-O 3.21Å; R279-T303 HydrophobicContact CB-CG2 3.91Å; R279-T303 HydrophobicContact CG-CG2 4.19Å; R279-F343 PolarHBondContact NH2-O 3.47Å; R279-P345 VanDerWaalsContact CZ-O 3.3Å; R279-P345 PolarHBondContact NH1-O 2.77Å; R279-P345 PolarHBondContact NH2-O 2.85Å
280	I	97.8	Very high	94.7	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.051	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	171.7	-178	58.9	178.4	0	0	0	110.3	V278 V285 V304 D306	V278-I280 HydrophobicContact CG2-CG2 4.29Å; I280-V285 HydrophobicContact CD1-CG2 3.41Å; I280-V285 VanDerWaalsContact CD1-CG2 3.41Å; I280-V285 HydrophobicContact CG1-CG2 3.88Å; I280-V304 HydrophobicContact CG1-CB 4.18Å; I280-V304 PolarHBondContact N-O 3.02Å; I280-V304 PolarHBondContact O-N 3.26Å; I280-D306 HydrophobicContact CD1-CB 3.86Å; I280-D306 HydrophobicContact CG1-CB 4.4Å
281	T	96.7	Very high	94.1	Very high	71 Å²	71	43.5 Å²	43.5	44%	0.436	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	154.3	-179.4	66.5	0	0	0	0	111.5	S283 E284 V285	T281-S283 VanDerWaalsContact C-N 3.27Å; T281-S283 PolarHBondContact O-N 2.89Å; T281-E284 WeakPolarHBondContact O-CB 3.41Å; T281-E284 PolarHBondContact O-N 3.34Å; T281-E284 VanDerWaalsContact O-N 3.15Å; T281-E284 PolarHBondContact OG1-N 3.14Å; T281-V285 PolarHBondContact O-N 2.84Å
282	H	92.4	Very high	93.6	Very high	55 Å²	55	48.4 Å²	48.4	26%	0.255	27%	0.269	S	S	.	.	H	α-helix	trans	-54.4	-43.7	170.7	-70.2	-91.4	0	0	0	111.9	E284 V285 D286 D300 D301 V304	H282-E284 VanDerWaalsContact C-N 3.29Å; H282-E284 PolarHBondContact O-N 2.82Å; H282-V285 WeakPolarHBondContact O-CB 3.48Å; H282-V285 PolarHBondContact O-N 3.36Å; H282-D286 WeakPolarHBondContact O-CB 3.21Å; H282-D286 PolarHBondContact O-N 2.86Å; H282-D300 PolarHBondContact NE2-O 2.99Å; H282-D301 PolarHBondContact CD2-O 3.24Å; H282-D301 PolarHBondContact NE2-O 3.06Å; H282-V304 HydrophobicContact CB-CG2 4.41Å; H282-V304 WeakPolarHBondContact ND1-CG2 3.31Å
283	S	92.8	Very high	93.3	Very high	87 Å²	87	48.5 Å²	48.5	61%	0.608	27%	0.269	S	S	*	.	H	α-helix	trans	-56.5	-38	177.1	-177	0	0	0	0	113.8	T281 S287	T281-S283 VanDerWaalsContact C-N 3.27Å; T281-S283 PolarHBondContact O-N 2.89Å; S283-S287 VanDerWaalsContact O-CB 3.24Å; S283-S287 WeakPolarHBondContact O-CB 2.99Å; S283-S287 PolarHBondContact O-N 3.5Å; S283-S287 VanDerWaalsContact O-N 3.14Å; S283-S287 PolarHBondContact O-OG 3.12Å
284	E	93.4	Very high	92.8	Very high	90 Å²	90	50.8 Å²	50.8	42%	0.421	29%	0.293	S	S	.	.	H	α-helix	trans	-67.9	-40.4	176	-174.9	177.2	158.6	0	0	111.8	T281 H282 S287 R288	T281-E284 WeakPolarHBondContact O-CB 3.41Å; T281-E284 PolarHBondContact O-N 3.34Å; T281-E284 VanDerWaalsContact O-N 3.15Å; T281-E284 PolarHBondContact OG1-N 3.14Å; H282-E284 VanDerWaalsContact C-N 3.29Å; H282-E284 PolarHBondContact O-N 2.82Å; E284-S287 PolarHBondContact O-OG 2.81Å; E284-R288 WeakPolarHBondContact O-CG 3.5Å; E284-R288 PolarHBondContact O-N 3.18Å
285	V	91.5	Very high	92.7	Very high	10 Å²	10	52.6 Å²	52.6	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-68.5	-41.8	179	174.8	0	0	0	0	111.4	I280 T281 H282 S287 N293 T296 V304	I280-V285 HydrophobicContact CD1-CG2 3.41Å; I280-V285 VanDerWaalsContact CD1-CG2 3.41Å; I280-V285 HydrophobicContact CG1-CG2 3.88Å; T281-V285 PolarHBondContact O-N 2.84Å; H282-V285 WeakPolarHBondContact O-CB 3.48Å; H282-V285 PolarHBondContact O-N 3.36Å; V285-S287 VanDerWaalsContact C-N 3.33Å; V285-S287 PolarHBondContact O-N 3.15Å; V285-N293 PolarHBondContact O-ND2 3.26Å; V285-T296 HydrophobicContact CG1-CG2 4.17Å; V285-T296 HydrophobicContact CG2-CG2 4.17Å; V285-V304 HydrophobicContact CG2-CB 4.06Å; V285-V304 HydrophobicContact CG2-CG1 3.92Å; V285-V304 HydrophobicContact CG2-CG2 4.22Å
286	D	87.8	Confident	92.6	Very high	107 Å²	107	53.6 Å²	53.6	57%	0.572	31%	0.309	S	S	*	.	H	α-helix	trans	-73.2	-26.4	-177.7	-61.5	-17.1	0	0	0	112.7	H282	H282-D286 WeakPolarHBondContact O-CB 3.21Å; H282-D286 PolarHBondContact O-N 2.86Å
287	S	89.3	Confident	92.4	Very high	95 Å²	95	54.4 Å²	54.4	66%	0.664	31%	0.314	S	S	*	.	H	α-helix	trans	-91.8	-14.6	-177.1	61.8	0	0	0	0	114.5	S283 E284 V285	S283-S287 VanDerWaalsContact O-CB 3.24Å; S283-S287 WeakPolarHBondContact O-CB 2.99Å; S283-S287 PolarHBondContact O-N 3.5Å; S283-S287 VanDerWaalsContact O-N 3.14Å; S283-S287 PolarHBondContact O-OG 3.12Å; E284-S287 PolarHBondContact O-OG 2.81Å; V285-S287 VanDerWaalsContact C-N 3.33Å; V285-S287 PolarHBondContact O-N 3.15Å
288	R	89.8	Confident	92.3	Very high	58 Å²	58	56.8 Å²	56.8	22%	0.219	33%	0.33	C	S	.	.	S	Bend	trans	-94.6	169.8	-179.3	74.4	-173.1	-172.2	171.5	7.5	112.7	E284 W290 L292 N293 D306	E284-R288 WeakPolarHBondContact O-CG 3.5Å; E284-R288 PolarHBondContact O-N 3.18Å; R288-W290 PolarHBondContact O-N 3Å; R288-L292 PolarHBondContact NH2-O 3.08Å; R288-N293 VanDerWaalsContact CZ-OD1 3.24Å; R288-N293 PolarHBondContact NE-OD1 2.9Å; R288-N293 PolarHBondContact NH2-OD1 2.98Å; R288-D306 IonicContact CZ-OD2 3.7Å; R288-D306 IonicContact NH1-OD2 2.88Å; R288-D306 PolarHBondContact NH1-OD2 2.78Å; R288-D306 IonicContact NH2-OD1 3.7Å; R288-D306 IonicContact NH2-OD2 3.93Å; R288-D306 PolarHBondContact NH2-OD2 2.8Å
289	D	88.2	Confident	92.1	Very high	110 Å²	110	57.7 Å²	57.7	59%	0.588	34%	0.335	S	S	*	.			trans	-61.8	130.8	177.6	-169.2	-29.3	0	0	0	110.5	A291 L292	D289-A291 PolarHBondContact O-N 3.09Å; D289-A291 VanDerWaalsContact O-N 3.11Å; D289-A291 WeakPolarHBondContact OD1-CB 3.4Å; D289-A291 PolarHBondContact OD1-N 3.31Å; D289-L292 WeakPolarHBondContact O-CB 3.27Å; D289-L292 PolarHBondContact O-N 3.36Å
290	W	82.2	Confident	91.9	Very high	90 Å²	90	58.1 Å²	58.1	34%	0.341	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-56.2	-27.3	178.2	-170.3	-104.3	0	0	0	113.2	R288 L292 N293 Y367	R288-W290 PolarHBondContact O-N 3Å; W290-L292 PolarHBondContact O-N 3.02Å; W290-N293 HydrophobicContact CD2-CB 4.29Å; W290-N293 HydrophobicContact CE3-CB 4.06Å; W290-N293 HydrophobicContact CZ3-CB 4.27Å; W290-N293 PolarHBondContact O-N 3.31Å; W290-Y367 HydrophobicContact CH2-CD1 4.01Å; W290-Y367 AromaticContact CH2-CE1 3.62Å; W290-Y367 HydrophobicContact CH2-CE1 3.62Å; W290-Y367 HydrophobicContact CZ2-CD1 4.06Å; W290-Y367 AromaticContact CZ2-CE1 3.53Å; W290-Y367 HydrophobicContact CZ2-CE1 3.53Å; W290-Y367 AromaticContact CZ2-CZ 3.89Å
291	A	85.8	Confident	91.6	Very high	83 Å²	83	65 Å²	65	69%	0.686	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-58.9	-19.4	174.9	0	0	0	0	0	113.5	D289	D289-A291 PolarHBondContact O-N 3.09Å; D289-A291 VanDerWaalsContact O-N 3.11Å; D289-A291 WeakPolarHBondContact OD1-CB 3.4Å; D289-A291 PolarHBondContact OD1-N 3.31Å
292	L	88.3	Confident	91.4	Very high	105 Å²	105	66.4 Å²	66.4	55%	0.55	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-90.7	-8.5	176.6	-57.7	175	0	0	0	113.2	R288 D289 W290	R288-L292 PolarHBondContact NH2-O 3.08Å; D289-L292 WeakPolarHBondContact O-CB 3.27Å; D289-L292 PolarHBondContact O-N 3.36Å; W290-L292 PolarHBondContact O-N 3.02Å
293	N	90.9	Very high	91.6	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.011	38%	0.378	C	S	.	.			trans	-97.4	17.9	-172.4	-65.4	-15.5	0	0	0	113.4	V285 R288 W290 N295 T296	V285-N293 PolarHBondContact O-ND2 3.26Å; R288-N293 VanDerWaalsContact CZ-OD1 3.24Å; R288-N293 PolarHBondContact NE-OD1 2.9Å; R288-N293 PolarHBondContact NH2-OD1 2.98Å; W290-N293 HydrophobicContact CD2-CB 4.29Å; W290-N293 HydrophobicContact CE3-CB 4.06Å; W290-N293 HydrophobicContact CZ3-CB 4.27Å; W290-N293 PolarHBondContact O-N 3.31Å; N293-N295 PolarHBondContact O-N 3.19Å; N293-T296 HydrophobicContact CB-CG2 4.26Å; N293-T296 PolarHBondContact O-N 2.83Å; N293-T296 PolarHBondContact O-OG1 2.89Å
294	G	90.4	Very high	91.9	Very high	48 Å²	48	61.4 Å²	61.4	50%	0.495	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.8	-177.3	0	0	0	0	0	114.3
295	N	95.8	Very high	92.1	Very high	37 Å²	37	57.1 Å²	57.1	20%	0.198	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	25.3	-176.6	-61	-29.8	0	0	0	112.6	Y275 N293 V307	Y275-N295 VanDerWaalsContact OH-C 3.27Å; Y275-N295 WeakPolarHBondContact OH-CA 3.22Å; Y275-N295 PolarHBondContact OH-O 2.9Å; N293-N295 PolarHBondContact O-N 3.19Å; N295-V307 HydrophobicContact CB-CB 3.94Å; N295-V307 WeakPolarHBondContact CB-O 3.48Å; N295-V307 PolarHBondContact ND2-O 2.97Å; N295-V307 PolarHBondContact O-N 3.01Å
296	T	95.8	Very high	92.4	Very high	28 Å²	28	56.7 Å²	56.7	17%	0.172	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	138.7	176	52.4	0	0	0	0	111	V285 N293 V304 I305 D306	V285-T296 HydrophobicContact CG1-CG2 4.17Å; V285-T296 HydrophobicContact CG2-CG2 4.17Å; N293-T296 HydrophobicContact CB-CG2 4.26Å; N293-T296 PolarHBondContact O-N 2.83Å; N293-T296 PolarHBondContact O-OG1 2.89Å; T296-V304 HydrophobicContact CG2-CG1 4.2Å; T296-I305 CarbonylContact C-O 3.58Å; T296-I305 WeakPolarHBondContact CA-O 3.49Å; T296-D306 HydrophobicContact CG2-CB 3.98Å
