LIMS1_HUMAN Loading...

Isoform 5 of LIM and senescent cell antigen-like-containing domain protein 1 AlphaSync

Canonical isoform description: Within the IPP (ILK-PINCH-PARVIN) complex, binds to F-actin, promoting F-actin bundling, a process required to generate force for actin cytoskeleton reorganization and subsequent dynamic cell adhesion events such as cell spreading and migration.

AlphaFold DB , UniProt , Accession P48059-5 (canonical: P48059), Species HUMAN (Homo sapiens, Human), Gene LIMS1, Length 362 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	37.3	Very low	35.8	Very low	249 Å²	249	148.4 Å²	148.4	100%	1.227	78%	0.779	S	S	*	*				0	120.8	0	-77.1	-173.7	-94.4	0	0	107.4
2	T	32.7	Very low	36.4	Very low	138 Å²	138	140.6 Å²	140.6	85%	0.847	75%	0.746	S	S	*	*			trans	-45	118.5	-165.1	35.7	0	0	0	0	115.4	L4	T2-L4 PolarHBondContact O-N 3.45Å
3	A	29.6	Very low	36.8	Very low	96 Å²	96	133.7 Å²	133.7	79%	0.793	73%	0.729	S	S	*	*			trans	-72.5	116.3	171.1	0	0	0	0	0	110.2	Q5	A3-Q5 PolarHBondContact O-N 3.42Å
4	L	30.8	Very low	36.9	Very low	171 Å²	171	133.7 Å²	133.7	90%	0.895	73%	0.727	S	S	*	*			trans	-86.8	93.3	169.1	-82.5	157.9	0	0	0	108.3	T2 L6	T2-L4 PolarHBondContact O-N 3.45Å; L4-L6 PolarHBondContact O-N 3.32Å
5	Q	31.5	Very low	37.1	Very low	159 Å²	159	134.5 Å²	134.5	74%	0.743	72%	0.716	S	S	*	*			trans	-65.8	114.2	167.2	-82.6	-178.7	-24.6	0	0	109.4	A3 K7	A3-Q5 PolarHBondContact O-N 3.42Å; Q5-K7 PolarHBondContact O-N 2.91Å; Q5-K7 VanDerWaalsContact O-N 3.08Å
6	L	31.7	Very low	37.4	Very low	136 Å²	136	136.8 Å²	136.8	71%	0.712	71%	0.712	S	S	*	*			trans	-65.2	100.8	162	-86.8	148.9	0	0	0	108.1	L4	L4-L6 PolarHBondContact O-N 3.32Å
7	K	36	Very low	37.8	Very low	178 Å²	178	140.5 Å²	140.5	77%	0.774	72%	0.715	S	S	*	*			trans	-87.4	141.4	169.1	-85	-175.7	175.9	-179.8	0	110.2	Q5	Q5-K7 PolarHBondContact O-N 2.91Å; Q5-K7 VanDerWaalsContact O-N 3.08Å
8	E	34.9	Very low	37.7	Very low	154 Å²	154	145.4 Å²	145.4	72%	0.72	72%	0.723	S	S	*	*			trans	-46.8	133.3	-172.7	-63.6	172.4	145.9	0	0	114	S10	E8-S10 PolarHBondContact O-N 3.36Å
9	L	42.9	Very low	37.7	Very low	156 Å²	156	148.6 Å²	148.6	82%	0.817	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	9.4	176.2	-89.6	120.5	0	0	0	114.7
10	S	44.8	Very low	37.4	Very low	57 Å²	57	148.7 Å²	148.7	40%	0.399	73%	0.73	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.9	-8.8	178.4	54.3	0	0	0	0	114	E8	E8-S10 PolarHBondContact O-N 3.36Å
11	H	41.3	Very low	37.3	Very low	138 Å²	138	153.2 Å²	153.2	64%	0.639	74%	0.739	S	S	*	*	S	Bend	trans	-116.4	8.1	-174.2	-81	-87	0	0	0	115.8
12	S	43	Very low	37	Very low	55 Å²	55	146.4 Å²	146.4	39%	0.385	71%	0.713	S	S	.	*			trans	-73.2	133.2	176.3	79.6	0	0	0	0	111.2	L14 Y15	S12-L14 PolarHBondContact O-N 3.25Å; S12-Y15 PolarHBondContact O-N 2.91Å
13	G	42.5	Very low	36.8	Very low	51 Å²	51	146.1 Å²	146.1	53%	0.526	71%	0.706	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	2.4	177.8	0	0	0	0	0	115.3	R17	G13-R17 PolarHBondContact O-NE 3.02Å
14	L	37.2	Very low	36.9	Very low	134 Å²	134	147.4 Å²	147.4	70%	0.702	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-27.9	172.9	-75.3	165.2	0	0	0	112.3	S12	S12-L14 PolarHBondContact O-N 3.25Å
15	Y	40.5	Very low	37	Very low	145 Å²	145	146.4 Å²	146.4	57%	0.569	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-28.9	176.3	-165.7	-105.1	0	0	0	112.8	S12 R17	S12-Y15 PolarHBondContact O-N 2.91Å; Y15-R17 VanDerWaalsContact C-N 3.33Å; Y15-R17 PolarHBondContact O-N 3.22Å
16	R	42.6	Very low	36.9	Very low	172 Å²	172	150.2 Å²	150.2	65%	0.649	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-12.3	174.6	-84.2	-174	-173.3	178.5	0.5	115.1
17	R	43	Very low	37.1	Very low	200 Å²	200	148.5 Å²	148.5	76%	0.755	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-1.8	-178.8	-85.9	-169.8	-89.8	-170.6	-4.6	115.2	G13 Y15	G13-R17 PolarHBondContact O-NE 3.02Å; Y15-R17 VanDerWaalsContact C-N 3.33Å; Y15-R17 PolarHBondContact O-N 3.22Å
18	R	36.2	Very low	36.9	Very low	229 Å²	229	147.3 Å²	147.3	86%	0.864	71%	0.709	S	S	*	*	S	Bend	trans	-109.4	6.4	178.3	-71.3	-169.9	-167.4	-169.5	3.2	114.8
19	R	37.9	Very low	36.8	Very low	206 Å²	206	143.7 Å²	143.7	78%	0.777	71%	0.713	S	S	*	*	S	Bend	trans	-109	0.6	-177.1	-119.4	179.6	177	-178.8	-1.4	115.5
20	D	32.9	Very low	36.5	Very low	150 Å²	150	141.6 Å²	141.6	80%	0.802	70%	0.702	S	S	*	*			trans	-132.4	85.7	174.2	-75.3	-48.7	0	0	0	110
21	R	34	Very low	36.1	Very low	244 Å²	244	143 Å²	143	92%	0.921	71%	0.709	S	S	*	*			trans	-160.3	134.1	132.6	-143.5	167.5	178.8	-178.1	-1.4	111.4
22	P	31	Very low	36.4	Very low	106 Å²	106	145 Å²	145	69%	0.688	72%	0.719	S	S	*	*			trans	-86.4	157.1	-162.8	-0.5	22	0	0	0	112.4
23	D	29.5	Very low	36.7	Very low	131 Å²	131	150.2 Å²	150.2	70%	0.701	74%	0.737	S	S	*	*			trans	35.7	106.7	145.7	-67	-35.7	0	0	0	118	L25	D23-L25 VanDerWaalsContact C-N 3.25Å; D23-L25 PolarHBondContact O-N 3.36Å
24	S	31.1	Very low	36.8	Very low	124 Å²	124	152.6 Å²	152.6	87%	0.867	74%	0.735	S	S	*	*				21.5	58.8	115	-43.5	0	0	0	0	117.3	R26	S24-R26 PolarHBondContact O-N 2.98Å
25	L	32.4	Very low	37.2	Very low	150 Å²	150	152 Å²	152	79%	0.785	73%	0.732	S	S	*	*			trans	-82.9	100	169.7	-77.5	168.6	0	0	0	109.3	D23 V27	D23-L25 VanDerWaalsContact C-N 3.25Å; D23-L25 PolarHBondContact O-N 3.36Å; L25-V27 HydrophobicContact CB-CG2 4.31Å; L25-V27 PolarHBondContact O-N 3.39Å
26	R	28.9	Very low	37.7	Very low	239 Å²	239	148 Å²	148	90%	0.902	73%	0.725	S	S	*	*			trans	-49.2	115.7	148.5	-78.9	176.1	164.6	179	-4.6	108.1	S24	S24-R26 PolarHBondContact O-N 2.98Å
27	V	35.9	Very low	38.2	Very low	99 Å²	99	145.3 Å²	145.3	60%	0.6	72%	0.723	S	S	*	*			trans	-117.3	101.1	166.8	-176.2	0	0	0	0	108	L25 L30	L25-V27 HydrophobicContact CB-CG2 4.31Å; L25-V27 PolarHBondContact O-N 3.39Å; V27-L30 HydrophobicContact CG1-CD1 4.44Å; V27-L30 HydrophobicContact CG1-CG 4.26Å
28	N	32.2	Very low	38.8	Very low	154 Å²	154	141 Å²	141	82%	0.824	71%	0.713	S	S	*	*			trans	-68.2	135	159.6	-74	-41.7	0	0	0	108.6
29	G	33.6	Very low	39.7	Very low	77 Å²	77	132.6 Å²	132.6	79%	0.794	69%	0.693	S	S	*	*			trans	68.6	91.3	159.1	0	0	0	0	0	116.3
30	L	35.3	Very low	40.8	Very low	112 Å²	112	127.8 Å²	127.8	59%	0.586	68%	0.682	S	S	*	*			trans	-111	145.4	162	-74.7	166.3	0	0	0	110	V27	V27-L30 HydrophobicContact CG1-CD1 4.44Å; V27-L30 HydrophobicContact CG1-CG 4.26Å
31	P	37.2	Very low	42.2	Very low	86 Å²	86	123.8 Å²	123.8	56%	0.558	67%	0.67	S	S	*	*			trans	-67.7	147.4	-170.7	-13.3	29	0	0	0	112.7	E33 E34	P31-E33 PolarHBondContact O-N 3.15Å; P31-E34 PolarHBondContact O-N 3.04Å; P31-E34 VanDerWaalsContact O-N 3.16Å
32	E	48.6	Very low	43.7	Very low	181 Å²	181	114.8 Å²	114.8	85%	0.846	64%	0.64	S	S	*	*	H	α-helix	trans	-55.1	-21.3	-174.4	-67.4	177.4	149.9	0	0	114.8
33	E	47.5	Very low	45.4	Very low	164 Å²	164	113.8 Å²	113.8	77%	0.766	64%	0.64	S	S	*	*	H	α-helix	trans	-73.9	-30	179.9	-69.6	-175.7	152.4	0	0	114	P31	P31-E33 PolarHBondContact O-N 3.15Å
34	E	44.9	Very low	47.7	Very low	102 Å²	102	112.4 Å²	112.4	48%	0.477	64%	0.641	S	S	.	*	H	α-helix	trans	-78.6	-27.2	177.4	-71.8	-170.3	151.7	0	0	112.6	P31 S36 N37 M38	P31-E34 PolarHBondContact O-N 3.04Å; P31-E34 VanDerWaalsContact O-N 3.16Å; E34-S36 VanDerWaalsContact C-N 3.3Å; E34-S36 PolarHBondContact O-N 3.24Å; E34-N37 PolarHBondContact O-N 3.15Å; E34-M38 HydrophobicContact CB-CE 4.45Å; E34-M38 WeakPolarHBondContact O-CE 3.17Å; E34-M38 PolarHBondContact O-N 3.42Å
35	L	45.3	Very low	50.1	Low	121 Å²	121	107.1 Å²	107.1	63%	0.634	61%	0.605	S	S	*	*	H	α-helix	trans	-65	-35.3	174.2	-128.1	78.2	0	0	0	111.7	A39	L35-A39 WeakPolarHBondContact O-CB 3.13Å; L35-A39 PolarHBondContact O-N 3.24Å
36	S	50.8	Low	52.9	Low	62 Å²	62	103.6 Å²	103.6	43%	0.434	59%	0.59	S	S	.	*	H	α-helix	trans	-66.6	-38.4	179.4	-170.2	0	0	0	0	112.4	E34 A39 N40	E34-S36 VanDerWaalsContact C-N 3.3Å; E34-S36 PolarHBondContact O-N 3.24Å; S36-A39 PolarHBondContact O-N 3.4Å; S36-N40 VanDerWaalsContact O-CG 3.32Å; S36-N40 PolarHBondContact O-N 3.47Å; S36-N40 PolarHBondContact O-ND2 3.49Å
37	N	54.9	Low	55.8	Low	114 Å²	114	92.2 Å²	92.2	61%	0.61	55%	0.547	S	S	*	.	H	α-helix	trans	-71.4	-36.7	179.3	-73	-28.5	0	0	0	112.8	E34 A41	E34-N37 PolarHBondContact O-N 3.15Å; N37-A41 PolarHBondContact O-N 2.97Å
38	M	55.3	Low	58.3	Low	111 Å²	111	91.5 Å²	91.5	55%	0.547	54%	0.537	S	S	.	.	H	α-helix	trans	-70.6	-37.5	174	-73.8	-176.9	-97	0	0	112	E34 N40 A41 L42	E34-M38 HydrophobicContact CB-CE 4.45Å; E34-M38 WeakPolarHBondContact O-CE 3.17Å; E34-M38 PolarHBondContact O-N 3.42Å; M38-N40 VanDerWaalsContact C-N 3.34Å; M38-N40 PolarHBondContact O-N 3.07Å; M38-A41 PolarHBondContact O-N 3.03Å; M38-L42 WeakPolarHBondContact O-CG 3.27Å; M38-L42 PolarHBondContact O-N 3.35Å; M38-L42 VanDerWaalsContact O-N 3.15Å
