A0A077YVX9_TRITR Loading...

Unc protein

AlphaFold DB , UniProt , Accession A0A077YVX9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 627 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	44.8	Very low	243 Å²	243	149.5 Å²	149.5	100%	1.197	76%	0.757	S	S	*	*				0	147.5	0	-85.3	-177.3	171.2	0	0	109.2
2	Q	37.6	Very low	45.4	Very low	176 Å²	176	147.5 Å²	147.5	82%	0.822	75%	0.748	S	S	*	*			trans	105.8	77	174.1	-62.7	-168	-13.3	0	0	115.6	R4	Q2-R4 PolarHBondContact O-N 3.09Å
3	Q	35.8	Very low	46	Very low	166 Å²	166	145 Å²	145	78%	0.776	74%	0.737	S	S	*	*			trans	-54.2	120.2	149.6	-69.1	166.1	-33.4	0	0	109.2	F5	Q3-F5 HydrophobicContact CB-CD2 4.17Å; Q3-F5 HydrophobicContact CB-CE2 4.05Å; Q3-F5 HydrophobicContact CG-CE2 4.45Å
4	R	43.3	Very low	46.4	Very low	236 Å²	236	146.3 Å²	146.3	89%	0.891	74%	0.735	S	S	*	*			trans	-104.6	102.3	155.1	-79.7	-172.4	176.8	-170.1	-0.4	107.1	Q2 G6	Q2-R4 PolarHBondContact O-N 3.09Å; R4-G6 PolarHBondContact O-N 3.41Å
5	F	44	Very low	46.8	Very low	179 Å²	179	140 Å²	140	79%	0.785	72%	0.715	S	S	*	*			trans	-63.6	96.9	168.8	-80.4	-91	0	0	0	108.8	Q3 C7	Q3-F5 HydrophobicContact CB-CD2 4.17Å; Q3-F5 HydrophobicContact CB-CE2 4.05Å; Q3-F5 HydrophobicContact CG-CE2 4.45Å; F5-C7 PolarHBondContact O-N 3.12Å
6	G	41.2	Very low	47	Very low	69 Å²	69	138.6 Å²	138.6	71%	0.711	71%	0.708	S	S	*	*			trans	-71.1	115.6	165.6	0	0	0	0	0	109.1	R4	R4-G6 PolarHBondContact O-N 3.41Å
7	C	48.5	Very low	47.3	Very low	91 Å²	91	135.4 Å²	135.4	62%	0.615	70%	0.697	S	S	*	*			trans	-57.2	125.2	-177.2	-165.1	0	0	0	0	111.2	F5 W9	F5-C7 PolarHBondContact O-N 3.12Å; C7-W9 PolarHBondContact O-N 2.95Å
8	P	49.4	Very low	47.5	Very low	89 Å²	89	131.3 Å²	131.3	58%	0.578	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-4.6	-171.3	25.3	-33.4	0	0	0	114.8	A10 I11	P8-A10 VanDerWaalsContact C-N 3.32Å; P8-A10 PolarHBondContact O-N 3.07Å; P8-I11 PolarHBondContact O-N 3.37Å
9	W	49.1	Very low	47.6	Very low	203 Å²	203	129.7 Å²	129.7	77%	0.769	68%	0.683	S	S	*	*	H	α-helix	trans	-71.3	-24.4	-178.4	-74.1	68	0	0	0	113.5	C7	C7-W9 PolarHBondContact O-N 2.95Å
10	A	52.2	Low	47.5	Very low	60 Å²	60	124.7 Å²	124.7	50%	0.496	66%	0.663	S	S	.	*	H	α-helix	trans	-71	-32.6	177.5	0	0	0	0	0	112.7	P8 F14	P8-A10 VanDerWaalsContact C-N 3.32Å; P8-A10 PolarHBondContact O-N 3.07Å; A10-F14 WeakPolarHBondContact O-CD2 3.03Å; A10-F14 PolarHBondContact O-N 3.49Å
11	I	54.5	Low	47.3	Very low	133 Å²	133	127.8 Å²	127.8	68%	0.682	67%	0.666	S	S	*	*	H	α-helix	trans	-73.9	-32.7	-177.6	-58.4	176.2	0	0	0	110.7	P8 A15	P8-I11 PolarHBondContact O-N 3.37Å; I11-A15 PolarHBondContact O-N 3.06Å; I11-A15 VanDerWaalsContact O-N 3.12Å
12	L	52.1	Low	47.7	Very low	125 Å²	125	119.3 Å²	119.3	65%	0.654	64%	0.635	S	S	*	*	H	α-helix	trans	-69.2	-36.1	177.9	-123.4	98.8	0	0	0	112.8	A15 L16	L12-A15 PolarHBondContact O-N 3.08Å; L12-L16 PolarHBondContact O-N 2.83Å; L12-L16 VanDerWaalsContact O-N 3.09Å
13	L	52.4	Low	48.1	Very low	115 Å²	115	113.5 Å²	113.5	60%	0.602	62%	0.617	S	S	*	*	H	α-helix	trans	-69.8	-38.5	177	-86.5	156.7	0	0	0	112.1	A15 L16 V17	L13-A15 VanDerWaalsContact C-N 3.35Å; L13-L16 PolarHBondContact O-N 3.45Å; L13-V17 WeakPolarHBondContact O-CG2 3.21Å; L13-V17 PolarHBondContact O-N 2.72Å; L13-V17 VanDerWaalsContact O-N 3.08Å
14	F	51.9	Low	48.5	Very low	163 Å²	163	114.2 Å²	114.2	72%	0.715	61%	0.613	S	S	*	*	H	α-helix	trans	-67.7	-34.1	174.3	-90.7	-79.9	0	0	0	112.8	A10 A18	A10-F14 WeakPolarHBondContact O-CD2 3.03Å; A10-F14 PolarHBondContact O-N 3.49Å; F14-A18 VanDerWaalsContact O-CB 3.3Å; F14-A18 WeakPolarHBondContact O-CB 3.04Å; F14-A18 PolarHBondContact O-N 2.99Å
15	A	52.9	Low	48.6	Very low	52 Å²	52	111.6 Å²	111.6	43%	0.43	61%	0.609	S	S	.	*	H	α-helix	trans	-66.5	-40.4	173.8	0	0	0	0	0	112.1	I11 L12 L13 A18 V19	I11-A15 PolarHBondContact O-N 3.06Å; I11-A15 VanDerWaalsContact O-N 3.12Å; L12-A15 PolarHBondContact O-N 3.08Å; L13-A15 VanDerWaalsContact C-N 3.35Å; A15-A18 PolarHBondContact O-N 2.05Å; A15-V19 WeakPolarHBondContact O-CB 3.04Å; A15-V19 WeakPolarHBondContact O-CG2 3.16Å; A15-V19 PolarHBondContact O-N 3.45Å
16	L	49.9	Very low	48.9	Very low	117 Å²	117	107.3 Å²	107.3	61%	0.613	60%	0.601	S	S	*	*	H	α-helix	trans	-69.7	-35.4	178.2	-78.3	163	0	0	0	113	L12 L13 G20	L12-L16 PolarHBondContact O-N 2.83Å; L12-L16 VanDerWaalsContact O-N 3.09Å; L13-L16 PolarHBondContact O-N 3.45Å; L16-G20 PolarHBondContact O-N 3.16Å
17	V	52.5	Low	49	Very low	85 Å²	85	111.7 Å²	111.7	52%	0.515	61%	0.605	S	S	.	*	H	α-helix	trans	-73	-33.7	174.9	178.5	0	0	0	0	111.7	L13 G20 R21	L13-V17 WeakPolarHBondContact O-CG2 3.21Å; L13-V17 PolarHBondContact O-N 2.72Å; L13-V17 VanDerWaalsContact O-N 3.08Å; V17-G20 PolarHBondContact O-N 3.23Å; V17-R21 PolarHBondContact O-N 3.25Å
18	A	50.2	Low	48.8	Very low	62 Å²	62	116 Å²	116	51%	0.512	61%	0.614	S	S	.	*	H	α-helix	trans	-70.1	-38.5	174.2	0	0	0	0	0	112.4	F14 A15 R21 A22	F14-A18 VanDerWaalsContact O-CB 3.3Å; F14-A18 WeakPolarHBondContact O-CB 3.04Å; F14-A18 PolarHBondContact O-N 2.99Å; A15-A18 PolarHBondContact O-N 2.05Å; A18-R21 PolarHBondContact O-N 2.03Å; A18-A22 WeakPolarHBondContact O-CB 3.3Å; A18-A22 PolarHBondContact O-N 3.13Å
19	V	49.1	Very low	48.7	Very low	100 Å²	100	114.1 Å²	114.1	61%	0.606	61%	0.61	S	S	*	*	H	α-helix	trans	-69.2	-36.2	173.1	175.7	0	0	0	0	110.7	A15 A22 A23	A15-V19 WeakPolarHBondContact O-CB 3.04Å; A15-V19 WeakPolarHBondContact O-CG2 3.16Å; A15-V19 PolarHBondContact O-N 3.45Å; V19-A22 PolarHBondContact O-N 2.98Å; V19-A23 WeakPolarHBondContact O-CB 3.03Å; V19-A23 PolarHBondContact O-N 3.31Å
20	G	45.3	Very low	48.8	Very low	29 Å²	29	111.6 Å²	111.6	30%	0.299	61%	0.611	S	S	.	*	H	α-helix	trans	-60.4	-48.5	172.4	0	0	0	0	0	112.5	L16 V17 A23 Y24	L16-G20 PolarHBondContact O-N 3.16Å; V17-G20 PolarHBondContact O-N 3.23Å; G20-A23 PolarHBondContact O-N 3.35Å; G20-Y24 WeakPolarHBondContact O-CD2 3.08Å; G20-Y24 PolarHBondContact O-N 3.06Å
21	R	43.2	Very low	48.7	Very low	190 Å²	190	117.3 Å²	117.3	72%	0.717	63%	0.628	S	S	*	*	H	α-helix	trans	-68.8	-33.4	178.3	-77.6	-176	171	-175.3	-2.1	113.3	V17 A18 F25	V17-R21 PolarHBondContact O-N 3.25Å; A18-R21 PolarHBondContact O-N 2.03Å; R21-F25 WeakPolarHBondContact O-CD2 3.39Å
22	A	47.7	Very low	48.6	Very low	66 Å²	66	119.1 Å²	119.1	55%	0.545	63%	0.631	S	S	.	*	H	α-helix	trans	-70.2	-34.1	174.8	0	0	0	0	0	112.7	A18 V19 S26	A18-A22 WeakPolarHBondContact O-CB 3.3Å; A18-A22 PolarHBondContact O-N 3.13Å; V19-A22 PolarHBondContact O-N 2.98Å; A22-S26 PolarHBondContact O-N 3.24Å
23	A	45.4	Very low	48.7	Very low	53 Å²	53	116.9 Å²	116.9	44%	0.438	62%	0.624	S	S	.	*	H	α-helix	trans	-69.5	-39	178.7	0	0	0	0	0	112.8	V19 G20 F25 S26 M27	V19-A23 WeakPolarHBondContact O-CB 3.03Å; V19-A23 PolarHBondContact O-N 3.31Å; G20-A23 PolarHBondContact O-N 3.35Å; A23-F25 VanDerWaalsContact C-N 3.33Å; A23-F25 PolarHBondContact O-N 2.99Å; A23-S26 PolarHBondContact O-N 3.46Å; A23-M27 PolarHBondContact O-N 2.71Å
24	Y	43.8	Very low	49.5	Very low	181 Å²	181	117.1 Å²	117.1	71%	0.71	64%	0.642	S	S	*	*	H	α-helix	trans	-65	-33.7	177.9	-80.8	-73	0	0	0	113.1	G20	G20-Y24 WeakPolarHBondContact O-CD2 3.08Å; G20-Y24 PolarHBondContact O-N 3.06Å
25	F	45.1	Very low	51.1	Low	181 Å²	181	114.2 Å²	114.2	79%	0.794	63%	0.629	S	S	*	*	H	α-helix	trans	-79.1	-18	175.3	-79.9	-76.9	0	0	0	113.7	R21 A23	R21-F25 WeakPolarHBondContact O-CD2 3.39Å; A23-F25 VanDerWaalsContact C-N 3.33Å; A23-F25 PolarHBondContact O-N 2.99Å
26	S	49.7	Very low	52.8	Low	90 Å²	90	114 Å²	114	63%	0.629	62%	0.621	S	S	*	*	H	α-helix	trans	-80.7	-20.3	175.9	-169.5	0	0	0	0	113.8	A22 A23 F28 G29	A22-S26 PolarHBondContact O-N 3.24Å; A23-S26 PolarHBondContact O-N 3.46Å; S26-F28 PolarHBondContact O-N 2.8Å; S26-G29 PolarHBondContact O-N 3.29Å; S26-G29 VanDerWaalsContact O-N 3.16Å
27	M	43.6	Very low	55	Low	160 Å²	160	111.5 Å²	111.5	79%	0.788	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-22.2	177.4	-68.8	-84.2	-165.2	0	0	112.6	A23	A23-M27 PolarHBondContact O-N 2.71Å
28	F	46	Very low	57	Low	182 Å²	182	107.5 Å²	107.5	80%	0.798	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	16.1	174.5	-62.7	-75.6	0	0	0	113.2	S26 L30	S26-F28 PolarHBondContact O-N 2.8Å; F28-L30 VanDerWaalsContact C-N 3.3Å; F28-L30 PolarHBondContact O-N 3.27Å
29	G	46.7	Very low	59.2	Low	49 Å²	49	107.4 Å²	107.4	51%	0.505	57%	0.574	S	S	.	*	S	Bend	trans	-60.8	100.4	162.6	0	0	0	0	0	107.2	S26 Q31	S26-G29 PolarHBondContact O-N 3.29Å; S26-G29 VanDerWaalsContact O-N 3.16Å; G29-Q31 VanDerWaalsContact C-N 3.35Å; G29-Q31 PolarHBondContact O-N 2.61Å
30	L	51.2	Low	61.3	Low	151 Å²	151	104.7 Å²	104.7	79%	0.791	56%	0.556	S	S	*	*			trans	-35.5	97.7	179.5	-155.4	86.6	0	0	0	108.4	F28 K32	F28-L30 VanDerWaalsContact C-N 3.3Å; F28-L30 PolarHBondContact O-N 3.27Å; L30-K32 PolarHBondContact O-N 3.18Å
31	Q	48.7	Very low	63.5	Low	180 Å²	180	109.9 Å²	109.9	84%	0.841	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-53.7	119.5	-179.1	-91.3	178.3	-17.6	0	0	104.6	G29 P33	G29-Q31 VanDerWaalsContact C-N 3.35Å; G29-Q31 PolarHBondContact O-N 2.61Å; Q31-P33 WeakPolarHBondContact O-CD 2.92Å
32	K	52.7	Low	65.9	Low	171 Å²	171	110.3 Å²	110.3	74%	0.743	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-49.7	121	167.6	-78.3	-179.8	-179.7	174	0	104	L30 A34	L30-K32 PolarHBondContact O-N 3.18Å; K32-A34 PolarHBondContact O-N 2.83Å; K32-A34 VanDerWaalsContact O-N 3.16Å
33	P	55.8	Low	68	Low	78 Å²	78	114.7 Å²	114.7	51%	0.506	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-51.5	133.9	-177.1	20.4	-31.7	0	0	0	106.5	Q31 K35	Q31-P33 WeakPolarHBondContact O-CD 2.92Å; P33-K35 WeakPolarHBondContact CB-O 3.44Å; P33-K35 PolarHBondContact O-N 3.39Å
34	A	68.9	Low	70.4	Confident	120 Å²	120	116.7 Å²	116.7	99%	0.992	59%	0.588	S	S	*	*	S	Bend	trans	-52.7	-19.7	-175.4	0	0	0	0	0	111.9	K32	K32-A34 PolarHBondContact O-N 2.83Å; K32-A34 VanDerWaalsContact O-N 3.16Å
35	K	84.2	Confident	72.9	Confident	102 Å²	102	109.3 Å²	109.3	44%	0.443	56%	0.562	S	S	.	*	S	Bend	trans	-129.9	133.9	176.8	-170.2	179.5	172.9	-158.9	0	111.7	P33 Y39 N41	P33-K35 WeakPolarHBondContact CB-O 3.44Å; P33-K35 PolarHBondContact O-N 3.39Å; K35-Y39 WeakPolarHBondContact CE-O 3.42Å; K35-N41 WeakPolarHBondContact CE-OD1 3.47Å; K35-N41 PolarHBondContact NZ-OD1 3.16Å
36	D	90.3	Very high	75.4	Confident	46 Å²	46	104 Å²	104	25%	0.246	54%	0.541	C	S	.	.			trans	-74.2	119	172.1	-169.8	-27.1	0	0	0	109.6	C38 Y39 K311	D36-C38 PolarHBondContact O-N 2.85Å; D36-C38 VanDerWaalsContact O-N 3.1Å; D36-C38 WeakPolarHBondContact OD1-CB 3.21Å; D36-C38 PolarHBondContact OD1-N 2.92Å; D36-C38 VanDerWaalsContact OD1-N 3.08Å; D36-Y39 HydrophobicContact CB-CD2 4.1Å; D36-Y39 PolarHBondContact O-N 3.39Å; D36-Y39 VanDerWaalsContact O-N 3.1Å; D36-K311 WeakPolarHBondContact OD2-CE 3.47Å; D36-K311 IonicContact OD2-NZ 2.9Å; D36-K311 PolarHBondContact OD2-NZ 3.47Å
37	P	94.2	Very high	77.5	Confident	66 Å²	66	103.4 Å²	103.4	43%	0.429	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-7.6	-176.5	30.1	-38.5	0	0	0	113.9	Y39	P37-Y39 PolarHBondContact O-N 3.24Å
38	C	96.4	Very high	80	Confident	0 Å²	0	96.1 Å²	96.1	0%	0	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	0.2	172.3	-56.7	0	0	0	0	113.5	D36 I46 C48 K311 H312	D36-C38 PolarHBondContact O-N 2.85Å; D36-C38 VanDerWaalsContact O-N 3.1Å; D36-C38 WeakPolarHBondContact OD1-CB 3.21Å; D36-C38 PolarHBondContact OD1-N 2.92Å; D36-C38 VanDerWaalsContact OD1-N 3.08Å; C38-I46 PolarHBondContact O-N 2.89Å; C38-C48 HydrophobicContact CB-CB 3.77Å; C38-C48 WeakPolarHBondContact CB-SG 3.35Å; C38-C48 WeakPolarHBondContact SG-CB 3.15Å; C38-C48 CovalentContact SG-SG 2.03Å; C38-C48 PolarHBondContact SG-SG 3.08Å; C38-K311 HydrophobicContact CB-CB 4.02Å; C38-K311 HydrophobicContact CB-CG 3.89Å; C38-K311 VanDerWaalsContact SG-CG 3.57Å; C38-H312 PolarHBondContact O-NE2 2.82Å
39	Y	96	Very high	82.4	Confident	61 Å²	61	89.5 Å²	89.5	24%	0.239	47%	0.465	C	S	.	.	B	Isolated β-bridge	trans	-133	138.1	178.1	-61.3	-87.2	0	0	0	111.3	K35 D36 P37 H43 E44 P45 K311	K35-Y39 WeakPolarHBondContact CE-O 3.42Å; D36-Y39 HydrophobicContact CB-CD2 4.1Å; D36-Y39 PolarHBondContact O-N 3.39Å; D36-Y39 VanDerWaalsContact O-N 3.1Å; P37-Y39 PolarHBondContact O-N 3.24Å; Y39-H43 WeakPolarHBondContact CD1-O 3.47Å; Y39-E44 CarbonylContact C-O 3.55Å; Y39-E44 WeakPolarHBondContact CA-O 3.48Å; Y39-P45 HydrophobicContact CD1-CB 4.33Å; Y39-P45 HydrophobicContact CE1-CB 4.1Å; Y39-K311 HydrophobicContact CE2-CB 4.47Å
40	N	93.4	Very high	84.8	Confident	42 Å²	42	87.6 Å²	87.6	23%	0.225	44%	0.443	C	S	.	.			trans	-73.6	-178	176.6	74.7	10.4	0	0	0	111.5	R42 H43 E44 I46	N40-R42 PolarHBondContact O-N 2.94Å; N40-R42 WeakPolarHBondContact OD1-CA 3.43Å; N40-R42 WeakPolarHBondContact OD1-CB 3.28Å; N40-R42 PolarHBondContact OD1-N 2.92Å; N40-H43 PolarHBondContact O-N 3.41Å; N40-H43 PolarHBondContact OD1-N 3.43Å; N40-E44 PolarHBondContact N-O 2.94Å; N40-E44 PolarHBondContact ND2-OE2 2.96Å; N40-E44 PolarHBondContact OD1-N 3.13Å; N40-E44 PolarHBondContact OD1-O 3.3Å; N40-I46 HydrophobicContact CB-CD1 4.38Å; N40-I46 HydrophobicContact CB-CG2 3.96Å
41	N	91.8	Very high	87	Confident	139 Å²	139	86.4 Å²	86.4	74%	0.743	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21	179.1	-70.6	-27.2	0	0	0	113.8	K35 H43	K35-N41 WeakPolarHBondContact CE-OD1 3.47Å; K35-N41 PolarHBondContact NZ-OD1 3.16Å; N41-H43 VanDerWaalsContact C-N 3.32Å
42	R	93.3	Very high	89.3	Confident	198 Å²	198	82 Å²	82	75%	0.747	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	6.3	177.1	-63.3	-177.5	172.7	-176.4	-1.4	112.8	N40 E44	N40-R42 PolarHBondContact O-N 2.94Å; N40-R42 WeakPolarHBondContact OD1-CA 3.43Å; N40-R42 WeakPolarHBondContact OD1-CB 3.28Å; N40-R42 PolarHBondContact OD1-N 2.92Å; R42-E44 HydrophobicContact CB-CG 4.05Å; R42-E44 PolarHBondContact O-N 2.91Å
43	H	91.9	Very high	91.4	Very high	159 Å²	159	76.8 Å²	76.8	74%	0.736	40%	0.398	S	S	*	.	S	Bend	trans	62.2	19.9	-172	-55.1	86.4	0	0	0	114	Y39 N40 N41	Y39-H43 WeakPolarHBondContact CD1-O 3.47Å; N40-H43 PolarHBondContact O-N 3.41Å; N40-H43 PolarHBondContact OD1-N 3.43Å; N41-H43 VanDerWaalsContact C-N 3.32Å
44	E	94.5	Very high	93.4	Very high	95 Å²	95	75.6 Å²	75.6	44%	0.444	39%	0.388	S	S	.	.			trans	-81.6	140.5	172	-58	161.9	159	0	0	108.9	Y39 N40 R42	Y39-E44 CarbonylContact C-O 3.55Å; Y39-E44 WeakPolarHBondContact CA-O 3.48Å; N40-E44 PolarHBondContact N-O 2.94Å; N40-E44 PolarHBondContact ND2-OE2 2.96Å; N40-E44 PolarHBondContact OD1-N 3.13Å; N40-E44 PolarHBondContact OD1-O 3.3Å; R42-E44 HydrophobicContact CB-CG 4.05Å; R42-E44 PolarHBondContact O-N 2.91Å
45	P	96.6	Very high	94.8	Very high	26 Å²	26	70.1 Å²	70.1	17%	0.169	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-63.6	140.1	-179.9	28.9	-37.4	0	0	0	111	Y39 P339 E341	Y39-P45 HydrophobicContact CD1-CB 4.33Å; Y39-P45 HydrophobicContact CE1-CB 4.1Å; P45-P339 HydrophobicContact CB-CB 3.92Å; P45-P339 HydrophobicContact CB-CG 3.93Å; P45-P339 HydrophobicContact CG-CB 4.34Å; P45-P339 HydrophobicContact CG-CG 3.79Å; P45-P339 WeakPolarHBondContact O-CG 3.46Å; P45-E341 HydrophobicContact CG-CB 4.41Å; P45-E341 HydrophobicContact CG-CG 4.21Å; P45-E341 WeakPolarHBondContact CG-OE2 3.05Å
46	I	96.8	Very high	95.4	Very high	69 Å²	69	65.3 Å²	65.3	35%	0.354	32%	0.321	S	S	.	.			trans	-136.9	153.4	173.5	58.5	172.7	0	0	0	109.1	C38 N40 C48 H312	C38-I46 PolarHBondContact O-N 2.89Å; N40-I46 HydrophobicContact CB-CD1 4.38Å; N40-I46 HydrophobicContact CB-CG2 3.96Å; I46-C48 PolarHBondContact O-N 2.93Å; I46-H312 PolarHBondContact O-CE1 2.76Å; I46-H312 PolarHBondContact O-NE2 2.94Å; I46-H312 VanDerWaalsContact O-NE2 3.09Å
47	R	95.7	Very high	95.7	Very high	78 Å²	78	68.5 Å²	68.5	29%	0.294	33%	0.333	S	S	.	.			trans	-54.6	133.4	174.7	174.4	177.9	177.5	-93.3	8.5	110.9	E229 A334 T335	R47-E229 IonicContact CZ-OE1 3.95Å; R47-E229 IonicContact NE-OE1 3.08Å; R47-E229 PolarHBondContact NE-OE1 3.22Å; R47-E229 IonicContact NH1-OE1 2.61Å; R47-E229 PolarHBondContact NH1-OE1 3.49Å; R47-E229 IonicContact NH2-OE1 3.97Å; R47-E229 PolarHBondContact NH2-OE1 2.85Å; R47-E229 VanDerWaalsContact NH2-OE1 3.16Å; R47-A334 HydrophobicContact CB-CB 3.97Å; R47-A334 WeakPolarHBondContact CD-O 3.35Å; R47-A334 HydrophobicContact CG-CB 4.02Å; R47-T335 WeakPolarHBondContact CB-O 3.28Å
48	C	96.1	Very high	95.8	Very high	7 Å²	7	68.2 Å²	68.2	5%	0.047	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-134.4	142.1	174.8	58.7	0	0	0	0	111.5	C38 I46 G293	C38-C48 HydrophobicContact CB-CB 3.77Å; C38-C48 WeakPolarHBondContact CB-SG 3.35Å; C38-C48 WeakPolarHBondContact SG-CB 3.15Å; C38-C48 CovalentContact SG-SG 2.03Å; C38-C48 PolarHBondContact SG-SG 3.08Å; I46-C48 PolarHBondContact O-N 2.93Å; C48-G293 PolarHBondContact N-O 3.07Å; C48-G293 VanDerWaalsContact N-O 3.11Å; C48-G293 CarbonylContact O-C 3.54Å; C48-G293 WeakPolarHBondContact O-CA 3.48Å; C48-G293 VanDerWaalsContact O-O 3.09Å
49	V	95.8	Very high	95.8	Very high	43 Å²	43	71.4 Å²	71.4	26%	0.261	36%	0.356	S	S	.	.			trans	-128.1	148	-177.2	-67.7	0	0	0	0	110.4	A295	V49-A295 CarbonylContact C-O 3.56Å
50	P	97.4	Very high	95.8	Very high	8 Å²	8	73.3 Å²	73.3	5%	0.052	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-66.7	160.4	174.8	-23.6	38.4	0	0	0	113	R288 C289 C291 A295 S296	P50-R288 WeakPolarHBondContact O-CD 3.1Å; P50-R288 PolarHBondContact O-NH1 3.25Å; P50-C289 HydrophobicContact CB-CB 3.96Å; P50-C289 HydrophobicContact CG-CB 3.97Å; P50-C289 WeakPolarHBondContact CG-O 3.33Å; P50-C291 HydrophobicContact CG-CB 4.23Å; P50-A295 WeakPolarHBondContact CD-O 3.47Å; P50-A295 WeakPolarHBondContact CG-O 3.22Å; P50-S296 WeakPolarHBondContact CA-O 3.01Å
51	D	96.2	Very high	96	Very high	127 Å²	127	72 Å²	72	68%	0.679	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-59.8	150.8	173.3	-64	-33.1	0	0	0	111.9
52	F	97.9	Very high	96.3	Very high	86 Å²	86	70.2 Å²	70.2	38%	0.377	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	130.8	174.9	-172.5	-89.2	0	0	0	109.8	Y143 G286 R288	F52-Y143 AromaticContact CE1-CE1 3.92Å; F52-Y143 HydrophobicContact CE1-CE1 3.92Å; F52-Y143 HydrophobicContact CZ-CD1 4.09Å; F52-Y143 AromaticContact CZ-CE1 3.52Å; F52-Y143 HydrophobicContact CZ-CE1 3.52Å; F52-G286 VanDerWaalsContact CZ-CA 3.42Å; F52-R288 HydrophobicContact CB-CG 4.29Å; F52-R288 HydrophobicContact CD2-CG 4.08Å
53	V	97.3	Very high	96.5	Very high	63 Å²	63	62 Å²	62	38%	0.382	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	159.9	-175.4	-61.6	0	0	0	0	111.4	A55 Y139 G287	V53-A55 PolarHBondContact O-N 3.32Å; V53-Y139 HydrophobicContact CG2-CE1 4.05Å; V53-G287 PolarHBondContact N-O 3.07Å; V53-G287 PolarHBondContact O-N 2.9Å
54	N	97.5	Very high	96.7	Very high	53 Å²	53	57.8 Å²	57.8	28%	0.283	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	100.4	159.5	-178.7	5	0	0	0	108.5	A56 F57 V285	N54-A56 PolarHBondContact O-N 3.48Å; N54-A56 WeakPolarHBondContact OD1-CB 3.41Å; N54-A56 PolarHBondContact OD1-N 3.38Å; N54-A56 VanDerWaalsContact OD1-N 3.15Å; N54-F57 HydrophobicContact CB-CB 4.23Å; N54-F57 WeakPolarHBondContact O-CB 3.19Å; N54-F57 PolarHBondContact O-N 2.64Å; N54-V285 CarbonylContact C-O 3.55Å; N54-V285 WeakPolarHBondContact CA-O 3.45Å; N54-V285 PolarHBondContact OD1-N 3.33Å
55	A	97.4	Very high	96.7	Very high	5 Å²	5	54.4 Å²	54.4	4%	0.041	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.1	-177.6	0	0	0	0	0	113.5	V53 K59 L135 Y139 V285	V53-A55 PolarHBondContact O-N 3.32Å; A55-K59 WeakPolarHBondContact O-CG 3.24Å; A55-L135 HydrophobicContact CB-CD1 4.42Å; A55-L135 HydrophobicContact CB-CD2 4.02Å; A55-Y139 HydrophobicContact CB-CD1 3.7Å; A55-Y139 HydrophobicContact CB-CD2 4.3Å; A55-Y139 HydrophobicContact CB-CE1 3.61Å; A55-Y139 HydrophobicContact CB-CE2 4.23Å; A55-Y139 HydrophobicContact CB-CG 4.06Å; A55-V285 HydrophobicContact CB-CB 4.45Å; A55-V285 HydrophobicContact CB-CG1 4.33Å; A55-V285 PolarHBondContact N-O 2.9Å
56	A	97.7	Very high	96.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-20.6	176.7	0	0	0	0	0	112.9	N54 G58 K59 T106 L133 L283 V285	N54-A56 PolarHBondContact O-N 3.48Å; N54-A56 WeakPolarHBondContact OD1-CB 3.41Å; N54-A56 PolarHBondContact OD1-N 3.38Å; N54-A56 VanDerWaalsContact OD1-N 3.15Å; A56-G58 PolarHBondContact O-N 3.17Å; A56-K59 VanDerWaalsContact O-CB 3.26Å; A56-K59 WeakPolarHBondContact O-CB 3.36Å; A56-K59 PolarHBondContact O-N 2.65Å; A56-T106 HydrophobicContact CB-CG2 4.03Å; A56-T106 VanDerWaalsContact O-CB 3.23Å; A56-T106 WeakPolarHBondContact O-CB 3.17Å; A56-T106 VanDerWaalsContact O-CG2 3.24Å; A56-T106 WeakPolarHBondContact O-CG2 3.46Å; A56-L133 HydrophobicContact CB-CD2 3.57Å; A56-L283 WeakPolarHBondContact CB-O 3.48Å; A56-V285 HydrophobicContact CB-CB 4.04Å; A56-V285 HydrophobicContact CB-CG2 3.86Å
57	F	96.9	Very high	96.5	Very high	113 Å²	113	50.5 Å²	50.5	50%	0.496	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	124.7	-173.6	-178.8	-104.7	0	0	0	112.2	N54 K59 L108	N54-F57 HydrophobicContact CB-CB 4.23Å; N54-F57 WeakPolarHBondContact O-CB 3.19Å; N54-F57 PolarHBondContact O-N 2.64Å; F57-K59 PolarHBondContact O-N 3.01Å; F57-L108 HydrophobicContact CE2-CB 4.21Å; F57-L108 HydrophobicContact CE2-CD1 4.09Å; F57-L108 HydrophobicContact CZ-CD1 4.34Å
58	G	95.3	Very high	96.5	Very high	60 Å²	60	47 Å²	47	62%	0.619	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	10.5	-178.7	0	0	0	0	0	115.5	A56 T106	A56-G58 PolarHBondContact O-N 3.17Å; G58-T106 PolarHBondContact N-O 3.23Å
59	K	96	Very high	96.3	Very high	67 Å²	67	52.6 Å²	52.6	29%	0.291	31%	0.305	S	S	.	.			trans	-88.7	141.5	-180	-66.5	-67.4	-176	173.1	0	111.7	A55 A56 F57 V61 T106 L133 L135	A55-K59 WeakPolarHBondContact O-CG 3.24Å; A56-K59 VanDerWaalsContact O-CB 3.26Å; A56-K59 WeakPolarHBondContact O-CB 3.36Å; A56-K59 PolarHBondContact O-N 2.65Å; F57-K59 PolarHBondContact O-N 3.01Å; K59-V61 PolarHBondContact O-N 2.73Å; K59-T106 PolarHBondContact O-OG1 2.82Å; K59-L133 HydrophobicContact CB-CD1 3.52Å; K59-L133 HydrophobicContact CG-CD1 4.41Å; K59-L135 PolarHBondContact NZ-O 3.29Å
60	P	96.5	Very high	96.1	Very high	102 Å²	102	59.3 Å²	59.3	66%	0.662	33%	0.33	S	S	*	.			trans	-67.1	132.8	176.8	28.7	-34.2	0	0	0	111
61	V	98.2	Very high	95.9	Very high	15 Å²	15	62.1 Å²	62.1	9%	0.091	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.5	171.7	-177.5	0	0	0	0	108.9	K59 A102 L105 T106 L131 L133	K59-V61 PolarHBondContact O-N 2.73Å; V61-A102 HydrophobicContact CB-CB 4.18Å; V61-A102 HydrophobicContact CG1-CB 4.29Å; V61-A102 WeakPolarHBondContact O-CB 3.04Å; V61-L105 HydrophobicContact CB-CD1 4.35Å; V61-L105 HydrophobicContact CG1-CD1 3.93Å; V61-L105 HydrophobicContact CG2-CB 4.42Å; V61-T106 HydrophobicContact CG2-CG2 3.66Å; V61-L131 HydrophobicContact CG1-CB 4.04Å; V61-L131 HydrophobicContact CG1-CD2 4.06Å; V61-L133 HydrophobicContact CG2-CB 4.48Å; V61-L133 HydrophobicContact CG2-CD1 4.1Å
62	V	97.5	Very high	95.8	Very high	101 Å²	101	61 Å²	61	61%	0.612	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.9	174.8	-179.5	0	0	0	0	108.8	L131 T132	V62-L131 CarbonylContact O-C 3.49Å; V62-L131 WeakPolarHBondContact O-CA 3.26Å; V62-T132 PolarHBondContact N-O 2.85Å; V62-T132 PolarHBondContact O-N 3.44Å
63	S	96.9	Very high	95.5	Very high	26 Å²	26	58 Å²	58	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	142	174.1	-174.9	0	0	0	0	111.7	S65 W117 T130	S63-S65 PolarHBondContact OG-N 3.33Å; S63-S65 VanDerWaalsContact OG-N 3.15Å; S63-S65 PolarHBondContact OG-O 2.04Å; S63-W117 WeakPolarHBondContact OG-CZ2 3.3Å; S63-T130 CarbonylContact C-O 3.33Å; S63-T130 WeakPolarHBondContact CA-O 3.06Å
64	S	95.8	Very high	95.4	Very high	70 Å²	70	56.1 Å²	56.1	49%	0.49	33%	0.329	S	S	.	.	S	Bend	trans	-79.7	-18.1	169.5	65.5	0	0	0	0	113.6	T130	S64-T130 VanDerWaalsContact CB-OG1 3.31Å; S64-T130 WeakPolarHBondContact CB-OG1 3.07Å; S64-T130 PolarHBondContact N-O 2.95Å; S64-T130 PolarHBondContact OG-N 3.28Å; S64-T130 PolarHBondContact OG-OG1 2.8Å
65	S	94.8	Very high	95.1	Very high	24 Å²	24	54 Å²	54	17%	0.168	32%	0.317	C	S	.	.			trans	-146.9	124.7	-178.1	-176.6	0	0	0	0	110.2	S63 W117 E120	S63-S65 PolarHBondContact OG-N 3.33Å; S63-S65 VanDerWaalsContact OG-N 3.15Å; S63-S65 PolarHBondContact OG-O 2.04Å; S65-W117 VanDerWaalsContact O-CZ2 3.25Å; S65-W117 WeakPolarHBondContact O-CZ2 3.41Å; S65-W117 PolarHBondContact O-NE1 2.89Å; S65-E120 WeakPolarHBondContact OG-CB 3.18Å; S65-E120 PolarHBondContact OG-N 2.85Å
66	T	95.8	Very high	94.8	Very high	12 Å²	12	53.7 Å²	53.7	7%	0.074	32%	0.315	C	S	.	.			trans	-140.7	130.2	176.9	-61.5	0	0	0	0	107.3	G68 Q69 Y100 W117 V118	T66-G68 PolarHBondContact O-N 3.37Å; T66-Q69 WeakPolarHBondContact O-CB 3.46Å; T66-Q69 PolarHBondContact O-N 3.04Å; T66-Q69 VanDerWaalsContact O-N 3.15Å; T66-Y100 WeakPolarHBondContact CG2-O 3.39Å; T66-W117 PolarHBondContact OG1-NE1 2.74Å; T66-V118 WeakPolarHBondContact CA-O 3.47Å
67	C	95	Very high	94.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	134.5	179.9	-165.8	0	0	0	0	110.5	Q69 S73 C94 V118	C67-Q69 PolarHBondContact O-N 3.14Å; C67-S73 PolarHBondContact SG-OG 3.04Å; C67-C94 HydrophobicContact CB-CB 3.75Å; C67-C94 WeakPolarHBondContact CB-SG 3.31Å; C67-C94 WeakPolarHBondContact SG-CB 3.48Å; C67-C94 CovalentContact SG-SG 2.03Å; C67-C94 PolarHBondContact SG-SG 3.45Å; C67-V118 HydrophobicContact CB-CB 4.22Å; C67-V118 HydrophobicContact CB-CG1 4.08Å; C67-V118 PolarHBondContact N-O 3.28Å
68	G	94.6	Very high	93.4	Very high	6 Å²	6	53.9 Å²	53.9	6%	0.062	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-2.7	-178.8	0	0	0	0	0	115.2	T66 S71 S73 C94 D96 G97 E120	T66-G68 PolarHBondContact O-N 3.37Å; G68-S71 VanDerWaalsContact CA-O 3.31Å; G68-S71 WeakPolarHBondContact CA-O 3.37Å; G68-S73 PolarHBondContact N-OG 3.35Å; G68-C94 WeakPolarHBondContact CA-O 3.49Å; G68-D96 CarbonylContact O-C 3.6Å; G68-G97 PolarHBondContact O-N 2.95Å; G68-E120 PolarHBondContact N-OE2 2.79Å
69	Q	92.9	Very high	92.7	Very high	124 Å²	124	57.5 Å²	57.5	58%	0.579	31%	0.308	S	S	*	.	S	Bend	trans	-71	-34.9	-173.4	-175.1	66.5	53.2	0	0	113.6	T66 C67	T66-Q69 WeakPolarHBondContact O-CB 3.46Å; T66-Q69 PolarHBondContact O-N 3.04Å; T66-Q69 VanDerWaalsContact O-N 3.15Å; C67-Q69 PolarHBondContact O-N 3.14Å
70	K	91	Very high	91.8	Very high	184 Å²	184	62.4 Å²	62.4	80%	0.8	32%	0.324	S	S	*	.	S	Bend	trans	-98.8	-40.6	-180	-68.9	-178.2	-179.7	177.2	0	112.4
71	S	92.3	Very high	90.9	Very high	67 Å²	67	59.7 Å²	59.7	47%	0.469	30%	0.304	S	S	.	.	S	Bend	trans	-155.2	156.6	179	54.4	0	0	0	0	108.6	G68 S73	G68-S71 VanDerWaalsContact CA-O 3.31Å; G68-S71 WeakPolarHBondContact CA-O 3.37Å; S71-S73 PolarHBondContact O-N 3.31Å
72	P	94	Very high	89.9	Confident	103 Å²	103	67.5 Å²	67.5	67%	0.669	34%	0.34	S	S	*	.			trans	-51.9	131.2	170.5	-25.5	34.1	0	0	0	110.9	C94	P72-C94 WeakPolarHBondContact CA-O 3.22Å
73	S	93.2	Very high	89.1	Confident	24 Å²	24	67.1 Å²	67.1	17%	0.168	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	178.8	179.1	61.2	0	0	0	0	111.3	C67 G68 S71 C94 E120	C67-S73 PolarHBondContact SG-OG 3.04Å; G68-S73 PolarHBondContact N-OG 3.35Å; S71-S73 PolarHBondContact O-N 3.31Å; S73-C94 PolarHBondContact N-O 3.44Å; S73-C94 PolarHBondContact O-N 3.06Å; S73-E120 WeakPolarHBondContact CB-OE1 3.36Å; S73-E120 PolarHBondContact OG-OE1 2.84Å
74	S	93.9	Very high	88.2	Confident	23 Å²	23	73 Å²	73	16%	0.161	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	139.1	-179.6	61.3	0	0	0	0	110.1	H92 R274	S74-H92 CarbonylContact C-O 3.47Å; S74-H92 WeakPolarHBondContact CA-O 3.49Å; S74-H92 WeakPolarHBondContact CB-O 3.5Å; S74-R274 WeakPolarHBondContact O-CG 3.47Å; S74-R274 WeakPolarHBondContact OG-CD 3.22Å; S74-R274 VanDerWaalsContact OG-CZ 3.32Å; S74-R274 PolarHBondContact OG-NE 2.86Å; S74-R274 VanDerWaalsContact OG-NE 3.16Å
75	Y	91.8	Very high	87.2	Confident	7 Å²	7	74.4 Å²	74.4	3%	0.027	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	153.1	175.4	70.9	-81.3	0	0	0	109.8	W77 C91 H92 Y100 V118 H150 R274 F277	Y75-W77 AromaticContact CD2-CE3 3.81Å; Y75-W77 HydrophobicContact CD2-CE3 3.81Å; Y75-W77 AromaticContact CD2-CZ3 3.86Å; Y75-W77 HydrophobicContact CD2-CZ3 3.86Å; Y75-W77 AromaticContact CE2-CE3 3.5Å; Y75-W77 HydrophobicContact CE2-CE3 3.5Å; Y75-W77 HydrophobicContact CE2-CH2 4.25Å; Y75-W77 AromaticContact CE2-CZ3 3.15Å; Y75-W77 HydrophobicContact CE2-CZ3 3.15Å; Y75-W77 AromaticContact CZ-CZ3 3.71Å; Y75-C91 CarbonylContact O-C 3.59Å; Y75-C91 VanDerWaalsContact O-CA 3.31Å; Y75-C91 WeakPolarHBondContact O-CA 3.26Å; Y75-H92 HydrophobicContact CD1-CB 4.21Å; Y75-H92 HydrophobicContact CE1-CB 3.6Å; Y75-H92 HydrophobicContact CE2-CB 4.4Å; Y75-H92 PolarHBondContact N-O 3.22Å; Y75-H92 PolarHBondContact O-N 2.99Å; Y75-Y100 HydrophobicContact CE1-CD2 4.5Å; Y75-Y100 HydrophobicContact CE1-CE1 4.25Å; Y75-Y100 AromaticContact CE1-CE2 3.91Å; Y75-Y100 HydrophobicContact CE1-CE2 3.91Å; Y75-Y100 AromaticContact CE1-CZ 3.76Å; Y75-Y100 WeakPolarHBondContact OH-CE1 3.46Å; Y75-Y100 PolarHBondContact OH-OH 3.25Å; Y75-V118 HydrophobicContact CD1-CG1 4.04Å; Y75-V118 HydrophobicContact CD2-CG1 4.33Å; Y75-V118 HydrophobicContact CE1-CG1 4.3Å; Y75-V118 HydrophobicContact CE1-CG2 4.36Å; Y75-V118 HydrophobicContact CE2-CG2 4.49Å; Y75-V118 HydrophobicContact CG-CG1 4.06Å; Y75-H150 AromaticContact CE2-NE2 3.89Å; Y75-R274 WeakPolarHBondContact CA-O 3.41Å; Y75-F277 HydrophobicContact CD2-CD1 4.34Å; Y75-F277 HydrophobicContact CD2-CD2 4.19Å; Y75-F277 AromaticContact CD2-CE1 3.91Å; Y75-F277 HydrophobicContact CD2-CE1 3.91Å; Y75-F277 AromaticContact CD2-CE2 3.71Å; Y75-F277 HydrophobicContact CD2-CE2 3.71Å; Y75-F277 HydrophobicContact CD2-CG 4.48Å; Y75-F277 AromaticContact CD2-CZ 3.56Å; Y75-F277 HydrophobicContact CD2-CZ 3.56Å; Y75-F277 HydrophobicContact CE2-CE2 4.16Å; Y75-F277 HydrophobicContact CE2-CZ 4.2Å
76	C	90.9	Very high	86.5	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143	-173.8	-54.1	0	0	0	0	111	D89 E90 C91 R274 H275 F277	C76-D89 VanDerWaalsContact CB-OD1 3.29Å; C76-D89 WeakPolarHBondContact CB-OD1 3.41Å; C76-E90 WeakPolarHBondContact CA-O 3.31Å; C76-C91 HydrophobicContact CB-CB 4.06Å; C76-C91 WeakPolarHBondContact CB-SG 3.24Å; C76-C91 WeakPolarHBondContact SG-CB 3.44Å; C76-C91 CovalentContact SG-SG 2.04Å; C76-C91 PolarHBondContact SG-SG 2.98Å; C76-R274 HydrophobicContact CB-CB 4.03Å; C76-R274 PolarHBondContact N-O 2.84Å; C76-H275 WeakPolarHBondContact O-CA 3.31Å; C76-H275 PolarHBondContact O-ND1 3.01Å; C76-F277 VanDerWaalsContact O-CE1 3.31Å; C76-F277 WeakPolarHBondContact O-CE1 3.37Å
77	W	84.6	Confident	85.6	Confident	40 Å²	40	78.1 Å²	78.1	15%	0.152	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	161	174.6	70.3	87.3	0	0	0	111.4	Y75 E90 H92 H150 F277	Y75-W77 AromaticContact CD2-CE3 3.81Å; Y75-W77 HydrophobicContact CD2-CE3 3.81Å; Y75-W77 AromaticContact CD2-CZ3 3.86Å; Y75-W77 HydrophobicContact CD2-CZ3 3.86Å; Y75-W77 AromaticContact CE2-CE3 3.5Å; Y75-W77 HydrophobicContact CE2-CE3 3.5Å; Y75-W77 HydrophobicContact CE2-CH2 4.25Å; Y75-W77 AromaticContact CE2-CZ3 3.15Å; Y75-W77 HydrophobicContact CE2-CZ3 3.15Å; Y75-W77 AromaticContact CZ-CZ3 3.71Å; W77-E90 HydrophobicContact CZ2-CG 4.22Å; W77-E90 PolarHBondContact N-O 2.78Å; W77-E90 PolarHBondContact O-N 3.07Å; W77-H92 AromaticContact CH2-CD2 2.94Å; W77-H92 WeakPolarHBondContact CH2-CD2 3.36Å; W77-H92 AromaticContact CH2-CE1 3.73Å; W77-H92 AromaticContact CH2-CG 3.64Å; W77-H92 AromaticContact CH2-NE2 3.01Å; W77-H92 WeakPolarHBondContact CH2-NE2 3.3Å; W77-H92 AromaticContact CZ2-CD2 3.82Å; W77-H92 AromaticContact CZ2-NE2 3.57Å; W77-H92 HydrophobicContact CZ3-CB 4.1Å; W77-H92 AromaticContact CZ3-CD2 3.05Å; W77-H92 WeakPolarHBondContact CZ3-CD2 3.31Å; W77-H92 AromaticContact CZ3-CG 3.64Å; W77-H92 AromaticContact CZ3-NE2 3.69Å; W77-H150 AromaticContact CD2-CE1 3.72Å; W77-H150 AromaticContact CE2-CE1 3.82Å; W77-H150 AromaticContact CE3-CE1 3.83Å; W77-H150 AromaticContact CH2-CE1 3.93Å; W77-H150 AromaticContact CZ2-CE1 3.95Å; W77-H150 AromaticContact CZ3-CE1 3.95Å; W77-F277 HydrophobicContact CB-CZ 4.45Å
78	W	81.2	Confident	85	Confident	77 Å²	77	81.9 Å²	81.9	29%	0.292	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128	178.7	-59.8	107.2	0	0	0	111.5	F87 D89 D256 H275	W78-F87 HydrophobicContact CB-CD1 4.38Å; W78-F87 HydrophobicContact CE3-CB 4.38Å; W78-D89 HydrophobicContact CE3-CB 4.14Å; W78-D89 HydrophobicContact CH2-CB 4.18Å; W78-D89 HydrophobicContact CZ3-CB 3.71Å; W78-D256 VanDerWaalsContact CD1-O 3.3Å; W78-D256 PolarHBondContact NE1-O 2.89Å; W78-H275 AromaticContact CD1-CE1 3.87Å; W78-H275 AromaticContact CD1-ND1 3.71Å; W78-H275 AromaticContact CD2-CE1 3.97Å; W78-H275 AromaticContact CE2-CE1 3.35Å; W78-H275 AromaticContact CE2-ND1 3.86Å; W78-H275 AromaticContact CZ2-CE1 3.69Å; W78-H275 AromaticContact NE1-CE1 3.29Å; W78-H275 PolarHBondContact NE1-CE1 2.99Å; W78-H275 VanDerWaalsContact NE1-CE1 3.29Å; W78-H275 AromaticContact NE1-ND1 3.29Å; W78-H275 PolarHBondContact NE1-ND1 2.92Å
79	R	80	Confident	84.5	Confident	136 Å²	136	84.8 Å²	84.8	51%	0.513	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.5	171	-176.3	168.9	178.4	168.8	0	109.9	D81 F87 H88 E90	R79-D81 PolarHBondContact O-N 3.45Å; R79-F87 WeakPolarHBondContact O-CA 3.49Å; R79-H88 PolarHBondContact N-O 2.91Å; R79-H88 PolarHBondContact O-N 2.89Å; R79-H88 PolarHBondContact O-ND1 2.74Å; R79-E90 WeakPolarHBondContact CD-OE2 3.47Å; R79-E90 IonicContact CZ-OE2 3.91Å; R79-E90 IonicContact NE-OE2 3.93Å; R79-E90 IonicContact NH1-OE1 3.98Å; R79-E90 IonicContact NH1-OE2 3.02Å; R79-E90 PolarHBondContact NH1-OE2 3.12Å
80	R	77.8	Confident	84.2	Confident	170 Å²	170	80.9 Å²	80.9	64%	0.642	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.8	173	-172.2	178.8	-65.3	-179.1	1.4	109.1	F87	R80-F87 HydrophobicContact CB-CD1 4.07Å; R80-F87 HydrophobicContact CB-CE1 3.82Å; R80-F87 HydrophobicContact CB-CZ 4.43Å; R80-F87 HydrophobicContact CG-CE1 4.13Å; R80-F87 HydrophobicContact CG-CZ 4.26Å
81	D	76	Confident	84.3	Confident	45 Å²	45	75 Å²	75	24%	0.241	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	106.3	166.2	-172.8	-16.9	0	0	0	108.1	R79 A83 K84 S85 T86	R79-D81 PolarHBondContact O-N 3.45Å; D81-A83 PolarHBondContact O-N 2.77Å; D81-A83 WeakPolarHBondContact OD1-CB 3.49Å; D81-A83 PolarHBondContact OD1-N 2.96Å; D81-K84 HydrophobicContact CB-CB 4.48Å; D81-K84 PolarHBondContact O-N 3.47Å; D81-S85 WeakPolarHBondContact O-CA 3.36Å; D81-S85 PolarHBondContact O-N 2.98Å; D81-T86 WeakPolarHBondContact CB-O 3.39Å; D81-T86 PolarHBondContact N-O 2.89Å
82	E	78.5	Confident	84.3	Confident	178 Å²	178	74.7 Å²	74.7	83%	0.832	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-30.9	-179.9	-65.5	-172.8	159.2	0	0	112.2
83	A	79.6	Confident	84.3	Confident	94 Å²	94	77.1 Å²	77.1	78%	0.777	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-35	-176.4	0	0	0	0	0	112.5	D81	D81-A83 PolarHBondContact O-N 2.77Å; D81-A83 WeakPolarHBondContact OD1-CB 3.49Å; D81-A83 PolarHBondContact OD1-N 2.96Å
84	K	78.4	Confident	84.4	Confident	150 Å²	150	76 Å²	76	65%	0.652	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-7.7	-176.6	-68.6	179.5	-175.5	170.5	0	113.8	D81 T86	D81-K84 HydrophobicContact CB-CB 4.48Å; D81-K84 PolarHBondContact O-N 3.47Å; K84-T86 HydrophobicContact CB-CG2 4.06Å; K84-T86 WeakPolarHBondContact CB-OG1 3.44Å; K84-T86 PolarHBondContact O-N 3.1Å; K84-T86 VanDerWaalsContact O-N 3.1Å
85	S	74.7	Confident	84.4	Confident	99 Å²	99	78.4 Å²	78.4	69%	0.692	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	28.2	-167.3	-62.3	0	0	0	0	112.6	D81	D81-S85 WeakPolarHBondContact O-CA 3.36Å; D81-S85 PolarHBondContact O-N 2.98Å
86	T	79.9	Confident	84.4	Confident	48 Å²	48	81.3 Å²	81.3	29%	0.294	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	154.7	177.6	54.2	0	0	0	0	110	D81 K84	D81-T86 WeakPolarHBondContact CB-O 3.39Å; D81-T86 PolarHBondContact N-O 2.89Å; K84-T86 HydrophobicContact CB-CG2 4.06Å; K84-T86 WeakPolarHBondContact CB-OG1 3.44Å; K84-T86 PolarHBondContact O-N 3.1Å; K84-T86 VanDerWaalsContact O-N 3.1Å
87	F	76.5	Confident	84.4	Confident	66 Å²	66	81.9 Å²	81.9	29%	0.289	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139.2	171.8	-64.6	-98.1	0	0	0	109	W78 R79 R80 V260	W78-F87 HydrophobicContact CB-CD1 4.38Å; W78-F87 HydrophobicContact CE3-CB 4.38Å; R79-F87 WeakPolarHBondContact O-CA 3.49Å; R80-F87 HydrophobicContact CB-CD1 4.07Å; R80-F87 HydrophobicContact CB-CE1 3.82Å; R80-F87 HydrophobicContact CB-CZ 4.43Å; R80-F87 HydrophobicContact CG-CE1 4.13Å; R80-F87 HydrophobicContact CG-CZ 4.26Å; F87-V260 HydrophobicContact CD2-CG2 4.41Å
88	H	82.9	Confident	84.7	Confident	79 Å²	79	83.5 Å²	83.5	37%	0.366	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	151.7	172.3	63.5	-83.6	0	0	0	110.5	R79	R79-H88 PolarHBondContact N-O 2.91Å; R79-H88 PolarHBondContact O-N 2.89Å; R79-H88 PolarHBondContact O-ND1 2.74Å
89	D	84.3	Confident	85.2	Confident	67 Å²	67	82.4 Å²	82.4	36%	0.358	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.5	178.7	-162.6	16.4	0	0	0	109.6	C76 W78 H275	C76-D89 VanDerWaalsContact CB-OD1 3.29Å; C76-D89 WeakPolarHBondContact CB-OD1 3.41Å; W78-D89 HydrophobicContact CE3-CB 4.14Å; W78-D89 HydrophobicContact CH2-CB 4.18Å; W78-D89 HydrophobicContact CZ3-CB 3.71Å; D89-H275 IonicContact OD1-CE1 3.93Å; D89-H275 PolarHBondContact OD1-CE1 3.42Å; D89-H275 IonicContact OD1-NE2 3.92Å; D89-H275 PolarHBondContact OD1-NE2 2.68Å; D89-H275 IonicContact OD2-NE2 3.95Å
90	E	87.8	Confident	85.9	Confident	42 Å²	42	77.7 Å²	77.7	20%	0.196	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	112.1	176.2	-167.9	-178.6	152.5	0	0	108.8	C76 W77 R79 H92	C76-E90 WeakPolarHBondContact CA-O 3.31Å; W77-E90 HydrophobicContact CZ2-CG 4.22Å; W77-E90 PolarHBondContact N-O 2.78Å; W77-E90 PolarHBondContact O-N 3.07Å; R79-E90 WeakPolarHBondContact CD-OE2 3.47Å; R79-E90 IonicContact CZ-OE2 3.91Å; R79-E90 IonicContact NE-OE2 3.93Å; R79-E90 IonicContact NH1-OE1 3.98Å; R79-E90 IonicContact NH1-OE2 3.02Å; R79-E90 PolarHBondContact NH1-OE2 3.12Å; E90-H92 IonicContact OE1-CD2 2.96Å; E90-H92 IonicContact OE1-CE1 3.41Å; E90-H92 IonicContact OE1-NE2 2.94Å; E90-H92 PolarHBondContact OE1-NE2 3.04Å
91	C	91.8	Very high	86.7	Confident	61 Å²	61	70.5 Å²	70.5	41%	0.412	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.2	-176.9	-64.5	0	0	0	0	112.2	Y75 C76	Y75-C91 CarbonylContact O-C 3.59Å; Y75-C91 VanDerWaalsContact O-CA 3.31Å; Y75-C91 WeakPolarHBondContact O-CA 3.26Å; C76-C91 HydrophobicContact CB-CB 4.06Å; C76-C91 WeakPolarHBondContact CB-SG 3.24Å; C76-C91 WeakPolarHBondContact SG-CB 3.44Å; C76-C91 CovalentContact SG-SG 2.04Å; C76-C91 PolarHBondContact SG-SG 2.98Å
92	H	93	Very high	87.7	Confident	60 Å²	60	68.7 Å²	68.7	28%	0.278	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146.2	178.2	-73.5	-109.9	0	0	0	110.7	S74 Y75 W77 E90	S74-H92 CarbonylContact C-O 3.47Å; S74-H92 WeakPolarHBondContact CA-O 3.49Å; S74-H92 WeakPolarHBondContact CB-O 3.5Å; Y75-H92 HydrophobicContact CD1-CB 4.21Å; Y75-H92 HydrophobicContact CE1-CB 3.6Å; Y75-H92 HydrophobicContact CE2-CB 4.4Å; Y75-H92 PolarHBondContact N-O 3.22Å; Y75-H92 PolarHBondContact O-N 2.99Å; W77-H92 AromaticContact CH2-CD2 2.94Å; W77-H92 WeakPolarHBondContact CH2-CD2 3.36Å; W77-H92 AromaticContact CH2-CE1 3.73Å; W77-H92 AromaticContact CH2-CG 3.64Å; W77-H92 AromaticContact CH2-NE2 3.01Å; W77-H92 WeakPolarHBondContact CH2-NE2 3.3Å; W77-H92 AromaticContact CZ2-CD2 3.82Å; W77-H92 AromaticContact CZ2-NE2 3.57Å; W77-H92 HydrophobicContact CZ3-CB 4.1Å; W77-H92 AromaticContact CZ3-CD2 3.05Å; W77-H92 WeakPolarHBondContact CZ3-CD2 3.31Å; W77-H92 AromaticContact CZ3-CG 3.64Å; W77-H92 AromaticContact CZ3-NE2 3.69Å; E90-H92 IonicContact OE1-CD2 2.96Å; E90-H92 IonicContact OE1-CE1 3.41Å; E90-H92 IonicContact OE1-NE2 2.94Å; E90-H92 PolarHBondContact OE1-NE2 3.04Å
93	Q	94.3	Very high	88.5	Confident	153 Å²	153	63.6 Å²	63.6	72%	0.715	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.7	-178.3	-65.6	-176.4	-2.3	0	0	111.1	P95	Q93-P95 VanDerWaalsContact O-CD 3.26Å; Q93-P95 WeakPolarHBondContact O-CD 3.37Å
94	C	94.4	Very high	89.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	84.6	168.3	-55.2	0	0	0	0	107.9	C67 G68 P72 S73 D96 Y100	C67-C94 HydrophobicContact CB-CB 3.75Å; C67-C94 WeakPolarHBondContact CB-SG 3.31Å; C67-C94 WeakPolarHBondContact SG-CB 3.48Å; C67-C94 CovalentContact SG-SG 2.03Å; C67-C94 PolarHBondContact SG-SG 3.45Å; G68-C94 WeakPolarHBondContact CA-O 3.49Å; P72-C94 WeakPolarHBondContact CA-O 3.22Å; S73-C94 PolarHBondContact N-O 3.44Å; S73-C94 PolarHBondContact O-N 3.06Å; C94-D96 VanDerWaalsContact C-N 3.26Å; C94-D96 PolarHBondContact O-N 2.86Å; C94-Y100 HydrophobicContact CB-CD2 4.33Å
95	P	93.8	Very high	90.1	Very high	74 Å²	74	56.7 Å²	56.7	48%	0.481	32%	0.317	S	S	.	.			trans	-66.3	-32.5	-176.6	27.1	-34.5	0	0	0	112	Q93	Q93-P95 VanDerWaalsContact O-CD 3.26Å; Q93-P95 WeakPolarHBondContact O-CD 3.37Å
96	D	92.9	Very high	91.2	Very high	68 Å²	68	52.2 Å²	52.2	36%	0.364	29%	0.285	S	S	.	.	S	Bend	trans	-144.6	167.8	178.9	63.6	41	0	0	0	111.6	G68 C94 S98 T99	G68-D96 CarbonylContact O-C 3.6Å; C94-D96 VanDerWaalsContact C-N 3.26Å; C94-D96 PolarHBondContact O-N 2.86Å; D96-S98 VanDerWaalsContact CG-OG 3.26Å; D96-S98 PolarHBondContact O-N 2.95Å; D96-S98 WeakPolarHBondContact OD1-CA 3.17Å; D96-S98 WeakPolarHBondContact OD1-CB 3.35Å; D96-S98 PolarHBondContact OD1-N 3.11Å; D96-S98 PolarHBondContact OD1-OG 3.41Å; D96-S98 PolarHBondContact OD2-OG 2.87Å; D96-T99 PolarHBondContact OD1-N 3.17Å; D96-T99 PolarHBondContact OD1-OG1 3.18Å
97	G	90.4	Very high	91.8	Very high	12 Å²	12	51.7 Å²	51.7	12%	0.124	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-2.9	177.9	0	0	0	0	0	114.9	G68	G68-G97 PolarHBondContact O-N 2.95Å
98	S	91	Very high	92.5	Very high	75 Å²	75	55.3 Å²	55.3	52%	0.524	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-30.7	-178.1	81.2	0	0	0	0	112.4	D96 Y100 A101	D96-S98 VanDerWaalsContact CG-OG 3.26Å; D96-S98 PolarHBondContact O-N 2.95Å; D96-S98 WeakPolarHBondContact OD1-CA 3.17Å; D96-S98 WeakPolarHBondContact OD1-CB 3.35Å; D96-S98 PolarHBondContact OD1-N 3.11Å; D96-S98 PolarHBondContact OD1-OG 3.41Å; D96-S98 PolarHBondContact OD2-OG 2.87Å; S98-Y100 PolarHBondContact O-N 3.1Å; S98-A101 PolarHBondContact O-N 2.87Å
99	T	90.9	Very high	92.5	Very high	53 Å²	53	53.9 Å²	53.9	33%	0.325	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-48.3	-175.3	-55.7	0	0	0	0	111.5	D96	D96-T99 PolarHBondContact OD1-N 3.17Å; D96-T99 PolarHBondContact OD1-OG1 3.18Å
100	Y	94.3	Very high	92.6	Very high	38 Å²	38	53.9 Å²	53.9	15%	0.149	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	38.9	-179.5	-58.8	-81.3	0	0	0	112.3	T66 Y75 C94 S98 C116 W117 V118	T66-Y100 WeakPolarHBondContact CG2-O 3.39Å; Y75-Y100 HydrophobicContact CE1-CD2 4.5Å; Y75-Y100 HydrophobicContact CE1-CE1 4.25Å; Y75-Y100 AromaticContact CE1-CE2 3.91Å; Y75-Y100 HydrophobicContact CE1-CE2 3.91Å; Y75-Y100 AromaticContact CE1-CZ 3.76Å; Y75-Y100 WeakPolarHBondContact OH-CE1 3.46Å; Y75-Y100 PolarHBondContact OH-OH 3.25Å; C94-Y100 HydrophobicContact CB-CD2 4.33Å; S98-Y100 PolarHBondContact O-N 3.1Å; Y100-C116 WeakPolarHBondContact CD1-O 3.32Å; Y100-W117 WeakPolarHBondContact O-CA 3.05Å; Y100-W117 VanDerWaalsContact O-CD1 3.23Å; Y100-V118 HydrophobicContact CD1-CB 4.35Å; Y100-V118 HydrophobicContact CD1-CG2 3.64Å; Y100-V118 HydrophobicContact CE1-CG2 4.25Å; Y100-V118 HydrophobicContact CG-CB 4.14Å; Y100-V118 HydrophobicContact CG-CG2 3.94Å; Y100-V118 PolarHBondContact O-N 3.35Å
101	A	95.7	Very high	92.4	Very high	18 Å²	18	57.3 Å²	57.3	15%	0.149	32%	0.323	C	S	.	.			trans	-64	153	-175.7	0	0	0	0	0	113.7	S98 S103 R104	S98-A101 PolarHBondContact O-N 2.87Å; A101-S103 PolarHBondContact O-N 3.07Å; A101-S103 VanDerWaalsContact O-N 3.08Å; A101-R104 WeakPolarHBondContact O-CB 3.25Å; A101-R104 WeakPolarHBondContact O-CG 3.31Å; A101-R104 PolarHBondContact O-N 2.98Å