297	I	95.8	Very high	93	Very high	18 Å²	18	51.6 Å²	51.6	9%	0.092	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	126.1	172	-171.5	174.8	0	0	0	109.7	Y275 L299 I305 Y335 K347	Y275-I297 HydrophobicContact CD1-CG2 3.61Å; Y275-I297 HydrophobicContact CD2-CD1 4.35Å; Y275-I297 HydrophobicContact CD2-CG2 4.28Å; Y275-I297 HydrophobicContact CE1-CB 4.48Å; Y275-I297 HydrophobicContact CE1-CG2 3.54Å; Y275-I297 HydrophobicContact CE2-CG2 4.21Å; Y275-I297 HydrophobicContact CG-CG2 4Å; I297-L299 PolarHBondContact O-N 2.58Å; I297-I305 HydrophobicContact CG2-CB 3.85Å; I297-I305 HydrophobicContact CG2-CG2 4.21Å; I297-I305 PolarHBondContact N-O 2.78Å; I297-I305 PolarHBondContact O-N 3.38Å; I297-Y335 HydrophobicContact CD1-CD1 3.82Å; I297-Y335 HydrophobicContact CD1-CD2 3.45Å; I297-Y335 VanDerWaalsContact CD1-CD2 3.45Å; I297-Y335 HydrophobicContact CD1-CE1 4.03Å; I297-Y335 HydrophobicContact CD1-CE2 3.65Å; I297-Y335 HydrophobicContact CD1-CG 3.51Å; I297-K347 HydrophobicContact CD1-CB 4.38Å; I297-K347 HydrophobicContact CD1-CD 3.44Å; I297-K347 VanDerWaalsContact CD1-CD 3.44Å; I297-K347 HydrophobicContact CD1-CG 4.49Å; I297-K347 HydrophobicContact CG1-CD 3.87Å
298	S	95.8	Very high	93.4	Very high	49 Å²	49	48.9 Å²	48.9	34%	0.343	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	130.9	173.5	163.6	0	0	0	0	109.5	D300 K347	S298-D300 PolarHBondContact OG-O 2.85Å; S298-D300 VanDerWaalsContact OG-O 3.14Å; S298-K347 WeakPolarHBondContact O-CD 3.5Å; S298-K347 WeakPolarHBondContact O-CE 3.39Å; S298-K347 PolarHBondContact O-NZ 3.02Å
299	L	94.6	Very high	93.6	Very high	28 Å²	28	53.6 Å²	53.6	15%	0.147	31%	0.305	C	S	.	.			trans	-88.7	-50.3	171.5	176.7	62.2	0	0	0	110	I297 T303 I305 K347	I297-L299 PolarHBondContact O-N 2.58Å; L299-T303 HydrophobicContact CB-CG2 4.34Å; L299-T303 WeakPolarHBondContact CB-O 3.28Å; L299-T303 HydrophobicContact CD2-CG2 4.1Å; L299-T303 PolarHBondContact N-O 2.79Å; L299-I305 HydrophobicContact CB-CD1 4.16Å; L299-I305 HydrophobicContact CB-CG1 4.16Å; L299-I305 HydrophobicContact CD1-CD1 3.99Å; L299-I305 HydrophobicContact CD2-CD1 4.18Å; L299-I305 HydrophobicContact CD2-CG1 4.43Å; L299-I305 HydrophobicContact CG-CD1 4.35Å; L299-K347 HydrophobicContact CD1-CG 4.32Å
300	D	94.1	Very high	94.1	Very high	39 Å²	39	51.4 Å²	51.4	21%	0.209	30%	0.297	C	S	.	.	S	Bend	trans	-150.9	-170.1	-179.6	52	50.6	0	0	0	109.4	L16 H282 S298 D302 T303	L16-D300 HydrophobicContact CD1-CB 3.74Å; H282-D300 PolarHBondContact NE2-O 2.99Å; S298-D300 PolarHBondContact OG-O 2.85Å; S298-D300 VanDerWaalsContact OG-O 3.14Å; D300-D302 PolarHBondContact O-N 3Å; D300-D302 PolarHBondContact OD1-N 3.1Å; D300-T303 PolarHBondContact N-O 2.98Å; D300-T303 WeakPolarHBondContact OD1-CA 3.23Å; D300-T303 VanDerWaalsContact OD1-CB 3.23Å; D300-T303 WeakPolarHBondContact OD1-CB 3.49Å; D300-T303 PolarHBondContact OD1-N 3.39Å; D300-T303 PolarHBondContact OD1-OG1 3.13Å
301	D	92.1	Very high	94.8	Very high	154 Å²	154	49.7 Å²	49.7	82%	0.824	29%	0.292	S	S	*	.	S	Bend	trans	-66.2	-22.1	-177.1	-67.1	-19.3	0	0	0	113.2	H282	H282-D301 PolarHBondContact CD2-O 3.24Å; H282-D301 PolarHBondContact NE2-O 3.06Å
302	D	93.4	Very high	95.3	Very high	102 Å²	102	47.4 Å²	47.4	55%	0.545	27%	0.268	S	S	.	.	S	Bend	trans	-105.5	-27.9	-175.6	-66.6	-45.3	0	0	0	112.6	D300	D300-D302 PolarHBondContact O-N 3Å; D300-D302 PolarHBondContact OD1-N 3.1Å
303	T	96.7	Very high	95.8	Very high	31 Å²	31	46.4 Å²	46.4	19%	0.19	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.2	-166.2	-50.2	0	0	0	0	112.5	R279 L299 D300	R279-T303 HydrophobicContact CB-CG2 3.91Å; R279-T303 HydrophobicContact CG-CG2 4.19Å; L299-T303 HydrophobicContact CB-CG2 4.34Å; L299-T303 WeakPolarHBondContact CB-O 3.28Å; L299-T303 HydrophobicContact CD2-CG2 4.1Å; L299-T303 PolarHBondContact N-O 2.79Å; D300-T303 PolarHBondContact N-O 2.98Å; D300-T303 WeakPolarHBondContact OD1-CA 3.23Å; D300-T303 VanDerWaalsContact OD1-CB 3.23Å; D300-T303 WeakPolarHBondContact OD1-CB 3.49Å; D300-T303 PolarHBondContact OD1-N 3.39Å; D300-T303 PolarHBondContact OD1-OG1 3.13Å
304	V	97.7	Very high	96.1	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.03	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134	165.7	-179	0	0	0	0	109	I280 H282 V285 T296	I280-V304 HydrophobicContact CG1-CB 4.18Å; I280-V304 PolarHBondContact N-O 3.02Å; I280-V304 PolarHBondContact O-N 3.26Å; H282-V304 HydrophobicContact CB-CG2 4.41Å; H282-V304 WeakPolarHBondContact ND1-CG2 3.31Å; V285-V304 HydrophobicContact CG2-CB 4.06Å; V285-V304 HydrophobicContact CG2-CG1 3.92Å; V285-V304 HydrophobicContact CG2-CG2 4.22Å; T296-V304 HydrophobicContact CG2-CG1 4.2Å
305	I	98.6	Very high	96.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.1	168.9	-69.2	173.9	0	0	0	108.4	Y275 V278 T296 I297 L299 I346	Y275-I305 HydrophobicContact CD1-CG2 3.85Å; Y275-I305 HydrophobicContact CE1-CG2 4.12Å; V278-I305 CarbonylContact O-C 3.45Å; V278-I305 WeakPolarHBondContact O-CA 3.5Å; T296-I305 CarbonylContact C-O 3.58Å; T296-I305 WeakPolarHBondContact CA-O 3.49Å; I297-I305 HydrophobicContact CG2-CB 3.85Å; I297-I305 HydrophobicContact CG2-CG2 4.21Å; I297-I305 PolarHBondContact N-O 2.78Å; I297-I305 PolarHBondContact O-N 3.38Å; L299-I305 HydrophobicContact CB-CD1 4.16Å; L299-I305 HydrophobicContact CB-CG1 4.16Å; L299-I305 HydrophobicContact CD1-CD1 3.99Å; L299-I305 HydrophobicContact CD2-CD1 4.18Å; L299-I305 HydrophobicContact CD2-CG1 4.43Å; L299-I305 HydrophobicContact CG-CD1 4.35Å; I305-I346 HydrophobicContact CD1-CB 4.17Å; I305-I346 HydrophobicContact CD1-CG2 4.17Å
306	D	98.6	Very high	96.6	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.011	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.4	176.6	-171.1	15.6	0	0	0	111.6	G277 V278 I280 R288 T296 P308	G277-D306 CarbonylContact C-O 3.5Å; G277-D306 WeakPolarHBondContact CA-O 3.37Å; V278-D306 HydrophobicContact CG2-CB 3.9Å; V278-D306 WeakPolarHBondContact CG2-O 3.47Å; V278-D306 PolarHBondContact N-O 2.83Å; V278-D306 PolarHBondContact O-N 2.85Å; I280-D306 HydrophobicContact CD1-CB 3.86Å; I280-D306 HydrophobicContact CG1-CB 4.4Å; R288-D306 IonicContact CZ-OD2 3.7Å; R288-D306 IonicContact NH1-OD2 2.88Å; R288-D306 PolarHBondContact NH1-OD2 2.78Å; R288-D306 IonicContact NH2-OD1 3.7Å; R288-D306 IonicContact NH2-OD2 3.93Å; R288-D306 PolarHBondContact NH2-OD2 2.8Å; T296-D306 HydrophobicContact CG2-CB 3.98Å; D306-P308 VanDerWaalsContact C-CD 3.46Å; D306-P308 VanDerWaalsContact O-CD 3.25Å; D306-P308 WeakPolarHBondContact O-CD 3.34Å
307	V	98.6	Very high	96.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.282	C	S	.	.			trans	-112.8	82.3	169	-173.8	0	0	0	0	108.5	I231 Y275 N276 N295 F311 Y317 H323	I231-V307 HydrophobicContact CD1-CG1 4.14Å; I231-V307 HydrophobicContact CD1-CG2 4.46Å; Y275-V307 HydrophobicContact CE1-CG2 4.06Å; N276-V307 VanDerWaalsContact O-CG2 3.31Å; N276-V307 WeakPolarHBondContact O-CG2 3.43Å; N295-V307 HydrophobicContact CB-CB 3.94Å; N295-V307 WeakPolarHBondContact CB-O 3.48Å; N295-V307 PolarHBondContact ND2-O 2.97Å; N295-V307 PolarHBondContact O-N 3.01Å; V307-F311 HydrophobicContact CG1-CB 4.02Å; V307-F311 WeakPolarHBondContact CG1-O 3.29Å; V307-Y317 HydrophobicContact CG1-CD1 4.38Å; V307-H323 HydrophobicContact CB-CB 4.11Å; V307-H323 HydrophobicContact CG2-CB 3.78Å
308	P	97.5	Very high	96.9	Very high	37 Å²	37	55.6 Å²	55.6	24%	0.24	29%	0.286	C	S	.	.			trans	-76.1	164	-174.9	31.9	-37.1	0	0	0	111.5	V278 D306 F311 D312	V278-P308 HydrophobicContact CG2-CG 4.12Å; D306-P308 VanDerWaalsContact C-CD 3.46Å; D306-P308 VanDerWaalsContact O-CD 3.25Å; D306-P308 WeakPolarHBondContact O-CD 3.34Å; P308-F311 HydrophobicContact CG-CD2 4.4Å; P308-F311 WeakPolarHBondContact O-CA 3.43Å; P308-F311 WeakPolarHBondContact O-CB 3.25Å; P308-F311 PolarHBondContact O-N 3.31Å; P308-D312 PolarHBondContact O-N 2.84Å
309	Q	96.1	Very high	97	Very high	157 Å²	157	53.2 Å²	53.2	73%	0.734	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	142.3	167.8	-64.4	-166.2	-18.3	0	0	111.1	D312	Q309-D312 WeakPolarHBondContact CA-OD1 3.47Å; Q309-D312 WeakPolarHBondContact CG-OD1 3.41Å
310	P	97	Very high	97.2	Very high	64 Å²	64	51.9 Å²	51.9	42%	0.416	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.5	12.3	2.6	39	-37.4	0	0	0	113.8	D312 Q313 R316	P310-D312 VanDerWaalsContact C-OD1 3.24Å; P310-D312 WeakPolarHBondContact CA-OD1 3.41Å; P310-D312 PolarHBondContact O-N 3.35Å; P310-Q313 PolarHBondContact O-N 2.92Å; P310-R316 HydrophobicContact CB-CG 4.31Å; P310-R316 VanDerWaalsContact O-CB 3.22Å; P310-R316 WeakPolarHBondContact O-CB 3.14Å; P310-R316 WeakPolarHBondContact O-CG 3.29Å
311	F	98.4	Very high	97.4	Very high	55 Å²	55	51 Å²	51	24%	0.241	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-6.6	-176.1	-56.3	-56.4	0	0	0	113.5	I231 T235 V307 P308 Q313 Y317	I231-F311 HydrophobicContact CB-CD2 4.25Å; I231-F311 HydrophobicContact CB-CE2 4.33Å; I231-F311 HydrophobicContact CD1-CB 3.91Å; I231-F311 HydrophobicContact CD1-CD2 4.2Å; I231-F311 HydrophobicContact CD1-CG 4.17Å; I231-F311 HydrophobicContact CG2-CD1 4.06Å; I231-F311 HydrophobicContact CG2-CD2 3.82Å; I231-F311 HydrophobicContact CG2-CE1 3.99Å; I231-F311 HydrophobicContact CG2-CE2 3.74Å; I231-F311 HydrophobicContact CG2-CG 3.97Å; I231-F311 HydrophobicContact CG2-CZ 3.83Å; T235-F311 HydrophobicContact CG2-CE1 3.99Å; V307-F311 HydrophobicContact CG1-CB 4.02Å; V307-F311 WeakPolarHBondContact CG1-O 3.29Å; P308-F311 HydrophobicContact CG-CD2 4.4Å; P308-F311 WeakPolarHBondContact O-CA 3.43Å; P308-F311 WeakPolarHBondContact O-CB 3.25Å; P308-F311 PolarHBondContact O-N 3.31Å; F311-Q313 PolarHBondContact O-N 3.19Å; F311-Y317 HydrophobicContact CB-CG 4.18Å; F311-Y317 WeakPolarHBondContact O-CB 3.45Å