39	A	55.3	Low	60.9	Low	52 Å²	52	89.2 Å²	89.2	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-62.4	-39.8	174.8	0	0	0	0	0	112.2	L35 S36 L42 A43	L35-A39 WeakPolarHBondContact O-CB 3.13Å; L35-A39 PolarHBondContact O-N 3.24Å; S36-A39 PolarHBondContact O-N 3.4Å; A39-L42 PolarHBondContact O-N 3.47Å; A39-A43 PolarHBondContact O-N 3.28Å; A39-A43 VanDerWaalsContact O-N 3.11Å
40	N	60.4	Low	63.6	Low	105 Å²	105	88.8 Å²	88.8	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-69.2	-35.1	177.3	-73.7	-24.1	0	0	0	113.3	S36 M38 A43	S36-N40 VanDerWaalsContact O-CG 3.32Å; S36-N40 PolarHBondContact O-N 3.47Å; S36-N40 PolarHBondContact O-ND2 3.49Å; M38-N40 VanDerWaalsContact C-N 3.34Å; M38-N40 PolarHBondContact O-N 3.07Å; N40-A43 PolarHBondContact O-N 2.95Å
41	A	62.3	Low	66.1	Low	65 Å²	65	89 Å²	89	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-69.7	-33.8	176.5	0	0	0	0	0	112.4	N37 M38	N37-A41 PolarHBondContact O-N 2.97Å; M38-A41 PolarHBondContact O-N 3.03Å
42	L	65.9	Low	68.6	Low	56 Å²	56	86.2 Å²	86.2	29%	0.293	48%	0.484	S	S	.	.	H	α-helix	trans	-76.6	-24.8	176.3	-71.7	164.9	0	0	0	112.9	M38 A39 S44 A45 I60	M38-L42 WeakPolarHBondContact O-CG 3.27Å; M38-L42 PolarHBondContact O-N 3.35Å; M38-L42 VanDerWaalsContact O-N 3.15Å; A39-L42 PolarHBondContact O-N 3.47Å; L42-S44 PolarHBondContact O-N 3.04Å; L42-A45 PolarHBondContact O-N 3.44Å; L42-I60 HydrophobicContact CD2-CD1 3.53Å
43	A	66.3	Low	70.5	Confident	84 Å²	84	80 Å²	80	69%	0.694	47%	0.468	S	S	*	.	H	α-helix	trans	-64.8	-24.7	-179.5	0	0	0	0	0	113.9	A39 N40	A39-A43 PolarHBondContact O-N 3.28Å; A39-A43 VanDerWaalsContact O-N 3.11Å; N40-A43 PolarHBondContact O-N 2.95Å
44	S	76.7	Confident	72.4	Confident	102 Å²	102	73.3 Å²	73.3	71%	0.713	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-6.8	176.3	62.3	0	0	0	0	113.8	L42	L42-S44 PolarHBondContact O-N 3.04Å
45	A	83.2	Confident	74.2	Confident	14 Å²	14	71.1 Å²	71.1	12%	0.116	44%	0.436	C	S	.	.			trans	-73.2	138	178.3	0	0	0	0	0	111.3	L42 F54 L67	L42-A45 PolarHBondContact O-N 3.44Å; A45-F54 HydrophobicContact CB-CD2 3.83Å; A45-F54 HydrophobicContact CB-CE2 4.01Å; A45-L67 HydrophobicContact CB-CD1 3.47Å; A45-L67 VanDerWaalsContact CB-CD1 3.47Å
46	T	90.2	Very high	75.7	Confident	75 Å²	75	71.6 Å²	71.6	46%	0.46	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-121.6	147.7	173.5	53.6	0	0	0	0	110.1	E48 G52	T46-E48 PolarHBondContact O-N 3.08Å; T46-G52 CarbonylContact C-O 3.4Å; T46-G52 WeakPolarHBondContact CA-O 3.35Å
47	C	90.4	Very high	77.1	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	47%	0.465	C	S	.	.			trans	-68.1	127.5	175.1	171.3	0	0	0	0	110.1	R49 C50 K51 G52 F54 L67 H69 C72	C47-R49 PolarHBondContact O-N 2.99Å; C47-R49 VanDerWaalsContact O-N 3.12Å; C47-C50 VanDerWaalsContact CB-SG 3.56Å; C47-K51 WeakPolarHBondContact O-CA 3.48Å; C47-K51 PolarHBondContact O-N 3.41Å; C47-G52 PolarHBondContact N-O 3.31Å; C47-F54 HydrophobicContact CB-CE1 4.19Å; C47-F54 HydrophobicContact CB-CZ 3.8Å; C47-L67 CarbonylContact C-O 3.55Å; C47-L67 VanDerWaalsContact CA-O 3.29Å; C47-L67 WeakPolarHBondContact CA-O 3.48Å; C47-H69 VanDerWaalsContact CB-CE1 3.44Å; C47-H69 WeakPolarHBondContact CB-CE1 3.42Å; C47-H69 WeakPolarHBondContact CB-ND1 3.37Å; C47-C72 VanDerWaalsContact SG-CB 3.59Å
48	E	88.4	Confident	78.5	Confident	84 Å²	84	72 Å²	72	39%	0.393	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.3	-174.1	-171.1	51.6	-138.7	0	0	112.8	T46 K51 E66 L67 Y68	T46-E48 PolarHBondContact O-N 3.08Å; E48-K51 VanDerWaalsContact O-CE 3.23Å; E48-K51 WeakPolarHBondContact O-CE 3.37Å; E48-K51 PolarHBondContact O-NZ 3.41Å; E48-K51 IonicContact OE1-NZ 3.33Å; E48-K51 PolarHBondContact OE1-NZ 2.96Å; E48-K51 IonicContact OE2-NZ 2.69Å; E48-K51 PolarHBondContact OE2-NZ 3.22Å; E48-K51 VanDerWaalsContact OE2-NZ 3.08Å; E48-E66 HydrophobicContact CB-CB 4.41Å; E48-E66 HydrophobicContact CG-CG 4.47Å; E48-L67 PolarHBondContact N-O 3.31Å; E48-Y68 HydrophobicContact CB-CD1 4.33Å; E48-Y68 HydrophobicContact CB-CE1 3.75Å; E48-Y68 HydrophobicContact CB-CE2 4.4Å; E48-Y68 HydrophobicContact CG-CE1 4.41Å
49	R	85.6	Confident	79.9	Confident	107 Å²	107	74 Å²	74	40%	0.404	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-56.7	178.5	-178.4	-179.8	-179.3	138.6	-2.9	114.3	C47 Y68 C72 V74	C47-R49 PolarHBondContact O-N 2.99Å; C47-R49 VanDerWaalsContact O-N 3.12Å; R49-Y68 HydrophobicContact CB-CD1 4.06Å; R49-Y68 HydrophobicContact CB-CE1 4.17Å; R49-C72 HydrophobicContact CB-CB 4.06Å; R49-C72 WeakPolarHBondContact CD-O 3.47Å; R49-C72 HydrophobicContact CG-CB 4.45Å; R49-C72 PolarHBondContact NH1-O 3.12Å; R49-V74 VanDerWaalsContact CZ-CG2 3.47Å; R49-V74 PolarHBondContact NH1-O 2.72Å
50	C	90.3	Very high	81.4	Confident	68 Å²	68	74.6 Å²	74.6	46%	0.459	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-8.9	-172.9	74.1	0	0	0	0	113.3	C47 G52 H69	C47-C50 VanDerWaalsContact CB-SG 3.56Å; C50-G52 PolarHBondContact O-N 3.11Å; C50-G52 VanDerWaalsContact O-N 3.12Å; C50-G52 PolarHBondContact SG-N 2.91Å; C50-H69 PolarHBondContact SG-CE1 3.17Å; C50-H69 PolarHBondContact SG-ND1 2.94Å
51	K	89.6	Confident	82.7	Confident	116 Å²	116	71.6 Å²	71.6	50%	0.504	44%	0.441	S	S	.	.			trans	59.7	13.8	-175.6	-52.4	-58.4	-177.1	-170.8	0	114.6	C47 E48	C47-K51 WeakPolarHBondContact O-CA 3.48Å; C47-K51 PolarHBondContact O-N 3.41Å; E48-K51 VanDerWaalsContact O-CE 3.23Å; E48-K51 WeakPolarHBondContact O-CE 3.37Å; E48-K51 PolarHBondContact O-NZ 3.41Å; E48-K51 IonicContact OE1-NZ 3.33Å; E48-K51 PolarHBondContact OE1-NZ 2.96Å; E48-K51 IonicContact OE2-NZ 2.69Å; E48-K51 PolarHBondContact OE2-NZ 3.22Å; E48-K51 VanDerWaalsContact OE2-NZ 3.08Å
52	G	88.1	Confident	83.9	Confident	27 Å²	27	73.6 Å²	73.6	28%	0.278	44%	0.443	S	S	.	.			trans	-80.6	157.4	172.2	0	0	0	0	0	112.7	T46 C47 C50	T46-G52 CarbonylContact C-O 3.4Å; T46-G52 WeakPolarHBondContact CA-O 3.35Å; C47-G52 PolarHBondContact N-O 3.31Å; C50-G52 PolarHBondContact O-N 3.11Å; C50-G52 VanDerWaalsContact O-N 3.12Å; C50-G52 PolarHBondContact SG-N 2.91Å
53	G	88.6	Confident	84.8	Confident	50 Å²	50	71.3 Å²	71.3	52%	0.515	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-74.8	176.6	173.2	0	0	0	0	0	113.3	H69	G53-H69 PolarHBondContact O-NE2 2.96Å
54	F	87.4	Confident	85.5	Confident	24 Å²	24	74.3 Å²	74.3	11%	0.105	44%	0.436	C	S	.	.			trans	-109.4	137.7	177.3	-62.9	-75.7	0	0	0	111	A45 C47 I60 L67 H69	A45-F54 HydrophobicContact CB-CD2 3.83Å; A45-F54 HydrophobicContact CB-CE2 4.01Å; C47-F54 HydrophobicContact CB-CE1 4.19Å; C47-F54 HydrophobicContact CB-CZ 3.8Å; F54-I60 HydrophobicContact CB-CG2 4.21Å; F54-I60 HydrophobicContact CD1-CB 4.4Å; F54-I60 HydrophobicContact CD1-CG2 3.27Å; F54-I60 HydrophobicContact CE1-CB 4.34Å; F54-I60 HydrophobicContact CE1-CG2 3.65Å; F54-I60 HydrophobicContact CG-CG2 3.77Å; F54-I60 HydrophobicContact CZ-CG2 4.45Å; F54-L67 HydrophobicContact CE2-CB 3.67Å; F54-L67 HydrophobicContact CE2-CD1 4.26Å; F54-L67 HydrophobicContact CZ-CB 3.62Å; F54-H69 AromaticContact CD1-CD2 3.53Å; F54-H69 AromaticContact CD1-NE2 3.64Å; F54-H69 AromaticContact CE1-CD2 3.57Å; F54-H69 AromaticContact CE1-NE2 3.81Å
55	A	83.7	Confident	85.8	Confident	56 Å²	56	72.4 Å²	72.4	46%	0.463	43%	0.432	S	S	.	.			trans	-75.5	151.5	172.8	0	0	0	0	0	111.2	A57 E58	A55-A57 PolarHBondContact O-N 3.42Å; A55-E58 HydrophobicContact CB-CB 4.05Å; A55-E58 PolarHBondContact N-OE2 3.17Å; A55-E58 WeakPolarHBondContact O-CB 3.25Å; A55-E58 PolarHBondContact O-N 3.4Å
56	P	76.8	Confident	85.9	Confident	132 Å²	132	75 Å²	75	86%	0.857	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.6	-171.4	-26.7	34.4	0	0	0	115.9
57	A	79.9	Confident	85.9	Confident	101 Å²	101	73.3 Å²	73.3	84%	0.835	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	13.8	179.8	0	0	0	0	0	112.9	A55	A55-A57 PolarHBondContact O-N 3.42Å
58	E	84.8	Confident	85.9	Confident	84 Å²	84	74.3 Å²	74.3	39%	0.393	43%	0.434	S	S	.	.			trans	-78.6	144.1	-179.3	-169.7	173.5	-167.6	0	0	111.7	A55 I60 H69	A55-E58 HydrophobicContact CB-CB 4.05Å; A55-E58 PolarHBondContact N-OE2 3.17Å; A55-E58 WeakPolarHBondContact O-CB 3.25Å; A55-E58 PolarHBondContact O-N 3.4Å; E58-I60 PolarHBondContact O-N 2.89Å; E58-H69 IonicContact OE1-CD2 3.59Å; E58-H69 PolarHBondContact OE1-CD2 3.07Å; E58-H69 IonicContact OE2-CD2 2.68Å; E58-H69 IonicContact OE2-NE2 3.08Å
59	K	83.4	Confident	85.9	Confident	151 Å²	151	71.4 Å²	71.4	66%	0.657	42%	0.42	S	S	*	.			trans	-75.2	122.8	173.1	-68.4	-177	-178.7	177.7	0	110
60	I	88	Confident	85.9	Confident	66 Å²	66	70.4 Å²	70.4	34%	0.338	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.6	179.2	61.6	176.6	0	0	0	110.9	L42 F54 E58 L67	L42-I60 HydrophobicContact CD2-CD1 3.53Å; F54-I60 HydrophobicContact CB-CG2 4.21Å; F54-I60 HydrophobicContact CD1-CB 4.4Å; F54-I60 HydrophobicContact CD1-CG2 3.27Å; F54-I60 HydrophobicContact CE1-CB 4.34Å; F54-I60 HydrophobicContact CE1-CG2 3.65Å; F54-I60 HydrophobicContact CG-CG2 3.77Å; F54-I60 HydrophobicContact CZ-CG2 4.45Å; E58-I60 PolarHBondContact O-N 2.89Å; I60-L67 HydrophobicContact CD1-CD2 4.45Å