102	A	96.7	Very high	92.1	Very high	8 Å²	8	63.1 Å²	63.1	7%	0.066	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-63.5	-16	178	0	0	0	0	0	113.9	V61 R104 L105	V61-A102 HydrophobicContact CB-CB 4.18Å; V61-A102 HydrophobicContact CG1-CB 4.29Å; V61-A102 WeakPolarHBondContact O-CB 3.04Å; A102-R104 PolarHBondContact O-N 3Å; A102-L105 HydrophobicContact CB-CD1 4.24Å; A102-L105 WeakPolarHBondContact O-CB 3.29Å; A102-L105 WeakPolarHBondContact O-CG 3.49Å; A102-L105 PolarHBondContact O-N 3.38Å
103	S	95.6	Very high	91.9	Very high	71 Å²	71	65.8 Å²	65.8	50%	0.497	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-63.4	-20.8	172.6	55.1	0	0	0	0	113.5	A101 L105 T106	A101-S103 PolarHBondContact O-N 3.07Å; A101-S103 VanDerWaalsContact O-N 3.08Å; S103-L105 VanDerWaalsContact C-N 3.28Å; S103-L105 PolarHBondContact O-N 3.16Å; S103-T106 PolarHBondContact O-OG1 2.78Å
104	R	95	Very high	91.6	Very high	98 Å²	98	61.5 Å²	61.5	37%	0.37	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-66.9	-28.2	175.4	-59.9	-57.1	-174.6	177.6	-2.1	112.7	A101 A102 T106 D107	A101-R104 WeakPolarHBondContact O-CB 3.25Å; A101-R104 WeakPolarHBondContact O-CG 3.31Å; A101-R104 PolarHBondContact O-N 2.98Å; A102-R104 PolarHBondContact O-N 3Å; R104-T106 PolarHBondContact O-N 3.5Å; R104-D107 PolarHBondContact O-N 3.09Å; R104-D107 VanDerWaalsContact O-OD1 3.08Å
105	L	96.8	Very high	91.6	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-61.3	-18.8	-179.2	-65.6	170.2	0	0	0	114.5	V61 A102 S103 W117 L131 M280 D282 L283	V61-L105 HydrophobicContact CB-CD1 4.35Å; V61-L105 HydrophobicContact CG1-CD1 3.93Å; V61-L105 HydrophobicContact CG2-CB 4.42Å; A102-L105 HydrophobicContact CB-CD1 4.24Å; A102-L105 WeakPolarHBondContact O-CB 3.29Å; A102-L105 WeakPolarHBondContact O-CG 3.49Å; A102-L105 PolarHBondContact O-N 3.38Å; S103-L105 VanDerWaalsContact C-N 3.28Å; S103-L105 PolarHBondContact O-N 3.16Å; L105-W117 HydrophobicContact CD1-CB 4.23Å; L105-W117 HydrophobicContact CD1-CD2 4.4Å; L105-W117 HydrophobicContact CD1-CG 4.25Å; L105-W117 HydrophobicContact CD2-CB 3.84Å; L105-W117 HydrophobicContact CD2-CE3 4.4Å; L105-W117 HydrophobicContact CG-CB 3.79Å; L105-W117 HydrophobicContact CG-CG 4.35Å; L105-L131 HydrophobicContact CD1-CD1 3.66Å; L105-L131 HydrophobicContact CD1-CD2 3.78Å; L105-L131 HydrophobicContact CD1-CG 4.29Å; L105-M280 HydrophobicContact CD2-CB 3.55Å; L105-M280 HydrophobicContact CD2-CG 3.5Å; L105-M280 VanDerWaalsContact CD2-CG 3.5Å; L105-M280 VanDerWaalsContact CD2-O 3.27Å; L105-M280 WeakPolarHBondContact CD2-O 3.45Å; L105-M280 HydrophobicContact CD2-SD 3.72Å; L105-D282 CarbonylContact O-C 3.55Å; L105-L283 HydrophobicContact CB-CB 4.11Å; L105-L283 PolarHBondContact O-N 3.44Å
106	T	96.6	Very high	91.6	Very high	6 Å²	6	60.6 Å²	60.6	4%	0.037	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-129.9	15.3	-172.9	54.3	0	0	0	0	111.7	A56 G58 K59 V61 S103 R104	A56-T106 HydrophobicContact CB-CG2 4.03Å; A56-T106 VanDerWaalsContact O-CB 3.23Å; A56-T106 WeakPolarHBondContact O-CB 3.17Å; A56-T106 VanDerWaalsContact O-CG2 3.24Å; A56-T106 WeakPolarHBondContact O-CG2 3.46Å; G58-T106 PolarHBondContact N-O 3.23Å; K59-T106 PolarHBondContact O-OG1 2.82Å; V61-T106 HydrophobicContact CG2-CG2 3.66Å; S103-T106 PolarHBondContact O-OG1 2.78Å; R104-T106 PolarHBondContact O-N 3.5Å
107	D	94.1	Very high	91.7	Very high	37 Å²	37	57.4 Å²	57.4	20%	0.198	32%	0.321	C	S	.	.	S	Bend	trans	-77.1	-173.7	178.4	70.7	13.6	0	0	0	111.4	R104 N109 T115	R104-D107 PolarHBondContact O-N 3.09Å; R104-D107 VanDerWaalsContact O-OD1 3.08Å; D107-N109 PolarHBondContact O-N 2.81Å; D107-N109 VanDerWaalsContact O-N 3.1Å; D107-T115 PolarHBondContact OD1-OG1 3.45Å; D107-T115 WeakPolarHBondContact OD2-CB 3.23Å; D107-T115 PolarHBondContact OD2-OG1 2.78Å
108	L	90.7	Very high	92	Very high	141 Å²	141	56.8 Å²	56.8	74%	0.738	32%	0.316	S	S	*	.			trans	-76.8	96.5	173.9	-177.3	66.3	0	0	0	109.1	F57 N110	F57-L108 HydrophobicContact CE2-CB 4.21Å; F57-L108 HydrophobicContact CE2-CD1 4.09Å; F57-L108 HydrophobicContact CZ-CD1 4.34Å; L108-N110 PolarHBondContact O-N 3.04Å; L108-N110 VanDerWaalsContact O-N 3.1Å
109	N	83.3	Confident	92.2	Very high	50 Å²	50	53.3 Å²	53.3	27%	0.267	29%	0.291	S	S	.	.			trans	-60.5	112.3	179.2	-172.2	-5.3	0	0	0	111.1	D107	D107-N109 PolarHBondContact O-N 2.81Å; D107-N109 VanDerWaalsContact O-N 3.1Å
110	N	85.5	Confident	92.3	Very high	67 Å²	67	53.1 Å²	53.1	36%	0.358	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-108.8	115.1	173.9	-179.9	1.8	0	0	0	109.4	L108 Q112 N113 V114	L108-N110 PolarHBondContact O-N 3.04Å; L108-N110 VanDerWaalsContact O-N 3.1Å; N110-Q112 PolarHBondContact O-N 2.86Å; N110-Q112 PolarHBondContact OD1-N 2.88Å; N110-N113 CarbonylContact O-C 3.16Å; N110-N113 PolarHBondContact O-N 2.81Å; N110-V114 PolarHBondContact O-N 3.39Å
111	P	82.7	Confident	92.1	Very high	114 Å²	114	52.2 Å²	52.2	74%	0.74	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.3	177.4	-26	34.6	0	0	0	114.7
112	Q	85.9	Confident	91.6	Very high	183 Å²	183	53.7 Å²	53.7	86%	0.855	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.9	177.5	-62.6	-172.7	-12.7	0	0	113.6	N110	N110-Q112 PolarHBondContact O-N 2.86Å; N110-Q112 PolarHBondContact OD1-N 2.88Å
113	N	88.6	Confident	90.6	Very high	116 Å²	116	56.5 Å²	56.5	62%	0.62	31%	0.311	S	S	*	.	B	Isolated β-bridge	trans	-144.2	74.8	-178.3	-172.5	14.8	0	0	0	109.1	N110 T115	N110-N113 CarbonylContact O-C 3.16Å; N110-N113 PolarHBondContact O-N 2.81Å; N113-T115 PolarHBondContact O-N 2.87Å
114	V	89.2	Confident	89.6	Confident	63 Å²	63	55.8 Å²	55.8	38%	0.382	30%	0.302	S	S	.	.			trans	-75.1	120	-176.3	-178.4	0	0	0	0	109.1	N110 A281	N110-V114 PolarHBondContact O-N 3.39Å; V114-A281 HydrophobicContact CG1-CB 3.53Å
115	T	93.1	Very high	88	Confident	32 Å²	32	56.6 Å²	56.6	20%	0.196	31%	0.313	C	S	.	.			trans	-86.7	151.2	170.2	53.5	0	0	0	0	109.6	D107 N113 A281	D107-T115 PolarHBondContact OD1-OG1 3.45Å; D107-T115 WeakPolarHBondContact OD2-CB 3.23Å; D107-T115 PolarHBondContact OD2-OG1 2.78Å; N113-T115 PolarHBondContact O-N 2.87Å; T115-A281 VanDerWaalsContact O-CA 3.27Å; T115-A281 WeakPolarHBondContact O-CA 3.44Å; T115-A281 WeakPolarHBondContact O-CB 3.36Å
116	C	93.9	Very high	86.5	Confident	23 Å²	23	64.1 Å²	64.1	16%	0.155	35%	0.353	C	S	.	.			trans	-132.6	138	-178.4	-66.7	0	0	0	0	110.7	Y100 V118 C149	Y100-C116 WeakPolarHBondContact CD1-O 3.32Å; C116-V118 HydrophobicContact CB-CG2 4.44Å; C116-C149 HydrophobicContact CB-CB 4.11Å; C116-C149 WeakPolarHBondContact CB-SG 3.03Å; C116-C149 WeakPolarHBondContact SG-CB 3.47Å; C116-C149 CovalentContact SG-SG 2.03Å; C116-C149 PolarHBondContact SG-SG 2.73Å
117	W	96.6	Very high	85.6	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	141.7	155.4	163.6	76.9	0	0	0	109.1	S63 S65 T66 Y100 L105 V129 L131 F247 S279 M280	S63-W117 WeakPolarHBondContact OG-CZ2 3.3Å; S65-W117 VanDerWaalsContact O-CZ2 3.25Å; S65-W117 WeakPolarHBondContact O-CZ2 3.41Å; S65-W117 PolarHBondContact O-NE1 2.89Å; T66-W117 PolarHBondContact OG1-NE1 2.74Å; Y100-W117 WeakPolarHBondContact O-CA 3.05Å; Y100-W117 VanDerWaalsContact O-CD1 3.23Å; L105-W117 HydrophobicContact CD1-CB 4.23Å; L105-W117 HydrophobicContact CD1-CD2 4.4Å; L105-W117 HydrophobicContact CD1-CG 4.25Å; L105-W117 HydrophobicContact CD2-CB 3.84Å; L105-W117 HydrophobicContact CD2-CE3 4.4Å; L105-W117 HydrophobicContact CG-CB 3.79Å; L105-W117 HydrophobicContact CG-CG 4.35Å; W117-V129 HydrophobicContact CH2-CG1 3.72Å; W117-V129 HydrophobicContact CZ2-CG1 3.82Å; W117-L131 HydrophobicContact CD2-CD2 4.2Å; W117-L131 HydrophobicContact CE3-CD1 4.15Å; W117-L131 HydrophobicContact CE3-CD2 4.46Å; W117-L131 HydrophobicContact CH2-CD1 4.17Å; W117-L131 HydrophobicContact CH2-CD2 4.06Å; W117-L131 HydrophobicContact CH2-CG 4.2Å; W117-L131 HydrophobicContact CZ2-CD2 3.78Å; W117-L131 HydrophobicContact CZ2-CG 4.4Å; W117-L131 HydrophobicContact CZ3-CD1 3.9Å; W117-L131 HydrophobicContact CZ3-CD2 4.4Å; W117-L131 HydrophobicContact CZ3-CG 4.42Å; W117-F247 HydrophobicContact CH2-CD2 4.34Å; W117-F247 AromaticContact CH2-CE2 3.96Å; W117-F247 HydrophobicContact CH2-CE2 3.96Å; W117-F247 AromaticContact CZ3-CE2 3.98Å; W117-F247 HydrophobicContact CZ3-CE2 3.98Å; W117-S279 CarbonylContact O-C 3.37Å; W117-S279 WeakPolarHBondContact O-CA 3.12Å; W117-M280 HydrophobicContact CE3-CB 4.06Å; W117-M280 HydrophobicContact CZ3-CB 4.49Å; W117-M280 PolarHBondContact N-O 2.83Å; W117-M280 PolarHBondContact O-N 2.79Å
118	V	95.6	Very high	85.6	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.8	179.3	-178	0	0	0	0	108.7	T66 C67 Y75 Y100 C116 F277 Y278	T66-V118 WeakPolarHBondContact CA-O 3.47Å; C67-V118 HydrophobicContact CB-CB 4.22Å; C67-V118 HydrophobicContact CB-CG1 4.08Å; C67-V118 PolarHBondContact N-O 3.28Å; Y75-V118 HydrophobicContact CD1-CG1 4.04Å; Y75-V118 HydrophobicContact CD2-CG1 4.33Å; Y75-V118 HydrophobicContact CE1-CG1 4.3Å; Y75-V118 HydrophobicContact CE1-CG2 4.36Å; Y75-V118 HydrophobicContact CE2-CG2 4.49Å; Y75-V118 HydrophobicContact CG-CG1 4.06Å; Y100-V118 HydrophobicContact CD1-CB 4.35Å; Y100-V118 HydrophobicContact CD1-CG2 3.64Å; Y100-V118 HydrophobicContact CE1-CG2 4.25Å; Y100-V118 HydrophobicContact CG-CB 4.14Å; Y100-V118 HydrophobicContact CG-CG2 3.94Å; Y100-V118 PolarHBondContact O-N 3.35Å; C116-V118 HydrophobicContact CB-CG2 4.44Å; V118-F277 HydrophobicContact CG1-CB 4.45Å; V118-F277 HydrophobicContact CG1-CD2 3.78Å; V118-F277 HydrophobicContact CG1-CE2 4.45Å; V118-F277 HydrophobicContact CG1-CG 4.33Å; V118-Y278 WeakPolarHBondContact CA-O 3.5Å
119	S	95.2	Very high	85.8	Confident	1 Å²	1	68 Å²	68	1%	0.007	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-76.5	161.8	174.5	75.4	0	0	0	0	111.7	P121 Y278	S119-P121 WeakPolarHBondContact O-CD 3.39Å; S119-Y278 PolarHBondContact N-O 3.02Å; S119-Y278 PolarHBondContact OG-N 3.4Å
120	E	93.5	Very high	86.4	Confident	49 Å²	49	67.2 Å²	67.2	23%	0.229	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-57.8	128.4	169.8	-163.7	66.9	-131.5	0	0	110.3	S65 G68 S73 S122	S65-E120 WeakPolarHBondContact OG-CB 3.18Å; S65-E120 PolarHBondContact OG-N 2.85Å; G68-E120 PolarHBondContact N-OE2 2.79Å; S73-E120 WeakPolarHBondContact CB-OE1 3.36Å; S73-E120 PolarHBondContact OG-OE1 2.84Å; E120-S122 PolarHBondContact O-N 3.2Å
121	P	90.8	Very high	87	Confident	20 Å²	20	64.1 Å²	64.1	13%	0.13	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-66.9	129.4	175.2	-20.8	33.8	0	0	0	111.3	S119 P273 Y276 F277	S119-P121 WeakPolarHBondContact O-CD 3.39Å; P121-P273 WeakPolarHBondContact CB-O 3.42Å; P121-Y276 WeakPolarHBondContact CA-O 3.29Å; P121-F277 HydrophobicContact CB-CB 4.43Å; P121-F277 HydrophobicContact CG-CB 4.33Å
122	S	85.2	Confident	87.8	Confident	48 Å²	48	60 Å²	60	34%	0.336	32%	0.315	S	S	.	.			trans	-160	133	-174.4	172.4	0	0	0	0	111.8	E120 D124 Y276	E120-S122 PolarHBondContact O-N 3.2Å; S122-D124 PolarHBondContact O-N 2.85Å; S122-D124 VanDerWaalsContact OG-CB 3.3Å; S122-D124 WeakPolarHBondContact OG-CB 3.46Å; S122-D124 PolarHBondContact OG-N 2.84Å; S122-D124 VanDerWaalsContact OG-N 3.08Å; S122-Y276 PolarHBondContact N-O 2.86Å; S122-Y276 WeakPolarHBondContact O-CB 3.43Å
123	T	75.9	Confident	88.4	Confident	68 Å²	68	51.3 Å²	51.3	42%	0.417	27%	0.274	S	S	.	.			trans	-79.2	-5.1	169.9	44.1	0	0	0	0	113.6	N125 P273 Y276	T123-N125 VanDerWaalsContact C-N 3.28Å; T123-N125 PolarHBondContact O-N 2.91Å; T123-P273 HydrophobicContact CG2-CB 3.65Å; T123-Y276 HydrophobicContact CG2-CD2 3.97Å; T123-Y276 HydrophobicContact CG2-CE2 4.23Å; T123-Y276 HydrophobicContact CG2-CG 4.32Å
124	D	73	Confident	88.8	Confident	56 Å²	56	48.6 Å²	48.6	30%	0.299	27%	0.265	S	S	.	.			trans	-68.5	84.5	177.4	-169.9	2.5	0	0	0	111.1	S122 L126 R127	S122-D124 PolarHBondContact O-N 2.85Å; S122-D124 VanDerWaalsContact OG-CB 3.3Å; S122-D124 WeakPolarHBondContact OG-CB 3.46Å; S122-D124 PolarHBondContact OG-N 2.84Å; S122-D124 VanDerWaalsContact OG-N 3.08Å; D124-L126 PolarHBondContact O-N 3.13Å; D124-L126 VanDerWaalsContact OD1-CB 3.29Å; D124-L126 WeakPolarHBondContact OD1-CB 3.43Å; D124-L126 PolarHBondContact OD1-N 3.27Å; D124-L126 VanDerWaalsContact OD1-N 3.13Å; D124-R127 HydrophobicContact CB-CG 4.49Å; D124-R127 PolarHBondContact O-N 2.92Å; D124-R127 VanDerWaalsContact O-N 3.11Å; D124-R127 WeakPolarHBondContact OD2-CD 3.41Å; D124-R127 VanDerWaalsContact OD2-CG 3.23Å; D124-R127 WeakPolarHBondContact OD2-CG 3.36Å; D124-R127 IonicContact OD2-CZ 3.83Å; D124-R127 IonicContact OD2-NE 3.89Å; D124-R127 PolarHBondContact OD2-NE 3.41Å
125	N	62.1	Low	89.2	Confident	114 Å²	114	45.7 Å²	45.7	61%	0.61	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-10.1	175.6	-74.1	-23.6	0	0	0	113.3	T123	T123-N125 VanDerWaalsContact C-N 3.28Å; T123-N125 PolarHBondContact O-N 2.91Å
126	L	64.7	Low	89.3	Confident	158 Å²	158	46.4 Å²	46.4	83%	0.827	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-14.5	177.5	-60.3	165.6	0	0	0	112.3	D124	D124-L126 PolarHBondContact O-N 3.13Å; D124-L126 VanDerWaalsContact OD1-CB 3.29Å; D124-L126 WeakPolarHBondContact OD1-CB 3.43Å; D124-L126 PolarHBondContact OD1-N 3.27Å; D124-L126 VanDerWaalsContact OD1-N 3.13Å
127	R	79.3	Confident	89.4	Confident	170 Å²	170	45.3 Å²	45.3	64%	0.642	25%	0.253	S	S	*	.			trans	-95.1	108.2	-177.4	-76.4	179.5	-168.7	-159.4	-3.9	112.2	D124	D124-R127 HydrophobicContact CB-CG 4.49Å; D124-R127 PolarHBondContact O-N 2.92Å; D124-R127 VanDerWaalsContact O-N 3.11Å; D124-R127 WeakPolarHBondContact OD2-CD 3.41Å; D124-R127 VanDerWaalsContact OD2-CG 3.23Å; D124-R127 WeakPolarHBondContact OD2-CG 3.36Å; D124-R127 IonicContact OD2-CZ 3.83Å; D124-R127 IonicContact OD2-NE 3.89Å; D124-R127 PolarHBondContact OD2-NE 3.41Å
128	N	92.6	Very high	89.5	Confident	84 Å²	84	48.1 Å²	48.1	45%	0.449	27%	0.266	S	S	.	.			trans	-65.9	132.1	167.7	-70	-31	0	0	0	111.5	I246 F247 S248	N128-I246 HydrophobicContact CB-CG2 3.73Å; N128-F247 VanDerWaalsContact CA-O 3.27Å; N128-F247 WeakPolarHBondContact CA-O 3.04Å; N128-S248 WeakPolarHBondContact OD1-CA 3.21Å; N128-S248 WeakPolarHBondContact OD1-CB 3.33Å; N128-S248 PolarHBondContact OD1-OG 2.83Å
129	V	95.1	Very high	89.7	Confident	12 Å²	12	48.9 Å²	48.9	7%	0.073	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.1	170.3	178.8	0	0	0	0	108.8	W117 I246 F247 Y278	W117-V129 HydrophobicContact CH2-CG1 3.72Å; W117-V129 HydrophobicContact CZ2-CG1 3.82Å; V129-I246 CarbonylContact O-C 3.55Å; V129-I246 WeakPolarHBondContact O-CA 3.37Å; V129-F247 HydrophobicContact CB-CB 4.42Å; V129-F247 HydrophobicContact CB-CD2 4.17Å; V129-F247 HydrophobicContact CG1-CD2 4.19Å; V129-F247 PolarHBondContact N-O 2.77Å; V129-F247 WeakPolarHBondContact O-CD2 3.32Å; V129-F247 PolarHBondContact O-N 3.12Å; V129-Y278 HydrophobicContact CB-CD2 3.93Å; V129-Y278 HydrophobicContact CB-CE2 4.17Å; V129-Y278 HydrophobicContact CG2-CD2 3.79Å; V129-Y278 HydrophobicContact CG2-CE2 3.92Å
130	T	97.1	Very high	89.8	Confident	34 Å²	34	50.1 Å²	50.1	21%	0.209	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.8	-173.2	66.4	0	0	0	0	111.7	S63 S64 V245 I246	S63-T130 CarbonylContact C-O 3.33Å; S63-T130 WeakPolarHBondContact CA-O 3.06Å; S64-T130 VanDerWaalsContact CB-OG1 3.31Å; S64-T130 WeakPolarHBondContact CB-OG1 3.07Å; S64-T130 PolarHBondContact N-O 2.95Å; S64-T130 PolarHBondContact OG-N 3.28Å; S64-T130 PolarHBondContact OG-OG1 2.8Å; T130-V245 CarbonylContact C-O 3.5Å; T130-V245 VanDerWaalsContact CA-O 3.26Å; T130-V245 WeakPolarHBondContact CA-O 3.4Å; T130-I246 HydrophobicContact CG2-CB 4.38Å; T130-I246 HydrophobicContact CG2-CD1 4.48Å; T130-I246 HydrophobicContact CG2-CG1 3.95Å; T130-I246 HydrophobicContact CG2-CG2 4.13Å
131	L	98.4	Very high	90	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.2	168.8	-63.8	172.9	0	0	0	108.4	V61 V62 L105 W117 R244 V245 F247 M280	V61-L131 HydrophobicContact CG1-CB 4.04Å; V61-L131 HydrophobicContact CG1-CD2 4.06Å; V62-L131 CarbonylContact O-C 3.49Å; V62-L131 WeakPolarHBondContact O-CA 3.26Å; L105-L131 HydrophobicContact CD1-CD1 3.66Å; L105-L131 HydrophobicContact CD1-CD2 3.78Å; L105-L131 HydrophobicContact CD1-CG 4.29Å; W117-L131 HydrophobicContact CD2-CD2 4.2Å; W117-L131 HydrophobicContact CE3-CD1 4.15Å; W117-L131 HydrophobicContact CE3-CD2 4.46Å; W117-L131 HydrophobicContact CH2-CD1 4.17Å; W117-L131 HydrophobicContact CH2-CD2 4.06Å; W117-L131 HydrophobicContact CH2-CG 4.2Å; W117-L131 HydrophobicContact CZ2-CD2 3.78Å; W117-L131 HydrophobicContact CZ2-CG 4.4Å; W117-L131 HydrophobicContact CZ3-CD1 3.9Å; W117-L131 HydrophobicContact CZ3-CD2 4.4Å; W117-L131 HydrophobicContact CZ3-CG 4.42Å; L131-R244 CarbonylContact O-C 3.53Å; L131-R244 WeakPolarHBondContact O-CA 3.23Å; L131-V245 HydrophobicContact CB-CB 4.48Å; L131-V245 PolarHBondContact N-O 2.64Å; L131-V245 PolarHBondContact O-N 2.97Å; L131-F247 HydrophobicContact CD1-CE2 3.68Å; L131-F247 HydrophobicContact CD1-CZ 4Å; L131-F247 HydrophobicContact CG-CE2 4.02Å; L131-M280 HydrophobicContact CD1-CE 4.43Å; L131-M280 HydrophobicContact CD1-SD 4.4Å
132	T	98.4	Very high	90.4	Very high	26 Å²	26	50.3 Å²	50.3	16%	0.16	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.8	178	-56.6	0	0	0	0	110.2	V62 W168 I243 R244	V62-T132 PolarHBondContact N-O 2.85Å; V62-T132 PolarHBondContact O-N 3.44Å; T132-W168 HydrophobicContact CG2-CH2 3.97Å; T132-W168 HydrophobicContact CG2-CZ2 4.25Å; T132-I243 WeakPolarHBondContact CA-O 3.43Å; T132-R244 PolarHBondContact OG1-NE 2.87Å
133	L	98.4	Very high	91	Very high	1 Å²	1	52 Å²	52	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.8	-179.2	169.7	66.5	0	0	0	109.6	A56 K59 V61 L135 D242 I243 L283 V285	A56-L133 HydrophobicContact CB-CD2 3.57Å; K59-L133 HydrophobicContact CB-CD1 3.52Å; K59-L133 HydrophobicContact CG-CD1 4.41Å; V61-L133 HydrophobicContact CG2-CB 4.48Å; V61-L133 HydrophobicContact CG2-CD1 4.1Å; L133-L135 HydrophobicContact CD2-CD2 3.95Å; L133-L135 HydrophobicContact CG-CD2 4.08Å; L133-D242 CarbonylContact O-C 3.49Å; L133-D242 VanDerWaalsContact O-CA 3.26Å; L133-D242 WeakPolarHBondContact O-CA 3.44Å; L133-I243 PolarHBondContact N-O 3.37Å; L133-I243 PolarHBondContact O-N 2.83Å; L133-L283 HydrophobicContact CB-CD2 4.46Å; L133-L283 HydrophobicContact CD2-CD2 4.21Å; L133-V285 HydrophobicContact CD2-CG2 3.8Å
134	S	98	Very high	92.1	Very high	60 Å²	60	48.8 Å²	48.8	42%	0.42	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120	174.3	-70.3	0	0	0	0	110.8	D242	S134-D242 WeakPolarHBondContact CA-OD1 3.21Å; S134-D242 WeakPolarHBondContact CB-OD1 3.01Å; S134-D242 PolarHBondContact OG-OD1 2.02Å
135	L	97.3	Very high	93.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-22.6	-177.6	-55.8	178.2	0	0	0	112.2	A55 K59 L133 K137 Y139 V240 T241 V285	A55-L135 HydrophobicContact CB-CD1 4.42Å; A55-L135 HydrophobicContact CB-CD2 4.02Å; K59-L135 PolarHBondContact NZ-O 3.29Å; L133-L135 HydrophobicContact CD2-CD2 3.95Å; L133-L135 HydrophobicContact CG-CD2 4.08Å; L135-K137 PolarHBondContact O-N 3.1Å; L135-Y139 HydrophobicContact CB-CD2 3.93Å; L135-Y139 HydrophobicContact CB-CE2 4.03Å; L135-Y139 HydrophobicContact CD1-CD2 3.81Å; L135-Y139 HydrophobicContact CD1-CG 4.21Å; L135-Y139 HydrophobicContact CG-CD2 4.48Å; L135-V240 HydrophobicContact CD1-CG1 4.24Å; L135-T241 VanDerWaalsContact CB-O 3.3Å; L135-T241 WeakPolarHBondContact CB-O 3.5Å; L135-T241 WeakPolarHBondContact CG-O 3.1Å; L135-T241 PolarHBondContact N-O 2.88Å; L135-V285 HydrophobicContact CD1-CG1 4.44Å
136	G	94.5	Very high	94.8	Very high	48 Å²	48	40.9 Å²	40.9	50%	0.495	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	76.4	2.5	-179.8	0	0	0	0	0	114.6
137	K	96.7	Very high	96.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	160.7	173.9	-179.4	170.9	171.4	55.6	0	109.4	L135 Y139 C289 K290 C298 L306 C308 V317 D318	L135-K137 PolarHBondContact O-N 3.1Å; K137-Y139 HydrophobicContact CB-CE2 4.08Å; K137-Y139 WeakPolarHBondContact O-CD2 3.48Å; K137-C289 WeakPolarHBondContact CD-SG 3.27Å; K137-C289 WeakPolarHBondContact CE-SG 3.36Å; K137-K290 PolarHBondContact NZ-O 3.29Å; K137-C298 VanDerWaalsContact CE-SG 3.53Å; K137-L306 HydrophobicContact CB-CB 4.29Å; K137-L306 HydrophobicContact CB-CD2 4.38Å; K137-L306 HydrophobicContact CD-CB 4.01Å; K137-L306 HydrophobicContact CD-CD2 3.93Å; K137-L306 HydrophobicContact CD-CG 3.83Å; K137-L306 WeakPolarHBondContact CD-O 3.1Å; K137-C308 PolarHBondContact NZ-SG 3.32Å; K137-C308 VanDerWaalsContact NZ-SG 3.37Å; K137-V317 PolarHBondContact NZ-O 2.77Å; K137-D318 IonicContact NZ-OD1 3.32Å; K137-D318 PolarHBondContact NZ-OD1 3.06Å
138	K	98.3	Very high	96.8	Very high	59 Å²	59	27.6 Å²	27.6	26%	0.257	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	128.1	167.5	-68.2	-174.5	-175.1	179.6	0	111.7	M162 T239 V240 T241 K290 D318	K138-M162 WeakPolarHBondContact CE-O 3.04Å; K138-T239 HydrophobicContact CB-CG2 4.19Å; K138-T239 HydrophobicContact CD-CG2 3.98Å; K138-T239 HydrophobicContact CG-CG2 4.17Å; K138-V240 WeakPolarHBondContact CA-O 3.05Å; K138-T241 HydrophobicContact CB-CG2 4.39Å; K138-T241 HydrophobicContact CG-CG2 3.46Å; K138-T241 VanDerWaalsContact CG-CG2 3.46Å; K138-K290 HydrophobicContact CB-CB 3.92Å; K138-K290 HydrophobicContact CB-CD 3.97Å; K138-K290 HydrophobicContact CD-CD 4.23Å; K138-K290 VanDerWaalsContact O-CB 3.24Å; K138-K290 WeakPolarHBondContact O-CB 3.38Å; K138-K290 PolarHBondContact O-N 2.84Å; K138-D318 WeakPolarHBondContact CD-OD2 3.44Å
139	Y	98.5	Very high	96.7	Very high	16 Å²	16	25 Å²	25	6%	0.063	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	147.4	170.8	-77.7	-101.5	0	0	0	110.3	V53 A55 L135 K137 T239 V240 R288 C289 L306	V53-Y139 HydrophobicContact CG2-CE1 4.05Å; A55-Y139 HydrophobicContact CB-CD1 3.7Å; A55-Y139 HydrophobicContact CB-CD2 4.3Å; A55-Y139 HydrophobicContact CB-CE1 3.61Å; A55-Y139 HydrophobicContact CB-CE2 4.23Å; A55-Y139 HydrophobicContact CB-CG 4.06Å; L135-Y139 HydrophobicContact CB-CD2 3.93Å; L135-Y139 HydrophobicContact CB-CE2 4.03Å; L135-Y139 HydrophobicContact CD1-CD2 3.81Å; L135-Y139 HydrophobicContact CD1-CG 4.21Å; L135-Y139 HydrophobicContact CG-CD2 4.48Å; K137-Y139 HydrophobicContact CB-CE2 4.08Å; K137-Y139 WeakPolarHBondContact O-CD2 3.48Å; Y139-T239 CarbonylContact O-C 3.14Å; Y139-T239 VanDerWaalsContact O-CA 3.3Å; Y139-T239 WeakPolarHBondContact O-CA 3.3Å; Y139-V240 PolarHBondContact N-O 3.05Å; Y139-V240 PolarHBondContact O-N 3.13Å; Y139-R288 CarbonylContact C-O 3.58Å; Y139-R288 VanDerWaalsContact CA-O 3.3Å; Y139-R288 WeakPolarHBondContact CA-O 3.16Å; Y139-R288 VanDerWaalsContact CD1-C 3.49Å; Y139-R288 WeakPolarHBondContact CD1-O 3.38Å; Y139-C289 HydrophobicContact CE1-CB 4.29Å; Y139-L306 WeakPolarHBondContact OH-CD2 3.04Å
140	E	97.9	Very high	96.3	Very high	26 Å²	26	26.5 Å²	26.5	12%	0.121	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	98.4	161.3	-66.5	177.8	179.1	0	0	106.9	V238 G287 R288 K290 R333	E140-V238 HydrophobicContact CB-CG2 4.11Å; E140-V238 HydrophobicContact CG-CG2 4.28Å; E140-G287 WeakPolarHBondContact O-CA 3.31Å; E140-R288 PolarHBondContact N-O 3.13Å; E140-R288 PolarHBondContact O-N 2.86Å; E140-K290 HydrophobicContact CG-CB 4.19Å; E140-K290 HydrophobicContact CG-CG 4.07Å; E140-K290 IonicContact OE1-NZ 2.94Å; E140-R333 IonicContact OE1-CZ 3.19Å; E140-R333 VanDerWaalsContact OE1-CZ 3.24Å; E140-R333 IonicContact OE1-NH1 3.64Å; E140-R333 PolarHBondContact OE1-NH1 2.95Å; E140-R333 IonicContact OE1-NH2 3.39Å; E140-R333 PolarHBondContact OE1-NH2 2.89Å; E140-R333 IonicContact OE2-NH1 3.83Å
141	V	98.4	Very high	95.5	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.012	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127.4	-175.2	175.3	0	0	0	0	109.9	Y143 I144 T218 V238 V240 V285	V141-Y143 WeakPolarHBondContact CG1-O 2.93Å; V141-I144 HydrophobicContact CG1-CG1 3.99Å; V141-T218 HydrophobicContact CB-CG2 4.41Å; V141-T218 HydrophobicContact CG1-CG2 4.01Å; V141-T218 WeakPolarHBondContact O-CB 3.28Å; V141-T218 VanDerWaalsContact O-CG2 3.24Å; V141-T218 WeakPolarHBondContact O-CG2 2.85Å; V141-T218 PolarHBondContact O-OG1 3.24Å; V141-V238 PolarHBondContact N-O 3.33Å; V141-V240 HydrophobicContact CB-CG2 3.95Å; V141-V240 HydrophobicContact CG2-CB 3.68Å; V141-V240 HydrophobicContact CG2-CG1 4.43Å; V141-V240 HydrophobicContact CG2-CG2 3.62Å; V141-V285 HydrophobicContact CG1-CG1 3.97Å; V141-V285 HydrophobicContact CG2-CG1 3.79Å
142	T	97.9	Very high	94.9	Very high	72 Å²	72	28.8 Å²	28.8	44%	0.442	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-40.9	175.7	-56.2	0	0	0	0	111.2	T218 G286	T142-T218 PolarHBondContact O-N 2.89Å; T142-T218 PolarHBondContact O-OG1 2.9Å; T142-G286 PolarHBondContact N-O 2.81Å
143	Y	98.3	Very high	94.6	Very high	83 Å²	83	27.6 Å²	27.6	33%	0.325	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	157	176.2	68	-102	0	0	0	113	F52 V141 F216 G286	F52-Y143 AromaticContact CE1-CE1 3.92Å; F52-Y143 HydrophobicContact CE1-CE1 3.92Å; F52-Y143 HydrophobicContact CZ-CD1 4.09Å; F52-Y143 AromaticContact CZ-CE1 3.52Å; F52-Y143 HydrophobicContact CZ-CE1 3.52Å; V141-Y143 WeakPolarHBondContact CG1-O 2.93Å; Y143-F216 CarbonylContact C-O 3.6Å; Y143-F216 WeakPolarHBondContact CA-O 3.36Å; Y143-F216 WeakPolarHBondContact CB-O 3.08Å; Y143-G286 PolarHBondContact N-O 2.93Å; Y143-G286 PolarHBondContact O-N 3.44Å
144	I	98.4	Very high	94.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.4	165	-58.9	171.2	0	0	0	106.6	V141 I158 F171 A215 F216 I243 L283 A284	V141-I144 HydrophobicContact CG1-CG1 3.99Å; I144-I158 HydrophobicContact CD1-CG2 3.82Å; I144-I158 HydrophobicContact CG2-CD1 4.42Å; I144-F171 HydrophobicContact CD1-CD1 3.82Å; I144-F171 HydrophobicContact CD1-CE1 3.92Å; I144-A215 CarbonylContact O-C 3.59Å; I144-A215 WeakPolarHBondContact O-CA 3.22Å; I144-F216 HydrophobicContact CB-CB 4.49Å; I144-F216 HydrophobicContact CD1-CD1 4.26Å; I144-F216 HydrophobicContact CG1-CD1 4.49Å; I144-F216 PolarHBondContact N-O 3.34Å; I144-F216 PolarHBondContact O-N 3.02Å; I144-I243 HydrophobicContact CD1-CD1 3.65Å; I144-I243 HydrophobicContact CD1-CG1 4.05Å; I144-I243 HydrophobicContact CD1-CG2 4.18Å; I144-I243 HydrophobicContact CG1-CD1 4Å; I144-L283 HydrophobicContact CG2-CD1 4.15Å; I144-A284 WeakPolarHBondContact CA-O 3.39Å
145	S	96.6	Very high	94	Very high	5 Å²	5	24.9 Å²	24.9	4%	0.035	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133	-178.5	174.3	0	0	0	0	109.7	R213 A284	S145-R213 WeakPolarHBondContact OG-CD 3.49Å; S145-A284 PolarHBondContact N-O 3.43Å; S145-A284 PolarHBondContact O-N 2.04Å
146	M	95.8	Very high	94	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.2	179.7	-68.3	172.1	-67.4	0	0	108.6	F148 M156 I158 R213 I214 V245 M280 D282 L283	M146-F148 HydrophobicContact CB-CE2 3.83Å; M146-F148 HydrophobicContact CB-CZ 4.08Å; M146-M156 HydrophobicContact CE-CE 3.44Å; M146-M156 VanDerWaalsContact CE-CE 3.44Å; M146-M156 HydrophobicContact CE-SD 3.94Å; M146-M156 HydrophobicContact SD-SD 4.31Å; M146-I158 HydrophobicContact CE-CD1 3.73Å; M146-I158 HydrophobicContact CE-CG1 4.24Å; M146-R213 CarbonylContact O-C 3.27Å; M146-R213 WeakPolarHBondContact O-CA 3.44Å; M146-I214 HydrophobicContact CE-CB 4.45Å; M146-I214 HydrophobicContact CE-CG2 4.3Å; M146-I214 PolarHBondContact N-O 3.4Å; M146-I214 PolarHBondContact O-N 2.91Å; M146-V245 HydrophobicContact SD-CG1 3.91Å; M146-V245 HydrophobicContact SD-CG2 3.92Å; M146-M280 HydrophobicContact CB-CE 3.71Å; M146-M280 HydrophobicContact CB-SD 4.03Å; M146-M280 HydrophobicContact CG-CE 3.74Å; M146-M280 HydrophobicContact CG-SD 4Å; M146-M280 HydrophobicContact SD-CE 3.87Å; M146-D282 WeakPolarHBondContact CA-O 3.44Å; M146-L283 HydrophobicContact CG-CD1 3.7Å
147	Q	93.8	Very high	94.1	Very high	45 Å²	45	23 Å²	23	21%	0.21	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	119.6	174.7	-176.7	169.7	-7.4	0	0	109.8	D212 M280 A281 D282	Q147-D212 CarbonylContact C-O 3.56Å; Q147-D212 WeakPolarHBondContact CA-O 3.49Å; Q147-M280 CarbonylContact O-C 3.57Å; Q147-M280 WeakPolarHBondContact O-CA 2.97Å; Q147-M280 WeakPolarHBondContact O-CG 3.38Å; Q147-A281 HydrophobicContact CG-CB 4.48Å; Q147-A281 PolarHBondContact O-N 3.39Å; Q147-D282 HydrophobicContact CB-CB 4.17Å; Q147-D282 PolarHBondContact N-O 3.42Å; Q147-D282 PolarHBondContact O-N 3.41Å
148	F	92.5	Very high	94.2	Very high	3 Å²	3	23 Å²	23	1%	0.013	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	150.5	-179.1	-62.6	-90.6	0	0	0	110.6	M146 R152 P153 M156 D212 I214 F247 S279 M280	M146-F148 HydrophobicContact CB-CE2 3.83Å; M146-F148 HydrophobicContact CB-CZ 4.08Å; F148-R152 HydrophobicContact CB-CG 4.27Å; F148-R152 HydrophobicContact CD2-CG 3.83Å; F148-R152 HydrophobicContact CE2-CG 4.46Å; F148-R152 HydrophobicContact CG-CG 4.07Å; F148-P153 HydrophobicContact CE1-CG 3.78Å; F148-P153 VanDerWaalsContact CZ-CD 3.48Å; F148-P153 HydrophobicContact CZ-CG 3.74Å; F148-M156 HydrophobicContact CZ-SD 4.22Å; F148-D212 HydrophobicContact CB-CB 4.48Å; F148-D212 WeakPolarHBondContact CD2-O 3.49Å; F148-D212 PolarHBondContact N-O 2.77Å; F148-D212 WeakPolarHBondContact O-CB 3.39Å; F148-I214 HydrophobicContact CD2-CD1 4.36Å; F148-I214 HydrophobicContact CD2-CG1 4.36Å; F148-I214 HydrophobicContact CE2-CB 4.12Å; F148-I214 HydrophobicContact CE2-CD1 3.65Å; F148-I214 HydrophobicContact CE2-CG1 3.85Å; F148-I214 HydrophobicContact CZ-CD1 4.29Å; F148-F247 AromaticContact CE1-CE1 3.87Å; F148-F247 HydrophobicContact CE1-CE1 3.87Å; F148-F247 HydrophobicContact CE1-CZ 4.37Å; F148-F247 HydrophobicContact CZ-CE1 4.14Å; F148-S279 WeakPolarHBondContact CA-O 3.19Å; F148-S279 VanDerWaalsContact CD1-O 3.28Å; F148-S279 WeakPolarHBondContact CD1-O 2.97Å; F148-M280 HydrophobicContact CD1-CB 4.4Å; F148-M280 HydrophobicContact CD1-CE 4.3Å; F148-M280 HydrophobicContact CE1-CE 3.54Å; F148-M280 HydrophobicContact CE2-CE 4.43Å; F148-M280 HydrophobicContact CZ-CE 3.63Å
149	C	90.4	Very high	94.2	Very high	30 Å²	30	21.4 Å²	21.4	20%	0.203	11%	0.105	C	C	.	.	S	Bend	trans	-89.1	-32.3	175.9	-57.8	0	0	0	0	112.4	C116 S279 A281	C116-C149 HydrophobicContact CB-CB 4.11Å; C116-C149 WeakPolarHBondContact CB-SG 3.03Å; C116-C149 WeakPolarHBondContact SG-CB 3.47Å; C116-C149 CovalentContact SG-SG 2.03Å; C116-C149 PolarHBondContact SG-SG 2.73Å; C149-S279 PolarHBondContact N-O 3.45Å; C149-A281 VanDerWaalsContact SG-CB 3.6Å; C149-A281 PolarHBondContact SG-N 3.07Å; C149-A281 VanDerWaalsContact SG-N 3.42Å
150	H	86.2	Confident	94.2	Very high	43 Å²	43	20.7 Å²	20.7	20%	0.199	10%	0.102	C	C	.	.	S	Bend	trans	-133.4	-139.7	-176.9	-53.7	-75.2	0	0	0	109.1	Y75 W77 R152 F277 S279	Y75-H150 AromaticContact CE2-NE2 3.89Å; W77-H150 AromaticContact CD2-CE1 3.72Å; W77-H150 AromaticContact CE2-CE1 3.82Å; W77-H150 AromaticContact CE3-CE1 3.83Å; W77-H150 AromaticContact CH2-CE1 3.93Å; W77-H150 AromaticContact CZ2-CE1 3.95Å; W77-H150 AromaticContact CZ3-CE1 3.95Å; H150-R152 PolarHBondContact O-N 3.33Å; H150-F277 HydrophobicContact CB-CE2 4.27Å; H150-F277 HydrophobicContact CB-CZ 4.37Å; H150-F277 AromaticContact CD2-CE2 3.64Å; H150-S279 WeakPolarHBondContact CB-OG 3.07Å; H150-S279 PolarHBondContact CD2-OG 2.82Å; H150-S279 PolarHBondContact N-OG 3.03Å
151	H	81.3	Confident	94.3	Very high	51 Å²	51	19.5 Å²	19.5	24%	0.236	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-57	134.6	-178.5	-56.2	-72.3	0	0	0	112.5	D256	H151-D256 IonicContact CE1-OD2 2.78Å; H151-D256 PolarHBondContact CE1-OD2 2.58Å; H151-D256 IonicContact ND1-OD2 3.68Å
152	R	86.1	Confident	94.2	Very high	33 Å²	33	22.6 Å²	22.6	13%	0.125	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-71.8	147.1	171.1	-76	176.4	-83.7	-164.2	-36.4	110.3	F148 H150 D154 H204 L209 G211 I214 N251	F148-R152 HydrophobicContact CB-CG 4.27Å; F148-R152 HydrophobicContact CD2-CG 3.83Å; F148-R152 HydrophobicContact CE2-CG 4.46Å; F148-R152 HydrophobicContact CG-CG 4.07Å; H150-R152 PolarHBondContact O-N 3.33Å; R152-D154 PolarHBondContact O-N 3.26Å; R152-H204 PolarHBondContact NH1-O 3.22Å; R152-H204 VanDerWaalsContact NH1-O 3.13Å; R152-L209 VanDerWaalsContact CZ-CD2 3.45Å; R152-G211 VanDerWaalsContact CZ-O 3.3Å; R152-G211 PolarHBondContact NH2-O 3.11Å; R152-I214 HydrophobicContact CB-CD1 4.4Å; R152-I214 HydrophobicContact CG-CD1 4.2Å; R152-N251 PolarHBondContact O-N 3.11Å
153	P	91.1	Very high	94.2	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.006	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	136.4	167.1	28.4	-35.1	0	0	0	109.4	F148 M156 H204 F247 R249 Y278	F148-P153 HydrophobicContact CE1-CG 3.78Å; F148-P153 VanDerWaalsContact CZ-CD 3.48Å; F148-P153 HydrophobicContact CZ-CG 3.74Å; P153-M156 HydrophobicContact CB-CB 4.33Å; P153-M156 HydrophobicContact CG-CB 4.31Å; P153-M156 HydrophobicContact CG-CE 4.41Å; P153-M156 HydrophobicContact CG-CG 4.1Å; P153-M156 HydrophobicContact CG-SD 3.53Å; P153-M156 VanDerWaalsContact CG-SD 3.53Å; P153-H204 PolarHBondContact O-CD2 3.03Å; P153-H204 PolarHBondContact O-NE2 2.83Å; P153-F247 HydrophobicContact CB-CD1 3.85Å; P153-F247 HydrophobicContact CG-CD1 3.79Å; P153-F247 HydrophobicContact CG-CE1 3.98Å; P153-R249 CarbonylContact C-O 3.45Å; P153-R249 WeakPolarHBondContact CA-O 2.93Å; P153-Y278 HydrophobicContact CB-CD1 4.2Å; P153-Y278 HydrophobicContact CB-CE1 3.9Å
154	D	90.6	Very high	94.1	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.021	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	-50.6	165.5	166.5	89.4	0	0	0	109.3	R152 S175 S176 H204 R249 N251	R152-D154 PolarHBondContact O-N 3.26Å; D154-S175 WeakPolarHBondContact O-CA 3.46Å; D154-S176 WeakPolarHBondContact OD1-CB 3.44Å; D154-S176 PolarHBondContact OD1-N 3.38Å; D154-S176 PolarHBondContact OD1-OG 3.5Å; D154-H204 PolarHBondContact O-CE1 3.4Å; D154-H204 PolarHBondContact O-NE2 3.18Å; D154-R249 HydrophobicContact CB-CB 4.45Å; D154-R249 HydrophobicContact CB-CG 4.44Å; D154-R249 PolarHBondContact N-O 3.49Å; D154-R249 IonicContact OD1-NH2 2.75Å; D154-R249 PolarHBondContact OD1-NH2 3.01Å; D154-R249 IonicContact OD2-CZ 3.92Å; D154-R249 IonicContact OD2-NE 3.24Å; D154-R249 PolarHBondContact OD2-NE 3.39Å; D154-R249 IonicContact OD2-NH2 2.82Å; D154-R249 PolarHBondContact OD2-NH2 2.94Å; D154-N251 HydrophobicContact CB-CB 3.7Å
155	S	94.2	Very high	94.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121	-175.7	-63.8	0	0	0	0	111.5	Y174 S175 S248 R249	S155-Y174 CarbonylContact C-O 3.58Å; S155-Y174 WeakPolarHBondContact CA-O 3.24Å; S155-S175 WeakPolarHBondContact OG-CB 3.37Å; S155-S175 PolarHBondContact OG-OG 3.05Å; S155-S248 PolarHBondContact O-N 3.08Å; S155-R249 PolarHBondContact N-O 3.09Å; S155-R249 PolarHBondContact O-N 3.48Å; S155-R249 VanDerWaalsContact O-N 3.11Å
156	M	95.9	Very high	94.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	161.5	173.4	65	174.8	179.8	0	0	111.8	M146 F148 P153 Y174 Y182 I214 V245 I246 F247	M146-M156 HydrophobicContact CE-CE 3.44Å; M146-M156 VanDerWaalsContact CE-CE 3.44Å; M146-M156 HydrophobicContact CE-SD 3.94Å; M146-M156 HydrophobicContact SD-SD 4.31Å; F148-M156 HydrophobicContact CZ-SD 4.22Å; P153-M156 HydrophobicContact CB-CB 4.33Å; P153-M156 HydrophobicContact CG-CB 4.31Å; P153-M156 HydrophobicContact CG-CE 4.41Å; P153-M156 HydrophobicContact CG-CG 4.1Å; P153-M156 HydrophobicContact CG-SD 3.53Å; P153-M156 VanDerWaalsContact CG-SD 3.53Å; M156-Y174 HydrophobicContact CE-CD1 4.39Å; M156-Y174 HydrophobicContact CE-CD2 3.44Å; M156-Y174 VanDerWaalsContact CE-CD2 3.44Å; M156-Y174 HydrophobicContact CE-CE2 3.86Å; M156-Y174 HydrophobicContact CE-CG 3.72Å; M156-Y174 HydrophobicContact CG-CD2 3.97Å; M156-Y174 HydrophobicContact CG-CG 4.24Å; M156-Y174 PolarHBondContact N-O 3.32Å; M156-Y174 PolarHBondContact O-N 3.38Å; M156-Y174 HydrophobicContact SD-CD2 4.47Å; M156-Y182 WeakPolarHBondContact CA-OH 3.33Å; M156-Y182 PolarHBondContact N-OH 2.96Å; M156-Y182 PolarHBondContact O-OH 2.78Å; M156-I214 HydrophobicContact CE-CB 4.14Å; M156-I214 HydrophobicContact CE-CD1 3.51Å; M156-I214 HydrophobicContact CE-CG1 4.41Å; M156-I214 HydrophobicContact CE-CG2 3.67Å; M156-V245 HydrophobicContact SD-CG1 4.44Å; M156-I246 CarbonylContact C-O 3.24Å; M156-I246 WeakPolarHBondContact CA-O 3.26Å; M156-I246 VanDerWaalsContact CB-O 3.3Å; M156-I246 WeakPolarHBondContact CB-O 3.48Å; M156-F247 HydrophobicContact CB-CD1 3.95Å; M156-F247 HydrophobicContact SD-CD1 4.26Å; M156-F247 HydrophobicContact SD-CE1 3.97Å
157	V	97.7	Very high	94.3	Very high	11 Å²	11	39 Å²	39	7%	0.067	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	134.8	173.3	59.8	0	0	0	0	110.4	L159 Q172 Y173 V245 I246	V157-L159 HydrophobicContact CG1-CD2 4.44Å; V157-L159 HydrophobicContact CG2-CD2 3.68Å; V157-L159 HydrophobicContact CG2-CG 4.44Å; V157-Q172 WeakPolarHBondContact CA-O 3.27Å; V157-Q172 WeakPolarHBondContact CG2-O 3.18Å; V157-Y173 HydrophobicContact CB-CD1 3.79Å; V157-Y173 HydrophobicContact CB-CE1 4.11Å; V157-Y173 HydrophobicContact CG2-CD1 3.48Å; V157-Y173 VanDerWaalsContact CG2-CD1 3.48Å; V157-Y173 HydrophobicContact CG2-CE1 3.52Å; V157-Y173 HydrophobicContact CG2-CG 4.06Å; V157-V245 WeakPolarHBondContact O-CA 3.46Å; V157-I246 HydrophobicContact CG1-CB 3.69Å; V157-I246 HydrophobicContact CG1-CD1 4.2Å; V157-I246 HydrophobicContact CG1-CG1 4.18Å; V157-I246 HydrophobicContact CG1-CG2 4.41Å; V157-I246 PolarHBondContact N-O 3.17Å; V157-I246 PolarHBondContact O-N 2.82Å
158	I	98.5	Very high	94.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.9	168	-53.6	178	0	0	0	107	I144 M146 F171 Q172 Y174 F216 I243	I144-I158 HydrophobicContact CD1-CG2 3.82Å; I144-I158 HydrophobicContact CG2-CD1 4.42Å; M146-I158 HydrophobicContact CE-CD1 3.73Å; M146-I158 HydrophobicContact CE-CG1 4.24Å; I158-F171 HydrophobicContact CB-CB 4.36Å; I158-F171 HydrophobicContact CG2-CB 4.09Å; I158-F171 HydrophobicContact CG2-CD1 4.38Å; I158-F171 WeakPolarHBondContact O-CA 3.47Å; I158-F171 WeakPolarHBondContact O-CB 3.47Å; I158-F171 PolarHBondContact O-N 2.98Å; I158-Q172 HydrophobicContact CD1-CB 4.49Å; I158-Q172 PolarHBondContact N-O 3.32Å; I158-Q172 PolarHBondContact O-N 3.35Å; I158-Y174 HydrophobicContact CD1-CE2 3.97Å; I158-Y174 HydrophobicContact CG1-CE2 4.38Å; I158-F216 HydrophobicContact CD1-CB 3.96Å; I158-F216 HydrophobicContact CD1-CG 4.41Å; I158-I243 HydrophobicContact CG2-CG2 4.13Å
159	L	98.7	Very high	94.7	Very high	25 Å²	25	43 Å²	43	13%	0.131	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	152.2	169.9	-52.1	-178	0	0	0	109.5	V157 W168 I169 P170 I243 R244 I246	V157-L159 HydrophobicContact CG1-CD2 4.44Å; V157-L159 HydrophobicContact CG2-CD2 3.68Å; V157-L159 HydrophobicContact CG2-CG 4.44Å; L159-W168 HydrophobicContact CB-CE3 3.88Å; L159-W168 HydrophobicContact CD1-CB 4.49Å; L159-I169 WeakPolarHBondContact CA-O 3.02Å; L159-P170 HydrophobicContact CD2-CB 4.14Å; L159-P170 HydrophobicContact CD2-CG 4.23Å; L159-I243 WeakPolarHBondContact O-CA 3.48Å; L159-R244 HydrophobicContact CB-CB 4.28Å; L159-R244 PolarHBondContact N-O 2.9Å; L159-R244 PolarHBondContact O-N 3.28Å; L159-I246 HydrophobicContact CD1-CD1 3.63Å; L159-I246 HydrophobicContact CD1-CG1 4.44Å; L159-I246 HydrophobicContact CG-CD1 4.29Å
160	K	98.6	Very high	95.1	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	155.9	172.6	68.3	164.6	-161.6	153	0	112	M162 W168 I169 F171 D236 W237 T239 V240 D242	K160-M162 PolarHBondContact NZ-SD 3.19Å; K160-W168 WeakPolarHBondContact O-CA 3.45Å; K160-I169 HydrophobicContact CG-CD1 4.49Å; K160-I169 HydrophobicContact CG-CG1 3.84Å; K160-I169 PolarHBondContact N-O 3Å; K160-I169 PolarHBondContact O-N 2.03Å; K160-F171 HydrophobicContact CB-CB 4.38Å; K160-F171 HydrophobicContact CB-CD1 3.78Å; K160-F171 HydrophobicContact CB-CE1 4.27Å; K160-F171 HydrophobicContact CB-CG 4.22Å; K160-F171 HydrophobicContact CD-CD1 3.83Å; K160-F171 HydrophobicContact CD-CD2 3.99Å; K160-F171 HydrophobicContact CD-CE1 3.81Å; K160-F171 HydrophobicContact CD-CE2 3.95Å; K160-F171 HydrophobicContact CD-CG 3.91Å; K160-F171 HydrophobicContact CD-CZ 3.85Å; K160-F171 HydrophobicContact CG-CB 4.21Å; K160-F171 HydrophobicContact CG-CD1 4.01Å; K160-F171 HydrophobicContact CG-CD2 4.48Å; K160-F171 HydrophobicContact CG-CE1 4.46Å; K160-F171 HydrophobicContact CG-CG 4.01Å; K160-D236 PolarHBondContact NZ-O 3.35Å; K160-W237 VanDerWaalsContact NZ-C 3.33Å; K160-W237 PolarHBondContact NZ-O 3.28Å; K160-T239 PolarHBondContact NZ-O 3.09Å; K160-V240 HydrophobicContact CB-CG1 4.36Å; K160-V240 HydrophobicContact CB-CG2 4.42Å; K160-V240 HydrophobicContact CD-CG2 4.08Å; K160-D242 CarbonylContact C-O 3.55Å; K160-D242 WeakPolarHBondContact CA-O 3.31Å
161	S	98.6	Very high	95.6	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	151.2	165.9	177.5	0	0	0	0	110.3	D163 G165 N167 V240 T241 D242	S161-D163 PolarHBondContact OG-N 3.06Å; S161-D163 PolarHBondContact OG-OD1 3.18Å; S161-G165 WeakPolarHBondContact OG-CA 3.27Å; S161-G165 PolarHBondContact OG-N 2.93Å; S161-N167 WeakPolarHBondContact CA-O 3.31Å; S161-N167 WeakPolarHBondContact CB-O 3.05Å; S161-N167 PolarHBondContact OG-O 2.97Å; S161-V240 WeakPolarHBondContact O-CA 3.33Å; S161-T241 PolarHBondContact O-N 3.21Å; S161-T241 PolarHBondContact O-OG1 2.68Å; S161-D242 PolarHBondContact N-O 2.9Å
162	M	97.4	Very high	96.4	Very high	66 Å²	66	39.6 Å²	39.6	33%	0.325	19%	0.187	S	C	.	.	S	Bend	trans	-117	1.7	174.3	-60.2	-169.6	-69.8	0	0	112.7	K138 K160 T239	K138-M162 WeakPolarHBondContact CE-O 3.04Å; K160-M162 PolarHBondContact NZ-SD 3.19Å; M162-T239 VanDerWaalsContact CG-O 3.28Å; M162-T239 WeakPolarHBondContact CG-O 3.4Å
163	D	97.1	Very high	97	Very high	46 Å²	46	39.5 Å²	39.5	25%	0.246	19%	0.187	C	C	.	.	S	Bend	trans	-138.6	35.9	-168.2	64.4	-6.6	0	0	0	112.2	S161 R166 N167 T241	S161-D163 PolarHBondContact OG-N 3.06Å; S161-D163 PolarHBondContact OG-OD1 3.18Å; D163-R166 WeakPolarHBondContact O-CD 3.47Å; D163-R166 WeakPolarHBondContact O-CG 3.37Å; D163-R166 PolarHBondContact OD1-N 2.77Å; D163-N167 PolarHBondContact OD1-N 3.49Å; D163-N167 WeakPolarHBondContact OD2-CB 3.04Å; D163-N167 PolarHBondContact OD2-N 3.44Å; D163-N167 PolarHBondContact OD2-ND2 3.22Å; D163-T241 PolarHBondContact N-OG1 3.2Å
164	Y	97.2	Very high	97.2	Very high	116 Å²	116	40.1 Å²	40.1	46%	0.455	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	46.2	172.5	-53.6	-81.6	0	0	0	112.9	R166 T241 D242	Y164-R166 VanDerWaalsContact C-N 3.35Å; Y164-R166 PolarHBondContact O-N 3.39Å; Y164-T241 HydrophobicContact CD1-CG2 3.99Å; Y164-T241 HydrophobicContact CD2-CG2 4.47Å; Y164-T241 HydrophobicContact CE1-CG2 3.83Å; Y164-T241 HydrophobicContact CE2-CG2 4.33Å; Y164-T241 HydrophobicContact CG-CG2 4.32Å; Y164-T241 PolarHBondContact N-OG1 3.23Å; Y164-D242 VanDerWaalsContact C-OD2 3.25Å; Y164-D242 WeakPolarHBondContact CA-OD2 3.37Å
165	G	97.4	Very high	97.4	Very high	26 Å²	26	39.9 Å²	39.9	27%	0.268	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	7.9	174	0	0	0	0	0	115.3	S161 W168 D242	S161-G165 WeakPolarHBondContact OG-CA 3.27Å; S161-G165 PolarHBondContact OG-N 2.93Å; G165-W168 PolarHBondContact O-NE1 3.41Å; G165-D242 PolarHBondContact N-OD2 3Å
166	R	97.9	Very high	97.3	Very high	208 Å²	208	42.5 Å²	42.5	79%	0.785	21%	0.206	S	C	*	.	S	Bend	trans	-76.4	-51.3	-180	-66.8	175.9	176	-130.7	-3.1	111.8	D163 Y164	D163-R166 WeakPolarHBondContact O-CD 3.47Å; D163-R166 WeakPolarHBondContact O-CG 3.37Å; D163-R166 PolarHBondContact OD1-N 2.77Å; Y164-R166 VanDerWaalsContact C-N 3.35Å; Y164-R166 PolarHBondContact O-N 3.39Å
167	N	98.3	Very high	97.1	Very high	109 Å²	109	46 Å²	46	58%	0.583	22%	0.223	S	C	*	.	S	Bend	trans	-114.4	138.7	176.2	-66.8	-67.1	0	0	0	110.1	S161 D163	S161-N167 WeakPolarHBondContact CA-O 3.31Å; S161-N167 WeakPolarHBondContact CB-O 3.05Å; S161-N167 PolarHBondContact OG-O 2.97Å; D163-N167 PolarHBondContact OD1-N 3.49Å; D163-N167 WeakPolarHBondContact OD2-CB 3.04Å; D163-N167 PolarHBondContact OD2-N 3.44Å; D163-N167 PolarHBondContact OD2-ND2 3.22Å