312	D	96.3	Very high	97.7	Very high	34 Å²	34	43.7 Å²	43.7	18%	0.182	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.1	164.1	67	-43.4	0	0	0	112.3	P308 Q309 P310 K324	P308-D312 PolarHBondContact O-N 2.84Å; Q309-D312 WeakPolarHBondContact CA-OD1 3.47Å; Q309-D312 WeakPolarHBondContact CG-OD1 3.41Å; P310-D312 VanDerWaalsContact C-OD1 3.24Å; P310-D312 WeakPolarHBondContact CA-OD1 3.41Å; P310-D312 PolarHBondContact O-N 3.35Å; D312-K324 VanDerWaalsContact O-CE 3.26Å; D312-K324 WeakPolarHBondContact O-CE 3.49Å; D312-K324 PolarHBondContact O-NZ 3.19Å
313	Q	97.9	Very high	98	Very high	84 Å²	84	39.2 Å²	39.2	39%	0.393	19%	0.194	S	C	.	.	S	Bend	trans	-97	129.9	178.7	-63	173.5	6.7	0	0	111.5	P310 F311 E315 R316 Y317	P310-Q313 PolarHBondContact O-N 2.92Å; F311-Q313 PolarHBondContact O-N 3.19Å; Q313-E315 PolarHBondContact O-N 3.04Å; Q313-E315 VanDerWaalsContact O-N 3.15Å; Q313-R316 HydrophobicContact CB-CB 4.4Å; Q313-R316 HydrophobicContact CB-CG 4.08Å; Q313-R316 WeakPolarHBondContact O-CA 3.5Å; Q313-R316 WeakPolarHBondContact O-CB 3.49Å; Q313-R316 PolarHBondContact O-N 3.1Å; Q313-Y317 PolarHBondContact O-N 3.22Å
314	T	97.2	Very high	98.1	Very high	32 Å²	32	39 Å²	39	20%	0.196	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.3	-177.5	39.3	0	0	0	0	113.9	V248 R316 Y317 L321	V248-T314 HydrophobicContact CB-CG2 4.38Å; V248-T314 HydrophobicContact CG1-CG2 4.41Å; V248-T314 HydrophobicContact CG2-CG2 4.07Å; T314-R316 PolarHBondContact O-N 2.76Å; T314-Y317 WeakPolarHBondContact CA-O 3.28Å; T314-L321 HydrophobicContact CG2-CD2 4.13Å
315	E	97.9	Very high	98.1	Very high	123 Å²	123	38.7 Å²	38.7	58%	0.575	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-10.5	175.8	-53.9	70.4	-146.9	0	0	112.4	L236 Q313	L236-E315 WeakPolarHBondContact CD2-O 3.28Å; Q313-E315 PolarHBondContact O-N 3.04Å; Q313-E315 VanDerWaalsContact O-N 3.15Å
316	R	98.4	Very high	98.1	Very high	145 Å²	145	39.8 Å²	39.8	55%	0.547	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-32.5	179.6	-58.8	-58.6	-172.8	177.4	0.6	112.1	T235 L236 P310 Q313 T314	T235-R316 VanDerWaalsContact CB-O 3.29Å; T235-R316 WeakPolarHBondContact CB-O 3.43Å; T235-R316 PolarHBondContact OG1-O 3.13Å; L236-R316 VanDerWaalsContact CD2-C 3.49Å; P310-R316 HydrophobicContact CB-CG 4.31Å; P310-R316 VanDerWaalsContact O-CB 3.22Å; P310-R316 WeakPolarHBondContact O-CB 3.14Å; P310-R316 WeakPolarHBondContact O-CG 3.29Å; Q313-R316 HydrophobicContact CB-CB 4.4Å; Q313-R316 HydrophobicContact CB-CG 4.08Å; Q313-R316 WeakPolarHBondContact O-CA 3.5Å; Q313-R316 WeakPolarHBondContact O-CB 3.49Å; Q313-R316 PolarHBondContact O-N 3.1Å; T314-R316 PolarHBondContact O-N 2.76Å
317	Y	98.7	Very high	98	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.			trans	-147	120.4	177.9	178.6	-100	0	0	0	110.9	I231 A232 T235 N276 V307 F311 Q313 T314 A319 S320 H323	I231-Y317 HydrophobicContact CD1-CD1 4.26Å; I231-Y317 HydrophobicContact CD1-CD2 3.9Å; I231-Y317 HydrophobicContact CD1-CE1 4.09Å; I231-Y317 HydrophobicContact CD1-CE2 3.71Å; I231-Y317 HydrophobicContact CD1-CG 4.18Å; I231-Y317 HydrophobicContact CG1-CD2 4.22Å; I231-Y317 HydrophobicContact CG1-CE2 3.72Å; I231-Y317 HydrophobicContact CG2-CD2 3.98Å; I231-Y317 HydrophobicContact CG2-CE2 4.11Å; A232-Y317 HydrophobicContact CB-CE2 4.37Å; T235-Y317 HydrophobicContact CG2-CD2 4.32Å; T235-Y317 WeakPolarHBondContact O-CA 3.14Å; N276-Y317 PolarHBondContact ND2-OH 3.14Å; V307-Y317 HydrophobicContact CG1-CD1 4.38Å; F311-Y317 HydrophobicContact CB-CG 4.18Å; F311-Y317 WeakPolarHBondContact O-CB 3.45Å; Q313-Y317 PolarHBondContact O-N 3.22Å; T314-Y317 WeakPolarHBondContact CA-O 3.28Å; Y317-A319 HydrophobicContact CD2-CB 4.25Å; Y317-A319 HydrophobicContact CE2-CB 3.65Å; Y317-S320 WeakPolarHBondContact CE1-O 3.38Å; Y317-S320 PolarHBondContact OH-N 2.75Å; Y317-S320 PolarHBondContact OH-OG 2.89Å; Y317-H323 AromaticContact CD1-CE1 3.87Å
318	C	98.6	Very high	97.9	Very high	26 Å²	26	41.1 Å²	41.1	18%	0.176	20%	0.204	C	C	.	.			trans	-138.6	17.3	173.2	63.9	0	0	0	0	112	T235 P238 S320 L321	T235-C318 PolarHBondContact O-N 3.2Å; P238-C318 WeakPolarHBondContact CA-O 3.21Å; C318-S320 PolarHBondContact O-N 2.72Å; C318-L321 HydrophobicContact CB-CD2 4.42Å
319	A	98.8	Very high	97.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-65.4	-30.2	175.9	0	0	0	0	0	112.4	T235 L237 D239 Y317 F343	T235-A319 PolarHBondContact O-N 2.84Å; T235-A319 VanDerWaalsContact O-N 3.12Å; L237-A319 VanDerWaalsContact O-CA 3.26Å; L237-A319 WeakPolarHBondContact O-CA 3.39Å; L237-A319 WeakPolarHBondContact O-CB 3.48Å; D239-A319 PolarHBondContact N-O 2.94Å; Y317-A319 HydrophobicContact CD2-CB 4.25Å; Y317-A319 HydrophobicContact CE2-CB 3.65Å; A319-F343 HydrophobicContact CB-CE1 4.27Å; A319-F343 HydrophobicContact CB-CZ 4.02Å; A319-F343 WeakPolarHBondContact O-CZ 3.04Å
320	S	98.9	Very high	97.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.193	C	C	.	.			trans	-147.2	155.7	165.8	73.2	0	0	0	0	111.1	E242 F274 N276 Y317 C318 H323	E242-S320 VanDerWaalsContact OE2-CA 3.26Å; E242-S320 WeakPolarHBondContact OE2-CA 3.32Å; F274-S320 VanDerWaalsContact O-CB 3.24Å; F274-S320 WeakPolarHBondContact O-CB 3.44Å; F274-S320 PolarHBondContact O-OG 3.48Å; N276-S320 WeakPolarHBondContact CB-OG 3.46Å; N276-S320 PolarHBondContact N-OG 2.85Å; Y317-S320 WeakPolarHBondContact CE1-O 3.38Å; Y317-S320 PolarHBondContact OH-N 2.75Å; Y317-S320 PolarHBondContact OH-OG 2.89Å; C318-S320 PolarHBondContact O-N 2.72Å; S320-H323 PolarHBondContact O-CE1 2.77Å
321	L	98.9	Very high	97.7	Very high	21 Å²	21	36.6 Å²	36.6	11%	0.11	18%	0.182	C	C	.	.			trans	-125.4	5.3	-169.3	-62.6	174.1	0	0	0	114.2	E242 V246 V248 L260 T314 C318 H323 K324	E242-L321 VanDerWaalsContact CD-N 3.31Å; E242-L321 PolarHBondContact OE1-N 2.84Å; E242-L321 WeakPolarHBondContact OE2-CB 3.33Å; E242-L321 WeakPolarHBondContact OE2-CG 3.4Å; E242-L321 PolarHBondContact OE2-N 3.48Å; V246-L321 HydrophobicContact CG2-CD1 4.35Å; V248-L321 HydrophobicContact CG2-CD1 4.25Å; V248-L321 HydrophobicContact CG2-CD2 4.03Å; L260-L321 HydrophobicContact CD1-CB 3.92Å; T314-L321 HydrophobicContact CG2-CD2 4.13Å; C318-L321 HydrophobicContact CB-CD2 4.42Å; L321-H323 PolarHBondContact O-N 2.8Å; L321-H323 VanDerWaalsContact O-N 3.15Å; L321-K324 WeakPolarHBondContact O-CB 3.43Å; L321-K324 PolarHBondContact O-N 2.82Å
322	G	98.7	Very high	97.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-55.8	-33.3	-178.9	0	0	0	0	0	114.2	F274 K324 A325 I349	F274-G322 VanDerWaalsContact O-CA 3.3Å; F274-G322 WeakPolarHBondContact O-CA 3.45Å; F274-G322 PolarHBondContact O-N 2.66Å; G322-K324 PolarHBondContact O-N 3.33Å; G322-A325 PolarHBondContact O-N 2.88Å; G322-I349 WeakPolarHBondContact O-CD1 3.39Å
323	H	98.6	Very high	97.9	Very high	8 Å²	8	32.7 Å²	32.7	4%	0.037	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-66.1	-5.2	176.7	69.8	-81.8	0	0	0	114.5	Y275 V307 Y317 S320 L321	Y275-H323 HydrophobicContact CE1-CB 3.98Å; Y275-H323 HydrophobicContact CE2-CB 4.08Å; V307-H323 HydrophobicContact CB-CB 4.11Å; V307-H323 HydrophobicContact CG2-CB 3.78Å; Y317-H323 AromaticContact CD1-CE1 3.87Å; S320-H323 PolarHBondContact O-CE1 2.77Å; L321-H323 PolarHBondContact O-N 2.8Å; L321-H323 VanDerWaalsContact O-N 3.15Å
324	K	98.7	Very high	97.9	Very high	25 Å²	25	32.3 Å²	32.3	11%	0.109	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-94.3	-6.9	176.4	-64.1	-66.5	-176.1	179	0	114.1	V248 G259 L260 D312 L321 G322 N326	V248-K324 HydrophobicContact CG1-CD 4.25Å; V248-K324 HydrophobicContact CG1-CG 4.31Å; V248-K324 HydrophobicContact CG2-CB 4.06Å; V248-K324 HydrophobicContact CG2-CG 3.82Å; G259-K324 CarbonylContact C-O 3.58Å; G259-K324 WeakPolarHBondContact CA-O 3.33Å; L260-K324 HydrophobicContact CB-CB 4.25Å; L260-K324 HydrophobicContact CD1-CB 4.33Å; L260-K324 PolarHBondContact N-O 3.28Å; L260-K324 VanDerWaalsContact N-O 3.08Å; D312-K324 VanDerWaalsContact O-CE 3.26Å; D312-K324 WeakPolarHBondContact O-CE 3.49Å; D312-K324 PolarHBondContact O-NZ 3.19Å; L321-K324 WeakPolarHBondContact O-CB 3.43Å; L321-K324 PolarHBondContact O-N 2.82Å; G322-K324 PolarHBondContact O-N 3.33Å; K324-N326 PolarHBondContact O-N 2.93Å
325	A	98.6	Very high	97.9	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-76.4	122.7	175.4	0	0	0	0	0	110.1	L260 G322 I349 V363 Y365	L260-A325 HydrophobicContact CB-CB 4.17Å; L260-A325 HydrophobicContact CD2-CB 4.15Å; G322-A325 PolarHBondContact O-N 2.88Å; A325-I349 HydrophobicContact CB-CD1 3.29Å; A325-V363 HydrophobicContact CB-CG2 4.27Å; A325-Y365 PolarHBondContact O-OH 3.25Å