61	V	87	Confident	85.8	Confident	41 Å²	41	75.2 Å²	75.2	25%	0.248	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	119.1	171.9	-178.4	0	0	0	0	108.2	Y68 E70 F73	V61-Y68 PolarHBondContact N-O 2.77Å; V61-Y68 PolarHBondContact O-N 3.5Å; V61-E70 HydrophobicContact CG2-CB 4.49Å; V61-F73 HydrophobicContact CB-CB 4.1Å; V61-F73 HydrophobicContact CB-CD1 4.49Å; V61-F73 HydrophobicContact CB-CG 4.2Å; V61-F73 HydrophobicContact CG1-CB 4.15Å; V61-F73 HydrophobicContact CG1-CD1 3.67Å; V61-F73 HydrophobicContact CG1-CD2 4.09Å; V61-F73 HydrophobicContact CG1-CE1 4.02Å; V61-F73 HydrophobicContact CG1-CE2 4.41Å; V61-F73 HydrophobicContact CG1-CG 3.7Å; V61-F73 HydrophobicContact CG1-CZ 4.39Å; V61-F73 HydrophobicContact CG2-CB 4.17Å
62	N	88	Confident	85.7	Confident	107 Å²	107	70.6 Å²	70.6	57%	0.572	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	113.7	173	-176.1	-17.4	0	0	0	109.3	G65 E66 L67	N62-G65 WeakPolarHBondContact OD1-CA 3.46Å; N62-G65 PolarHBondContact OD1-N 2.88Å; N62-G65 VanDerWaalsContact OD1-N 3.08Å; N62-E66 WeakPolarHBondContact CA-O 3.47Å; N62-L67 HydrophobicContact CB-CD2 4.02Å
63	S	84.2	Confident	85.9	Confident	9 Å²	9	70.4 Å²	70.4	6%	0.063	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	105	177.6	171.5	0	0	0	0	109.2	G65 E66 K94	S63-G65 PolarHBondContact O-N 2.78Å; S63-E66 PolarHBondContact N-O 3.06Å; S63-E66 WeakPolarHBondContact O-CB 3.31Å; S63-E66 PolarHBondContact O-N 3.39Å; S63-K94 WeakPolarHBondContact OG-CE 3.47Å
64	N	81.1	Confident	85.9	Confident	147 Å²	147	68.7 Å²	68.7	79%	0.786	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	33.5	179.6	-66	-26.1	0	0	0	114.6
65	G	82.2	Confident	86	Confident	61 Å²	61	67.6 Å²	67.6	63%	0.629	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.2	-8.2	179.6	0	0	0	0	0	114.5	N62 S63	N62-G65 WeakPolarHBondContact OD1-CA 3.46Å; N62-G65 PolarHBondContact OD1-N 2.88Å; N62-G65 VanDerWaalsContact OD1-N 3.08Å; S63-G65 PolarHBondContact O-N 2.78Å
66	E	87.3	Confident	86.2	Confident	70 Å²	70	66.4 Å²	66.4	33%	0.327	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135.4	171	-61.2	175.8	155.8	0	0	110.2	E48 N62 S63 Y68 K94	E48-E66 HydrophobicContact CB-CB 4.41Å; E48-E66 HydrophobicContact CG-CG 4.47Å; N62-E66 WeakPolarHBondContact CA-O 3.47Å; S63-E66 PolarHBondContact N-O 3.06Å; S63-E66 WeakPolarHBondContact O-CB 3.31Å; S63-E66 PolarHBondContact O-N 3.39Å; E66-Y68 HydrophobicContact CB-CD2 4.27Å; E66-Y68 HydrophobicContact CB-CE2 3.43Å; E66-Y68 VanDerWaalsContact CB-CE2 3.43Å; E66-Y68 PolarHBondContact OE2-OH 3.29Å; E66-K94 IonicContact OE2-NZ 3.99Å; E66-K94 PolarHBondContact OE2-NZ 3.05Å
67	L	89.3	Confident	86.7	Confident	38 Å²	38	64.9 Å²	64.9	20%	0.199	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.5	-178.3	-60.3	175.4	0	0	0	110.4	A45 C47 E48 F54 I60 N62	A45-L67 HydrophobicContact CB-CD1 3.47Å; A45-L67 VanDerWaalsContact CB-CD1 3.47Å; C47-L67 CarbonylContact C-O 3.55Å; C47-L67 VanDerWaalsContact CA-O 3.29Å; C47-L67 WeakPolarHBondContact CA-O 3.48Å; E48-L67 PolarHBondContact N-O 3.31Å; F54-L67 HydrophobicContact CE2-CB 3.67Å; F54-L67 HydrophobicContact CE2-CD1 4.26Å; F54-L67 HydrophobicContact CZ-CB 3.62Å; I60-L67 HydrophobicContact CD1-CD2 4.45Å; N62-L67 HydrophobicContact CB-CD2 4.02Å
68	Y	89.9	Confident	87.1	Confident	21 Å²	21	62.2 Å²	62.2	8%	0.082	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147	179.5	-62.1	-93.3	0	0	0	111	E48 R49 V61 E66 F73 K94	E48-Y68 HydrophobicContact CB-CD1 4.33Å; E48-Y68 HydrophobicContact CB-CE1 3.75Å; E48-Y68 HydrophobicContact CB-CE2 4.4Å; E48-Y68 HydrophobicContact CG-CE1 4.41Å; R49-Y68 HydrophobicContact CB-CD1 4.06Å; R49-Y68 HydrophobicContact CB-CE1 4.17Å; V61-Y68 PolarHBondContact N-O 2.77Å; V61-Y68 PolarHBondContact O-N 3.5Å; E66-Y68 HydrophobicContact CB-CD2 4.27Å; E66-Y68 HydrophobicContact CB-CE2 3.43Å; E66-Y68 VanDerWaalsContact CB-CE2 3.43Å; E66-Y68 PolarHBondContact OE2-OH 3.29Å; Y68-F73 HydrophobicContact CD1-CD2 4.33Å; Y68-F73 AromaticContact CD2-CD2 3.68Å; Y68-F73 HydrophobicContact CD2-CD2 3.68Å; Y68-F73 HydrophobicContact CD2-CE2 4.18Å; Y68-F73 HydrophobicContact CE2-CD2 4.1Å; Y68-F73 HydrophobicContact CE2-CE2 4.25Å; Y68-F73 HydrophobicContact CG-CB 4.36Å; Y68-F73 AromaticContact CG-CD2 3.81Å; Y68-F73 HydrophobicContact CG-CD2 3.81Å; Y68-K94 PolarHBondContact OH-NZ 2.99Å
69	H	88.4	Confident	87.3	Confident	24 Å²	24	64.5 Å²	64.5	11%	0.111	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	148.6	160	-56.9	112	0	0	0	108.9	C47 C50 G53 F54 E58 Q71 C72 F73	C47-H69 VanDerWaalsContact CB-CE1 3.44Å; C47-H69 WeakPolarHBondContact CB-CE1 3.42Å; C47-H69 WeakPolarHBondContact CB-ND1 3.37Å; C50-H69 PolarHBondContact SG-CE1 3.17Å; C50-H69 PolarHBondContact SG-ND1 2.94Å; G53-H69 PolarHBondContact O-NE2 2.96Å; F54-H69 AromaticContact CD1-CD2 3.53Å; F54-H69 AromaticContact CD1-NE2 3.64Å; F54-H69 AromaticContact CE1-CD2 3.57Å; F54-H69 AromaticContact CE1-NE2 3.81Å; E58-H69 IonicContact OE1-CD2 3.59Å; E58-H69 PolarHBondContact OE1-CD2 3.07Å; E58-H69 IonicContact OE2-CD2 2.68Å; E58-H69 IonicContact OE2-NE2 3.08Å; H69-Q71 PolarHBondContact O-N 3.14Å; H69-Q71 VanDerWaalsContact O-N 3.15Å; H69-C72 HydrophobicContact CB-CB 3.87Å; H69-C72 CarbonylContact O-C 3.52Å; H69-C72 WeakPolarHBondContact O-CA 3.49Å; H69-C72 WeakPolarHBondContact O-CB 3.17Å; H69-C72 PolarHBondContact O-N 2.82Å; H69-F73 PolarHBondContact O-N 2.85Å
70	E	86.5	Confident	87.5	Confident	86 Å²	86	63.9 Å²	63.9	40%	0.402	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-37	175.2	-168.9	173.8	-171.4	0	0	111.8	V61	V61-E70 HydrophobicContact CG2-CB 4.49Å
71	Q	86.8	Confident	87.5	Confident	169 Å²	169	66.1 Å²	66.1	79%	0.79	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-19.5	176.1	-59	178.5	11	0	0	113.9	H69 V74	H69-Q71 PolarHBondContact O-N 3.14Å; H69-Q71 VanDerWaalsContact O-N 3.15Å; Q71-V74 WeakPolarHBondContact O-CG1 3.33Å
72	C	88.8	Confident	87.5	Confident	19 Å²	19	64.9 Å²	64.9	13%	0.128	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-25.5	177.5	-78.7	0	0	0	0	112.3	C47 R49 H69 V74	C47-C72 VanDerWaalsContact SG-CB 3.59Å; R49-C72 HydrophobicContact CB-CB 4.06Å; R49-C72 WeakPolarHBondContact CD-O 3.47Å; R49-C72 HydrophobicContact CG-CB 4.45Å; R49-C72 PolarHBondContact NH1-O 3.12Å; H69-C72 HydrophobicContact CB-CB 3.87Å; H69-C72 CarbonylContact O-C 3.52Å; H69-C72 WeakPolarHBondContact O-CA 3.49Å; H69-C72 WeakPolarHBondContact O-CB 3.17Å; H69-C72 PolarHBondContact O-N 2.82Å; C72-V74 PolarHBondContact O-N 2.98Å
73	F	90.9	Very high	87	Confident	22 Å²	22	64.1 Å²	64.1	10%	0.096	34%	0.34	C	S	.	.	S	Bend	trans	-80.5	71	177.7	-163.9	-108.8	0	0	0	111.3	V61 Y68 H69 F82 F87 K94	V61-F73 HydrophobicContact CB-CB 4.1Å; V61-F73 HydrophobicContact CB-CD1 4.49Å; V61-F73 HydrophobicContact CB-CG 4.2Å; V61-F73 HydrophobicContact CG1-CB 4.15Å; V61-F73 HydrophobicContact CG1-CD1 3.67Å; V61-F73 HydrophobicContact CG1-CD2 4.09Å; V61-F73 HydrophobicContact CG1-CE1 4.02Å; V61-F73 HydrophobicContact CG1-CE2 4.41Å; V61-F73 HydrophobicContact CG1-CG 3.7Å; V61-F73 HydrophobicContact CG1-CZ 4.39Å; V61-F73 HydrophobicContact CG2-CB 4.17Å; Y68-F73 HydrophobicContact CD1-CD2 4.33Å; Y68-F73 AromaticContact CD2-CD2 3.68Å; Y68-F73 HydrophobicContact CD2-CD2 3.68Å; Y68-F73 HydrophobicContact CD2-CE2 4.18Å; Y68-F73 HydrophobicContact CE2-CD2 4.1Å; Y68-F73 HydrophobicContact CE2-CE2 4.25Å; Y68-F73 HydrophobicContact CG-CB 4.36Å; Y68-F73 AromaticContact CG-CD2 3.81Å; Y68-F73 HydrophobicContact CG-CD2 3.81Å; H69-F73 PolarHBondContact O-N 2.85Å; F73-F82 AromaticContact CD1-CD2 3.46Å; F73-F82 HydrophobicContact CD1-CD2 3.46Å; F73-F82 VanDerWaalsContact CD1-CD2 3.46Å; F73-F82 AromaticContact CD1-CE2 3.75Å; F73-F82 HydrophobicContact CD1-CE2 3.75Å; F73-F82 HydrophobicContact CD2-CE2 4.34Å; F73-F82 AromaticContact CE1-CD2 3.28Å; F73-F82 HydrophobicContact CE1-CD2 3.28Å; F73-F82 AromaticContact CE1-CE2 3.64Å; F73-F82 HydrophobicContact CE1-CE2 3.64Å; F73-F82 HydrophobicContact CE1-CG 4.34Å; F73-F82 HydrophobicContact CE2-CE2 4.24Å; F73-F82 HydrophobicContact CG-CD2 4.26Å; F73-F82 HydrophobicContact CG-CE2 4.11Å; F73-F82 AromaticContact CZ-CD2 3.95Å; F73-F82 HydrophobicContact CZ-CD2 3.95Å; F73-F82 AromaticContact CZ-CE2 3.89Å; F73-F82 HydrophobicContact CZ-CE2 3.89Å; F73-F87 HydrophobicContact CE1-CD1 4.25Å; F73-F87 HydrophobicContact CE1-CE1 4.34Å; F73-F87 AromaticContact CZ-CD1 3.87Å; F73-F87 HydrophobicContact CZ-CD1 3.87Å; F73-F87 AromaticContact CZ-CE1 3.69Å; F73-F87 HydrophobicContact CZ-CE1 3.69Å; F73-F87 HydrophobicContact CZ-CZ 4.17Å; F73-K94 HydrophobicContact CD2-CD 4.35Å; F73-K94 HydrophobicContact CE2-CD 3.48Å; F73-K94 VanDerWaalsContact CE2-CD 3.48Å; F73-K94 HydrophobicContact CZ-CD 4.04Å