168	W	98.5	Very high	97	Very high	61 Å²	61	45.8 Å²	45.8	23%	0.231	22%	0.222	C	C	.	.			trans	-121.3	127.2	-179.2	-67.2	86.9	0	0	0	109.4	T132 L159 K160 G165 D242 R244	T132-W168 HydrophobicContact CG2-CH2 3.97Å; T132-W168 HydrophobicContact CG2-CZ2 4.25Å; L159-W168 HydrophobicContact CB-CE3 3.88Å; L159-W168 HydrophobicContact CD1-CB 4.49Å; K160-W168 WeakPolarHBondContact O-CA 3.45Å; G165-W168 PolarHBondContact O-NE1 3.41Å; W168-D242 HydrophobicContact CH2-CB 3.54Å; W168-D242 HydrophobicContact CZ2-CB 4.15Å; W168-D242 HydrophobicContact CZ3-CB 4.2Å; W168-R244 HydrophobicContact CE3-CB 3.91Å; W168-R244 HydrophobicContact CH2-CB 3.81Å; W168-R244 HydrophobicContact CZ3-CB 3.4Å
169	I	98	Very high	96.9	Very high	70 Å²	70	53 Å²	53	36%	0.359	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	149.2	172.8	63.1	172.1	0	0	0	110.3	L159 K160 F171 W237	L159-I169 WeakPolarHBondContact CA-O 3.02Å; K160-I169 HydrophobicContact CG-CD1 4.49Å; K160-I169 HydrophobicContact CG-CG1 3.84Å; K160-I169 PolarHBondContact N-O 3Å; K160-I169 PolarHBondContact O-N 2.03Å; I169-F171 PolarHBondContact O-N 3.13Å; I169-W237 HydrophobicContact CD1-CZ3 4.38Å
170	P	98.1	Very high	96.7	Very high	39 Å²	39	61.6 Å²	61.6	25%	0.253	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	137.6	173.4	-19.4	32.2	0	0	0	111.3	L159 Y173 A198	L159-P170 HydrophobicContact CD2-CB 4.14Å; L159-P170 HydrophobicContact CD2-CG 4.23Å; P170-Y173 HydrophobicContact CB-CD2 4.46Å; P170-Y173 HydrophobicContact CB-CE2 3.47Å; P170-Y173 VanDerWaalsContact CB-CE2 3.47Å; P170-Y173 WeakPolarHBondContact CB-OH 3.35Å; P170-Y173 HydrophobicContact CG-CE2 4.12Å; P170-Y173 WeakPolarHBondContact CG-OH 3.27Å; P170-A198 HydrophobicContact CB-CB 3.69Å; P170-A198 WeakPolarHBondContact O-CB 3.44Å
171	F	97.6	Very high	96.5	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-44.9	175.8	-148.8	177.5	0	0	0	110.6	I144 I158 K160 I169 F216 T218 W237 V240	I144-F171 HydrophobicContact CD1-CD1 3.82Å; I144-F171 HydrophobicContact CD1-CE1 3.92Å; I158-F171 HydrophobicContact CB-CB 4.36Å; I158-F171 HydrophobicContact CG2-CB 4.09Å; I158-F171 HydrophobicContact CG2-CD1 4.38Å; I158-F171 WeakPolarHBondContact O-CA 3.47Å; I158-F171 WeakPolarHBondContact O-CB 3.47Å; I158-F171 PolarHBondContact O-N 2.98Å; K160-F171 HydrophobicContact CB-CB 4.38Å; K160-F171 HydrophobicContact CB-CD1 3.78Å; K160-F171 HydrophobicContact CB-CE1 4.27Å; K160-F171 HydrophobicContact CB-CG 4.22Å; K160-F171 HydrophobicContact CD-CD1 3.83Å; K160-F171 HydrophobicContact CD-CD2 3.99Å; K160-F171 HydrophobicContact CD-CE1 3.81Å; K160-F171 HydrophobicContact CD-CE2 3.95Å; K160-F171 HydrophobicContact CD-CG 3.91Å; K160-F171 HydrophobicContact CD-CZ 3.85Å; K160-F171 HydrophobicContact CG-CB 4.21Å; K160-F171 HydrophobicContact CG-CD1 4.01Å; K160-F171 HydrophobicContact CG-CD2 4.48Å; K160-F171 HydrophobicContact CG-CE1 4.46Å; K160-F171 HydrophobicContact CG-CG 4.01Å; I169-F171 PolarHBondContact O-N 3.13Å; F171-F216 HydrophobicContact CB-CE1 4.31Å; F171-F216 HydrophobicContact CD1-CD1 4.29Å; F171-F216 AromaticContact CD1-CE1 3.63Å; F171-F216 HydrophobicContact CD1-CE1 3.63Å; F171-F216 AromaticContact CD2-CE1 3.4Å; F171-F216 HydrophobicContact CD2-CE1 3.4Å; F171-F216 AromaticContact CD2-CZ 3.53Å; F171-F216 HydrophobicContact CD2-CZ 3.53Å; F171-F216 HydrophobicContact CE1-CD1 4.47Å; F171-F216 AromaticContact CE1-CE1 3.74Å; F171-F216 HydrophobicContact CE1-CE1 3.74Å; F171-F216 AromaticContact CE2-CE1 3.54Å; F171-F216 HydrophobicContact CE2-CE1 3.54Å; F171-F216 AromaticContact CE2-CZ 3.76Å; F171-F216 HydrophobicContact CE2-CZ 3.76Å; F171-F216 HydrophobicContact CG-CD1 4.4Å; F171-F216 AromaticContact CG-CE1 3.48Å; F171-F216 HydrophobicContact CG-CE1 3.48Å; F171-F216 VanDerWaalsContact CG-CE1 3.48Å; F171-F216 AromaticContact CG-CZ 4Å; F171-F216 HydrophobicContact CG-CZ 4Å; F171-F216 AromaticContact CZ-CE1 3.72Å; F171-F216 HydrophobicContact CZ-CE1 3.72Å; F171-F216 HydrophobicContact CZ-CZ 4.37Å; F171-T218 HydrophobicContact CE1-CG2 4.01Å; F171-T218 HydrophobicContact CE2-CG2 4.07Å; F171-T218 HydrophobicContact CZ-CG2 3.42Å; F171-T218 VanDerWaalsContact CZ-CG2 3.42Å; F171-W237 HydrophobicContact CD2-CD2 4.48Å; F171-W237 AromaticContact CD2-CE2 3.84Å; F171-W237 AromaticContact CD2-CH2 3.71Å; F171-W237 HydrophobicContact CD2-CH2 3.71Å; F171-W237 AromaticContact CD2-CZ2 3.43Å; F171-W237 HydrophobicContact CD2-CZ2 3.43Å; F171-W237 VanDerWaalsContact CD2-CZ2 3.43Å; F171-W237 HydrophobicContact CD2-CZ3 4.33Å; F171-W237 HydrophobicContact CE2-CD2 4.07Å; F171-W237 AromaticContact CE2-CE2 3.59Å; F171-W237 HydrophobicContact CE2-CH2 4.25Å; F171-W237 AromaticContact CE2-CZ2 3.72Å; F171-W237 HydrophobicContact CE2-CZ2 3.72Å; F171-W237 AromaticContact CE2-NE1 3.8Å; F171-W237 WeakPolarHBondContact CE2-O 3.5Å; F171-V240 HydrophobicContact CE1-CG2 3.78Å; F171-V240 HydrophobicContact CZ-CG2 4.19Å
172	Q	97.6	Very high	96.3	Very high	14 Å²	14	67 Å²	67	7%	0.065	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	139.6	176.9	-177.6	60.1	30.5	0	0	111.3	V157 I158 Y174 L199 F216	V157-Q172 WeakPolarHBondContact CA-O 3.27Å; V157-Q172 WeakPolarHBondContact CG2-O 3.18Å; I158-Q172 HydrophobicContact CD1-CB 4.49Å; I158-Q172 PolarHBondContact N-O 3.32Å; I158-Q172 PolarHBondContact O-N 3.35Å; Q172-Y174 HydrophobicContact CB-CE2 4.07Å; Q172-Y174 HydrophobicContact CG-CD2 3.94Å; Q172-Y174 HydrophobicContact CG-CE1 4.29Å; Q172-Y174 HydrophobicContact CG-CE2 3.31Å; Q172-L199 PolarHBondContact NE2-O 3.08Å; Q172-F216 HydrophobicContact CB-CD2 3.67Å; Q172-F216 HydrophobicContact CB-CE2 3.77Å; Q172-F216 HydrophobicContact CB-CG 4.06Å; Q172-F216 HydrophobicContact CB-CZ 4.22Å; Q172-F216 HydrophobicContact CG-CD2 3.76Å; Q172-F216 HydrophobicContact CG-CE2 4.13Å; Q172-F216 HydrophobicContact CG-CG 4.39Å
173	Y	97.7	Very high	96.3	Very high	32 Å²	32	65.7 Å²	65.7	13%	0.125	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	143.4	170	-59.9	-95.2	0	0	0	110.8	V157 P170 Y182 A198 L199 C200 T201	V157-Y173 HydrophobicContact CB-CD1 3.79Å; V157-Y173 HydrophobicContact CB-CE1 4.11Å; V157-Y173 HydrophobicContact CG2-CD1 3.48Å; V157-Y173 VanDerWaalsContact CG2-CD1 3.48Å; V157-Y173 HydrophobicContact CG2-CE1 3.52Å; V157-Y173 HydrophobicContact CG2-CG 4.06Å; P170-Y173 HydrophobicContact CB-CD2 4.46Å; P170-Y173 HydrophobicContact CB-CE2 3.47Å; P170-Y173 VanDerWaalsContact CB-CE2 3.47Å; P170-Y173 WeakPolarHBondContact CB-OH 3.35Å; P170-Y173 HydrophobicContact CG-CE2 4.12Å; P170-Y173 WeakPolarHBondContact CG-OH 3.27Å; Y173-Y182 AromaticContact CD1-CD1 3.72Å; Y173-Y182 HydrophobicContact CD1-CD1 3.72Å; Y173-Y182 AromaticContact CD1-CD2 3.68Å; Y173-Y182 HydrophobicContact CD1-CD2 3.68Å; Y173-Y182 AromaticContact CD1-CE1 3.97Å; Y173-Y182 HydrophobicContact CD1-CE1 3.97Å; Y173-Y182 AromaticContact CD1-CE2 3.9Å; Y173-Y182 HydrophobicContact CD1-CE2 3.9Å; Y173-Y182 AromaticContact CD1-CG 3.58Å; Y173-Y182 HydrophobicContact CD1-CG 3.58Å; Y173-Y182 AromaticContact CE1-CD1 3.92Å; Y173-Y182 HydrophobicContact CE1-CD1 3.92Å; Y173-Y182 HydrophobicContact CE1-CE1 4.34Å; Y173-Y182 HydrophobicContact CE1-CG 4.07Å; Y173-Y182 HydrophobicContact CG-CD2 4.18Å; Y173-Y182 HydrophobicContact CG-CE2 4.49Å; Y173-Y182 HydrophobicContact CG-CG 4.37Å; Y173-A198 HydrophobicContact CD2-CB 4.17Å; Y173-A198 HydrophobicContact CE2-CB 3.91Å; Y173-L199 WeakPolarHBondContact CB-O 3.32Å; Y173-L199 WeakPolarHBondContact CD2-O 3.16Å; Y173-L199 PolarHBondContact N-O 3.41Å; Y173-C200 WeakPolarHBondContact O-CA 3.47Å; Y173-T201 PolarHBondContact O-N 2.04Å; Y173-T201 VanDerWaalsContact O-N 3.08Å
174	Y	96	Very high	96.2	Very high	13 Å²	13	67 Å²	67	5%	0.051	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.5	174	-68.1	-84	0	0	0	108.2	S155 M156 I158 Q172 Y182 T201 H204 I214 A215 F216	S155-Y174 CarbonylContact C-O 3.58Å; S155-Y174 WeakPolarHBondContact CA-O 3.24Å; M156-Y174 HydrophobicContact CE-CD1 4.39Å; M156-Y174 HydrophobicContact CE-CD2 3.44Å; M156-Y174 VanDerWaalsContact CE-CD2 3.44Å; M156-Y174 HydrophobicContact CE-CE2 3.86Å; M156-Y174 HydrophobicContact CE-CG 3.72Å; M156-Y174 HydrophobicContact CG-CD2 3.97Å; M156-Y174 HydrophobicContact CG-CG 4.24Å; M156-Y174 PolarHBondContact N-O 3.32Å; M156-Y174 PolarHBondContact O-N 3.38Å; M156-Y174 HydrophobicContact SD-CD2 4.47Å; I158-Y174 HydrophobicContact CD1-CE2 3.97Å; I158-Y174 HydrophobicContact CG1-CE2 4.38Å; Q172-Y174 HydrophobicContact CB-CE2 4.07Å; Q172-Y174 HydrophobicContact CG-CD2 3.94Å; Q172-Y174 HydrophobicContact CG-CE1 4.29Å; Q172-Y174 HydrophobicContact CG-CE2 3.31Å; Y174-Y182 WeakPolarHBondContact O-CE2 3.33Å; Y174-T201 WeakPolarHBondContact CA-O 3.33Å; Y174-T201 HydrophobicContact CD1-CG2 3.48Å; Y174-T201 VanDerWaalsContact CD1-CG2 3.48Å; Y174-T201 HydrophobicContact CE1-CG2 3.54Å; Y174-T201 HydrophobicContact CG-CG2 4.44Å; Y174-H204 HydrophobicContact CD1-CB 4.33Å; Y174-H204 AromaticContact CD1-CG 3.97Å; Y174-H204 AromaticContact CD1-ND1 3.6Å; Y174-I214 HydrophobicContact CD1-CG2 4.3Å; Y174-I214 HydrophobicContact CE1-CG2 3.75Å; Y174-I214 HydrophobicContact CE2-CG2 4.29Å; Y174-A215 PolarHBondContact OH-O 3.17Å; Y174-F216 WeakPolarHBondContact OH-CB 3.48Å
175	S	95	Very high	96.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.313	C	S	.	.			trans	-168	136.3	172.4	-175.1	0	0	0	0	111.2	D154 S155 Q177 C178 T201 H204	D154-S175 WeakPolarHBondContact O-CA 3.46Å; S155-S175 WeakPolarHBondContact OG-CB 3.37Å; S155-S175 PolarHBondContact OG-OG 3.05Å; S175-Q177 PolarHBondContact O-N 3.19Å; S175-Q177 PolarHBondContact OG-N 2.99Å; S175-C178 PolarHBondContact O-SG 2.87Å; S175-T201 PolarHBondContact N-O 3.4Å; S175-H204 PolarHBondContact N-CE1 3.43Å
176	S	91.6	Very high	95.9	Very high	54 Å²	54	66.4 Å²	66.4	38%	0.378	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.1	165.9	64.9	0	0	0	0	112.9	D154 R249	D154-S176 WeakPolarHBondContact OD1-CB 3.44Å; D154-S176 PolarHBondContact OD1-N 3.38Å; D154-S176 PolarHBondContact OD1-OG 3.5Å; S176-R249 PolarHBondContact OG-NH2 3.38Å; S176-R249 VanDerWaalsContact OG-NH2 3.16Å
177	Q	92.8	Very high	95.5	Very high	74 Å²	74	60.6 Å²	60.6	35%	0.346	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	48.6	-178.9	-64.4	180	-4	0	0	111.2	S175 R179 R180 M181	S175-Q177 PolarHBondContact O-N 3.19Å; S175-Q177 PolarHBondContact OG-N 2.99Å; Q177-R179 PolarHBondContact O-N 3.22Å; Q177-R180 HydrophobicContact CB-CB 4.22Å; Q177-R180 PolarHBondContact O-N 3.18Å; Q177-M181 WeakPolarHBondContact O-CB 3.37Å; Q177-M181 PolarHBondContact O-N 2.69Å
178	C	95.6	Very high	95.1	Very high	6 Å²	6	57.5 Å²	57.5	4%	0.041	28%	0.284	C	S	.	.	H	α-helix	trans	-41.1	-42.4	179.9	-80.3	0	0	0	0	114.8	S175 Y182 G183 R184 C200	S175-C178 PolarHBondContact O-SG 2.87Å; C178-Y182 CarbonylContact O-C 3.56Å; C178-Y182 PolarHBondContact O-N 2.91Å; C178-G183 PolarHBondContact O-N 2.93Å; C178-R184 CarbonylContact C-O 3.55Å; C178-R184 WeakPolarHBondContact CB-O 3.27Å; C178-R184 PolarHBondContact O-N 2.79Å; C178-R184 VanDerWaalsContact O-N 3.17Å; C178-C200 VanDerWaalsContact CA-SG 3.53Å; C178-C200 HydrophobicContact CB-CB 3.81Å; C178-C200 WeakPolarHBondContact CB-SG 3.31Å; C178-C200 VanDerWaalsContact SG-C 3.56Å; C178-C200 WeakPolarHBondContact SG-CB 3.3Å; C178-C200 CovalentContact SG-SG 2.03Å; C178-C200 PolarHBondContact SG-SG 3.08Å
179	R	96.2	Very high	94.7	Very high	151 Å²	151	60 Å²	60	57%	0.57	31%	0.308	S	S	*	.	H	α-helix	trans	-67.1	-45.9	-179.2	-168.9	69	-103.8	163.4	149.8	112.5	Q177 G183 R184	Q177-R179 PolarHBondContact O-N 3.22Å; R179-G183 VanDerWaalsContact NH1-C 3.27Å; R179-G183 PolarHBondContact NH1-O 3.45Å; R179-G183 PolarHBondContact NH2-O 3.13Å; R179-G183 VanDerWaalsContact O-CA 3.23Å; R179-G183 WeakPolarHBondContact O-CA 3.03Å; R179-G183 PolarHBondContact O-N 2.86Å; R179-G183 VanDerWaalsContact O-N 3.1Å; R179-R184 WeakPolarHBondContact CA-O 3.4Å; R179-R184 PolarHBondContact N-O 3.16Å; R179-R184 VanDerWaalsContact NH2-N 3.16Å; R179-R184 PolarHBondContact NH2-O 2.75Å
180	R	94.4	Very high	94.4	Very high	207 Å²	207	58 Å²	58	78%	0.781	30%	0.297	S	S	*	.	H	α-helix	trans	-76.9	-41.4	-178	-178.4	-179	174	177	0.5	111.5	Q177	Q177-R180 HydrophobicContact CB-CB 4.22Å; Q177-R180 PolarHBondContact O-N 3.18Å
181	M	93.1	Very high	94.1	Very high	68 Å²	68	58.4 Å²	58.4	34%	0.335	30%	0.302	S	S	.	.	H	α-helix	trans	-77.4	-44	-175.1	-176.3	63.2	-143.7	0	0	112.5	Q177	Q177-M181 WeakPolarHBondContact O-CB 3.37Å; Q177-M181 PolarHBondContact O-N 2.69Å
182	Y	95.7	Very high	93.8	Very high	46 Å²	46	66.4 Å²	66.4	18%	0.18	33%	0.332	C	S	.	.	H	α-helix	trans	-125.2	1.6	-170.9	-60.4	-56.6	0	0	0	114.4	M156 Y173 Y174 C178 R184	M156-Y182 WeakPolarHBondContact CA-OH 3.33Å; M156-Y182 PolarHBondContact N-OH 2.96Å; M156-Y182 PolarHBondContact O-OH 2.78Å; Y173-Y182 AromaticContact CD1-CD1 3.72Å; Y173-Y182 HydrophobicContact CD1-CD1 3.72Å; Y173-Y182 AromaticContact CD1-CD2 3.68Å; Y173-Y182 HydrophobicContact CD1-CD2 3.68Å; Y173-Y182 AromaticContact CD1-CE1 3.97Å; Y173-Y182 HydrophobicContact CD1-CE1 3.97Å; Y173-Y182 AromaticContact CD1-CE2 3.9Å; Y173-Y182 HydrophobicContact CD1-CE2 3.9Å; Y173-Y182 AromaticContact CD1-CG 3.58Å; Y173-Y182 HydrophobicContact CD1-CG 3.58Å; Y173-Y182 AromaticContact CE1-CD1 3.92Å; Y173-Y182 HydrophobicContact CE1-CD1 3.92Å; Y173-Y182 HydrophobicContact CE1-CE1 4.34Å; Y173-Y182 HydrophobicContact CE1-CG 4.07Å; Y173-Y182 HydrophobicContact CG-CD2 4.18Å; Y173-Y182 HydrophobicContact CG-CE2 4.49Å; Y173-Y182 HydrophobicContact CG-CG 4.37Å; Y174-Y182 WeakPolarHBondContact O-CE2 3.33Å; C178-Y182 CarbonylContact O-C 3.56Å; C178-Y182 PolarHBondContact O-N 2.91Å; Y182-R184 PolarHBondContact O-N 3.34Å
183	G	96.3	Very high	93.5	Very high	40 Å²	40	74.6 Å²	74.6	41%	0.412	37%	0.37	S	S	.	.	S	Bend	trans	60.5	32.4	-174.5	0	0	0	0	0	112.2	C178 R179	C178-G183 PolarHBondContact O-N 2.93Å; R179-G183 VanDerWaalsContact NH1-C 3.27Å; R179-G183 PolarHBondContact NH1-O 3.45Å; R179-G183 PolarHBondContact NH2-O 3.13Å; R179-G183 VanDerWaalsContact O-CA 3.23Å; R179-G183 WeakPolarHBondContact O-CA 3.03Å; R179-G183 PolarHBondContact O-N 2.86Å; R179-G183 VanDerWaalsContact O-N 3.1Å
184	R	95.1	Very high	93.2	Very high	72 Å²	72	75 Å²	75	27%	0.272	37%	0.374	S	S	.	.			trans	-119.2	148.1	179.2	-71.1	-172.8	173.8	-83.5	-4.7	112.2	C178 R179 Y182 E197 A198 C200	C178-R184 CarbonylContact C-O 3.55Å; C178-R184 WeakPolarHBondContact CB-O 3.27Å; C178-R184 PolarHBondContact O-N 2.79Å; C178-R184 VanDerWaalsContact O-N 3.17Å; R179-R184 WeakPolarHBondContact CA-O 3.4Å; R179-R184 PolarHBondContact N-O 3.16Å; R179-R184 VanDerWaalsContact NH2-N 3.16Å; R179-R184 PolarHBondContact NH2-O 2.75Å; Y182-R184 PolarHBondContact O-N 3.34Å; R184-E197 IonicContact NH1-OE1 3.45Å; R184-A198 PolarHBondContact NH1-O 3.35Å; R184-C200 HydrophobicContact CB-CB 3.79Å
185	V	94.4	Very high	93.1	Very high	89 Å²	89	74.6 Å²	74.6	54%	0.539	37%	0.372	S	S	.	.			trans	-81.3	140.8	170.9	179.3	0	0	0	0	107.5	V188	V185-V188 HydrophobicContact CB-CG2 3.7Å; V185-V188 HydrophobicContact CG1-CG2 4Å
186	S	93.6	Very high	93.1	Very high	41 Å²	41	79 Å²	79	29%	0.287	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-73.6	140.6	179.6	-164.6	0	0	0	0	110.7	V188 C200 D202	S186-V188 VanDerWaalsContact C-N 3.33Å; S186-V188 PolarHBondContact O-N 2.67Å; S186-C200 CarbonylContact C-O 3.47Å; S186-C200 WeakPolarHBondContact CA-O 3.4Å; S186-D202 PolarHBondContact OG-OD1 3.24Å
187	N	89	Confident	93.2	Very high	87 Å²	87	79.6 Å²	79.6	47%	0.465	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	43.3	170.2	-54.1	-48.7	0	0	0	114.5	C200 T201 D202	N187-C200 PolarHBondContact N-O 3.19Å; N187-T201 WeakPolarHBondContact OD1-CB 3.45Å; N187-T201 PolarHBondContact OD1-OG1 3.21Å; N187-D202 PolarHBondContact ND2-OD1 2.95Å
188	V	90.9	Very high	93.4	Very high	44 Å²	44	76.4 Å²	76.4	27%	0.267	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-59.5	130.8	176.4	176.9	0	0	0	0	110.1	V185 S186 L199	V185-V188 HydrophobicContact CB-CG2 3.7Å; V185-V188 HydrophobicContact CG1-CG2 4Å; S186-V188 VanDerWaalsContact C-N 3.33Å; S186-V188 PolarHBondContact O-N 2.67Å; V188-L199 HydrophobicContact CB-CD2 4.23Å; V188-L199 WeakPolarHBondContact O-CD2 3.36Å
189	P	90.4	Very high	93.4	Very high	114 Å²	114	77.6 Å²	77.6	74%	0.74	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-65.8	138.9	177.9	26.9	-34.5	0	0	0	111.1
190	L	92.1	Very high	93.4	Very high	26 Å²	26	70.5 Å²	70.5	14%	0.136	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-95.5	133.5	-178.3	-66.5	165.9	0	0	0	110.7	E197 L199 G221 R222	L190-E197 HydrophobicContact CD2-CB 4.42Å; L190-L199 HydrophobicContact CD1-CD1 3.55Å; L190-L199 HydrophobicContact CD1-CD2 4.38Å; L190-L199 HydrophobicContact CD1-CG 4.09Å; L190-L199 HydrophobicContact CD2-CD1 4.42Å; L190-L199 HydrophobicContact CD2-CD2 3.65Å; L190-L199 HydrophobicContact CD2-CG 4.17Å; L190-L199 HydrophobicContact CG-CD1 3.99Å; L190-L199 HydrophobicContact CG-CD2 4.03Å; L190-L199 HydrophobicContact CG-CG 4.29Å; L190-G221 WeakPolarHBondContact CB-O 3.37Å; L190-R222 HydrophobicContact CD1-CG 4.45Å; L190-R222 VanDerWaalsContact CD1-NE 3.27Å
191	S	92	Very high	93.4	Very high	49 Å²	49	61.4 Å²	61.4	34%	0.343	32%	0.323	S	S	.	.			trans	-113.4	169.9	174.7	79.4	0	0	0	0	110.1	H193 N194 E195	S191-H193 PolarHBondContact O-N 3.41Å; S191-H193 VanDerWaalsContact O-N 3.08Å; S191-H193 PolarHBondContact OG-N 3.19Å; S191-N194 WeakPolarHBondContact CA-OD1 2.99Å; S191-N194 WeakPolarHBondContact CB-OD1 3.31Å; S191-N194 PolarHBondContact N-OD1 2.9Å; S191-N194 PolarHBondContact O-N 2.03Å; S191-N194 PolarHBondContact O-OD1 3.31Å; S191-N194 PolarHBondContact OG-OD1 3.35Å; S191-E195 WeakPolarHBondContact O-CG 3.5Å; S191-E195 PolarHBondContact O-N 3.24Å
192	R	90.2	Very high	93.3	Very high	168 Å²	168	61.2 Å²	61.2	63%	0.634	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.9	174.2	-72.1	-174.2	176.5	-175.4	-0.4	114.1	P223	R192-P223 HydrophobicContact CG-CB 3.98Å
193	H	90.8	Very high	92.9	Very high	186 Å²	186	62.2 Å²	62.2	86%	0.861	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-19.9	-177.5	-57.2	94.1	0	0	0	113.5	S191	S191-H193 PolarHBondContact O-N 3.41Å; S191-H193 VanDerWaalsContact O-N 3.08Å; S191-H193 PolarHBondContact OG-N 3.19Å
194	N	92.1	Very high	92.3	Very high	39 Å²	39	61 Å²	61	21%	0.209	33%	0.325	C	S	.	.	S	Bend	trans	-128.1	32.7	-176.3	65.4	-24.9	0	0	0	112.3	S191 Q196 E197 R222	S191-N194 WeakPolarHBondContact CA-OD1 2.99Å; S191-N194 WeakPolarHBondContact CB-OD1 3.31Å; S191-N194 PolarHBondContact N-OD1 2.9Å; S191-N194 PolarHBondContact O-N 2.03Å; S191-N194 PolarHBondContact O-OD1 3.31Å; S191-N194 PolarHBondContact OG-OD1 3.35Å; N194-Q196 PolarHBondContact O-N 3.36Å; N194-Q196 VanDerWaalsContact O-N 3.07Å; N194-E197 HydrophobicContact CB-CB 4.12Å; N194-E197 PolarHBondContact ND2-OE2 3.41Å; N194-E197 VanDerWaalsContact O-CB 3.26Å; N194-E197 WeakPolarHBondContact O-CB 3.08Å; N194-E197 PolarHBondContact O-N 2.73Å; N194-R222 PolarHBondContact O-NH1 3.44Å; N194-R222 VanDerWaalsContact O-NH1 3.11Å
195	E	93.5	Very high	91.6	Very high	5 Å²	5	59.1 Å²	59.1	2%	0.023	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.8	-179.9	-64.3	-166.9	169.6	0	0	114.4	S191 R222 P223 S224 V233 L234	S191-E195 WeakPolarHBondContact O-CG 3.5Å; S191-E195 PolarHBondContact O-N 3.24Å; E195-R222 WeakPolarHBondContact O-CD 3.34Å; E195-R222 VanDerWaalsContact O-CZ 3.22Å; E195-R222 PolarHBondContact O-NE 2.82Å; E195-R222 PolarHBondContact O-NH1 2.9Å; E195-P223 WeakPolarHBondContact OE1-CD 3.43Å; E195-S224 WeakPolarHBondContact OE1-CB 3.24Å; E195-S224 PolarHBondContact OE1-N 3.43Å; E195-S224 PolarHBondContact OE1-OG 2.66Å; E195-S224 WeakPolarHBondContact OE2-CB 3.44Å; E195-S224 PolarHBondContact OE2-OG 2.99Å; E195-S224 VanDerWaalsContact OE2-OG 3.05Å; E195-V233 HydrophobicContact CB-CG1 4.35Å; E195-L234 HydrophobicContact CB-CD2 3.95Å; E195-L234 WeakPolarHBondContact OE2-CD1 3.41Å; E195-L234 WeakPolarHBondContact OE2-CG 3.49Å
196	Q	94.8	Very high	90.5	Very high	93 Å²	93	57.8 Å²	57.8	44%	0.435	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7.2	173.8	-64.9	-179.9	-36.9	0	0	113.2	N194 A198 V233 W237	N194-Q196 PolarHBondContact O-N 3.36Å; N194-Q196 VanDerWaalsContact O-N 3.07Å; Q196-A198 PolarHBondContact O-N 2.82Å; Q196-V233 HydrophobicContact CG-CG1 3.59Å; Q196-V233 PolarHBondContact NE2-O 3.26Å; Q196-W237 HydrophobicContact CB-CD2 4.47Å; Q196-W237 HydrophobicContact CB-CE3 3.89Å; Q196-W237 HydrophobicContact CB-CZ3 4.33Å; Q196-W237 HydrophobicContact CG-CB 4.18Å; Q196-W237 HydrophobicContact CG-CE3 4.17Å; Q196-W237 WeakPolarHBondContact O-CH2 3.48Å; Q196-W237 WeakPolarHBondContact O-CZ3 3.41Å
197	E	93.9	Very high	88.9	Confident	67 Å²	67	60.2 Å²	60.2	31%	0.313	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-76.4	122.1	-179.6	-177.8	171.9	-173.1	0	0	111.5	R184 L190 N194 L199 R222	R184-E197 IonicContact NH1-OE1 3.45Å; L190-E197 HydrophobicContact CD2-CB 4.42Å; N194-E197 HydrophobicContact CB-CB 4.12Å; N194-E197 PolarHBondContact ND2-OE2 3.41Å; N194-E197 VanDerWaalsContact O-CB 3.26Å; N194-E197 WeakPolarHBondContact O-CB 3.08Å; N194-E197 PolarHBondContact O-N 2.73Å; E197-L199 PolarHBondContact O-N 3.25Å; E197-R222 VanDerWaalsContact O-CZ 3.29Å; E197-R222 PolarHBondContact O-NH1 3.27Å; E197-R222 PolarHBondContact O-NH2 2.74Å
198	A	96.4	Very high	87.5	Confident	7 Å²	7	60.8 Å²	60.8	6%	0.058	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-68.4	121.1	171.6	0	0	0	0	0	111.3	P170 Y173 R184 Q196 W237	P170-A198 HydrophobicContact CB-CB 3.69Å; P170-A198 WeakPolarHBondContact O-CB 3.44Å; Y173-A198 HydrophobicContact CD2-CB 4.17Å; Y173-A198 HydrophobicContact CE2-CB 3.91Å; R184-A198 PolarHBondContact NH1-O 3.35Å; Q196-A198 PolarHBondContact O-N 2.82Å; A198-W237 HydrophobicContact CB-CH2 4.35Å
199	L	95.8	Very high	86	Confident	30 Å²	30	63.1 Å²	63.1	16%	0.157	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-81.9	160	-179.6	-65.5	-175.1	0	0	0	111.7	Q172 Y173 V188 L190 E197	Q172-L199 PolarHBondContact NE2-O 3.08Å; Y173-L199 WeakPolarHBondContact CB-O 3.32Å; Y173-L199 WeakPolarHBondContact CD2-O 3.16Å; Y173-L199 PolarHBondContact N-O 3.41Å; V188-L199 HydrophobicContact CB-CD2 4.23Å; V188-L199 WeakPolarHBondContact O-CD2 3.36Å; L190-L199 HydrophobicContact CD1-CD1 3.55Å; L190-L199 HydrophobicContact CD1-CD2 4.38Å; L190-L199 HydrophobicContact CD1-CG 4.09Å; L190-L199 HydrophobicContact CD2-CD1 4.42Å; L190-L199 HydrophobicContact CD2-CD2 3.65Å; L190-L199 HydrophobicContact CD2-CG 4.17Å; L190-L199 HydrophobicContact CG-CD1 3.99Å; L190-L199 HydrophobicContact CG-CD2 4.03Å; L190-L199 HydrophobicContact CG-CG 4.29Å; E197-L199 PolarHBondContact O-N 3.25Å
200	C	97	Very high	84.1	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.014	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.3	164.2	-166.7	0	0	0	0	109.3	Y173 C178 R184 S186 N187	Y173-C200 WeakPolarHBondContact O-CA 3.47Å; C178-C200 VanDerWaalsContact CA-SG 3.53Å; C178-C200 HydrophobicContact CB-CB 3.81Å; C178-C200 WeakPolarHBondContact CB-SG 3.31Å; C178-C200 VanDerWaalsContact SG-C 3.56Å; C178-C200 WeakPolarHBondContact SG-CB 3.3Å; C178-C200 CovalentContact SG-SG 2.03Å; C178-C200 PolarHBondContact SG-SG 3.08Å; R184-C200 HydrophobicContact CB-CB 3.79Å; S186-C200 CarbonylContact C-O 3.47Å; S186-C200 WeakPolarHBondContact CA-O 3.4Å; N187-C200 PolarHBondContact N-O 3.19Å
201	T	94.5	Very high	82.7	Confident	16 Å²	16	69.3 Å²	69.3	10%	0.098	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.1	179.9	-169.5	0	0	0	0	111.5	Y173 Y174 S175 N187 A203	Y173-T201 PolarHBondContact O-N 2.04Å; Y173-T201 VanDerWaalsContact O-N 3.08Å; Y174-T201 WeakPolarHBondContact CA-O 3.33Å; Y174-T201 HydrophobicContact CD1-CG2 3.48Å; Y174-T201 VanDerWaalsContact CD1-CG2 3.48Å; Y174-T201 HydrophobicContact CE1-CG2 3.54Å; Y174-T201 HydrophobicContact CG-CG2 4.44Å; S175-T201 PolarHBondContact N-O 3.4Å; N187-T201 WeakPolarHBondContact OD1-CB 3.45Å; N187-T201 PolarHBondContact OD1-OG1 3.21Å; T201-A203 WeakPolarHBondContact OG1-CB 3.15Å; T201-A203 PolarHBondContact OG1-N 3.44Å
202	D	91.3	Very high	82.2	Confident	64 Å²	64	70.7 Å²	70.7	34%	0.342	39%	0.386	S	S	.	.			trans	-107.5	2.7	174	55.6	-17.6	0	0	0	112.4	S186 N187 H204 S205	S186-D202 PolarHBondContact OG-OD1 3.24Å; N187-D202 PolarHBondContact ND2-OD1 2.95Å; D202-H204 PolarHBondContact O-N 2.02Å; D202-H204 VanDerWaalsContact O-N 3.1Å; D202-S205 WeakPolarHBondContact O-CB 3.32Å; D202-S205 PolarHBondContact O-N 3.05Å
203	A	86.8	Confident	82.2	Confident	68 Å²	68	69.1 Å²	69.1	56%	0.562	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-58	-28.7	-174.5	0	0	0	0	0	114	T201 S205 A206	T201-A203 WeakPolarHBondContact OG1-CB 3.15Å; T201-A203 PolarHBondContact OG1-N 3.44Å; A203-S205 PolarHBondContact O-N 2.86Å; A203-A206 PolarHBondContact O-N 3.07Å
204	H	84.2	Confident	82.3	Confident	15 Å²	15	60.7 Å²	60.7	7%	0.069	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-72.6	-14.4	176.9	66.9	-62.3	0	0	0	113.7	R152 P153 D154 Y174 S175 D202 I214	R152-H204 PolarHBondContact NH1-O 3.22Å; R152-H204 VanDerWaalsContact NH1-O 3.13Å; P153-H204 PolarHBondContact O-CD2 3.03Å; P153-H204 PolarHBondContact O-NE2 2.83Å; D154-H204 PolarHBondContact O-CE1 3.4Å; D154-H204 PolarHBondContact O-NE2 3.18Å; Y174-H204 HydrophobicContact CD1-CB 4.33Å; Y174-H204 AromaticContact CD1-CG 3.97Å; Y174-H204 AromaticContact CD1-ND1 3.6Å; S175-H204 PolarHBondContact N-CE1 3.43Å; D202-H204 PolarHBondContact O-N 2.02Å; D202-H204 VanDerWaalsContact O-N 3.1Å; H204-I214 HydrophobicContact CB-CD1 3.78Å; H204-I214 HydrophobicContact CB-CG1 4.1Å
205	S	80.8	Confident	82.4	Confident	31 Å²	31	61.7 Å²	61.7	22%	0.217	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-96.7	-12.7	179.5	-54	0	0	0	0	113.3	D202 A203	D202-S205 WeakPolarHBondContact O-CB 3.32Å; D202-S205 PolarHBondContact O-N 3.05Å; A203-S205 PolarHBondContact O-N 2.86Å
206	A	70.7	Confident	82.5	Confident	62 Å²	62	62 Å²	62	51%	0.512	36%	0.356	S	S	.	.	S	Bend	trans	-72	134.6	-177.1	0	0	0	0	0	112	A203	A203-A206 PolarHBondContact O-N 3.07Å
207	A	59.5	Low	82.6	Confident	91 Å²	91	59.4 Å²	59.4	75%	0.752	35%	0.351	S	S	*	.	S	Bend	trans	-83.7	151.1	175.1	0	0	0	0	0	111.8
208	P	59.8	Low	82.7	Confident	100 Å²	100	56.3 Å²	56.3	65%	0.649	34%	0.337	S	S	*	.	S	Bend	cis	-69.8	136.3	-5.5	29	-32	0	0	0	109.8	R210	P208-R210 HydrophobicContact CG-CG 4.35Å; P208-R210 PolarHBondContact O-N 3.41Å
209	L	59.4	Low	82.7	Confident	92 Å²	92	58.3 Å²	58.3	48%	0.482	35%	0.346	S	S	.	.			trans	-64.2	74.2	174.3	-77.8	177.1	0	0	0	108.8	R152 G211	R152-L209 VanDerWaalsContact CZ-CD2 3.45Å; L209-G211 PolarHBondContact O-N 2.88Å
210	R	50.2	Low	82.6	Confident	226 Å²	226	63.6 Å²	63.6	85%	0.853	37%	0.37	S	S	*	.			trans	-69.1	99.3	-179.2	-87.3	-174.8	173.6	170.4	-0.6	109.2	P208	P208-R210 HydrophobicContact CG-CG 4.35Å; P208-R210 PolarHBondContact O-N 3.41Å
211	G	62.6	Low	82.4	Confident	44 Å²	44	66.3 Å²	66.3	45%	0.454	40%	0.398	S	S	.	.	S	Bend	trans	73	165.7	173	0	0	0	0	0	115.1	R152 L209 R213	R152-G211 VanDerWaalsContact CZ-O 3.3Å; R152-G211 PolarHBondContact NH2-O 3.11Å; L209-G211 PolarHBondContact O-N 2.88Å; G211-R213 VanDerWaalsContact C-N 3.31Å; G211-R213 PolarHBondContact O-N 3.5Å
212	D	81.7	Confident	82.4	Confident	78 Å²	78	66.1 Å²	66.1	42%	0.417	40%	0.396	S	S	.	.	S	Bend	trans	-93.1	18.7	-172.7	-50.7	-47.7	0	0	0	113.4	Q147 F148	Q147-D212 CarbonylContact C-O 3.56Å; Q147-D212 WeakPolarHBondContact CA-O 3.49Å; F148-D212 HydrophobicContact CB-CB 4.48Å; F148-D212 WeakPolarHBondContact CD2-O 3.49Å; F148-D212 PolarHBondContact N-O 2.77Å; F148-D212 WeakPolarHBondContact O-CB 3.39Å
213	R	89.8	Confident	82.5	Confident	136 Å²	136	65.2 Å²	65.2	51%	0.513	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128	-172.7	-172.5	171.6	-71.2	-170.7	-2.3	111.5	S145 M146 G211	S145-R213 WeakPolarHBondContact OG-CD 3.49Å; M146-R213 CarbonylContact O-C 3.27Å; M146-R213 WeakPolarHBondContact O-CA 3.44Å; G211-R213 VanDerWaalsContact C-N 3.31Å; G211-R213 PolarHBondContact O-N 3.5Å
214	I	93.3	Very high	83	Confident	8 Å²	8	63 Å²	63	4%	0.041	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.9	168	-57.5	178.1	0	0	0	107.6	M146 F148 R152 M156 Y174 H204	M146-I214 HydrophobicContact CE-CB 4.45Å; M146-I214 HydrophobicContact CE-CG2 4.3Å; M146-I214 PolarHBondContact N-O 3.4Å; M146-I214 PolarHBondContact O-N 2.91Å; F148-I214 HydrophobicContact CD2-CD1 4.36Å; F148-I214 HydrophobicContact CD2-CG1 4.36Å; F148-I214 HydrophobicContact CE2-CB 4.12Å; F148-I214 HydrophobicContact CE2-CD1 3.65Å; F148-I214 HydrophobicContact CE2-CG1 3.85Å; F148-I214 HydrophobicContact CZ-CD1 4.29Å; R152-I214 HydrophobicContact CB-CD1 4.4Å; R152-I214 HydrophobicContact CG-CD1 4.2Å; M156-I214 HydrophobicContact CE-CB 4.14Å; M156-I214 HydrophobicContact CE-CD1 3.51Å; M156-I214 HydrophobicContact CE-CG1 4.41Å; M156-I214 HydrophobicContact CE-CG2 3.67Å; Y174-I214 HydrophobicContact CD1-CG2 4.3Å; Y174-I214 HydrophobicContact CE1-CG2 3.75Å; Y174-I214 HydrophobicContact CE2-CG2 4.29Å; H204-I214 HydrophobicContact CB-CD1 3.78Å; H204-I214 HydrophobicContact CB-CG1 4.1Å
215	A	93.8	Very high	83.5	Confident	60 Å²	60	63.8 Å²	63.8	50%	0.496	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.8	176.2	0	0	0	0	0	110.3	I144 Y174	I144-A215 CarbonylContact O-C 3.59Å; I144-A215 WeakPolarHBondContact O-CA 3.22Å; Y174-A215 PolarHBondContact OH-O 3.17Å
216	F	96.2	Very high	84	Confident	11 Å²	11	70.3 Å²	70.3	5%	0.048	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.2	171.1	169.4	-120.2	0	0	0	108.4	Y143 I144 I158 F171 Q172 Y174 T218	Y143-F216 CarbonylContact C-O 3.6Å; Y143-F216 WeakPolarHBondContact CA-O 3.36Å; Y143-F216 WeakPolarHBondContact CB-O 3.08Å; I144-F216 HydrophobicContact CB-CB 4.49Å; I144-F216 HydrophobicContact CD1-CD1 4.26Å; I144-F216 HydrophobicContact CG1-CD1 4.49Å; I144-F216 PolarHBondContact N-O 3.34Å; I144-F216 PolarHBondContact O-N 3.02Å; I158-F216 HydrophobicContact CD1-CB 3.96Å; I158-F216 HydrophobicContact CD1-CG 4.41Å; F171-F216 HydrophobicContact CB-CE1 4.31Å; F171-F216 HydrophobicContact CD1-CD1 4.29Å; F171-F216 AromaticContact CD1-CE1 3.63Å; F171-F216 HydrophobicContact CD1-CE1 3.63Å; F171-F216 AromaticContact CD2-CE1 3.4Å; F171-F216 HydrophobicContact CD2-CE1 3.4Å; F171-F216 AromaticContact CD2-CZ 3.53Å; F171-F216 HydrophobicContact CD2-CZ 3.53Å; F171-F216 HydrophobicContact CE1-CD1 4.47Å; F171-F216 AromaticContact CE1-CE1 3.74Å; F171-F216 HydrophobicContact CE1-CE1 3.74Å; F171-F216 AromaticContact CE2-CE1 3.54Å; F171-F216 HydrophobicContact CE2-CE1 3.54Å; F171-F216 AromaticContact CE2-CZ 3.76Å; F171-F216 HydrophobicContact CE2-CZ 3.76Å; F171-F216 HydrophobicContact CG-CD1 4.4Å; F171-F216 AromaticContact CG-CE1 3.48Å; F171-F216 HydrophobicContact CG-CE1 3.48Å; F171-F216 VanDerWaalsContact CG-CE1 3.48Å; F171-F216 AromaticContact CG-CZ 4Å; F171-F216 HydrophobicContact CG-CZ 4Å; F171-F216 AromaticContact CZ-CE1 3.72Å; F171-F216 HydrophobicContact CZ-CE1 3.72Å; F171-F216 HydrophobicContact CZ-CZ 4.37Å; Q172-F216 HydrophobicContact CB-CD2 3.67Å; Q172-F216 HydrophobicContact CB-CE2 3.77Å; Q172-F216 HydrophobicContact CB-CG 4.06Å; Q172-F216 HydrophobicContact CB-CZ 4.22Å; Q172-F216 HydrophobicContact CG-CD2 3.76Å; Q172-F216 HydrophobicContact CG-CE2 4.13Å; Q172-F216 HydrophobicContact CG-CG 4.39Å; Y174-F216 WeakPolarHBondContact OH-CB 3.48Å; F216-T218 HydrophobicContact CD1-CG2 4.28Å; F216-T218 HydrophobicContact CE1-CG2 3.76Å; F216-T218 HydrophobicContact CZ-CG2 4.39Å
217	A	96.7	Very high	85	Confident	39 Å²	39	70.2 Å²	70.2	32%	0.322	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.8	172.9	0	0	0	0	0	110.1	L219 E220	A217-L219 VanDerWaalsContact C-N 3.32Å; A217-L219 PolarHBondContact O-N 2.86Å; A217-E220 HydrophobicContact CB-CB 3.9Å; A217-E220 PolarHBondContact O-N 2.65Å
218	T	96.7	Very high	86.5	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.018	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-27.9	-166.2	56.6	0	0	0	0	114.3	V141 T142 F171 F216 W237	V141-T218 HydrophobicContact CB-CG2 4.41Å; V141-T218 HydrophobicContact CG1-CG2 4.01Å; V141-T218 WeakPolarHBondContact O-CB 3.28Å; V141-T218 VanDerWaalsContact O-CG2 3.24Å; V141-T218 WeakPolarHBondContact O-CG2 2.85Å; V141-T218 PolarHBondContact O-OG1 3.24Å; T142-T218 PolarHBondContact O-N 2.89Å; T142-T218 PolarHBondContact O-OG1 2.9Å; F171-T218 HydrophobicContact CE1-CG2 4.01Å; F171-T218 HydrophobicContact CE2-CG2 4.07Å; F171-T218 HydrophobicContact CZ-CG2 3.42Å; F171-T218 VanDerWaalsContact CZ-CG2 3.42Å; F216-T218 HydrophobicContact CD1-CG2 4.28Å; F216-T218 HydrophobicContact CE1-CG2 3.76Å; F216-T218 HydrophobicContact CZ-CG2 4.39Å; T218-W237 PolarHBondContact O-NE1 2.79Å
219	L	96.1	Very high	87.9	Confident	48 Å²	48	65.3 Å²	65.3	25%	0.251	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	0.2	-177.9	-64.5	-177.8	0	0	0	113.8	A217 G221 R222 A225 F228 L234 V238	A217-L219 VanDerWaalsContact C-N 3.32Å; A217-L219 PolarHBondContact O-N 2.86Å; L219-G221 PolarHBondContact O-N 2.91Å; L219-R222 WeakPolarHBondContact O-CB 3.13Å; L219-R222 PolarHBondContact O-N 3.2Å; L219-A225 HydrophobicContact CB-CB 3.99Å; L219-A225 HydrophobicContact CD1-CB 4.47Å; L219-F228 HydrophobicContact CD1-CD2 4.16Å; L219-F228 HydrophobicContact CD2-CD2 4.36Å; L219-L234 HydrophobicContact CD2-CB 4.18Å; L219-L234 HydrophobicContact CD2-CD1 4.11Å; L219-L234 HydrophobicContact CD2-CD2 4.06Å; L219-L234 HydrophobicContact CD2-CG 4.36Å; L219-V238 HydrophobicContact CD2-CG1 3.55Å; L219-V238 HydrophobicContact CG-CG1 3.96Å
220	E	93.9	Very high	89.4	Confident	141 Å²	141	68.5 Å²	68.5	66%	0.659	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	132.8	-178.3	-175.1	173.3	-164.8	0	0	111.5	A217 R222	A217-E220 HydrophobicContact CB-CB 3.9Å; A217-E220 PolarHBondContact O-N 2.65Å; E220-R222 PolarHBondContact O-N 3.4Å
221	G	91.7	Very high	91.5	Very high	59 Å²	59	58.3 Å²	58.3	61%	0.608	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	1.5	-178.1	0	0	0	0	0	115.5	L190 L219 P223	L190-G221 WeakPolarHBondContact CB-O 3.37Å; L219-G221 PolarHBondContact O-N 2.91Å; G221-P223 WeakPolarHBondContact O-CD 3.45Å
222	R	95.3	Very high	93	Very high	12 Å²	12	60 Å²	60	5%	0.045	32%	0.323	C	S	.	.			trans	-87.8	118.7	-177.9	-56.6	-71.5	167.9	-179	-2	110.9	L190 N194 E195 E197 L219 E220 S224 A225 L234	L190-R222 HydrophobicContact CD1-CG 4.45Å; L190-R222 VanDerWaalsContact CD1-NE 3.27Å; N194-R222 PolarHBondContact O-NH1 3.44Å; N194-R222 VanDerWaalsContact O-NH1 3.11Å; E195-R222 WeakPolarHBondContact O-CD 3.34Å; E195-R222 VanDerWaalsContact O-CZ 3.22Å; E195-R222 PolarHBondContact O-NE 2.82Å; E195-R222 PolarHBondContact O-NH1 2.9Å; E197-R222 VanDerWaalsContact O-CZ 3.29Å; E197-R222 PolarHBondContact O-NH1 3.27Å; E197-R222 PolarHBondContact O-NH2 2.74Å; L219-R222 WeakPolarHBondContact O-CB 3.13Å; L219-R222 PolarHBondContact O-N 3.2Å; E220-R222 PolarHBondContact O-N 3.4Å; R222-S224 PolarHBondContact O-N 3.14Å; R222-A225 HydrophobicContact CB-CB 4.46Å; R222-A225 WeakPolarHBondContact O-CB 3.03Å; R222-A225 PolarHBondContact O-N 3.06Å; R222-A225 VanDerWaalsContact O-N 3.09Å; R222-L234 HydrophobicContact CB-CD1 4.43Å; R222-L234 HydrophobicContact CB-CD2 4.09Å; R222-L234 HydrophobicContact CG-CD2 4.19Å
223	P	94.2	Very high	93.7	Very high	45 Å²	45	59.2 Å²	59.2	29%	0.292	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-56.8	-41	-174.8	-28.7	36	0	0	0	114.8	R192 E195 G221 A225 F226	R192-P223 HydrophobicContact CG-CB 3.98Å; E195-P223 WeakPolarHBondContact OE1-CD 3.43Å; G221-P223 WeakPolarHBondContact O-CD 3.45Å; P223-A225 PolarHBondContact O-N 3.02Å; P223-F226 WeakPolarHBondContact O-CD1 3.05Å; P223-F226 WeakPolarHBondContact O-CE1 3.46Å
224	S	95.6	Very high	94	Very high	22 Å²	22	52.7 Å²	52.7	15%	0.154	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-79.8	7.5	-178.9	-46.8	0	0	0	0	114.5	E195 R222 F226 D227 F228 L234	E195-S224 WeakPolarHBondContact OE1-CB 3.24Å; E195-S224 PolarHBondContact OE1-N 3.43Å; E195-S224 PolarHBondContact OE1-OG 2.66Å; E195-S224 WeakPolarHBondContact OE2-CB 3.44Å; E195-S224 PolarHBondContact OE2-OG 2.99Å; E195-S224 VanDerWaalsContact OE2-OG 3.05Å; R222-S224 PolarHBondContact O-N 3.14Å; S224-F226 VanDerWaalsContact C-N 3.28Å; S224-F226 PolarHBondContact O-N 3.06Å; S224-D227 CarbonylContact O-C 3.55Å; S224-D227 VanDerWaalsContact O-C 3.27Å; S224-D227 PolarHBondContact O-N 2.95Å; S224-F228 PolarHBondContact O-N 3.3Å; S224-L234 WeakPolarHBondContact O-CD1 3.38Å
225	A	94.7	Very high	94.2	Very high	31 Å²	31	53.4 Å²	53.4	26%	0.256	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.5	-35.1	-176.8	0	0	0	0	0	113.4	L219 R222 P223 D227 F228	L219-A225 HydrophobicContact CB-CB 3.99Å; L219-A225 HydrophobicContact CD1-CB 4.47Å; R222-A225 HydrophobicContact CB-CB 4.46Å; R222-A225 WeakPolarHBondContact O-CB 3.03Å; R222-A225 PolarHBondContact O-N 3.06Å; R222-A225 VanDerWaalsContact O-N 3.09Å; P223-A225 PolarHBondContact O-N 3.02Å; A225-D227 PolarHBondContact O-N 2.76Å; A225-F228 PolarHBondContact O-N 3.37Å
226	F	91.7	Very high	94.3	Very high	168 Å²	168	54.5 Å²	54.5	74%	0.737	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-69.3	-22.3	177.4	70.3	-93.4	0	0	0	113.1	P223 S224	P223-F226 WeakPolarHBondContact O-CD1 3.05Å; P223-F226 WeakPolarHBondContact O-CE1 3.46Å; S224-F226 VanDerWaalsContact C-N 3.28Å; S224-F226 PolarHBondContact O-N 3.06Å
227	D	91.7	Very high	94.3	Very high	61 Å²	61	54.2 Å²	54.2	33%	0.326	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-115.6	40.6	177.3	-166	19.2	0	0	0	111	S224 A225 E229 R230 S231	S224-D227 CarbonylContact O-C 3.55Å; S224-D227 VanDerWaalsContact O-C 3.27Å; S224-D227 PolarHBondContact O-N 2.95Å; A225-D227 PolarHBondContact O-N 2.76Å; D227-E229 PolarHBondContact O-N 2.96Å; D227-R230 PolarHBondContact O-N 3.14Å; D227-R230 VanDerWaalsContact O-N 3.13Å; D227-R230 WeakPolarHBondContact OD1-CB 3.38Å; D227-R230 WeakPolarHBondContact OD1-CD 3.41Å; D227-R230 WeakPolarHBondContact OD1-CG 3.5Å; D227-S231 PolarHBondContact O-N 2.92Å
228	F	92.6	Very high	94.4	Very high	36 Å²	36	52.5 Å²	52.5	16%	0.158	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-55	-36.9	-177.9	171.5	-100.5	0	0	0	113	L219 S224 A225 R230 S231 L234 Q235 V238	L219-F228 HydrophobicContact CD1-CD2 4.16Å; L219-F228 HydrophobicContact CD2-CD2 4.36Å; S224-F228 PolarHBondContact O-N 3.3Å; A225-F228 PolarHBondContact O-N 3.37Å; F228-R230 PolarHBondContact O-N 2.04Å; F228-S231 PolarHBondContact O-N 3.44Å; F228-L234 HydrophobicContact CD2-CB 3.95Å; F228-L234 HydrophobicContact CE2-CB 4.29Å; F228-Q235 HydrophobicContact CD2-CG 4.46Å; F228-Q235 HydrophobicContact CE1-CG 4.19Å; F228-Q235 HydrophobicContact CE2-CB 4.41Å; F228-Q235 HydrophobicContact CE2-CG 3.87Å; F228-Q235 HydrophobicContact CZ-CB 4.38Å; F228-Q235 HydrophobicContact CZ-CG 3.72Å; F228-Q235 PolarHBondContact O-NE2 3.19Å; F228-V238 HydrophobicContact CE2-CG1 4.17Å; F228-V238 HydrophobicContact CE2-CG2 3.53Å; F228-V238 HydrophobicContact CZ-CG2 3.6Å
229	E	88.6	Confident	94.5	Very high	52 Å²	52	52.5 Å²	52.5	24%	0.243	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-62.8	-28	-178.2	-63.7	-164.1	166.6	0	0	113.1	R47 D227 Q235 A336	R47-E229 IonicContact CZ-OE1 3.95Å; R47-E229 IonicContact NE-OE1 3.08Å; R47-E229 PolarHBondContact NE-OE1 3.22Å; R47-E229 IonicContact NH1-OE1 2.61Å; R47-E229 PolarHBondContact NH1-OE1 3.49Å; R47-E229 IonicContact NH2-OE1 3.97Å; R47-E229 PolarHBondContact NH2-OE1 2.85Å; R47-E229 VanDerWaalsContact NH2-OE1 3.16Å; D227-E229 PolarHBondContact O-N 2.96Å; E229-Q235 VanDerWaalsContact C-NE2 3.27Å; E229-Q235 PolarHBondContact O-NE2 2.94Å; E229-A336 PolarHBondContact OE2-N 3.03Å
230	R	89.7	Confident	94.6	Very high	159 Å²	159	50.2 Å²	50.2	60%	0.6	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-102.7	-5.5	180	-57.8	-179.4	178.8	-171.1	-0.1	113.3	D227 F228 P232 D337	D227-R230 PolarHBondContact O-N 3.14Å; D227-R230 VanDerWaalsContact O-N 3.13Å; D227-R230 WeakPolarHBondContact OD1-CB 3.38Å; D227-R230 WeakPolarHBondContact OD1-CD 3.41Å; D227-R230 WeakPolarHBondContact OD1-CG 3.5Å; F228-R230 PolarHBondContact O-N 2.04Å; R230-P232 WeakPolarHBondContact O-CD 3.22Å; R230-D337 IonicContact CZ-OD2 3.62Å; R230-D337 IonicContact NH2-OD2 2.74Å; R230-D337 PolarHBondContact NH2-OD2 2.98Å
231	S	94.8	Very high	94.8	Very high	12 Å²	12	43.5 Å²	43.5	8%	0.084	24%	0.238	C	C	.	.			trans	-95.2	94.7	177.6	-178.8	0	0	0	0	111.9	D227 F228 V233 L234 Q235	D227-S231 PolarHBondContact O-N 2.92Å; F228-S231 PolarHBondContact O-N 3.44Å; S231-V233 PolarHBondContact O-N 2.84Å; S231-L234 PolarHBondContact O-N 2.04Å; S231-L234 PolarHBondContact OG-N 3.25Å; S231-Q235 VanDerWaalsContact O-CG 3.24Å; S231-Q235 WeakPolarHBondContact O-CG 3.43Å; S231-Q235 PolarHBondContact O-N 3.32Å
232	P	94.8	Very high	95.1	Very high	80 Å²	80	41 Å²	41	52%	0.519	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-31.7	173.7	25.6	-34.6	0	0	0	111.8	R230 L234 Q235 D236	R230-P232 WeakPolarHBondContact O-CD 3.22Å; P232-L234 PolarHBondContact O-N 2.77Å; P232-Q235 PolarHBondContact O-N 3.11Å; P232-D236 PolarHBondContact O-N 2.74Å
233	V	96.1	Very high	95.3	Very high	60 Å²	60	40.5 Å²	40.5	36%	0.364	21%	0.209	S	C	.	.	H	α-helix	trans	-57.4	-49.2	177.1	177.6	0	0	0	0	110.9	E195 Q196 S231 W237	E195-V233 HydrophobicContact CB-CG1 4.35Å; Q196-V233 HydrophobicContact CG-CG1 3.59Å; Q196-V233 PolarHBondContact NE2-O 3.26Å; S231-V233 PolarHBondContact O-N 2.84Å; V233-W237 WeakPolarHBondContact O-CB 3.38Å; V233-W237 PolarHBondContact O-N 3.15Å
234	L	96.7	Very high	95.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-75.2	-31.7	178.1	-69.2	179.4	0	0	0	112.6	E195 L219 R222 S224 F228 S231 P232 D236 W237 V238	E195-L234 HydrophobicContact CB-CD2 3.95Å; E195-L234 WeakPolarHBondContact OE2-CD1 3.41Å; E195-L234 WeakPolarHBondContact OE2-CG 3.49Å; L219-L234 HydrophobicContact CD2-CB 4.18Å; L219-L234 HydrophobicContact CD2-CD1 4.11Å; L219-L234 HydrophobicContact CD2-CD2 4.06Å; L219-L234 HydrophobicContact CD2-CG 4.36Å; R222-L234 HydrophobicContact CB-CD1 4.43Å; R222-L234 HydrophobicContact CB-CD2 4.09Å; R222-L234 HydrophobicContact CG-CD2 4.19Å; S224-L234 WeakPolarHBondContact O-CD1 3.38Å; F228-L234 HydrophobicContact CD2-CB 3.95Å; F228-L234 HydrophobicContact CE2-CB 4.29Å; S231-L234 PolarHBondContact O-N 2.04Å; S231-L234 PolarHBondContact OG-N 3.25Å; P232-L234 PolarHBondContact O-N 2.77Å; L234-D236 VanDerWaalsContact C-N 3.3Å; L234-D236 PolarHBondContact O-N 3.47Å; L234-W237 HydrophobicContact CD2-CB 4.39Å; L234-W237 WeakPolarHBondContact O-CB 3.21Å; L234-W237 PolarHBondContact O-N 2.89Å; L234-W237 VanDerWaalsContact O-N 3.13Å; L234-V238 WeakPolarHBondContact O-CG1 3.12Å; L234-V238 WeakPolarHBondContact O-CG2 3.03Å; L234-V238 PolarHBondContact O-N 3.45Å
235	Q	96.1	Very high	95.6	Very high	22 Å²	22	40.8 Å²	40.8	10%	0.103	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-40.9	174.5	-70.7	166	25.1	0	0	111.9	F228 E229 S231 P232 T239 R333	F228-Q235 HydrophobicContact CD2-CG 4.46Å; F228-Q235 HydrophobicContact CE1-CG 4.19Å; F228-Q235 HydrophobicContact CE2-CB 4.41Å; F228-Q235 HydrophobicContact CE2-CG 3.87Å; F228-Q235 HydrophobicContact CZ-CB 4.38Å; F228-Q235 HydrophobicContact CZ-CG 3.72Å; F228-Q235 PolarHBondContact O-NE2 3.19Å; E229-Q235 VanDerWaalsContact C-NE2 3.27Å; E229-Q235 PolarHBondContact O-NE2 2.94Å; S231-Q235 VanDerWaalsContact O-CG 3.24Å; S231-Q235 WeakPolarHBondContact O-CG 3.43Å; S231-Q235 PolarHBondContact O-N 3.32Å; P232-Q235 PolarHBondContact O-N 3.11Å; Q235-T239 WeakPolarHBondContact O-CB 3.24Å; Q235-T239 PolarHBondContact O-N 3.23Å; Q235-T239 PolarHBondContact O-OG1 3.42Å; Q235-R333 VanDerWaalsContact OE1-NE 3.08Å