326	N	98.3	Very high	97.9	Very high	22 Å²	22	29.6 Å²	29.6	12%	0.118	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	163.2	-179.3	-75.7	-49.5	0	0	0	112.4	S251 I253 Q258 G259 K324 E360 T362 V363	S251-N326 WeakPolarHBondContact CB-ND2 3.3Å; S251-N326 PolarHBondContact OG-ND2 3.11Å; S251-N326 VanDerWaalsContact OG-ND2 3.14Å; I253-N326 HydrophobicContact CD1-CB 3.83Å; Q258-N326 PolarHBondContact O-ND2 3Å; G259-N326 WeakPolarHBondContact CA-ND2 3.24Å; K324-N326 PolarHBondContact O-N 2.93Å; N326-E360 PolarHBondContact ND2-OE1 2.86Å; N326-E360 VanDerWaalsContact ND2-OE1 3.15Å; N326-T362 VanDerWaalsContact O-CA 3.25Å; N326-T362 WeakPolarHBondContact O-CA 3.3Å; N326-V363 PolarHBondContact O-N 2.88Å
327	H	96.6	Very high	97.9	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.028	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	144.2	171.8	179.3	54.8	0	0	0	112.6	I253 F329 V363 Y365 W382 Y383 E386	I253-H327 WeakPolarHBondContact CD1-O 3.33Å; H327-F329 AromaticContact NE2-CD1 3.73Å; H327-F329 AromaticContact NE2-CD2 3.5Å; H327-F329 AromaticContact NE2-CE1 3.6Å; H327-F329 AromaticContact NE2-CE2 3.35Å; H327-F329 WeakPolarHBondContact NE2-CE2 3.35Å; H327-F329 AromaticContact NE2-CG 3.67Å; H327-F329 AromaticContact NE2-CZ 3.4Å; H327-F329 WeakPolarHBondContact NE2-CZ 3.25Å; H327-V363 CarbonylContact C-O 3.37Å; H327-V363 VanDerWaalsContact CA-O 3.23Å; H327-V363 WeakPolarHBondContact CA-O 3.47Å; H327-V363 PolarHBondContact ND1-O 3.01Å; H327-Y365 HydrophobicContact CB-CD1 3.83Å; H327-Y365 HydrophobicContact CB-CD2 3.98Å; H327-Y365 HydrophobicContact CB-CE1 3.84Å; H327-Y365 HydrophobicContact CB-CE2 4Å; H327-Y365 HydrophobicContact CB-CG 3.89Å; H327-Y365 AromaticContact ND1-CG 3.95Å; H327-Y365 PolarHBondContact ND1-N 2.83Å; H327-Y365 VanDerWaalsContact ND1-N 3.18Å; H327-W382 HydrophobicContact CB-CH2 3.54Å; H327-W382 HydrophobicContact CB-CZ3 3.77Å; H327-W382 AromaticContact CD2-CZ3 3.78Å; H327-Y383 AromaticContact CD2-CD2 3.61Å; H327-Y383 AromaticContact CD2-CE2 3.71Å; H327-Y383 AromaticContact CE1-CE2 3.45Å; H327-Y383 VanDerWaalsContact CE1-CE2 3.45Å; H327-Y383 WeakPolarHBondContact CE1-CE2 3.3Å; H327-Y383 AromaticContact ND1-CE2 3.88Å; H327-Y383 AromaticContact NE2-CD2 3.7Å; H327-Y383 AromaticContact NE2-CE2 3.33Å; H327-Y383 VanDerWaalsContact NE2-CE2 3.33Å; H327-Y383 WeakPolarHBondContact NE2-CE2 3.39Å; H327-E386 IonicContact CD2-OE2 2.77Å
328	S	95.8	Very high	97.9	Very high	25 Å²	25	27.7 Å²	27.7	18%	0.175	15%	0.151	C	C	.	.			trans	-148	145.3	157	-175	0	0	0	0	110.9	T330 P331 V363	S328-T330 VanDerWaalsContact C-N 3.25Å; S328-T330 PolarHBondContact OG-N 2.83Å; S328-T330 VanDerWaalsContact OG-N 3.15Å; S328-P331 WeakPolarHBondContact O-CD 3.44Å; S328-V363 PolarHBondContact N-O 2.98Å
329	F	94.2	Very high	97.9	Very high	42 Å²	42	28.8 Å²	28.8	18%	0.184	16%	0.155	C	C	.	.	S	Bend	trans	-75.3	-11.4	168.1	-69.6	-69.8	0	0	0	113.7	H327 P331 Y383 E386 L387 F390	H327-F329 AromaticContact NE2-CD1 3.73Å; H327-F329 AromaticContact NE2-CD2 3.5Å; H327-F329 AromaticContact NE2-CE1 3.6Å; H327-F329 AromaticContact NE2-CE2 3.35Å; H327-F329 WeakPolarHBondContact NE2-CE2 3.35Å; H327-F329 AromaticContact NE2-CG 3.67Å; H327-F329 AromaticContact NE2-CZ 3.4Å; H327-F329 WeakPolarHBondContact NE2-CZ 3.25Å; F329-P331 WeakPolarHBondContact O-CD 3.3Å; F329-Y383 HydrophobicContact CE1-CE1 4.25Å; F329-Y383 AromaticContact CE1-CE2 3.95Å; F329-Y383 HydrophobicContact CE1-CE2 3.95Å; F329-Y383 AromaticContact CE1-CZ 3.66Å; F329-Y383 HydrophobicContact CZ-CD1 4.25Å; F329-Y383 HydrophobicContact CZ-CD2 4.05Å; F329-Y383 AromaticContact CZ-CE1 3.89Å; F329-Y383 HydrophobicContact CZ-CE1 3.89Å; F329-Y383 AromaticContact CZ-CE2 3.65Å; F329-Y383 HydrophobicContact CZ-CE2 3.65Å; F329-Y383 HydrophobicContact CZ-CG 4.35Å; F329-Y383 AromaticContact CZ-CZ 3.57Å; F329-E386 HydrophobicContact CD2-CB 4.35Å; F329-E386 HydrophobicContact CE2-CB 3.81Å; F329-L387 HydrophobicContact CD1-CD1 4.33Å; F329-L387 HydrophobicContact CE1-CB 4.44Å; F329-L387 HydrophobicContact CE1-CD1 3.65Å; F329-L387 HydrophobicContact CE2-CB 4.04Å; F329-L387 HydrophobicContact CE2-CD1 4.5Å; F329-L387 HydrophobicContact CZ-CB 3.66Å; F329-L387 HydrophobicContact CZ-CD1 3.76Å; F329-L387 HydrophobicContact CZ-CG 4.28Å; F329-F390 HydrophobicContact CB-CB 4.39Å; F329-F390 HydrophobicContact CB-CD1 3.95Å; F329-F390 HydrophobicContact CB-CD2 3.74Å; F329-F390 HydrophobicContact CB-CE1 4.12Å; F329-F390 HydrophobicContact CB-CE2 3.93Å; F329-F390 HydrophobicContact CB-CG 3.75Å; F329-F390 HydrophobicContact CB-CZ 4.11Å; F329-F390 HydrophobicContact CD1-CD1 4.43Å; F329-F390 HydrophobicContact CD2-CB 4.06Å; F329-F390 HydrophobicContact CD2-CG 4.31Å; F329-F390 HydrophobicContact CG-CB 4.28Å; F329-F390 HydrophobicContact CG-CD1 4.11Å; F329-F390 HydrophobicContact CG-CD2 4.5Å; F329-F390 HydrophobicContact CG-CG 4.04Å
330	T	95.1	Very high	97.9	Very high	94 Å²	94	28.9 Å²	28.9	58%	0.577	16%	0.155	S	C	*	.	S	Bend	trans	-124.3	59.3	172.4	57	0	0	0	0	110.4	S328 F390	S328-T330 VanDerWaalsContact C-N 3.25Å; S328-T330 PolarHBondContact OG-N 2.83Å; S328-T330 VanDerWaalsContact OG-N 3.15Å; T330-F390 HydrophobicContact CG2-CE2 3.74Å; T330-F390 HydrophobicContact CG2-CZ 4.44Å
331	P	97.9	Very high	97.8	Very high	26 Å²	26	29.6 Å²	29.6	17%	0.169	16%	0.16	C	C	.	.			trans	-68.4	159.3	-168	32.5	-37.7	0	0	0	112.1	S328 F329 C333 L352 T362 A364	S328-P331 WeakPolarHBondContact O-CD 3.44Å; F329-P331 WeakPolarHBondContact O-CD 3.3Å; P331-C333 WeakPolarHBondContact CB-O 3.12Å; P331-L352 HydrophobicContact CG-CD1 4.19Å; P331-T362 VanDerWaalsContact CB-O 3.3Å; P331-T362 WeakPolarHBondContact CB-O 3.23Å; P331-A364 HydrophobicContact CG-CB 4.14Å
332	N	98.6	Very high	97.8	Very high	6 Å²	6	28.8 Å²	28.8	3%	0.032	16%	0.155	C	C	.	.	S	Bend	trans	-103.4	-7	170.1	57.1	2.9	0	0	0	113	L352 K353 V355 E359 E360 L361 T362	N332-L352 PolarHBondContact O-N 2.89Å; N332-K353 HydrophobicContact CB-CD 4.39Å; N332-K353 HydrophobicContact CB-CG 4.13Å; N332-V355 HydrophobicContact CB-CG1 4.07Å; N332-E359 PolarHBondContact ND2-OE1 3.16Å; N332-E360 PolarHBondContact ND2-O 3.32Å; N332-L361 WeakPolarHBondContact OD1-CA 3.07Å; N332-T362 PolarHBondContact N-O 3.47Å; N332-T362 PolarHBondContact OD1-N 3.46Å; N332-T362 PolarHBondContact OD1-O 3.16Å; N332-T362 PolarHBondContact OD1-OG1 3.46Å
333	C	98.8	Very high	97.8	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	169.3	175.5	-62.2	0	0	0	0	111.8	P331 I349 R350 L352 T362 V363	P331-C333 WeakPolarHBondContact CB-O 3.12Å; C333-I349 HydrophobicContact CB-CG2 3.45Å; C333-I349 VanDerWaalsContact CB-CG2 3.45Å; C333-R350 CarbonylContact C-O 3.59Å; C333-R350 WeakPolarHBondContact CA-O 3.36Å; C333-R350 WeakPolarHBondContact CB-O 3.17Å; C333-L352 WeakPolarHBondContact O-CD1 3.46Å; C333-T362 WeakPolarHBondContact CB-O 3.26Å; C333-T362 PolarHBondContact N-O 2.96Å; C333-V363 HydrophobicContact CB-CG1 3.78Å
334	Q	98.4	Very high	97.8	Very high	77 Å²	77	28.4 Å²	28.4	36%	0.36	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	161.9	171.3	65.5	-179.3	2.7	0	0	111	E336 I349 R350 L352	Q334-E336 HydrophobicContact CG-CG 4.22Å; Q334-E336 PolarHBondContact NE2-OE1 2.9Å; Q334-I349 WeakPolarHBondContact O-CA 3.47Å; Q334-R350 PolarHBondContact N-O 3.2Å; Q334-R350 PolarHBondContact O-N 3.32Å; Q334-L352 HydrophobicContact CB-CD1 4.29Å; Q334-L352 HydrophobicContact CB-CD2 4.07Å; Q334-L352 HydrophobicContact CB-CG 4.11Å; Q334-L352 HydrophobicContact CG-CD2 3.78Å; Q334-L352 HydrophobicContact CG-CG 4.14Å; Q334-L352 VanDerWaalsContact OE1-CD2 3.3Å
335	Y	98.4	Very high	97.8	Very high	47 Å²	47	28.8 Å²	28.8	18%	0.184	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.7	169.1	-64.2	-56.3	0	0	0	110.8	Y275 I297 C348 I349 V363	Y275-Y335 HydrophobicContact CD2-CD1 4.4Å; Y275-Y335 AromaticContact CD2-CE1 3.62Å; Y275-Y335 HydrophobicContact CD2-CE1 3.62Å; Y275-Y335 HydrophobicContact CE2-CE1 4.07Å; Y275-Y335 AromaticContact CE2-CZ 4Å; I297-Y335 HydrophobicContact CD1-CD1 3.82Å; I297-Y335 HydrophobicContact CD1-CD2 3.45Å; I297-Y335 VanDerWaalsContact CD1-CD2 3.45Å; I297-Y335 HydrophobicContact CD1-CE1 4.03Å; I297-Y335 HydrophobicContact CD1-CE2 3.65Å; I297-Y335 HydrophobicContact CD1-CG 3.51Å; Y335-C348 VanDerWaalsContact CA-O 3.29Å; Y335-C348 WeakPolarHBondContact CA-O 3.45Å; Y335-I349 HydrophobicContact CD1-CG1 3.96Å; Y335-I349 HydrophobicContact CE1-CD1 4.11Å; Y335-I349 HydrophobicContact CE1-CG1 3.78Å; Y335-V363 HydrophobicContact CD2-CG2 4.48Å; Y335-V363 HydrophobicContact CE1-CG1 4.32Å; Y335-V363 HydrophobicContact CE1-CG2 4.11Å; Y335-V363 HydrophobicContact CE2-CB 4.14Å; Y335-V363 HydrophobicContact CE2-CG2 3.65Å; Y335-V363 VanDerWaalsContact CZ-CG2 3.45Å; Y335-V363 WeakPolarHBondContact OH-CG2 3.43Å
336	E	97.8	Very high	97.8	Very high	50 Å²	50	28.9 Å²	28.9	23%	0.234	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.4	173.2	-76	-176.2	-164.7	0	0	111.3	Q334 K347 C348 R350	Q334-E336 HydrophobicContact CG-CG 4.22Å; Q334-E336 PolarHBondContact NE2-OE1 2.9Å; E336-K347 CarbonylContact O-C 3.51Å; E336-K347 VanDerWaalsContact O-CA 3.23Å; E336-K347 WeakPolarHBondContact O-CA 3.29Å; E336-C348 PolarHBondContact N-O 2.89Å; E336-C348 PolarHBondContact O-N 3.42Å; E336-R350 WeakPolarHBondContact OE1-CD 3.45Å; E336-R350 IonicContact OE1-NE 3.74Å; E336-R350 WeakPolarHBondContact OE2-CD 3.15Å; E336-R350 IonicContact OE2-CZ 3.56Å; E336-R350 IonicContact OE2-NE 3.72Å; E336-R350 PolarHBondContact OE2-NE 2.81Å; E336-R350 IonicContact OE2-NH2 3.57Å