74	V	90.1	Very high	86.7	Confident	15 Å²	15	72.7 Å²	72.7	9%	0.091	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-128.7	157.7	-179.3	-57.1	0	0	0	0	111.3	R49 Q71 C72 A76 F79 Q80 Q81 F82	R49-V74 VanDerWaalsContact CZ-CG2 3.47Å; R49-V74 PolarHBondContact NH1-O 2.72Å; Q71-V74 WeakPolarHBondContact O-CG1 3.33Å; C72-V74 PolarHBondContact O-N 2.98Å; V74-A76 PolarHBondContact O-N 3.21Å; V74-F79 WeakPolarHBondContact CB-O 3.34Å; V74-F79 HydrophobicContact CG2-CB 4.24Å; V74-F79 WeakPolarHBondContact CG2-O 3.34Å; V74-Q80 CarbonylContact C-O 3.55Å; V74-Q80 WeakPolarHBondContact CA-O 3.3Å; V74-Q80 WeakPolarHBondContact CB-O 3.22Å; V74-Q81 HydrophobicContact CG1-CG 3.83Å; V74-F82 VanDerWaalsContact C-CZ 3.48Å
75	C	89	Confident	86.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.365	C	S	.	.			trans	-52.9	136.6	177.5	176.4	0	0	0	0	112	Q77 C78 F79 Q80 F82 K94 C96 D99	C75-Q77 PolarHBondContact O-N 3.43Å; C75-Q77 PolarHBondContact SG-N 2.8Å; C75-C78 VanDerWaalsContact CB-SG 3.51Å; C75-F79 WeakPolarHBondContact O-CA 2.99Å; C75-F79 PolarHBondContact O-N 2.88Å; C75-Q80 PolarHBondContact N-O 3.42Å; C75-F82 HydrophobicContact CB-CE1 3.87Å; C75-F82 HydrophobicContact CB-CZ 4.33Å; C75-K94 CarbonylContact C-O 3.58Å; C75-K94 WeakPolarHBondContact CA-O 2.89Å; C75-C96 HydrophobicContact CB-CB 4.15Å; C75-C96 PolarHBondContact SG-N 3.01Å; C75-D99 PolarHBondContact SG-OD2 2.92Å
76	A	88.6	Confident	86.6	Confident	32 Å²	32	69.6 Å²	69.6	26%	0.264	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-18.9	178.9	0	0	0	0	0	114	V74 R93 K94 Y95	V74-A76 PolarHBondContact O-N 3.21Å; A76-R93 HydrophobicContact CB-CB 4Å; A76-K94 WeakPolarHBondContact CB-O 3.44Å; A76-K94 PolarHBondContact N-O 3.36Å; A76-Y95 HydrophobicContact CB-CD1 4.33Å; A76-Y95 HydrophobicContact CB-CE1 4.04Å
77	Q	86	Confident	86.6	Confident	99 Å²	99	69.1 Å²	69.1	46%	0.463	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-59.8	-176.5	-177	68.8	7.7	0	0	112	C75 Y95 D99 L103	C75-Q77 PolarHBondContact O-N 3.43Å; C75-Q77 PolarHBondContact SG-N 2.8Å; Q77-Y95 HydrophobicContact CB-CD1 4.08Å; Q77-Y95 HydrophobicContact CB-CE1 4.27Å; Q77-D99 HydrophobicContact CB-CB 3.8Å; Q77-D99 WeakPolarHBondContact CB-OD2 3.37Å; Q77-D99 HydrophobicContact CG-CB 4.01Å; Q77-L103 HydrophobicContact CB-CD1 4.3Å; Q77-L103 HydrophobicContact CG-CD1 4.07Å
78	C	88.7	Confident	86.4	Confident	45 Å²	45	71.8 Å²	71.8	30%	0.304	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.8	179.7	66.8	0	0	0	0	115.2	C75 Q80 D99	C75-C78 VanDerWaalsContact CB-SG 3.51Å; C78-Q80 HydrophobicContact CB-CG 4.4Å; C78-Q80 PolarHBondContact O-N 2.9Å; C78-Q80 VanDerWaalsContact O-N 3.1Å; C78-D99 WeakPolarHBondContact CB-OD2 3.2Å; C78-D99 PolarHBondContact N-OD2 3.36Å; C78-D99 PolarHBondContact SG-OD2 3.21Å
79	F	89.2	Confident	86.3	Confident	133 Å²	133	75.7 Å²	75.7	58%	0.583	38%	0.383	S	S	*	.			trans	58.8	17.7	-177.2	-51.5	-68.4	0	0	0	115.4	V74 C75	V74-F79 WeakPolarHBondContact CB-O 3.34Å; V74-F79 HydrophobicContact CG2-CB 4.24Å; V74-F79 WeakPolarHBondContact CG2-O 3.34Å; C75-F79 WeakPolarHBondContact O-CA 2.99Å; C75-F79 PolarHBondContact O-N 2.88Å
80	Q	88.5	Confident	85.9	Confident	137 Å²	137	78 Å²	78	64%	0.64	39%	0.393	S	S	*	.			trans	-90.1	150.6	172.8	-60.2	-172.7	-10	0	0	111.5	V74 C75 C78	V74-Q80 CarbonylContact C-O 3.55Å; V74-Q80 WeakPolarHBondContact CA-O 3.3Å; V74-Q80 WeakPolarHBondContact CB-O 3.22Å; C75-Q80 PolarHBondContact N-O 3.42Å; C78-Q80 HydrophobicContact CB-CG 4.4Å; C78-Q80 PolarHBondContact O-N 2.9Å; C78-Q80 VanDerWaalsContact O-N 3.1Å
81	Q	86.9	Confident	85.9	Confident	113 Å²	113	81.9 Å²	81.9	53%	0.528	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-61.6	150.1	172	-66.2	177.2	21.7	0	0	110.3	V74 P83	V74-Q81 HydrophobicContact CG1-CG 3.83Å; Q81-P83 VanDerWaalsContact O-CD 3.23Å; Q81-P83 WeakPolarHBondContact O-CD 3.31Å
82	F	86.9	Confident	85.7	Confident	16 Å²	16	76.4 Å²	76.4	7%	0.07	40%	0.399	C	S	.	.			trans	-75.1	114	-177.9	-58.8	-72.9	0	0	0	110.9	F73 V74 C75 E84 G85 F87 K94 C96	F73-F82 AromaticContact CD1-CD2 3.46Å; F73-F82 HydrophobicContact CD1-CD2 3.46Å; F73-F82 VanDerWaalsContact CD1-CD2 3.46Å; F73-F82 AromaticContact CD1-CE2 3.75Å; F73-F82 HydrophobicContact CD1-CE2 3.75Å; F73-F82 HydrophobicContact CD2-CE2 4.34Å; F73-F82 AromaticContact CE1-CD2 3.28Å; F73-F82 HydrophobicContact CE1-CD2 3.28Å; F73-F82 AromaticContact CE1-CE2 3.64Å; F73-F82 HydrophobicContact CE1-CE2 3.64Å; F73-F82 HydrophobicContact CE1-CG 4.34Å; F73-F82 HydrophobicContact CE2-CE2 4.24Å; F73-F82 HydrophobicContact CG-CD2 4.26Å; F73-F82 HydrophobicContact CG-CE2 4.11Å; F73-F82 AromaticContact CZ-CD2 3.95Å; F73-F82 HydrophobicContact CZ-CD2 3.95Å; F73-F82 AromaticContact CZ-CE2 3.89Å; F73-F82 HydrophobicContact CZ-CE2 3.89Å; V74-F82 VanDerWaalsContact C-CZ 3.48Å; C75-F82 HydrophobicContact CB-CE1 3.87Å; C75-F82 HydrophobicContact CB-CZ 4.33Å; F82-E84 PolarHBondContact O-N 2.8Å; F82-G85 PolarHBondContact O-N 3.11Å; F82-G85 VanDerWaalsContact O-N 3.09Å; F82-F87 HydrophobicContact CD1-CB 3.4Å; F82-F87 VanDerWaalsContact CD1-CB 3.4Å; F82-F87 HydrophobicContact CD2-CB 4.29Å; F82-F87 HydrophobicContact CE1-CB 3.51Å; F82-F87 HydrophobicContact CE2-CB 4.36Å; F82-F87 HydrophobicContact CG-CB 3.81Å; F82-F87 HydrophobicContact CZ-CB 4Å; F82-K94 HydrophobicContact CE1-CB 4.34Å; F82-K94 HydrophobicContact CE2-CB 4.29Å; F82-K94 HydrophobicContact CZ-CB 3.59Å; F82-C96 HydrophobicContact CD1-CB 4.37Å
83	P	77.5	Confident	85.6	Confident	90 Å²	90	83.1 Å²	83.1	58%	0.584	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-57.1	131.7	175.6	-20.4	33.2	0	0	0	109.7	Q81 G85 L86	Q81-P83 VanDerWaalsContact O-CD 3.23Å; Q81-P83 WeakPolarHBondContact O-CD 3.31Å; P83-G85 PolarHBondContact O-N 2.9Å; P83-L86 PolarHBondContact O-N 3.29Å; P83-L86 VanDerWaalsContact O-N 3.08Å
84	E	77.9	Confident	85.4	Confident	190 Å²	190	82.8 Å²	82.8	89%	0.888	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	58.9	11.9	-179.7	-51.5	-176.9	173	0	0	115	F82 L86	F82-E84 PolarHBondContact O-N 2.8Å; E84-L86 VanDerWaalsContact C-N 3.25Å; E84-L86 HydrophobicContact CB-CG 4.48Å; E84-L86 PolarHBondContact O-N 3.43Å
85	G	78.7	Confident	85.3	Confident	46 Å²	46	82.7 Å²	82.7	47%	0.474	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	71.8	14.9	-174.4	0	0	0	0	0	114.3	F82 P83 F87	F82-G85 PolarHBondContact O-N 3.11Å; F82-G85 VanDerWaalsContact O-N 3.09Å; P83-G85 PolarHBondContact O-N 2.9Å; G85-F87 WeakPolarHBondContact O-CD1 3.29Å
86	L	83	Confident	85.1	Confident	96 Å²	96	83.4 Å²	83.4	50%	0.503	42%	0.424	S	S	.	.			trans	-85.4	122.6	176.9	-68.1	173	0	0	0	111	P83 E84	P83-L86 PolarHBondContact O-N 3.29Å; P83-L86 VanDerWaalsContact O-N 3.08Å; E84-L86 VanDerWaalsContact C-N 3.25Å; E84-L86 HydrophobicContact CB-CG 4.48Å; E84-L86 PolarHBondContact O-N 3.43Å
87	F	87.7	Confident	84.9	Confident	61 Å²	61	86.3 Å²	86.3	27%	0.268	43%	0.432	S	S	.	.			trans	-144.7	157.2	177.4	64.6	-88.8	0	0	0	111.3	F73 F82 G85 K94 Y95	F73-F87 HydrophobicContact CE1-CD1 4.25Å; F73-F87 HydrophobicContact CE1-CE1 4.34Å; F73-F87 AromaticContact CZ-CD1 3.87Å; F73-F87 HydrophobicContact CZ-CD1 3.87Å; F73-F87 AromaticContact CZ-CE1 3.69Å; F73-F87 HydrophobicContact CZ-CE1 3.69Å; F73-F87 HydrophobicContact CZ-CZ 4.17Å; F82-F87 HydrophobicContact CD1-CB 3.4Å; F82-F87 VanDerWaalsContact CD1-CB 3.4Å; F82-F87 HydrophobicContact CD2-CB 4.29Å; F82-F87 HydrophobicContact CE1-CB 3.51Å; F82-F87 HydrophobicContact CE2-CB 4.36Å; F82-F87 HydrophobicContact CG-CB 3.81Å; F82-F87 HydrophobicContact CZ-CB 4Å; G85-F87 WeakPolarHBondContact O-CD1 3.29Å; F87-K94 HydrophobicContact CD2-CB 4.09Å; F87-K94 HydrophobicContact CD2-CD 4.08Å; F87-K94 HydrophobicContact CD2-CG 3.94Å; F87-K94 HydrophobicContact CE2-CD 3.94Å; F87-K94 HydrophobicContact CE2-CG 4.1Å; F87-Y95 WeakPolarHBondContact CA-O 2.94Å
88	Y	84.8	Confident	84.9	Confident	94 Å²	94	87.2 Å²	87.2	37%	0.369	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.9	174.8	-67.7	-98.3	0	0	0	109.2	K94 Y95 E97 F100	Y88-K94 CarbonylContact O-C 3.57Å; Y88-K94 WeakPolarHBondContact O-CA 3.49Å; Y88-Y95 PolarHBondContact N-O 2.95Å; Y88-Y95 PolarHBondContact O-N 3.19Å; Y88-E97 HydrophobicContact CD2-CB 4.31Å; Y88-E97 HydrophobicContact CE2-CB 3.74Å; Y88-E97 HydrophobicContact CE2-CG 3.81Å; Y88-F100 VanDerWaalsContact CB-CG 3.5Å; Y88-F100 AromaticContact CD1-CD1 3.91Å; Y88-F100 HydrophobicContact CD1-CD1 3.91Å; Y88-F100 HydrophobicContact CD1-CE1 4.02Å; Y88-F100 HydrophobicContact CD1-CG 4.2Å; Y88-F100 HydrophobicContact CD1-CZ 4.38Å; Y88-F100 HydrophobicContact CD2-CB 4.24Å; Y88-F100 HydrophobicContact CD2-CG 4.4Å; Y88-F100 HydrophobicContact CG-CB 4.09Å; Y88-F100 AromaticContact CG-CD1 3.94Å; Y88-F100 HydrophobicContact CG-CD1 3.94Å; Y88-F100 HydrophobicContact CG-CD2 4.15Å; Y88-F100 HydrophobicContact CG-CE1 4.43Å; Y88-F100 AromaticContact CG-CG 3.79Å; Y88-F100 HydrophobicContact CG-CG 3.79Å