236	D	95.9	Very high	95.8	Very high	84 Å²	84	40.6 Å²	40.6	45%	0.449	20%	0.195	S	C	.	.	H	α-helix	trans	-71.1	-38.5	172.7	-70.7	-16.2	0	0	0	110.9	K160 P232 L234 V238 T239	K160-D236 PolarHBondContact NZ-O 3.35Å; P232-D236 PolarHBondContact O-N 2.74Å; L234-D236 VanDerWaalsContact C-N 3.3Å; L234-D236 PolarHBondContact O-N 3.47Å; D236-V238 PolarHBondContact O-N 2.82Å; D236-T239 PolarHBondContact O-N 3.22Å; D236-T239 VanDerWaalsContact O-N 3.15Å
237	W	97.4	Very high	95.9	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-39.8	176.7	-175.3	-118.6	0	0	0	114	K160 I169 F171 Q196 A198 T218 V233 L234	K160-W237 VanDerWaalsContact NZ-C 3.33Å; K160-W237 PolarHBondContact NZ-O 3.28Å; I169-W237 HydrophobicContact CD1-CZ3 4.38Å; F171-W237 HydrophobicContact CD2-CD2 4.48Å; F171-W237 AromaticContact CD2-CE2 3.84Å; F171-W237 AromaticContact CD2-CH2 3.71Å; F171-W237 HydrophobicContact CD2-CH2 3.71Å; F171-W237 AromaticContact CD2-CZ2 3.43Å; F171-W237 HydrophobicContact CD2-CZ2 3.43Å; F171-W237 VanDerWaalsContact CD2-CZ2 3.43Å; F171-W237 HydrophobicContact CD2-CZ3 4.33Å; F171-W237 HydrophobicContact CE2-CD2 4.07Å; F171-W237 AromaticContact CE2-CE2 3.59Å; F171-W237 HydrophobicContact CE2-CH2 4.25Å; F171-W237 AromaticContact CE2-CZ2 3.72Å; F171-W237 HydrophobicContact CE2-CZ2 3.72Å; F171-W237 AromaticContact CE2-NE1 3.8Å; F171-W237 WeakPolarHBondContact CE2-O 3.5Å; Q196-W237 HydrophobicContact CB-CD2 4.47Å; Q196-W237 HydrophobicContact CB-CE3 3.89Å; Q196-W237 HydrophobicContact CB-CZ3 4.33Å; Q196-W237 HydrophobicContact CG-CB 4.18Å; Q196-W237 HydrophobicContact CG-CE3 4.17Å; Q196-W237 WeakPolarHBondContact O-CH2 3.48Å; Q196-W237 WeakPolarHBondContact O-CZ3 3.41Å; A198-W237 HydrophobicContact CB-CH2 4.35Å; T218-W237 PolarHBondContact O-NE1 2.79Å; V233-W237 WeakPolarHBondContact O-CB 3.38Å; V233-W237 PolarHBondContact O-N 3.15Å; L234-W237 HydrophobicContact CD2-CB 4.39Å; L234-W237 WeakPolarHBondContact O-CB 3.21Å; L234-W237 PolarHBondContact O-N 2.89Å; L234-W237 VanDerWaalsContact O-N 3.13Å
238	V	97.8	Very high	96	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-86.1	-9.7	178.2	-55.1	0	0	0	0	113.3	E140 V141 L219 F228 L234 D236	E140-V238 HydrophobicContact CB-CG2 4.11Å; E140-V238 HydrophobicContact CG-CG2 4.28Å; V141-V238 PolarHBondContact N-O 3.33Å; L219-V238 HydrophobicContact CD2-CG1 3.55Å; L219-V238 HydrophobicContact CG-CG1 3.96Å; F228-V238 HydrophobicContact CE2-CG1 4.17Å; F228-V238 HydrophobicContact CE2-CG2 3.53Å; F228-V238 HydrophobicContact CZ-CG2 3.6Å; L234-V238 WeakPolarHBondContact O-CG1 3.12Å; L234-V238 WeakPolarHBondContact O-CG2 3.03Å; L234-V238 PolarHBondContact O-N 3.45Å; D236-V238 PolarHBondContact O-N 2.82Å
239	T	98.3	Very high	95.9	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.025	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.8	179.1	-64.1	0	0	0	0	110.2	K138 Y139 K160 M162 Q235 D236 K290	K138-T239 HydrophobicContact CB-CG2 4.19Å; K138-T239 HydrophobicContact CD-CG2 3.98Å; K138-T239 HydrophobicContact CG-CG2 4.17Å; Y139-T239 CarbonylContact O-C 3.14Å; Y139-T239 VanDerWaalsContact O-CA 3.3Å; Y139-T239 WeakPolarHBondContact O-CA 3.3Å; K160-T239 PolarHBondContact NZ-O 3.09Å; M162-T239 VanDerWaalsContact CG-O 3.28Å; M162-T239 WeakPolarHBondContact CG-O 3.4Å; Q235-T239 WeakPolarHBondContact O-CB 3.24Å; Q235-T239 PolarHBondContact O-N 3.23Å; Q235-T239 PolarHBondContact O-OG1 3.42Å; D236-T239 PolarHBondContact O-N 3.22Å; D236-T239 VanDerWaalsContact O-N 3.15Å; T239-K290 HydrophobicContact CG2-CD 3.87Å; T239-K290 PolarHBondContact OG1-NZ 3.38Å
240	V	98.5	Very high	95.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	135.3	-177.9	-175.5	0	0	0	0	110.6	L135 K138 Y139 V141 K160 S161 F171 D242 I243	L135-V240 HydrophobicContact CD1-CG1 4.24Å; K138-V240 WeakPolarHBondContact CA-O 3.05Å; Y139-V240 PolarHBondContact N-O 3.05Å; Y139-V240 PolarHBondContact O-N 3.13Å; V141-V240 HydrophobicContact CB-CG2 3.95Å; V141-V240 HydrophobicContact CG2-CB 3.68Å; V141-V240 HydrophobicContact CG2-CG1 4.43Å; V141-V240 HydrophobicContact CG2-CG2 3.62Å; K160-V240 HydrophobicContact CB-CG1 4.36Å; K160-V240 HydrophobicContact CB-CG2 4.42Å; K160-V240 HydrophobicContact CD-CG2 4.08Å; S161-V240 WeakPolarHBondContact O-CA 3.33Å; F171-V240 HydrophobicContact CE1-CG2 3.78Å; F171-V240 HydrophobicContact CZ-CG2 4.19Å; V240-D242 WeakPolarHBondContact CG1-O 3.49Å; V240-I243 HydrophobicContact CG1-CD1 4.1Å; V240-I243 HydrophobicContact CG1-CG1 3.6Å
241	T	98.3	Very high	95.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-33.1	165.9	54.6	0	0	0	0	112.1	L135 K138 S161 D163 Y164	L135-T241 VanDerWaalsContact CB-O 3.3Å; L135-T241 WeakPolarHBondContact CB-O 3.5Å; L135-T241 WeakPolarHBondContact CG-O 3.1Å; L135-T241 PolarHBondContact N-O 2.88Å; K138-T241 HydrophobicContact CB-CG2 4.39Å; K138-T241 HydrophobicContact CG-CG2 3.46Å; K138-T241 VanDerWaalsContact CG-CG2 3.46Å; S161-T241 PolarHBondContact O-N 3.21Å; S161-T241 PolarHBondContact O-OG1 2.68Å; D163-T241 PolarHBondContact N-OG1 3.2Å; Y164-T241 HydrophobicContact CD1-CG2 3.99Å; Y164-T241 HydrophobicContact CD2-CG2 4.47Å; Y164-T241 HydrophobicContact CE1-CG2 3.83Å; Y164-T241 HydrophobicContact CE2-CG2 4.33Å; Y164-T241 HydrophobicContact CG-CG2 4.32Å; Y164-T241 PolarHBondContact N-OG1 3.23Å
242	D	98.7	Very high	94	Very high	7 Å²	7	27.1 Å²	27.1	4%	0.037	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	146.6	-175.8	-45.3	-101	0	0	0	110.2	L133 S134 K160 S161 Y164 G165 W168 V240	L133-D242 CarbonylContact O-C 3.49Å; L133-D242 VanDerWaalsContact O-CA 3.26Å; L133-D242 WeakPolarHBondContact O-CA 3.44Å; S134-D242 WeakPolarHBondContact CA-OD1 3.21Å; S134-D242 WeakPolarHBondContact CB-OD1 3.01Å; S134-D242 PolarHBondContact OG-OD1 2.02Å; K160-D242 CarbonylContact C-O 3.55Å; K160-D242 WeakPolarHBondContact CA-O 3.31Å; S161-D242 PolarHBondContact N-O 2.9Å; Y164-D242 VanDerWaalsContact C-OD2 3.25Å; Y164-D242 WeakPolarHBondContact CA-OD2 3.37Å; G165-D242 PolarHBondContact N-OD2 3Å; W168-D242 HydrophobicContact CH2-CB 3.54Å; W168-D242 HydrophobicContact CZ2-CB 4.15Å; W168-D242 HydrophobicContact CZ3-CB 4.2Å; V240-D242 WeakPolarHBondContact CG1-O 3.49Å
243	I	98.7	Very high	92.4	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.5	179.1	-67	163.3	0	0	0	108	T132 L133 I144 I158 L159 V240 V245 V285	T132-I243 WeakPolarHBondContact CA-O 3.43Å; L133-I243 PolarHBondContact N-O 3.37Å; L133-I243 PolarHBondContact O-N 2.83Å; I144-I243 HydrophobicContact CD1-CD1 3.65Å; I144-I243 HydrophobicContact CD1-CG1 4.05Å; I144-I243 HydrophobicContact CD1-CG2 4.18Å; I144-I243 HydrophobicContact CG1-CD1 4Å; I158-I243 HydrophobicContact CG2-CG2 4.13Å; L159-I243 WeakPolarHBondContact O-CA 3.48Å; V240-I243 HydrophobicContact CG1-CD1 4.1Å; V240-I243 HydrophobicContact CG1-CG1 3.6Å; I243-V245 HydrophobicContact CG2-CG2 4.39Å; I243-V285 HydrophobicContact CD1-CB 4.19Å; I243-V285 HydrophobicContact CD1-CG1 3.63Å; I243-V285 HydrophobicContact CD1-CG2 3.41Å; I243-V285 VanDerWaalsContact CD1-CG2 3.41Å
244	R	98.6	Very high	90.2	Very high	71 Å²	71	34 Å²	34	27%	0.268	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.7	171.7	179.7	-177.7	-64	159	3	109.6	L131 T132 L159 W168 I246	L131-R244 CarbonylContact O-C 3.53Å; L131-R244 WeakPolarHBondContact O-CA 3.23Å; T132-R244 PolarHBondContact OG1-NE 2.87Å; L159-R244 HydrophobicContact CB-CB 4.28Å; L159-R244 PolarHBondContact N-O 2.9Å; L159-R244 PolarHBondContact O-N 3.28Å; W168-R244 HydrophobicContact CE3-CB 3.91Å; W168-R244 HydrophobicContact CH2-CB 3.81Å; W168-R244 HydrophobicContact CZ3-CB 3.4Å; R244-I246 HydrophobicContact CG-CG1 4.04Å
245	V	98.3	Very high	88	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.2	172.3	-174.3	0	0	0	0	107.8	T130 L131 M146 M156 V157 I243 F247	T130-V245 CarbonylContact C-O 3.5Å; T130-V245 VanDerWaalsContact CA-O 3.26Å; T130-V245 WeakPolarHBondContact CA-O 3.4Å; L131-V245 HydrophobicContact CB-CB 4.48Å; L131-V245 PolarHBondContact N-O 2.64Å; L131-V245 PolarHBondContact O-N 2.97Å; M146-V245 HydrophobicContact SD-CG1 3.91Å; M146-V245 HydrophobicContact SD-CG2 3.92Å; M156-V245 HydrophobicContact SD-CG1 4.44Å; V157-V245 WeakPolarHBondContact O-CA 3.46Å; I243-V245 HydrophobicContact CG2-CG2 4.39Å; V245-F247 HydrophobicContact CB-CZ 4.42Å; V245-F247 HydrophobicContact CG1-CD1 4.34Å; V245-F247 HydrophobicContact CG1-CE1 3.7Å; V245-F247 HydrophobicContact CG1-CE2 4.18Å; V245-F247 HydrophobicContact CG1-CZ 3.6Å
246	I	97.8	Very high	85.7	Confident	27 Å²	27	37.8 Å²	37.8	14%	0.138	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	117.9	177.7	-53.3	-175.8	0	0	0	107.5	N128 V129 T130 M156 V157 L159 R244	N128-I246 HydrophobicContact CB-CG2 3.73Å; V129-I246 CarbonylContact O-C 3.55Å; V129-I246 WeakPolarHBondContact O-CA 3.37Å; T130-I246 HydrophobicContact CG2-CB 4.38Å; T130-I246 HydrophobicContact CG2-CD1 4.48Å; T130-I246 HydrophobicContact CG2-CG1 3.95Å; T130-I246 HydrophobicContact CG2-CG2 4.13Å; M156-I246 CarbonylContact C-O 3.24Å; M156-I246 WeakPolarHBondContact CA-O 3.26Å; M156-I246 VanDerWaalsContact CB-O 3.3Å; M156-I246 WeakPolarHBondContact CB-O 3.48Å; V157-I246 HydrophobicContact CG1-CB 3.69Å; V157-I246 HydrophobicContact CG1-CD1 4.2Å; V157-I246 HydrophobicContact CG1-CG1 4.18Å; V157-I246 HydrophobicContact CG1-CG2 4.41Å; V157-I246 PolarHBondContact N-O 3.17Å; V157-I246 PolarHBondContact O-N 2.82Å; L159-I246 HydrophobicContact CD1-CD1 3.63Å; L159-I246 HydrophobicContact CD1-CG1 4.44Å; L159-I246 HydrophobicContact CG-CD1 4.29Å; R244-I246 HydrophobicContact CG-CG1 4.04Å
247	F	95.4	Very high	83.4	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133	171.6	-50.9	-73.8	0	0	0	109.8	W117 N128 V129 L131 F148 P153 M156 V245 Y278 M280	W117-F247 HydrophobicContact CH2-CD2 4.34Å; W117-F247 AromaticContact CH2-CE2 3.96Å; W117-F247 HydrophobicContact CH2-CE2 3.96Å; W117-F247 AromaticContact CZ3-CE2 3.98Å; W117-F247 HydrophobicContact CZ3-CE2 3.98Å; N128-F247 VanDerWaalsContact CA-O 3.27Å; N128-F247 WeakPolarHBondContact CA-O 3.04Å; V129-F247 HydrophobicContact CB-CB 4.42Å; V129-F247 HydrophobicContact CB-CD2 4.17Å; V129-F247 HydrophobicContact CG1-CD2 4.19Å; V129-F247 PolarHBondContact N-O 2.77Å; V129-F247 WeakPolarHBondContact O-CD2 3.32Å; V129-F247 PolarHBondContact O-N 3.12Å; L131-F247 HydrophobicContact CD1-CE2 3.68Å; L131-F247 HydrophobicContact CD1-CZ 4Å; L131-F247 HydrophobicContact CG-CE2 4.02Å; F148-F247 AromaticContact CE1-CE1 3.87Å; F148-F247 HydrophobicContact CE1-CE1 3.87Å; F148-F247 HydrophobicContact CE1-CZ 4.37Å; F148-F247 HydrophobicContact CZ-CE1 4.14Å; P153-F247 HydrophobicContact CB-CD1 3.85Å; P153-F247 HydrophobicContact CG-CD1 3.79Å; P153-F247 HydrophobicContact CG-CE1 3.98Å; M156-F247 HydrophobicContact CB-CD1 3.95Å; M156-F247 HydrophobicContact SD-CD1 4.26Å; M156-F247 HydrophobicContact SD-CE1 3.97Å; V245-F247 HydrophobicContact CB-CZ 4.42Å; V245-F247 HydrophobicContact CG1-CD1 4.34Å; V245-F247 HydrophobicContact CG1-CE1 3.7Å; V245-F247 HydrophobicContact CG1-CE2 4.18Å; V245-F247 HydrophobicContact CG1-CZ 3.6Å; F247-Y278 HydrophobicContact CB-CD1 3.78Å; F247-Y278 HydrophobicContact CB-CD2 3.92Å; F247-Y278 HydrophobicContact CB-CE1 3.53Å; F247-Y278 HydrophobicContact CB-CE2 3.66Å; F247-Y278 HydrophobicContact CB-CG 3.97Å; F247-Y278 VanDerWaalsContact CB-CZ 3.45Å; F247-Y278 HydrophobicContact CD1-CD1 4.09Å; F247-Y278 HydrophobicContact CD1-CE1 4.37Å; F247-Y278 HydrophobicContact CD2-CD2 4.47Å; F247-Y278 HydrophobicContact CD2-CG 4.22Å; F247-Y278 AromaticContact CG-CD1 3.89Å; F247-Y278 HydrophobicContact CG-CD1 3.89Å; F247-Y278 HydrophobicContact CG-CD2 4.34Å; F247-Y278 HydrophobicContact CG-CE1 4.12Å; F247-Y278 HydrophobicContact CG-CG 4.01Å; F247-M280 HydrophobicContact CE1-CE 4.11Å; F247-M280 HydrophobicContact CZ-CE 3.56Å
248	S	93	Very high	80.9	Confident	16 Å²	16	45 Å²	45	11%	0.112	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-25.9	-174	-65.1	0	0	0	0	113.7	N128 S155	N128-S248 WeakPolarHBondContact OD1-CA 3.21Å; N128-S248 WeakPolarHBondContact OD1-CB 3.33Å; N128-S248 PolarHBondContact OD1-OG 2.83Å; S155-S248 PolarHBondContact O-N 3.08Å
249	R	90.3	Very high	78.4	Confident	63 Å²	63	46.7 Å²	46.7	24%	0.238	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	135.9	176.1	-165.3	169.3	68.7	174.3	6.4	111.8	P153 D154 S155 S176 Y278	P153-R249 CarbonylContact C-O 3.45Å; P153-R249 WeakPolarHBondContact CA-O 2.93Å; D154-R249 HydrophobicContact CB-CB 4.45Å; D154-R249 HydrophobicContact CB-CG 4.44Å; D154-R249 PolarHBondContact N-O 3.49Å; D154-R249 IonicContact OD1-NH2 2.75Å; D154-R249 PolarHBondContact OD1-NH2 3.01Å; D154-R249 IonicContact OD2-CZ 3.92Å; D154-R249 IonicContact OD2-NE 3.24Å; D154-R249 PolarHBondContact OD2-NE 3.39Å; D154-R249 IonicContact OD2-NH2 2.82Å; D154-R249 PolarHBondContact OD2-NH2 2.94Å; S155-R249 PolarHBondContact N-O 3.09Å; S155-R249 PolarHBondContact O-N 3.48Å; S155-R249 VanDerWaalsContact O-N 3.11Å; S176-R249 PolarHBondContact OG-NH2 3.38Å; S176-R249 VanDerWaalsContact OG-NH2 3.16Å; R249-Y278 WeakPolarHBondContact CA-OH 3.48Å; R249-Y278 PolarHBondContact N-OH 3.35Å; R249-Y278 VanDerWaalsContact N-OH 3.16Å
250	L	85.6	Confident	75.7	Confident	24 Å²	24	50.4 Å²	50.4	13%	0.126	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	147.1	170.8	-77	165.4	0	0	0	111.2	L252 Y276 F277 Y278	L250-L252 HydrophobicContact CB-CG 4.33Å; L250-Y276 HydrophobicContact CD1-CD1 4.43Å; L250-F277 WeakPolarHBondContact CD2-O 3.42Å; L250-Y278 HydrophobicContact CB-CE1 4.49Å; L250-Y278 HydrophobicContact CD1-CE1 4.42Å; L250-Y278 HydrophobicContact CD2-CD1 3.35Å; L250-Y278 HydrophobicContact CD2-CE1 3.25Å; L250-Y278 HydrophobicContact CD2-CG 4.18Å; L250-Y278 HydrophobicContact CG-CD1 3.99Å; L250-Y278 HydrophobicContact CG-CE1 3.43Å; L250-Y278 VanDerWaalsContact CG-CE1 3.43Å; L250-Y278 HydrophobicContact CG-CE2 4.46Å
251	N	77.5	Confident	72.9	Confident	61 Å²	61	54.8 Å²	54.8	33%	0.326	30%	0.297	S	S	.	.			trans	-96.1	88	168.1	-161.8	6.9	0	0	0	108.7	R152 D154	R152-N251 PolarHBondContact O-N 3.11Å; D154-N251 HydrophobicContact CB-CB 3.7Å
252	L	70.2	Confident	69.8	Low	41 Å²	41	57.4 Å²	57.4	22%	0.215	32%	0.324	C	S	.	.			trans	-90.1	115.9	171.1	-62.8	173.8	0	0	0	107.1	L250 Y276	L250-L252 HydrophobicContact CB-CG 4.33Å; L252-Y276 HydrophobicContact CD1-CD1 3.68Å; L252-Y276 HydrophobicContact CD1-CD2 4.21Å; L252-Y276 HydrophobicContact CD1-CE1 3.23Å; L252-Y276 HydrophobicContact CD1-CE2 3.79Å; L252-Y276 HydrophobicContact CD1-CG 4.15Å
253	D	60.4	Low	67	Low	86 Å²	86	65.2 Å²	65.2	46%	0.46	37%	0.366	S	S	.	.			trans	-63.8	143.9	174.7	-174.1	21.9	0	0	0	109.1	S255 D256 L257	D253-S255 PolarHBondContact O-N 2.95Å; D253-S255 VanDerWaalsContact OD2-CB 3.28Å; D253-S255 WeakPolarHBondContact OD2-CB 3.45Å; D253-S255 PolarHBondContact OD2-OG 3.48Å; D253-D256 WeakPolarHBondContact O-CA 3.25Å; D253-D256 WeakPolarHBondContact O-CB 3.26Å; D253-D256 PolarHBondContact O-N 3.35Å; D253-L257 PolarHBondContact O-N 3.37Å
254	R	50.7	Low	63.9	Low	198 Å²	198	69.3 Å²	69.3	75%	0.747	40%	0.395	S	S	*	.	H	α-helix	trans	-64.8	-23.3	-178.2	-157.3	161	71.7	177.7	5.6	111.6	D256 L257 Y258	R254-D256 VanDerWaalsContact C-N 3.33Å; R254-L257 PolarHBondContact O-N 2.93Å; R254-Y258 HydrophobicContact CG-CD2 4.45Å; R254-Y258 PolarHBondContact O-N 2.95Å
255	S	49.8	Very low	61.1	Low	70 Å²	70	73.1 Å²	73.1	49%	0.49	43%	0.426	S	S	.	.	H	α-helix	trans	-66.6	-31	170.6	-37.2	0	0	0	0	112.9	D253 Y258	D253-S255 PolarHBondContact O-N 2.95Å; D253-S255 VanDerWaalsContact OD2-CB 3.28Å; D253-S255 WeakPolarHBondContact OD2-CB 3.45Å; D253-S255 PolarHBondContact OD2-OG 3.48Å; S255-Y258 CarbonylContact O-C 3.47Å; S255-Y258 VanDerWaalsContact O-O 3.14Å
256	D	49	Very low	58	Low	32 Å²	32	75 Å²	75	17%	0.171	44%	0.441	C	S	.	.	H	α-helix	trans	-80	-20.6	174.8	-64.2	-34.1	0	0	0	111.3	W78 H151 D253 R254	W78-D256 VanDerWaalsContact CD1-O 3.3Å; W78-D256 PolarHBondContact NE1-O 2.89Å; H151-D256 IonicContact CE1-OD2 2.78Å; H151-D256 PolarHBondContact CE1-OD2 2.58Å; H151-D256 IonicContact ND1-OD2 3.68Å; D253-D256 WeakPolarHBondContact O-CA 3.25Å; D253-D256 WeakPolarHBondContact O-CB 3.26Å; D253-D256 PolarHBondContact O-N 3.35Å; R254-D256 VanDerWaalsContact C-N 3.33Å
257	L	48	Very low	55.3	Low	89 Å²	89	82.6 Å²	82.6	47%	0.466	48%	0.482	S	S	.	.	H	α-helix	trans	-84.7	-26.9	175.8	-156.7	71.4	0	0	0	112.5	D253 R254	D253-L257 PolarHBondContact O-N 3.37Å; R254-L257 PolarHBondContact O-N 2.93Å
258	Y	44.5	Very low	52.6	Low	151 Å²	151	85.7 Å²	85.7	59%	0.592	51%	0.513	S	S	*	.	S	Bend	trans	-117.2	84.2	175.7	-73.5	-83.9	0	0	0	109.6	R254 S255 V260	R254-Y258 HydrophobicContact CG-CD2 4.45Å; R254-Y258 PolarHBondContact O-N 2.95Å; S255-Y258 CarbonylContact O-C 3.47Å; S255-Y258 VanDerWaalsContact O-O 3.14Å; Y258-V260 PolarHBondContact O-N 3.28Å
259	G	45.6	Very low	50.1	Low	39 Å²	39	92.4 Å²	92.4	40%	0.402	54%	0.543	S	S	.	.			trans	-55.4	112.4	162.3	0	0	0	0	0	109.2
260	V	40.3	Very low	48	Very low	82 Å²	82	95.4 Å²	95.4	50%	0.497	57%	0.568	S	S	.	*	S	Bend	trans	53.6	103.9	153.5	-172.2	0	0	0	0	115.9	F87 Y258 G262	F87-V260 HydrophobicContact CD2-CG2 4.41Å; Y258-V260 PolarHBondContact O-N 3.28Å; V260-G262 PolarHBondContact O-N 3.27Å
261	G	39.3	Very low	47	Very low	91 Å²	91	96.5 Å²	96.5	94%	0.938	58%	0.577	S	S	*	*	S	Bend		45.9	21.8	128.7	0	0	0	0	0	121
262	G	34.6	Very low	47	Very low	56 Å²	56	96 Å²	96	58%	0.577	58%	0.575	S	S	*	*			trans	-107.4	125.4	174.6	0	0	0	0	0	109.2	V260 S264	V260-G262 PolarHBondContact O-N 3.27Å; G262-S264 PolarHBondContact O-N 3.37Å
263	N	39	Very low	47.5	Very low	170 Å²	170	96.6 Å²	96.6	91%	0.909	58%	0.581	S	S	*	*			trans	-63	65.4	176.2	-73.7	-25	0	0	0	112.6
264	S	34.5	Very low	48.8	Very low	87 Å²	87	98.1 Å²	98.1	61%	0.608	58%	0.58	S	S	*	*			trans	-101.9	89	168.9	-73	0	0	0	0	108.7	G262 A266	G262-S264 PolarHBondContact O-N 3.37Å; S264-A266 PolarHBondContact O-N 3.04Å
265	T	38.3	Very low	50.4	Low	151 Å²	151	89.5 Å²	89.5	93%	0.926	55%	0.549	S	S	*	.			trans	-62.3	75.1	157.8	39	0	0	0	0	109.4
266	A	35.1	Very low	52.3	Low	40 Å²	40	88 Å²	88	33%	0.331	53%	0.532	S	S	.	.			trans	-134	95.8	171	0	0	0	0	0	109	S264 G268	S264-A266 PolarHBondContact O-N 3.04Å; A266-G268 PolarHBondContact O-N 3.39Å
267	L	39.8	Very low	54.3	Low	188 Å²	188	86.8 Å²	86.8	98%	0.984	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	41.8	172	-74.7	162.9	0	0	0	112.7
268	G	39.5	Very low	56.5	Low	64 Å²	64	83.6 Å²	83.6	66%	0.66	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-173.7	13.6	-172.2	0	0	0	0	0	118.9	A266 V270	A266-G268 PolarHBondContact O-N 3.39Å; G268-V270 PolarHBondContact O-N 3.21Å; G268-V270 VanDerWaalsContact O-N 3.14Å
269	E	40.9	Very low	58.8	Low	158 Å²	158	76.4 Å²	76.4	74%	0.738	48%	0.479	S	S	*	.			trans	-75.8	110.3	176.1	-84.9	178.6	166.6	0	0	110.9	S271	E269-S271 PolarHBondContact O-N 2.02Å
270	V	46.1	Very low	61.2	Low	126 Å²	126	74.6 Å²	74.6	76%	0.764	46%	0.46	S	S	*	.			trans	-27.3	106.4	172.7	-179.6	0	0	0	0	110.8	G268 N272	G268-V270 PolarHBondContact O-N 3.21Å; G268-V270 VanDerWaalsContact O-N 3.14Å; V270-N272 PolarHBondContact O-N 3.44Å
271	S	63.5	Low	63.8	Low	46 Å²	46	70.9 Å²	70.9	32%	0.322	44%	0.438	S	S	.	.			trans	-53.1	110.6	167.2	43.5	0	0	0	0	107.8	E269 P273 Y276	E269-S271 PolarHBondContact O-N 2.02Å; S271-P273 VanDerWaalsContact O-CD 3.28Å; S271-P273 WeakPolarHBondContact O-CD 3.11Å; S271-Y276 WeakPolarHBondContact CB-OH 3.49Å
272	N	77.1	Confident	66.5	Low	52 Å²	52	67.2 Å²	67.2	28%	0.278	40%	0.397	S	S	.	.			trans	-55.4	114.6	-174.8	174.3	7.6	0	0	0	108.3	V270 R274 H275	V270-N272 PolarHBondContact O-N 3.44Å; N272-R274 PolarHBondContact O-N 3.5Å; N272-R274 VanDerWaalsContact OD1-CB 3.3Å; N272-R274 WeakPolarHBondContact OD1-CB 3.23Å; N272-R274 VanDerWaalsContact OD1-CG 3.3Å; N272-R274 WeakPolarHBondContact OD1-CG 3.26Å; N272-R274 PolarHBondContact OD1-N 3.28Å; N272-R274 VanDerWaalsContact OD1-N 3.16Å; N272-H275 PolarHBondContact ND2-CD2 2.65Å; N272-H275 PolarHBondContact ND2-NE2 2.91Å; N272-H275 PolarHBondContact O-N 2.89Å
273	P	81	Confident	69.5	Low	52 Å²	52	64.6 Å²	64.6	34%	0.338	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-62.3	-18	-173.4	24.1	-34	0	0	0	113	P121 T123 S271 H275 Y276	P121-P273 WeakPolarHBondContact CB-O 3.42Å; T123-P273 HydrophobicContact CG2-CB 3.65Å; S271-P273 VanDerWaalsContact O-CD 3.28Å; S271-P273 WeakPolarHBondContact O-CD 3.11Å; P273-H275 PolarHBondContact O-N 2.95Å; P273-Y276 PolarHBondContact O-N 2.76Å; P273-Y276 VanDerWaalsContact O-N 3.15Å
274	R	87.8	Confident	72.3	Confident	119 Å²	119	56.9 Å²	56.9	45%	0.449	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-66.3	-16.6	176.5	-58.4	-179.6	178	174.9	-1.4	113.9	S74 Y75 C76 N272 F277	S74-R274 WeakPolarHBondContact O-CG 3.47Å; S74-R274 WeakPolarHBondContact OG-CD 3.22Å; S74-R274 VanDerWaalsContact OG-CZ 3.32Å; S74-R274 PolarHBondContact OG-NE 2.86Å; S74-R274 VanDerWaalsContact OG-NE 3.16Å; Y75-R274 WeakPolarHBondContact CA-O 3.41Å; C76-R274 HydrophobicContact CB-CB 4.03Å; C76-R274 PolarHBondContact N-O 2.84Å; N272-R274 PolarHBondContact O-N 3.5Å; N272-R274 VanDerWaalsContact OD1-CB 3.3Å; N272-R274 WeakPolarHBondContact OD1-CB 3.23Å; N272-R274 VanDerWaalsContact OD1-CG 3.3Å; N272-R274 WeakPolarHBondContact OD1-CG 3.26Å; N272-R274 PolarHBondContact OD1-N 3.28Å; N272-R274 VanDerWaalsContact OD1-N 3.16Å; R274-F277 VanDerWaalsContact O-CD1 3.28Å; R274-F277 WeakPolarHBondContact O-CD1 3.47Å
275	H	85.7	Confident	75.3	Confident	17 Å²	17	52.8 Å²	52.8	8%	0.079	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-87.1	-12.3	174.8	-66.9	-109.3	0	0	0	113.3	C76 W78 D89 N272 P273 F277	C76-H275 WeakPolarHBondContact O-CA 3.31Å; C76-H275 PolarHBondContact O-ND1 3.01Å; W78-H275 AromaticContact CD1-CE1 3.87Å; W78-H275 AromaticContact CD1-ND1 3.71Å; W78-H275 AromaticContact CD2-CE1 3.97Å; W78-H275 AromaticContact CE2-CE1 3.35Å; W78-H275 AromaticContact CE2-ND1 3.86Å; W78-H275 AromaticContact CZ2-CE1 3.69Å; W78-H275 AromaticContact NE1-CE1 3.29Å; W78-H275 PolarHBondContact NE1-CE1 2.99Å; W78-H275 VanDerWaalsContact NE1-CE1 3.29Å; W78-H275 AromaticContact NE1-ND1 3.29Å; W78-H275 PolarHBondContact NE1-ND1 2.92Å; D89-H275 IonicContact OD1-CE1 3.93Å; D89-H275 PolarHBondContact OD1-CE1 3.42Å; D89-H275 IonicContact OD1-NE2 3.92Å; D89-H275 PolarHBondContact OD1-NE2 2.68Å; D89-H275 IonicContact OD2-NE2 3.95Å; N272-H275 PolarHBondContact ND2-CD2 2.65Å; N272-H275 PolarHBondContact ND2-NE2 2.91Å; N272-H275 PolarHBondContact O-N 2.89Å; P273-H275 PolarHBondContact O-N 2.95Å; H275-F277 PolarHBondContact O-N 3.23Å
276	Y	88.1	Confident	78.2	Confident	39 Å²	39	45.6 Å²	45.6	15%	0.153	26%	0.257	C	S	.	.			trans	-95.9	77.8	-176.4	-69.3	-103.7	0	0	0	110.2	P121 S122 T123 L250 L252 S271 P273	P121-Y276 WeakPolarHBondContact CA-O 3.29Å; S122-Y276 PolarHBondContact N-O 2.86Å; S122-Y276 WeakPolarHBondContact O-CB 3.43Å; T123-Y276 HydrophobicContact CG2-CD2 3.97Å; T123-Y276 HydrophobicContact CG2-CE2 4.23Å; T123-Y276 HydrophobicContact CG2-CG 4.32Å; L250-Y276 HydrophobicContact CD1-CD1 4.43Å; L252-Y276 HydrophobicContact CD1-CD1 3.68Å; L252-Y276 HydrophobicContact CD1-CD2 4.21Å; L252-Y276 HydrophobicContact CD1-CE1 3.23Å; L252-Y276 HydrophobicContact CD1-CE2 3.79Å; L252-Y276 HydrophobicContact CD1-CG 4.15Å; S271-Y276 WeakPolarHBondContact CB-OH 3.49Å; P273-Y276 PolarHBondContact O-N 2.76Å; P273-Y276 VanDerWaalsContact O-N 3.15Å
277	F	91.6	Very high	81.2	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.026	24%	0.241	C	C	.	.			trans	-139.5	155	177.4	64.9	-83.6	0	0	0	111	Y75 C76 W77 V118 P121 H150 L250 R274 H275	Y75-F277 HydrophobicContact CD2-CD1 4.34Å; Y75-F277 HydrophobicContact CD2-CD2 4.19Å; Y75-F277 AromaticContact CD2-CE1 3.91Å; Y75-F277 HydrophobicContact CD2-CE1 3.91Å; Y75-F277 AromaticContact CD2-CE2 3.71Å; Y75-F277 HydrophobicContact CD2-CE2 3.71Å; Y75-F277 HydrophobicContact CD2-CG 4.48Å; Y75-F277 AromaticContact CD2-CZ 3.56Å; Y75-F277 HydrophobicContact CD2-CZ 3.56Å; Y75-F277 HydrophobicContact CE2-CE2 4.16Å; Y75-F277 HydrophobicContact CE2-CZ 4.2Å; C76-F277 VanDerWaalsContact O-CE1 3.31Å; C76-F277 WeakPolarHBondContact O-CE1 3.37Å; W77-F277 HydrophobicContact CB-CZ 4.45Å; V118-F277 HydrophobicContact CG1-CB 4.45Å; V118-F277 HydrophobicContact CG1-CD2 3.78Å; V118-F277 HydrophobicContact CG1-CE2 4.45Å; V118-F277 HydrophobicContact CG1-CG 4.33Å; P121-F277 HydrophobicContact CB-CB 4.43Å; P121-F277 HydrophobicContact CG-CB 4.33Å; H150-F277 HydrophobicContact CB-CE2 4.27Å; H150-F277 HydrophobicContact CB-CZ 4.37Å; H150-F277 AromaticContact CD2-CE2 3.64Å; L250-F277 WeakPolarHBondContact CD2-O 3.42Å; R274-F277 VanDerWaalsContact O-CD1 3.28Å; R274-F277 WeakPolarHBondContact O-CD1 3.47Å; H275-F277 PolarHBondContact O-N 3.23Å
278	Y	93.6	Very high	83.9	Confident	21 Å²	21	39.1 Å²	39.1	8%	0.082	21%	0.211	C	C	.	.			trans	-99	141.8	168.9	-59.7	-76.9	0	0	0	109.3	V118 S119 V129 P153 F247 R249 L250	V118-Y278 WeakPolarHBondContact CA-O 3.5Å; S119-Y278 PolarHBondContact N-O 3.02Å; S119-Y278 PolarHBondContact OG-N 3.4Å; V129-Y278 HydrophobicContact CB-CD2 3.93Å; V129-Y278 HydrophobicContact CB-CE2 4.17Å; V129-Y278 HydrophobicContact CG2-CD2 3.79Å; V129-Y278 HydrophobicContact CG2-CE2 3.92Å; P153-Y278 HydrophobicContact CB-CD1 4.2Å; P153-Y278 HydrophobicContact CB-CE1 3.9Å; F247-Y278 HydrophobicContact CB-CD1 3.78Å; F247-Y278 HydrophobicContact CB-CD2 3.92Å; F247-Y278 HydrophobicContact CB-CE1 3.53Å; F247-Y278 HydrophobicContact CB-CE2 3.66Å; F247-Y278 HydrophobicContact CB-CG 3.97Å; F247-Y278 VanDerWaalsContact CB-CZ 3.45Å; F247-Y278 HydrophobicContact CD1-CD1 4.09Å; F247-Y278 HydrophobicContact CD1-CE1 4.37Å; F247-Y278 HydrophobicContact CD2-CD2 4.47Å; F247-Y278 HydrophobicContact CD2-CG 4.22Å; F247-Y278 AromaticContact CG-CD1 3.89Å; F247-Y278 HydrophobicContact CG-CD1 3.89Å; F247-Y278 HydrophobicContact CG-CD2 4.34Å; F247-Y278 HydrophobicContact CG-CE1 4.12Å; F247-Y278 HydrophobicContact CG-CG 4.01Å; R249-Y278 WeakPolarHBondContact CA-OH 3.48Å; R249-Y278 PolarHBondContact N-OH 3.35Å; R249-Y278 VanDerWaalsContact N-OH 3.16Å; L250-Y278 HydrophobicContact CB-CE1 4.49Å; L250-Y278 HydrophobicContact CD1-CE1 4.42Å; L250-Y278 HydrophobicContact CD2-CD1 3.35Å; L250-Y278 HydrophobicContact CD2-CE1 3.25Å; L250-Y278 HydrophobicContact CD2-CG 4.18Å; L250-Y278 HydrophobicContact CG-CD1 3.99Å; L250-Y278 HydrophobicContact CG-CE1 3.43Å; L250-Y278 VanDerWaalsContact CG-CE1 3.43Å; L250-Y278 HydrophobicContact CG-CE2 4.46Å
279	S	93.9	Very high	86.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.007	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.8	178	63	0	0	0	0	111.6	W117 F148 C149 H150	W117-S279 CarbonylContact O-C 3.37Å; W117-S279 WeakPolarHBondContact O-CA 3.12Å; F148-S279 WeakPolarHBondContact CA-O 3.19Å; F148-S279 VanDerWaalsContact CD1-O 3.28Å; F148-S279 WeakPolarHBondContact CD1-O 2.97Å; C149-S279 PolarHBondContact N-O 3.45Å; H150-S279 WeakPolarHBondContact CB-OG 3.07Å; H150-S279 PolarHBondContact CD2-OG 2.82Å; H150-S279 PolarHBondContact N-OG 3.03Å
280	M	95.4	Very high	89.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	134.9	-179.4	-178.6	-173.6	-60.5	0	0	110.6	L105 W117 L131 M146 Q147 F148 F247 L283	L105-M280 HydrophobicContact CD2-CB 3.55Å; L105-M280 HydrophobicContact CD2-CG 3.5Å; L105-M280 VanDerWaalsContact CD2-CG 3.5Å; L105-M280 VanDerWaalsContact CD2-O 3.27Å; L105-M280 WeakPolarHBondContact CD2-O 3.45Å; L105-M280 HydrophobicContact CD2-SD 3.72Å; W117-M280 HydrophobicContact CE3-CB 4.06Å; W117-M280 HydrophobicContact CZ3-CB 4.49Å; W117-M280 PolarHBondContact N-O 2.83Å; W117-M280 PolarHBondContact O-N 2.79Å; L131-M280 HydrophobicContact CD1-CE 4.43Å; L131-M280 HydrophobicContact CD1-SD 4.4Å; M146-M280 HydrophobicContact CB-CE 3.71Å; M146-M280 HydrophobicContact CB-SD 4.03Å; M146-M280 HydrophobicContact CG-CE 3.74Å; M146-M280 HydrophobicContact CG-SD 4Å; M146-M280 HydrophobicContact SD-CE 3.87Å; Q147-M280 CarbonylContact O-C 3.57Å; Q147-M280 WeakPolarHBondContact O-CA 2.97Å; Q147-M280 WeakPolarHBondContact O-CG 3.38Å; F148-M280 HydrophobicContact CD1-CB 4.4Å; F148-M280 HydrophobicContact CD1-CE 4.3Å; F148-M280 HydrophobicContact CE1-CE 3.54Å; F148-M280 HydrophobicContact CE2-CE 4.43Å; F148-M280 HydrophobicContact CZ-CE 3.63Å; F247-M280 HydrophobicContact CE1-CE 4.11Å; F247-M280 HydrophobicContact CZ-CE 3.56Å; M280-L283 HydrophobicContact SD-CB 4.12Å
281	A	94.6	Very high	91.9	Very high	4 Å²	4	23.9 Å²	23.9	3%	0.033	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-45.9	178.5	0	0	0	0	0	111.7	V114 T115 Q147 C149	V114-A281 HydrophobicContact CG1-CB 3.53Å; T115-A281 VanDerWaalsContact O-CA 3.27Å; T115-A281 WeakPolarHBondContact O-CA 3.44Å; T115-A281 WeakPolarHBondContact O-CB 3.36Å; Q147-A281 HydrophobicContact CG-CB 4.48Å; Q147-A281 PolarHBondContact O-N 3.39Å; C149-A281 VanDerWaalsContact SG-CB 3.6Å; C149-A281 PolarHBondContact SG-N 3.07Å; C149-A281 VanDerWaalsContact SG-N 3.42Å
282	D	95.7	Very high	93.5	Very high	14 Å²	14	22.3 Å²	22.3	8%	0.075	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	134	-170	179.5	42.5	0	0	0	111.3	L105 M146 Q147	L105-D282 CarbonylContact O-C 3.55Å; M146-D282 WeakPolarHBondContact CA-O 3.44Å; Q147-D282 HydrophobicContact CB-CB 4.17Å; Q147-D282 PolarHBondContact N-O 3.42Å; Q147-D282 PolarHBondContact O-N 3.41Å
283	L	97.6	Very high	94.5	Very high	2 Å²	2	20 Å²	20	1%	0.01	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	94.3	171.2	177.6	62.8	0	0	0	108.1	A56 L105 L133 I144 M146 M280	A56-L283 WeakPolarHBondContact CB-O 3.48Å; L105-L283 HydrophobicContact CB-CB 4.11Å; L105-L283 PolarHBondContact O-N 3.44Å; L133-L283 HydrophobicContact CB-CD2 4.46Å; L133-L283 HydrophobicContact CD2-CD2 4.21Å; I144-L283 HydrophobicContact CG2-CD1 4.15Å; M146-L283 HydrophobicContact CG-CD1 3.7Å; M280-L283 HydrophobicContact SD-CB 4.12Å
284	A	97.7	Very high	95.3	Very high	8 Å²	8	17.6 Å²	17.6	7%	0.066	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	135.1	179.8	0	0	0	0	0	111.5	I144 S145	I144-A284 WeakPolarHBondContact CA-O 3.39Å; S145-A284 PolarHBondContact N-O 3.43Å; S145-A284 PolarHBondContact O-N 2.04Å
285	V	98.4	Very high	95.8	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	94	177.4	179.8	0	0	0	0	108.1	N54 A55 A56 L133 L135 V141 I243	N54-V285 CarbonylContact C-O 3.55Å; N54-V285 WeakPolarHBondContact CA-O 3.45Å; N54-V285 PolarHBondContact OD1-N 3.33Å; A55-V285 HydrophobicContact CB-CB 4.45Å; A55-V285 HydrophobicContact CB-CG1 4.33Å; A55-V285 PolarHBondContact N-O 2.9Å; A56-V285 HydrophobicContact CB-CB 4.04Å; A56-V285 HydrophobicContact CB-CG2 3.86Å; L133-V285 HydrophobicContact CD2-CG2 3.8Å; L135-V285 HydrophobicContact CD1-CG1 4.44Å; V141-V285 HydrophobicContact CG1-CG1 3.97Å; V141-V285 HydrophobicContact CG2-CG1 3.79Å; I243-V285 HydrophobicContact CD1-CB 4.19Å; I243-V285 HydrophobicContact CD1-CG1 3.63Å; I243-V285 HydrophobicContact CD1-CG2 3.41Å; I243-V285 VanDerWaalsContact CD1-CG2 3.41Å
286	G	98.4	Very high	96.3	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121.5	-179.5	0	0	0	0	0	111	F52 T142 Y143	F52-G286 VanDerWaalsContact CZ-CA 3.42Å; T142-G286 PolarHBondContact N-O 2.81Å; Y143-G286 PolarHBondContact N-O 2.93Å; Y143-G286 PolarHBondContact O-N 3.44Å
287	G	98.1	Very high	96.7	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-175.6	178.6	0	0	0	0	0	113.8	V53 E140	V53-G287 PolarHBondContact N-O 3.07Å; V53-G287 PolarHBondContact O-N 2.9Å; E140-G287 WeakPolarHBondContact O-CA 3.31Å
288	R	97.8	Very high	96.9	Very high	92 Å²	92	14.9 Å²	14.9	35%	0.347	7%	0.072	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.9	176.7	-64.2	174.3	-173.9	-113	5.6	110.1	P50 F52 Y139 E140 K290	P50-R288 WeakPolarHBondContact O-CD 3.1Å; P50-R288 PolarHBondContact O-NH1 3.25Å; F52-R288 HydrophobicContact CB-CG 4.29Å; F52-R288 HydrophobicContact CD2-CG 4.08Å; Y139-R288 CarbonylContact C-O 3.58Å; Y139-R288 VanDerWaalsContact CA-O 3.3Å; Y139-R288 WeakPolarHBondContact CA-O 3.16Å; Y139-R288 VanDerWaalsContact CD1-C 3.49Å; Y139-R288 WeakPolarHBondContact CD1-O 3.38Å; E140-R288 PolarHBondContact N-O 3.13Å; E140-R288 PolarHBondContact O-N 2.86Å; R288-K290 PolarHBondContact O-N 2.74Å
289	C	97.8	Very high	97.1	Very high	9 Å²	9	17.7 Å²	17.7	6%	0.061	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	125.1	173.7	-160.2	0	0	0	0	109.9	P50 K137 Y139 C291 C298	P50-C289 HydrophobicContact CB-CB 3.96Å; P50-C289 HydrophobicContact CG-CB 3.97Å; P50-C289 WeakPolarHBondContact CG-O 3.33Å; K137-C289 WeakPolarHBondContact CD-SG 3.27Å; K137-C289 WeakPolarHBondContact CE-SG 3.36Å; Y139-C289 HydrophobicContact CE1-CB 4.29Å; C289-C291 PolarHBondContact O-N 3.22Å; C289-C291 VanDerWaalsContact O-N 3.12Å; C289-C298 HydrophobicContact CB-CB 4.06Å; C289-C298 WeakPolarHBondContact CB-SG 3.46Å; C289-C298 WeakPolarHBondContact SG-CB 3.32Å; C289-C298 CovalentContact SG-SG 2.02Å; C289-C298 PolarHBondContact SG-SG 3.37Å
290	K	98.1	Very high	97.1	Very high	16 Å²	16	22.5 Å²	22.5	7%	0.07	12%	0.117	C	C	.	.			trans	-73.2	109.1	-176.7	-172.7	-175.9	-178.2	87	0	110	K137 K138 E140 T239 R288 C308 D318	K137-K290 PolarHBondContact NZ-O 3.29Å; K138-K290 HydrophobicContact CB-CB 3.92Å; K138-K290 HydrophobicContact CB-CD 3.97Å; K138-K290 HydrophobicContact CD-CD 4.23Å; K138-K290 VanDerWaalsContact O-CB 3.24Å; K138-K290 WeakPolarHBondContact O-CB 3.38Å; K138-K290 PolarHBondContact O-N 2.84Å; E140-K290 HydrophobicContact CG-CB 4.19Å; E140-K290 HydrophobicContact CG-CG 4.07Å; E140-K290 IonicContact OE1-NZ 2.94Å; T239-K290 HydrophobicContact CG2-CD 3.87Å; T239-K290 PolarHBondContact OG1-NZ 3.38Å; R288-K290 PolarHBondContact O-N 2.74Å; K290-C308 PolarHBondContact O-SG 2.82Å; K290-D318 WeakPolarHBondContact O-CA 3.38Å; K290-D318 WeakPolarHBondContact O-CB 3.39Å
291	C	98.1	Very high	97	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.02	13%	0.128	C	C	.	.			trans	-129.1	14.8	178.7	-58.7	0	0	0	0	114	P50 C289 G293 H294 A295 C298 C308 D318	P50-C291 HydrophobicContact CG-CB 4.23Å; C289-C291 PolarHBondContact O-N 3.22Å; C289-C291 VanDerWaalsContact O-N 3.12Å; C291-G293 PolarHBondContact O-N 3.35Å; C291-H294 PolarHBondContact O-N 3.34Å; C291-A295 HydrophobicContact CB-CB 3.69Å; C291-C298 PolarHBondContact SG-SG 2.87Å; C291-C308 WeakPolarHBondContact CA-SG 3.27Å; C291-C308 HydrophobicContact CB-CB 3.83Å; C291-C308 WeakPolarHBondContact CB-SG 3.35Å; C291-C308 WeakPolarHBondContact SG-CB 3.29Å; C291-C308 CovalentContact SG-SG 2.03Å; C291-C308 PolarHBondContact SG-SG 3.06Å; C291-D318 CarbonylContact C-O 3.58Å; C291-D318 VanDerWaalsContact C-O 3.25Å; C291-D318 WeakPolarHBondContact CA-O 3.36Å
292	N	97.2	Very high	96.9	Very high	13 Å²	13	34.8 Å²	34.8	7%	0.07	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	28.3	177.4	-61.7	-64.7	0	0	0	115	H294 D318 W331 R333 A334	N292-H294 VanDerWaalsContact C-N 3.31Å; N292-H294 PolarHBondContact O-CD2 2.91Å; N292-H294 PolarHBondContact O-N 3.4Å; N292-H294 PolarHBondContact O-NE2 3.19Å; N292-D318 PolarHBondContact ND2-O 3.48Å; N292-W331 HydrophobicContact CB-CH2 4.05Å; N292-W331 HydrophobicContact CB-CZ2 3.68Å; N292-R333 HydrophobicContact CB-CB 4.48Å; N292-R333 PolarHBondContact OD1-NH2 2.79Å; N292-A334 PolarHBondContact O-N 2.92Å
293	G	97.1	Very high	96.7	Very high	5 Å²	5	40.2 Å²	40.2	5%	0.052	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	11.4	-179.7	0	0	0	0	0	115.2	C48 C291 A334	C48-G293 PolarHBondContact N-O 3.07Å; C48-G293 VanDerWaalsContact N-O 3.11Å; C48-G293 CarbonylContact O-C 3.54Å; C48-G293 WeakPolarHBondContact O-CA 3.48Å; C48-G293 VanDerWaalsContact O-O 3.09Å; C291-G293 PolarHBondContact O-N 3.35Å; G293-A334 VanDerWaalsContact O-CB 3.29Å; G293-A334 WeakPolarHBondContact O-CB 3.12Å
294	H	98.2	Very high	96.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-111.6	8.3	-178.1	-59.3	-71.8	0	0	0	114.2	C291 N292 K311 H312 T314 C319 W331 G332 P339 H340	C291-H294 PolarHBondContact O-N 3.34Å; N292-H294 VanDerWaalsContact C-N 3.31Å; N292-H294 PolarHBondContact O-CD2 2.91Å; N292-H294 PolarHBondContact O-N 3.4Å; N292-H294 PolarHBondContact O-NE2 3.19Å; H294-K311 WeakPolarHBondContact O-CA 3.3Å; H294-K311 WeakPolarHBondContact O-CB 3.43Å; H294-K311 PolarHBondContact O-N 3.37Å; H294-H312 AromaticContact CE1-ND1 3.86Å; H294-H312 AromaticContact ND1-CG 3.6Å; H294-H312 AromaticContact ND1-ND1 3.03Å; H294-H312 PolarHBondContact ND1-ND1 2.64Å; H294-T314 HydrophobicContact CB-CG2 4.07Å; H294-T314 WeakPolarHBondContact CB-OG1 3.34Å; H294-C319 HydrophobicContact CB-CB 3.76Å; H294-W331 AromaticContact NE2-NE1 3.83Å; H294-G332 PolarHBondContact CE1-O 3.1Å; H294-G332 PolarHBondContact NE2-O 2.89Å; H294-P339 PolarHBondContact CE1-O 3.36Å; H294-P339 VanDerWaalsContact CE1-O 3.28Å; H294-H340 PolarHBondContact CE1-O 3.26Å
295	A	98.1	Very high	96.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.			trans	-148.9	140.2	173	0	0	0	0	0	110.4	V49 P50 C291 C308 D309	V49-A295 CarbonylContact C-O 3.56Å; P50-A295 WeakPolarHBondContact CD-O 3.47Å; P50-A295 WeakPolarHBondContact CG-O 3.22Å; C291-A295 HydrophobicContact CB-CB 3.69Å; A295-C308 HydrophobicContact CB-CB 3.89Å; A295-D309 WeakPolarHBondContact CB-O 3.31Å
296	S	97.1	Very high	96.1	Very high	18 Å²	18	50.6 Å²	50.6	13%	0.126	26%	0.257	C	S	.	.	S	Bend	trans	-89.3	-2.1	175.9	52.3	0	0	0	0	113.7	P50	P50-S296 WeakPolarHBondContact CA-O 3.01Å
297	R	96.4	Very high	96	Very high	77 Å²	77	52.1 Å²	52.1	29%	0.291	27%	0.266	S	S	.	.			trans	-163.8	165.7	180	61	-176.8	174.9	-173.6	-5.1	111.9	D309	R297-D309 HydrophobicContact CG-CB 3.92Å; R297-D309 IonicContact CZ-OD2 3.68Å; R297-D309 IonicContact NE-OD2 3.29Å; R297-D309 PolarHBondContact NE-OD2 2.61Å; R297-D309 IonicContact NH2-OD2 3.16Å; R297-D309 PolarHBondContact NH2-OD2 2.71Å; R297-D309 PolarHBondContact O-N 3.01Å; R297-D309 VanDerWaalsContact O-N 3.07Å
298	C	96.5	Very high	96	Very high	29 Å²	29	52.5 Å²	52.5	20%	0.196	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.9	170.9	-71	0	0	0	0	110.5	K137 C289 C291 L306 V307	K137-C298 VanDerWaalsContact CE-SG 3.53Å; C289-C298 HydrophobicContact CB-CB 4.06Å; C289-C298 WeakPolarHBondContact CB-SG 3.46Å; C289-C298 WeakPolarHBondContact SG-CB 3.32Å; C289-C298 CovalentContact SG-SG 2.02Å; C289-C298 PolarHBondContact SG-SG 3.37Å; C291-C298 PolarHBondContact SG-SG 2.87Å; C298-L306 HydrophobicContact CB-CD1 3.75Å; C298-L306 HydrophobicContact CB-CD2 4.2Å; C298-L306 HydrophobicContact CB-CG 3.8Å; C298-V307 CarbonylContact C-O 3.59Å; C298-V307 VanDerWaalsContact CA-O 3.32Å; C298-V307 WeakPolarHBondContact CA-O 3.41Å
299	L	96	Very high	96	Very high	81 Å²	81	49.8 Å²	49.8	42%	0.424	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	152.3	-177.1	-58	176.1	0	0	0	109.2	L306 V307 D309	L299-L306 CarbonylContact O-C 3.6Å; L299-V307 PolarHBondContact N-O 2.88Å; L299-V307 PolarHBondContact O-N 3.04Å; L299-V307 VanDerWaalsContact O-O 3.13Å; L299-D309 HydrophobicContact CD1-CB 3.8Å; L299-D309 HydrophobicContact CG-CB 4.13Å
300	V	94.6	Very high	96	Very high	102 Å²	102	50.3 Å²	50.3	62%	0.618	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.3	172.3	-176.3	0	0	0	0	108.4	G304 R305 L306	V300-G304 VanDerWaalsContact CG1-CA 3.47Å; V300-R305 CarbonylContact C-O 3.49Å; V300-R305 WeakPolarHBondContact CA-O 3.35Å; V300-L306 HydrophobicContact CG2-CD1 4.29Å
301	D	92.9	Very high	96	Very high	42 Å²	42	51.5 Å²	51.5	23%	0.225	27%	0.269	C	S	.	.			trans	-73.7	175.3	176.8	81	-1	0	0	0	111.6	I303 G304 R305 V307	D301-I303 PolarHBondContact O-N 2.76Å; D301-I303 WeakPolarHBondContact OD1-CA 3.21Å; D301-I303 WeakPolarHBondContact OD1-CB 3.32Å; D301-I303 PolarHBondContact OD1-N 3.38Å; D301-G304 PolarHBondContact O-N 3.26Å; D301-G304 PolarHBondContact OD1-N 3.38Å; D301-R305 PolarHBondContact N-O 2.86Å; D301-R305 PolarHBondContact OD1-N 2.69Å; D301-R305 IonicContact OD2-CZ 2.77Å; D301-R305 IonicContact OD2-NE 2.65Å; D301-R305 PolarHBondContact OD2-NE 3.48Å; D301-R305 VanDerWaalsContact OD2-NE 3.08Å; D301-R305 IonicContact OD2-NH2 2.58Å; D301-R305 PolarHBondContact OD2-NH2 3.29Å; D301-V307 HydrophobicContact CB-CG2 4.13Å
302	K	93.6	Very high	96	Very high	219 Å²	219	51.3 Å²	51.3	95%	0.952	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.2	179.8	-61.7	-176.1	179.6	-175.7	0	114.1
303	I	91.8	Very high	96	Very high	129 Å²	129	52.8 Å²	52.8	66%	0.662	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-0.1	-177	-52.2	174	0	0	0	109.9	D301	D301-I303 PolarHBondContact O-N 2.76Å; D301-I303 WeakPolarHBondContact OD1-CA 3.21Å; D301-I303 WeakPolarHBondContact OD1-CB 3.32Å; D301-I303 PolarHBondContact OD1-N 3.38Å
304	G	91.3	Very high	96.1	Very high	55 Å²	55	52.6 Å²	52.6	57%	0.567	27%	0.274	S	S	*	.	S	Bend	trans	86.1	10.6	-178.6	0	0	0	0	0	114.1	V300 D301	V300-G304 VanDerWaalsContact CG1-CA 3.47Å; D301-G304 PolarHBondContact O-N 3.26Å; D301-G304 PolarHBondContact OD1-N 3.38Å
305	R	93.5	Very high	96	Very high	133 Å²	133	53.8 Å²	53.8	50%	0.502	28%	0.284	S	S	.	.			trans	-94	141.1	179.8	-58.9	178.9	-59.3	177.8	3.5	111.1	V300 D301	V300-R305 CarbonylContact C-O 3.49Å; V300-R305 WeakPolarHBondContact CA-O 3.35Å; D301-R305 PolarHBondContact N-O 2.86Å; D301-R305 PolarHBondContact OD1-N 2.69Å; D301-R305 IonicContact OD2-CZ 2.77Å; D301-R305 IonicContact OD2-NE 2.65Å; D301-R305 PolarHBondContact OD2-NE 3.48Å; D301-R305 VanDerWaalsContact OD2-NE 3.08Å; D301-R305 IonicContact OD2-NH2 2.58Å; D301-R305 PolarHBondContact OD2-NH2 3.29Å
306	L	95.4	Very high	96	Very high	40 Å²	40	54.9 Å²	54.9	21%	0.209	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	127.8	175	-165.5	67.1	0	0	0	110	K137 Y139 C298 L299 V300	K137-L306 HydrophobicContact CB-CB 4.29Å; K137-L306 HydrophobicContact CB-CD2 4.38Å; K137-L306 HydrophobicContact CD-CB 4.01Å; K137-L306 HydrophobicContact CD-CD2 3.93Å; K137-L306 HydrophobicContact CD-CG 3.83Å; K137-L306 WeakPolarHBondContact CD-O 3.1Å; Y139-L306 WeakPolarHBondContact OH-CD2 3.04Å; C298-L306 HydrophobicContact CB-CD1 3.75Å; C298-L306 HydrophobicContact CB-CD2 4.2Å; C298-L306 HydrophobicContact CB-CG 3.8Å; L299-L306 CarbonylContact O-C 3.6Å; V300-L306 HydrophobicContact CG2-CD1 4.29Å
307	V	97.3	Very high	96	Very high	32 Å²	32	56.4 Å²	56.4	19%	0.194	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	145.9	-176.2	174.4	0	0	0	0	109.4	C298 L299 D301 V317	C298-V307 CarbonylContact C-O 3.59Å; C298-V307 VanDerWaalsContact CA-O 3.32Å; C298-V307 WeakPolarHBondContact CA-O 3.41Å; L299-V307 PolarHBondContact N-O 2.88Å; L299-V307 PolarHBondContact O-N 3.04Å; L299-V307 VanDerWaalsContact O-O 3.13Å; D301-V307 HydrophobicContact CB-CG2 4.13Å; V307-V317 HydrophobicContact CG2-CG1 4.43Å
308	C	98	Very high	96	Very high	8 Å²	8	53.3 Å²	53.3	5%	0.054	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	141.8	176.8	-63.4	0	0	0	0	112.8	K137 K290 C291 A295 C310 V317 C319	K137-C308 PolarHBondContact NZ-SG 3.32Å; K137-C308 VanDerWaalsContact NZ-SG 3.37Å; K290-C308 PolarHBondContact O-SG 2.82Å; C291-C308 WeakPolarHBondContact CA-SG 3.27Å; C291-C308 HydrophobicContact CB-CB 3.83Å; C291-C308 WeakPolarHBondContact CB-SG 3.35Å; C291-C308 WeakPolarHBondContact SG-CB 3.29Å; C291-C308 CovalentContact SG-SG 2.03Å; C291-C308 PolarHBondContact SG-SG 3.06Å; A295-C308 HydrophobicContact CB-CB 3.89Å; C308-C310 VanDerWaalsContact C-N 3.26Å; C308-C310 PolarHBondContact O-N 3.32Å; C308-V317 PolarHBondContact N-O 3.08Å; C308-V317 PolarHBondContact SG-O 3.16Å; C308-V317 VanDerWaalsContact SG-O 3.32Å; C308-C319 WeakPolarHBondContact CB-SG 3.33Å