337	P	97.9	Very high	97.8	Very high	100 Å²	100	29.8 Å²	29.8	65%	0.649	16%	0.162	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-55.5	145.1	169.6	-22.6	33.9	0	0	0	112.1
338	F	98.5	Very high	97.9	Very high	5 Å²	5	29.5 Å²	29.5	2%	0.022	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	131	177.9	-165.8	-85.6	0	0	0	110.7	D155 Y176 P179 V271 F274 H340 I346 C348	D155-F338 HydrophobicContact CB-CD2 3.48Å; D155-F338 VanDerWaalsContact CB-CD2 3.48Å; D155-F338 HydrophobicContact CB-CE2 3.75Å; D155-F338 HydrophobicContact CB-CG 4.2Å; Y176-F338 WeakPolarHBondContact OH-CE1 3.28Å; Y176-F338 VanDerWaalsContact OH-CZ 3.28Å; Y176-F338 WeakPolarHBondContact OH-CZ 3.36Å; P179-F338 HydrophobicContact CG-CE2 3.77Å; P179-F338 HydrophobicContact CG-CZ 4.07Å; V271-F338 HydrophobicContact CG1-CD2 4.42Å; V271-F338 HydrophobicContact CG1-CE2 4.23Å; V271-F338 HydrophobicContact CG2-CD2 4.44Å; V271-F338 HydrophobicContact CG2-CE2 4.17Å; F274-F338 AromaticContact CD1-CD1 3.95Å; F274-F338 HydrophobicContact CD1-CD1 3.95Å; F274-F338 HydrophobicContact CD1-CE1 4.09Å; F274-F338 HydrophobicContact CD1-CG 4.24Å; F274-F338 AromaticContact CE1-CD1 3.71Å; F274-F338 HydrophobicContact CE1-CD1 3.71Å; F274-F338 HydrophobicContact CE1-CD2 4.06Å; F274-F338 AromaticContact CE1-CE1 3.41Å; F274-F338 HydrophobicContact CE1-CE1 3.41Å; F274-F338 VanDerWaalsContact CE1-CE1 3.41Å; F274-F338 AromaticContact CE1-CE2 3.82Å; F274-F338 HydrophobicContact CE1-CE2 3.82Å; F274-F338 HydrophobicContact CE1-CG 4.04Å; F274-F338 AromaticContact CE1-CZ 3.49Å; F274-F338 HydrophobicContact CE1-CZ 3.49Å; F274-F338 VanDerWaalsContact CE1-CZ 3.49Å; F274-F338 HydrophobicContact CZ-CE1 4.08Å; F274-F338 HydrophobicContact CZ-CZ 4.02Å; F338-H340 HydrophobicContact CD1-CB 3.89Å; F338-H340 HydrophobicContact CE1-CB 4.07Å; F338-H340 AromaticContact CE1-CD2 3.69Å; F338-H340 PolarHBondContact O-N 2.89Å; F338-I346 HydrophobicContact CB-CG1 4.37Å; F338-I346 PolarHBondContact N-O 2.77Å; F338-I346 PolarHBondContact O-N 2.81Å; F338-C348 HydrophobicContact CB-CB 3.74Å; F338-C348 HydrophobicContact CD2-CB 3.9Å; F338-C348 HydrophobicContact CG-CB 3.96Å
339	L	97.8	Very high	98	Very high	50 Å²	50	28.3 Å²	28.3	26%	0.262	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	95.7	172.7	-174.8	62.6	0	0	0	109.6	Y153 D155 P345	Y153-L339 HydrophobicContact CD1-CD2 3.71Å; Y153-L339 HydrophobicContact CE1-CD2 3.48Å; Y153-L339 VanDerWaalsContact CE1-CD2 3.48Å; Y153-L339 HydrophobicContact CE2-CD2 4.3Å; Y153-L339 HydrophobicContact CG-CD2 4.22Å; D155-L339 PolarHBondContact OD2-N 2.81Å; L339-P345 HydrophobicContact CD1-CG 3.96Å
340	H	98.8	Very high	98.3	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.1	-177.2	-161.3	-87.4	0	0	0	111.4	Y178 D239 F274 F338 R342 F343 G344 I346	Y178-H340 AromaticContact CE1-NE2 3.75Å; D239-H340 IonicContact OD2-CE1 3.19Å; D239-H340 PolarHBondContact OD2-CE1 2.66Å; D239-H340 IonicContact OD2-NE2 2.98Å; D239-H340 PolarHBondContact OD2-NE2 2.99Å; F274-H340 AromaticContact CD1-CD2 3.79Å; F274-H340 AromaticContact CD2-CD2 3.83Å; F274-H340 AromaticContact CD2-NE2 3.64Å; F274-H340 AromaticContact CE1-CD2 3.81Å; F274-H340 AromaticContact CE2-CD2 3.84Å; F274-H340 AromaticContact CE2-NE2 3.54Å; F274-H340 AromaticContact CG-CD2 3.81Å; F274-H340 AromaticContact CZ-CD2 3.83Å; F274-H340 AromaticContact CZ-NE2 3.92Å; F338-H340 HydrophobicContact CD1-CB 3.89Å; F338-H340 HydrophobicContact CE1-CB 4.07Å; F338-H340 AromaticContact CE1-CD2 3.69Å; F338-H340 PolarHBondContact O-N 2.89Å; H340-R342 WeakPolarHBondContact ND1-CB 3.17Å; H340-R342 PolarHBondContact ND1-N 3.04Å; H340-R342 VanDerWaalsContact ND1-N 3.15Å; H340-R342 PolarHBondContact O-N 3Å; H340-R342 VanDerWaalsContact O-N 3.15Å; H340-F343 HydrophobicContact CB-CB 3.99Å; H340-F343 HydrophobicContact CB-CD2 4.14Å; H340-F343 AromaticContact CE1-CD2 3.6Å; H340-F343 AromaticContact CE1-CE2 3.66Å; H340-F343 AromaticContact CG-CD2 3.52Å; H340-F343 AromaticContact ND1-CD2 3.22Å; H340-F343 WeakPolarHBondContact ND1-CD2 3.19Å; H340-F343 AromaticContact ND1-CE2 3.78Å; H340-F343 AromaticContact ND1-CG 3.82Å; H340-F343 PolarHBondContact ND1-N 3.3Å; H340-F343 PolarHBondContact O-N 3.19Å; H340-G344 PolarHBondContact N-O 2.86Å; H340-G344 WeakPolarHBondContact O-CA 3.42Å; H340-G344 PolarHBondContact O-N 3.3Å; H340-I346 HydrophobicContact CB-CD1 3.81Å; H340-I346 HydrophobicContact CB-CG1 4.02Å
341	P	98.1	Very high	98.4	Very high	14 Å²	14	23.4 Å²	23.4	9%	0.091	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-21.1	-176.4	32	-41.6	0	0	0	113.2	Y176 L185 I194	Y176-P341 HydrophobicContact CD1-CB 4.03Å; Y176-P341 HydrophobicContact CD1-CG 3.48Å; Y176-P341 VanDerWaalsContact CD1-CG 3.48Å; Y176-P341 HydrophobicContact CD2-CB 3.74Å; Y176-P341 HydrophobicContact CD2-CG 4Å; Y176-P341 HydrophobicContact CE1-CB 4.43Å; Y176-P341 HydrophobicContact CE1-CG 3.63Å; Y176-P341 HydrophobicContact CE2-CB 4.17Å; Y176-P341 HydrophobicContact CE2-CG 4.14Å; Y176-P341 HydrophobicContact CG-CB 3.64Å; Y176-P341 HydrophobicContact CG-CG 3.66Å; Y176-P341 VanDerWaalsContact CZ-CD 3.49Å; L185-P341 HydrophobicContact CD1-CB 4.5Å; L185-P341 HydrophobicContact CD1-CG 3.88Å; I194-P341 HydrophobicContact CD1-CB 3.64Å; I194-P341 HydrophobicContact CD1-CG 4.37Å; I194-P341 HydrophobicContact CG1-CB 4.21Å
342	R	98.6	Very high	98.5	Very high	4 Å²	4	26 Å²	26	2%	0.015	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-44.9	172.5	177.4	-179.5	175.5	-167.3	-3	113.2	S222 D224 K225 H234 L237 H340	S222-R342 WeakPolarHBondContact O-CG 3.22Å; D224-R342 CarbonylContact C-O 3.41Å; D224-R342 WeakPolarHBondContact CA-O 3.47Å; D224-R342 HydrophobicContact CB-CG 4.03Å; D224-R342 PolarHBondContact N-O 3.34Å; D224-R342 IonicContact OD2-NE 3.79Å; D224-R342 IonicContact OD2-NH2 3.35Å; K225-R342 PolarHBondContact N-O 3.19Å; H234-R342 PolarHBondContact O-NH2 2.81Å; L237-R342 PolarHBondContact O-NH1 3.03Å; H340-R342 WeakPolarHBondContact ND1-CB 3.17Å; H340-R342 PolarHBondContact ND1-N 3.04Å; H340-R342 VanDerWaalsContact ND1-N 3.15Å; H340-R342 PolarHBondContact O-N 3Å; H340-R342 VanDerWaalsContact O-N 3.15Å
343	F	98.8	Very high	98.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-7.1	-166.9	-54.8	-56.8	0	0	0	113.3	N276 R279 A319 H340 I346	N276-F343 HydrophobicContact CB-CB 4.13Å; N276-F343 HydrophobicContact CB-CD1 4.06Å; N276-F343 HydrophobicContact CB-CD2 3.98Å; N276-F343 HydrophobicContact CB-CE1 4.48Å; N276-F343 HydrophobicContact CB-CE2 4.42Å; N276-F343 HydrophobicContact CB-CG 3.8Å; N276-F343 WeakPolarHBondContact ND2-CD1 3.41Å; R279-F343 PolarHBondContact NH2-O 3.47Å; A319-F343 HydrophobicContact CB-CE1 4.27Å; A319-F343 HydrophobicContact CB-CZ 4.02Å; A319-F343 WeakPolarHBondContact O-CZ 3.04Å; H340-F343 HydrophobicContact CB-CB 3.99Å; H340-F343 HydrophobicContact CB-CD2 4.14Å; H340-F343 AromaticContact CE1-CD2 3.6Å; H340-F343 AromaticContact CE1-CE2 3.66Å; H340-F343 AromaticContact CG-CD2 3.52Å; H340-F343 AromaticContact ND1-CD2 3.22Å; H340-F343 WeakPolarHBondContact ND1-CD2 3.19Å; H340-F343 AromaticContact ND1-CE2 3.78Å; H340-F343 AromaticContact ND1-CG 3.82Å; H340-F343 PolarHBondContact ND1-N 3.3Å; H340-F343 PolarHBondContact O-N 3.19Å; F343-I346 HydrophobicContact CB-CD1 4.1Å; F343-I346 HydrophobicContact CB-CG2 3.86Å; F343-I346 HydrophobicContact CD2-CD1 3.99Å; F343-I346 HydrophobicContact CG-CD1 4.48Å
344	G	98.2	Very high	98.4	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.6	-153.7	-170.7	0	0	0	0	0	112.1	H340 I346	H340-G344 PolarHBondContact N-O 2.86Å; H340-G344 WeakPolarHBondContact O-CA 3.42Å; H340-G344 PolarHBondContact O-N 3.3Å; G344-I346 PolarHBondContact O-N 3.05Å
345	P	98.2	Very high	98.4	Very high	33 Å²	33	29.5 Å²	29.5	21%	0.214	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	118.2	177.2	-20.6	32.2	0	0	0	111	R279 L339	R279-P345 VanDerWaalsContact CZ-O 3.3Å; R279-P345 PolarHBondContact NH1-O 2.77Å; R279-P345 PolarHBondContact NH2-O 2.85Å; L339-P345 HydrophobicContact CD1-CG 3.96Å
346	I	98.7	Very high	98.4	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	-170.5	178.5	59.2	165.1	0	0	0	109.6	F274 N276 I305 F338 H340 F343 G344	F274-I346 HydrophobicContact CB-CD1 3.86Å; F274-I346 HydrophobicContact CD1-CD1 4.39Å; F274-I346 HydrophobicContact CG-CD1 4.42Å; N276-I346 HydrophobicContact CB-CD1 4.39Å; N276-I346 HydrophobicContact CB-CG2 4.3Å; I305-I346 HydrophobicContact CD1-CB 4.17Å; I305-I346 HydrophobicContact CD1-CG2 4.17Å; F338-I346 HydrophobicContact CB-CG1 4.37Å; F338-I346 PolarHBondContact N-O 2.77Å; F338-I346 PolarHBondContact O-N 2.81Å; H340-I346 HydrophobicContact CB-CD1 3.81Å; H340-I346 HydrophobicContact CB-CG1 4.02Å; F343-I346 HydrophobicContact CB-CD1 4.1Å; F343-I346 HydrophobicContact CB-CG2 3.86Å; F343-I346 HydrophobicContact CD2-CD1 3.99Å; F343-I346 HydrophobicContact CG-CD1 4.48Å; G344-I346 PolarHBondContact O-N 3.05Å