89	E	86.5	Confident	84.6	Confident	103 Å²	103	86 Å²	86	48%	0.481	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.3	178.7	-164	178	144.8	0	0	110.5	R93	E89-R93 CarbonylContact C-O 3.6Å; E89-R93 VanDerWaalsContact CA-O 3.31Å; E89-R93 WeakPolarHBondContact CA-O 3.07Å
90	F	81.5	Confident	84.4	Confident	73 Å²	73	81.9 Å²	81.9	32%	0.32	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	126.1	175.6	-168	-96.6	0	0	0	109.5	G92 R93 Y95 F100 F104	F90-G92 PolarHBondContact O-N 2.97Å; F90-R93 PolarHBondContact N-O 3.06Å; F90-R93 PolarHBondContact O-N 3.08Å; F90-Y95 HydrophobicContact CB-CD2 4.14Å; F90-Y95 HydrophobicContact CB-CE2 3.81Å; F90-F100 HydrophobicContact CB-CD2 4.45Å; F90-F100 HydrophobicContact CB-CE2 3.99Å; F90-F100 HydrophobicContact CD2-CE2 4.29Å; F90-F100 HydrophobicContact CG-CE2 4.47Å; F90-F104 HydrophobicContact CB-CE2 4.07Å; F90-F104 HydrophobicContact CB-CZ 4.2Å; F90-F104 HydrophobicContact CD1-CD1 4.02Å; F90-F104 AromaticContact CD1-CE1 3.35Å; F90-F104 HydrophobicContact CD1-CE1 3.35Å; F90-F104 HydrophobicContact CD1-CE2 4.07Å; F90-F104 AromaticContact CD1-CZ 3.38Å; F90-F104 HydrophobicContact CD1-CZ 3.38Å; F90-F104 HydrophobicContact CD2-CD1 4.48Å; F90-F104 AromaticContact CE1-CD1 3.85Å; F90-F104 HydrophobicContact CE1-CD1 3.85Å; F90-F104 AromaticContact CE1-CE1 3.35Å; F90-F104 HydrophobicContact CE1-CE1 3.35Å; F90-F104 AromaticContact CE1-CZ 3.91Å; F90-F104 HydrophobicContact CE1-CZ 3.91Å; F90-F104 HydrophobicContact CE2-CD1 4.33Å; F90-F104 HydrophobicContact CG-CD1 4.33Å; F90-F104 HydrophobicContact CG-CD2 4.4Å; F90-F104 HydrophobicContact CG-CE1 4.01Å; F90-F104 HydrophobicContact CG-CE2 4.09Å; F90-F104 AromaticContact CG-CZ 3.88Å; F90-F104 HydrophobicContact CG-CZ 3.88Å; F90-F104 HydrophobicContact CZ-CD1 4.02Å; F90-F104 HydrophobicContact CZ-CE1 4Å
91	E	85	Confident	84	Confident	166 Å²	166	77.2 Å²	77.2	78%	0.776	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	41.1	-178.5	-64.8	-179.4	164.7	0	0	113.4	R93	E91-R93 PolarHBondContact O-N 3.01Å
92	G	83.7	Confident	83.5	Confident	54 Å²	54	76.9 Å²	76.9	56%	0.557	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	4.8	-179.8	0	0	0	0	0	115.1	F90	F90-G92 PolarHBondContact O-N 2.97Å
93	R	85.9	Confident	83.2	Confident	160 Å²	160	80 Å²	80	60%	0.604	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	143.7	176.8	-64.6	-179.5	-178.2	-175.6	2.1	111	A76 E89 F90 E91 Y95	A76-R93 HydrophobicContact CB-CB 4Å; E89-R93 CarbonylContact C-O 3.6Å; E89-R93 VanDerWaalsContact CA-O 3.31Å; E89-R93 WeakPolarHBondContact CA-O 3.07Å; F90-R93 PolarHBondContact N-O 3.06Å; F90-R93 PolarHBondContact O-N 3.08Å; E91-R93 PolarHBondContact O-N 3.01Å; R93-Y95 HydrophobicContact CB-CD2 4.44Å; R93-Y95 HydrophobicContact CB-CE2 3.59Å; R93-Y95 WeakPolarHBondContact CD-OH 3.47Å; R93-Y95 WeakPolarHBondContact O-CD2 3.42Å; R93-Y95 WeakPolarHBondContact O-CE2 3.45Å
94	K	88.2	Confident	83.4	Confident	15 Å²	15	79 Å²	79	7%	0.065	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.5	-178	-60	177.8	176.9	66.9	0	110	S63 E66 Y68 F73 C75 A76 F82 F87 Y88	S63-K94 WeakPolarHBondContact OG-CE 3.47Å; E66-K94 IonicContact OE2-NZ 3.99Å; E66-K94 PolarHBondContact OE2-NZ 3.05Å; Y68-K94 PolarHBondContact OH-NZ 2.99Å; F73-K94 HydrophobicContact CD2-CD 4.35Å; F73-K94 HydrophobicContact CE2-CD 3.48Å; F73-K94 VanDerWaalsContact CE2-CD 3.48Å; F73-K94 HydrophobicContact CZ-CD 4.04Å; C75-K94 CarbonylContact C-O 3.58Å; C75-K94 WeakPolarHBondContact CA-O 2.89Å; A76-K94 WeakPolarHBondContact CB-O 3.44Å; A76-K94 PolarHBondContact N-O 3.36Å; F82-K94 HydrophobicContact CE1-CB 4.34Å; F82-K94 HydrophobicContact CE2-CB 4.29Å; F82-K94 HydrophobicContact CZ-CB 3.59Å; F87-K94 HydrophobicContact CD2-CB 4.09Å; F87-K94 HydrophobicContact CD2-CD 4.08Å; F87-K94 HydrophobicContact CD2-CG 3.94Å; F87-K94 HydrophobicContact CE2-CD 3.94Å; F87-K94 HydrophobicContact CE2-CG 4.1Å; Y88-K94 CarbonylContact O-C 3.57Å; Y88-K94 WeakPolarHBondContact O-CA 3.49Å
95	Y	86.9	Confident	83.5	Confident	13 Å²	13	71 Å²	71	5%	0.051	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	145.8	-177.9	-60.8	-90.5	0	0	0	110.7	A76 Q77 F87 Y88 F90 R93 D99 F100 L103 F104	A76-Y95 HydrophobicContact CB-CD1 4.33Å; A76-Y95 HydrophobicContact CB-CE1 4.04Å; Q77-Y95 HydrophobicContact CB-CD1 4.08Å; Q77-Y95 HydrophobicContact CB-CE1 4.27Å; F87-Y95 WeakPolarHBondContact CA-O 2.94Å; Y88-Y95 PolarHBondContact N-O 2.95Å; Y88-Y95 PolarHBondContact O-N 3.19Å; F90-Y95 HydrophobicContact CB-CD2 4.14Å; F90-Y95 HydrophobicContact CB-CE2 3.81Å; R93-Y95 HydrophobicContact CB-CD2 4.44Å; R93-Y95 HydrophobicContact CB-CE2 3.59Å; R93-Y95 WeakPolarHBondContact CD-OH 3.47Å; R93-Y95 WeakPolarHBondContact O-CD2 3.42Å; R93-Y95 WeakPolarHBondContact O-CE2 3.45Å; Y95-D99 HydrophobicContact CD1-CB 4.45Å; Y95-F100 HydrophobicContact CD2-CD2 4.46Å; Y95-L103 HydrophobicContact CD1-CD1 3.99Å; Y95-L103 HydrophobicContact CE1-CD1 3.74Å; Y95-F104 HydrophobicContact CD1-CE2 4.36Å; Y95-F104 HydrophobicContact CD2-CE2 4.06Å; Y95-F104 HydrophobicContact CE1-CE2 4.2Å; Y95-F104 HydrophobicContact CE1-CZ 4.41Å; Y95-F104 AromaticContact CE2-CE2 3.88Å; Y95-F104 HydrophobicContact CE2-CE2 3.88Å; Y95-F104 HydrophobicContact CE2-CZ 4.12Å; Y95-F104 HydrophobicContact CG-CE2 4.29Å; Y95-F104 AromaticContact CZ-CE2 3.95Å; Y95-F104 AromaticContact CZ-CZ 3.94Å
96	C	86	Confident	83.8	Confident	16 Å²	16	71.2 Å²	71.2	11%	0.108	35%	0.349	C	S	.	.			trans	-69.6	162.8	166.6	72.6	0	0	0	0	109	C75 F82 H98 D99 F100	C75-C96 HydrophobicContact CB-CB 4.15Å; C75-C96 PolarHBondContact SG-N 3.01Å; F82-C96 HydrophobicContact CD1-CB 4.37Å; C96-H98 VanDerWaalsContact C-N 3.27Å; C96-H98 PolarHBondContact O-N 2.85Å; C96-D99 PolarHBondContact O-N 2.95Å; C96-D99 VanDerWaalsContact SG-CG 3.52Å; C96-D99 PolarHBondContact SG-N 3.32Å; C96-D99 VanDerWaalsContact SG-N 3.36Å; C96-D99 PolarHBondContact SG-OD2 2.79Å; C96-F100 WeakPolarHBondContact O-CB 3.43Å; C96-F100 PolarHBondContact O-N 2.8Å
97	E	84.4	Confident	84	Confident	92 Å²	92	69.9 Å²	69.9	43%	0.43	35%	0.347	S	S	.	.	H	α-helix	trans	-53.4	-44.9	179.8	-176.6	172.5	-171.3	0	0	112.4	Y88 F100 Q101	Y88-E97 HydrophobicContact CD2-CB 4.31Å; Y88-E97 HydrophobicContact CE2-CB 3.74Å; Y88-E97 HydrophobicContact CE2-CG 3.81Å; E97-F100 PolarHBondContact O-N 3.4Å; E97-Q101 VanDerWaalsContact CG-NE2 3.33Å; E97-Q101 WeakPolarHBondContact O-CB 3.15Å; E97-Q101 VanDerWaalsContact O-CG 3.23Å; E97-Q101 WeakPolarHBondContact O-CG 3.33Å; E97-Q101 PolarHBondContact O-N 3.27Å; E97-Q101 PolarHBondContact OE1-NE2 3.37Å
98	H	84	Confident	84.2	Confident	118 Å²	118	67 Å²	67	55%	0.546	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-52.1	-179.9	-177.6	71.5	0	0	0	112.5	C96 F100 Q101 M102	C96-H98 VanDerWaalsContact C-N 3.27Å; C96-H98 PolarHBondContact O-N 2.85Å; H98-F100 VanDerWaalsContact C-N 3.33Å; H98-F100 PolarHBondContact O-N 3.36Å; H98-Q101 PolarHBondContact O-N 2.86Å; H98-M102 VanDerWaalsContact O-CG 3.29Å; H98-M102 WeakPolarHBondContact O-CG 3.32Å; H98-M102 PolarHBondContact O-N 2.83Å
99	D	84.1	Confident	84.6	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.102	34%	0.342	C	S	.	.	H	α-helix	trans	-67.6	-36.1	-178.1	-70.8	-30.9	0	0	0	111.7	C75 Q77 C78 Y95 C96 Q101 M102 L103	C75-D99 PolarHBondContact SG-OD2 2.92Å; Q77-D99 HydrophobicContact CB-CB 3.8Å; Q77-D99 WeakPolarHBondContact CB-OD2 3.37Å; Q77-D99 HydrophobicContact CG-CB 4.01Å; C78-D99 WeakPolarHBondContact CB-OD2 3.2Å; C78-D99 PolarHBondContact N-OD2 3.36Å; C78-D99 PolarHBondContact SG-OD2 3.21Å; Y95-D99 HydrophobicContact CD1-CB 4.45Å; C96-D99 PolarHBondContact O-N 2.95Å; C96-D99 VanDerWaalsContact SG-CG 3.52Å; C96-D99 PolarHBondContact SG-N 3.32Å; C96-D99 VanDerWaalsContact SG-N 3.36Å; C96-D99 PolarHBondContact SG-OD2 2.79Å; D99-Q101 VanDerWaalsContact C-N 3.35Å; D99-M102 PolarHBondContact O-N 3.43Å; D99-L103 VanDerWaalsContact O-CB 3.3Å; D99-L103 WeakPolarHBondContact O-CB 3.44Å; D99-L103 WeakPolarHBondContact O-CG 3.5Å; D99-L103 PolarHBondContact O-N 3.44Å