309	D	97.3	Very high	96.1	Very high	35 Å²	35	52 Å²	52	19%	0.187	28%	0.284	C	S	.	.			trans	-79	72.5	169.6	-175.3	12.4	0	0	0	110.3	A295 R297 L299 K311	A295-D309 WeakPolarHBondContact CB-O 3.31Å; R297-D309 HydrophobicContact CG-CB 3.92Å; R297-D309 IonicContact CZ-OD2 3.68Å; R297-D309 IonicContact NE-OD2 3.29Å; R297-D309 PolarHBondContact NE-OD2 2.61Å; R297-D309 IonicContact NH2-OD2 3.16Å; R297-D309 PolarHBondContact NH2-OD2 2.71Å; R297-D309 PolarHBondContact O-N 3.01Å; R297-D309 VanDerWaalsContact O-N 3.07Å; L299-D309 HydrophobicContact CD1-CB 3.8Å; L299-D309 HydrophobicContact CG-CB 4.13Å; D309-K311 WeakPolarHBondContact O-CE 3.5Å; D309-K311 PolarHBondContact O-N 3.45Å; D309-K311 IonicContact OD2-NZ 3.17Å
310	C	97.7	Very high	96.2	Very high	20 Å²	20	51.7 Å²	51.7	14%	0.135	28%	0.28	C	S	.	.			trans	-62.4	129.7	-166.7	-63.6	0	0	0	0	115.3	C308 T314 C319	C308-C310 VanDerWaalsContact C-N 3.26Å; C308-C310 PolarHBondContact O-N 3.32Å; C310-T314 WeakPolarHBondContact CB-O 3.43Å; C310-T314 WeakPolarHBondContact CB-OG1 3.21Å; C310-C319 WeakPolarHBondContact CA-SG 3.42Å; C310-C319 HydrophobicContact CB-CB 4Å; C310-C319 WeakPolarHBondContact CB-SG 3.1Å; C310-C319 WeakPolarHBondContact SG-CA 3.24Å; C310-C319 WeakPolarHBondContact SG-CB 3.43Å; C310-C319 CovalentContact SG-SG 2.05Å; C310-C319 PolarHBondContact SG-SG 3.48Å
311	K	97.5	Very high	96.3	Very high	40 Å²	40	52.1 Å²	52.1	17%	0.174	27%	0.274	C	S	.	.			trans	-112.3	-172.6	175.5	-52.4	-59.4	172.7	154.7	0	111.1	D36 C38 Y39 H294 D309 N313 T314	D36-K311 WeakPolarHBondContact OD2-CE 3.47Å; D36-K311 IonicContact OD2-NZ 2.9Å; D36-K311 PolarHBondContact OD2-NZ 3.47Å; C38-K311 HydrophobicContact CB-CB 4.02Å; C38-K311 HydrophobicContact CB-CG 3.89Å; C38-K311 VanDerWaalsContact SG-CG 3.57Å; Y39-K311 HydrophobicContact CE2-CB 4.47Å; H294-K311 WeakPolarHBondContact O-CA 3.3Å; H294-K311 WeakPolarHBondContact O-CB 3.43Å; H294-K311 PolarHBondContact O-N 3.37Å; D309-K311 WeakPolarHBondContact O-CE 3.5Å; D309-K311 PolarHBondContact O-N 3.45Å; D309-K311 IonicContact OD2-NZ 3.17Å; K311-N313 PolarHBondContact O-N 2.95Å; K311-T314 WeakPolarHBondContact O-CB 3.02Å; K311-T314 PolarHBondContact O-N 3Å; K311-T314 PolarHBondContact O-OG1 3.18Å
312	H	97.9	Very high	96.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	30.9	179.5	-48.8	169.4	0	0	0	113	C38 I46 H294 T314 P339 E341 C342	C38-H312 PolarHBondContact O-NE2 2.82Å; I46-H312 PolarHBondContact O-CE1 2.76Å; I46-H312 PolarHBondContact O-NE2 2.94Å; I46-H312 VanDerWaalsContact O-NE2 3.09Å; H294-H312 AromaticContact CE1-ND1 3.86Å; H294-H312 AromaticContact ND1-CG 3.6Å; H294-H312 AromaticContact ND1-ND1 3.03Å; H294-H312 PolarHBondContact ND1-ND1 2.64Å; H312-T314 HydrophobicContact CB-CG2 4.47Å; H312-T314 PolarHBondContact O-N 3.02Å; H312-P339 PolarHBondContact ND1-O 3.43Å; H312-P339 VanDerWaalsContact ND1-O 3.15Å; H312-E341 HydrophobicContact CB-CB 3.82Å; H312-C342 PolarHBondContact O-N 2.05Å
313	N	98	Very high	96.8	Very high	44 Å²	44	43.8 Å²	43.8	24%	0.235	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	31.1	-173.3	-55.5	-47.4	0	0	0	114.9	K311 K323 H326 C342	K311-N313 PolarHBondContact O-N 2.95Å; N313-K323 HydrophobicContact CB-CD 4.43Å; N313-K323 VanDerWaalsContact O-CB 3.27Å; N313-K323 WeakPolarHBondContact O-CB 3.45Å; N313-K323 VanDerWaalsContact O-CG 3.29Å; N313-K323 WeakPolarHBondContact O-CG 3.48Å; N313-K323 PolarHBondContact O-N 2.99Å; N313-H326 HydrophobicContact CB-CB 4.2Å; N313-H326 WeakPolarHBondContact CB-CD2 3.34Å; N313-H326 PolarHBondContact ND2-CD2 2.75Å; N313-C342 HydrophobicContact CB-CB 3.93Å; N313-C342 WeakPolarHBondContact CB-O 3.46Å; N313-C342 PolarHBondContact ND2-O 3.3Å; N313-C342 VanDerWaalsContact ND2-O 3.1Å; N313-C342 WeakPolarHBondContact O-CB 3.36Å
314	T	98.5	Very high	97.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	163.7	172.1	63.5	0	0	0	0	112	H294 C310 K311 H312 C319 K321 K323	H294-T314 HydrophobicContact CB-CG2 4.07Å; H294-T314 WeakPolarHBondContact CB-OG1 3.34Å; C310-T314 WeakPolarHBondContact CB-O 3.43Å; C310-T314 WeakPolarHBondContact CB-OG1 3.21Å; K311-T314 WeakPolarHBondContact O-CB 3.02Å; K311-T314 PolarHBondContact O-N 3Å; K311-T314 PolarHBondContact O-OG1 3.18Å; H312-T314 HydrophobicContact CB-CG2 4.47Å; H312-T314 PolarHBondContact O-N 3.02Å; T314-C319 WeakPolarHBondContact OG1-CB 3.03Å; T314-K321 CarbonylContact C-O 3.54Å; T314-K321 VanDerWaalsContact CA-O 3.3Å; T314-K321 WeakPolarHBondContact CA-O 3.31Å; T314-K323 WeakPolarHBondContact O-CE 3.44Å; T314-K323 WeakPolarHBondContact O-CG 3.47Å
315	A	97.7	Very high	97.4	Very high	25 Å²	25	42.1 Å²	42.1	21%	0.207	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	167.8	-179.6	0	0	0	0	0	109.8	C319 E320 K321 K323	A315-C319 CarbonylContact O-C 3.49Å; A315-C319 WeakPolarHBondContact O-CA 3.49Å; A315-E320 PolarHBondContact O-N 2.97Å; A315-K321 HydrophobicContact CB-CG 4.47Å; A315-K321 PolarHBondContact N-O 3.36Å; A315-K321 WeakPolarHBondContact O-CG 3.09Å; A315-K321 PolarHBondContact O-N 3.03Å; A315-K321 VanDerWaalsContact O-O 3.09Å; A315-K323 HydrophobicContact CB-CG 3.94Å
316	G	97	Very high	97.7	Very high	24 Å²	24	37.6 Å²	37.6	25%	0.247	20%	0.203	C	C	.	.	S	Bend	trans	112.5	177.1	-177.7	0	0	0	0	0	112.5	D318 E320	G316-D318 VanDerWaalsContact C-N 3.31Å; G316-E320 WeakPolarHBondContact CA-OE1 3.47Å; G316-E320 VanDerWaalsContact CA-OE2 3.31Å; G316-E320 WeakPolarHBondContact CA-OE2 3.04Å
317	V	96.9	Very high	97.8	Very high	50 Å²	50	39.2 Å²	39.2	30%	0.303	21%	0.207	S	C	.	.	S	Bend	trans	-69.6	-37	-179.5	175.6	0	0	0	0	110.2	K137 V307 C308 E320	K137-V317 PolarHBondContact NZ-O 2.77Å; V307-V317 HydrophobicContact CG2-CG1 4.43Å; C308-V317 PolarHBondContact N-O 3.08Å; C308-V317 PolarHBondContact SG-O 3.16Å; C308-V317 VanDerWaalsContact SG-O 3.32Å; V317-E320 PolarHBondContact N-OE2 3.15Å
318	D	97.7	Very high	97.8	Very high	12 Å²	12	38.4 Å²	38.4	6%	0.064	20%	0.202	C	C	.	.	S	Bend	trans	-113.9	14.3	-175.9	-52.9	-44.8	0	0	0	111.6	K137 K138 K290 C291 N292 G316 E320	K137-D318 IonicContact NZ-OD1 3.32Å; K137-D318 PolarHBondContact NZ-OD1 3.06Å; K138-D318 WeakPolarHBondContact CD-OD2 3.44Å; K290-D318 WeakPolarHBondContact O-CA 3.38Å; K290-D318 WeakPolarHBondContact O-CB 3.39Å; C291-D318 CarbonylContact C-O 3.58Å; C291-D318 VanDerWaalsContact C-O 3.25Å; C291-D318 WeakPolarHBondContact CA-O 3.36Å; N292-D318 PolarHBondContact ND2-O 3.48Å; G316-D318 VanDerWaalsContact C-N 3.31Å; D318-E320 WeakPolarHBondContact CA-OE2 3.36Å; D318-E320 PolarHBondContact N-OE2 3.28Å; D318-E320 PolarHBondContact O-N 3.01Å
319	C	98.2	Very high	97.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	58.6	34.5	-170.8	-49.8	0	0	0	0	113.4	H294 C308 C310 T314 A315 K321 W331	H294-C319 HydrophobicContact CB-CB 3.76Å; C308-C319 WeakPolarHBondContact CB-SG 3.33Å; C310-C319 WeakPolarHBondContact CA-SG 3.42Å; C310-C319 HydrophobicContact CB-CB 4Å; C310-C319 WeakPolarHBondContact CB-SG 3.1Å; C310-C319 WeakPolarHBondContact SG-CA 3.24Å; C310-C319 WeakPolarHBondContact SG-CB 3.43Å; C310-C319 CovalentContact SG-SG 2.05Å; C310-C319 PolarHBondContact SG-SG 3.48Å; T314-C319 WeakPolarHBondContact OG1-CB 3.03Å; A315-C319 CarbonylContact O-C 3.49Å; A315-C319 WeakPolarHBondContact O-CA 3.49Å; C319-K321 VanDerWaalsContact C-N 3.29Å; C319-K321 PolarHBondContact O-N 2.88Å; C319-W331 WeakPolarHBondContact O-CZ2 3.42Å; C319-W331 PolarHBondContact O-NE1 3.49Å
320	E	97.3	Very high	97.7	Very high	75 Å²	75	43.6 Å²	43.6	35%	0.35	23%	0.225	S	C	.	.			trans	-81.3	2.8	-171	74.3	-71.3	164.5	0	0	115.3	A315 G316 V317 D318	A315-E320 PolarHBondContact O-N 2.97Å; G316-E320 WeakPolarHBondContact CA-OE1 3.47Å; G316-E320 VanDerWaalsContact CA-OE2 3.31Å; G316-E320 WeakPolarHBondContact CA-OE2 3.04Å; V317-E320 PolarHBondContact N-OE2 3.15Å; D318-E320 WeakPolarHBondContact CA-OE2 3.36Å; D318-E320 PolarHBondContact N-OE2 3.28Å; D318-E320 PolarHBondContact O-N 3.01Å
321	K	97.8	Very high	97.7	Very high	112 Å²	112	46.8 Å²	46.8	49%	0.487	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159.3	-178.9	57.1	-176.6	172	-162.5	0	111.8	T314 A315 C319	T314-K321 CarbonylContact C-O 3.54Å; T314-K321 VanDerWaalsContact CA-O 3.3Å; T314-K321 WeakPolarHBondContact CA-O 3.31Å; A315-K321 HydrophobicContact CB-CG 4.47Å; A315-K321 PolarHBondContact N-O 3.36Å; A315-K321 WeakPolarHBondContact O-CG 3.09Å; A315-K321 PolarHBondContact O-N 3.03Å; A315-K321 VanDerWaalsContact O-O 3.09Å; C319-K321 VanDerWaalsContact C-N 3.29Å; C319-K321 PolarHBondContact O-N 2.88Å
322	C	98.4	Very high	97.6	Very high	6 Å²	6	45.5 Å²	45.5	4%	0.041	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	148.1	171.6	-65.2	0	0	0	0	112.6	H326 Y327 C342	C322-H326 HydrophobicContact CB-CB 4.46Å; C322-H326 WeakPolarHBondContact CB-O 3.43Å; C322-H326 PolarHBondContact SG-O 2.78Å; C322-Y327 HydrophobicContact CB-CD1 3.96Å; C322-Y327 HydrophobicContact CB-CE1 3.89Å; C322-C342 WeakPolarHBondContact CA-SG 3.39Å; C322-C342 HydrophobicContact CB-CB 3.57Å; C322-C342 WeakPolarHBondContact CB-SG 3.35Å; C322-C342 WeakPolarHBondContact SG-CB 3.04Å; C322-C342 CovalentContact SG-SG 2.04Å; C322-C342 PolarHBondContact SG-SG 2.94Å
323	K	98.3	Very high	97.5	Very high	79 Å²	79	46.9 Å²	46.9	34%	0.343	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-57.9	151.9	168.5	-77.6	178.4	-170	177.3	0	110	N313 T314 A315 F325 H326	N313-K323 HydrophobicContact CB-CD 4.43Å; N313-K323 VanDerWaalsContact O-CB 3.27Å; N313-K323 WeakPolarHBondContact O-CB 3.45Å; N313-K323 VanDerWaalsContact O-CG 3.29Å; N313-K323 WeakPolarHBondContact O-CG 3.48Å; N313-K323 PolarHBondContact O-N 2.99Å; T314-K323 WeakPolarHBondContact O-CE 3.44Å; T314-K323 WeakPolarHBondContact O-CG 3.47Å; A315-K323 HydrophobicContact CB-CG 3.94Å; K323-F325 PolarHBondContact O-N 3.28Å; K323-H326 WeakPolarHBondContact O-CB 3.41Å; K323-H326 PolarHBondContact O-N 3.46Å
324	P	97.6	Very high	97.4	Very high	99 Å²	99	44.8 Å²	44.8	64%	0.643	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.2	139.8	170.6	-27.3	35.5	0	0	0	111.4	H326 Y327	P324-H326 PolarHBondContact O-N 2.62Å; P324-H326 PolarHBondContact O-ND1 2.81Å; P324-Y327 WeakPolarHBondContact CA-OH 3.16Å
325	F	98.1	Very high	97.2	Very high	51 Å²	51	45.8 Å²	45.8	22%	0.224	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	-3.9	-178.5	-161.4	-108.3	0	0	0	115.9	K323 Y327 P344 C345 C347 A351 C354	K323-F325 PolarHBondContact O-N 3.28Å; F325-Y327 PolarHBondContact O-N 2.86Å; F325-P344 HydrophobicContact CD1-CB 4.47Å; F325-P344 WeakPolarHBondContact O-CA 3.34Å; F325-C345 HydrophobicContact CD2-CB 4.42Å; F325-C345 WeakPolarHBondContact CE1-O 3.44Å; F325-C345 HydrophobicContact CE2-CB 4.16Å; F325-C345 HydrophobicContact CZ-CB 4.24Å; F325-C345 WeakPolarHBondContact CZ-O 3.35Å; F325-C345 PolarHBondContact O-N 3.06Å; F325-C347 HydrophobicContact CE2-CB 4.12Å; F325-C347 VanDerWaalsContact CE2-SG 3.53Å; F325-C347 HydrophobicContact CZ-CB 3.98Å; F325-A351 WeakPolarHBondContact CE2-O 3.44Å; F325-C354 HydrophobicContact CD2-CB 4.43Å; F325-C354 PolarHBondContact O-SG 3.21Å
326	H	98.4	Very high	96.9	Very high	37 Å²	37	48.4 Å²	48.4	17%	0.171	25%	0.254	C	S	.	.			trans	-100.1	51.8	176.8	-62	70.5	0	0	0	111.8	N313 C322 K323 P324 C342 V343	N313-H326 HydrophobicContact CB-CB 4.2Å; N313-H326 WeakPolarHBondContact CB-CD2 3.34Å; N313-H326 PolarHBondContact ND2-CD2 2.75Å; C322-H326 HydrophobicContact CB-CB 4.46Å; C322-H326 WeakPolarHBondContact CB-O 3.43Å; C322-H326 PolarHBondContact SG-O 2.78Å; K323-H326 WeakPolarHBondContact O-CB 3.41Å; K323-H326 PolarHBondContact O-N 3.46Å; P324-H326 PolarHBondContact O-N 2.62Å; P324-H326 PolarHBondContact O-ND1 2.81Å; H326-C342 HydrophobicContact CB-CB 3.78Å; H326-C342 PolarHBondContact CD2-O 3.02Å; H326-V343 CarbonylContact C-O 3.59Å; H326-V343 WeakPolarHBondContact CA-O 3.4Å
327	Y	98	Very high	96.7	Very high	74 Å²	74	53 Å²	53	29%	0.29	27%	0.273	S	S	.	.			trans	-113.1	25.2	-174.6	-52.7	-60.8	0	0	0	112.5	C322 P324 F325 R329 V343 C354 F356	C322-Y327 HydrophobicContact CB-CD1 3.96Å; C322-Y327 HydrophobicContact CB-CE1 3.89Å; P324-Y327 WeakPolarHBondContact CA-OH 3.16Å; F325-Y327 PolarHBondContact O-N 2.86Å; Y327-R329 VanDerWaalsContact C-N 3.27Å; Y327-V343 PolarHBondContact N-O 2.91Å; Y327-C354 VanDerWaalsContact CD2-O 3.26Å; Y327-C354 WeakPolarHBondContact CD2-O 3.42Å; Y327-F356 WeakPolarHBondContact O-CA 3.37Å; Y327-F356 WeakPolarHBondContact O-CB 3.46Å
328	D	97.9	Very high	96.6	Very high	15 Å²	15	54 Å²	54	8%	0.08	28%	0.277	C	S	.	.	S	Bend	trans	-73.6	-24.9	176.5	-167.5	52.9	0	0	0	112.2	V343 S368 G369 G370	D328-V343 HydrophobicContact CB-CB 4.01Å; D328-V343 HydrophobicContact CB-CG1 3.92Å; D328-V343 VanDerWaalsContact CB-O 3.32Å; D328-V343 WeakPolarHBondContact CB-O 3.24Å; D328-V343 PolarHBondContact N-O 3.46Å; D328-S368 PolarHBondContact OD1-OG 3.27Å; D328-S368 WeakPolarHBondContact OD2-CB 3Å; D328-S368 PolarHBondContact OD2-OG 2.83Å; D328-G369 WeakPolarHBondContact O-CA 2.96Å; D328-G369 PolarHBondContact O-N 2.88Å; D328-G369 PolarHBondContact OD1-N 2.88Å; D328-G370 WeakPolarHBondContact OD1-CA 3.38Å; D328-G370 PolarHBondContact OD1-N 2.84Å
329	R	96.5	Very high	96.5	Very high	98 Å²	98	54.6 Å²	54.6	37%	0.37	28%	0.281	S	S	.	.	S	Bend	trans	-128.4	155.7	173.6	-67.3	-171.7	-177.6	171	2.2	110.2	Y327 V343 Y361 K367	Y327-R329 VanDerWaalsContact C-N 3.27Å; R329-V343 HydrophobicContact CG-CB 4.32Å; R329-V343 HydrophobicContact CG-CG2 4.19Å; R329-Y361 HydrophobicContact CG-CE2 4.07Å; R329-K367 PolarHBondContact NE-O 3.34Å; R329-K367 PolarHBondContact NH2-O 3.04Å
330	P	95.9	Very high	96.4	Very high	54 Å²	54	57.6 Å²	57.6	35%	0.351	30%	0.295	S	S	.	.			trans	-66.3	150.6	173.1	30.1	-33.4	0	0	0	110.2	F356 Y361	P330-F356 HydrophobicContact CB-CE1 4.26Å; P330-F356 HydrophobicContact CB-CZ 4.17Å; P330-F356 HydrophobicContact CG-CE2 4.43Å; P330-F356 HydrophobicContact CG-CZ 4.12Å; P330-Y361 HydrophobicContact CG-CE1 4.26Å
331	W	97.4	Very high	96.4	Very high	87 Å²	87	57.4 Å²	57.4	33%	0.33	29%	0.294	S	S	.	.			trans	-66.5	144.7	170.4	178.4	88.5	0	0	0	110	N292 H294 C319 R333	N292-W331 HydrophobicContact CB-CH2 4.05Å; N292-W331 HydrophobicContact CB-CZ2 3.68Å; H294-W331 AromaticContact NE2-NE1 3.83Å; C319-W331 WeakPolarHBondContact O-CZ2 3.42Å; C319-W331 PolarHBondContact O-NE1 3.49Å; W331-R333 HydrophobicContact CH2-CB 4.45Å
332	G	95.9	Very high	96.4	Very high	14 Å²	14	52.1 Å²	52.1	14%	0.144	27%	0.271	C	S	.	.			trans	-150.9	154.9	171.8	0	0	0	0	0	110.5	H294 H340	H294-G332 PolarHBondContact CE1-O 3.1Å; H294-G332 PolarHBondContact NE2-O 2.89Å; G332-H340 VanDerWaalsContact O-CB 3.24Å; G332-H340 WeakPolarHBondContact O-CB 3.38Å
333	R	96.1	Very high	96.3	Very high	28 Å²	28	53.2 Å²	53.2	11%	0.106	28%	0.278	C	S	.	.			trans	-65.7	137.3	172.5	164.1	178.4	-73.4	-100.8	-1.3	109.6	E140 Q235 N292 W331 T335 H340	E140-R333 IonicContact OE1-CZ 3.19Å; E140-R333 VanDerWaalsContact OE1-CZ 3.24Å; E140-R333 IonicContact OE1-NH1 3.64Å; E140-R333 PolarHBondContact OE1-NH1 2.95Å; E140-R333 IonicContact OE1-NH2 3.39Å; E140-R333 PolarHBondContact OE1-NH2 2.89Å; E140-R333 IonicContact OE2-NH1 3.83Å; Q235-R333 VanDerWaalsContact OE1-NE 3.08Å; N292-R333 HydrophobicContact CB-CB 4.48Å; N292-R333 PolarHBondContact OD1-NH2 2.79Å; W331-R333 HydrophobicContact CH2-CB 4.45Å; R333-T335 PolarHBondContact O-N 3.13Å; R333-H340 PolarHBondContact O-ND1 3.05Å
334	A	96.2	Very high	96.3	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.008	28%	0.281	C	S	.	.			trans	-67.5	133.6	173.7	0	0	0	0	0	111.6	R47 N292 G293 P339	R47-A334 HydrophobicContact CB-CB 3.97Å; R47-A334 WeakPolarHBondContact CD-O 3.35Å; R47-A334 HydrophobicContact CG-CB 4.02Å; N292-A334 PolarHBondContact O-N 2.92Å; G293-A334 VanDerWaalsContact O-CB 3.29Å; G293-A334 WeakPolarHBondContact O-CB 3.12Å; A334-P339 WeakPolarHBondContact CB-O 3.49Å
335	T	94.4	Very high	96.3	Very high	21 Å²	21	48 Å²	48	13%	0.129	25%	0.252	C	S	.	.			trans	-113.2	171.6	174.9	62.8	0	0	0	0	109.9	R47 R333 D337 D338	R47-T335 WeakPolarHBondContact CB-O 3.28Å; R333-T335 PolarHBondContact O-N 3.13Å; T335-D337 PolarHBondContact O-N 3.5Å; T335-D337 PolarHBondContact OG1-N 2.68Å; T335-D338 PolarHBondContact N-O 3.3Å; T335-D338 PolarHBondContact OG1-N 3Å; T335-D338 PolarHBondContact OG1-O 3.13Å
336	A	91.4	Very high	96.3	Very high	79 Å²	79	50.1 Å²	50.1	65%	0.653	27%	0.265	S	S	*	.	S	Bend	trans	-55.9	-33.5	172.2	0	0	0	0	0	113	E229	E229-A336 PolarHBondContact OE2-N 3.03Å
337	D	92.2	Very high	96.3	Very high	122 Å²	122	48.4 Å²	48.4	65%	0.652	26%	0.258	S	S	*	.	S	Bend	trans	-89.7	-34	-175	-54.9	-48.7	0	0	0	113.5	R230 T335	R230-D337 IonicContact CZ-OD2 3.62Å; R230-D337 IonicContact NH2-OD2 2.74Å; R230-D337 PolarHBondContact NH2-OD2 2.98Å; T335-D337 PolarHBondContact O-N 3.5Å; T335-D337 PolarHBondContact OG1-N 2.68Å
338	D	94.1	Very high	96.3	Very high	71 Å²	71	46.2 Å²	46.2	38%	0.38	25%	0.251	S	S	.	.			trans	-137.7	118.3	-176.7	-172.8	-11.7	0	0	0	111	T335 H340	T335-D338 PolarHBondContact N-O 3.3Å; T335-D338 PolarHBondContact OG1-N 3Å; T335-D338 PolarHBondContact OG1-O 3.13Å; D338-H340 PolarHBondContact O-N 2.97Å; D338-H340 VanDerWaalsContact O-N 3.13Å; D338-H340 PolarHBondContact O-ND1 3.46Å; D338-H340 WeakPolarHBondContact OD1-CA 3.49Å; D338-H340 IonicContact OD1-CG 2.67Å; D338-H340 PolarHBondContact OD1-N 2.86Å; D338-H340 IonicContact OD1-ND1 3.66Å; D338-H340 IonicContact OD2-CD2 3.51Å; D338-H340 IonicContact OD2-CE1 2.69Å; D338-H340 IonicContact OD2-NE2 3.34Å
339	P	95.8	Very high	96.3	Very high	23 Å²	23	52 Å²	52	15%	0.149	28%	0.282	C	S	.	.			trans	-66.9	-9.5	176.7	30.2	-37.8	0	0	0	113.9	P45 H294 H312 A334 E341	P45-P339 HydrophobicContact CB-CB 3.92Å; P45-P339 HydrophobicContact CB-CG 3.93Å; P45-P339 HydrophobicContact CG-CB 4.34Å; P45-P339 HydrophobicContact CG-CG 3.79Å; P45-P339 WeakPolarHBondContact O-CG 3.46Å; H294-P339 PolarHBondContact CE1-O 3.36Å; H294-P339 VanDerWaalsContact CE1-O 3.28Å; H312-P339 PolarHBondContact ND1-O 3.43Å; H312-P339 VanDerWaalsContact ND1-O 3.15Å; A334-P339 WeakPolarHBondContact CB-O 3.49Å; P339-E341 VanDerWaalsContact C-N 3.29Å; P339-E341 PolarHBondContact O-N 3.3Å
340	H	96.1	Very high	96.3	Very high	63 Å²	63	47.4 Å²	47.4	29%	0.292	26%	0.264	S	S	.	.			trans	48	49.6	-179.6	-71.4	88	0	0	0	112.3	H294 G332 R333 D338	H294-H340 PolarHBondContact CE1-O 3.26Å; G332-H340 VanDerWaalsContact O-CB 3.24Å; G332-H340 WeakPolarHBondContact O-CB 3.38Å; R333-H340 PolarHBondContact O-ND1 3.05Å; D338-H340 PolarHBondContact O-N 2.97Å; D338-H340 VanDerWaalsContact O-N 3.13Å; D338-H340 PolarHBondContact O-ND1 3.46Å; D338-H340 WeakPolarHBondContact OD1-CA 3.49Å; D338-H340 IonicContact OD1-CG 2.67Å; D338-H340 PolarHBondContact OD1-N 2.86Å; D338-H340 IonicContact OD1-ND1 3.66Å; D338-H340 IonicContact OD2-CD2 3.51Å; D338-H340 IonicContact OD2-CE1 2.69Å; D338-H340 IonicContact OD2-NE2 3.34Å
341	E	97.1	Very high	96.5	Very high	72 Å²	72	45.1 Å²	45.1	34%	0.336	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-68.1	140.4	179.5	69.1	167.3	178.6	0	0	112.8	P45 H312 P339 V343	P45-E341 HydrophobicContact CG-CB 4.41Å; P45-E341 HydrophobicContact CG-CG 4.21Å; P45-E341 WeakPolarHBondContact CG-OE2 3.05Å; H312-E341 HydrophobicContact CB-CB 3.82Å; P339-E341 VanDerWaalsContact C-N 3.29Å; P339-E341 PolarHBondContact O-N 3.3Å; E341-V343 PolarHBondContact O-N 2.82Å
342	C	98	Very high	96.5	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.007	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-75.1	118.7	175	-65.9	0	0	0	0	109.7	H312 N313 C322 H326	H312-C342 PolarHBondContact O-N 2.05Å; N313-C342 HydrophobicContact CB-CB 3.93Å; N313-C342 WeakPolarHBondContact CB-O 3.46Å; N313-C342 PolarHBondContact ND2-O 3.3Å; N313-C342 VanDerWaalsContact ND2-O 3.1Å; N313-C342 WeakPolarHBondContact O-CB 3.36Å; C322-C342 WeakPolarHBondContact CA-SG 3.39Å; C322-C342 HydrophobicContact CB-CB 3.57Å; C322-C342 WeakPolarHBondContact CB-SG 3.35Å; C322-C342 WeakPolarHBondContact SG-CB 3.04Å; C322-C342 CovalentContact SG-SG 2.04Å; C322-C342 PolarHBondContact SG-SG 2.94Å; H326-C342 HydrophobicContact CB-CB 3.78Å; H326-C342 PolarHBondContact CD2-O 3.02Å
343	V	97.5	Very high	96.6	Very high	28 Å²	28	57.3 Å²	57.3	17%	0.17	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-91.1	132.2	-175.3	178.8	0	0	0	0	110.7	H326 Y327 D328 R329 E341	H326-V343 CarbonylContact C-O 3.59Å; H326-V343 WeakPolarHBondContact CA-O 3.4Å; Y327-V343 PolarHBondContact N-O 2.91Å; D328-V343 HydrophobicContact CB-CB 4.01Å; D328-V343 HydrophobicContact CB-CG1 3.92Å; D328-V343 VanDerWaalsContact CB-O 3.32Å; D328-V343 WeakPolarHBondContact CB-O 3.24Å; D328-V343 PolarHBondContact N-O 3.46Å; R329-V343 HydrophobicContact CG-CB 4.32Å; R329-V343 HydrophobicContact CG-CG2 4.19Å; E341-V343 PolarHBondContact O-N 2.82Å
344	P	97.7	Very high	96.7	Very high	63 Å²	63	56.4 Å²	56.4	41%	0.409	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-64.8	138.6	176.7	27.8	-34.4	0	0	0	112.1	F325	F325-P344 HydrophobicContact CD1-CB 4.47Å; F325-P344 WeakPolarHBondContact O-CA 3.34Å
345	C	98	Very high	96.7	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.034	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-65.7	134.7	174.2	-63.6	0	0	0	0	111.5	F325 C347 C354	F325-C345 HydrophobicContact CD2-CB 4.42Å; F325-C345 WeakPolarHBondContact CE1-O 3.44Å; F325-C345 HydrophobicContact CE2-CB 4.16Å; F325-C345 HydrophobicContact CZ-CB 4.24Å; F325-C345 WeakPolarHBondContact CZ-O 3.35Å; F325-C345 PolarHBondContact O-N 3.06Å; C345-C347 PolarHBondContact O-N 2.97Å; C345-C354 HydrophobicContact CB-CB 3.49Å; C345-C354 VanDerWaalsContact CB-CB 3.49Å; C345-C354 WeakPolarHBondContact CB-SG 3.32Å; C345-C354 WeakPolarHBondContact SG-CB 3.18Å; C345-C354 CovalentContact SG-SG 2.02Å; C345-C354 PolarHBondContact SG-SG 3.05Å
346	N	97.9	Very high	96.9	Very high	96 Å²	96	63.5 Å²	63.5	51%	0.513	32%	0.315	S	S	.	.			trans	-84.4	95	172.8	-175.7	7.4	0	0	0	111.2	N348 H383	N346-N348 PolarHBondContact OD1-N 3.21Å; N346-H383 WeakPolarHBondContact O-CA 3.26Å; N346-H383 VanDerWaalsContact O-CB 3.31Å; N346-H383 WeakPolarHBondContact O-CB 3.45Å; N346-H383 PolarHBondContact O-CD2 3.15Å
347	C	98.2	Very high	97.2	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.014	29%	0.292	C	S	.	.			trans	-106.9	20.5	177.6	-58.7	0	0	0	0	114	F325 C345 L349 H350 A351 C372 H383	F325-C347 HydrophobicContact CE2-CB 4.12Å; F325-C347 VanDerWaalsContact CE2-SG 3.53Å; F325-C347 HydrophobicContact CZ-CB 3.98Å; C345-C347 PolarHBondContact O-N 2.97Å; C347-L349 PolarHBondContact O-N 3.45Å; C347-H350 WeakPolarHBondContact O-CB 3.4Å; C347-H350 PolarHBondContact O-N 3.2Å; C347-A351 HydrophobicContact CB-CB 3.78Å; C347-C372 WeakPolarHBondContact CA-SG 3.35Å; C347-C372 HydrophobicContact CB-CB 3.88Å; C347-C372 WeakPolarHBondContact CB-SG 3.26Å; C347-C372 WeakPolarHBondContact SG-CB 3.19Å; C347-C372 CovalentContact SG-SG 2.02Å; C347-C372 PolarHBondContact SG-SG 3.07Å; C347-H383 CarbonylContact C-O 3.58Å; C347-H383 VanDerWaalsContact C-O 3.27Å; C347-H383 WeakPolarHBondContact CA-O 3.34Å
348	N	97.3	Very high	97.4	Very high	27 Å²	27	61 Å²	61	14%	0.144	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	34.8	-178.1	-67.5	-72.6	0	0	0	113.8	N346 H350 H383 M399 T400	N346-N348 PolarHBondContact OD1-N 3.21Å; N348-H350 PolarHBondContact O-CE1 3.36Å; N348-H350 PolarHBondContact O-N 3.13Å; N348-H350 VanDerWaalsContact O-N 3.15Å; N348-H350 PolarHBondContact O-ND1 2.86Å; N348-H350 VanDerWaalsContact O-ND1 3.09Å; N348-H383 PolarHBondContact ND2-O 2.89Å; N348-M399 HydrophobicContact CB-CG 4.16Å; N348-T400 HydrophobicContact CB-CG2 4.39Å; N348-T400 WeakPolarHBondContact O-CA 3.2Å
349	L	97.8	Very high	97.6	Very high	138 Å²	138	61.6 Å²	61.6	72%	0.723	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	24.7	-175	-51.9	-179.7	0	0	0	114.7	C347 H377	C347-L349 PolarHBondContact O-N 3.45Å; L349-H377 PolarHBondContact O-CE1 3.5Å
350	H	98.3	Very high	97.6	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	29%	0.29	C	S	.	.	S	Bend	trans	-111.9	-9.7	-178.6	-64.4	-13.5	0	0	0	113.8	C347 N348 R376 H377 T379 C384 M399 H401	C347-H350 WeakPolarHBondContact O-CB 3.4Å; C347-H350 PolarHBondContact O-N 3.2Å; N348-H350 PolarHBondContact O-CE1 3.36Å; N348-H350 PolarHBondContact O-N 3.13Å; N348-H350 VanDerWaalsContact O-N 3.15Å; N348-H350 PolarHBondContact O-ND1 2.86Å; N348-H350 VanDerWaalsContact O-ND1 3.09Å; H350-R376 WeakPolarHBondContact O-CA 3.05Å; H350-R376 WeakPolarHBondContact O-CB 3.49Å; H350-R376 WeakPolarHBondContact O-CG 3.33Å; H350-R376 PolarHBondContact O-N 3.3Å; H350-H377 AromaticContact CE1-ND1 3.52Å; H350-H377 AromaticContact CG-ND1 3.62Å; H350-H377 AromaticContact ND1-CE1 3.81Å; H350-H377 AromaticContact ND1-CG 3.83Å; H350-H377 AromaticContact ND1-ND1 2.89Å; H350-H377 PolarHBondContact ND1-ND1 3.09Å; H350-T379 WeakPolarHBondContact CB-OG1 3.49Å; H350-T379 WeakPolarHBondContact CD2-CG2 3.49Å; H350-T379 PolarHBondContact CD2-OG1 2.78Å; H350-T379 WeakPolarHBondContact NE2-CG2 3.37Å; H350-C384 HydrophobicContact CB-CB 3.65Å; H350-C384 PolarHBondContact CD2-O 2.79Å; H350-M399 PolarHBondContact CE1-O 2.82Å; H350-M399 PolarHBondContact NE2-O 3.11Å; H350-H401 PolarHBondContact CE1-O 3.42Å
351	A	98.3	Very high	97.6	Very high	6 Å²	6	60.9 Å²	60.9	5%	0.05	28%	0.283	C	S	.	.			trans	-131.9	153.1	168.3	0	0	0	0	0	110.4	F325 C347 C372 I373	F325-A351 WeakPolarHBondContact CE2-O 3.44Å; C347-A351 HydrophobicContact CB-CB 3.78Å; A351-C372 HydrophobicContact CB-CB 4.01Å; A351-I373 WeakPolarHBondContact CB-O 3.44Å
352	R	97.4	Very high	97.6	Very high	186 Å²	186	64.1 Å²	64.1	70%	0.702	29%	0.292	S	S	*	.	S	Bend	trans	-110.3	2	173	-66.2	-172.4	-179.9	164.5	-3.3	112.7
353	R	98.1	Very high	97.6	Very high	171 Å²	171	70.4 Å²	70.4	65%	0.645	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.4	-179.1	-68.6	178.9	66.6	168.4	-0.4	107.9	I373	R353-I373 HydrophobicContact CB-CB 4.34Å; R353-I373 PolarHBondContact O-N 2.94Å
354	C	98	Very high	97.5	Very high	9 Å²	9	71 Å²	71	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	171.5	171.1	61.5	0	0	0	0	108.5	F325 Y327 C345 M371	F325-C354 HydrophobicContact CD2-CB 4.43Å; F325-C354 PolarHBondContact O-SG 3.21Å; Y327-C354 VanDerWaalsContact CD2-O 3.26Å; Y327-C354 WeakPolarHBondContact CD2-O 3.42Å; C345-C354 HydrophobicContact CB-CB 3.49Å; C345-C354 VanDerWaalsContact CB-CB 3.49Å; C345-C354 WeakPolarHBondContact CB-SG 3.32Å; C345-C354 WeakPolarHBondContact SG-CB 3.18Å; C345-C354 CovalentContact SG-SG 2.02Å; C345-C354 PolarHBondContact SG-SG 3.05Å; C354-M371 CarbonylContact C-O 3.58Å; C354-M371 WeakPolarHBondContact CA-O 3.36Å; C354-M371 VanDerWaalsContact CB-O 3.23Å; C354-M371 WeakPolarHBondContact CB-O 2.99Å
355	R	97.5	Very high	97.4	Very high	120 Å²	120	70.2 Å²	70.2	45%	0.453	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156.3	168.8	62.3	-176.2	-174.9	97	-7.4	109	M371 I373	R355-M371 HydrophobicContact CG-CB 4.3Å; R355-M371 PolarHBondContact N-O 3.08Å; R355-M371 PolarHBondContact NH2-SD 3.03Å; R355-M371 PolarHBondContact O-N 2.86Å; R355-I373 HydrophobicContact CB-CD1 3.98Å; R355-I373 HydrophobicContact CG-CD1 3.99Å; R355-I373 HydrophobicContact CG-CG1 4.42Å
356	F	98.2	Very high	97.2	Very high	51 Å²	51	77 Å²	77	22%	0.224	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	144.4	168.9	179.9	-107.4	0	0	0	110.7	Y327 P330 M358 Y361 G369	Y327-F356 WeakPolarHBondContact O-CA 3.37Å; Y327-F356 WeakPolarHBondContact O-CB 3.46Å; P330-F356 HydrophobicContact CB-CE1 4.26Å; P330-F356 HydrophobicContact CB-CZ 4.17Å; P330-F356 HydrophobicContact CG-CE2 4.43Å; P330-F356 HydrophobicContact CG-CZ 4.12Å; F356-M358 HydrophobicContact CE1-CB 4.01Å; F356-M358 HydrophobicContact CE1-CE 3.75Å; F356-M358 HydrophobicContact CE1-SD 3.87Å; F356-M358 HydrophobicContact CZ-CE 4.21Å; F356-M358 HydrophobicContact CZ-SD 3.86Å; F356-Y361 HydrophobicContact CE2-CD1 4.27Å; F356-Y361 HydrophobicContact CE2-CD2 4.11Å; F356-Y361 AromaticContact CE2-CG 3.79Å; F356-Y361 HydrophobicContact CE2-CG 3.79Å; F356-Y361 AromaticContact CZ-CD1 3.87Å; F356-Y361 HydrophobicContact CZ-CD1 3.87Å; F356-Y361 AromaticContact CZ-CG 3.78Å; F356-Y361 HydrophobicContact CZ-CG 3.78Å; F356-G369 CarbonylContact C-O 3.6Å
357	N	97.9	Very high	97	Very high	33 Å²	33	79.1 Å²	79.1	18%	0.176	36%	0.363	C	S	.	.			trans	-132.8	112.6	174.3	-175.7	-51.3	0	0	0	109.3	E359 L360 Y361 G369	N357-E359 VanDerWaalsContact C-N 3.31Å; N357-E359 PolarHBondContact O-N 2.77Å; N357-E359 WeakPolarHBondContact OD1-CB 3.17Å; N357-E359 PolarHBondContact OD1-N 2.81Å; N357-L360 HydrophobicContact CB-CB 4.12Å; N357-L360 PolarHBondContact O-N 2.77Å; N357-L360 PolarHBondContact OD1-N 2.81Å; N357-L360 VanDerWaalsContact OD1-N 3.09Å; N357-Y361 PolarHBondContact O-N 3.07Å; N357-Y361 VanDerWaalsContact O-N 3.08Å; N357-G369 PolarHBondContact N-O 2.62Å
358	M	97.1	Very high	96.9	Very high	115 Å²	115	80.4 Å²	80.4	57%	0.567	37%	0.372	S	S	*	.	H	α-helix	trans	-64.1	-34.1	-176.1	-171.3	61.8	83.9	0	0	113.2	F356 Y361 R362	F356-M358 HydrophobicContact CE1-CB 4.01Å; F356-M358 HydrophobicContact CE1-CE 3.75Å; F356-M358 HydrophobicContact CE1-SD 3.87Å; F356-M358 HydrophobicContact CZ-CE 4.21Å; F356-M358 HydrophobicContact CZ-SD 3.86Å; M358-Y361 WeakPolarHBondContact O-CB 3.35Å; M358-Y361 PolarHBondContact O-N 2.73Å; M358-Y361 HydrophobicContact SD-CD1 4.1Å; M358-R362 WeakPolarHBondContact O-CB 3.04Å; M358-R362 PolarHBondContact O-N 2.03Å
359	E	97.3	Very high	96.9	Very high	83 Å²	83	79.1 Å²	79.1	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-70.4	-41.8	-179.1	-173.3	55.5	-155.2	0	0	111.3	N357 Y361 R362 M363	N357-E359 VanDerWaalsContact C-N 3.31Å; N357-E359 PolarHBondContact O-N 2.77Å; N357-E359 WeakPolarHBondContact OD1-CB 3.17Å; N357-E359 PolarHBondContact OD1-N 2.81Å; E359-Y361 VanDerWaalsContact C-N 3.31Å; E359-Y361 PolarHBondContact O-N 2.62Å; E359-R362 PolarHBondContact O-N 3.22Å; E359-R362 IonicContact OE1-CZ 3.04Å; E359-R362 IonicContact OE1-NE 2.71Å; E359-R362 IonicContact OE1-NH2 2.63Å; E359-R362 PolarHBondContact OE1-NH2 2.78Å; E359-R362 IonicContact OE2-CZ 3.19Å; E359-R362 IonicContact OE2-NE 3.16Å; E359-R362 PolarHBondContact OE2-NE 3Å; E359-R362 IonicContact OE2-NH2 3.2Å; E359-R362 PolarHBondContact OE2-NH2 3.06Å; E359-M363 HydrophobicContact CG-CE 4.14Å; E359-M363 WeakPolarHBondContact O-CB 3.18Å; E359-M363 WeakPolarHBondContact O-CG 3.36Å; E359-M363 PolarHBondContact O-N 3.24Å
360	L	95.7	Very high	96.9	Very high	36 Å²	36	72.6 Å²	72.6	19%	0.188	33%	0.331	C	S	.	.	H	α-helix	trans	-61	-43.1	172.5	-177.4	60.8	0	0	0	111.1	N357 R362 M363 S364 S368 G370	N357-L360 HydrophobicContact CB-CB 4.12Å; N357-L360 PolarHBondContact O-N 2.77Å; N357-L360 PolarHBondContact OD1-N 2.81Å; N357-L360 VanDerWaalsContact OD1-N 3.09Å; L360-R362 PolarHBondContact O-N 2.96Å; L360-M363 PolarHBondContact O-N 2.94Å; L360-S364 WeakPolarHBondContact O-CB 3.37Å; L360-S364 PolarHBondContact O-N 3.47Å; L360-S368 CarbonylContact C-O 3.55Å; L360-G370 WeakPolarHBondContact CD2-O 3.16Å
361	Y	96.6	Very high	96.9	Very high	36 Å²	36	74.8 Å²	74.8	14%	0.141	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-48.7	176.7	-170.9	-122.7	0	0	0	112	R329 P330 F356 N357 M358 E359 S364 Y366 S368	R329-Y361 HydrophobicContact CG-CE2 4.07Å; P330-Y361 HydrophobicContact CG-CE1 4.26Å; F356-Y361 HydrophobicContact CE2-CD1 4.27Å; F356-Y361 HydrophobicContact CE2-CD2 4.11Å; F356-Y361 AromaticContact CE2-CG 3.79Å; F356-Y361 HydrophobicContact CE2-CG 3.79Å; F356-Y361 AromaticContact CZ-CD1 3.87Å; F356-Y361 HydrophobicContact CZ-CD1 3.87Å; F356-Y361 AromaticContact CZ-CG 3.78Å; F356-Y361 HydrophobicContact CZ-CG 3.78Å; N357-Y361 PolarHBondContact O-N 3.07Å; N357-Y361 VanDerWaalsContact O-N 3.08Å; M358-Y361 WeakPolarHBondContact O-CB 3.35Å; M358-Y361 PolarHBondContact O-N 2.73Å; M358-Y361 HydrophobicContact SD-CD1 4.1Å; E359-Y361 VanDerWaalsContact C-N 3.31Å; E359-Y361 PolarHBondContact O-N 2.62Å; Y361-S364 PolarHBondContact O-N 2.03Å; Y361-S364 PolarHBondContact O-OG 3.49Å; Y361-Y366 AromaticContact CD1-CD1 3.83Å; Y361-Y366 HydrophobicContact CD1-CD1 3.83Å; Y361-Y366 AromaticContact CE1-CD1 3.61Å; Y361-Y366 HydrophobicContact CE1-CD1 3.61Å; Y361-Y366 HydrophobicContact CE1-CG 4.26Å; Y361-Y366 WeakPolarHBondContact CE2-O 3.41Å; Y361-Y366 VanDerWaalsContact CZ-C 3.42Å; Y361-Y366 WeakPolarHBondContact O-CA 3.05Å; Y361-Y366 PolarHBondContact O-N 3.35Å; Y361-Y366 PolarHBondContact OH-O 3.34Å; Y361-S368 VanDerWaalsContact CA-O 3.31Å; Y361-S368 WeakPolarHBondContact CA-O 3.3Å; Y361-S368 PolarHBondContact N-O 2.9Å
362	R	97.3	Very high	96.9	Very high	139 Å²	139	75 Å²	75	53%	0.525	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-48.4	176.5	-172.7	175.6	69.6	137	2.9	112.1	M358 E359 L360 S364 G365	M358-R362 WeakPolarHBondContact O-CB 3.04Å; M358-R362 PolarHBondContact O-N 2.03Å; E359-R362 PolarHBondContact O-N 3.22Å; E359-R362 IonicContact OE1-CZ 3.04Å; E359-R362 IonicContact OE1-NE 2.71Å; E359-R362 IonicContact OE1-NH2 2.63Å; E359-R362 PolarHBondContact OE1-NH2 2.78Å; E359-R362 IonicContact OE2-CZ 3.19Å; E359-R362 IonicContact OE2-NE 3.16Å; E359-R362 PolarHBondContact OE2-NE 3Å; E359-R362 IonicContact OE2-NH2 3.2Å; E359-R362 PolarHBondContact OE2-NH2 3.06Å; L360-R362 PolarHBondContact O-N 2.96Å; R362-S364 PolarHBondContact O-N 3.1Å; R362-G365 PolarHBondContact O-N 3.41Å
363	M	96.7	Very high	97	Very high	133 Å²	133	68.6 Å²	68.6	66%	0.655	32%	0.322	S	S	*	.	H	α-helix	trans	-63.1	-27.9	178.7	-72.3	-170.8	-63.5	0	0	113.2	E359 L360 G365	E359-M363 HydrophobicContact CG-CE 4.14Å; E359-M363 WeakPolarHBondContact O-CB 3.18Å; E359-M363 WeakPolarHBondContact O-CG 3.36Å; E359-M363 PolarHBondContact O-N 3.24Å; L360-M363 PolarHBondContact O-N 2.94Å; M363-G365 PolarHBondContact O-N 2.02Å
364	S	95.2	Very high	96.9	Very high	41 Å²	41	66.3 Å²	66.3	29%	0.287	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.3	175.4	78.9	0	0	0	0	114.3	L360 Y361 R362 K367 S368	L360-S364 WeakPolarHBondContact O-CB 3.37Å; L360-S364 PolarHBondContact O-N 3.47Å; Y361-S364 PolarHBondContact O-N 2.03Å; Y361-S364 PolarHBondContact O-OG 3.49Å; R362-S364 PolarHBondContact O-N 3.1Å; S364-K367 PolarHBondContact OG-N 2.95Å; S364-S368 WeakPolarHBondContact CB-O 3.07Å; S364-S368 PolarHBondContact OG-N 3.22Å; S364-S368 PolarHBondContact OG-O 3.19Å
365	G	95.5	Very high	97	Very high	47 Å²	47	67.7 Å²	67.7	49%	0.485	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	40.9	-170.8	0	0	0	0	0	112.5	R362 M363 K367	R362-G365 PolarHBondContact O-N 3.41Å; M363-G365 PolarHBondContact O-N 2.02Å; G365-K367 VanDerWaalsContact C-N 3.33Å; G365-K367 PolarHBondContact O-N 2.93Å
366	Y	94.4	Very high	97	Very high	146 Å²	146	67.5 Å²	67.5	57%	0.573	33%	0.331	S	S	*	.	S	Bend	trans	62	34.7	-179.6	-52.3	-81.1	0	0	0	113.9	Y361	Y361-Y366 AromaticContact CD1-CD1 3.83Å; Y361-Y366 HydrophobicContact CD1-CD1 3.83Å; Y361-Y366 AromaticContact CE1-CD1 3.61Å; Y361-Y366 HydrophobicContact CE1-CD1 3.61Å; Y361-Y366 HydrophobicContact CE1-CG 4.26Å; Y361-Y366 WeakPolarHBondContact CE2-O 3.41Å; Y361-Y366 VanDerWaalsContact CZ-C 3.42Å; Y361-Y366 WeakPolarHBondContact O-CA 3.05Å; Y361-Y366 PolarHBondContact O-N 3.35Å; Y361-Y366 PolarHBondContact OH-O 3.34Å
367	K	94.4	Very high	97	Very high	141 Å²	141	67.5 Å²	67.5	61%	0.613	33%	0.332	S	S	*	.	S	Bend	trans	-105	-48	-178.5	-66.4	-175.5	-179.6	-179	0	113.8	R329 S364 G365	R329-K367 PolarHBondContact NE-O 3.34Å; R329-K367 PolarHBondContact NH2-O 3.04Å; S364-K367 PolarHBondContact OG-N 2.95Å; G365-K367 VanDerWaalsContact C-N 3.33Å; G365-K367 PolarHBondContact O-N 2.93Å
368	S	96.6	Very high	97	Very high	29 Å²	29	68.4 Å²	68.4	20%	0.203	34%	0.337	C	S	.	.			trans	-149.1	129.5	-173.5	169	0	0	0	0	111.3	D328 L360 Y361 S364	D328-S368 PolarHBondContact OD1-OG 3.27Å; D328-S368 WeakPolarHBondContact OD2-CB 3Å; D328-S368 PolarHBondContact OD2-OG 2.83Å; L360-S368 CarbonylContact C-O 3.55Å; Y361-S368 VanDerWaalsContact CA-O 3.31Å; Y361-S368 WeakPolarHBondContact CA-O 3.3Å; Y361-S368 PolarHBondContact N-O 2.9Å; S364-S368 WeakPolarHBondContact CB-O 3.07Å; S364-S368 PolarHBondContact OG-N 3.22Å; S364-S368 PolarHBondContact OG-O 3.19Å
369	G	97.1	Very high	97	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.311	C	S	.	.			trans	-132.6	8.8	-179.3	0	0	0	0	0	113.6	D328 F356 N357	D328-G369 WeakPolarHBondContact O-CA 2.96Å; D328-G369 PolarHBondContact O-N 2.88Å; D328-G369 PolarHBondContact OD1-N 2.88Å; F356-G369 CarbonylContact C-O 3.6Å; N357-G369 PolarHBondContact N-O 2.62Å
370	G	97.8	Very high	97	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.7	-179.5	0	0	0	0	0	112.5	D328 L360	D328-G370 WeakPolarHBondContact OD1-CA 3.38Å; D328-G370 PolarHBondContact OD1-N 2.84Å; L360-G370 WeakPolarHBondContact CD2-O 3.16Å
371	M	98	Very high	97	Very high	47 Å²	47	59.7 Å²	59.7	23%	0.232	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	117.9	173.4	179.4	-177.3	-87.8	0	0	110.2	C354 R355 V382	C354-M371 CarbonylContact C-O 3.58Å; C354-M371 WeakPolarHBondContact CA-O 3.36Å; C354-M371 VanDerWaalsContact CB-O 3.23Å; C354-M371 WeakPolarHBondContact CB-O 2.99Å; R355-M371 HydrophobicContact CG-CB 4.3Å; R355-M371 PolarHBondContact N-O 3.08Å; R355-M371 PolarHBondContact NH2-SD 3.03Å; R355-M371 PolarHBondContact O-N 2.86Å; M371-V382 HydrophobicContact CE-CG1 3.84Å
372	C	98.5	Very high	97	Very high	12 Å²	12	60.5 Å²	60.5	8%	0.081	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	143.7	179.9	-56.9	0	0	0	0	112.1	C347 A351 V382 C384	C347-C372 WeakPolarHBondContact CA-SG 3.35Å; C347-C372 HydrophobicContact CB-CB 3.88Å; C347-C372 WeakPolarHBondContact CB-SG 3.26Å; C347-C372 WeakPolarHBondContact SG-CB 3.19Å; C347-C372 CovalentContact SG-SG 2.02Å; C347-C372 PolarHBondContact SG-SG 3.07Å; A351-C372 HydrophobicContact CB-CB 4.01Å; C372-V382 VanDerWaalsContact CB-O 3.26Å; C372-V382 WeakPolarHBondContact CB-O 3.4Å; C372-V382 PolarHBondContact N-O 2.83Å; C372-V382 PolarHBondContact SG-O 2.9Å; C372-C384 VanDerWaalsContact CB-SG 3.54Å
373	I	98.2	Very high	97	Very high	50 Å²	50	55.9 Å²	55.9	26%	0.256	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	135.3	-178.6	-58.9	170	0	0	0	108.8	A351 R353 R355	A351-I373 WeakPolarHBondContact CB-O 3.44Å; R353-I373 HydrophobicContact CB-CB 4.34Å; R353-I373 PolarHBondContact O-N 2.94Å; R355-I373 HydrophobicContact CB-CD1 3.98Å; R355-I373 HydrophobicContact CG-CD1 3.99Å; R355-I373 HydrophobicContact CG-CG1 4.42Å
374	N	97.7	Very high	97.1	Very high	124 Å²	124	49.6 Å²	49.6	66%	0.663	27%	0.266	S	S	*	.	S	Bend	trans	57.3	58.8	179.8	-59.9	-25.5	0	0	0	112.6	R376	N374-R376 PolarHBondContact O-N 3.12Å
375	C	98.3	Very high	97.1	Very high	38 Å²	38	50.9 Å²	50.9	26%	0.257	27%	0.27	S	S	.	.			trans	-52.6	127.4	173	-66.4	0	0	0	0	111	T379 C384	C375-T379 VanDerWaalsContact CB-O 3.22Å; C375-T379 WeakPolarHBondContact CB-O 3.47Å; C375-C384 VanDerWaalsContact CA-SG 3.52Å; C375-C384 HydrophobicContact CB-CB 3.81Å; C375-C384 WeakPolarHBondContact CB-SG 3.24Å; C375-C384 VanDerWaalsContact SG-CA 3.5Å; C375-C384 WeakPolarHBondContact SG-CB 3.43Å; C375-C384 CovalentContact SG-SG 2.04Å; C375-C384 PolarHBondContact SG-SG 2.8Å
376	R	98.1	Very high	97.2	Very high	116 Å²	116	54 Å²	54	44%	0.438	27%	0.268	S	S	.	.			trans	-98.2	-174.4	179	-58.7	179.2	-178.3	166.1	-3	109.9	H350 N374 N378 T379	H350-R376 WeakPolarHBondContact O-CA 3.05Å; H350-R376 WeakPolarHBondContact O-CB 3.49Å; H350-R376 WeakPolarHBondContact O-CG 3.33Å; H350-R376 PolarHBondContact O-N 3.3Å; N374-R376 PolarHBondContact O-N 3.12Å; R376-N378 PolarHBondContact O-N 3.07Å; R376-T379 PolarHBondContact O-N 3.11Å; R376-T379 PolarHBondContact O-OG1 3.33Å
377	H	98.2	Very high	97.3	Very high	51 Å²	51	47 Å²	47	24%	0.236	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	27.8	174.2	-48.1	133.6	0	0	0	113.7	L349 H350 T379 R402	L349-H377 PolarHBondContact O-CE1 3.5Å; H350-H377 AromaticContact CE1-ND1 3.52Å; H350-H377 AromaticContact CG-ND1 3.62Å; H350-H377 AromaticContact ND1-CE1 3.81Å; H350-H377 AromaticContact ND1-CG 3.83Å; H350-H377 AromaticContact ND1-ND1 2.89Å; H350-H377 PolarHBondContact ND1-ND1 3.09Å; H377-T379 VanDerWaalsContact C-N 3.26Å; H377-T379 PolarHBondContact O-N 2.84Å; H377-R402 WeakPolarHBondContact CB-O 3.49Å
378	N	97.4	Very high	97.3	Very high	52 Å²	52	44.3 Å²	44.3	28%	0.278	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	34.1	-178.2	-51.8	-55.5	0	0	0	114.3	R376 K388 F391 C405	R376-N378 PolarHBondContact O-N 3.07Å; N378-K388 HydrophobicContact CB-CD 4.22Å; N378-K388 HydrophobicContact CB-CG 4.23Å; N378-K388 WeakPolarHBondContact O-CG 3.39Å; N378-K388 PolarHBondContact O-N 2.9Å; N378-K388 WeakPolarHBondContact OD1-CE 3.31Å; N378-K388 PolarHBondContact OD1-NZ 2.81Å; N378-F391 HydrophobicContact CB-CB 4.33Å; N378-F391 HydrophobicContact CB-CD1 3.4Å; N378-F391 VanDerWaalsContact CB-CD1 3.4Å; N378-F391 HydrophobicContact CB-CD2 3.85Å; N378-F391 HydrophobicContact CB-CE1 3.58Å; N378-F391 HydrophobicContact CB-CE2 4Å; N378-F391 HydrophobicContact CB-CG 3.58Å; N378-F391 HydrophobicContact CB-CZ 3.88Å; N378-F391 WeakPolarHBondContact ND2-CE1 3.38Å; N378-F391 VanDerWaalsContact OD1-CZ 3.3Å; N378-F391 WeakPolarHBondContact OD1-CZ 3.47Å; N378-C405 HydrophobicContact CB-CB 4.12Å
379	T	98.1	Very high	97.2	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.031	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	162.7	175.3	61.1	0	0	0	0	111.9	H350 C375 R376 H377 C384 Y386	H350-T379 WeakPolarHBondContact CB-OG1 3.49Å; H350-T379 WeakPolarHBondContact CD2-CG2 3.49Å; H350-T379 PolarHBondContact CD2-OG1 2.78Å; H350-T379 WeakPolarHBondContact NE2-CG2 3.37Å; C375-T379 VanDerWaalsContact CB-O 3.22Å; C375-T379 WeakPolarHBondContact CB-O 3.47Å; R376-T379 PolarHBondContact O-N 3.11Å; R376-T379 PolarHBondContact O-OG1 3.33Å; H377-T379 VanDerWaalsContact C-N 3.26Å; H377-T379 PolarHBondContact O-N 2.84Å; T379-C384 WeakPolarHBondContact OG1-CB 3.3Å; T379-Y386 CarbonylContact C-O 3.27Å; T379-Y386 WeakPolarHBondContact CA-O 3.15Å; T379-Y386 WeakPolarHBondContact CB-O 3.29Å
380	A	96.9	Very high	97.1	Very high	22 Å²	22	50.4 Å²	50.4	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	169.3	-179.6	0	0	0	0	0	109.8	C384 D385 Y386 K388	A380-C384 CarbonylContact O-C 3.59Å; A380-C384 VanDerWaalsContact O-CA 3.31Å; A380-C384 WeakPolarHBondContact O-CA 3.49Å; A380-D385 PolarHBondContact O-N 3.16Å; A380-D385 VanDerWaalsContact O-N 3.11Å; A380-Y386 HydrophobicContact CB-CD2 4.14Å; A380-Y386 HydrophobicContact CB-CE2 3.58Å; A380-Y386 PolarHBondContact N-O 3.19Å; A380-Y386 WeakPolarHBondContact O-CD1 3.4Å; A380-Y386 PolarHBondContact O-N 3.29Å; A380-K388 HydrophobicContact CB-CB 3.89Å
381	G	96.3	Very high	97.1	Very high	24 Å²	24	52.1 Å²	52.1	25%	0.247	27%	0.265	C	S	.	.	S	Bend	trans	104.8	170.6	-177.8	0	0	0	0	0	114	H383 C384	G381-H383 PolarHBondContact O-N 2.75Å; G381-C384 PolarHBondContact O-N 2.87Å
382	V	96.3	Very high	97	Very high	53 Å²	53	52.7 Å²	52.7	32%	0.321	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.9	-179.2	-63	0	0	0	0	112.3	M371 C372	M371-V382 HydrophobicContact CE-CG1 3.84Å; C372-V382 VanDerWaalsContact CB-O 3.26Å; C372-V382 WeakPolarHBondContact CB-O 3.4Å; C372-V382 PolarHBondContact N-O 2.83Å; C372-V382 PolarHBondContact SG-O 2.9Å
383	H	97.3	Very high	96.9	Very high	42 Å²	42	55 Å²	55	19%	0.194	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	10.8	177.7	-59.8	125	0	0	0	112.9	N346 C347 N348 G381 D385	N346-H383 WeakPolarHBondContact O-CA 3.26Å; N346-H383 VanDerWaalsContact O-CB 3.31Å; N346-H383 WeakPolarHBondContact O-CB 3.45Å; N346-H383 PolarHBondContact O-CD2 3.15Å; C347-H383 CarbonylContact C-O 3.58Å; C347-H383 VanDerWaalsContact C-O 3.27Å; C347-H383 WeakPolarHBondContact CA-O 3.34Å; N348-H383 PolarHBondContact ND2-O 2.89Å; G381-H383 PolarHBondContact O-N 2.75Å; H383-D385 HydrophobicContact CB-CB 4.08Å; H383-D385 PolarHBondContact O-N 2.92Å