347	K	98.6	Very high	98.4	Very high	42 Å²	42	36 Å²	36	18%	0.183	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	158.2	164.9	-72.1	-175.3	165.5	-178.3	0	111	Y275 I297 S298 L299 E336	Y275-K347 WeakPolarHBondContact CA-O 3.33Å; Y275-K347 PolarHBondContact N-O 2.79Å; I297-K347 HydrophobicContact CD1-CB 4.38Å; I297-K347 HydrophobicContact CD1-CD 3.44Å; I297-K347 VanDerWaalsContact CD1-CD 3.44Å; I297-K347 HydrophobicContact CD1-CG 4.49Å; I297-K347 HydrophobicContact CG1-CD 3.87Å; S298-K347 WeakPolarHBondContact O-CD 3.5Å; S298-K347 WeakPolarHBondContact O-CE 3.39Å; S298-K347 PolarHBondContact O-NZ 3.02Å; L299-K347 HydrophobicContact CD1-CG 4.32Å; E336-K347 CarbonylContact O-C 3.51Å; E336-K347 VanDerWaalsContact O-CA 3.23Å; E336-K347 WeakPolarHBondContact O-CA 3.29Å
348	C	98.8	Very high	98.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	167	170.1	73	0	0	0	0	110.6	V271 A273 F274 Y335 E336 F338	V271-C348 HydrophobicContact CG1-CB 3.89Å; A273-C348 CarbonylContact O-C 3.49Å; A273-C348 VanDerWaalsContact O-CA 3.27Å; A273-C348 WeakPolarHBondContact O-CA 3.46Å; A273-C348 WeakPolarHBondContact O-CB 3.49Å; F274-C348 HydrophobicContact CD1-CB 4.03Å; F274-C348 HydrophobicContact CE1-CB 4.42Å; Y335-C348 VanDerWaalsContact CA-O 3.29Å; Y335-C348 WeakPolarHBondContact CA-O 3.45Å; E336-C348 PolarHBondContact N-O 2.89Å; E336-C348 PolarHBondContact O-N 3.42Å; F338-C348 HydrophobicContact CB-CB 3.74Å; F338-C348 HydrophobicContact CD2-CB 3.9Å; F338-C348 HydrophobicContact CG-CB 3.96Å
349	I	98.8	Very high	98.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.1	169.3	-62.4	-175.2	0	0	0	107.7	L260 M272 A273 G322 A325 C333 Q334 Y335 V363	L260-I349 HydrophobicContact CD2-CD1 3.92Å; M272-I349 PolarHBondContact N-O 2.81Å; A273-I349 HydrophobicContact CB-CB 4.28Å; A273-I349 HydrophobicContact CB-CD1 4.34Å; A273-I349 HydrophobicContact CB-CG1 4.49Å; A273-I349 PolarHBondContact O-N 3.09Å; G322-I349 WeakPolarHBondContact O-CD1 3.39Å; A325-I349 HydrophobicContact CB-CD1 3.29Å; C333-I349 HydrophobicContact CB-CG2 3.45Å; C333-I349 VanDerWaalsContact CB-CG2 3.45Å; Q334-I349 WeakPolarHBondContact O-CA 3.47Å; Y335-I349 HydrophobicContact CD1-CG1 3.96Å; Y335-I349 HydrophobicContact CE1-CD1 4.11Å; Y335-I349 HydrophobicContact CE1-CG1 3.78Å; I349-V363 HydrophobicContact CG2-CG1 4.13Å
350	R	98.8	Very high	98.5	Very high	30 Å²	30	36.5 Å²	36.5	11%	0.113	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.5	176.9	-169.7	179.2	-61.1	-91.3	2.5	110.8	D155 G269 T270 V271 C333 Q334 E336	D155-R350 PolarHBondContact O-NH2 2.81Å; G269-R350 VanDerWaalsContact C-CG 3.47Å; G269-R350 WeakPolarHBondContact O-CD 3.42Å; G269-R350 PolarHBondContact O-NH1 2.9Å; T270-R350 CarbonylContact O-C 3.51Å; T270-R350 VanDerWaalsContact O-CA 3.32Å; T270-R350 WeakPolarHBondContact O-CA 3.47Å; V271-R350 VanDerWaalsContact CG2-NH1 3.31Å; V271-R350 VanDerWaalsContact CG2-NH2 3.32Å; C333-R350 CarbonylContact C-O 3.59Å; C333-R350 WeakPolarHBondContact CA-O 3.36Å; C333-R350 WeakPolarHBondContact CB-O 3.17Å; Q334-R350 PolarHBondContact N-O 3.2Å; Q334-R350 PolarHBondContact O-N 3.32Å; E336-R350 WeakPolarHBondContact OE1-CD 3.45Å; E336-R350 IonicContact OE1-NE 3.74Å; E336-R350 WeakPolarHBondContact OE2-CD 3.15Å; E336-R350 IonicContact OE2-CZ 3.56Å; E336-R350 IonicContact OE2-NE 3.72Å; E336-R350 PolarHBondContact OE2-NE 2.81Å; E336-R350 IonicContact OE2-NH2 3.57Å
351	T	98.8	Very high	98.5	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.5	177.7	58.2	0	0	0	0	111.8	A266 G267 G269 T270 M272 K353 V355	A266-T351 HydrophobicContact CB-CG2 4.45Å; G267-T351 PolarHBondContact O-OG1 2.87Å; G269-T351 PolarHBondContact N-O 3.22Å; G269-T351 PolarHBondContact N-OG1 3.32Å; G269-T351 VanDerWaalsContact N-OG1 3.16Å; T270-T351 PolarHBondContact N-OG1 3.4Å; T270-T351 PolarHBondContact O-N 3.11Å; T270-T351 PolarHBondContact O-OG1 3.39Å; M272-T351 HydrophobicContact CG-CG2 3.51Å; M272-T351 HydrophobicContact SD-CG2 3.81Å; T351-K353 WeakPolarHBondContact CB-O 3.35Å; T351-V355 HydrophobicContact CG2-CG1 4.09Å; T351-V355 HydrophobicContact CG2-CG2 3.87Å
352	L	98.3	Very high	98.5	Very high	80 Å²	80	36.4 Å²	36.4	42%	0.419	18%	0.183	S	C	.	.	S	Bend	trans	-82.1	-30.6	171.4	-74.1	172	0	0	0	111.9	P331 N332 C333 Q334	P331-L352 HydrophobicContact CG-CD1 4.19Å; N332-L352 PolarHBondContact O-N 2.89Å; C333-L352 WeakPolarHBondContact O-CD1 3.46Å; Q334-L352 HydrophobicContact CB-CD1 4.29Å; Q334-L352 HydrophobicContact CB-CD2 4.07Å; Q334-L352 HydrophobicContact CB-CG 4.11Å; Q334-L352 HydrophobicContact CG-CD2 3.78Å; Q334-L352 HydrophobicContact CG-CG 4.14Å; Q334-L352 VanDerWaalsContact OE1-CD2 3.3Å
353	K	97.8	Very high	98.5	Very high	105 Å²	105	36.2 Å²	36.2	46%	0.457	18%	0.182	S	C	.	.	S	Bend	trans	-140.4	168.9	-177.6	58.8	-173.5	175.6	-168	0	109.6	N332 T351 V355	N332-K353 HydrophobicContact CB-CD 4.39Å; N332-K353 HydrophobicContact CB-CG 4.13Å; T351-K353 WeakPolarHBondContact CB-O 3.35Å; K353-V355 PolarHBondContact O-N 2.94Å
354	A	98.3	Very high	98.3	Very high	53 Å²	53	38.6 Å²	38.6	44%	0.438	20%	0.202	S	C	.	.			trans	-61.1	135.7	174.1	0	0	0	0	0	110.1	A266	A266-A354 CarbonylContact O-C 3.51Å; A266-A354 VanDerWaalsContact O-CA 3.24Å; A266-A354 WeakPolarHBondContact O-CA 3.26Å
355	V	98.4	Very high	98	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-117.6	143.8	177.3	-61.8	0	0	0	0	109.7	A262 V265 A266 M272 N332 T351 K353 E359 L361	A262-V355 HydrophobicContact CB-CG2 4.32Å; V265-V355 WeakPolarHBondContact CA-O 3.12Å; A266-V355 HydrophobicContact CB-CG2 3.72Å; A266-V355 PolarHBondContact N-O 2.59Å; A266-V355 PolarHBondContact O-N 2.74Å; M272-V355 HydrophobicContact CE-CG2 4.26Å; N332-V355 HydrophobicContact CB-CG1 4.07Å; T351-V355 HydrophobicContact CG2-CG1 4.09Å; T351-V355 HydrophobicContact CG2-CG2 3.87Å; K353-V355 PolarHBondContact O-N 2.94Å; V355-E359 WeakPolarHBondContact CA-OE2 3.33Å; V355-L361 HydrophobicContact CB-CD2 4.32Å; V355-L361 HydrophobicContact CG1-CD2 4.1Å; V355-L361 HydrophobicContact CG2-CD2 4.25Å
356	Q	98.6	Very high	97.2	Very high	109 Å²	109	42.4 Å²	42.4	51%	0.509	23%	0.231	S	C	.	.			trans	-86.3	160.9	177.1	-61	-55.3	-55.5	0	0	111.4	A262 D358 E359	A262-Q356 WeakPolarHBondContact CB-O 3.38Å; Q356-D358 PolarHBondContact O-N 2.96Å; Q356-E359 HydrophobicContact CB-CB 4.39Å; Q356-E359 PolarHBondContact N-OE2 3.48Å; Q356-E359 WeakPolarHBondContact O-CB 3.22Å; Q356-E359 PolarHBondContact O-N 3.25Å
357	K	98.4	Very high	96.3	Very high	125 Å²	125	43.9 Å²	43.9	54%	0.543	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	139.4	166.2	175	176.2	178.1	-170	0	109.8	K263 E359	K263-K357 WeakPolarHBondContact O-CD 3.37Å; K263-K357 WeakPolarHBondContact O-CG 3.29Å; K357-E359 PolarHBondContact O-N 2.89Å
358	D	98.6	Very high	94.8	Very high	92 Å²	92	45.7 Å²	45.7	49%	0.492	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	11.9	-178	-49.1	-43.8	0	0	0	113.9	A262 Q356	A262-D358 WeakPolarHBondContact O-CA 3.41Å; A262-D358 PolarHBondContact O-N 3.24Å; Q356-D358 PolarHBondContact O-N 2.96Å
359	E	98.7	Very high	93.1	Very high	57 Å²	57	49.8 Å²	49.8	27%	0.266	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-75.1	136	171.1	-170.2	176.8	150.5	0	0	110.7	F261 A262 N332 V355 Q356 K357	F261-E359 WeakPolarHBondContact CA-O 3.46Å; A262-E359 PolarHBondContact N-O 3.11Å; N332-E359 PolarHBondContact ND2-OE1 3.16Å; V355-E359 WeakPolarHBondContact CA-OE2 3.33Å; Q356-E359 HydrophobicContact CB-CB 4.39Å; Q356-E359 PolarHBondContact N-OE2 3.48Å; Q356-E359 WeakPolarHBondContact O-CB 3.22Å; Q356-E359 PolarHBondContact O-N 3.25Å; K357-E359 PolarHBondContact O-N 2.89Å
360	E	98.8	Very high	90.9	Very high	15 Å²	15	58.3 Å²	58.3	7%	0.07	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	128.6	173.8	-167.3	169.9	-178.1	0	0	110.2	S251 L252 F261 N326 N332 T362	S251-E360 VanDerWaalsContact CB-OE1 3.27Å; S251-E360 WeakPolarHBondContact CB-OE1 3.4Å; S251-E360 VanDerWaalsContact OG-CD 3.32Å; S251-E360 PolarHBondContact OG-OE1 3.24Å; S251-E360 PolarHBondContact OG-OE2 2.76Å; L252-E360 VanDerWaalsContact CB-OE2 3.29Å; L252-E360 WeakPolarHBondContact CB-OE2 3.29Å; L252-E360 HydrophobicContact CD1-CB 4.45Å; L252-E360 PolarHBondContact N-OE2 3.48Å; F261-E360 HydrophobicContact CD1-CB 3.86Å; F261-E360 HydrophobicContact CD1-CG 4.36Å; F261-E360 HydrophobicContact CE1-CB 3.5Å; F261-E360 HydrophobicContact CE1-CG 3.92Å; F261-E360 HydrophobicContact CE2-CG 4.21Å; F261-E360 HydrophobicContact CZ-CB 3.94Å; F261-E360 HydrophobicContact CZ-CG 3.82Å; N326-E360 PolarHBondContact ND2-OE1 2.86Å; N326-E360 VanDerWaalsContact ND2-OE1 3.15Å; N332-E360 PolarHBondContact ND2-O 3.32Å; E360-T362 HydrophobicContact CG-CG2 4.36Å
361	L	98.8	Very high	88.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.5	176.6	-55.7	-175.8	0	0	0	109.1	V246 L260 A262 M272 N332 V355	V246-L361 HydrophobicContact CG1-CD1 3.6Å; L260-L361 HydrophobicContact CD2-CD1 4.17Å; L260-L361 HydrophobicContact CG-CD1 4.33Å; L260-L361 PolarHBondContact O-N 3.27Å; A262-L361 HydrophobicContact CB-CD2 4.18Å; M272-L361 HydrophobicContact CB-CD1 3.81Å; M272-L361 HydrophobicContact CE-CD1 3.97Å; M272-L361 HydrophobicContact CG-CD1 4.07Å; N332-L361 WeakPolarHBondContact OD1-CA 3.07Å; V355-L361 HydrophobicContact CB-CD2 4.32Å; V355-L361 HydrophobicContact CG1-CD2 4.1Å; V355-L361 HydrophobicContact CG2-CD2 4.25Å