100	F	84.6	Confident	84.8	Confident	48 Å²	48	68.6 Å²	68.6	21%	0.211	35%	0.345	C	S	.	.	H	α-helix	trans	-63	-43.7	175.1	-175.1	-91.6	0	0	0	111.4	Y88 F90 Y95 C96 E97 H98 F104	Y88-F100 VanDerWaalsContact CB-CG 3.5Å; Y88-F100 AromaticContact CD1-CD1 3.91Å; Y88-F100 HydrophobicContact CD1-CD1 3.91Å; Y88-F100 HydrophobicContact CD1-CE1 4.02Å; Y88-F100 HydrophobicContact CD1-CG 4.2Å; Y88-F100 HydrophobicContact CD1-CZ 4.38Å; Y88-F100 HydrophobicContact CD2-CB 4.24Å; Y88-F100 HydrophobicContact CD2-CG 4.4Å; Y88-F100 HydrophobicContact CG-CB 4.09Å; Y88-F100 AromaticContact CG-CD1 3.94Å; Y88-F100 HydrophobicContact CG-CD1 3.94Å; Y88-F100 HydrophobicContact CG-CD2 4.15Å; Y88-F100 HydrophobicContact CG-CE1 4.43Å; Y88-F100 AromaticContact CG-CG 3.79Å; Y88-F100 HydrophobicContact CG-CG 3.79Å; F90-F100 HydrophobicContact CB-CD2 4.45Å; F90-F100 HydrophobicContact CB-CE2 3.99Å; F90-F100 HydrophobicContact CD2-CE2 4.29Å; F90-F100 HydrophobicContact CG-CE2 4.47Å; Y95-F100 HydrophobicContact CD2-CD2 4.46Å; C96-F100 WeakPolarHBondContact O-CB 3.43Å; C96-F100 PolarHBondContact O-N 2.8Å; E97-F100 PolarHBondContact O-N 3.4Å; H98-F100 VanDerWaalsContact C-N 3.33Å; H98-F100 PolarHBondContact O-N 3.36Å; F100-F104 AromaticContact CD2-CD2 3.49Å; F100-F104 HydrophobicContact CD2-CD2 3.49Å; F100-F104 VanDerWaalsContact CD2-CD2 3.49Å; F100-F104 HydrophobicContact CD2-CE2 4.01Å; F100-F104 HydrophobicContact CD2-CG 4.48Å; F100-F104 AromaticContact CE2-CD2 3.77Å; F100-F104 HydrophobicContact CE2-CD2 3.77Å; F100-F104 HydrophobicContact CE2-CE2 4.41Å; F100-F104 HydrophobicContact CE2-CG 4.39Å; F100-F104 HydrophobicContact CG-CD2 4Å; F100-F104 HydrophobicContact CZ-CB 4.4Å; F100-F104 HydrophobicContact CZ-CD2 4.45Å; F100-F104 WeakPolarHBondContact O-CB 3.48Å; F100-F104 WeakPolarHBondContact O-CD2 3.46Å; F100-F104 PolarHBondContact O-N 3.15Å
101	Q	79.9	Confident	85.3	Confident	39 Å²	39	68 Å²	68	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-63.1	-48.6	176.4	-72.4	171.7	5.5	0	0	111.4	E97 H98 D99 L103 A105 F114	E97-Q101 VanDerWaalsContact CG-NE2 3.33Å; E97-Q101 WeakPolarHBondContact O-CB 3.15Å; E97-Q101 VanDerWaalsContact O-CG 3.23Å; E97-Q101 WeakPolarHBondContact O-CG 3.33Å; E97-Q101 PolarHBondContact O-N 3.27Å; E97-Q101 PolarHBondContact OE1-NE2 3.37Å; H98-Q101 PolarHBondContact O-N 2.86Å; D99-Q101 VanDerWaalsContact C-N 3.35Å; Q101-L103 VanDerWaalsContact C-N 3.29Å; Q101-L103 PolarHBondContact O-N 2.84Å; Q101-A105 HydrophobicContact CB-CB 4.29Å; Q101-A105 WeakPolarHBondContact O-CB 3.23Å; Q101-A105 PolarHBondContact O-N 3.14Å; Q101-F114 HydrophobicContact CB-CD2 4.31Å; Q101-F114 HydrophobicContact CB-CG 4.42Å; Q101-F114 WeakPolarHBondContact O-CE1 3.41Å
102	M	76.9	Confident	85.4	Confident	106 Å²	106	62.3 Å²	62.3	52%	0.522	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-34.9	-179.5	-71.7	-67.6	-61.8	0	0	113.5	H98 D99 F114	H98-M102 VanDerWaalsContact O-CG 3.29Å; H98-M102 WeakPolarHBondContact O-CG 3.32Å; H98-M102 PolarHBondContact O-N 2.83Å; D99-M102 PolarHBondContact O-N 3.43Å; M102-F114 HydrophobicContact CG-CZ 4.33Å; M102-F114 HydrophobicContact SD-CE2 3.73Å; M102-F114 HydrophobicContact SD-CZ 3.43Å; M102-F114 WeakPolarHBondContact SD-CZ 3.48Å
103	L	79.9	Confident	85.6	Confident	81 Å²	81	65.7 Å²	65.7	42%	0.424	34%	0.336	S	S	.	.	H	α-helix	trans	-89.8	-33.6	-176.2	-67.4	173	0	0	0	113.4	Q77 Y95 D99 Q101	Q77-L103 HydrophobicContact CB-CD1 4.3Å; Q77-L103 HydrophobicContact CG-CD1 4.07Å; Y95-L103 HydrophobicContact CD1-CD1 3.99Å; Y95-L103 HydrophobicContact CE1-CD1 3.74Å; D99-L103 VanDerWaalsContact O-CB 3.3Å; D99-L103 WeakPolarHBondContact O-CB 3.44Å; D99-L103 WeakPolarHBondContact O-CG 3.5Å; D99-L103 PolarHBondContact O-N 3.44Å; Q101-L103 VanDerWaalsContact C-N 3.29Å; Q101-L103 PolarHBondContact O-N 2.84Å
104	F	82.3	Confident	85.6	Confident	70 Å²	70	60.7 Å²	60.7	31%	0.307	32%	0.319	S	S	.	.	H	α-helix	trans	-126.8	-20.3	-166.1	-51.4	-66.8	0	0	0	114.8	F90 Y95 F100	F90-F104 HydrophobicContact CB-CE2 4.07Å; F90-F104 HydrophobicContact CB-CZ 4.2Å; F90-F104 HydrophobicContact CD1-CD1 4.02Å; F90-F104 AromaticContact CD1-CE1 3.35Å; F90-F104 HydrophobicContact CD1-CE1 3.35Å; F90-F104 HydrophobicContact CD1-CE2 4.07Å; F90-F104 AromaticContact CD1-CZ 3.38Å; F90-F104 HydrophobicContact CD1-CZ 3.38Å; F90-F104 HydrophobicContact CD2-CD1 4.48Å; F90-F104 AromaticContact CE1-CD1 3.85Å; F90-F104 HydrophobicContact CE1-CD1 3.85Å; F90-F104 AromaticContact CE1-CE1 3.35Å; F90-F104 HydrophobicContact CE1-CE1 3.35Å; F90-F104 AromaticContact CE1-CZ 3.91Å; F90-F104 HydrophobicContact CE1-CZ 3.91Å; F90-F104 HydrophobicContact CE2-CD1 4.33Å; F90-F104 HydrophobicContact CG-CD1 4.33Å; F90-F104 HydrophobicContact CG-CD2 4.4Å; F90-F104 HydrophobicContact CG-CE1 4.01Å; F90-F104 HydrophobicContact CG-CE2 4.09Å; F90-F104 AromaticContact CG-CZ 3.88Å; F90-F104 HydrophobicContact CG-CZ 3.88Å; F90-F104 HydrophobicContact CZ-CD1 4.02Å; F90-F104 HydrophobicContact CZ-CE1 4Å; Y95-F104 HydrophobicContact CD1-CE2 4.36Å; Y95-F104 HydrophobicContact CD2-CE2 4.06Å; Y95-F104 HydrophobicContact CE1-CE2 4.2Å; Y95-F104 HydrophobicContact CE1-CZ 4.41Å; Y95-F104 AromaticContact CE2-CE2 3.88Å; Y95-F104 HydrophobicContact CE2-CE2 3.88Å; Y95-F104 HydrophobicContact CE2-CZ 4.12Å; Y95-F104 HydrophobicContact CG-CE2 4.29Å; Y95-F104 AromaticContact CZ-CE2 3.95Å; Y95-F104 AromaticContact CZ-CZ 3.94Å; F100-F104 AromaticContact CD2-CD2 3.49Å; F100-F104 HydrophobicContact CD2-CD2 3.49Å; F100-F104 VanDerWaalsContact CD2-CD2 3.49Å; F100-F104 HydrophobicContact CD2-CE2 4.01Å; F100-F104 HydrophobicContact CD2-CG 4.48Å; F100-F104 AromaticContact CE2-CD2 3.77Å; F100-F104 HydrophobicContact CE2-CD2 3.77Å; F100-F104 HydrophobicContact CE2-CE2 4.41Å; F100-F104 HydrophobicContact CE2-CG 4.39Å; F100-F104 HydrophobicContact CG-CD2 4Å; F100-F104 HydrophobicContact CZ-CB 4.4Å; F100-F104 HydrophobicContact CZ-CD2 4.45Å; F100-F104 WeakPolarHBondContact O-CB 3.48Å; F100-F104 WeakPolarHBondContact O-CD2 3.46Å; F100-F104 PolarHBondContact O-N 3.15Å
105	A	79.2	Confident	85.4	Confident	20 Å²	20	60.4 Å²	60.4	17%	0.165	32%	0.318	C	S	.	.	S	Bend	trans	-76.1	130.3	-178.4	0	0	0	0	0	110.8	Q101 C107 F114	Q101-A105 HydrophobicContact CB-CB 4.29Å; Q101-A105 WeakPolarHBondContact O-CB 3.23Å; Q101-A105 PolarHBondContact O-N 3.14Å; A105-C107 PolarHBondContact O-N 2.85Å; A105-F114 HydrophobicContact CB-CB 4Å; A105-F114 HydrophobicContact CB-CD1 3.76Å; A105-F114 HydrophobicContact CB-CG 4.14Å
106	P	85.1	Confident	85.1	Confident	51 Å²	51	65.8 Å²	65.8	33%	0.331	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-69.7	133.8	176.1	26.2	-29.4	0	0	0	110.2	I115 V119	P106-I115 HydrophobicContact CG-CB 4.29Å; P106-I115 HydrophobicContact CG-CD1 4.48Å; P106-I115 WeakPolarHBondContact O-CB 3.42Å; P106-I115 WeakPolarHBondContact O-CG1 3.2Å; P106-I115 PolarHBondContact O-N 2.81Å; P106-V119 HydrophobicContact CG-CG2 4.25Å
107	C	87.9	Confident	85	Confident	68 Å²	68	68.4 Å²	68.4	46%	0.459	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-78	141.3	172	-59.3	0	0	0	0	110.8	A105	A105-C107 PolarHBondContact O-N 2.85Å
108	C	92.4	Very high	85.1	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.014	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-73.6	131.9	171.1	176.5	0	0	0	0	111.2	Q110 C111 G112 E113 I115 S126 H128 C131	C108-Q110 VanDerWaalsContact C-N 3.26Å; C108-Q110 PolarHBondContact O-N 3.44Å; C108-Q110 PolarHBondContact SG-N 2.84Å; C108-Q110 VanDerWaalsContact SG-N 3.38Å; C108-C111 VanDerWaalsContact CB-SG 3.53Å; C108-G112 WeakPolarHBondContact O-CA 3.48Å; C108-G112 PolarHBondContact O-N 3.43Å; C108-E113 PolarHBondContact N-O 3.42Å; C108-I115 HydrophobicContact CB-CD1 3.97Å; C108-I115 HydrophobicContact CB-CG1 3.79Å; C108-S126 CarbonylContact C-O 3.56Å; C108-S126 WeakPolarHBondContact CA-O 3.49Å; C108-H128 VanDerWaalsContact CB-CE1 3.42Å; C108-H128 WeakPolarHBondContact CB-CE1 3.4Å; C108-H128 WeakPolarHBondContact CB-ND1 3.5Å; C108-H128 PolarHBondContact SG-N 2.93Å; C108-C131 VanDerWaalsContact SG-CB 3.54Å
109	H	91.4	Very high	85.4	Confident	112 Å²	112	65.7 Å²	65.7	52%	0.519	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.9	178.8	-172.8	82.2	0	0	0	114.1	N125 S126 W127	H109-N125 HydrophobicContact CB-CB 3.84Å; H109-N125 PolarHBondContact CE1-ND2 2.98Å; H109-N125 VanDerWaalsContact CE1-ND2 3.32Å; H109-N125 PolarHBondContact ND1-ND2 3.16Å; H109-N125 VanDerWaalsContact ND1-ND2 3.16Å; H109-S126 PolarHBondContact N-O 2.96Å; H109-W127 HydrophobicContact CB-CD2 4.09Å; H109-W127 HydrophobicContact CB-CE3 3.99Å; H109-W127 HydrophobicContact CB-CH2 3.86Å; H109-W127 HydrophobicContact CB-CZ2 3.93Å; H109-W127 HydrophobicContact CB-CZ3 3.88Å; H109-W127 AromaticContact CD2-CH2 3.22Å; H109-W127 WeakPolarHBondContact CD2-CH2 3.32Å; H109-W127 AromaticContact CD2-CZ2 3.78Å; H109-W127 AromaticContact CD2-CZ3 3.75Å; H109-W127 AromaticContact CG-CH2 3.82Å
110	Q	90.7	Very high	85.8	Confident	118 Å²	118	65.9 Å²	65.9	55%	0.551	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-49.6	-178.1	-175.4	65.9	-0.4	0	0	113.1	C108 W127 C131	C108-Q110 VanDerWaalsContact C-N 3.26Å; C108-Q110 PolarHBondContact O-N 3.44Å; C108-Q110 PolarHBondContact SG-N 2.84Å; C108-Q110 VanDerWaalsContact SG-N 3.38Å; Q110-W127 HydrophobicContact CB-CE3 3.96Å; Q110-W127 HydrophobicContact CB-CZ3 3.92Å; Q110-C131 HydrophobicContact CB-CB 3.88Å; Q110-C131 HydrophobicContact CG-CB 4.29Å
111	C	93.1	Very high	86.2	Confident	60 Å²	60	71.7 Å²	71.7	41%	0.405	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-14.9	-175.3	62.7	0	0	0	0	113.7	C108 E113 H128	C108-C111 VanDerWaalsContact CB-SG 3.53Å; C111-E113 PolarHBondContact O-N 2.91Å; C111-H128 PolarHBondContact SG-CE1 3.32Å; C111-H128 PolarHBondContact SG-ND1 2.83Å; C111-H128 VanDerWaalsContact SG-ND1 3.37Å