384	C	98	Very high	96.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	53.4	43	-171.1	-51.5	0	0	0	0	112.3	H350 C372 C375 T379 A380 G381	H350-C384 HydrophobicContact CB-CB 3.65Å; H350-C384 PolarHBondContact CD2-O 2.79Å; C372-C384 VanDerWaalsContact CB-SG 3.54Å; C375-C384 VanDerWaalsContact CA-SG 3.52Å; C375-C384 HydrophobicContact CB-CB 3.81Å; C375-C384 WeakPolarHBondContact CB-SG 3.24Å; C375-C384 VanDerWaalsContact SG-CA 3.5Å; C375-C384 WeakPolarHBondContact SG-CB 3.43Å; C375-C384 CovalentContact SG-SG 2.04Å; C375-C384 PolarHBondContact SG-SG 2.8Å; T379-C384 WeakPolarHBondContact OG1-CB 3.3Å; A380-C384 CarbonylContact O-C 3.59Å; A380-C384 VanDerWaalsContact O-CA 3.31Å; A380-C384 WeakPolarHBondContact O-CA 3.49Å; G381-C384 PolarHBondContact O-N 2.87Å
385	D	96.4	Very high	96.6	Very high	69 Å²	69	57.1 Å²	57.1	37%	0.369	27%	0.27	S	S	.	.			trans	-104.7	2.6	-164.5	59.5	-38.1	0	0	0	114.3	A380 H383 M399	A380-D385 PolarHBondContact O-N 3.16Å; A380-D385 VanDerWaalsContact O-N 3.11Å; H383-D385 HydrophobicContact CB-CB 4.08Å; H383-D385 PolarHBondContact O-N 2.92Å; D385-M399 WeakPolarHBondContact O-CE 3.47Å
386	Y	96.2	Very high	96.5	Very high	111 Å²	111	64.7 Å²	64.7	44%	0.435	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	167.2	169.6	62.4	-89.5	0	0	0	111.3	T379 A380	T379-Y386 CarbonylContact C-O 3.27Å; T379-Y386 WeakPolarHBondContact CA-O 3.15Å; T379-Y386 WeakPolarHBondContact CB-O 3.29Å; A380-Y386 HydrophobicContact CB-CD2 4.14Å; A380-Y386 HydrophobicContact CB-CE2 3.58Å; A380-Y386 PolarHBondContact N-O 3.19Å; A380-Y386 WeakPolarHBondContact O-CD1 3.4Å; A380-Y386 PolarHBondContact O-N 3.29Å
387	C	96.8	Very high	96.4	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.007	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	136.2	-178.1	-60.4	0	0	0	0	111.1	F391 Y392 C405 Q422	C387-F391 HydrophobicContact CB-CB 4.01Å; C387-Y392 VanDerWaalsContact SG-C 3.52Å; C387-C405 WeakPolarHBondContact CA-SG 3.23Å; C387-C405 HydrophobicContact CB-CB 3.78Å; C387-C405 WeakPolarHBondContact CB-SG 3.39Å; C387-C405 WeakPolarHBondContact SG-CA 3.33Å; C387-C405 WeakPolarHBondContact SG-CB 3.48Å; C387-C405 CovalentContact SG-SG 2.04Å; C387-C405 PolarHBondContact SG-SG 3.27Å; C387-Q422 PolarHBondContact O-NE2 2.71Å; C387-Q422 PolarHBondContact O-OE1 2.74Å
388	K	95.5	Very high	96.3	Very high	84 Å²	84	62.1 Å²	62.1	37%	0.365	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-65	163	174.3	78	-177.1	-179.9	-175	0	110.6	N378 A380 G390 F391	N378-K388 HydrophobicContact CB-CD 4.22Å; N378-K388 HydrophobicContact CB-CG 4.23Å; N378-K388 WeakPolarHBondContact O-CG 3.39Å; N378-K388 PolarHBondContact O-N 2.9Å; N378-K388 WeakPolarHBondContact OD1-CE 3.31Å; N378-K388 PolarHBondContact OD1-NZ 2.81Å; A380-K388 HydrophobicContact CB-CB 3.89Å; K388-G390 PolarHBondContact O-N 3.2Å; K388-F391 HydrophobicContact CD-CD2 4.3Å; K388-F391 HydrophobicContact CD-CE2 4.34Å; K388-F391 HydrophobicContact CG-CD2 3.64Å; K388-F391 HydrophobicContact CG-CE2 4.16Å; K388-F391 HydrophobicContact CG-CG 4.44Å; K388-F391 WeakPolarHBondContact O-CB 3.3Å; K388-F391 PolarHBondContact O-N 3.21Å; K388-F391 VanDerWaalsContact O-N 3.08Å
389	E	93.5	Very high	96.2	Very high	140 Å²	140	61.4 Å²	61.4	65%	0.654	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	137	177.8	-62.4	-178.7	169.3	0	0	112.5	F391 Y419	E389-F391 VanDerWaalsContact C-N 3.33Å; E389-Y419 HydrophobicContact CB-CD1 3.92Å; E389-Y419 HydrophobicContact CB-CE1 3.89Å
390	G	95.4	Very high	96.2	Very high	16 Å²	16	64.2 Å²	64.2	17%	0.165	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	2.9	-174.9	0	0	0	0	0	114.6	K388 C408	K388-G390 PolarHBondContact O-N 3.2Å; G390-C408 PolarHBondContact O-N 2.75Å; G390-C408 PolarHBondContact O-SG 2.9Å
391	F	97.2	Very high	96.2	Very high	37 Å²	37	67 Å²	67	16%	0.162	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	152.6	175.2	-63.8	-101.5	0	0	0	111.3	N378 C387 K388 E389 C405 K406 P407	N378-F391 HydrophobicContact CB-CB 4.33Å; N378-F391 HydrophobicContact CB-CD1 3.4Å; N378-F391 VanDerWaalsContact CB-CD1 3.4Å; N378-F391 HydrophobicContact CB-CD2 3.85Å; N378-F391 HydrophobicContact CB-CE1 3.58Å; N378-F391 HydrophobicContact CB-CE2 4Å; N378-F391 HydrophobicContact CB-CG 3.58Å; N378-F391 HydrophobicContact CB-CZ 3.88Å; N378-F391 WeakPolarHBondContact ND2-CE1 3.38Å; N378-F391 VanDerWaalsContact OD1-CZ 3.3Å; N378-F391 WeakPolarHBondContact OD1-CZ 3.47Å; C387-F391 HydrophobicContact CB-CB 4.01Å; K388-F391 HydrophobicContact CD-CD2 4.3Å; K388-F391 HydrophobicContact CD-CE2 4.34Å; K388-F391 HydrophobicContact CG-CD2 3.64Å; K388-F391 HydrophobicContact CG-CE2 4.16Å; K388-F391 HydrophobicContact CG-CG 4.44Å; K388-F391 WeakPolarHBondContact O-CB 3.3Å; K388-F391 PolarHBondContact O-N 3.21Å; K388-F391 VanDerWaalsContact O-N 3.08Å; E389-F391 VanDerWaalsContact C-N 3.33Å; F391-C405 HydrophobicContact CB-CB 4.16Å; F391-K406 CarbonylContact C-O 3.03Å; F391-K406 WeakPolarHBondContact CA-O 3.35Å; F391-K406 WeakPolarHBondContact CB-O 3.33Å; F391-K406 VanDerWaalsContact CD1-C 3.5Å; F391-P407 HydrophobicContact CD1-CB 4.17Å; F391-P407 HydrophobicContact CE1-CB 3.85Å; F391-P407 HydrophobicContact CZ-CB 4.46Å
392	Y	96.1	Very high	96.3	Very high	60 Å²	60	74.7 Å²	74.7	24%	0.235	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	157.8	177.1	74.3	-86	0	0	0	111.7	C387 C405 K406 P407 Q422 A425	C387-Y392 VanDerWaalsContact SG-C 3.52Å; Y392-C405 WeakPolarHBondContact O-CA 3.47Å; Y392-K406 HydrophobicContact CD1-CB 4.13Å; Y392-K406 VanDerWaalsContact CD1-O 3.22Å; Y392-K406 WeakPolarHBondContact CD1-O 3.48Å; Y392-K406 HydrophobicContact CE1-CB 3.55Å; Y392-K406 HydrophobicContact CE2-CB 4.26Å; Y392-K406 PolarHBondContact N-O 3.23Å; Y392-K406 PolarHBondContact O-N 3.17Å; Y392-P407 WeakPolarHBondContact CE1-O 3.48Å; Y392-Q422 CarbonylContact C-O 3.58Å; Y392-Q422 WeakPolarHBondContact CA-O 3.35Å; Y392-Q422 WeakPolarHBondContact CB-O 3.42Å; Y392-A425 HydrophobicContact CD1-CB 3.74Å; Y392-A425 HydrophobicContact CD2-CB 3.58Å; Y392-A425 HydrophobicContact CE1-CB 3.88Å; Y392-A425 HydrophobicContact CE2-CB 3.71Å; Y392-A425 HydrophobicContact CG-CB 3.58Å
393	R	96.4	Very high	96.3	Very high	59 Å²	59	79.2 Å²	79.2	22%	0.223	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.7	-173.9	179.8	65.9	179.8	95.7	10.3	111.7	R395 L397 M399 A404 Q422	R393-R395 HydrophobicContact CG-CG 4.34Å; R393-R395 PolarHBondContact O-N 2.86Å; R393-L397 PolarHBondContact NH1-O 3.36Å; R393-L397 PolarHBondContact NH2-O 2.91Å; R393-M399 VanDerWaalsContact NE-CE 3.26Å; R393-A404 PolarHBondContact NH1-O 2.85Å; R393-Q422 WeakPolarHBondContact CB-O 3.21Å; R393-Q422 PolarHBondContact N-O 3.24Å
394	D	95.9	Very high	96.3	Very high	20 Å²	20	77.2 Å²	77.2	11%	0.107	35%	0.352	C	S	.	.			trans	-82.4	91.6	170.2	-172.9	-8.5	0	0	0	111.4	K396 L397 A404 K406	D394-K396 PolarHBondContact O-N 2.69Å; D394-K396 WeakPolarHBondContact OD1-CB 3.43Å; D394-K396 PolarHBondContact OD1-N 3.28Å; D394-K396 VanDerWaalsContact OD1-N 3.14Å; D394-L397 HydrophobicContact CB-CD1 4.36Å; D394-L397 PolarHBondContact O-N 3.05Å; D394-A404 PolarHBondContact N-O 2.98Å; D394-K406 HydrophobicContact CB-CD 4.13Å; D394-K406 HydrophobicContact CB-CG 4.42Å; D394-K406 WeakPolarHBondContact OD2-CE 3.47Å; D394-K406 IonicContact OD2-NZ 3.58Å; D394-K406 PolarHBondContact OD2-NZ 3.25Å
395	R	94.3	Very high	96.3	Very high	200 Å²	200	77.5 Å²	77.5	76%	0.755	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-12.5	-175.9	-60.4	-174.1	77.7	167.9	3.8	114.8	R393 L397	R393-R395 HydrophobicContact CG-CG 4.34Å; R393-R395 PolarHBondContact O-N 2.86Å; R395-L397 VanDerWaalsContact C-N 3.31Å
396	K	95.7	Very high	96.3	Very high	197 Å²	197	78.1 Å²	78.1	86%	0.857	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-19.7	175	-59.1	-177.2	179.4	-174.9	0	113.3	D394	D394-K396 PolarHBondContact O-N 2.69Å; D394-K396 WeakPolarHBondContact OD1-CB 3.43Å; D394-K396 PolarHBondContact OD1-N 3.28Å; D394-K396 VanDerWaalsContact OD1-N 3.14Å
397	L	96	Very high	96.3	Very high	50 Å²	50	75.6 Å²	75.6	26%	0.262	35%	0.351	S	S	.	.	S	Bend	trans	-108.2	145.8	-177.8	-61.1	172	0	0	0	110.1	R393 D394 R395 H401 K403	R393-L397 PolarHBondContact NH1-O 3.36Å; R393-L397 PolarHBondContact NH2-O 2.91Å; D394-L397 HydrophobicContact CB-CD1 4.36Å; D394-L397 PolarHBondContact O-N 3.05Å; R395-L397 VanDerWaalsContact C-N 3.31Å; L397-H401 HydrophobicContact CB-CB 4.18Å; L397-K403 HydrophobicContact CD1-CB 4.13Å; L397-K403 WeakPolarHBondContact CD1-O 3.49Å
398	A	96.4	Very high	96.3	Very high	62 Å²	62	75.9 Å²	75.9	51%	0.512	35%	0.353	S	S	.	.			trans	-62.1	152.5	170.9	0	0	0	0	0	111.2	T400 H401	A398-T400 PolarHBondContact O-N 3.26Å; A398-H401 VanDerWaalsContact O-CB 3.26Å; A398-H401 WeakPolarHBondContact O-CB 3.48Å; A398-H401 PolarHBondContact O-N 3.09Å
399	M	95.5	Very high	96.3	Very high	38 Å²	38	77.5 Å²	77.5	19%	0.187	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-33	177.7	-176.5	57	68.3	0	0	111.6	N348 H350 D385 R393 H401 A404	N348-M399 HydrophobicContact CB-CG 4.16Å; H350-M399 PolarHBondContact CE1-O 2.82Å; H350-M399 PolarHBondContact NE2-O 3.11Å; D385-M399 WeakPolarHBondContact O-CE 3.47Å; R393-M399 VanDerWaalsContact NE-CE 3.26Å; M399-H401 PolarHBondContact O-N 3.3Å; M399-H401 VanDerWaalsContact O-N 3.13Å; M399-A404 HydrophobicContact SD-CB 4.41Å
400	T	97.3	Very high	96.5	Very high	64 Å²	64	71.7 Å²	71.7	39%	0.393	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.3	178.8	52.3	0	0	0	0	114.7	N348 A398	N348-T400 HydrophobicContact CB-CG2 4.39Å; N348-T400 WeakPolarHBondContact O-CA 3.2Å; A398-T400 PolarHBondContact O-N 3.26Å
401	H	98	Very high	96.5	Very high	80 Å²	80	74.3 Å²	74.3	37%	0.37	35%	0.348	S	S	.	.	S	Bend	trans	-75.7	137.9	-175.6	-170.5	-92.3	0	0	0	112.1	H350 L397 A398 M399 K403 A404	H350-H401 PolarHBondContact CE1-O 3.42Å; L397-H401 HydrophobicContact CB-CB 4.18Å; A398-H401 VanDerWaalsContact O-CB 3.26Å; A398-H401 WeakPolarHBondContact O-CB 3.48Å; A398-H401 PolarHBondContact O-N 3.09Å; M399-H401 PolarHBondContact O-N 3.3Å; M399-H401 VanDerWaalsContact O-N 3.13Å; H401-K403 PolarHBondContact ND1-N 3.05Å; H401-K403 PolarHBondContact O-N 3.3Å; H401-A404 VanDerWaalsContact O-CB 3.24Å; H401-A404 WeakPolarHBondContact O-CB 3.14Å; H401-A404 PolarHBondContact O-N 3.39Å
402	R	97.5	Very high	96.5	Very high	186 Å²	186	78.2 Å²	78.2	70%	0.702	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-15.4	-177.8	-56.5	-169.3	-175.7	175.8	3.1	115.4	H377	H377-R402 WeakPolarHBondContact CB-O 3.49Å
403	K	97.6	Very high	96.4	Very high	147 Å²	147	77.9 Å²	77.9	64%	0.639	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	18.4	177.7	-56.8	-178.5	178.7	176.4	0	113	L397 H401 C405	L397-K403 HydrophobicContact CD1-CB 4.13Å; L397-K403 WeakPolarHBondContact CD1-O 3.49Å; H401-K403 PolarHBondContact ND1-N 3.05Å; H401-K403 PolarHBondContact O-N 3.3Å; K403-C405 PolarHBondContact O-N 3.43Å; K403-C405 VanDerWaalsContact O-N 3.14Å
404	A	96.8	Very high	96.3	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	37%	0.371	C	S	.	.	S	Bend	trans	-58.4	-24.2	179.7	0	0	0	0	0	113.3	R393 D394 M399 H401	R393-A404 PolarHBondContact NH1-O 2.85Å; D394-A404 PolarHBondContact N-O 2.98Å; M399-A404 HydrophobicContact SD-CB 4.41Å; H401-A404 VanDerWaalsContact O-CB 3.24Å; H401-A404 WeakPolarHBondContact O-CB 3.14Å; H401-A404 PolarHBondContact O-N 3.39Å
405	C	97.6	Very high	96.3	Very high	7 Å²	7	74.5 Å²	74.5	5%	0.047	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.8	177.4	-65.3	0	0	0	0	111.8	N378 C387 F391 Y392 K403	N378-C405 HydrophobicContact CB-CB 4.12Å; C387-C405 WeakPolarHBondContact CA-SG 3.23Å; C387-C405 HydrophobicContact CB-CB 3.78Å; C387-C405 WeakPolarHBondContact CB-SG 3.39Å; C387-C405 WeakPolarHBondContact SG-CA 3.33Å; C387-C405 WeakPolarHBondContact SG-CB 3.48Å; C387-C405 CovalentContact SG-SG 2.04Å; C387-C405 PolarHBondContact SG-SG 3.27Å; F391-C405 HydrophobicContact CB-CB 4.16Å; Y392-C405 WeakPolarHBondContact O-CA 3.47Å; K403-C405 PolarHBondContact O-N 3.43Å; K403-C405 VanDerWaalsContact O-N 3.14Å
406	K	96.6	Very high	96.3	Very high	82 Å²	82	70.6 Å²	70.6	36%	0.357	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	144.6	-179.9	-76.3	179.9	171	168.9	0	111.1	F391 Y392 D394	F391-K406 CarbonylContact C-O 3.03Å; F391-K406 WeakPolarHBondContact CA-O 3.35Å; F391-K406 WeakPolarHBondContact CB-O 3.33Å; F391-K406 VanDerWaalsContact CD1-C 3.5Å; Y392-K406 HydrophobicContact CD1-CB 4.13Å; Y392-K406 VanDerWaalsContact CD1-O 3.22Å; Y392-K406 WeakPolarHBondContact CD1-O 3.48Å; Y392-K406 HydrophobicContact CE1-CB 3.55Å; Y392-K406 HydrophobicContact CE2-CB 4.26Å; Y392-K406 PolarHBondContact N-O 3.23Å; Y392-K406 PolarHBondContact O-N 3.17Å; D394-K406 HydrophobicContact CB-CD 4.13Å; D394-K406 HydrophobicContact CB-CG 4.42Å; D394-K406 WeakPolarHBondContact OD2-CE 3.47Å; D394-K406 IonicContact OD2-NZ 3.58Å; D394-K406 PolarHBondContact OD2-NZ 3.25Å
407	P	96.8	Very high	96.2	Very high	58 Å²	58	63.2 Å²	63.2	38%	0.377	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	143	179	29	-34.9	0	0	0	110.8	F391 Y392 N409	F391-P407 HydrophobicContact CD1-CB 4.17Å; F391-P407 HydrophobicContact CE1-CB 3.85Å; F391-P407 HydrophobicContact CZ-CB 4.46Å; Y392-P407 WeakPolarHBondContact CE1-O 3.48Å; P407-N409 VanDerWaalsContact C-N 3.31Å; P407-N409 PolarHBondContact O-N 3Å
408	C	96.3	Very high	96	Very high	6 Å²	6	69 Å²	69	4%	0.041	36%	0.359	C	S	.	.			trans	-64.4	-32.4	179.9	-67.3	0	0	0	0	113.7	G390 C410 C420	G390-C408 PolarHBondContact O-N 2.75Å; G390-C408 PolarHBondContact O-SG 2.9Å; C408-C410 PolarHBondContact O-N 2.87Å; C408-C420 HydrophobicContact CB-CB 3.54Å; C408-C420 WeakPolarHBondContact CB-SG 3.46Å; C408-C420 WeakPolarHBondContact SG-CB 3.34Å; C408-C420 PolarHBondContact SG-N 3.1Å; C408-C420 CovalentContact SG-SG 2.02Å; C408-C420 PolarHBondContact SG-SG 2.94Å
409	N	95.8	Very high	95.8	Very high	119 Å²	119	72.3 Å²	72.3	64%	0.636	36%	0.359	S	S	*	.			trans	52	37.6	-175.7	-62.5	-22.3	0	0	0	114.1	P407 H411 T437	P407-N409 VanDerWaalsContact C-N 3.31Å; P407-N409 PolarHBondContact O-N 3Å; N409-H411 PolarHBondContact O-N 3.44Å; N409-T437 HydrophobicContact CB-CG2 4.33Å; N409-T437 WeakPolarHBondContact O-CB 3.32Å; N409-T437 WeakPolarHBondContact O-CG2 3.06Å
410	C	97.1	Very high	95.8	Very high	18 Å²	18	71.2 Å²	71.2	12%	0.122	36%	0.355	C	S	.	.			trans	-60.5	132.7	176	-56.5	0	0	0	0	111.1	C408 A415 S417 C427	C408-C410 PolarHBondContact O-N 2.87Å; C410-A415 HydrophobicContact CB-CB 3.74Å; C410-S417 WeakPolarHBondContact CB-O 3.46Å; C410-C427 WeakPolarHBondContact CA-SG 3Å; C410-C427 HydrophobicContact CB-CB 3.76Å; C410-C427 WeakPolarHBondContact CB-SG 3.19Å; C410-C427 WeakPolarHBondContact SG-CB 3.16Å; C410-C427 CovalentContact SG-SG 2.03Å; C410-C427 PolarHBondContact SG-SG 3.26Å
411	H	96.3	Very high	95.6	Very high	71 Å²	71	72 Å²	72	33%	0.329	36%	0.356	S	S	.	.			trans	-63	124.8	-176.9	-169.7	-97.3	0	0	0	110.2	N409 V413 G414 A415 T437 C438 N439	N409-H411 PolarHBondContact O-N 3.44Å; H411-V413 PolarHBondContact ND1-N 2.87Å; H411-V413 PolarHBondContact O-N 2.83Å; H411-V413 VanDerWaalsContact O-N 3.09Å; H411-G414 PolarHBondContact ND1-N 3.1Å; H411-G414 PolarHBondContact O-N 3.08Å; H411-G414 VanDerWaalsContact O-N 3.16Å; H411-A415 WeakPolarHBondContact O-CB 3.38Å; H411-A415 PolarHBondContact O-N 3.31Å; H411-T437 WeakPolarHBondContact CB-O 3.49Å; H411-T437 PolarHBondContact N-O 3.05Å; H411-C438 VanDerWaalsContact CB-O 3.23Å; H411-C438 WeakPolarHBondContact CB-O 3.39Å; H411-N439 HydrophobicContact CB-CB 4.49Å
412	P	95.3	Very high	95.2	Very high	118 Å²	118	71.5 Å²	71.5	77%	0.766	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.9	-169.4	23.7	-34.4	0	0	0	113.3
413	V	95.1	Very high	94.8	Very high	53 Å²	53	67.1 Å²	67.1	32%	0.321	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-34.3	177.8	-175.9	0	0	0	0	112	H411 K430 P451 P454	H411-V413 PolarHBondContact ND1-N 2.87Å; H411-V413 PolarHBondContact O-N 2.83Å; H411-V413 VanDerWaalsContact O-N 3.09Å; V413-K430 VanDerWaalsContact O-CD 3.29Å; V413-K430 WeakPolarHBondContact O-CD 3.46Å; V413-K430 VanDerWaalsContact O-CE 3.31Å; V413-K430 WeakPolarHBondContact O-CE 3.46Å; V413-K430 PolarHBondContact O-NZ 3.42Å; V413-P451 HydrophobicContact CG1-CB 4.32Å; V413-P454 HydrophobicContact CG1-CB 3.85Å; V413-P454 HydrophobicContact CG1-CG 4.21Å
414	G	94.8	Very high	94.5	Very high	2 Å²	2	64.3 Å²	64.3	2%	0.021	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-27.3	-168.3	0	0	0	0	0	113.6	H411 K430 C438	H411-G414 PolarHBondContact ND1-N 3.1Å; H411-G414 PolarHBondContact O-N 3.08Å; H411-G414 VanDerWaalsContact O-N 3.16Å; G414-K430 WeakPolarHBondContact O-CB 3.45Å; G414-K430 PolarHBondContact O-N 2.74Å; G414-C438 WeakPolarHBondContact CA-O 3.44Å
415	A	96	Very high	94.4	Very high	7 Å²	7	64.8 Å²	64.8	6%	0.058	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-89.5	156.3	175.9	0	0	0	0	0	112	C410 H411 S417 C427 P428 C438	C410-A415 HydrophobicContact CB-CB 3.74Å; H411-A415 WeakPolarHBondContact O-CB 3.38Å; H411-A415 PolarHBondContact O-N 3.31Å; A415-S417 WeakPolarHBondContact CB-O 3.37Å; A415-C427 HydrophobicContact CB-CB 4.37Å; A415-P428 CarbonylContact C-O 3.57Å; A415-P428 WeakPolarHBondContact CA-O 3.26Å; A415-C438 HydrophobicContact CB-CB 4.08Å
416	L	94.3	Very high	94.2	Very high	117 Å²	117	68.2 Å²	68.2	61%	0.613	36%	0.363	S	S	*	.	S	Bend	trans	-82.3	-25.1	173.9	-69.3	168.7	0	0	0	112.4	P428 K430	L416-P428 HydrophobicContact CB-CB 4.29Å; L416-P428 HydrophobicContact CB-CG 4.28Å; L416-P428 HydrophobicContact CD1-CB 4.39Å; L416-P428 PolarHBondContact N-O 3.17Å; L416-K430 HydrophobicContact CD2-CG 3.62Å; L416-K430 HydrophobicContact CG-CG 4Å
417	S	92.9	Very high	94.2	Very high	42 Å²	42	64.4 Å²	64.4	29%	0.294	35%	0.346	S	S	.	.			trans	-148.6	168.2	178.3	80.3	0	0	0	0	110.9	C410 A415 Y419 P428	C410-S417 WeakPolarHBondContact CB-O 3.46Å; A415-S417 WeakPolarHBondContact CB-O 3.37Å; S417-Y419 PolarHBondContact OG-N 3.15Å; S417-Y419 PolarHBondContact OG-O 2.86Å; S417-P428 WeakPolarHBondContact OG-CG 3.29Å
418	K	91.2	Very high	94.1	Very high	173 Å²	173	64 Å²	64	75%	0.752	34%	0.344	S	S	*	.	S	Bend	trans	-81	-3.9	172.5	-63.3	-178.1	-179.4	178.9	0	112.8
419	Y	93.3	Very high	94.1	Very high	131 Å²	131	65.4 Å²	65.4	51%	0.514	35%	0.353	S	S	.	.			trans	-97	131.5	-175.4	-47	-54	0	0	0	109.5	E389 S417 P428	E389-Y419 HydrophobicContact CB-CD1 3.92Å; E389-Y419 HydrophobicContact CB-CE1 3.89Å; S417-Y419 PolarHBondContact OG-N 3.15Å; S417-Y419 PolarHBondContact OG-O 2.86Å; Y419-P428 WeakPolarHBondContact O-CD 3.3Å
420	C	94.8	Very high	94	Very high	15 Å²	15	61.6 Å²	61.6	10%	0.101	33%	0.331	C	S	.	.			trans	-110.6	166.6	171.5	68.6	0	0	0	0	110.6	C408 Q422 A425 Q426	C408-C420 HydrophobicContact CB-CB 3.54Å; C408-C420 WeakPolarHBondContact CB-SG 3.46Å; C408-C420 WeakPolarHBondContact SG-CB 3.34Å; C408-C420 PolarHBondContact SG-N 3.1Å; C408-C420 CovalentContact SG-SG 2.02Å; C408-C420 PolarHBondContact SG-SG 2.94Å; C420-Q422 PolarHBondContact O-N 2.86Å; C420-A425 WeakPolarHBondContact CB-O 3.45Å; C420-Q426 WeakPolarHBondContact CA-O 3.4Å; C420-Q426 WeakPolarHBondContact CB-O 3.32Å
421	N	92.5	Very high	93.9	Very high	79 Å²	79	66 Å²	66	42%	0.422	36%	0.36	S	S	.	.			trans	-59.9	121.5	169.2	-177.7	-49.4	0	0	0	109.9	T423 T424 A425 Q426	N421-T423 PolarHBondContact O-N 2.85Å; N421-T423 VanDerWaalsContact O-N 3.11Å; N421-T423 WeakPolarHBondContact OD1-CB 3.46Å; N421-T423 PolarHBondContact OD1-N 2.98Å; N421-T424 VanDerWaalsContact CB-OG1 3.24Å; N421-T424 WeakPolarHBondContact CB-OG1 3.26Å; N421-T424 PolarHBondContact O-N 2.96Å; N421-T424 PolarHBondContact OD1-N 2.79Å; N421-T424 VanDerWaalsContact OD1-N 3.07Å; N421-T424 PolarHBondContact OD1-OG1 2.88Å; N421-A425 WeakPolarHBondContact O-CA 3.39Å; N421-A425 PolarHBondContact O-N 3.11Å; N421-Q426 PolarHBondContact N-O 3.05Å
422	Q	89.6	Confident	93.7	Very high	71 Å²	71	63.1 Å²	63.1	33%	0.332	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.3	-174.3	-63.2	-173.6	-0.8	0	0	113.8	C387 Y392 R393 C420	C387-Q422 PolarHBondContact O-NE2 2.71Å; C387-Q422 PolarHBondContact O-OE1 2.74Å; Y392-Q422 CarbonylContact C-O 3.58Å; Y392-Q422 WeakPolarHBondContact CA-O 3.35Å; Y392-Q422 WeakPolarHBondContact CB-O 3.42Å; R393-Q422 WeakPolarHBondContact CB-O 3.21Å; R393-Q422 PolarHBondContact N-O 3.24Å; C420-Q422 PolarHBondContact O-N 2.86Å
423	T	89.6	Confident	93.8	Very high	94 Å²	94	58.3 Å²	58.3	58%	0.577	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-40.5	-180	-52.7	0	0	0	0	112.2	N421	N421-T423 PolarHBondContact O-N 2.85Å; N421-T423 VanDerWaalsContact O-N 3.11Å; N421-T423 WeakPolarHBondContact OD1-CB 3.46Å; N421-T423 PolarHBondContact OD1-N 2.98Å
424	T	91.7	Very high	93.8	Very high	87 Å²	87	58.6 Å²	58.6	53%	0.534	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-8.5	-173.5	66.2	0	0	0	0	114.4	N421 Q426	N421-T424 VanDerWaalsContact CB-OG1 3.24Å; N421-T424 WeakPolarHBondContact CB-OG1 3.26Å; N421-T424 PolarHBondContact O-N 2.96Å; N421-T424 PolarHBondContact OD1-N 2.79Å; N421-T424 VanDerWaalsContact OD1-N 3.07Å; N421-T424 PolarHBondContact OD1-OG1 2.88Å; T424-Q426 PolarHBondContact O-N 3.13Å; T424-Q426 WeakPolarHBondContact OG1-CB 3.4Å; T424-Q426 PolarHBondContact OG1-N 3.05Å
425	A	94	Very high	93.7	Very high	10 Å²	10	59.3 Å²	59.3	8%	0.083	33%	0.327	C	S	.	.			trans	64.4	2.7	-171.4	0	0	0	0	0	115.5	Y392 C420 N421 C427 V436	Y392-A425 HydrophobicContact CD1-CB 3.74Å; Y392-A425 HydrophobicContact CD2-CB 3.58Å; Y392-A425 HydrophobicContact CE1-CB 3.88Å; Y392-A425 HydrophobicContact CE2-CB 3.71Å; Y392-A425 HydrophobicContact CG-CB 3.58Å; C420-A425 WeakPolarHBondContact CB-O 3.45Å; N421-A425 WeakPolarHBondContact O-CA 3.39Å; N421-A425 PolarHBondContact O-N 3.11Å; A425-C427 PolarHBondContact O-N 2.87Å; A425-V436 HydrophobicContact CB-CG1 4.04Å; A425-V436 VanDerWaalsContact O-CG1 3.31Å; A425-V436 WeakPolarHBondContact O-CG1 3.2Å
426	Q	95.2	Very high	93.6	Very high	79 Å²	79	62.7 Å²	62.7	37%	0.369	35%	0.347	S	S	.	.			trans	-71.2	122.2	-176	-176.6	59.8	53.9	0	0	111.8	C420 N421 T424 G435 V436	C420-Q426 WeakPolarHBondContact CA-O 3.4Å; C420-Q426 WeakPolarHBondContact CB-O 3.32Å; N421-Q426 PolarHBondContact N-O 3.05Å; T424-Q426 PolarHBondContact O-N 3.13Å; T424-Q426 WeakPolarHBondContact OG1-CB 3.4Å; T424-Q426 PolarHBondContact OG1-N 3.05Å; Q426-G435 PolarHBondContact NE2-O 3.11Å; Q426-V436 PolarHBondContact NE2-O 2.8Å
427	C	95.9	Very high	93.7	Very high	2 Å²	2	59 Å²	59	1%	0.014	33%	0.329	C	S	.	.			trans	-79.9	147.6	171.3	-63.2	0	0	0	0	111.3	C410 A415 A425 C429 V436 C438	C410-C427 WeakPolarHBondContact CA-SG 3Å; C410-C427 HydrophobicContact CB-CB 3.76Å; C410-C427 WeakPolarHBondContact CB-SG 3.19Å; C410-C427 WeakPolarHBondContact SG-CB 3.16Å; C410-C427 CovalentContact SG-SG 2.03Å; C410-C427 PolarHBondContact SG-SG 3.26Å; A415-C427 HydrophobicContact CB-CB 4.37Å; A425-C427 PolarHBondContact O-N 2.87Å; C427-C429 PolarHBondContact O-N 2.8Å; C427-V436 WeakPolarHBondContact CB-O 3.23Å; C427-V436 PolarHBondContact N-O 2.91Å; C427-V436 PolarHBondContact SG-O 2.9Å; C427-C438 VanDerWaalsContact CB-SG 3.57Å; C427-C438 PolarHBondContact O-SG 2.84Å
428	P	94.5	Very high	93.9	Very high	50 Å²	50	57 Å²	57	33%	0.325	32%	0.315	S	S	.	.			trans	-74.2	108.4	174.1	29.4	-32.8	0	0	0	109.8	A415 L416 S417 Y419	A415-P428 CarbonylContact C-O 3.57Å; A415-P428 WeakPolarHBondContact CA-O 3.26Å; L416-P428 HydrophobicContact CB-CB 4.29Å; L416-P428 HydrophobicContact CB-CG 4.28Å; L416-P428 HydrophobicContact CD1-CB 4.39Å; L416-P428 PolarHBondContact N-O 3.17Å; S417-P428 WeakPolarHBondContact OG-CG 3.29Å; Y419-P428 WeakPolarHBondContact O-CD 3.3Å
429	C	95.9	Very high	94.1	Very high	35 Å²	35	53 Å²	53	24%	0.236	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-84.4	146.9	-175.5	-56.2	0	0	0	0	113	C427 V433 C438	C427-C429 PolarHBondContact O-N 2.8Å; C429-V433 HydrophobicContact CB-CB 4.15Å; C429-V433 HydrophobicContact CB-CG1 4.39Å; C429-C438 WeakPolarHBondContact CA-SG 3.27Å; C429-C438 HydrophobicContact CB-CB 3.76Å; C429-C438 WeakPolarHBondContact CB-SG 3.46Å; C429-C438 PolarHBondContact N-SG 3Å; C429-C438 VanDerWaalsContact N-SG 3.4Å; C429-C438 VanDerWaalsContact SG-CA 3.53Å; C429-C438 WeakPolarHBondContact SG-CB 3.13Å; C429-C438 CovalentContact SG-SG 2.04Å; C429-C438 PolarHBondContact SG-SG 3.17Å
430	K	94.4	Very high	94.2	Very high	39 Å²	39	52 Å²	52	17%	0.17	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-65.9	157.9	168.6	-74.6	-179.7	-176.7	166.3	0	110.6	V413 G414 L416 G432 V433 P451 P454	V413-K430 VanDerWaalsContact O-CD 3.29Å; V413-K430 WeakPolarHBondContact O-CD 3.46Å; V413-K430 VanDerWaalsContact O-CE 3.31Å; V413-K430 WeakPolarHBondContact O-CE 3.46Å; V413-K430 PolarHBondContact O-NZ 3.42Å; G414-K430 WeakPolarHBondContact O-CB 3.45Å; G414-K430 PolarHBondContact O-N 2.74Å; L416-K430 HydrophobicContact CD2-CG 3.62Å; L416-K430 HydrophobicContact CG-CG 4Å; K430-G432 PolarHBondContact O-N 3.16Å; K430-V433 HydrophobicContact CB-CG2 3.99Å; K430-V433 WeakPolarHBondContact O-CB 3.44Å; K430-V433 PolarHBondContact O-N 3.2Å; K430-P451 PolarHBondContact NZ-O 2.83Å; K430-P454 HydrophobicContact CD-CG 4.25Å
431	P	94	Very high	94.2	Very high	111 Å²	111	53 Å²	53	72%	0.721	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	134.8	177.3	-26.5	35.2	0	0	0	112.5	V433	P431-V433 PolarHBondContact O-N 2.8Å
432	G	93.7	Very high	94.3	Very high	11 Å²	11	50.4 Å²	50.4	11%	0.113	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	-3.7	-178.7	0	0	0	0	0	115.4	K430 A442 Y445 C455	K430-G432 PolarHBondContact O-N 3.16Å; G432-A442 WeakPolarHBondContact O-CB 3.49Å; G432-A442 PolarHBondContact O-N 3.08Å; G432-Y445 VanDerWaalsContact CA-CD1 3.49Å; G432-Y445 VanDerWaalsContact CA-CE1 3.46Å; G432-C455 VanDerWaalsContact O-CB 3.3Å; G432-C455 WeakPolarHBondContact O-CB 3.45Å
433	V	96.8	Very high	94.5	Very high	16 Å²	16	57.2 Å²	57.2	10%	0.097	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	145.3	176.7	-171.7	0	0	0	0	109.7	C429 K430 P431 C438 Q440 P454 C455	C429-V433 HydrophobicContact CB-CB 4.15Å; C429-V433 HydrophobicContact CB-CG1 4.39Å; K430-V433 HydrophobicContact CB-CG2 3.99Å; K430-V433 WeakPolarHBondContact O-CB 3.44Å; K430-V433 PolarHBondContact O-N 3.2Å; P431-V433 PolarHBondContact O-N 2.8Å; V433-C438 HydrophobicContact CG1-CB 3.75Å; V433-C438 WeakPolarHBondContact CG1-O 3.34Å; V433-Q440 WeakPolarHBondContact CG1-O 3.24Å; V433-P454 HydrophobicContact CG2-CG 3.76Å; V433-C455 HydrophobicContact CG2-CB 4.13Å
434	T	94.4	Very high	94.6	Very high	59 Å²	59	54.2 Å²	54.2	36%	0.362	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	178.9	178.7	-164.9	0	0	0	0	112	C438 N439 Q440 A442	T434-C438 CarbonylContact O-C 3.49Å; T434-C438 WeakPolarHBondContact O-CA 3.3Å; T434-N439 PolarHBondContact O-N 2.76Å; T434-Q440 HydrophobicContact CG2-CG 3.69Å; T434-Q440 PolarHBondContact N-O 3.21Å; T434-Q440 PolarHBondContact O-N 2.85Å; T434-A442 HydrophobicContact CG2-CB 4.15Å
435	G	94.1	Very high	94.7	Very high	18 Å²	18	54 Å²	54	19%	0.186	30%	0.304	C	S	.	.	S	Bend	trans	96.3	159.7	-175	0	0	0	0	0	112.9	Q426 T437 C438	Q426-G435 PolarHBondContact NE2-O 3.11Å; G435-T437 PolarHBondContact O-N 3.21Å; G435-C438 PolarHBondContact O-N 2.95Å; G435-C438 VanDerWaalsContact O-N 3.13Å
436	V	94	Very high	94.6	Very high	77 Å²	77	58.2 Å²	58.2	47%	0.467	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-38.9	-179	178.9	0	0	0	0	111.2	A425 Q426 C427	A425-V436 HydrophobicContact CB-CG1 4.04Å; A425-V436 VanDerWaalsContact O-CG1 3.31Å; A425-V436 WeakPolarHBondContact O-CG1 3.2Å; Q426-V436 PolarHBondContact NE2-O 2.8Å; C427-V436 WeakPolarHBondContact CB-O 3.23Å; C427-V436 PolarHBondContact N-O 2.91Å; C427-V436 PolarHBondContact SG-O 2.9Å
437	T	96.1	Very high	94.5	Very high	39 Å²	39	62.4 Å²	62.4	24%	0.239	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	4.4	178.5	56.3	0	0	0	0	113.5	N409 H411 G435 N439	N409-T437 HydrophobicContact CB-CG2 4.33Å; N409-T437 WeakPolarHBondContact O-CB 3.32Å; N409-T437 WeakPolarHBondContact O-CG2 3.06Å; H411-T437 WeakPolarHBondContact CB-O 3.49Å; H411-T437 PolarHBondContact N-O 3.05Å; G435-T437 PolarHBondContact O-N 3.21Å; T437-N439 PolarHBondContact O-N 3.19Å; T437-N439 PolarHBondContact OG1-OD1 2.86Å
438	C	96.8	Very high	94.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.352	C	S	.	.	S	Bend	trans	59.2	40.2	-176.4	-47.3	0	0	0	0	114	H411 G414 A415 C427 C429 V433 T434 G435	H411-C438 VanDerWaalsContact CB-O 3.23Å; H411-C438 WeakPolarHBondContact CB-O 3.39Å; G414-C438 WeakPolarHBondContact CA-O 3.44Å; A415-C438 HydrophobicContact CB-CB 4.08Å; C427-C438 VanDerWaalsContact CB-SG 3.57Å; C427-C438 PolarHBondContact O-SG 2.84Å; C429-C438 WeakPolarHBondContact CA-SG 3.27Å; C429-C438 HydrophobicContact CB-CB 3.76Å; C429-C438 WeakPolarHBondContact CB-SG 3.46Å; C429-C438 PolarHBondContact N-SG 3Å; C429-C438 VanDerWaalsContact N-SG 3.4Å; C429-C438 VanDerWaalsContact SG-CA 3.53Å; C429-C438 WeakPolarHBondContact SG-CB 3.13Å; C429-C438 CovalentContact SG-SG 2.04Å; C429-C438 PolarHBondContact SG-SG 3.17Å; V433-C438 HydrophobicContact CG1-CB 3.75Å; V433-C438 WeakPolarHBondContact CG1-O 3.34Å; T434-C438 CarbonylContact O-C 3.49Å; T434-C438 WeakPolarHBondContact O-CA 3.3Å; G435-C438 PolarHBondContact O-N 2.95Å; G435-C438 VanDerWaalsContact O-N 3.13Å
439	N	95.8	Very high	94.2	Very high	90 Å²	90	73.7 Å²	73.7	48%	0.481	38%	0.383	S	S	.	.			trans	-97.2	-2	-172.7	66.9	-46.9	0	0	0	114.6	H411 T434 T437	H411-N439 HydrophobicContact CB-CB 4.49Å; T434-N439 PolarHBondContact O-N 2.76Å; T437-N439 PolarHBondContact O-N 3.19Å; T437-N439 PolarHBondContact OG1-OD1 2.86Å
440	Q	95.1	Very high	93.9	Very high	111 Å²	111	74.3 Å²	74.3	52%	0.519	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	152.3	-176.7	64.9	-173.9	25.3	0	0	111.9	V433 T434	V433-Q440 WeakPolarHBondContact CG1-O 3.24Å; T434-Q440 HydrophobicContact CG2-CG 3.69Å; T434-Q440 PolarHBondContact N-O 3.21Å; T434-Q440 PolarHBondContact O-N 2.85Å
441	C	95.4	Very high	93.7	Very high	35 Å²	35	76.5 Å²	76.5	24%	0.236	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	140.9	171.8	-63.4	0	0	0	0	110.5	Y445 C455	C441-Y445 WeakPolarHBondContact CB-O 3.5Å; C441-C455 WeakPolarHBondContact CA-SG 2.98Å; C441-C455 HydrophobicContact CB-CB 3.79Å; C441-C455 WeakPolarHBondContact CB-SG 3.39Å; C441-C455 WeakPolarHBondContact SG-CB 3.48Å; C441-C455 CovalentContact SG-SG 2.04Å; C441-C455 PolarHBondContact SG-SG 3.23Å
442	A	94.1	Very high	93.6	Very high	24 Å²	24	76.9 Å²	76.9	20%	0.198	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-61.6	156	171.7	0	0	0	0	0	110.2	G432 T434 G444 Y445	G432-A442 WeakPolarHBondContact O-CB 3.49Å; G432-A442 PolarHBondContact O-N 3.08Å; T434-A442 HydrophobicContact CG2-CB 4.15Å; A442-G444 PolarHBondContact O-N 3.37Å; A442-Y445 HydrophobicContact CB-CD2 3.99Å; A442-Y445 HydrophobicContact CB-CE2 4.47Å; A442-Y445 WeakPolarHBondContact O-CB 3.22Å; A442-Y445 PolarHBondContact O-N 3.29Å
443	K	92.5	Very high	93.5	Very high	215 Å²	215	78.5 Å²	78.5	94%	0.935	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	131.3	174.9	-172.7	176.5	179.3	178.7	0	110.1
444	G	91.6	Very high	93.4	Very high	30 Å²	30	78.3 Å²	78.3	31%	0.309	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	5.8	-175.2	0	0	0	0	0	114.9	A442 I458	A442-G444 PolarHBondContact O-N 3.37Å; G444-I458 PolarHBondContact O-N 3.15Å
445	Y	94.6	Very high	93.5	Very high	82 Å²	82	76.1 Å²	76.1	32%	0.322	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.4	171.4	-67.5	-106.8	0	0	0	110.3	G432 C441 A442 C455 V456 K457	G432-Y445 VanDerWaalsContact CA-CD1 3.49Å; G432-Y445 VanDerWaalsContact CA-CE1 3.46Å; C441-Y445 WeakPolarHBondContact CB-O 3.5Å; A442-Y445 HydrophobicContact CB-CD2 3.99Å; A442-Y445 HydrophobicContact CB-CE2 4.47Å; A442-Y445 WeakPolarHBondContact O-CB 3.22Å; A442-Y445 PolarHBondContact O-N 3.29Å; Y445-C455 HydrophobicContact CD1-CB 4.33Å; Y445-V456 CarbonylContact C-O 3.55Å; Y445-V456 WeakPolarHBondContact CA-O 3.05Å; Y445-V456 VanDerWaalsContact CD1-C 3.46Å; Y445-K457 HydrophobicContact CD1-CB 4.26Å; Y445-K457 HydrophobicContact CE1-CB 4.04Å
446	Q	92.1	Very high	93.4	Very high	99 Å²	99	78.1 Å²	78.1	46%	0.463	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	152.8	174	63.7	-177.4	9.5	0	0	110.8	C455 V456 I458	Q446-C455 WeakPolarHBondContact O-CA 3.49Å; Q446-V456 HydrophobicContact CG-CG2 3.84Å; Q446-V456 PolarHBondContact N-O 3.16Å; Q446-V456 PolarHBondContact O-N 2.93Å; Q446-I458 HydrophobicContact CB-CD1 4.37Å; Q446-I458 HydrophobicContact CB-CG1 3.88Å; Q446-I458 HydrophobicContact CG-CG1 4.03Å
447	Q	93.4	Very high	93.2	Very high	168 Å²	168	79.6 Å²	79.6	79%	0.785	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	133.7	179.7	-168.2	173.6	33.8	0	0	110.5	P454	Q447-P454 CarbonylContact C-O 3.49Å; Q447-P454 WeakPolarHBondContact CA-O 3.34Å
448	S	91.9	Very high	92.8	Very high	33 Å²	33	81.2 Å²	81.2	23%	0.231	42%	0.419	C	S	.	.			trans	-109	165.2	175	101.7	0	0	0	0	110.5	S450 A453 P454	S448-S450 VanDerWaalsContact C-N 3.25Å; S448-S450 PolarHBondContact O-N 3.41Å; S448-S450 WeakPolarHBondContact OG-CB 3.43Å; S448-S450 PolarHBondContact OG-N 2.99Å; S448-A453 PolarHBondContact OG-O 3.18Å; S448-P454 PolarHBondContact N-O 3.18Å
449	R	91.4	Very high	91.8	Very high	256 Å²	256	86.5 Å²	86.5	97%	0.966	45%	0.453	S	S	*	.	S	Bend	trans	-79.8	-2.6	173.2	-65.1	-170.1	-71.6	-174	-2.5	113.6	P451	R449-P451 WeakPolarHBondContact O-CD 3.41Å
450	S	89.9	Confident	90.4	Very high	47 Å²	47	88.7 Å²	88.7	33%	0.329	46%	0.461	S	S	.	.			trans	-87.5	122.8	-176.4	178.6	0	0	0	0	111.7	S448 V452 A453 P454	S448-S450 VanDerWaalsContact C-N 3.25Å; S448-S450 PolarHBondContact O-N 3.41Å; S448-S450 WeakPolarHBondContact OG-CB 3.43Å; S448-S450 PolarHBondContact OG-N 2.99Å; S450-V452 PolarHBondContact O-N 3.28Å; S450-V452 PolarHBondContact OG-N 3.03Å; S450-A453 CarbonylContact O-C 3.09Å; S450-A453 VanDerWaalsContact O-C 3.28Å; S450-A453 PolarHBondContact O-N 2.96Å; S450-A453 PolarHBondContact OG-N 2.03Å; S450-P454 VanDerWaalsContact O-CA 3.24Å; S450-P454 WeakPolarHBondContact O-CA 3.19Å; S450-P454 VanDerWaalsContact O-N 3.16Å
451	P	90.2	Very high	88.2	Confident	86 Å²	86	89 Å²	89	56%	0.558	47%	0.47	S	S	*	.	S	Bend	trans	-64.7	-24	171.3	-21.5	33.3	0	0	0	113.5	V413 K430 R449	V413-P451 HydrophobicContact CG1-CB 4.32Å; K430-P451 PolarHBondContact NZ-O 2.83Å; R449-P451 WeakPolarHBondContact O-CD 3.41Å
452	V	91.6	Very high	85.6	Confident	119 Å²	119	93.2 Å²	93.2	72%	0.721	50%	0.497	S	S	*	.	S	Bend	trans	-77.4	-42.6	-179.9	179.6	0	0	0	0	110.8	S450	S450-V452 PolarHBondContact O-N 3.28Å; S450-V452 PolarHBondContact OG-N 3.03Å
453	A	92.4	Very high	83.1	Confident	45 Å²	45	97.9 Å²	97.9	37%	0.372	52%	0.523	S	S	.	.	S	Bend	trans	-127.6	73.4	179.6	0	0	0	0	0	110.4	S448 S450 C455	S448-A453 PolarHBondContact OG-O 3.18Å; S450-A453 CarbonylContact O-C 3.09Å; S450-A453 VanDerWaalsContact O-C 3.28Å; S450-A453 PolarHBondContact O-N 2.96Å; S450-A453 PolarHBondContact OG-N 2.03Å; A453-C455 PolarHBondContact O-N 3.17Å
454	P	94.7	Very high	80.5	Confident	12 Å²	12	93.7 Å²	93.7	8%	0.078	52%	0.515	C	S	.	.	S	Bend	trans	-67.5	-17.8	-171.9	26.1	-35.4	0	0	0	114.3	V413 K430 V433 Q447 S448 S450	V413-P454 HydrophobicContact CG1-CB 3.85Å; V413-P454 HydrophobicContact CG1-CG 4.21Å; K430-P454 HydrophobicContact CD-CG 4.25Å; V433-P454 HydrophobicContact CG2-CG 3.76Å; Q447-P454 CarbonylContact C-O 3.49Å; Q447-P454 WeakPolarHBondContact CA-O 3.34Å; S448-P454 PolarHBondContact N-O 3.18Å; S450-P454 VanDerWaalsContact O-CA 3.24Å; S450-P454 WeakPolarHBondContact O-CA 3.19Å; S450-P454 VanDerWaalsContact O-N 3.16Å
455	C	95.4	Very high	78.1	Confident	12 Å²	12	96.1 Å²	96.1	8%	0.081	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.6	176.8	-65.7	0	0	0	0	109.1	G432 V433 C441 Y445 Q446 A453	G432-C455 VanDerWaalsContact O-CB 3.3Å; G432-C455 WeakPolarHBondContact O-CB 3.45Å; V433-C455 HydrophobicContact CG2-CB 4.13Å; C441-C455 WeakPolarHBondContact CA-SG 2.98Å; C441-C455 HydrophobicContact CB-CB 3.79Å; C441-C455 WeakPolarHBondContact CB-SG 3.39Å; C441-C455 WeakPolarHBondContact SG-CB 3.48Å; C441-C455 CovalentContact SG-SG 2.04Å; C441-C455 PolarHBondContact SG-SG 3.23Å; Y445-C455 HydrophobicContact CD1-CB 4.33Å; Q446-C455 WeakPolarHBondContact O-CA 3.49Å; A453-C455 PolarHBondContact O-N 3.17Å
456	V	93.1	Very high	75.9	Confident	60 Å²	60	97.8 Å²	97.8	36%	0.364	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	144.7	177.2	-66.6	0	0	0	0	109.6	Y445 Q446 I458	Y445-V456 CarbonylContact C-O 3.55Å; Y445-V456 WeakPolarHBondContact CA-O 3.05Å; Y445-V456 VanDerWaalsContact CD1-C 3.46Å; Q446-V456 HydrophobicContact CG-CG2 3.84Å; Q446-V456 PolarHBondContact N-O 3.16Å; Q446-V456 PolarHBondContact O-N 2.93Å; V456-I458 PolarHBondContact O-N 3.3Å
457	K	90.1	Very high	73.6	Confident	109 Å²	109	99.4 Å²	99.4	47%	0.474	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	132.2	-179.4	-162	-171.3	178.9	-160.3	0	109.1	Y445 E460	Y445-K457 HydrophobicContact CD1-CB 4.26Å; Y445-K457 HydrophobicContact CE1-CB 4.04Å; K457-E460 WeakPolarHBondContact CE-OE1 3.44Å; K457-E460 IonicContact NZ-OE1 2.73Å; K457-E460 PolarHBondContact NZ-OE1 3.03Å; K457-E460 IonicContact NZ-OE2 3.9Å; K457-E460 PolarHBondContact NZ-OE2 2.96Å
458	I	86.7	Confident	71.3	Confident	72 Å²	72	96.3 Å²	96.3	37%	0.369	53%	0.533	S	S	.	.			trans	-64.4	131	171.2	-60	168.2	0	0	0	107.1	G444 Q446 V456 E460	G444-I458 PolarHBondContact O-N 3.15Å; Q446-I458 HydrophobicContact CB-CD1 4.37Å; Q446-I458 HydrophobicContact CB-CG1 3.88Å; Q446-I458 HydrophobicContact CG-CG1 4.03Å; V456-I458 PolarHBondContact O-N 3.3Å; I458-E460 PolarHBondContact O-N 3.32Å
459	P	76.7	Confident	69.5	Low	111 Å²	111	99.2 Å²	99.2	72%	0.721	55%	0.549	S	S	*	.			trans	-58.8	113.6	172.4	-19.2	30.7	0	0	0	109.2	T461	P459-T461 PolarHBondContact O-N 3.27Å
460	E	65.4	Low	67.8	Low	137 Å²	137	90.9 Å²	90.9	64%	0.64	54%	0.536	S	S	*	.			trans	-71	125.6	168	-73.6	157	-167.4	0	0	106.9	K457 I458	K457-E460 WeakPolarHBondContact CE-OE1 3.44Å; K457-E460 IonicContact NZ-OE1 2.73Å; K457-E460 PolarHBondContact NZ-OE1 3.03Å; K457-E460 IonicContact NZ-OE2 3.9Å; K457-E460 PolarHBondContact NZ-OE2 2.96Å; I458-E460 PolarHBondContact O-N 3.32Å
461	T	49.1	Very low	66.6	Low	118 Å²	118	97.3 Å²	97.3	72%	0.724	56%	0.558	S	S	*	*			trans	-53.5	142.5	156.9	43.9	0	0	0	0	107.4	P459 V463	P459-T461 PolarHBondContact O-N 3.27Å; T461-V463 VanDerWaalsContact C-N 3.33Å; T461-V463 PolarHBondContact O-N 3.23Å
462	P	41.6	Very low	65.6	Low	122 Å²	122	95.2 Å²	95.2	79%	0.792	54%	0.544	S	S	*	.			trans	-64.3	97.5	-172.2	25.5	-32	0	0	0	109.1	V464	P462-V464 PolarHBondContact O-N 2.81Å; P462-V464 VanDerWaalsContact O-N 3.09Å
463	V	40.8	Very low	64.5	Low	122 Å²	122	94.6 Å²	94.6	74%	0.739	54%	0.543	S	S	*	.			trans	-66.4	107.2	157.3	-179.9	0	0	0	0	104.2	T461 D465	T461-V463 VanDerWaalsContact C-N 3.33Å; T461-V463 PolarHBondContact O-N 3.23Å; V463-D465 PolarHBondContact O-N 2.81Å
464	V	38.2	Very low	63.4	Low	127 Å²	127	102.2 Å²	102.2	77%	0.77	57%	0.568	S	S	*	*			trans	-49.3	110.2	166.9	177.9	0	0	0	0	106.3	P462 P466	P462-V464 PolarHBondContact O-N 2.81Å; P462-V464 VanDerWaalsContact O-N 3.09Å; V464-P466 WeakPolarHBondContact O-CD 3.31Å; V464-P466 VanDerWaalsContact O-N 3.09Å
465	D	40.4	Very low	62.3	Low	82 Å²	82	104.3 Å²	104.3	44%	0.439	58%	0.582	S	S	.	*			trans	-56.7	110.9	175	-167.1	-11.7	0	0	0	106.8	V463 Y467 R543	V463-D465 PolarHBondContact O-N 2.81Å; D465-Y467 PolarHBondContact O-N 3.45Å; D465-Y467 VanDerWaalsContact O-N 3.08Å; D465-Y467 PolarHBondContact OD1-N 2.65Å; D465-R543 IonicContact OD2-NH2 3.7Å
466	P	48.7	Very low	61.1	Low	116 Å²	116	112 Å²	112	75%	0.753	61%	0.609	S	S	*	*			trans	-76.7	8.8	-176.5	32.3	-31.8	0	0	0	111.7	V464	V464-P466 WeakPolarHBondContact O-CD 3.31Å; V464-P466 VanDerWaalsContact O-N 3.09Å
467	Y	43.4	Very low	60	Low	133 Å²	133	113.2 Å²	113.2	52%	0.522	63%	0.626	S	S	.	*	S	Bend	trans	-92.1	106.7	169	-85.9	-88.2	0	0	0	110.8	D465 T469 Q541	D465-Y467 PolarHBondContact O-N 3.45Å; D465-Y467 VanDerWaalsContact O-N 3.08Å; D465-Y467 PolarHBondContact OD1-N 2.65Å; Y467-T469 VanDerWaalsContact C-N 3.32Å; Y467-T469 PolarHBondContact O-N 3.5Å; Y467-Q541 PolarHBondContact OH-NE2 2.88Å
468	D	46.5	Very low	58.9	Low	103 Å²	103	111.4 Å²	111.4	55%	0.551	62%	0.62	S	S	*	*			trans	-55.2	95.1	163.3	-175.6	10.6	0	0	0	110	A470 K471	D468-A470 PolarHBondContact O-N 3.36Å; D468-A470 WeakPolarHBondContact OD1-CB 3.07Å; D468-A470 PolarHBondContact OD1-N 3.08Å; D468-A470 VanDerWaalsContact OD1-N 3.07Å; D468-K471 PolarHBondContact O-N 3.22Å; D468-K471 VanDerWaalsContact O-N 3.12Å
469	T	52.8	Low	58.1	Low	94 Å²	94	109.4 Å²	109.4	58%	0.577	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-56.3	-10.5	173.8	27.1	0	0	0	0	113.2	Y467 K471 C472	Y467-T469 VanDerWaalsContact C-N 3.32Å; Y467-T469 PolarHBondContact O-N 3.5Å; T469-K471 VanDerWaalsContact C-N 3.27Å; T469-K471 PolarHBondContact O-N 3.27Å; T469-C472 PolarHBondContact O-N 3.36Å
470	A	56.8	Low	57.9	Low	82 Å²	82	112.7 Å²	112.7	68%	0.678	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-65.6	-25.8	173.8	0	0	0	0	0	113.3	D468	D468-A470 PolarHBondContact O-N 3.36Å; D468-A470 WeakPolarHBondContact OD1-CB 3.07Å; D468-A470 PolarHBondContact OD1-N 3.08Å; D468-A470 VanDerWaalsContact OD1-N 3.07Å
471	K	63.5	Low	58.5	Low	181 Å²	181	115.5 Å²	115.5	79%	0.787	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-89.4	-1.8	178	-73.4	-177.1	-178.6	175.5	0	114.7	D468 T469 P473	D468-K471 PolarHBondContact O-N 3.22Å; D468-K471 VanDerWaalsContact O-N 3.12Å; T469-K471 VanDerWaalsContact C-N 3.27Å; T469-K471 PolarHBondContact O-N 3.27Å; K471-P473 WeakPolarHBondContact O-CD 3.46Å
472	C	69.6	Low	60.3	Low	42 Å²	42	110.2 Å²	110.2	28%	0.284	59%	0.589	S	S	.	*	S	Bend	trans	-75	121.5	176.6	-88.4	0	0	0	0	110.9	T469 K474 C542	T469-C472 PolarHBondContact O-N 3.36Å; C472-K474 PolarHBondContact O-N 2.87Å; C472-C542 VanDerWaalsContact CA-SG 3.58Å; C472-C542 HydrophobicContact CB-CB 3.79Å; C472-C542 WeakPolarHBondContact CB-SG 3.5Å; C472-C542 WeakPolarHBondContact SG-CA 2.96Å; C472-C542 WeakPolarHBondContact SG-CB 3.49Å; C472-C542 CovalentContact SG-SG 2.05Å; C472-C542 PolarHBondContact SG-SG 3.24Å
473	P	68.5	Low	62.5	Low	106 Å²	106	108 Å²	108	69%	0.688	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-58.6	141.6	169.4	23.6	-30.6	0	0	0	109.2	K471 C475	K471-P473 WeakPolarHBondContact O-CD 3.46Å; P473-C475 PolarHBondContact O-N 3.28Å; P473-C475 VanDerWaalsContact O-N 3.13Å
474	K	69.5	Low	64.9	Low	206 Å²	206	103.4 Å²	103.4	90%	0.896	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-48.1	124.8	177.8	-70.2	-177.1	-179.9	176.8	0	109	C472 R476	C472-K474 PolarHBondContact O-N 2.87Å; K474-R476 PolarHBondContact O-N 2.64Å
475	C	71.6	Confident	67.4	Low	56 Å²	56	101.6 Å²	101.6	38%	0.378	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-48.9	134.1	174.3	-67.1	0	0	0	0	108.4	P473 A477 C544	P473-C475 PolarHBondContact O-N 3.28Å; P473-C475 VanDerWaalsContact O-N 3.13Å; C475-A477 PolarHBondContact O-N 2.98Å; C475-C544 WeakPolarHBondContact CA-SG 3.48Å; C475-C544 HydrophobicContact CB-CB 3.95Å; C475-C544 WeakPolarHBondContact CB-SG 3.33Å; C475-C544 WeakPolarHBondContact SG-CB 3.43Å; C475-C544 CovalentContact SG-SG 2.03Å; C475-C544 PolarHBondContact SG-SG 3.15Å
476	R	70.3	Confident	69.8	Low	172 Å²	172	100.8 Å²	100.8	65%	0.649	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-51	120	172.2	-176	-175.4	-177.1	179.4	11.3	108.3	K474 M478 K573	K474-R476 PolarHBondContact O-N 2.64Å; R476-M478 PolarHBondContact O-N 2.88Å; R476-K573 PolarHBondContact NH1-O 3.47Å