362	T	98.7	Very high	85.9	Confident	14 Å²	14	65.8 Å²	65.8	9%	0.086	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	150	-178.6	56	0	0	0	0	110.7	I253 N326 P331 N332 C333 E360	I253-T362 HydrophobicContact CD1-CG2 4.11Å; N326-T362 VanDerWaalsContact O-CA 3.25Å; N326-T362 WeakPolarHBondContact O-CA 3.3Å; P331-T362 VanDerWaalsContact CB-O 3.3Å; P331-T362 WeakPolarHBondContact CB-O 3.23Å; N332-T362 PolarHBondContact N-O 3.47Å; N332-T362 PolarHBondContact OD1-N 3.46Å; N332-T362 PolarHBondContact OD1-O 3.16Å; N332-T362 PolarHBondContact OD1-OG1 3.46Å; C333-T362 WeakPolarHBondContact CB-O 3.26Å; C333-T362 PolarHBondContact N-O 2.96Å; E360-T362 HydrophobicContact CG-CG2 4.36Å
363	V	98.1	Very high	83.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153.6	-175.9	-67.2	0	0	0	0	110.2	A325 N326 H327 S328 C333 Y335 I349 Y365	A325-V363 HydrophobicContact CB-CG2 4.27Å; N326-V363 PolarHBondContact O-N 2.88Å; H327-V363 CarbonylContact C-O 3.37Å; H327-V363 VanDerWaalsContact CA-O 3.23Å; H327-V363 WeakPolarHBondContact CA-O 3.47Å; H327-V363 PolarHBondContact ND1-O 3.01Å; S328-V363 PolarHBondContact N-O 2.98Å; C333-V363 HydrophobicContact CB-CG1 3.78Å; Y335-V363 HydrophobicContact CD2-CG2 4.48Å; Y335-V363 HydrophobicContact CE1-CG1 4.32Å; Y335-V363 HydrophobicContact CE1-CG2 4.11Å; Y335-V363 HydrophobicContact CE2-CB 4.14Å; Y335-V363 HydrophobicContact CE2-CG2 3.65Å; Y335-V363 VanDerWaalsContact CZ-CG2 3.45Å; Y335-V363 WeakPolarHBondContact OH-CG2 3.43Å; I349-V363 HydrophobicContact CG2-CG1 4.13Å; V363-Y365 HydrophobicContact CG2-CD1 3.87Å; V363-Y365 HydrophobicContact CG2-CE1 3.67Å
364	A	94.8	Very high	80.9	Confident	50 Å²	50	68.4 Å²	68.4	41%	0.413	37%	0.365	S	S	.	.			trans	-79.9	126.9	167.9	0	0	0	0	0	108.9	P331 G366	P331-A364 HydrophobicContact CG-CB 4.14Å; A364-G366 VanDerWaalsContact C-N 3.34Å
365	Y	91.2	Very high	78.3	Confident	55 Å²	55	73.9 Å²	73.9	22%	0.216	39%	0.387	C	S	.	.			trans	-77.7	-25.7	179.9	-77.1	10.9	0	0	0	111.6	A325 H327 V363 Y367 W382	A325-Y365 PolarHBondContact O-OH 3.25Å; H327-Y365 HydrophobicContact CB-CD1 3.83Å; H327-Y365 HydrophobicContact CB-CD2 3.98Å; H327-Y365 HydrophobicContact CB-CE1 3.84Å; H327-Y365 HydrophobicContact CB-CE2 4Å; H327-Y365 HydrophobicContact CB-CG 3.89Å; H327-Y365 AromaticContact ND1-CG 3.95Å; H327-Y365 PolarHBondContact ND1-N 2.83Å; H327-Y365 VanDerWaalsContact ND1-N 3.18Å; V363-Y365 HydrophobicContact CG2-CD1 3.87Å; V363-Y365 HydrophobicContact CG2-CE1 3.67Å; Y365-Y367 VanDerWaalsContact C-N 3.34Å; Y365-Y367 AromaticContact CD2-CE2 3.76Å; Y365-Y367 HydrophobicContact CD2-CE2 3.76Å; Y365-Y367 HydrophobicContact CG-CE2 4.39Å; Y365-Y367 PolarHBondContact O-N 2.71Å; Y365-W382 HydrophobicContact CD2-CH2 4.03Å; Y365-W382 HydrophobicContact CD2-CZ2 4.29Å; Y365-W382 HydrophobicContact CE2-CH2 4.01Å; Y365-W382 HydrophobicContact CE2-CZ2 4.12Å
366	G	81.1	Confident	75.7	Confident	60 Å²	60	75 Å²	75	62%	0.619	40%	0.399	S	S	*	.			trans	69	30.7	172.3	0	0	0	0	0	113.7	A364	A364-G366 VanDerWaalsContact C-N 3.34Å
367	Y	79.8	Confident	73.4	Confident	32 Å²	32	73.6 Å²	73.6	13%	0.125	40%	0.395	C	S	.	.			trans	-58	139.8	169.1	-65.7	-58.5	0	0	0	110	W290 Y365 H369 E378 A379 P380 Y383	W290-Y367 HydrophobicContact CH2-CD1 4.01Å; W290-Y367 AromaticContact CH2-CE1 3.62Å; W290-Y367 HydrophobicContact CH2-CE1 3.62Å; W290-Y367 HydrophobicContact CZ2-CD1 4.06Å; W290-Y367 AromaticContact CZ2-CE1 3.53Å; W290-Y367 HydrophobicContact CZ2-CE1 3.53Å; W290-Y367 AromaticContact CZ2-CZ 3.89Å; Y365-Y367 VanDerWaalsContact C-N 3.34Å; Y365-Y367 AromaticContact CD2-CE2 3.76Å; Y365-Y367 HydrophobicContact CD2-CE2 3.76Å; Y365-Y367 HydrophobicContact CG-CE2 4.39Å; Y365-Y367 PolarHBondContact O-N 2.71Å; Y367-H369 PolarHBondContact O-CD2 2.84Å; Y367-H369 PolarHBondContact O-N 3.48Å; Y367-H369 PolarHBondContact O-NE2 3.12Å; Y367-E378 WeakPolarHBondContact CD1-O 3.33Å; Y367-A379 HydrophobicContact CD2-CB 4.07Å; Y367-A379 HydrophobicContact CG-CB 4.06Å; Y367-P380 HydrophobicContact CE2-CG 4.05Å; Y367-Y383 HydrophobicContact CD2-CD1 4.06Å; Y367-Y383 AromaticContact CD2-CD2 3.69Å; Y367-Y383 HydrophobicContact CD2-CD2 3.69Å; Y367-Y383 HydrophobicContact CD2-CE1 4.1Å; Y367-Y383 AromaticContact CD2-CE2 3.74Å; Y367-Y383 HydrophobicContact CD2-CE2 3.74Å; Y367-Y383 AromaticContact CD2-CG 3.83Å; Y367-Y383 HydrophobicContact CD2-CG 3.83Å; Y367-Y383 AromaticContact CD2-CZ 3.95Å; Y367-Y383 HydrophobicContact CE2-CD2 4.16Å; Y367-Y383 HydrophobicContact CE2-CE2 4.49Å; Y367-Y383 HydrophobicContact CE2-CG 4.42Å
368	D	67.9	Low	72	Confident	80 Å²	80	72.2 Å²	72.2	43%	0.428	39%	0.39	S	S	.	.			trans	-62.5	130.8	-180	-170.3	-9.5	0	0	0	110.7	E370 S371	D368-E370 PolarHBondContact OD1-N 3.15Å; D368-S371 WeakPolarHBondContact CB-OG 3.36Å; D368-S371 PolarHBondContact OD1-N 3.47Å; D368-S371 WeakPolarHBondContact OD2-CB 3.36Å; D368-S371 PolarHBondContact OD2-OG 3.24Å
369	H	62.3	Low	71	Confident	85 Å²	85	68.3 Å²	68.3	39%	0.394	37%	0.37	S	S	.	.	S	Bend	trans	-97.4	-12.7	-176.7	-63.3	-68.2	0	0	0	112.8	Y367 L377 Y383 L387	Y367-H369 PolarHBondContact O-CD2 2.84Å; Y367-H369 PolarHBondContact O-N 3.48Å; Y367-H369 PolarHBondContact O-NE2 3.12Å; H369-L377 VanDerWaalsContact O-CD2 3.28Å; H369-L377 WeakPolarHBondContact O-CD2 3.2Å; H369-Y383 AromaticContact CE1-CE1 3.43Å; H369-Y383 VanDerWaalsContact CE1-CE1 3.43Å; H369-Y383 WeakPolarHBondContact CE1-CE1 3.47Å; H369-Y383 AromaticContact CE1-CZ 3.63Å; H369-Y383 PolarHBondContact CE1-OH 2.79Å; H369-Y383 AromaticContact ND1-CE1 3.98Å; H369-Y383 PolarHBondContact NE2-OH 2.83Å; H369-L387 WeakPolarHBondContact ND1-CD2 3.21Å
370	E	52.1	Low	70	Confident	179 Å²	179	66.3 Å²	66.3	84%	0.836	36%	0.363	S	S	*	.	S	Bend	trans	-117.2	-22.9	-167.7	-62.1	-168.5	169.9	0	0	113.4	D368 L372	D368-E370 PolarHBondContact OD1-N 3.15Å; E370-L372 PolarHBondContact O-N 2.83Å
371	S	48.6	Very low	69.3	Low	33 Å²	33	72 Å²	72	23%	0.231	39%	0.394	C	S	.	.			trans	-76.6	108.3	178.9	51.5	0	0	0	0	112.5	D368 G373	D368-S371 WeakPolarHBondContact CB-OG 3.36Å; D368-S371 PolarHBondContact OD1-N 3.47Å; D368-S371 WeakPolarHBondContact OD2-CB 3.36Å; D368-S371 PolarHBondContact OD2-OG 3.24Å; S371-G373 PolarHBondContact O-N 2.91Å
372	L	44.8	Very low	68.6	Low	158 Å²	158	77.7 Å²	77.7	83%	0.827	42%	0.415	S	S	*	.			trans	-71.2	76.5	150.7	-82.8	154.5	0	0	0	107.5	E370	E370-L372 PolarHBondContact O-N 2.83Å
373	G	46.3	Very low	68	Low	23 Å²	23	77.3 Å²	77.3	24%	0.237	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-55.7	168.5	164.3	0	0	0	0	0	110.3	S371 N375 G376	S371-G373 PolarHBondContact O-N 2.91Å; G373-N375 PolarHBondContact O-N 3.06Å; G373-G376 PolarHBondContact O-N 2.88Å
374	K	45.6	Very low	67.3	Low	216 Å²	216	80.1 Å²	80.1	94%	0.939	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-14.4	178.2	-75.9	179.6	179.4	171.1	0	113.6
375	N	42.2	Very low	66.7	Low	168 Å²	168	83.3 Å²	83.3	90%	0.898	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	13.2	179.3	-65.9	-18.8	0	0	0	115.2	G373	G373-N375 PolarHBondContact O-N 3.06Å
376	G	45.2	Very low	66.4	Low	24 Å²	24	83.9 Å²	83.9	25%	0.247	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	88.5	-176.9	-178.5	0	0	0	0	0	114.2	G373 E378	G373-G376 PolarHBondContact O-N 2.88Å; G376-E378 PolarHBondContact O-N 2.8Å
377	L	50.2	Low	66.6	Low	80 Å²	80	82.4 Å²	82.4	42%	0.419	41%	0.413	S	S	.	.	S	Bend	trans	-46.9	118.2	178.9	-75.2	161.6	0	0	0	111	H369 A379 K384	H369-L377 VanDerWaalsContact O-CD2 3.28Å; H369-L377 WeakPolarHBondContact O-CD2 3.2Å; L377-A379 PolarHBondContact O-N 3.37Å; L377-K384 VanDerWaalsContact CB-CE 3.47Å; L377-K384 WeakPolarHBondContact O-CE 3.5Å; L377-K384 PolarHBondContact O-NZ 2.84Å
378	E	69.3	Low	66.9	Low	96 Å²	96	86.2 Å²	86.2	45%	0.449	43%	0.432	S	S	.	.	S	Bend	trans	-77.2	57.6	-176.5	-70.8	-176.6	172.2	0	0	112.4	Y367 G376	Y367-E378 WeakPolarHBondContact CD1-O 3.33Å; G376-E378 PolarHBondContact O-N 2.8Å
379	A	76.3	Confident	67.8	Low	9 Å²	9	84.8 Å²	84.8	7%	0.074	43%	0.426	C	S	.	.	S	Bend	trans	-141	149.6	175.5	0	0	0	0	0	111	Y367 L377 Y383 K384	Y367-A379 HydrophobicContact CD2-CB 4.07Å; Y367-A379 HydrophobicContact CG-CB 4.06Å; L377-A379 PolarHBondContact O-N 3.37Å; A379-Y383 HydrophobicContact CB-CD1 3.54Å; A379-Y383 HydrophobicContact CB-CE1 4.13Å; A379-Y383 HydrophobicContact CB-CG 4.2Å; A379-K384 HydrophobicContact CB-CG 4.19Å; A379-K384 WeakPolarHBondContact O-CE 3.22Å; A379-K384 PolarHBondContact O-NZ 3.34Å
380	P	78.7	Confident	68.9	Low	16 Å²	16	84.9 Å²	84.9	10%	0.104	43%	0.425	C	S	.	.			trans	-67.1	155	175	28.7	-33	0	0	0	111.3	Y367 W382 Y383 K384	Y367-P380 HydrophobicContact CE2-CG 4.05Å; P380-W382 HydrophobicContact CB-CG 4.4Å; P380-W382 HydrophobicContact CG-CD2 4.16Å; P380-W382 HydrophobicContact CG-CG 4.37Å; P380-W382 HydrophobicContact CG-CZ2 3.66Å; P380-W382 PolarHBondContact O-N 2.64Å; P380-Y383 WeakPolarHBondContact O-CB 3.34Å; P380-Y383 PolarHBondContact O-N 3.26Å; P380-K384 PolarHBondContact O-N 3.33Å
381	D	84.3	Confident	70.5	Confident	135 Å²	135	82.9 Å²	82.9	72%	0.722	42%	0.416	S	S	*	.	H	α-helix	trans	-57.3	-35.9	-175.7	-68.4	-22.5	0	0	0	113.3	Y383 K384 H385	D381-Y383 VanDerWaalsContact C-N 3.31Å; D381-Y383 PolarHBondContact O-N 3.3Å; D381-K384 PolarHBondContact O-N 2.81Å; D381-H385 PolarHBondContact O-N 2.93Å