112	G	87.7	Confident	86.6	Confident	46 Å²	46	70.2 Å²	70.2	47%	0.474	38%	0.383	S	S	.	.			trans	81.8	-17.1	-176.1	0	0	0	0	0	114.8	C108	C108-G112 WeakPolarHBondContact O-CA 3.48Å; C108-G112 PolarHBondContact O-N 3.43Å
113	E	87.5	Confident	87.1	Confident	126 Å²	126	67.2 Å²	67.2	59%	0.589	37%	0.368	S	S	*	.			trans	-72.3	155.4	-176	-62.8	-60.5	153.7	0	0	113.3	C108 C111 I115 H128	C108-E113 PolarHBondContact N-O 3.42Å; C111-E113 PolarHBondContact O-N 2.91Å; E113-I115 PolarHBondContact O-N 2.89Å; E113-H128 PolarHBondContact O-CE1 2.98Å
114	F	85.1	Confident	87.4	Confident	55 Å²	55	71.4 Å²	71.4	24%	0.241	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-61.9	135.5	175	-62.7	-64	0	0	0	111.6	Q101 M102 A105 I116 H128	Q101-F114 HydrophobicContact CB-CD2 4.31Å; Q101-F114 HydrophobicContact CB-CG 4.42Å; Q101-F114 WeakPolarHBondContact O-CE1 3.41Å; M102-F114 HydrophobicContact CG-CZ 4.33Å; M102-F114 HydrophobicContact SD-CE2 3.73Å; M102-F114 HydrophobicContact SD-CZ 3.43Å; M102-F114 WeakPolarHBondContact SD-CZ 3.48Å; A105-F114 HydrophobicContact CB-CB 4Å; A105-F114 HydrophobicContact CB-CD1 3.76Å; A105-F114 HydrophobicContact CB-CG 4.14Å; F114-I116 PolarHBondContact O-N 3.2Å; F114-H128 PolarHBondContact O-NE2 3.19Å
115	I	85.1	Confident	87.9	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.041	39%	0.39	C	S	.	.			trans	-89.3	109.1	176.4	-55.7	163.1	0	0	0	108.9	P106 C108 E113 R118 V119 W127 H128	P106-I115 HydrophobicContact CG-CB 4.29Å; P106-I115 HydrophobicContact CG-CD1 4.48Å; P106-I115 WeakPolarHBondContact O-CB 3.42Å; P106-I115 WeakPolarHBondContact O-CG1 3.2Å; P106-I115 PolarHBondContact O-N 2.81Å; C108-I115 HydrophobicContact CB-CD1 3.97Å; C108-I115 HydrophobicContact CB-CG1 3.79Å; E113-I115 PolarHBondContact O-N 2.89Å; I115-R118 WeakPolarHBondContact CG2-O 3.42Å; I115-V119 HydrophobicContact CD1-CG2 3.9Å; I115-V119 HydrophobicContact CG2-CB 4.08Å; I115-V119 HydrophobicContact CG2-CG2 4.46Å; I115-W127 VanDerWaalsContact CD1-C 3.43Å; I115-H128 WeakPolarHBondContact CA-NE2 3.24Å
116	I	80.9	Confident	88.6	Confident	126 Å²	126	70.9 Å²	70.9	65%	0.646	39%	0.391	S	S	*	.			trans	-96.9	121.9	174.2	-55.3	176.5	0	0	0	108.2	F114	F114-I116 PolarHBondContact O-N 3.2Å
117	G	82.9	Confident	89	Confident	71 Å²	71	68.8 Å²	68.8	73%	0.732	38%	0.376	S	S	*	.	S	Bend	trans	92.2	-122.8	178	0	0	0	0	0	114.1	V119	G117-V119 PolarHBondContact O-N 3.36Å
118	R	87.6	Confident	89.2	Confident	101 Å²	101	67.4 Å²	67.4	38%	0.381	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-71.4	119.4	-175.4	-176.3	-175.9	-179.1	-169.6	-1.8	109.8	I115 I120 P129 A142 D143	I115-R118 WeakPolarHBondContact CG2-O 3.42Å; R118-I120 HydrophobicContact CG-CD1 4.49Å; R118-P129 HydrophobicContact CB-CG 4Å; R118-P129 HydrophobicContact CG-CG 3.96Å; R118-P129 VanDerWaalsContact O-CD 3.31Å; R118-P129 WeakPolarHBondContact O-CD 3.39Å; R118-A142 PolarHBondContact NH2-O 3Å; R118-D143 IonicContact CZ-OD1 3.22Å; R118-D143 IonicContact NH1-OD1 2.71Å; R118-D143 PolarHBondContact NH1-OD1 2.81Å; R118-D143 IonicContact NH1-OD2 2.9Å; R118-D143 IonicContact NH2-OD1 3.83Å; R118-D143 PolarHBondContact NH2-OD1 3.45Å
119	V	89.9	Confident	89.3	Confident	52 Å²	52	68.7 Å²	68.7	32%	0.315	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-103	132.3	172.2	60.1	0	0	0	0	110.8	P106 I115 G117 K121	P106-V119 HydrophobicContact CG-CG2 4.25Å; I115-V119 HydrophobicContact CD1-CG2 3.9Å; I115-V119 HydrophobicContact CG2-CB 4.08Å; I115-V119 HydrophobicContact CG2-CG2 4.46Å; G117-V119 PolarHBondContact O-N 3.36Å; V119-K121 HydrophobicContact CG2-CG 4.26Å
120	I	92.2	Very high	89.4	Confident	24 Å²	24	70.1 Å²	70.1	12%	0.123	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.4	167.1	-53.8	-56.5	0	0	0	107.6	R118 A122 S126 W127 P129 F132 A142	R118-I120 HydrophobicContact CG-CD1 4.49Å; I120-A122 HydrophobicContact CG2-CB 4.17Å; I120-S126 CarbonylContact O-C 3.58Å; I120-S126 WeakPolarHBondContact O-CA 3.23Å; I120-W127 HydrophobicContact CB-CB 4.24Å; I120-W127 PolarHBondContact N-O 3.42Å; I120-W127 PolarHBondContact O-N 2.98Å; I120-P129 HydrophobicContact CG1-CB 4.42Å; I120-P129 HydrophobicContact CG1-CG 4.32Å; I120-F132 HydrophobicContact CG2-CD1 3.83Å; I120-F132 HydrophobicContact CG2-CE1 4.25Å; I120-F132 HydrophobicContact CG2-CG 4.12Å; I120-A142 HydrophobicContact CD1-CB 3.98Å; I120-A142 HydrophobicContact CG1-CB 4.15Å
121	K	91.7	Very high	89.6	Confident	170 Å²	170	65.8 Å²	65.8	74%	0.739	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	105.4	171.4	-69	-170.8	177.8	-176.1	0	108.8	V119 N125	V119-K121 HydrophobicContact CG2-CG 4.26Å; K121-N125 WeakPolarHBondContact CA-O 3.47Å
122	A	89.7	Confident	89.6	Confident	8 Å²	8	63 Å²	63	7%	0.066	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	148.2	-178.3	0	0	0	0	0	109.8	I120 N124 N125 W127 F132 F146	I120-A122 HydrophobicContact CG2-CB 4.17Å; A122-N124 PolarHBondContact O-N 3.48Å; A122-N125 PolarHBondContact N-O 2.9Å; A122-N125 CarbonylContact O-C 3.54Å; A122-N125 PolarHBondContact O-N 3.13Å; A122-W127 PolarHBondContact O-NE1 2.84Å; A122-F132 HydrophobicContact CB-CE1 4.23Å; A122-F132 HydrophobicContact CB-CE2 3.82Å; A122-F132 HydrophobicContact CB-CZ 3.61Å; A122-F146 HydrophobicContact CB-CE1 3.9Å; A122-F146 HydrophobicContact CB-CZ 3.75Å
123	M	86.7	Confident	90	Very high	42 Å²	42	65.3 Å²	65.3	21%	0.207	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	32.7	176.5	-59.7	-73	-67.7	0	0	113.8	N125 F146 K148 G151	M123-N125 PolarHBondContact O-N 3.14Å; M123-F146 HydrophobicContact CG-CE2 4.22Å; M123-F146 HydrophobicContact SD-CE2 4.28Å; M123-K148 HydrophobicContact CE-CD 4.3Å; M123-K148 HydrophobicContact CE-CG 4.15Å; M123-K148 HydrophobicContact SD-CB 4.09Å; M123-K148 HydrophobicContact SD-CD 3.56Å; M123-K148 VanDerWaalsContact SD-CD 3.56Å; M123-K148 HydrophobicContact SD-CG 3.56Å; M123-K148 VanDerWaalsContact SD-CG 3.56Å; M123-G151 WeakPolarHBondContact CE-O 3.42Å
124	N	87.2	Confident	90.3	Very high	169 Å²	169	59.3 Å²	59.3	90%	0.904	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	16.5	-172.9	-58	-15.1	0	0	0	114.9	A122	A122-N124 PolarHBondContact O-N 3.48Å
125	N	92.2	Very high	90.7	Very high	52 Å²	52	60.3 Å²	60.3	28%	0.278	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	161.5	-178.8	-73.5	-31.2	0	0	0	111	H109 K121 A122 M123 W127	H109-N125 HydrophobicContact CB-CB 3.84Å; H109-N125 PolarHBondContact CE1-ND2 2.98Å; H109-N125 VanDerWaalsContact CE1-ND2 3.32Å; H109-N125 PolarHBondContact ND1-ND2 3.16Å; H109-N125 VanDerWaalsContact ND1-ND2 3.16Å; K121-N125 WeakPolarHBondContact CA-O 3.47Å; A122-N125 PolarHBondContact N-O 2.9Å; A122-N125 CarbonylContact O-C 3.54Å; A122-N125 PolarHBondContact O-N 3.13Å; M123-N125 PolarHBondContact O-N 3.14Å; N125-W127 HydrophobicContact CB-CZ2 3.82Å; N125-W127 PolarHBondContact O-NE1 2.82Å
126	S	92.7	Very high	91	Very high	27 Å²	27	64 Å²	64	19%	0.189	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.9	172.1	-58.8	0	0	0	0	109.8	C108 H109 I120	C108-S126 CarbonylContact C-O 3.56Å; C108-S126 WeakPolarHBondContact CA-O 3.49Å; H109-S126 PolarHBondContact N-O 2.96Å; I120-S126 CarbonylContact O-C 3.58Å; I120-S126 WeakPolarHBondContact O-CA 3.23Å
127	W	94.8	Very high	91.6	Very high	7 Å²	7	60.7 Å²	60.7	3%	0.027	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.4	-177	-45.2	77.8	0	0	0	111.1	H109 Q110 I115 I120 A122 N125 F132 H153	H109-W127 HydrophobicContact CB-CD2 4.09Å; H109-W127 HydrophobicContact CB-CE3 3.99Å; H109-W127 HydrophobicContact CB-CH2 3.86Å; H109-W127 HydrophobicContact CB-CZ2 3.93Å; H109-W127 HydrophobicContact CB-CZ3 3.88Å; H109-W127 AromaticContact CD2-CH2 3.22Å; H109-W127 WeakPolarHBondContact CD2-CH2 3.32Å; H109-W127 AromaticContact CD2-CZ2 3.78Å; H109-W127 AromaticContact CD2-CZ3 3.75Å; H109-W127 AromaticContact CG-CH2 3.82Å; Q110-W127 HydrophobicContact CB-CE3 3.96Å; Q110-W127 HydrophobicContact CB-CZ3 3.92Å; I115-W127 VanDerWaalsContact CD1-C 3.43Å; I120-W127 HydrophobicContact CB-CB 4.24Å; I120-W127 PolarHBondContact N-O 3.42Å; I120-W127 PolarHBondContact O-N 2.98Å; A122-W127 PolarHBondContact O-NE1 2.84Å; N125-W127 HydrophobicContact CB-CZ2 3.82Å; N125-W127 PolarHBondContact O-NE1 2.82Å; W127-F132 HydrophobicContact CB-CB 3.92Å; W127-F132 HydrophobicContact CB-CD2 4.35Å; W127-F132 HydrophobicContact CB-CG 4.45Å; W127-F132 AromaticContact CD2-CD2 3.81Å; W127-F132 HydrophobicContact CD2-CD2 3.81Å; W127-F132 HydrophobicContact CE3-CD2 4.28Å; W127-F132 HydrophobicContact CG-CB 4.31Å; W127-F132 AromaticContact CG-CD2 3.82Å; W127-F132 HydrophobicContact CG-CD2 3.82Å; W127-F132 HydrophobicContact CG-CG 4.37Å; W127-H153 AromaticContact CH2-CE1 3.94Å