477	A	69.3	Low	71.8	Confident	86 Å²	86	95.3 Å²	95.3	71%	0.711	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-52.4	120.6	179.3	0	0	0	0	0	109.1	C475	C475-A477 PolarHBondContact O-N 2.98Å
478	M	68.3	Low	74.1	Confident	72 Å²	72	90.1 Å²	90.1	36%	0.355	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-60.7	125	171.5	-79.1	-169.7	-177.7	0	0	106.8	R476 Q480 P545 F577	R476-M478 PolarHBondContact O-N 2.88Å; M478-Q480 PolarHBondContact O-N 2.87Å; M478-P545 HydrophobicContact CE-CB 3.44Å; M478-P545 VanDerWaalsContact CE-CB 3.44Å; M478-F577 HydrophobicContact CE-CB 3.84Å; M478-F577 HydrophobicContact SD-CB 4.41Å
479	P	70.3	Confident	76.2	Confident	30 Å²	30	91.8 Å²	91.8	20%	0.195	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-72	132.4	-174.2	31	-35.5	0	0	0	109.7	R481 R486 V576 L578	P479-R481 VanDerWaalsContact C-N 3.34Å; P479-R481 PolarHBondContact O-N 2.79Å; P479-R486 VanDerWaalsContact CG-NH1 3.28Å; P479-V576 HydrophobicContact CG-CG1 3.81Å; P479-L578 HydrophobicContact CG-CD2 4.32Å; P479-L578 WeakPolarHBondContact O-CD2 3.24Å
480	Q	71.2	Confident	78	Confident	180 Å²	180	88.6 Å²	88.6	84%	0.841	44%	0.438	S	S	*	.	S	Bend	trans	-73.3	-20.8	-168.4	-67.7	-173	-9.1	0	0	115.1	M478	M478-Q480 PolarHBondContact O-N 2.87Å
481	R	78.9	Confident	79.6	Confident	195 Å²	195	87.1 Å²	87.1	74%	0.736	42%	0.417	S	S	*	.			trans	-131.8	136	-172.3	-65.7	-176.7	-179.9	-177.1	0.1	112.4	P479 R486	P479-R481 VanDerWaalsContact C-N 3.34Å; P479-R481 PolarHBondContact O-N 2.79Å; R481-R486 PolarHBondContact O-NH1 2.95Å
482	L	85.9	Confident	81	Confident	7 Å²	7	79 Å²	79	4%	0.037	38%	0.381	C	S	.	.			trans	-85.7	128.1	173.1	-178.3	68.5	0	0	0	110.6	L554 M556 L578 R587 L588 L591	L482-L554 HydrophobicContact CD1-CD2 4.01Å; L482-L554 HydrophobicContact CD2-CD2 3.76Å; L482-L554 HydrophobicContact CG-CD2 4.43Å; L482-M556 HydrophobicContact CD1-CE 3.4Å; L482-M556 VanDerWaalsContact CD1-CE 3.4Å; L482-M556 HydrophobicContact CD1-SD 3.62Å; L482-L578 HydrophobicContact CB-CD1 4Å; L482-R587 VanDerWaalsContact O-CZ 3.26Å; L482-R587 PolarHBondContact O-NE 3.17Å; L482-R587 PolarHBondContact O-NH2 3.41Å; L482-L588 HydrophobicContact CD2-CD2 3.56Å; L482-L588 HydrophobicContact CD2-CG 3.7Å; L482-L591 HydrophobicContact CD2-CD1 3.66Å; L482-L591 HydrophobicContact CG-CD1 3.58Å
483	N	88.8	Confident	82.2	Confident	77 Å²	77	77 Å²	77	41%	0.412	37%	0.368	S	S	.	.			trans	-133.8	164.8	175.1	62.5	14.4	0	0	0	110.6	K485 R486 L487	N483-K485 PolarHBondContact O-N 2.94Å; N483-R486 PolarHBondContact O-N 3.32Å; N483-R486 VanDerWaalsContact O-N 3.11Å; N483-R486 WeakPolarHBondContact OD1-CB 3.23Å; N483-R486 PolarHBondContact OD1-N 3.07Å; N483-L487 PolarHBondContact O-N 2.91Å
484	L	91.6	Very high	83.4	Confident	25 Å²	25	71.9 Å²	71.9	13%	0.131	34%	0.335	C	S	.	.	H	α-helix	trans	-55.9	-49.4	-176.6	-173.7	59.4	0	0	0	111.9	R486 L487 C488 L591 D594 E595 L599 F603	L484-R486 PolarHBondContact O-N 2.83Å; L484-R486 VanDerWaalsContact O-N 3.1Å; L484-L487 WeakPolarHBondContact O-CA 3.19Å; L484-L487 WeakPolarHBondContact O-CB 3.45Å; L484-L487 PolarHBondContact O-N 3.17Å; L484-C488 PolarHBondContact O-N 3.08Å; L484-C488 PolarHBondContact O-SG 3.47Å; L484-L591 HydrophobicContact CB-CD2 3.82Å; L484-L591 HydrophobicContact CD1-CB 4.36Å; L484-L591 HydrophobicContact CD1-CD2 4.23Å; L484-L591 WeakPolarHBondContact CD1-O 3.39Å; L484-D594 HydrophobicContact CD1-CB 3.69Å; L484-D594 HydrophobicContact CD2-CB 3.84Å; L484-D594 HydrophobicContact CG-CB 4.4Å; L484-E595 HydrophobicContact CD1-CB 4.31Å; L484-L599 HydrophobicContact CD2-CB 3.75Å; L484-F603 HydrophobicContact CB-CE2 4.27Å; L484-F603 HydrophobicContact CB-CZ 4.42Å; L484-F603 HydrophobicContact CD2-CE2 4.1Å; L484-F603 HydrophobicContact CD2-CZ 4.48Å; L484-F603 HydrophobicContact CG-CE2 3.93Å; L484-F603 HydrophobicContact CG-CZ 4.48Å
485	K	90.2	Very high	84.6	Confident	89 Å²	89	62.5 Å²	62.5	39%	0.387	29%	0.294	S	S	.	.	H	α-helix	trans	-49	-41.1	175.9	-172.6	169.3	-173.8	166.9	0	113.3	N483 R489 F603	N483-K485 PolarHBondContact O-N 2.94Å; K485-R489 VanDerWaalsContact CE-NH2 3.29Å; K485-R489 WeakPolarHBondContact O-CG 3.19Å; K485-R489 PolarHBondContact O-N 2.92Å; K485-F603 HydrophobicContact CB-CD1 3.81Å; K485-F603 HydrophobicContact CB-CD2 4.14Å; K485-F603 HydrophobicContact CB-CE1 3.64Å; K485-F603 HydrophobicContact CB-CE2 4.01Å; K485-F603 HydrophobicContact CB-CG 4.06Å; K485-F603 HydrophobicContact CB-CZ 3.74Å; K485-F603 HydrophobicContact CD-CD1 3.65Å; K485-F603 HydrophobicContact CD-CE1 3.97Å; K485-F603 HydrophobicContact CD-CG 4.32Å; K485-F603 HydrophobicContact CG-CB 4.32Å; K485-F603 HydrophobicContact CG-CD1 3.59Å; K485-F603 HydrophobicContact CG-CD2 4.32Å; K485-F603 HydrophobicContact CG-CE1 3.95Å; K485-F603 HydrophobicContact CG-CG 3.8Å; K485-F603 HydrophobicContact CG-CZ 4.46Å
486	R	89.5	Confident	85.8	Confident	65 Å²	65	59.9 Å²	59.9	25%	0.245	28%	0.276	C	S	.	.	H	α-helix	trans	-74.5	-36.9	179.4	-173.2	172.9	-69.3	136.4	2.2	112.3	P479 R481 N483 L484 R490 M556	P479-R486 VanDerWaalsContact CG-NH1 3.28Å; R481-R486 PolarHBondContact O-NH1 2.95Å; N483-R486 PolarHBondContact O-N 3.32Å; N483-R486 VanDerWaalsContact O-N 3.11Å; N483-R486 WeakPolarHBondContact OD1-CB 3.23Å; N483-R486 PolarHBondContact OD1-N 3.07Å; L484-R486 PolarHBondContact O-N 2.83Å; L484-R486 VanDerWaalsContact O-N 3.1Å; R486-R490 VanDerWaalsContact O-CG 3.31Å; R486-R490 WeakPolarHBondContact O-CG 3.25Å; R486-M556 HydrophobicContact CG-CE 4.22Å
487	L	92	Very high	87	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-47.3	174.6	-177.7	67.6	0	0	0	110.8	N483 L484 R489 R490 A493 K519 M556 L591 V592	N483-L487 PolarHBondContact O-N 2.91Å; L484-L487 WeakPolarHBondContact O-CA 3.19Å; L484-L487 WeakPolarHBondContact O-CB 3.45Å; L484-L487 PolarHBondContact O-N 3.17Å; L487-R489 VanDerWaalsContact C-N 3.29Å; L487-R489 PolarHBondContact O-N 2.99Å; L487-R490 PolarHBondContact O-N 2.85Å; L487-R490 VanDerWaalsContact O-N 3.11Å; L487-A493 HydrophobicContact CD1-CB 3.67Å; L487-K519 HydrophobicContact CD1-CB 4.48Å; L487-K519 HydrophobicContact CD1-CD 4.01Å; L487-K519 HydrophobicContact CG-CD 4.26Å; L487-K519 PolarHBondContact O-NZ 3.46Å; L487-M556 HydrophobicContact CD1-SD 4.03Å; L487-L591 VanDerWaalsContact CD2-C 3.48Å; L487-L591 HydrophobicContact CD2-CB 3.55Å; L487-V592 HydrophobicContact CD2-CG2 3.79Å
488	C	91.5	Very high	88.2	Confident	24 Å²	24	50.1 Å²	50.1	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-53.9	-42.7	178.7	-65.2	0	0	0	0	112.4	L484 R490 K519 C600 F603	L484-C488 PolarHBondContact O-N 3.08Å; L484-C488 PolarHBondContact O-SG 3.47Å; C488-R490 PolarHBondContact O-N 2.79Å; C488-K519 PolarHBondContact O-NZ 2.7Å; C488-C600 HydrophobicContact CB-CB 3.7Å; C488-C600 WeakPolarHBondContact CB-SG 3.41Å; C488-C600 WeakPolarHBondContact SG-CA 3.47Å; C488-C600 WeakPolarHBondContact SG-CB 3.11Å; C488-C600 CovalentContact SG-SG 2.03Å; C488-C600 PolarHBondContact SG-SG 3.26Å; C488-F603 HydrophobicContact CB-CD2 4.24Å
489	R	90.4	Very high	89.2	Confident	139 Å²	139	50.3 Å²	50.3	53%	0.525	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	12.7	-179.2	-69.1	179	176.2	-160.5	-4.6	115.3	K485 L487 L558	K485-R489 VanDerWaalsContact CE-NH2 3.29Å; K485-R489 WeakPolarHBondContact O-CG 3.19Å; K485-R489 PolarHBondContact O-N 2.92Å; L487-R489 VanDerWaalsContact C-N 3.29Å; L487-R489 PolarHBondContact O-N 2.99Å; R489-L558 WeakPolarHBondContact O-CD2 3.41Å
490	R	90.7	Very high	90.1	Very high	26 Å²	26	50.4 Å²	50.4	10%	0.098	23%	0.228	C	C	.	.			trans	-129.6	144.4	-177.1	-61.6	-65.4	176.5	-118.9	11.8	109.7	R486 L487 C488 K519 M556 G557 H574	R486-R490 VanDerWaalsContact O-CG 3.31Å; R486-R490 WeakPolarHBondContact O-CG 3.25Å; L487-R490 PolarHBondContact O-N 2.85Å; L487-R490 VanDerWaalsContact O-N 3.11Å; C488-R490 PolarHBondContact O-N 2.79Å; R490-K519 WeakPolarHBondContact O-CD 3.41Å; R490-K519 WeakPolarHBondContact O-CE 3.48Å; R490-K519 PolarHBondContact O-NZ 3.48Å; R490-M556 HydrophobicContact CB-CB 4.12Å; R490-M556 HydrophobicContact CG-CB 3.92Å; R490-G557 CarbonylContact C-O 3.54Å; R490-H574 WeakPolarHBondContact CD-O 3.3Å; R490-H574 PolarHBondContact NE-O 3.41Å; R490-H574 PolarHBondContact NH2-O 3.41Å
491	E	90.4	Very high	90.9	Very high	51 Å²	51	47.6 Å²	47.6	24%	0.238	21%	0.214	C	C	.	.	S	Bend	trans	-89.2	-20	-177.6	-62.7	-172.2	153.3	0	0	112.9	R520 K521 G557 L558 G559	E491-R520 CarbonylContact O-C 3.56Å; E491-R520 WeakPolarHBondContact O-CA 2.93Å; E491-K521 HydrophobicContact CB-CD 4.17Å; E491-K521 HydrophobicContact CB-CG 4.16Å; E491-K521 HydrophobicContact CG-CD 3.98Å; E491-K521 HydrophobicContact CG-CG 4.45Å; E491-K521 PolarHBondContact O-N 3.34Å; E491-K521 VanDerWaalsContact O-N 3.16Å; E491-K521 VanDerWaalsContact OE1-CE 3.27Å; E491-K521 WeakPolarHBondContact OE1-CE 3.47Å; E491-K521 IonicContact OE1-NZ 2.91Å; E491-K521 PolarHBondContact OE1-NZ 2.71Å; E491-G557 PolarHBondContact N-O 3.46Å; E491-L558 HydrophobicContact CG-CD2 3.87Å; E491-G559 VanDerWaalsContact OE2-CA 3.24Å; E491-G559 WeakPolarHBondContact OE2-CA 3.35Å; E491-G559 PolarHBondContact OE2-N 3.01Å
492	Y	92.6	Very high	91.2	Very high	10 Å²	10	41.8 Å²	41.8	4%	0.039	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.8	173.7	69.4	-92.1	0	0	0	111.8	I494 K519 L526 I555 M556 G557 I569	Y492-I494 HydrophobicContact CD2-CG1 4.43Å; Y492-I494 HydrophobicContact CD2-CG2 4.41Å; Y492-K519 CarbonylContact C-O 3.51Å; Y492-K519 WeakPolarHBondContact CA-O 3.39Å; Y492-K519 WeakPolarHBondContact CB-O 3.49Å; Y492-L526 HydrophobicContact CD2-CD2 3.86Å; Y492-L526 HydrophobicContact CG-CD2 3.87Å; Y492-I555 HydrophobicContact CE2-CG2 4.2Å; Y492-M556 VanDerWaalsContact O-CA 3.23Å; Y492-M556 WeakPolarHBondContact O-CA 3.21Å; Y492-G557 WeakPolarHBondContact CD1-O 3.46Å; Y492-G557 VanDerWaalsContact CE1-C 3.45Å; Y492-G557 VanDerWaalsContact CZ-CA 3.48Å; Y492-G557 PolarHBondContact N-O 3.12Å; Y492-G557 PolarHBondContact O-N 2.63Å; Y492-I569 HydrophobicContact CE2-CD1 4.07Å; Y492-I569 WeakPolarHBondContact OH-CG2 3.17Å
493	A	94.4	Very high	91.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	122.1	171.2	0	0	0	0	0	108.8	L487 F518 K519 L554 I555 M556	L487-A493 HydrophobicContact CD1-CB 3.67Å; A493-F518 HydrophobicContact CB-CB 4.32Å; A493-F518 PolarHBondContact O-N 2.85Å; A493-K519 HydrophobicContact CB-CB 3.81Å; A493-K519 PolarHBondContact N-O 2.74Å; A493-K519 PolarHBondContact O-N 3.49Å; A493-K519 VanDerWaalsContact O-N 3.13Å; A493-L554 HydrophobicContact CB-CD1 4.31Å; A493-I555 WeakPolarHBondContact CA-O 3.42Å; A493-M556 HydrophobicContact CB-CG 3.68Å; A493-M556 HydrophobicContact CB-SD 4.28Å
494	I	94.5	Very high	90.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.1	-175.2	60.9	176.5	0	0	0	111.7	Y492 A496 I514 T516 V517 L526 L554 I555 I569	Y492-I494 HydrophobicContact CD2-CG1 4.43Å; Y492-I494 HydrophobicContact CD2-CG2 4.41Å; I494-A496 HydrophobicContact CD1-CB 4.33Å; I494-I514 HydrophobicContact CB-CG2 4.25Å; I494-I514 HydrophobicContact CD1-CD1 3.81Å; I494-I514 HydrophobicContact CD1-CG1 4.06Å; I494-I514 HydrophobicContact CG2-CG2 4.33Å; I494-T516 CarbonylContact C-O 3.51Å; I494-T516 VanDerWaalsContact CA-O 3.32Å; I494-T516 WeakPolarHBondContact CA-O 3.39Å; I494-V517 HydrophobicContact CG2-CB 4.3Å; I494-V517 HydrophobicContact CG2-CG1 4.12Å; I494-V517 HydrophobicContact CG2-CG2 4Å; I494-L526 HydrophobicContact CD1-CD1 4.5Å; I494-L526 HydrophobicContact CD1-CD2 4.44Å; I494-L526 HydrophobicContact CG2-CD2 3.5Å; I494-L526 HydrophobicContact CG2-CG 4.32Å; I494-L554 WeakPolarHBondContact O-CA 3.3Å; I494-I555 HydrophobicContact CD1-CB 4.27Å; I494-I555 HydrophobicContact CG1-CB 3.8Å; I494-I555 PolarHBondContact N-O 2.95Å; I494-I555 PolarHBondContact O-N 3.02Å; I494-I569 HydrophobicContact CD1-CD1 3.88Å
495	E	95.5	Very high	90.2	Very high	9 Å²	9	50.2 Å²	50.2	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	119.3	159.5	177.6	-166.7	178.6	0	0	108.2	R515 T516 F518 K552 W580	E495-R515 HydrophobicContact CG-CB 4.23Å; E495-R515 PolarHBondContact O-N 3.06Å; E495-T516 PolarHBondContact N-O 2.91Å; E495-T516 PolarHBondContact O-N 3.41Å; E495-T516 PolarHBondContact OE2-OG1 3.28Å; E495-F518 HydrophobicContact CB-CE2 3.9Å; E495-K552 WeakPolarHBondContact OE1-CD 3.43Å; E495-K552 IonicContact OE1-NZ 2.89Å; E495-K552 PolarHBondContact OE1-NZ 3.1Å; E495-W580 HydrophobicContact CB-CE3 4.16Å; E495-W580 HydrophobicContact CB-CH2 3.79Å; E495-W580 HydrophobicContact CB-CZ2 4.39Å; E495-W580 HydrophobicContact CB-CZ3 3.66Å; E495-W580 HydrophobicContact CG-CD2 4.06Å; E495-W580 HydrophobicContact CG-CE3 3.9Å; E495-W580 HydrophobicContact CG-CH2 3.94Å; E495-W580 HydrophobicContact CG-CZ2 4.06Å; E495-W580 HydrophobicContact CG-CZ3 3.85Å
496	A	95.3	Very high	89.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140	178.6	0	0	0	0	0	111.2	I494 L512 A513 K552 Y553 I555	I494-A496 HydrophobicContact CD1-CB 4.33Å; A496-L512 HydrophobicContact CB-CB 4.24Å; A496-L512 HydrophobicContact CB-CD1 4.26Å; A496-A513 WeakPolarHBondContact CA-O 3.22Å; A496-K552 CarbonylContact O-C 3.42Å; A496-K552 WeakPolarHBondContact O-CA 3.41Å; A496-Y553 PolarHBondContact N-O 3.36Å; A496-Y553 PolarHBondContact O-N 3.49Å; A496-I555 HydrophobicContact CB-CD1 3.75Å; A496-I555 HydrophobicContact CB-CG1 4.39Å
497	Q	95.5	Very high	89.4	Confident	53 Å²	53	47.3 Å²	47.3	25%	0.248	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	132.1	170.4	-172.7	176	9.7	0	0	109.3	I499 L512 A513 G550 K552	Q497-I499 PolarHBondContact O-N 3.38Å; Q497-L512 CarbonylContact O-C 3.52Å; Q497-L512 WeakPolarHBondContact O-CA 3.47Å; Q497-A513 HydrophobicContact CB-CB 4.41Å; Q497-A513 PolarHBondContact N-O 2.68Å; Q497-A513 PolarHBondContact O-N 3.34Å; Q497-G550 PolarHBondContact NE2-O 3.42Å; Q497-K552 HydrophobicContact CB-CG 4.21Å; Q497-K552 HydrophobicContact CG-CG 4.29Å
498	V	93.9	Very high	89.1	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.5	177.5	-172.7	0	0	0	0	108.9	Y510 L512 L547 L549 G550 K551 Y553	V498-Y510 HydrophobicContact CG1-CD1 3.45Å; V498-Y510 VanDerWaalsContact CG1-CD1 3.45Å; V498-Y510 HydrophobicContact CG1-CE1 4.1Å; V498-Y510 HydrophobicContact CG1-CG 4.32Å; V498-L512 HydrophobicContact CB-CD2 4.42Å; V498-L512 HydrophobicContact CG2-CD2 3.97Å; V498-L547 HydrophobicContact CG2-CB 4.38Å; V498-L549 HydrophobicContact CG1-CD2 3.71Å; V498-G550 WeakPolarHBondContact O-CA 3.35Å; V498-G550 PolarHBondContact O-N 3.4Å; V498-K551 PolarHBondContact N-O 3.13Å; V498-Y553 HydrophobicContact CG2-CD2 3.75Å; V498-Y553 HydrophobicContact CG2-CE2 3.81Å
499	I	89.9	Confident	89	Confident	75 Å²	75	50 Å²	50	39%	0.385	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-57	-177.1	-50.4	175.2	0	0	0	110	Q497 Q511 A513 E530	Q497-I499 PolarHBondContact O-N 3.38Å; I499-Q511 HydrophobicContact CB-CB 4.4Å; I499-Q511 PolarHBondContact N-O 3.16Å; I499-A513 HydrophobicContact CD1-CB 3.67Å; I499-A513 HydrophobicContact CG1-CB 3.86Å; I499-E530 HydrophobicContact CD1-CG 4.3Å
500	A	89.5	Confident	89.1	Confident	32 Å²	32	44 Å²	44	26%	0.264	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	165.9	-173.1	0	0	0	0	0	110.6	Y510 Q511	A500-Y510 CarbonylContact O-C 3.5Å; A500-Y510 WeakPolarHBondContact O-CA 3.5Å; A500-Q511 HydrophobicContact CB-CB 4.19Å; A500-Q511 HydrophobicContact CB-CG 4.45Å; A500-Q511 PolarHBondContact O-N 3.32Å
501	K	87.8	Confident	89.1	Confident	122 Å²	122	45.6 Å²	45.6	53%	0.53	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.8	170	72.5	177.6	-175.1	167.2	0	109.4	L508 R509 Y510 L549	K501-L508 HydrophobicContact CB-CD1 4.33Å; K501-R509 CarbonylContact C-O 3.36Å; K501-R509 VanDerWaalsContact CA-O 3.29Å; K501-R509 WeakPolarHBondContact CA-O 3.1Å; K501-Y510 HydrophobicContact CB-CD1 3.52Å; K501-Y510 HydrophobicContact CB-CE1 3.52Å; K501-Y510 HydrophobicContact CB-CG 4.25Å; K501-Y510 HydrophobicContact CD-CE1 3.92Å; K501-Y510 HydrophobicContact CG-CE1 4.3Å; K501-L549 HydrophobicContact CB-CD2 4.16Å; K501-L549 HydrophobicContact CG-CD2 4.21Å
502	E	86.5	Confident	89.3	Confident	72 Å²	72	43.2 Å²	43.2	34%	0.336	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	153.6	179.6	58.7	-175.4	159.2	0	0	110.5	V504 R509 Q511	E502-V504 HydrophobicContact CG-CG2 3.92Å; E502-R509 HydrophobicContact CG-CB 3.99Å; E502-R509 HydrophobicContact CG-CG 4.39Å; E502-R509 PolarHBondContact N-O 3.29Å; E502-R509 PolarHBondContact O-N 3Å; E502-R509 VanDerWaalsContact OE1-CD 3.27Å; E502-R509 WeakPolarHBondContact OE1-CD 3.32Å; E502-R509 IonicContact OE1-CZ 2.86Å; E502-R509 IonicContact OE1-NE 2.64Å; E502-R509 IonicContact OE1-NH1 3.26Å; E502-R509 PolarHBondContact OE1-NH1 3.16Å; E502-Q511 PolarHBondContact OE1-NE2 3.34Å
503	M	82.6	Confident	89.4	Confident	105 Å²	105	43.6 Å²	43.6	52%	0.517	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124.9	172.7	-67.4	-61.9	-67.3	0	0	108.4	W507 L508 F540	M503-W507 WeakPolarHBondContact CA-O 3.36Å; M503-L508 HydrophobicContact SD-CB 3.95Å; M503-L508 HydrophobicContact SD-CD1 3.74Å; M503-L508 HydrophobicContact SD-CG 4.44Å; M503-F540 HydrophobicContact CE-CD1 4.23Å; M503-F540 HydrophobicContact CE-CE1 3.64Å; M503-F540 HydrophobicContact CE-CE2 4.14Å; M503-F540 HydrophobicContact CE-CZ 3.64Å
504	V	81.9	Confident	89.4	Confident	38 Å²	38	43.9 Å²	43.9	23%	0.23	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	117.1	-179.9	-178.4	0	0	0	0	107.9	E502 G506 W507 R509 W534	E502-V504 HydrophobicContact CG-CG2 3.92Å; V504-G506 VanDerWaalsContact C-N 3.3Å; V504-G506 PolarHBondContact O-N 2.52Å; V504-W507 PolarHBondContact N-O 3.24Å; V504-W507 WeakPolarHBondContact O-CA 3.42Å; V504-W507 WeakPolarHBondContact O-CB 3.42Å; V504-W507 PolarHBondContact O-N 3.48Å; V504-R509 HydrophobicContact CG2-CB 4.46Å; V504-W534 HydrophobicContact CB-CH2 4.09Å; V504-W534 HydrophobicContact CB-CZ3 3.86Å; V504-W534 HydrophobicContact CG1-CH2 4.04Å; V504-W534 HydrophobicContact CG1-CZ3 4.15Å; V504-W534 HydrophobicContact CG2-CH2 4.47Å
505	D	80.1	Confident	89.3	Confident	143 Å²	143	50.4 Å²	50.4	77%	0.765	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	41	176.6	-52.6	-31.1	0	0	0	114.8	W507	D505-W507 VanDerWaalsContact C-N 3.27Å; D505-W507 VanDerWaalsContact O-CD1 3.31Å; D505-W507 PolarHBondContact O-N 3.21Å
506	G	78	Confident	89.2	Confident	33 Å²	33	51.1 Å²	51.1	34%	0.34	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	4.7	-177	0	0	0	0	0	114.7	V504	V504-G506 VanDerWaalsContact C-N 3.3Å; V504-G506 PolarHBondContact O-N 2.52Å
507	W	83.8	Confident	89.1	Confident	60 Å²	60	52.7 Å²	52.7	23%	0.227	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.4	174.4	-67.5	70.9	0	0	0	111.4	M503 V504 D505 W534 P536 V570	M503-W507 WeakPolarHBondContact CA-O 3.36Å; V504-W507 PolarHBondContact N-O 3.24Å; V504-W507 WeakPolarHBondContact O-CA 3.42Å; V504-W507 WeakPolarHBondContact O-CB 3.42Å; V504-W507 PolarHBondContact O-N 3.48Å; D505-W507 VanDerWaalsContact C-N 3.27Å; D505-W507 VanDerWaalsContact O-CD1 3.31Å; D505-W507 PolarHBondContact O-N 3.21Å; W507-W534 HydrophobicContact CB-CE3 3.8Å; W507-W534 HydrophobicContact CB-CZ3 4.13Å; W507-W534 HydrophobicContact CE3-CB 4.21Å; W507-W534 HydrophobicContact CG-CE3 4.45Å; W507-P536 VanDerWaalsContact CE3-CA 3.48Å; W507-P536 HydrophobicContact CE3-CB 4.15Å; W507-P536 HydrophobicContact CH2-CB 3.69Å; W507-P536 HydrophobicContact CZ2-CB 4.45Å; W507-P536 HydrophobicContact CZ3-CB 3.51Å; W507-P536 HydrophobicContact CZ3-CG 4.21Å; W507-V570 HydrophobicContact CZ3-CG1 4.23Å
508	L	86.4	Confident	89.1	Confident	19 Å²	19	51.4 Å²	51.4	10%	0.099	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.3	169.5	178.6	63.9	0	0	0	109.2	K501 M503 Y510 I535 F540	K501-L508 HydrophobicContact CB-CD1 4.33Å; M503-L508 HydrophobicContact SD-CB 3.95Å; M503-L508 HydrophobicContact SD-CD1 3.74Å; M503-L508 HydrophobicContact SD-CG 4.44Å; L508-Y510 HydrophobicContact CD2-CD2 4.41Å; L508-Y510 HydrophobicContact CD2-CE2 3.49Å; L508-Y510 VanDerWaalsContact CD2-CE2 3.49Å; L508-Y510 HydrophobicContact CG-CD2 4.25Å; L508-Y510 HydrophobicContact CG-CE2 3.79Å; L508-I535 HydrophobicContact CB-CB 4.27Å; L508-I535 HydrophobicContact CD2-CD1 4.49Å; L508-I535 PolarHBondContact N-O 2.74Å; L508-I535 VanDerWaalsContact N-O 3.13Å; L508-I535 PolarHBondContact O-N 3.42Å; L508-F540 HydrophobicContact CB-CB 3.85Å; L508-F540 HydrophobicContact CB-CD1 4.12Å; L508-F540 HydrophobicContact CB-CG 4.17Å; L508-F540 HydrophobicContact CD2-CB 3.66Å; L508-F540 HydrophobicContact CG-CB 4.41Å
509	R	89.6	Confident	89	Confident	62 Å²	62	52.5 Å²	52.5	23%	0.234	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121	177.6	-177.4	-170.9	174.5	-164.3	8.7	109.9	K501 E502 V504 S532 I533 W534	K501-R509 CarbonylContact C-O 3.36Å; K501-R509 VanDerWaalsContact CA-O 3.29Å; K501-R509 WeakPolarHBondContact CA-O 3.1Å; E502-R509 HydrophobicContact CG-CB 3.99Å; E502-R509 HydrophobicContact CG-CG 4.39Å; E502-R509 PolarHBondContact N-O 3.29Å; E502-R509 PolarHBondContact O-N 3Å; E502-R509 VanDerWaalsContact OE1-CD 3.27Å; E502-R509 WeakPolarHBondContact OE1-CD 3.32Å; E502-R509 IonicContact OE1-CZ 2.86Å; E502-R509 IonicContact OE1-NE 2.64Å; E502-R509 IonicContact OE1-NH1 3.26Å; E502-R509 PolarHBondContact OE1-NH1 3.16Å; V504-R509 HydrophobicContact CG2-CB 4.46Å; R509-S532 PolarHBondContact NE-OG 3.18Å; R509-S532 PolarHBondContact NH2-OG 2.84Å; R509-I533 WeakPolarHBondContact CA-O 3.48Å; R509-W534 HydrophobicContact CB-CD2 4.28Å; R509-W534 HydrophobicContact CB-CE3 3.88Å; R509-W534 HydrophobicContact CB-CH2 4.18Å; R509-W534 HydrophobicContact CB-CZ3 3.85Å; R509-W534 HydrophobicContact CG-CD2 4.16Å; R509-W534 HydrophobicContact CG-CE3 4.22Å; R509-W534 HydrophobicContact CG-CH2 4.07Å; R509-W534 HydrophobicContact CG-CZ2 3.96Å; R509-W534 HydrophobicContact CG-CZ3 4.2Å
510	Y	91.6	Very high	89.1	Confident	13 Å²	13	53.3 Å²	53.3	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.1	166.8	-72.7	-87.9	0	0	0	110.1	V498 A500 K501 L508 S532 I533 I535 L547 L549	V498-Y510 HydrophobicContact CG1-CD1 3.45Å; V498-Y510 VanDerWaalsContact CG1-CD1 3.45Å; V498-Y510 HydrophobicContact CG1-CE1 4.1Å; V498-Y510 HydrophobicContact CG1-CG 4.32Å; A500-Y510 CarbonylContact O-C 3.5Å; A500-Y510 WeakPolarHBondContact O-CA 3.5Å; K501-Y510 HydrophobicContact CB-CD1 3.52Å; K501-Y510 HydrophobicContact CB-CE1 3.52Å; K501-Y510 HydrophobicContact CB-CG 4.25Å; K501-Y510 HydrophobicContact CD-CE1 3.92Å; K501-Y510 HydrophobicContact CG-CE1 4.3Å; L508-Y510 HydrophobicContact CD2-CD2 4.41Å; L508-Y510 HydrophobicContact CD2-CE2 3.49Å; L508-Y510 VanDerWaalsContact CD2-CE2 3.49Å; L508-Y510 HydrophobicContact CG-CD2 4.25Å; L508-Y510 HydrophobicContact CG-CE2 3.79Å; Y510-S532 CarbonylContact O-C 3.59Å; Y510-S532 WeakPolarHBondContact O-CA 3.22Å; Y510-I533 HydrophobicContact CD2-CG2 4.48Å; Y510-I533 HydrophobicContact CG-CG2 4.44Å; Y510-I533 PolarHBondContact N-O 2.98Å; Y510-I533 PolarHBondContact O-N 2.86Å; Y510-I535 HydrophobicContact CD2-CD1 3.68Å; Y510-I535 HydrophobicContact CD2-CG1 4.3Å; Y510-I535 HydrophobicContact CE2-CD1 3.46Å; Y510-I535 VanDerWaalsContact CE2-CD1 3.46Å; Y510-I535 HydrophobicContact CE2-CG1 4.44Å; Y510-L547 HydrophobicContact CD2-CD1 4.15Å; Y510-L547 HydrophobicContact CE1-CB 4.07Å; Y510-L547 HydrophobicContact CE2-CB 4.41Å; Y510-L547 HydrophobicContact CE2-CD1 4.26Å; Y510-L547 HydrophobicContact CG-CD1 4.43Å; Y510-L549 HydrophobicContact CD1-CD2 4.48Å; Y510-L549 HydrophobicContact CE1-CD2 4.47Å
511	Q	91.9	Very high	88.9	Confident	60 Å²	60	56.9 Å²	56.9	28%	0.28	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.5	169.6	-65.3	179.7	-4.2	0	0	109.1	I499 A500 E502	I499-Q511 HydrophobicContact CB-CB 4.4Å; I499-Q511 PolarHBondContact N-O 3.16Å; A500-Q511 HydrophobicContact CB-CB 4.19Å; A500-Q511 HydrophobicContact CB-CG 4.45Å; A500-Q511 PolarHBondContact O-N 3.32Å; E502-Q511 PolarHBondContact OE1-NE2 3.34Å
512	L	93.7	Very high	88.5	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.6	-174.8	-59.4	-179.3	0	0	0	110.2	A496 Q497 V498 E530 E531 I533 I555	A496-L512 HydrophobicContact CB-CB 4.24Å; A496-L512 HydrophobicContact CB-CD1 4.26Å; Q497-L512 CarbonylContact O-C 3.52Å; Q497-L512 WeakPolarHBondContact O-CA 3.47Å; V498-L512 HydrophobicContact CB-CD2 4.42Å; V498-L512 HydrophobicContact CG2-CD2 3.97Å; L512-E530 VanDerWaalsContact O-CA 3.31Å; L512-E530 WeakPolarHBondContact O-CA 3.45Å; L512-E531 WeakPolarHBondContact CB-O 3.44Å; L512-E531 PolarHBondContact N-O 2.73Å; L512-E531 PolarHBondContact O-N 3.1Å; L512-I533 HydrophobicContact CD1-CB 3.84Å; L512-I533 HydrophobicContact CD1-CG2 3.69Å; L512-I533 HydrophobicContact CD2-CG2 4.13Å; L512-I533 HydrophobicContact CG-CB 4.47Å; L512-I533 HydrophobicContact CG-CG2 3.93Å; L512-I555 HydrophobicContact CD1-CD1 3.59Å; L512-I555 HydrophobicContact CD2-CD1 4.4Å
513	A	94.6	Very high	88.1	Confident	18 Å²	18	63.2 Å²	63.2	15%	0.149	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	103.7	162.3	0	0	0	0	0	108.5	A496 Q497 I499 R515	A496-A513 WeakPolarHBondContact CA-O 3.22Å; Q497-A513 HydrophobicContact CB-CB 4.41Å; Q497-A513 PolarHBondContact N-O 2.68Å; Q497-A513 PolarHBondContact O-N 3.34Å; I499-A513 HydrophobicContact CD1-CB 3.67Å; I499-A513 HydrophobicContact CG1-CB 3.86Å; A513-R515 PolarHBondContact O-N 3.42Å
514	I	94.2	Very high	88.1	Confident	6 Å²	6	59.8 Å²	59.8	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	110.2	174	-57.4	-177.3	0	0	0	108.6	I494 V517 L526 R527 G529 E531	I494-I514 HydrophobicContact CB-CG2 4.25Å; I494-I514 HydrophobicContact CD1-CD1 3.81Å; I494-I514 HydrophobicContact CD1-CG1 4.06Å; I494-I514 HydrophobicContact CG2-CG2 4.33Å; I514-V517 HydrophobicContact CG2-CG2 3.76Å; I514-L526 HydrophobicContact CD1-CD1 3.53Å; I514-L526 HydrophobicContact CD1-CG 4.2Å; I514-R527 WeakPolarHBondContact CD1-O 3.41Å; I514-G529 WeakPolarHBondContact CB-O 3.34Å; I514-G529 PolarHBondContact N-O 3.28Å; I514-G529 PolarHBondContact O-N 3.41Å; I514-G529 VanDerWaalsContact O-N 3.13Å; I514-E531 HydrophobicContact CD1-CB 3.54Å; I514-E531 HydrophobicContact CD1-CG 4.06Å; I514-E531 HydrophobicContact CG1-CB 4.1Å
515	R	93.2	Very high	88	Confident	137 Å²	137	67.6 Å²	67.6	52%	0.517	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-49.8	177.8	-66.1	-65.9	-176.4	174.5	-0.7	111	E495 A513 R528	E495-R515 HydrophobicContact CG-CB 4.23Å; E495-R515 PolarHBondContact O-N 3.06Å; A513-R515 PolarHBondContact O-N 3.42Å; R515-R528 WeakPolarHBondContact O-CD 3.42Å; R515-R528 PolarHBondContact O-NE 2.93Å
516	T	93.5	Very high	88.2	Confident	23 Å²	23	61.4 Å²	61.4	14%	0.141	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	135	-172.6	-48.5	0	0	0	0	110.2	I494 E495 F518	I494-T516 CarbonylContact C-O 3.51Å; I494-T516 VanDerWaalsContact CA-O 3.32Å; I494-T516 WeakPolarHBondContact CA-O 3.39Å; E495-T516 PolarHBondContact N-O 2.91Å; E495-T516 PolarHBondContact O-N 3.41Å; E495-T516 PolarHBondContact OE2-OG1 3.28Å; T516-F518 HydrophobicContact CG2-CD1 4.32Å; T516-F518 HydrophobicContact CG2-CD2 4.07Å; T516-F518 HydrophobicContact CG2-CE1 3.92Å; T516-F518 HydrophobicContact CG2-CE2 3.62Å; T516-F518 HydrophobicContact CG2-CG 4.39Å; T516-F518 HydrophobicContact CG2-CZ 3.54Å
517	V	93.8	Very high	88.7	Confident	34 Å²	34	66.1 Å²	66.1	21%	0.206	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	107.9	172.1	-178.8	0	0	0	0	106.9	I494 I514 R520 R528	I494-V517 HydrophobicContact CG2-CB 4.3Å; I494-V517 HydrophobicContact CG2-CG1 4.12Å; I494-V517 HydrophobicContact CG2-CG2 4Å; I514-V517 HydrophobicContact CG2-CG2 3.76Å; V517-R520 HydrophobicContact CG1-CB 3.84Å; V517-R528 HydrophobicContact CG2-CG 4.23Å
518	F	94.3	Very high	89	Confident	25 Å²	25	71.6 Å²	71.6	11%	0.11	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-37.5	-178	-70.6	-82	0	0	0	112.1	A493 E495 T516 W580 E585 L588 R589 V592	A493-F518 HydrophobicContact CB-CB 4.32Å; A493-F518 PolarHBondContact O-N 2.85Å; E495-F518 HydrophobicContact CB-CE2 3.9Å; T516-F518 HydrophobicContact CG2-CD1 4.32Å; T516-F518 HydrophobicContact CG2-CD2 4.07Å; T516-F518 HydrophobicContact CG2-CE1 3.92Å; T516-F518 HydrophobicContact CG2-CE2 3.62Å; T516-F518 HydrophobicContact CG2-CG 4.39Å; T516-F518 HydrophobicContact CG2-CZ 3.54Å; F518-W580 AromaticContact CE2-CH2 3.62Å; F518-W580 HydrophobicContact CE2-CH2 3.62Å; F518-W580 HydrophobicContact CE2-CZ3 4.14Å; F518-W580 AromaticContact CZ-CH2 3.76Å; F518-W580 HydrophobicContact CZ-CH2 3.76Å; F518-E585 HydrophobicContact CE1-CG 4.08Å; F518-E585 HydrophobicContact CZ-CG 4.01Å; F518-L588 HydrophobicContact CD1-CB 3.87Å; F518-L588 HydrophobicContact CD2-CD1 4.02Å; F518-L588 HydrophobicContact CE1-CB 4.02Å; F518-L588 HydrophobicContact CE2-CD1 3.95Å; F518-L588 HydrophobicContact CG-CB 4.2Å; F518-L588 HydrophobicContact CG-CD1 4.37Å; F518-L588 HydrophobicContact CZ-CB 4.48Å; F518-L588 HydrophobicContact CZ-CD1 4.24Å; F518-R589 HydrophobicContact CD1-CG 4.37Å; F518-R589 HydrophobicContact CE1-CG 4.07Å; F518-V592 HydrophobicContact CB-CG2 4.09Å
519	K	92.7	Very high	89.2	Confident	24 Å²	24	72.5 Å²	72.5	10%	0.104	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	139.9	179.1	179.2	-178.5	-174.3	166.5	0	109.5	L487 C488 R490 Y492 A493 E595	L487-K519 HydrophobicContact CD1-CB 4.48Å; L487-K519 HydrophobicContact CD1-CD 4.01Å; L487-K519 HydrophobicContact CG-CD 4.26Å; L487-K519 PolarHBondContact O-NZ 3.46Å; C488-K519 PolarHBondContact O-NZ 2.7Å; R490-K519 WeakPolarHBondContact O-CD 3.41Å; R490-K519 WeakPolarHBondContact O-CE 3.48Å; R490-K519 PolarHBondContact O-NZ 3.48Å; Y492-K519 CarbonylContact C-O 3.51Å; Y492-K519 WeakPolarHBondContact CA-O 3.39Å; Y492-K519 WeakPolarHBondContact CB-O 3.49Å; A493-K519 HydrophobicContact CB-CB 3.81Å; A493-K519 PolarHBondContact N-O 2.74Å; A493-K519 PolarHBondContact O-N 3.49Å; A493-K519 VanDerWaalsContact O-N 3.13Å; K519-E595 VanDerWaalsContact CD-OE2 3.28Å; K519-E595 WeakPolarHBondContact CD-OE2 3.28Å; K519-E595 VanDerWaalsContact CE-CD 3.44Å; K519-E595 WeakPolarHBondContact CE-OE1 3.02Å; K519-E595 WeakPolarHBondContact CE-OE2 3.04Å; K519-E595 IonicContact NZ-OE1 2.82Å; K519-E595 PolarHBondContact NZ-OE1 3.47Å; K519-E595 IonicContact NZ-OE2 2.8Å; K519-E595 PolarHBondContact NZ-OE2 3Å
520	R	90.9	Very high	89.3	Confident	93 Å²	93	77.3 Å²	77.3	35%	0.351	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	136.9	174.2	-169.2	-171.3	68.9	-147.5	-4.4	110.5	E491 V517 L526	E491-R520 CarbonylContact O-C 3.56Å; E491-R520 WeakPolarHBondContact O-CA 2.93Å; V517-R520 HydrophobicContact CG1-CB 3.84Å; R520-L526 WeakPolarHBondContact CD-O 3.32Å; R520-L526 HydrophobicContact CG-CB 4.38Å; R520-L526 PolarHBondContact NH1-O 3.44Å
521	K	84.8	Confident	89.2	Confident	106 Å²	106	79 Å²	79	46%	0.461	36%	0.357	S	S	.	.			trans	-60.7	147	166.1	-80.1	-171	168.6	179.7	0	112.2	E491 Y523 S524	E491-K521 HydrophobicContact CB-CD 4.17Å; E491-K521 HydrophobicContact CB-CG 4.16Å; E491-K521 HydrophobicContact CG-CD 3.98Å; E491-K521 HydrophobicContact CG-CG 4.45Å; E491-K521 PolarHBondContact O-N 3.34Å; E491-K521 VanDerWaalsContact O-N 3.16Å; E491-K521 VanDerWaalsContact OE1-CE 3.27Å; E491-K521 WeakPolarHBondContact OE1-CE 3.47Å; E491-K521 IonicContact OE1-NZ 2.91Å; E491-K521 PolarHBondContact OE1-NZ 2.71Å; K521-Y523 VanDerWaalsContact C-N 3.28Å; K521-Y523 PolarHBondContact O-N 2.03Å; K521-S524 WeakPolarHBondContact O-CB 3.42Å; K521-S524 PolarHBondContact O-N 3.2Å; K521-S524 VanDerWaalsContact O-N 3.08Å
522	P	80.3	Confident	89.1	Confident	106 Å²	106	76.5 Å²	76.5	69%	0.688	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-41.9	-179.2	-28.9	35.2	0	0	0	114.2	S524	P522-S524 VanDerWaalsContact C-N 3.32Å; P522-S524 PolarHBondContact O-N 3.31Å
523	Y	78.6	Confident	88.9	Confident	221 Å²	221	76.5 Å²	76.5	87%	0.867	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-0.7	-176.3	-48.9	-74.2	0	0	0	114.8	K521	K521-Y523 VanDerWaalsContact C-N 3.28Å; K521-Y523 PolarHBondContact O-N 2.03Å
524	S	81.6	Confident	88.6	Confident	34 Å²	34	76 Å²	76	24%	0.238	34%	0.341	C	S	.	.			trans	-74	136.1	179.8	176.4	0	0	0	0	110.9	K521 P522 L526 R527	K521-S524 WeakPolarHBondContact O-CB 3.42Å; K521-S524 PolarHBondContact O-N 3.2Å; K521-S524 VanDerWaalsContact O-N 3.08Å; P522-S524 VanDerWaalsContact C-N 3.32Å; P522-S524 PolarHBondContact O-N 3.31Å; S524-L526 PolarHBondContact O-N 2.84Å; S524-L526 WeakPolarHBondContact OG-CB 3.45Å; S524-L526 PolarHBondContact OG-N 3.07Å; S524-R527 PolarHBondContact O-NH1 3.04Å
525	R	80.3	Confident	88.2	Confident	202 Å²	202	75.8 Å²	75.8	76%	0.762	34%	0.34	S	S	*	.			trans	-76.8	-4.5	173.4	-67	-174.9	-178.6	164.2	0.9	113.9	R527	R525-R527 WeakPolarHBondContact O-CG 3.43Å; R525-R527 PolarHBondContact O-N 3.3Å
526	L	84.8	Confident	87.4	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.063	32%	0.319	C	S	.	.			trans	-61.3	123.5	-179	-167	68.9	0	0	0	110.6	Y492 I494 I514 R520 S524 E531 I569	Y492-L526 HydrophobicContact CD2-CD2 3.86Å; Y492-L526 HydrophobicContact CG-CD2 3.87Å; I494-L526 HydrophobicContact CD1-CD1 4.5Å; I494-L526 HydrophobicContact CD1-CD2 4.44Å; I494-L526 HydrophobicContact CG2-CD2 3.5Å; I494-L526 HydrophobicContact CG2-CG 4.32Å; I514-L526 HydrophobicContact CD1-CD1 3.53Å; I514-L526 HydrophobicContact CD1-CG 4.2Å; R520-L526 WeakPolarHBondContact CD-O 3.32Å; R520-L526 HydrophobicContact CG-CB 4.38Å; R520-L526 PolarHBondContact NH1-O 3.44Å; S524-L526 PolarHBondContact O-N 2.84Å; S524-L526 WeakPolarHBondContact OG-CB 3.45Å; S524-L526 PolarHBondContact OG-N 3.07Å; L526-E531 HydrophobicContact CD1-CG 4.17Å; L526-I569 HydrophobicContact CD1-CD1 4Å; L526-I569 HydrophobicContact CD1-CG1 4.36Å
527	R	88.1	Confident	86.3	Confident	133 Å²	133	73.6 Å²	73.6	50%	0.502	34%	0.335	S	S	.	.			trans	-130.8	166.9	179.4	-63.9	-65.6	177.5	-85.3	3.5	110.1	I514 S524 R525	I514-R527 WeakPolarHBondContact CD1-O 3.41Å; S524-R527 PolarHBondContact O-NH1 3.04Å; R525-R527 WeakPolarHBondContact O-CG 3.43Å; R525-R527 PolarHBondContact O-N 3.3Å
528	R	91	Very high	85.2	Confident	175 Å²	175	77.4 Å²	77.4	66%	0.66	35%	0.35	S	S	*	.	S	Bend	trans	-64.1	145.8	165.2	-66.4	-177.2	-177.6	-173.8	-3	108.5	R515 V517	R515-R528 WeakPolarHBondContact O-CD 3.42Å; R515-R528 PolarHBondContact O-NE 2.93Å; V517-R528 HydrophobicContact CG2-CG 4.23Å
529	G	90.5	Very high	84.2	Confident	37 Å²	37	78.1 Å²	78.1	38%	0.381	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.9	-160.5	-175.4	0	0	0	0	0	112.6	I514	I514-G529 WeakPolarHBondContact CB-O 3.34Å; I514-G529 PolarHBondContact N-O 3.28Å; I514-G529 PolarHBondContact O-N 3.41Å; I514-G529 VanDerWaalsContact O-N 3.13Å
530	E	91.4	Very high	83	Confident	163 Å²	163	79.4 Å²	79.4	76%	0.762	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	132.1	-179.8	-67.4	-176.4	172.9	0	0	111.2	I499 L512	I499-E530 HydrophobicContact CD1-CG 4.3Å; L512-E530 VanDerWaalsContact O-CA 3.31Å; L512-E530 WeakPolarHBondContact O-CA 3.45Å
531	E	89.9	Confident	81.9	Confident	49 Å²	49	77.3 Å²	77.3	23%	0.229	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.4	177	-170.4	55.7	-88.8	0	0	109.7	L512 I514 L526 G568	L512-E531 WeakPolarHBondContact CB-O 3.44Å; L512-E531 PolarHBondContact N-O 2.73Å; L512-E531 PolarHBondContact O-N 3.1Å; I514-E531 HydrophobicContact CD1-CB 3.54Å; I514-E531 HydrophobicContact CD1-CG 4.06Å; I514-E531 HydrophobicContact CG1-CB 4.1Å; L526-E531 HydrophobicContact CD1-CG 4.17Å; E531-G568 VanDerWaalsContact OE1-CA 3.27Å; E531-G568 WeakPolarHBondContact OE1-CA 3.41Å
532	S	89.8	Confident	81.5	Confident	8 Å²	8	73.5 Å²	73.5	6%	0.056	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.8	177.2	-58.4	0	0	0	0	111.5	R509 Y510 G568 I569	R509-S532 PolarHBondContact NE-OG 3.18Å; R509-S532 PolarHBondContact NH2-OG 2.84Å; Y510-S532 CarbonylContact O-C 3.59Å; Y510-S532 WeakPolarHBondContact O-CA 3.22Å; S532-G568 CarbonylContact O-C 3.58Å; S532-G568 VanDerWaalsContact O-CA 3.27Å; S532-G568 WeakPolarHBondContact O-CA 3.34Å; S532-I569 PolarHBondContact O-N 3.44Å
533	I	89.6	Confident	81	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.5	165.9	-168.2	157.3	0	0	0	110.6	R509 Y510 L512 I555 I569 T575 F577	R509-I533 WeakPolarHBondContact CA-O 3.48Å; Y510-I533 HydrophobicContact CD2-CG2 4.48Å; Y510-I533 HydrophobicContact CG-CG2 4.44Å; Y510-I533 PolarHBondContact N-O 2.98Å; Y510-I533 PolarHBondContact O-N 2.86Å; L512-I533 HydrophobicContact CD1-CB 3.84Å; L512-I533 HydrophobicContact CD1-CG2 3.69Å; L512-I533 HydrophobicContact CD2-CG2 4.13Å; L512-I533 HydrophobicContact CG-CB 4.47Å; L512-I533 HydrophobicContact CG-CG2 3.93Å; I533-I555 HydrophobicContact CD1-CG2 4.27Å; I533-I569 CarbonylContact C-O 3.6Å; I533-I569 WeakPolarHBondContact CA-O 3.27Å; I533-I569 HydrophobicContact CB-CB 4.24Å; I533-I569 HydrophobicContact CD1-CB 4.05Å; I533-I569 HydrophobicContact CD1-CG2 3.63Å; I533-I569 HydrophobicContact CG1-CB 3.94Å; I533-I569 HydrophobicContact CG1-CG2 3.88Å; I533-I569 WeakPolarHBondContact CG1-O 3.19Å; I533-T575 HydrophobicContact CD1-CG2 4.46Å; I533-F577 HydrophobicContact CD1-CE1 3.76Å; I533-F577 HydrophobicContact CD1-CZ 3.45Å; I533-F577 VanDerWaalsContact CD1-CZ 3.45Å; I533-F577 HydrophobicContact CG1-CZ 4.5Å
534	W	88.1	Confident	80.9	Confident	8 Å²	8	65.9 Å²	65.9	3%	0.03	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.2	-172.2	-63.9	91.1	0	0	0	110.3	V504 W507 R509 R566 P567 I569 V570 L571	V504-W534 HydrophobicContact CB-CH2 4.09Å; V504-W534 HydrophobicContact CB-CZ3 3.86Å; V504-W534 HydrophobicContact CG1-CH2 4.04Å; V504-W534 HydrophobicContact CG1-CZ3 4.15Å; V504-W534 HydrophobicContact CG2-CH2 4.47Å; W507-W534 HydrophobicContact CB-CE3 3.8Å; W507-W534 HydrophobicContact CB-CZ3 4.13Å; W507-W534 HydrophobicContact CE3-CB 4.21Å; W507-W534 HydrophobicContact CG-CE3 4.45Å; R509-W534 HydrophobicContact CB-CD2 4.28Å; R509-W534 HydrophobicContact CB-CE3 3.88Å; R509-W534 HydrophobicContact CB-CH2 4.18Å; R509-W534 HydrophobicContact CB-CZ3 3.85Å; R509-W534 HydrophobicContact CG-CD2 4.16Å; R509-W534 HydrophobicContact CG-CE3 4.22Å; R509-W534 HydrophobicContact CG-CH2 4.07Å; R509-W534 HydrophobicContact CG-CZ2 3.96Å; R509-W534 HydrophobicContact CG-CZ3 4.2Å; W534-R566 HydrophobicContact CD2-CB 4.13Å; W534-R566 HydrophobicContact CD2-CG 4.15Å; W534-R566 HydrophobicContact CE3-CG 4.12Å; W534-R566 HydrophobicContact CG-CB 4.44Å; W534-R566 HydrophobicContact CH2-CG 4.09Å; W534-R566 HydrophobicContact CZ2-CB 4.2Å; W534-R566 HydrophobicContact CZ2-CG 4.15Å; W534-R566 HydrophobicContact CZ3-CG 4.07Å; W534-P567 PolarHBondContact NE1-O 2.75Å; W534-I569 PolarHBondContact N-O 3.38Å; W534-V570 HydrophobicContact CB-CG2 4.41Å; W534-L571 WeakPolarHBondContact O-CB 3.45Å; W534-L571 PolarHBondContact O-N 2.9Å
535	I	84.8	Confident	80.7	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.4	-180	-51.6	-173.3	0	0	0	108.7	L508 Y510 N539 F540 P545 L571	L508-I535 HydrophobicContact CB-CB 4.27Å; L508-I535 HydrophobicContact CD2-CD1 4.49Å; L508-I535 PolarHBondContact N-O 2.74Å; L508-I535 VanDerWaalsContact N-O 3.13Å; L508-I535 PolarHBondContact O-N 3.42Å; Y510-I535 HydrophobicContact CD2-CD1 3.68Å; Y510-I535 HydrophobicContact CD2-CG1 4.3Å; Y510-I535 HydrophobicContact CE2-CD1 3.46Å; Y510-I535 VanDerWaalsContact CE2-CD1 3.46Å; Y510-I535 HydrophobicContact CE2-CG1 4.44Å; I535-N539 HydrophobicContact CG2-CB 3.6Å; I535-F540 HydrophobicContact CG2-CB 4.5Å; I535-P545 HydrophobicContact CD1-CG 4.21Å; I535-L571 HydrophobicContact CD1-CD1 3.99Å; I535-L571 HydrophobicContact CG1-CB 4.21Å; I535-L571 HydrophobicContact CG1-CD1 3.91Å; I535-L571 HydrophobicContact CG2-CD1 4.33Å
536	P	77.3	Confident	80.6	Confident	14 Å²	14	64.3 Å²	64.3	9%	0.091	29%	0.292	C	S	.	.			trans	-66.6	158.1	178.9	26.8	-33.6	0	0	0	112	W507 H538 N539 F540	W507-P536 VanDerWaalsContact CE3-CA 3.48Å; W507-P536 HydrophobicContact CE3-CB 4.15Å; W507-P536 HydrophobicContact CH2-CB 3.69Å; W507-P536 HydrophobicContact CZ2-CB 4.45Å; W507-P536 HydrophobicContact CZ3-CB 3.51Å; W507-P536 HydrophobicContact CZ3-CG 4.21Å; P536-H538 WeakPolarHBondContact CG-CE1 3.16Å; P536-H538 PolarHBondContact O-N 2.76Å; P536-N539 HydrophobicContact CG-CB 4.26Å; P536-N539 PolarHBondContact O-N 2.9Å; P536-F540 PolarHBondContact O-N 3.27Å
537	E	69.7	Low	80.7	Confident	100 Å²	100	64.4 Å²	64.4	47%	0.467	29%	0.292	S	S	.	.	H	α-helix	trans	-53.6	-52.3	-169.6	178.7	157.2	-141.2	0	0	114.8	N539 F540 Q541	E537-N539 PolarHBondContact O-N 2.98Å; E537-F540 HydrophobicContact CB-CD1 4.27Å; E537-F540 HydrophobicContact CB-CE1 3.7Å; E537-F540 HydrophobicContact CB-CZ 4.47Å; E537-F540 HydrophobicContact CG-CD1 4.39Å; E537-F540 HydrophobicContact CG-CE1 3.5Å; E537-F540 VanDerWaalsContact CG-CE1 3.5Å; E537-F540 HydrophobicContact CG-CZ 3.77Å; E537-F540 VanDerWaalsContact O-CD1 3.22Å; E537-F540 WeakPolarHBondContact O-CD1 3.28Å; E537-F540 WeakPolarHBondContact O-CG 3.37Å; E537-F540 PolarHBondContact O-N 3.15Å; E537-F540 VanDerWaalsContact O-N 3.14Å; E537-Q541 HydrophobicContact CG-CG 4.35Å; E537-Q541 VanDerWaalsContact CG-NE2 3.32Å; E537-Q541 WeakPolarHBondContact O-CG 3.28Å; E537-Q541 PolarHBondContact O-N 3.04Å; E537-Q541 VanDerWaalsContact O-N 3.13Å; E537-Q541 PolarHBondContact OE1-NE2 3.28Å
538	H	70.7	Confident	80.6	Confident	114 Å²	114	66.3 Å²	66.3	53%	0.528	30%	0.3	S	S	.	.	H	α-helix	trans	-53.5	-32.1	178.4	66	-89.1	0	0	0	113.9	P536	P536-H538 WeakPolarHBondContact CG-CE1 3.16Å; P536-H538 PolarHBondContact O-N 2.76Å
539	N	72.5	Confident	80.5	Confident	40 Å²	40	62.1 Å²	62.1	21%	0.214	29%	0.29	C	S	.	.	H	α-helix	trans	-81.7	-39.1	-177.7	-83.5	-11.5	0	0	0	112	I535 P536 E537 R543 C544 L571	I535-N539 HydrophobicContact CG2-CB 3.6Å; P536-N539 HydrophobicContact CG-CB 4.26Å; P536-N539 PolarHBondContact O-N 2.9Å; E537-N539 PolarHBondContact O-N 2.98Å; N539-R543 PolarHBondContact O-N 2.82Å; N539-C544 CarbonylContact C-O 3.47Å; N539-C544 WeakPolarHBondContact CB-O 3.28Å; N539-C544 PolarHBondContact O-N 3.16Å; N539-L571 VanDerWaalsContact ND2-CD2 3.26Å; N539-L571 WeakPolarHBondContact ND2-CD2 3.46Å
540	F	69.3	Low	80.4	Confident	51 Å²	51	62.4 Å²	62.4	22%	0.224	29%	0.293	C	S	.	.	H	α-helix	trans	-69.4	-38.2	178.1	84.2	-112.3	0	0	0	111.9	M503 L508 I535 P536 E537 C542 R543	M503-F540 HydrophobicContact CE-CD1 4.23Å; M503-F540 HydrophobicContact CE-CE1 3.64Å; M503-F540 HydrophobicContact CE-CE2 4.14Å; M503-F540 HydrophobicContact CE-CZ 3.64Å; L508-F540 HydrophobicContact CB-CB 3.85Å; L508-F540 HydrophobicContact CB-CD1 4.12Å; L508-F540 HydrophobicContact CB-CG 4.17Å; L508-F540 HydrophobicContact CD2-CB 3.66Å; L508-F540 HydrophobicContact CG-CB 4.41Å; I535-F540 HydrophobicContact CG2-CB 4.5Å; P536-F540 PolarHBondContact O-N 3.27Å; E537-F540 HydrophobicContact CB-CD1 4.27Å; E537-F540 HydrophobicContact CB-CE1 3.7Å; E537-F540 HydrophobicContact CB-CZ 4.47Å; E537-F540 HydrophobicContact CG-CD1 4.39Å; E537-F540 HydrophobicContact CG-CE1 3.5Å; E537-F540 VanDerWaalsContact CG-CE1 3.5Å; E537-F540 HydrophobicContact CG-CZ 3.77Å; E537-F540 VanDerWaalsContact O-CD1 3.22Å; E537-F540 WeakPolarHBondContact O-CD1 3.28Å; E537-F540 WeakPolarHBondContact O-CG 3.37Å; E537-F540 PolarHBondContact O-N 3.15Å; E537-F540 VanDerWaalsContact O-N 3.14Å; F540-C542 VanDerWaalsContact C-N 3.31Å; F540-C542 PolarHBondContact O-N 3.35Å; F540-R543 WeakPolarHBondContact O-CA 3.34Å; F540-R543 PolarHBondContact O-N 3.04Å
541	Q	67.8	Low	80.5	Confident	49 Å²	49	60.6 Å²	60.6	23%	0.229	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-41.9	179.3	-69.6	178.8	-5.6	0	0	110.7	Y467 E537 R543	Y467-Q541 PolarHBondContact OH-NE2 2.88Å; E537-Q541 HydrophobicContact CG-CG 4.35Å; E537-Q541 VanDerWaalsContact CG-NE2 3.32Å; E537-Q541 WeakPolarHBondContact O-CG 3.28Å; E537-Q541 PolarHBondContact O-N 3.04Å; E537-Q541 VanDerWaalsContact O-N 3.13Å; E537-Q541 PolarHBondContact OE1-NE2 3.28Å; Q541-R543 PolarHBondContact O-N 3.14Å; Q541-R543 VanDerWaalsContact O-N 3.16Å