382	W	84.3	Confident	72.2	Confident	119 Å²	119	89 Å²	89	45%	0.451	44%	0.441	S	S	.	.	H	α-helix	trans	-62.7	-38.2	177.1	67	-102.8	0	0	0	112.1	H327 Y365 P380 E386	H327-W382 HydrophobicContact CB-CH2 3.54Å; H327-W382 HydrophobicContact CB-CZ3 3.77Å; H327-W382 AromaticContact CD2-CZ3 3.78Å; Y365-W382 HydrophobicContact CD2-CH2 4.03Å; Y365-W382 HydrophobicContact CD2-CZ2 4.29Å; Y365-W382 HydrophobicContact CE2-CH2 4.01Å; Y365-W382 HydrophobicContact CE2-CZ2 4.12Å; P380-W382 HydrophobicContact CB-CG 4.4Å; P380-W382 HydrophobicContact CG-CD2 4.16Å; P380-W382 HydrophobicContact CG-CG 4.37Å; P380-W382 HydrophobicContact CG-CZ2 3.66Å; P380-W382 PolarHBondContact O-N 2.64Å; W382-E386 PolarHBondContact O-N 2.87Å; W382-E386 VanDerWaalsContact O-N 3.07Å
383	Y	84.8	Confident	73.8	Confident	5 Å²	5	93.6 Å²	93.6	2%	0.02	45%	0.447	C	S	.	.	H	α-helix	trans	-70.8	-42.9	179.7	-179.3	-87.9	0	0	0	111.1	H327 F329 Y367 H369 A379 P380 D381 H385 E386 L387	H327-Y383 AromaticContact CD2-CD2 3.61Å; H327-Y383 AromaticContact CD2-CE2 3.71Å; H327-Y383 AromaticContact CE1-CE2 3.45Å; H327-Y383 VanDerWaalsContact CE1-CE2 3.45Å; H327-Y383 WeakPolarHBondContact CE1-CE2 3.3Å; H327-Y383 AromaticContact ND1-CE2 3.88Å; H327-Y383 AromaticContact NE2-CD2 3.7Å; H327-Y383 AromaticContact NE2-CE2 3.33Å; H327-Y383 VanDerWaalsContact NE2-CE2 3.33Å; H327-Y383 WeakPolarHBondContact NE2-CE2 3.39Å; F329-Y383 HydrophobicContact CE1-CE1 4.25Å; F329-Y383 AromaticContact CE1-CE2 3.95Å; F329-Y383 HydrophobicContact CE1-CE2 3.95Å; F329-Y383 AromaticContact CE1-CZ 3.66Å; F329-Y383 HydrophobicContact CZ-CD1 4.25Å; F329-Y383 HydrophobicContact CZ-CD2 4.05Å; F329-Y383 AromaticContact CZ-CE1 3.89Å; F329-Y383 HydrophobicContact CZ-CE1 3.89Å; F329-Y383 AromaticContact CZ-CE2 3.65Å; F329-Y383 HydrophobicContact CZ-CE2 3.65Å; F329-Y383 HydrophobicContact CZ-CG 4.35Å; F329-Y383 AromaticContact CZ-CZ 3.57Å; Y367-Y383 HydrophobicContact CD2-CD1 4.06Å; Y367-Y383 AromaticContact CD2-CD2 3.69Å; Y367-Y383 HydrophobicContact CD2-CD2 3.69Å; Y367-Y383 HydrophobicContact CD2-CE1 4.1Å; Y367-Y383 AromaticContact CD2-CE2 3.74Å; Y367-Y383 HydrophobicContact CD2-CE2 3.74Å; Y367-Y383 AromaticContact CD2-CG 3.83Å; Y367-Y383 HydrophobicContact CD2-CG 3.83Å; Y367-Y383 AromaticContact CD2-CZ 3.95Å; Y367-Y383 HydrophobicContact CE2-CD2 4.16Å; Y367-Y383 HydrophobicContact CE2-CE2 4.49Å; Y367-Y383 HydrophobicContact CE2-CG 4.42Å; H369-Y383 AromaticContact CE1-CE1 3.43Å; H369-Y383 VanDerWaalsContact CE1-CE1 3.43Å; H369-Y383 WeakPolarHBondContact CE1-CE1 3.47Å; H369-Y383 AromaticContact CE1-CZ 3.63Å; H369-Y383 PolarHBondContact CE1-OH 2.79Å; H369-Y383 AromaticContact ND1-CE1 3.98Å; H369-Y383 PolarHBondContact NE2-OH 2.83Å; A379-Y383 HydrophobicContact CB-CD1 3.54Å; A379-Y383 HydrophobicContact CB-CE1 4.13Å; A379-Y383 HydrophobicContact CB-CG 4.2Å; P380-Y383 WeakPolarHBondContact O-CB 3.34Å; P380-Y383 PolarHBondContact O-N 3.26Å; D381-Y383 VanDerWaalsContact C-N 3.31Å; D381-Y383 PolarHBondContact O-N 3.3Å; Y383-H385 VanDerWaalsContact C-N 3.31Å; Y383-H385 PolarHBondContact O-N 2.93Å; Y383-E386 PolarHBondContact O-N 3.34Å; Y383-L387 WeakPolarHBondContact O-CB 3.48Å; Y383-L387 PolarHBondContact O-N 2.98Å
384	K	83.6	Confident	75.1	Confident	59 Å²	59	97.1 Å²	97.1	26%	0.257	46%	0.458	S	S	.	.	H	α-helix	trans	-59	-44.6	176	-67.3	172.2	177.5	160.9	0	111.1	L377 A379 P380 D381 L387 E388	L377-K384 VanDerWaalsContact CB-CE 3.47Å; L377-K384 WeakPolarHBondContact O-CE 3.5Å; L377-K384 PolarHBondContact O-NZ 2.84Å; A379-K384 HydrophobicContact CB-CG 4.19Å; A379-K384 WeakPolarHBondContact O-CE 3.22Å; A379-K384 PolarHBondContact O-NZ 3.34Å; P380-K384 PolarHBondContact O-N 3.33Å; D381-K384 PolarHBondContact O-N 2.81Å; K384-L387 PolarHBondContact O-N 2.86Å; K384-E388 WeakPolarHBondContact O-CG 3.41Å; K384-E388 PolarHBondContact O-N 3.16Å; K384-E388 VanDerWaalsContact O-N 3.11Å
385	H	83.1	Confident	76.7	Confident	117 Å²	117	90.8 Å²	90.8	54%	0.542	43%	0.432	S	S	.	.	H	α-helix	trans	-63	-45.2	177.4	-174.7	58.1	0	0	0	112.1	D381 Y383 L387 E388 V389	D381-H385 PolarHBondContact O-N 2.93Å; Y383-H385 VanDerWaalsContact C-N 3.31Å; Y383-H385 PolarHBondContact O-N 2.93Å; H385-L387 VanDerWaalsContact C-N 3.33Å; H385-L387 PolarHBondContact O-N 2.87Å; H385-E388 PolarHBondContact O-N 2.83Å; H385-V389 WeakPolarHBondContact O-CG2 3.39Å; H385-V389 PolarHBondContact O-N 2.83Å
386	E	84.5	Confident	78.6	Confident	67 Å²	67	86.6 Å²	86.6	31%	0.313	41%	0.406	S	S	.	.	H	α-helix	trans	-65.5	-35.2	176.6	-75.9	-165.4	162.2	0	0	112.9	H327 F329 W382 Y383 V389 F390	H327-E386 IonicContact CD2-OE2 2.77Å; F329-E386 HydrophobicContact CD2-CB 4.35Å; F329-E386 HydrophobicContact CE2-CB 3.81Å; W382-E386 PolarHBondContact O-N 2.87Å; W382-E386 VanDerWaalsContact O-N 3.07Å; Y383-E386 PolarHBondContact O-N 3.34Å; E386-V389 PolarHBondContact O-N 3.24Å; E386-F390 WeakPolarHBondContact O-CB 3.18Å; E386-F390 PolarHBondContact O-N 3.07Å
387	L	85.9	Confident	80.6	Confident	30 Å²	30	90.2 Å²	90.2	16%	0.157	42%	0.416	C	S	.	.	H	α-helix	trans	-61.9	-46.3	176.2	-179.7	64.2	0	0	0	111.5	F329 H369 Y383 K384 H385 V389 F390 Q391	F329-L387 HydrophobicContact CD1-CD1 4.33Å; F329-L387 HydrophobicContact CE1-CB 4.44Å; F329-L387 HydrophobicContact CE1-CD1 3.65Å; F329-L387 HydrophobicContact CE2-CB 4.04Å; F329-L387 HydrophobicContact CE2-CD1 4.5Å; F329-L387 HydrophobicContact CZ-CB 3.66Å; F329-L387 HydrophobicContact CZ-CD1 3.76Å; F329-L387 HydrophobicContact CZ-CG 4.28Å; H369-L387 WeakPolarHBondContact ND1-CD2 3.21Å; Y383-L387 WeakPolarHBondContact O-CB 3.48Å; Y383-L387 PolarHBondContact O-N 2.98Å; K384-L387 PolarHBondContact O-N 2.86Å; H385-L387 VanDerWaalsContact C-N 3.33Å; H385-L387 PolarHBondContact O-N 2.87Å; L387-V389 VanDerWaalsContact C-N 3.31Å; L387-V389 PolarHBondContact O-N 3.13Å; L387-F390 PolarHBondContact O-N 3.28Å; L387-Q391 HydrophobicContact CD1-CG 4.32Å; L387-Q391 WeakPolarHBondContact O-CG 3.42Å; L387-Q391 PolarHBondContact O-N 2.86Å
388	E	85.2	Confident	82.5	Confident	111 Å²	111	90.9 Å²	90.9	52%	0.519	42%	0.415	S	S	.	.	H	α-helix	trans	-59.7	-43	176	-72.1	176.5	177.7	0	0	111.5	K384 H385 F390 Q392	K384-E388 WeakPolarHBondContact O-CG 3.41Å; K384-E388 PolarHBondContact O-N 3.16Å; K384-E388 VanDerWaalsContact O-N 3.11Å; H385-E388 PolarHBondContact O-N 2.83Å; E388-F390 VanDerWaalsContact C-N 3.35Å; E388-Q392 VanDerWaalsContact O-CG 3.26Å; E388-Q392 WeakPolarHBondContact O-CG 3.34Å; E388-Q392 PolarHBondContact O-N 3.03Å
389	V	85.9	Confident	83.4	Confident	51 Å²	51	90.5 Å²	90.5	31%	0.309	41%	0.413	S	S	.	.	H	α-helix	trans	-64.8	-39.9	177.1	172.5	0	0	0	0	111.2	H385 E386 L387 Q392	H385-V389 WeakPolarHBondContact O-CG2 3.39Å; H385-V389 PolarHBondContact O-N 2.83Å; E386-V389 PolarHBondContact O-N 3.24Å; L387-V389 VanDerWaalsContact C-N 3.31Å; L387-V389 PolarHBondContact O-N 3.13Å; V389-Q392 PolarHBondContact O-N 2.89Å
390	F	86.3	Confident	83.9	Confident	86 Å²	86	96.4 Å²	96.4	38%	0.377	44%	0.437	S	S	.	.	H	α-helix	trans	-66.8	-44.5	178.7	178.4	-106.7	0	0	0	111.9	F329 T330 E386 L387 E388 Q392 R393	F329-F390 HydrophobicContact CB-CB 4.39Å; F329-F390 HydrophobicContact CB-CD1 3.95Å; F329-F390 HydrophobicContact CB-CD2 3.74Å; F329-F390 HydrophobicContact CB-CE1 4.12Å; F329-F390 HydrophobicContact CB-CE2 3.93Å; F329-F390 HydrophobicContact CB-CG 3.75Å; F329-F390 HydrophobicContact CB-CZ 4.11Å; F329-F390 HydrophobicContact CD1-CD1 4.43Å; F329-F390 HydrophobicContact CD2-CB 4.06Å; F329-F390 HydrophobicContact CD2-CG 4.31Å; F329-F390 HydrophobicContact CG-CB 4.28Å; F329-F390 HydrophobicContact CG-CD1 4.11Å; F329-F390 HydrophobicContact CG-CD2 4.5Å; F329-F390 HydrophobicContact CG-CG 4.04Å; T330-F390 HydrophobicContact CG2-CE2 3.74Å; T330-F390 HydrophobicContact CG2-CZ 4.44Å; E386-F390 WeakPolarHBondContact O-CB 3.18Å; E386-F390 PolarHBondContact O-N 3.07Å; L387-F390 PolarHBondContact O-N 3.28Å; E388-F390 VanDerWaalsContact C-N 3.35Å; F390-Q392 PolarHBondContact O-N 3.18Å; F390-R393 PolarHBondContact O-N 3.28Å; F390-R393 VanDerWaalsContact O-N 3.16Å
391	Q	86.4	Confident	84.3	Confident	137 Å²	137	102.5 Å²	102.5	64%	0.64	46%	0.463	S	S	*	.	H	α-helix	trans	-65.5	-20.1	178.7	-71.9	174.9	-11.6	0	0	113.9	L387	L387-Q391 HydrophobicContact CD1-CG 4.32Å; L387-Q391 WeakPolarHBondContact O-CG 3.42Å; L387-Q391 PolarHBondContact O-N 2.86Å
392	Q	84.6	Confident	84.3	Confident	161 Å²	161	99.8 Å²	99.8	75%	0.752	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.7	177	-71.5	172.5	26.2	0	0	114	E388 V389 F390	E388-Q392 VanDerWaalsContact O-CG 3.26Å; E388-Q392 WeakPolarHBondContact O-CG 3.34Å; E388-Q392 PolarHBondContact O-N 3.03Å; V389-Q392 PolarHBondContact O-N 2.89Å; F390-Q392 PolarHBondContact O-N 3.18Å
393	R	76.6	Confident	84.3	Confident	255 Å²	255	98.1 Å²	98.1	96%	0.962	44%	0.441	S	S	*	.			trans	-93.4	0	177.9	-69.5	177.3	-178.3	-176.4	3.4	110.8	F390	F390-R393 PolarHBondContact O-N 3.28Å; F390-R393 VanDerWaalsContact O-N 3.16Å

Retrieved 393 of 393 residues in 528 ms (Link to these results)

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