542	C	75	Confident	80.7	Confident	26 Å²	26	62.2 Å²	62.2	18%	0.176	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	7.8	173.4	-63.2	0	0	0	0	114.9	C472 F540 C544	C472-C542 VanDerWaalsContact CA-SG 3.58Å; C472-C542 HydrophobicContact CB-CB 3.79Å; C472-C542 WeakPolarHBondContact CB-SG 3.5Å; C472-C542 WeakPolarHBondContact SG-CA 2.96Å; C472-C542 WeakPolarHBondContact SG-CB 3.49Å; C472-C542 CovalentContact SG-SG 2.05Å; C472-C542 PolarHBondContact SG-SG 3.24Å; F540-C542 VanDerWaalsContact C-N 3.31Å; F540-C542 PolarHBondContact O-N 3.35Å; C542-C544 PolarHBondContact O-N 2.79Å; C542-C544 PolarHBondContact O-SG 2.83Å
543	R	70.7	Confident	80.9	Confident	149 Å²	149	62.4 Å²	62.4	56%	0.562	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34.4	-177.5	-52.1	-178.6	-176.5	-174.6	1.5	112.9	D465 N539 F540 Q541 R546	D465-R543 IonicContact OD2-NH2 3.7Å; N539-R543 PolarHBondContact O-N 2.82Å; F540-R543 WeakPolarHBondContact O-CA 3.34Å; F540-R543 PolarHBondContact O-N 3.04Å; Q541-R543 PolarHBondContact O-N 3.14Å; Q541-R543 VanDerWaalsContact O-N 3.16Å; R543-R546 WeakPolarHBondContact O-CG 3.47Å
544	C	76.6	Confident	81.1	Confident	19 Å²	19	62.4 Å²	62.4	13%	0.128	29%	0.288	C	S	.	.			trans	-115.5	127.1	179	-45.4	0	0	0	0	110.9	C475 N539 C542	C475-C544 WeakPolarHBondContact CA-SG 3.48Å; C475-C544 HydrophobicContact CB-CB 3.95Å; C475-C544 WeakPolarHBondContact CB-SG 3.33Å; C475-C544 WeakPolarHBondContact SG-CB 3.43Å; C475-C544 CovalentContact SG-SG 2.03Å; C475-C544 PolarHBondContact SG-SG 3.15Å; N539-C544 CarbonylContact C-O 3.47Å; N539-C544 WeakPolarHBondContact CB-O 3.28Å; N539-C544 PolarHBondContact O-N 3.16Å; C542-C544 PolarHBondContact O-N 2.79Å; C542-C544 PolarHBondContact O-SG 2.83Å
545	P	77.9	Confident	81.4	Confident	23 Å²	23	62.1 Å²	62.1	15%	0.149	29%	0.287	C	S	.	.	S	Bend	cis	-74.8	151.1	-16.4	31.2	-37.8	0	0	0	113.5	M478 I535 L547 L571 F577	M478-P545 HydrophobicContact CE-CB 3.44Å; M478-P545 VanDerWaalsContact CE-CB 3.44Å; I535-P545 HydrophobicContact CD1-CG 4.21Å; P545-L547 VanDerWaalsContact C-N 3.29Å; P545-L547 HydrophobicContact CB-CG 4.36Å; P545-L547 HydrophobicContact CG-CD1 4.28Å; P545-L547 HydrophobicContact CG-CG 4.06Å; P545-L547 PolarHBondContact O-N 3.44Å; P545-L571 HydrophobicContact CG-CD1 3.59Å; P545-F577 HydrophobicContact CB-CD2 4.15Å; P545-F577 HydrophobicContact CG-CD2 3.89Å; P545-F577 HydrophobicContact CG-CE2 3.78Å; P545-F577 HydrophobicContact CG-CG 4.5Å; P545-F577 HydrophobicContact CG-CZ 4.26Å
546	R	77.9	Confident	81.7	Confident	180 Å²	180	62.1 Å²	62.1	68%	0.679	29%	0.287	S	S	*	.			trans	-79.7	69.2	176.5	-61.5	-175.6	-178.9	174.4	-1.2	112.2	R543	R543-R546 WeakPolarHBondContact O-CG 3.47Å
547	L	85.6	Confident	82.3	Confident	13 Å²	13	61.4 Å²	61.4	7%	0.068	28%	0.283	C	S	.	.			trans	-75.5	131	174.5	-59.8	179.1	0	0	0	110.6	V498 Y510 P545 Y553 F577	V498-L547 HydrophobicContact CG2-CB 4.38Å; Y510-L547 HydrophobicContact CD2-CD1 4.15Å; Y510-L547 HydrophobicContact CE1-CB 4.07Å; Y510-L547 HydrophobicContact CE2-CB 4.41Å; Y510-L547 HydrophobicContact CE2-CD1 4.26Å; Y510-L547 HydrophobicContact CG-CD1 4.43Å; P545-L547 VanDerWaalsContact C-N 3.29Å; P545-L547 HydrophobicContact CB-CG 4.36Å; P545-L547 HydrophobicContact CG-CD1 4.28Å; P545-L547 HydrophobicContact CG-CG 4.06Å; P545-L547 PolarHBondContact O-N 3.44Å; L547-Y553 HydrophobicContact CD2-CD1 3.89Å; L547-Y553 HydrophobicContact CD2-CD2 4.13Å; L547-Y553 HydrophobicContact CD2-CE1 3.8Å; L547-Y553 HydrophobicContact CD2-CE2 4.04Å; L547-Y553 HydrophobicContact CD2-CG 4.06Å; L547-F577 HydrophobicContact CD1-CD1 4.1Å; L547-F577 HydrophobicContact CD1-CE1 3.71Å; L547-F577 HydrophobicContact CD1-CZ 4.22Å; L547-F577 HydrophobicContact CD2-CB 4.26Å; L547-F577 HydrophobicContact CD2-CD1 3.58Å; L547-F577 HydrophobicContact CD2-CE1 4.09Å; L547-F577 HydrophobicContact CD2-CG 4.01Å; L547-F577 HydrophobicContact CG-CD1 4.41Å; L547-F577 HydrophobicContact CG-CE1 4.47Å
548	R	86.7	Confident	83	Confident	174 Å²	174	59 Å²	59	66%	0.657	27%	0.273	S	S	*	.			trans	-104.6	133.9	179.9	-63.5	-176.7	-177.9	-173.3	0.8	109.6	K551 Y553	R548-K551 HydrophobicContact CB-CB 4.17Å; R548-K551 HydrophobicContact CB-CG 3.74Å; R548-K551 WeakPolarHBondContact O-CB 3.37Å; R548-K551 PolarHBondContact O-N 2.85Å; R548-Y553 PolarHBondContact N-OH 2.89Å
549	L	89.2	Confident	83	Confident	86 Å²	86	55.3 Å²	55.3	45%	0.45	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	143.9	173.8	-59.4	-178.5	0	0	0	110.5	V498 K501 Y510 K551	V498-L549 HydrophobicContact CG1-CD2 3.71Å; K501-L549 HydrophobicContact CB-CD2 4.16Å; K501-L549 HydrophobicContact CG-CD2 4.21Å; Y510-L549 HydrophobicContact CD1-CD2 4.48Å; Y510-L549 HydrophobicContact CE1-CD2 4.47Å; L549-K551 PolarHBondContact O-N 3.42Å; L549-K551 VanDerWaalsContact O-N 3.08Å
550	G	89	Confident	82.1	Confident	43 Å²	43	59 Å²	59	44%	0.443	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	-15.1	-177.2	0	0	0	0	0	115.2	Q497 V498	Q497-G550 PolarHBondContact NE2-O 3.42Å; V498-G550 WeakPolarHBondContact O-CA 3.35Å; V498-G550 PolarHBondContact O-N 3.4Å
551	K	92.7	Very high	81.3	Confident	125 Å²	125	60.3 Å²	60.3	54%	0.543	30%	0.297	S	S	.	.			trans	-82.2	148.1	179.6	-65.1	-64	-175.4	-179	0	111.4	V498 R548 L549 Y553	V498-K551 PolarHBondContact N-O 3.13Å; R548-K551 HydrophobicContact CB-CB 4.17Å; R548-K551 HydrophobicContact CB-CG 3.74Å; R548-K551 WeakPolarHBondContact O-CB 3.37Å; R548-K551 PolarHBondContact O-N 2.85Å; L549-K551 PolarHBondContact O-N 3.42Å; L549-K551 VanDerWaalsContact O-N 3.08Å; K551-Y553 HydrophobicContact CB-CD2 4.47Å; K551-Y553 HydrophobicContact CB-CE2 3.65Å
552	K	94	Very high	80.5	Confident	84 Å²	84	64.9 Å²	64.9	37%	0.365	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	142.6	175.8	-67.1	-178.1	172.2	-157.4	0	110.5	E495 A496 Q497 W580	E495-K552 WeakPolarHBondContact OE1-CD 3.43Å; E495-K552 IonicContact OE1-NZ 2.89Å; E495-K552 PolarHBondContact OE1-NZ 3.1Å; A496-K552 CarbonylContact O-C 3.42Å; A496-K552 WeakPolarHBondContact O-CA 3.41Å; Q497-K552 HydrophobicContact CB-CG 4.21Å; Q497-K552 HydrophobicContact CG-CG 4.29Å; K552-W580 HydrophobicContact CB-CB 3.49Å; K552-W580 VanDerWaalsContact CB-CB 3.49Å; K552-W580 HydrophobicContact CB-CG 3.96Å; K552-W580 HydrophobicContact CD-CG 4.44Å; K552-W580 VanDerWaalsContact O-CB 3.28Å; K552-W580 WeakPolarHBondContact O-CB 3.43Å; K552-W580 PolarHBondContact O-N 2.84Å
553	Y	94.3	Very high	79.7	Confident	12 Å²	12	65.9 Å²	65.9	5%	0.047	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.2	177.6	-65.1	-93.1	0	0	0	110.6	A496 V498 L547 R548 K551 L578 P579	A496-Y553 PolarHBondContact N-O 3.36Å; A496-Y553 PolarHBondContact O-N 3.49Å; V498-Y553 HydrophobicContact CG2-CD2 3.75Å; V498-Y553 HydrophobicContact CG2-CE2 3.81Å; L547-Y553 HydrophobicContact CD2-CD1 3.89Å; L547-Y553 HydrophobicContact CD2-CD2 4.13Å; L547-Y553 HydrophobicContact CD2-CE1 3.8Å; L547-Y553 HydrophobicContact CD2-CE2 4.04Å; L547-Y553 HydrophobicContact CD2-CG 4.06Å; R548-Y553 PolarHBondContact N-OH 2.89Å; K551-Y553 HydrophobicContact CB-CD2 4.47Å; K551-Y553 HydrophobicContact CB-CE2 3.65Å; Y553-L578 CarbonylContact C-O 3.28Å; Y553-L578 VanDerWaalsContact CA-O 3.22Å; Y553-L578 WeakPolarHBondContact CA-O 3.35Å; Y553-P579 HydrophobicContact CE1-CB 4.39Å; Y553-P579 HydrophobicContact CE1-CG 4.24Å
554	L	93.9	Very high	79.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.7	157.4	170.2	63.7	0	0	0	107.7	L482 A493 I494 M556 F577 L578 W580 M584 L588	L482-L554 HydrophobicContact CD1-CD2 4.01Å; L482-L554 HydrophobicContact CD2-CD2 3.76Å; L482-L554 HydrophobicContact CG-CD2 4.43Å; A493-L554 HydrophobicContact CB-CD1 4.31Å; I494-L554 WeakPolarHBondContact O-CA 3.3Å; L554-M556 HydrophobicContact CD1-CG 3.93Å; L554-M556 HydrophobicContact CD2-CE 4.04Å; L554-M556 HydrophobicContact CD2-CG 4.3Å; L554-M556 HydrophobicContact CD2-SD 4.02Å; L554-M556 HydrophobicContact CG-CG 3.99Å; L554-M556 HydrophobicContact CG-SD 4.38Å; L554-F577 WeakPolarHBondContact O-CA 3.31Å; L554-L578 HydrophobicContact CB-CB 4.27Å; L554-L578 HydrophobicContact CD2-CD1 4.04Å; L554-L578 PolarHBondContact N-O 2.93Å; L554-L578 PolarHBondContact O-N 2.04Å; L554-W580 HydrophobicContact CB-CE3 4.07Å; L554-W580 HydrophobicContact CB-CZ3 4.14Å; L554-M584 HydrophobicContact CB-SD 3.91Å; L554-M584 HydrophobicContact CD2-SD 4.3Å; L554-L588 HydrophobicContact CD1-CD1 3.73Å; L554-L588 HydrophobicContact CD1-CD2 3.95Å; L554-L588 HydrophobicContact CD1-CG 4.47Å; L554-L588 HydrophobicContact CD2-CD1 4.01Å; L554-L588 HydrophobicContact CD2-CD2 3.97Å; L554-L588 HydrophobicContact CD2-CG 4.32Å; L554-L588 HydrophobicContact CG-CD1 4.34Å
555	I	92.8	Very high	78.9	Confident	2 Å²	2	70 Å²	70	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.2	176.4	-48.7	178.8	0	0	0	108	Y492 A493 I494 A496 L512 I533 T575 V576 F577	Y492-I555 HydrophobicContact CE2-CG2 4.2Å; A493-I555 WeakPolarHBondContact CA-O 3.42Å; I494-I555 HydrophobicContact CD1-CB 4.27Å; I494-I555 HydrophobicContact CG1-CB 3.8Å; I494-I555 PolarHBondContact N-O 2.95Å; I494-I555 PolarHBondContact O-N 3.02Å; A496-I555 HydrophobicContact CB-CD1 3.75Å; A496-I555 HydrophobicContact CB-CG1 4.39Å; L512-I555 HydrophobicContact CD1-CD1 3.59Å; L512-I555 HydrophobicContact CD2-CD1 4.4Å; I533-I555 HydrophobicContact CD1-CG2 4.27Å; I555-T575 HydrophobicContact CG2-CG2 4.09Å; I555-V576 WeakPolarHBondContact CA-O 3.32Å; I555-F577 HydrophobicContact CB-CD1 4.46Å; I555-F577 HydrophobicContact CB-CE1 4.48Å; I555-F577 HydrophobicContact CD1-CD1 4.15Å; I555-F577 HydrophobicContact CD1-CE1 3.83Å; I555-F577 HydrophobicContact CG1-CD1 3.78Å; I555-F577 HydrophobicContact CG1-CE1 3.9Å; I555-F577 HydrophobicContact CG2-CD1 4.19Å; I555-F577 HydrophobicContact CG2-CE1 3.85Å; I555-F577 HydrophobicContact CG2-CZ 4.31Å
556	M	92	Very high	78.8	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.6	174.9	-54	178.1	-72	0	0	109.9	L482 R486 L487 R490 Y492 A493 L554 T575 V576	L482-M556 HydrophobicContact CD1-CE 3.4Å; L482-M556 VanDerWaalsContact CD1-CE 3.4Å; L482-M556 HydrophobicContact CD1-SD 3.62Å; R486-M556 HydrophobicContact CG-CE 4.22Å; L487-M556 HydrophobicContact CD1-SD 4.03Å; R490-M556 HydrophobicContact CB-CB 4.12Å; R490-M556 HydrophobicContact CG-CB 3.92Å; Y492-M556 VanDerWaalsContact O-CA 3.23Å; Y492-M556 WeakPolarHBondContact O-CA 3.21Å; A493-M556 HydrophobicContact CB-CG 3.68Å; A493-M556 HydrophobicContact CB-SD 4.28Å; L554-M556 HydrophobicContact CD1-CG 3.93Å; L554-M556 HydrophobicContact CD2-CE 4.04Å; L554-M556 HydrophobicContact CD2-CG 4.3Å; L554-M556 HydrophobicContact CD2-SD 4.02Å; L554-M556 HydrophobicContact CG-CG 3.99Å; L554-M556 HydrophobicContact CG-SD 4.38Å; M556-T575 CarbonylContact O-C 3.25Å; M556-T575 WeakPolarHBondContact O-CA 3.07Å; M556-V576 HydrophobicContact CE-CB 4.25Å; M556-V576 HydrophobicContact CE-CG1 4.07Å; M556-V576 PolarHBondContact N-O 3.1Å; M556-V576 PolarHBondContact O-N 3.3Å
557	G	89.8	Confident	78.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	-179.4	-177.7	0	0	0	0	0	112.7	R490 E491 Y492	R490-G557 CarbonylContact C-O 3.54Å; E491-G557 PolarHBondContact N-O 3.46Å; Y492-G557 WeakPolarHBondContact CD1-O 3.46Å; Y492-G557 VanDerWaalsContact CE1-C 3.45Å; Y492-G557 VanDerWaalsContact CZ-CA 3.48Å; Y492-G557 PolarHBondContact N-O 3.12Å; Y492-G557 PolarHBondContact O-N 2.63Å
558	L	84.9	Confident	78.6	Confident	50 Å²	50	67.7 Å²	67.7	26%	0.262	37%	0.37	S	S	.	.			trans	-93.7	141.6	163.4	-59.6	177.5	0	0	0	107.5	R489 E491 N560 H574	R489-L558 WeakPolarHBondContact O-CD2 3.41Å; E491-L558 HydrophobicContact CG-CD2 3.87Å; L558-N560 PolarHBondContact O-N 3.44Å; L558-H574 HydrophobicContact CB-CB 4.41Å; L558-H574 HydrophobicContact CD1-CB 3.67Å; L558-H574 VanDerWaalsContact CD1-CD2 3.48Å; L558-H574 WeakPolarHBondContact CD1-CD2 3.3Å; L558-H574 VanDerWaalsContact CD1-CG 3.44Å; L558-H574 HydrophobicContact CG-CB 3.73Å
559	G	70	Confident	78.6	Confident	35 Å²	35	60.1 Å²	60.1	36%	0.361	34%	0.342	S	S	.	.			trans	-68	119.7	171.5	0	0	0	0	0	109.5	E491	E491-G559 VanDerWaalsContact OE2-CA 3.24Å; E491-G559 WeakPolarHBondContact OE2-CA 3.35Å; E491-G559 PolarHBondContact OE2-N 3.01Å
560	N	53.1	Low	78.4	Confident	119 Å²	119	57.3 Å²	57.3	64%	0.636	33%	0.329	S	S	*	.			trans	-172.3	141.4	164.2	-115.5	-4.6	0	0	0	105.9	L558	L558-N560 PolarHBondContact O-N 3.44Å
561	T	53.3	Low	78	Confident	77 Å²	77	56 Å²	56	47%	0.472	31%	0.312	S	S	.	.			cis	-143	151.4	10.6	35.7	0	0	0	0	107.9	N563	T561-N563 PolarHBondContact O-N 3.09Å
562	L	50.6	Low	77.4	Confident	146 Å²	146	52.3 Å²	52.3	76%	0.764	30%	0.298	S	S	*	.			trans	-65.5	76.7	166.4	-74.7	149.7	0	0	0	109.2	P564	L562-P564 WeakPolarHBondContact O-CD 3.14Å
563	N	59.5	Low	76.7	Confident	46 Å²	46	56.1 Å²	56.1	25%	0.246	31%	0.314	C	S	.	.			trans	-95	106.6	165.5	-166.7	-31.5	0	0	0	108	T561 N565 R566	T561-N563 PolarHBondContact O-N 3.09Å; N563-N565 PolarHBondContact O-N 3.37Å; N563-N565 VanDerWaalsContact O-N 3.17Å; N563-N565 WeakPolarHBondContact OD1-CB 3.26Å; N563-N565 PolarHBondContact OD1-N 3.48Å; N563-R566 HydrophobicContact CB-CB 4.33Å; N563-R566 PolarHBondContact ND2-NH2 3.4Å; N563-R566 CarbonylContact O-C 3.53Å; N563-R566 VanDerWaalsContact O-C 3.24Å; N563-R566 PolarHBondContact O-N 3.01Å
564	P	63.2	Low	76.2	Confident	117 Å²	117	58.6 Å²	58.6	76%	0.76	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-27	179.7	21.3	-30.1	0	0	0	112.7	L562 R566	L562-P564 WeakPolarHBondContact O-CD 3.14Å; P564-R566 VanDerWaalsContact C-N 3.34Å
565	N	67.5	Low	75.9	Confident	137 Å²	137	59.2 Å²	59.2	73%	0.733	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.2	178.4	-61.9	-5.4	0	0	0	112.9	N563	N563-N565 PolarHBondContact O-N 3.37Å; N563-N565 VanDerWaalsContact O-N 3.17Å; N563-N565 WeakPolarHBondContact OD1-CB 3.26Å; N563-N565 PolarHBondContact OD1-N 3.48Å
566	R	74.6	Confident	75.7	Confident	63 Å²	63	59.5 Å²	59.5	24%	0.238	33%	0.332	C	S	.	.	S	Bend	trans	-138.5	72.9	-178.4	-72.8	-175.7	-76.4	-105.7	0.5	110.7	W534 N563 P564 G568	W534-R566 HydrophobicContact CD2-CB 4.13Å; W534-R566 HydrophobicContact CD2-CG 4.15Å; W534-R566 HydrophobicContact CE3-CG 4.12Å; W534-R566 HydrophobicContact CG-CB 4.44Å; W534-R566 HydrophobicContact CH2-CG 4.09Å; W534-R566 HydrophobicContact CZ2-CB 4.2Å; W534-R566 HydrophobicContact CZ2-CG 4.15Å; W534-R566 HydrophobicContact CZ3-CG 4.07Å; N563-R566 HydrophobicContact CB-CB 4.33Å; N563-R566 PolarHBondContact ND2-NH2 3.4Å; N563-R566 CarbonylContact O-C 3.53Å; N563-R566 VanDerWaalsContact O-C 3.24Å; N563-R566 PolarHBondContact O-N 3.01Å; P564-R566 VanDerWaalsContact C-N 3.34Å; R566-G568 PolarHBondContact O-N 2.97Å
567	P	76.2	Confident	75.4	Confident	81 Å²	81	60 Å²	60	53%	0.526	33%	0.334	S	S	.	.			trans	-64	128.7	177.3	26.4	-33.2	0	0	0	110.2	W534	W534-P567 PolarHBondContact NE1-O 2.75Å
568	G	83.8	Confident	75.4	Confident	25 Å²	25	60.4 Å²	60.4	26%	0.258	34%	0.336	S	S	.	.	S	Bend	trans	135	-162.2	173.9	0	0	0	0	0	113.9	E531 S532 R566	E531-G568 VanDerWaalsContact OE1-CA 3.27Å; E531-G568 WeakPolarHBondContact OE1-CA 3.41Å; S532-G568 CarbonylContact O-C 3.58Å; S532-G568 VanDerWaalsContact O-CA 3.27Å; S532-G568 WeakPolarHBondContact O-CA 3.34Å; R566-G568 PolarHBondContact O-N 2.97Å
569	I	85.9	Confident	75.7	Confident	14 Å²	14	61.2 Å²	61.2	7%	0.072	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.4	179.5	-61	170.3	0	0	0	108.6	Y492 I494 L526 S532 I533 W534	Y492-I569 HydrophobicContact CE2-CD1 4.07Å; Y492-I569 WeakPolarHBondContact OH-CG2 3.17Å; I494-I569 HydrophobicContact CD1-CD1 3.88Å; L526-I569 HydrophobicContact CD1-CD1 4Å; L526-I569 HydrophobicContact CD1-CG1 4.36Å; S532-I569 PolarHBondContact O-N 3.44Å; I533-I569 CarbonylContact C-O 3.6Å; I533-I569 WeakPolarHBondContact CA-O 3.27Å; I533-I569 HydrophobicContact CB-CB 4.24Å; I533-I569 HydrophobicContact CD1-CB 4.05Å; I533-I569 HydrophobicContact CD1-CG2 3.63Å; I533-I569 HydrophobicContact CG1-CB 3.94Å; I533-I569 HydrophobicContact CG1-CG2 3.88Å; I533-I569 WeakPolarHBondContact CG1-O 3.19Å; W534-I569 PolarHBondContact N-O 3.38Å
570	V	84.7	Confident	76.7	Confident	27 Å²	27	62 Å²	62	16%	0.164	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129	170.3	-177.2	0	0	0	0	109.4	W507 W534 N572	W507-V570 HydrophobicContact CZ3-CG1 4.23Å; W534-V570 HydrophobicContact CB-CG2 4.41Å; V570-N572 PolarHBondContact O-N 2.92Å
571	L	81.5	Confident	78.5	Confident	17 Å²	17	63 Å²	63	9%	0.089	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-67.9	122.7	176.1	-172.4	148.8	0	0	0	109.8	W534 I535 N539 P545 F577	W534-L571 WeakPolarHBondContact O-CB 3.45Å; W534-L571 PolarHBondContact O-N 2.9Å; I535-L571 HydrophobicContact CD1-CD1 3.99Å; I535-L571 HydrophobicContact CG1-CB 4.21Å; I535-L571 HydrophobicContact CG1-CD1 3.91Å; I535-L571 HydrophobicContact CG2-CD1 4.33Å; N539-L571 VanDerWaalsContact ND2-CD2 3.26Å; N539-L571 WeakPolarHBondContact ND2-CD2 3.46Å; P545-L571 HydrophobicContact CG-CD1 3.59Å; L571-F577 HydrophobicContact CD1-CE2 3.49Å; L571-F577 VanDerWaalsContact CD1-CE2 3.49Å; L571-F577 HydrophobicContact CD1-CZ 3.84Å; L571-F577 HydrophobicContact CG-CE2 4.24Å
572	N	79.8	Confident	80.1	Confident	47 Å²	47	68.8 Å²	68.8	25%	0.251	36%	0.357	S	S	.	.			trans	-132.2	177.5	177.1	63.5	42.4	0	0	0	110.6	V570 H574 T575	V570-N572 PolarHBondContact O-N 2.92Å; N572-H574 PolarHBondContact O-N 3.36Å; N572-H574 VanDerWaalsContact OD1-CA 3.24Å; N572-H574 WeakPolarHBondContact OD1-CA 3.27Å; N572-H574 VanDerWaalsContact OD1-CB 3.27Å; N572-H574 WeakPolarHBondContact OD1-CB 3.36Å; N572-H574 PolarHBondContact OD1-N 3.27Å; N572-T575 PolarHBondContact N-OG1 2.77Å; N572-T575 VanDerWaalsContact N-OG1 3.1Å; N572-T575 PolarHBondContact O-N 2.99Å; N572-T575 PolarHBondContact O-OG1 3.45Å; N572-T575 PolarHBondContact OD1-N 3.16Å; N572-T575 PolarHBondContact OD1-OG1 3.01Å
573	K	79.1	Confident	81.9	Confident	163 Å²	163	64.1 Å²	64.1	71%	0.709	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-7.3	177.4	69.3	-176.6	176.6	-174.6	0	114.4	R476	R476-K573 PolarHBondContact NH1-O 3.47Å
574	H	84.2	Confident	83.4	Confident	65 Å²	65	63 Å²	63	30%	0.301	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-12	175.9	-56.2	-67.7	0	0	0	112.7	R490 L558 N572 V576	R490-H574 WeakPolarHBondContact CD-O 3.3Å; R490-H574 PolarHBondContact NE-O 3.41Å; R490-H574 PolarHBondContact NH2-O 3.41Å; L558-H574 HydrophobicContact CB-CB 4.41Å; L558-H574 HydrophobicContact CD1-CB 3.67Å; L558-H574 VanDerWaalsContact CD1-CD2 3.48Å; L558-H574 WeakPolarHBondContact CD1-CD2 3.3Å; L558-H574 VanDerWaalsContact CD1-CG 3.44Å; L558-H574 HydrophobicContact CG-CB 3.73Å; N572-H574 PolarHBondContact O-N 3.36Å; N572-H574 VanDerWaalsContact OD1-CA 3.24Å; N572-H574 WeakPolarHBondContact OD1-CA 3.27Å; N572-H574 VanDerWaalsContact OD1-CB 3.27Å; N572-H574 WeakPolarHBondContact OD1-CB 3.36Å; N572-H574 PolarHBondContact OD1-N 3.27Å; H574-V576 PolarHBondContact O-N 3.41Å
575	T	86.7	Confident	84.8	Confident	13 Å²	13	60.4 Å²	60.4	8%	0.08	32%	0.315	C	S	.	.			trans	-70.6	129.9	175	-44.8	0	0	0	0	110.5	I533 I555 M556 N572 F577	I533-T575 HydrophobicContact CD1-CG2 4.46Å; I555-T575 HydrophobicContact CG2-CG2 4.09Å; M556-T575 CarbonylContact O-C 3.25Å; M556-T575 WeakPolarHBondContact O-CA 3.07Å; N572-T575 PolarHBondContact N-OG1 2.77Å; N572-T575 VanDerWaalsContact N-OG1 3.1Å; N572-T575 PolarHBondContact O-N 2.99Å; N572-T575 PolarHBondContact O-OG1 3.45Å; N572-T575 PolarHBondContact OD1-N 3.16Å; N572-T575 PolarHBondContact OD1-OG1 3.01Å; T575-F577 HydrophobicContact CG2-CD2 4.25Å; T575-F577 HydrophobicContact CG2-CE2 3.46Å; T575-F577 VanDerWaalsContact CG2-CE2 3.46Å; T575-F577 HydrophobicContact CG2-CZ 3.67Å
576	V	88.5	Confident	86	Confident	8 Å²	8	58.1 Å²	58.1	5%	0.048	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131	178.4	178.2	0	0	0	0	108.3	P479 I555 M556 H574 L578	P479-V576 HydrophobicContact CG-CG1 3.81Å; I555-V576 WeakPolarHBondContact CA-O 3.32Å; M556-V576 HydrophobicContact CE-CB 4.25Å; M556-V576 HydrophobicContact CE-CG1 4.07Å; M556-V576 PolarHBondContact N-O 3.1Å; M556-V576 PolarHBondContact O-N 3.3Å; H574-V576 PolarHBondContact O-N 3.41Å; V576-L578 HydrophobicContact CG1-CD2 4.31Å; V576-L578 HydrophobicContact CG1-CG 4.4Å
577	F	87.5	Confident	86.8	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.039	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.7	173.4	-61.3	-94.3	0	0	0	108.8	M478 I533 P545 L547 L554 I555 L571 T575	M478-F577 HydrophobicContact CE-CB 3.84Å; M478-F577 HydrophobicContact SD-CB 4.41Å; I533-F577 HydrophobicContact CD1-CE1 3.76Å; I533-F577 HydrophobicContact CD1-CZ 3.45Å; I533-F577 VanDerWaalsContact CD1-CZ 3.45Å; I533-F577 HydrophobicContact CG1-CZ 4.5Å; P545-F577 HydrophobicContact CB-CD2 4.15Å; P545-F577 HydrophobicContact CG-CD2 3.89Å; P545-F577 HydrophobicContact CG-CE2 3.78Å; P545-F577 HydrophobicContact CG-CG 4.5Å; P545-F577 HydrophobicContact CG-CZ 4.26Å; L547-F577 HydrophobicContact CD1-CD1 4.1Å; L547-F577 HydrophobicContact CD1-CE1 3.71Å; L547-F577 HydrophobicContact CD1-CZ 4.22Å; L547-F577 HydrophobicContact CD2-CB 4.26Å; L547-F577 HydrophobicContact CD2-CD1 3.58Å; L547-F577 HydrophobicContact CD2-CE1 4.09Å; L547-F577 HydrophobicContact CD2-CG 4.01Å; L547-F577 HydrophobicContact CG-CD1 4.41Å; L547-F577 HydrophobicContact CG-CE1 4.47Å; L554-F577 WeakPolarHBondContact O-CA 3.31Å; I555-F577 HydrophobicContact CB-CD1 4.46Å; I555-F577 HydrophobicContact CB-CE1 4.48Å; I555-F577 HydrophobicContact CD1-CD1 4.15Å; I555-F577 HydrophobicContact CD1-CE1 3.83Å; I555-F577 HydrophobicContact CG1-CD1 3.78Å; I555-F577 HydrophobicContact CG1-CE1 3.9Å; I555-F577 HydrophobicContact CG2-CD1 4.19Å; I555-F577 HydrophobicContact CG2-CE1 3.85Å; I555-F577 HydrophobicContact CG2-CZ 4.31Å; L571-F577 HydrophobicContact CD1-CE2 3.49Å; L571-F577 VanDerWaalsContact CD1-CE2 3.49Å; L571-F577 HydrophobicContact CD1-CZ 3.84Å; L571-F577 HydrophobicContact CG-CE2 4.24Å; T575-F577 HydrophobicContact CG2-CD2 4.25Å; T575-F577 HydrophobicContact CG2-CE2 3.46Å; T575-F577 VanDerWaalsContact CG2-CE2 3.46Å; T575-F577 HydrophobicContact CG2-CZ 3.67Å
578	L	89.4	Confident	87.6	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.047	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.4	165.9	-56.1	-177.7	0	0	0	108.5	P479 L482 Y553 L554 V576 W580	P479-L578 HydrophobicContact CG-CD2 4.32Å; P479-L578 WeakPolarHBondContact O-CD2 3.24Å; L482-L578 HydrophobicContact CB-CD1 4Å; Y553-L578 CarbonylContact C-O 3.28Å; Y553-L578 VanDerWaalsContact CA-O 3.22Å; Y553-L578 WeakPolarHBondContact CA-O 3.35Å; L554-L578 HydrophobicContact CB-CB 4.27Å; L554-L578 HydrophobicContact CD2-CD1 4.04Å; L554-L578 PolarHBondContact N-O 2.93Å; L554-L578 PolarHBondContact O-N 2.04Å; V576-L578 HydrophobicContact CG1-CD2 4.31Å; V576-L578 HydrophobicContact CG1-CG 4.4Å; L578-W580 PolarHBondContact O-N 2.03Å
579	P	90.3	Very high	88.1	Confident	68 Å²	68	62.1 Å²	62.1	44%	0.442	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	130.9	165.3	-22.4	32.8	0	0	0	109.5	Y553 K581 M584	Y553-P579 HydrophobicContact CE1-CB 4.39Å; Y553-P579 HydrophobicContact CE1-CG 4.24Å; P579-K581 PolarHBondContact O-N 3.32Å; P579-M584 WeakPolarHBondContact O-CE 3.29Å
580	W	91.7	Very high	88.5	Confident	52 Å²	52	69.2 Å²	69.2	20%	0.197	33%	0.325	C	S	.	.			trans	-66.2	134.1	177.4	-165.8	-96.5	0	0	0	110	E495 F518 K552 L554 L578 M584 E585 L588	E495-W580 HydrophobicContact CB-CE3 4.16Å; E495-W580 HydrophobicContact CB-CH2 3.79Å; E495-W580 HydrophobicContact CB-CZ2 4.39Å; E495-W580 HydrophobicContact CB-CZ3 3.66Å; E495-W580 HydrophobicContact CG-CD2 4.06Å; E495-W580 HydrophobicContact CG-CE3 3.9Å; E495-W580 HydrophobicContact CG-CH2 3.94Å; E495-W580 HydrophobicContact CG-CZ2 4.06Å; E495-W580 HydrophobicContact CG-CZ3 3.85Å; F518-W580 AromaticContact CE2-CH2 3.62Å; F518-W580 HydrophobicContact CE2-CH2 3.62Å; F518-W580 HydrophobicContact CE2-CZ3 4.14Å; F518-W580 AromaticContact CZ-CH2 3.76Å; F518-W580 HydrophobicContact CZ-CH2 3.76Å; K552-W580 HydrophobicContact CB-CB 3.49Å; K552-W580 VanDerWaalsContact CB-CB 3.49Å; K552-W580 HydrophobicContact CB-CG 3.96Å; K552-W580 HydrophobicContact CD-CG 4.44Å; K552-W580 VanDerWaalsContact O-CB 3.28Å; K552-W580 WeakPolarHBondContact O-CB 3.43Å; K552-W580 PolarHBondContact O-N 2.84Å; L554-W580 HydrophobicContact CB-CE3 4.07Å; L554-W580 HydrophobicContact CB-CZ3 4.14Å; L578-W580 PolarHBondContact O-N 2.03Å; W580-M584 HydrophobicContact CD2-SD 4.25Å; W580-M584 HydrophobicContact CE3-CG 4.31Å; W580-M584 HydrophobicContact CE3-SD 3.79Å; W580-M584 HydrophobicContact CZ3-CG 4.25Å; W580-M584 HydrophobicContact CZ3-SD 4.18Å; W580-E585 HydrophobicContact CH2-CB 4.49Å; W580-E585 HydrophobicContact CZ2-CB 4.01Å; W580-L588 HydrophobicContact CH2-CD1 3.73Å; W580-L588 HydrophobicContact CZ3-CD1 3.63Å
581	K	90.6	Very high	89	Confident	140 Å²	140	68.8 Å²	68.8	61%	0.609	32%	0.322	S	S	*	.			trans	-127	158.5	177.5	-62	-175.7	178.1	-174.5	0	109.4	P579 M584	P579-K581 PolarHBondContact O-N 3.32Å; K581-M584 HydrophobicContact CB-CE 4.05Å; K581-M584 HydrophobicContact CG-CE 4.2Å; K581-M584 WeakPolarHBondContact O-CB 3.04Å; K581-M584 PolarHBondContact O-N 3.29Å
582	E	87	Confident	89.6	Confident	198 Å²	198	68.7 Å²	68.7	93%	0.925	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	145.1	171.7	-66.8	-176.6	169.1	0	0	111.1	M584	E582-M584 PolarHBondContact O-N 3.16Å; E582-M584 VanDerWaalsContact O-N 3.16Å
583	G	87.9	Confident	90.2	Very high	47 Å²	47	71.4 Å²	71.4	49%	0.485	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	-4.1	-174.2	0	0	0	0	0	115.7	E585 R587	G583-E585 VanDerWaalsContact C-N 3.26Å; G583-E585 PolarHBondContact O-N 3.29Å; G583-R587 PolarHBondContact O-N 3.21Å
584	M	90.9	Very high	90.8	Very high	23 Å²	23	66.1 Å²	66.1	11%	0.113	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-31.7	177.8	-170.3	169.7	-67.3	0	0	112.2	L554 P579 W580 K581 E582 R587 L588	L554-M584 HydrophobicContact CB-SD 3.91Å; L554-M584 HydrophobicContact CD2-SD 4.3Å; P579-M584 WeakPolarHBondContact O-CE 3.29Å; W580-M584 HydrophobicContact CD2-SD 4.25Å; W580-M584 HydrophobicContact CE3-CG 4.31Å; W580-M584 HydrophobicContact CE3-SD 3.79Å; W580-M584 HydrophobicContact CZ3-CG 4.25Å; W580-M584 HydrophobicContact CZ3-SD 4.18Å; K581-M584 HydrophobicContact CB-CE 4.05Å; K581-M584 HydrophobicContact CG-CE 4.2Å; K581-M584 WeakPolarHBondContact O-CB 3.04Å; K581-M584 PolarHBondContact O-N 3.29Å; E582-M584 PolarHBondContact O-N 3.16Å; E582-M584 VanDerWaalsContact O-N 3.16Å; M584-R587 PolarHBondContact O-N 3.19Å; M584-L588 HydrophobicContact CG-CD1 4Å; M584-L588 WeakPolarHBondContact O-CB 3.42Å; M584-L588 WeakPolarHBondContact O-CG 3.04Å; M584-L588 PolarHBondContact O-N 2.79Å
585	E	92.6	Very high	91.1	Very high	63 Å²	63	65 Å²	65	29%	0.294	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-53.9	177.2	-176.7	160.5	-163.7	0	0	112.2	F518 W580 G583 R587 L588 R589	F518-E585 HydrophobicContact CE1-CG 4.08Å; F518-E585 HydrophobicContact CZ-CG 4.01Å; W580-E585 HydrophobicContact CH2-CB 4.49Å; W580-E585 HydrophobicContact CZ2-CB 4.01Å; G583-E585 VanDerWaalsContact C-N 3.26Å; G583-E585 PolarHBondContact O-N 3.29Å; E585-R587 PolarHBondContact O-N 2.93Å; E585-L588 WeakPolarHBondContact O-CB 3.17Å; E585-L588 PolarHBondContact O-N 3.31Å; E585-L588 VanDerWaalsContact O-N 3.1Å; E585-R589 WeakPolarHBondContact O-CG 3.31Å; E585-R589 PolarHBondContact O-N 3.35Å; E585-R589 IonicContact OE1-CZ 3.76Å; E585-R589 VanDerWaalsContact OE1-CZ 3.26Å; E585-R589 IonicContact OE1-NE 3.9Å; E585-R589 IonicContact OE1-NH2 2.84Å; E585-R589 PolarHBondContact OE1-NH2 3.41Å
586	D	92.4	Very high	91.2	Very high	88 Å²	88	71.6 Å²	71.6	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-63.7	-33.7	179.6	-59.6	-42.6	0	0	0	112	R590	D586-R590 WeakPolarHBondContact O-CG 3.4Å; D586-R590 PolarHBondContact O-N 3.29Å; D586-R590 VanDerWaalsContact O-N 3.12Å; D586-R590 PolarHBondContact O-NE 3.02Å
587	R	92.5	Very high	91.3	Very high	112 Å²	112	77.1 Å²	77.1	42%	0.423	36%	0.363	S	S	.	.	H	α-helix	trans	-66.9	-43.6	173.5	-174.2	177.1	-179.9	153.7	6	111.6	L482 G583 M584 E585 R590 L591	L482-R587 VanDerWaalsContact O-CZ 3.26Å; L482-R587 PolarHBondContact O-NE 3.17Å; L482-R587 PolarHBondContact O-NH2 3.41Å; G583-R587 PolarHBondContact O-N 3.21Å; M584-R587 PolarHBondContact O-N 3.19Å; E585-R587 PolarHBondContact O-N 2.93Å; R587-R590 PolarHBondContact O-N 3.18Å; R587-L591 HydrophobicContact CG-CD1 4.36Å; R587-L591 VanDerWaalsContact O-CG 3.3Å; R587-L591 WeakPolarHBondContact O-CG 3.46Å; R587-L591 PolarHBondContact O-N 3.42Å
588	L	93.5	Very high	91.2	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-63.9	-44.3	176.9	-89.2	159.3	0	0	0	111.7	L482 F518 L554 W580 M584 E585 R590 L591 V592	L482-L588 HydrophobicContact CD2-CD2 3.56Å; L482-L588 HydrophobicContact CD2-CG 3.7Å; F518-L588 HydrophobicContact CD1-CB 3.87Å; F518-L588 HydrophobicContact CD2-CD1 4.02Å; F518-L588 HydrophobicContact CE1-CB 4.02Å; F518-L588 HydrophobicContact CE2-CD1 3.95Å; F518-L588 HydrophobicContact CG-CB 4.2Å; F518-L588 HydrophobicContact CG-CD1 4.37Å; F518-L588 HydrophobicContact CZ-CB 4.48Å; F518-L588 HydrophobicContact CZ-CD1 4.24Å; L554-L588 HydrophobicContact CD1-CD1 3.73Å; L554-L588 HydrophobicContact CD1-CD2 3.95Å; L554-L588 HydrophobicContact CD1-CG 4.47Å; L554-L588 HydrophobicContact CD2-CD1 4.01Å; L554-L588 HydrophobicContact CD2-CD2 3.97Å; L554-L588 HydrophobicContact CD2-CG 4.32Å; L554-L588 HydrophobicContact CG-CD1 4.34Å; W580-L588 HydrophobicContact CH2-CD1 3.73Å; W580-L588 HydrophobicContact CZ3-CD1 3.63Å; M584-L588 HydrophobicContact CG-CD1 4Å; M584-L588 WeakPolarHBondContact O-CB 3.42Å; M584-L588 WeakPolarHBondContact O-CG 3.04Å; M584-L588 PolarHBondContact O-N 2.79Å; E585-L588 WeakPolarHBondContact O-CB 3.17Å; E585-L588 PolarHBondContact O-N 3.31Å; E585-L588 VanDerWaalsContact O-N 3.1Å; L588-R590 VanDerWaalsContact C-N 3.32Å; L588-R590 PolarHBondContact O-N 2.69Å; L588-L591 PolarHBondContact O-N 3.44Å; L588-V592 VanDerWaalsContact O-CG2 3.31Å; L588-V592 WeakPolarHBondContact O-CG2 3.36Å; L588-V592 PolarHBondContact O-N 3.3Å
589	R	94.6	Very high	91.1	Very high	141 Å²	141	82.6 Å²	82.6	53%	0.532	40%	0.402	S	S	.	.	H	α-helix	trans	-59.4	-43.2	177.1	-71.3	178.2	-178.5	170.1	-3.5	111.7	F518 E585 V592 H593	F518-R589 HydrophobicContact CD1-CG 4.37Å; F518-R589 HydrophobicContact CE1-CG 4.07Å; E585-R589 WeakPolarHBondContact O-CG 3.31Å; E585-R589 PolarHBondContact O-N 3.35Å; E585-R589 IonicContact OE1-CZ 3.76Å; E585-R589 VanDerWaalsContact OE1-CZ 3.26Å; E585-R589 IonicContact OE1-NE 3.9Å; E585-R589 IonicContact OE1-NH2 2.84Å; E585-R589 PolarHBondContact OE1-NH2 3.41Å; R589-V592 PolarHBondContact O-N 3.35Å; R589-H593 WeakPolarHBondContact O-CB 3.48Å; R589-H593 PolarHBondContact O-N 2.91Å
590	R	93.7	Very high	91	Very high	163 Å²	163	80.4 Å²	80.4	62%	0.615	39%	0.388	S	S	*	.	H	α-helix	trans	-59.5	-49	173	-77.5	-179.1	-81.9	179.6	-9.7	112.2	D586 R587 L588 V592 H593 D594	D586-R590 WeakPolarHBondContact O-CG 3.4Å; D586-R590 PolarHBondContact O-N 3.29Å; D586-R590 VanDerWaalsContact O-N 3.12Å; D586-R590 PolarHBondContact O-NE 3.02Å; R587-R590 PolarHBondContact O-N 3.18Å; L588-R590 VanDerWaalsContact C-N 3.32Å; L588-R590 PolarHBondContact O-N 2.69Å; R590-V592 VanDerWaalsContact C-N 3.35Å; R590-V592 PolarHBondContact O-N 3.08Å; R590-H593 WeakPolarHBondContact O-CB 3.5Å; R590-H593 PolarHBondContact O-N 2.85Å; R590-H593 VanDerWaalsContact O-N 3.17Å; R590-D594 PolarHBondContact O-N 3.38Å
591	L	94.5	Very high	90.5	Very high	18 Å²	18	81.4 Å²	81.4	9%	0.094	41%	0.407	C	S	.	.	H	α-helix	trans	-65.5	-35.2	179.5	-66.3	175.9	0	0	0	113.4	L482 L484 L487 R587 L588 E595	L482-L591 HydrophobicContact CD2-CD1 3.66Å; L482-L591 HydrophobicContact CG-CD1 3.58Å; L484-L591 HydrophobicContact CB-CD2 3.82Å; L484-L591 HydrophobicContact CD1-CB 4.36Å; L484-L591 HydrophobicContact CD1-CD2 4.23Å; L484-L591 WeakPolarHBondContact CD1-O 3.39Å; L487-L591 VanDerWaalsContact CD2-C 3.48Å; L487-L591 HydrophobicContact CD2-CB 3.55Å; R587-L591 HydrophobicContact CG-CD1 4.36Å; R587-L591 VanDerWaalsContact O-CG 3.3Å; R587-L591 WeakPolarHBondContact O-CG 3.46Å; R587-L591 PolarHBondContact O-N 3.42Å; L588-L591 PolarHBondContact O-N 3.44Å; L591-E595 WeakPolarHBondContact O-CB 2.94Å; L591-E595 PolarHBondContact O-N 2.69Å
592	V	93.7	Very high	89.7	Confident	16 Å²	16	78.8 Å²	78.8	10%	0.097	41%	0.412	C	S	.	.	H	α-helix	trans	-68.4	-39.5	173.8	170.7	0	0	0	0	110.6	L487 F518 L588 R589 R590 E595 H596	L487-V592 HydrophobicContact CD2-CG2 3.79Å; F518-V592 HydrophobicContact CB-CG2 4.09Å; L588-V592 VanDerWaalsContact O-CG2 3.31Å; L588-V592 WeakPolarHBondContact O-CG2 3.36Å; L588-V592 PolarHBondContact O-N 3.3Å; R589-V592 PolarHBondContact O-N 3.35Å; R590-V592 VanDerWaalsContact C-N 3.35Å; R590-V592 PolarHBondContact O-N 3.08Å; V592-E595 PolarHBondContact O-N 3.36Å; V592-H596 PolarHBondContact O-N 2.95Å
593	H	93.1	Very high	89.3	Confident	103 Å²	103	72 Å²	72	48%	0.477	38%	0.38	S	S	.	.	H	α-helix	trans	-60.1	-50.2	173.1	-177.8	81.5	0	0	0	111.1	R589 R590 E595 H596 Q597	R589-H593 WeakPolarHBondContact O-CB 3.48Å; R589-H593 PolarHBondContact O-N 2.91Å; R590-H593 WeakPolarHBondContact O-CB 3.5Å; R590-H593 PolarHBondContact O-N 2.85Å; R590-H593 VanDerWaalsContact O-N 3.17Å; H593-E595 VanDerWaalsContact C-N 3.28Å; H593-E595 PolarHBondContact O-N 2.99Å; H593-H596 WeakPolarHBondContact O-CB 3.06Å; H593-H596 PolarHBondContact O-N 3.05Å; H593-Q597 PolarHBondContact CE1-NE2 2.82Å; H593-Q597 PolarHBondContact NE2-NE2 2.88Å; H593-Q597 WeakPolarHBondContact O-CG 3.05Å; H593-Q597 PolarHBondContact O-N 2.97Å
594	D	92	Very high	88.3	Confident	52 Å²	52	76 Å²	76	28%	0.278	39%	0.39	S	S	.	.	H	α-helix	trans	-56.5	-41.1	176.5	-66.5	-15.3	0	0	0	112.1	L484 R590 Q597 L599	L484-D594 HydrophobicContact CD1-CB 3.69Å; L484-D594 HydrophobicContact CD2-CB 3.84Å; L484-D594 HydrophobicContact CG-CB 4.4Å; R590-D594 PolarHBondContact O-N 3.38Å; D594-Q597 PolarHBondContact O-N 2.72Å; D594-L599 HydrophobicContact CB-CD1 3.8Å; D594-L599 VanDerWaalsContact O-CB 3.25Å; D594-L599 WeakPolarHBondContact O-CB 3.2Å; D594-L599 WeakPolarHBondContact O-CG 3.34Å; D594-L599 PolarHBondContact O-N 3.43Å
595	E	90.2	Very high	86.4	Confident	42 Å²	42	82 Å²	82	20%	0.196	42%	0.422	C	S	.	.	H	α-helix	trans	-61.5	-46.4	173.3	163.3	165.4	-161	0	0	112.2	L484 K519 L591 V592 H593 Q597 G598 C600	L484-E595 HydrophobicContact CD1-CB 4.31Å; K519-E595 VanDerWaalsContact CD-OE2 3.28Å; K519-E595 WeakPolarHBondContact CD-OE2 3.28Å; K519-E595 VanDerWaalsContact CE-CD 3.44Å; K519-E595 WeakPolarHBondContact CE-OE1 3.02Å; K519-E595 WeakPolarHBondContact CE-OE2 3.04Å; K519-E595 IonicContact NZ-OE1 2.82Å; K519-E595 PolarHBondContact NZ-OE1 3.47Å; K519-E595 IonicContact NZ-OE2 2.8Å; K519-E595 PolarHBondContact NZ-OE2 3Å; L591-E595 WeakPolarHBondContact O-CB 2.94Å; L591-E595 PolarHBondContact O-N 2.69Å; V592-E595 PolarHBondContact O-N 3.36Å; H593-E595 VanDerWaalsContact C-N 3.28Å; H593-E595 PolarHBondContact O-N 2.99Å; E595-Q597 PolarHBondContact O-N 3.01Å; E595-G598 PolarHBondContact O-N 3.19Å; E595-C600 VanDerWaalsContact CB-SG 3.59Å; E595-C600 WeakPolarHBondContact CG-SG 3.01Å
596	H	89.3	Confident	84.1	Confident	151 Å²	151	87.9 Å²	87.9	70%	0.699	45%	0.448	S	S	*	.	H	α-helix	trans	-63.4	-28.7	176.4	-71.4	168.8	0	0	0	112.7	V592 H593 G598	V592-H596 PolarHBondContact O-N 2.95Å; H593-H596 WeakPolarHBondContact O-CB 3.06Å; H593-H596 PolarHBondContact O-N 3.05Å; H596-G598 PolarHBondContact O-N 2.93Å
597	Q	89.2	Confident	81.6	Confident	124 Å²	124	93.6 Å²	93.6	58%	0.579	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	6.5	171.9	-64.1	-61.4	-20.4	0	0	113.3	H593 D594 E595 L599	H593-Q597 PolarHBondContact CE1-NE2 2.82Å; H593-Q597 PolarHBondContact NE2-NE2 2.88Å; H593-Q597 WeakPolarHBondContact O-CG 3.05Å; H593-Q597 PolarHBondContact O-N 2.97Å; D594-Q597 PolarHBondContact O-N 2.72Å; E595-Q597 PolarHBondContact O-N 3.01Å; Q597-L599 VanDerWaalsContact C-N 3.27Å; Q597-L599 HydrophobicContact CB-CG 4.3Å; Q597-L599 PolarHBondContact O-N 3.02Å
598	G	86.1	Confident	79.1	Confident	44 Å²	44	92.7 Å²	92.7	45%	0.454	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	7.4	177.4	0	0	0	0	0	114.3	E595 H596 C600 A601	E595-G598 PolarHBondContact O-N 3.19Å; H596-G598 PolarHBondContact O-N 2.93Å; G598-C600 PolarHBondContact O-N 2.66Å; G598-A601 WeakPolarHBondContact O-CB 3.4Å; G598-A601 PolarHBondContact O-N 3.01Å
599	L	87.5	Confident	76.2	Confident	90 Å²	90	99.4 Å²	99.4	47%	0.471	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-2.5	-179.9	-60.3	175.9	0	0	0	113.4	L484 D594 Q597 A601	L484-L599 HydrophobicContact CD2-CB 3.75Å; D594-L599 HydrophobicContact CB-CD1 3.8Å; D594-L599 VanDerWaalsContact O-CB 3.25Å; D594-L599 WeakPolarHBondContact O-CB 3.2Å; D594-L599 WeakPolarHBondContact O-CG 3.34Å; D594-L599 PolarHBondContact O-N 3.43Å; Q597-L599 VanDerWaalsContact C-N 3.27Å; Q597-L599 HydrophobicContact CB-CG 4.3Å; Q597-L599 PolarHBondContact O-N 3.02Å; L599-A601 VanDerWaalsContact C-N 3.35Å
600	C	87.6	Confident	73.1	Confident	21 Å²	21	95.8 Å²	95.8	14%	0.142	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.7	169.5	-68.4	0	0	0	0	113.7	C488 E595 G598 A602 F603	C488-C600 HydrophobicContact CB-CB 3.7Å; C488-C600 WeakPolarHBondContact CB-SG 3.41Å; C488-C600 WeakPolarHBondContact SG-CA 3.47Å; C488-C600 WeakPolarHBondContact SG-CB 3.11Å; C488-C600 CovalentContact SG-SG 2.03Å; C488-C600 PolarHBondContact SG-SG 3.26Å; E595-C600 VanDerWaalsContact CB-SG 3.59Å; E595-C600 WeakPolarHBondContact CG-SG 3.01Å; G598-C600 PolarHBondContact O-N 2.66Å; C600-A602 PolarHBondContact O-N 2.72Å; C600-F603 WeakPolarHBondContact O-CD2 3.43Å; C600-F603 PolarHBondContact O-N 2.81Å
601	A	80.7	Confident	70.2	Confident	73 Å²	73	94.4 Å²	94.4	60%	0.603	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-58.2	-32.7	-176.6	0	0	0	0	0	112.7	G598 L599 F603 D604	G598-A601 WeakPolarHBondContact O-CB 3.4Å; G598-A601 PolarHBondContact O-N 3.01Å; L599-A601 VanDerWaalsContact C-N 3.35Å; A601-F603 PolarHBondContact O-N 3.43Å; A601-D604 PolarHBondContact O-N 2.94Å
602	A	75.1	Confident	67.2	Low	86 Å²	86	99.9 Å²	99.9	71%	0.711	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-62.9	-7.8	176.3	0	0	0	0	0	114.5	C600	C600-A602 PolarHBondContact O-N 2.72Å
603	F	77.5	Confident	64.1	Low	54 Å²	54	103.5 Å²	103.5	24%	0.237	60%	0.602	C	S	.	*	G	3₁₀ helix	trans	-108	-1.4	179.8	-53	-57.3	0	0	0	114.7	L484 K485 C488 C600 A601	L484-F603 HydrophobicContact CB-CE2 4.27Å; L484-F603 HydrophobicContact CB-CZ 4.42Å; L484-F603 HydrophobicContact CD2-CE2 4.1Å; L484-F603 HydrophobicContact CD2-CZ 4.48Å; L484-F603 HydrophobicContact CG-CE2 3.93Å; L484-F603 HydrophobicContact CG-CZ 4.48Å; K485-F603 HydrophobicContact CB-CD1 3.81Å; K485-F603 HydrophobicContact CB-CD2 4.14Å; K485-F603 HydrophobicContact CB-CE1 3.64Å; K485-F603 HydrophobicContact CB-CE2 4.01Å; K485-F603 HydrophobicContact CB-CG 4.06Å; K485-F603 HydrophobicContact CB-CZ 3.74Å; K485-F603 HydrophobicContact CD-CD1 3.65Å; K485-F603 HydrophobicContact CD-CE1 3.97Å; K485-F603 HydrophobicContact CD-CG 4.32Å; K485-F603 HydrophobicContact CG-CB 4.32Å; K485-F603 HydrophobicContact CG-CD1 3.59Å; K485-F603 HydrophobicContact CG-CD2 4.32Å; K485-F603 HydrophobicContact CG-CE1 3.95Å; K485-F603 HydrophobicContact CG-CG 3.8Å; K485-F603 HydrophobicContact CG-CZ 4.46Å; C488-F603 HydrophobicContact CB-CD2 4.24Å; C600-F603 WeakPolarHBondContact O-CD2 3.43Å; C600-F603 PolarHBondContact O-N 2.81Å; A601-F603 PolarHBondContact O-N 3.43Å
604	D	66.6	Low	61.2	Low	131 Å²	131	103 Å²	103	70%	0.701	62%	0.616	S	S	*	*			trans	-89.2	-5.1	-175.1	-76.1	-29.2	0	0	0	114.5	A601 F606	A601-D604 PolarHBondContact O-N 2.94Å; D604-F606 PolarHBondContact O-N 3.32Å
605	D	52.8	Low	58.3	Low	149 Å²	149	107 Å²	107	80%	0.797	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	104.7	165.4	-92.7	-18.3	0	0	0	110.5
606	F	43.6	Very low	55.3	Low	188 Å²	188	113.7 Å²	113.7	83%	0.825	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	153	23.6	155.6	-101.2	-85.6	0	0	0	114	D604	D604-F606 PolarHBondContact O-N 3.32Å
607	K	40.4	Very low	52.8	Low	208 Å²	208	111.4 Å²	111.4	90%	0.904	67%	0.672	S	S	*	*	S	Bend	trans	-120.6	1	167.9	-94.6	-166.7	174	-166.7	0	116.3
608	A	38.8	Very low	50.1	Low	92 Å²	92	113.1 Å²	113.1	76%	0.76	68%	0.68	S	S	*	*			trans	-123.9	77.4	169.2	0	0	0	0	0	108.7
609	N	32.8	Very low	47.6	Very low	142 Å²	142	121.1 Å²	121.1	76%	0.759	70%	0.697	S	S	*	*			trans	-134.1	65.3	157.6	-106.4	-3.8	0	0	0	107.4
610	G	30.8	Very low	44.9	Very low	64 Å²	64	122.7 Å²	122.7	66%	0.66	71%	0.714	S	S	*	*	S	Bend	trans	-107	113.4	138.5	0	0	0	0	0	105.5
611	T	31.5	Very low	42.5	Very low	134 Å²	134	130.2 Å²	130.2	82%	0.822	75%	0.745	S	S	*	*	S	Bend	trans	74.9	110.8	168.4	31.8	0	0	0	0	120.7
612	V	31.6	Very low	40.3	Very low	134 Å²	134	130.6 Å²	130.6	81%	0.812	75%	0.748	S	S	*	*			trans	86.8	123.6	144.7	-165.8	0	0	0	0	119.1
613	A	29.7	Very low	38.1	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	75%	0.754	S	S	*	*			trans	-75.4	178.8	-178.3	0	0	0	0	0	114.4
614	A	31	Very low	36.1	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	79%	0.785	S	S	*	*			trans	85.3	128.2	176.9	0	0	0	0	0	113.5
615	T	31.1	Very low	34.4	Very low	136 Å²	136	139.8 Å²	139.8	83%	0.834	79%	0.792	S	S	*	*			cis	-160.8	149.7	18.1	0.4	0	0	0	0	109.6
616	F	28.6	Very low	33.4	Very low	182 Å²	182	138.6 Å²	138.6	80%	0.798	79%	0.79	S	S	*	*			trans	-43.1	131	163	-127.5	-114.3	0	0	0	112.7	Q618	F616-Q618 HydrophobicContact CD1-CG 4.28Å; F616-Q618 HydrophobicContact CE1-CG 4.06Å
617	S	35.6	Very low	33.2	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	81%	0.811	S	S	*	*			trans	-147.4	104	149.1	-172.6	0	0	0	0	109.6	R619	S617-R619 PolarHBondContact O-N 3.1Å
618	Q	33	Very low	32.9	Very low	160 Å²	160	137.9 Å²	137.9	75%	0.748	81%	0.807	S	S	*	*			trans	-58.2	121.2	162.7	-70.9	164.2	-41.1	0	0	109.2	F616	F616-Q618 HydrophobicContact CD1-CG 4.28Å; F616-Q618 HydrophobicContact CE1-CG 4.06Å
619	R	34.2	Very low	32.6	Very low	211 Å²	211	140.3 Å²	140.3	80%	0.796	81%	0.809	S	S	*	*			trans	-133	79.5	150.2	-79.1	-169.3	177.4	-177	-0.9	109.1	S617 F621	S617-R619 PolarHBondContact O-N 3.1Å; R619-F621 PolarHBondContact O-N 3.04Å
620	C	30.9	Very low	32.5	Very low	124 Å²	124	140.2 Å²	140.2	84%	0.838	81%	0.812	S	S	*	*			trans	-61.2	113.3	141.1	-78.9	0	0	0	0	107
621	F	36.4	Very low	32.6	Very low	179 Å²	179	144.7 Å²	144.7	79%	0.785	82%	0.821	S	S	*	*			trans	-117.4	89.7	153.8	-101.1	-87.9	0	0	0	106.9	R619	R619-F621 PolarHBondContact O-N 3.04Å
622	A	34.7	Very low	32.7	Very low	81 Å²	81	145.4 Å²	145.4	67%	0.669	82%	0.821	S	S	*	*			trans	-67	141.5	158.5	0	0	0	0	0	108.8
623	C	29.6	Very low	32.8	Very low	124 Å²	124	146.1 Å²	146.1	84%	0.838	82%	0.821	S	S	*	*			trans	27	113.4	144.9	-62.9	0	0	0	0	118.6
624	T	35.5	Very low	33	Very low	146 Å²	146	150.1 Å²	150.1	90%	0.896	83%	0.826	S	S	*	*				-146.6	113.8	128	-2.9	0	0	0	0	111.6
625	K	29	Very low	33.2	Very low	193 Å²	193	154.5 Å²	154.5	84%	0.839	83%	0.831	S	S	*	*			trans	-83.8	146.3	156.5	-124.4	-178.6	-176.3	-176.4	0	106.4
626	V	33.6	Very low	33.3	Very low	124 Å²	124	156 Å²	156	75%	0.752	83%	0.83	S	S	*	*			trans	76.8	109.1	157.9	-172.5	0	0	0	0	117.4
627	L	39.2	Very low	33.8	Very low	244 Å²	244	153.6 Å²	153.6	100%	1.277	83%	0.833	S	S	*	*				-139.9	0	108.8	-100.1	164.1	0	0	0	108.3

Retrieved 627 of 627 residues in 363.5 ms (Link to these results)

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