128	H	92.6	Very high	92.1	Very high	39 Å²	39	61.9 Å²	61.9	18%	0.181	31%	0.31	C	S	.	.			trans	-63.3	147.1	159.7	-59.7	97.7	0	0	0	109	C108 C111 E113 F114 I115 E130 C131 F132	C108-H128 VanDerWaalsContact CB-CE1 3.42Å; C108-H128 WeakPolarHBondContact CB-CE1 3.4Å; C108-H128 WeakPolarHBondContact CB-ND1 3.5Å; C108-H128 PolarHBondContact SG-N 2.93Å; C111-H128 PolarHBondContact SG-CE1 3.32Å; C111-H128 PolarHBondContact SG-ND1 2.83Å; C111-H128 VanDerWaalsContact SG-ND1 3.37Å; E113-H128 PolarHBondContact O-CE1 2.98Å; F114-H128 PolarHBondContact O-NE2 3.19Å; I115-H128 WeakPolarHBondContact CA-NE2 3.24Å; H128-E130 PolarHBondContact O-N 3.37Å; H128-C131 HydrophobicContact CB-CB 3.95Å; H128-C131 PolarHBondContact O-N 3.05Å; H128-F132 PolarHBondContact O-N 3.19Å; H128-F132 VanDerWaalsContact O-N 3.1Å
129	P	93.3	Very high	92.3	Very high	30 Å²	30	61.9 Å²	61.9	20%	0.195	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-42.3	175.2	-27.3	35.9	0	0	0	112	R118 I120 C131 V140 A142	R118-P129 HydrophobicContact CB-CG 4Å; R118-P129 HydrophobicContact CG-CG 3.96Å; R118-P129 VanDerWaalsContact O-CD 3.31Å; R118-P129 WeakPolarHBondContact O-CD 3.39Å; I120-P129 HydrophobicContact CG1-CB 4.42Å; I120-P129 HydrophobicContact CG1-CG 4.32Å; P129-C131 PolarHBondContact O-N 3.21Å; P129-V140 WeakPolarHBondContact O-CG1 3.29Å; P129-A142 HydrophobicContact CB-CB 3.86Å
130	E	93.9	Very high	92.5	Very high	142 Å²	142	61.4 Å²	61.4	66%	0.664	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-23	-179.7	-62.3	164.4	-145.2	0	0	113.8	H128 R133	H128-E130 PolarHBondContact O-N 3.37Å; E130-R133 WeakPolarHBondContact O-CG 3.21Å; E130-R133 VanDerWaalsContact O-CZ 3.23Å; E130-R133 PolarHBondContact O-NE 3.31Å; E130-R133 PolarHBondContact O-NH2 2.82Å; E130-R133 VanDerWaalsContact O-NH2 3.14Å
131	C	94	Very high	92.6	Very high	27 Å²	27	60.4 Å²	60.4	18%	0.182	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-22.1	179.4	-71.8	0	0	0	0	112.5	C108 Q110 H128 P129 R133	C108-C131 VanDerWaalsContact SG-CB 3.54Å; Q110-C131 HydrophobicContact CB-CB 3.88Å; Q110-C131 HydrophobicContact CG-CB 4.29Å; H128-C131 HydrophobicContact CB-CB 3.95Å; H128-C131 PolarHBondContact O-N 3.05Å; P129-C131 PolarHBondContact O-N 3.21Å; C131-R133 PolarHBondContact O-N 2.97Å
132	F	94.8	Very high	92.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.009	28%	0.277	C	S	.	.			trans	-79.8	86.9	179.2	-168.3	-122.9	0	0	0	110.5	I120 A122 W127 H128 L141 F146 H153	I120-F132 HydrophobicContact CG2-CD1 3.83Å; I120-F132 HydrophobicContact CG2-CE1 4.25Å; I120-F132 HydrophobicContact CG2-CG 4.12Å; A122-F132 HydrophobicContact CB-CE1 4.23Å; A122-F132 HydrophobicContact CB-CE2 3.82Å; A122-F132 HydrophobicContact CB-CZ 3.61Å; W127-F132 HydrophobicContact CB-CB 3.92Å; W127-F132 HydrophobicContact CB-CD2 4.35Å; W127-F132 HydrophobicContact CB-CG 4.45Å; W127-F132 AromaticContact CD2-CD2 3.81Å; W127-F132 HydrophobicContact CD2-CD2 3.81Å; W127-F132 HydrophobicContact CE3-CD2 4.28Å; W127-F132 HydrophobicContact CG-CB 4.31Å; W127-F132 AromaticContact CG-CD2 3.82Å; W127-F132 HydrophobicContact CG-CD2 3.82Å; W127-F132 HydrophobicContact CG-CG 4.37Å; H128-F132 PolarHBondContact O-N 3.19Å; H128-F132 VanDerWaalsContact O-N 3.1Å; F132-L141 HydrophobicContact CD1-CB 3.56Å; F132-L141 HydrophobicContact CD1-CD1 4.35Å; F132-L141 HydrophobicContact CE1-CB 3.66Å; F132-L141 HydrophobicContact CE1-CD1 4.03Å; F132-L141 HydrophobicContact CG-CB 4.42Å; F132-L141 HydrophobicContact CZ-CD1 4.18Å; F132-L141 WeakPolarHBondContact O-CB 3.46Å; F132-L141 PolarHBondContact O-N 2.97Å; F132-F146 HydrophobicContact CE1-CB 4.19Å; F132-F146 AromaticContact CE1-CD1 3.47Å; F132-F146 HydrophobicContact CE1-CD1 3.47Å; F132-F146 VanDerWaalsContact CE1-CD1 3.47Å; F132-F146 AromaticContact CE1-CE1 3.93Å; F132-F146 HydrophobicContact CE1-CE1 3.93Å; F132-F146 AromaticContact CE1-CG 3.83Å; F132-F146 HydrophobicContact CE1-CG 3.83Å; F132-F146 HydrophobicContact CZ-CB 4.26Å; F132-F146 AromaticContact CZ-CD1 3.56Å; F132-F146 HydrophobicContact CZ-CD1 3.56Å; F132-F146 AromaticContact CZ-CD2 3.91Å; F132-F146 HydrophobicContact CZ-CD2 3.91Å; F132-F146 AromaticContact CZ-CE1 3.77Å; F132-F146 HydrophobicContact CZ-CE1 3.77Å; F132-F146 HydrophobicContact CZ-CE2 4.11Å; F132-F146 AromaticContact CZ-CG 3.64Å; F132-F146 HydrophobicContact CZ-CG 3.64Å; F132-F146 HydrophobicContact CZ-CZ 4.04Å; F132-H153 AromaticContact CD2-CD2 3.7Å; F132-H153 HydrophobicContact CE2-CB 3.84Å; F132-H153 AromaticContact CE2-CD2 3.44Å; F132-H153 VanDerWaalsContact CE2-CD2 3.44Å; F132-H153 WeakPolarHBondContact CE2-CD2 3.46Å; F132-H153 AromaticContact CE2-CG 3.69Å; F132-H153 HydrophobicContact CZ-CB 3.91Å
133	R	94.7	Very high	92.5	Very high	94 Å²	94	58.5 Å²	58.5	36%	0.355	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-117	149.6	-170	-68.9	178.7	-178.9	-89.8	-4.3	112.6	E130 C131 D135 Q138 E139 V140 H153	E130-R133 WeakPolarHBondContact O-CG 3.21Å; E130-R133 VanDerWaalsContact O-CZ 3.23Å; E130-R133 PolarHBondContact O-NE 3.31Å; E130-R133 PolarHBondContact O-NH2 2.82Å; E130-R133 VanDerWaalsContact O-NH2 3.14Å; C131-R133 PolarHBondContact O-N 2.97Å; R133-D135 PolarHBondContact O-N 3.43Å; R133-Q138 WeakPolarHBondContact CD-O 3.38Å; R133-Q138 WeakPolarHBondContact CG-O 2.84Å; R133-Q138 PolarHBondContact NH1-O 2.9Å; R133-E139 CarbonylContact C-O 3.58Å; R133-E139 VanDerWaalsContact CA-O 3.27Å; R133-E139 WeakPolarHBondContact CA-O 3.42Å; R133-V140 HydrophobicContact CG-CG2 4.23Å; R133-H153 PolarHBondContact O-CD2 3.41Å; R133-H153 PolarHBondContact O-NE2 3.42Å
134	C	94.9	Very high	92.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.			trans	-57.8	125.8	174.1	-177.4	0	0	0	0	110.5	L136 C137 Q138 E139 L141 H153 C155	C134-L136 PolarHBondContact O-N 3.5Å; C134-C137 WeakPolarHBondContact CB-SG 3.49Å; C134-C137 PolarHBondContact O-N 3.03Å; C134-Q138 VanDerWaalsContact O-CA 3.26Å; C134-Q138 WeakPolarHBondContact O-CA 3.27Å; C134-Q138 PolarHBondContact O-N 3.36Å; C134-Q138 PolarHBondContact O-NE2 3.14Å; C134-E139 PolarHBondContact N-O 3.43Å; C134-L141 HydrophobicContact CB-CD2 3.93Å; C134-L141 HydrophobicContact CB-CG 4.4Å; C134-H153 WeakPolarHBondContact CA-O 3.45Å; C134-C155 HydrophobicContact CB-CB 4.17Å; C134-C155 PolarHBondContact SG-N 3.47Å; C134-C155 VanDerWaalsContact SG-SG 3.68Å
135	D	92.4	Very high	92.6	Very high	76 Å²	76	54.8 Å²	54.8	41%	0.406	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.2	179.5	-167.3	59.2	0	0	0	113	R133 Q138 R152 H153 L154	R133-D135 PolarHBondContact O-N 3.43Å; D135-Q138 PolarHBondContact O-NE2 3.44Å; D135-R152 HydrophobicContact CB-CB 4.34Å; D135-R152 WeakPolarHBondContact OD2-CD 3.44Å; D135-H153 PolarHBondContact N-O 3.45Å; D135-H153 VanDerWaalsContact N-O 3.13Å; D135-L154 HydrophobicContact CB-CD2 3.79Å
136	L	91.7	Very high	92.6	Very high	84 Å²	84	56 Å²	56	44%	0.44	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-42.3	-178.5	-67.9	177	0	0	0	114.9	C134 L154 C158 E162	C134-L136 PolarHBondContact O-N 3.5Å; L136-L154 HydrophobicContact CB-CD2 4.34Å; L136-L154 HydrophobicContact CD1-CD1 4.25Å; L136-L154 HydrophobicContact CD1-CD2 3.89Å; L136-L154 HydrophobicContact CG-CD2 3.73Å; L136-C158 HydrophobicContact CB-CB 4.15Å; L136-C158 HydrophobicContact CD1-CB 3.94Å; L136-E162 HydrophobicContact CD1-CG 3.83Å
137	C	93.5	Very high	92.5	Very high	58 Å²	58	56.5 Å²	56.5	39%	0.392	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-3.1	-174.4	70.4	0	0	0	0	114.7	C134 E139	C134-C137 WeakPolarHBondContact CB-SG 3.49Å; C134-C137 PolarHBondContact O-N 3.03Å; C137-E139 PolarHBondContact O-N 2.96Å
138	Q	93	Very high	92.3	Very high	96 Å²	96	62.7 Å²	62.7	45%	0.449	33%	0.325	S	S	.	.			trans	61	12.5	179.4	-58.4	-61.3	-37.7	0	0	115.7	R133 C134 D135	R133-Q138 WeakPolarHBondContact CD-O 3.38Å; R133-Q138 WeakPolarHBondContact CG-O 2.84Å; R133-Q138 PolarHBondContact NH1-O 2.9Å; C134-Q138 VanDerWaalsContact O-CA 3.26Å; C134-Q138 WeakPolarHBondContact O-CA 3.27Å; C134-Q138 PolarHBondContact O-N 3.36Å; C134-Q138 PolarHBondContact O-NE2 3.14Å; D135-Q138 PolarHBondContact O-NE2 3.44Å
139	E	92.8	Very high	92	Very high	101 Å²	101	62.8 Å²	62.8	47%	0.472	33%	0.327	S	S	.	.			trans	-71.2	139.3	173.9	-171.3	169.7	-151.8	0	0	110.9	R133 C134 C137 L141 I144	R133-E139 CarbonylContact C-O 3.58Å; R133-E139 VanDerWaalsContact CA-O 3.27Å; R133-E139 WeakPolarHBondContact CA-O 3.42Å; C134-E139 PolarHBondContact N-O 3.43Å; C137-E139 PolarHBondContact O-N 2.96Å; E139-L141 PolarHBondContact O-N 3.05Å; E139-I144 HydrophobicContact CG-CD1 3.74Å
140	V	94.4	Very high	91.6	Very high	42 Å²	42	66 Å²	66	26%	0.255	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-67.8	121.7	-178.9	175	0	0	0	0	110.2	P129 R133 A142 I144	P129-V140 WeakPolarHBondContact O-CG1 3.29Å; R133-V140 HydrophobicContact CG-CG2 4.23Å; V140-A142 HydrophobicContact CG1-CB 3.96Å; V140-I144 WeakPolarHBondContact O-CD1 3.35Å
141	L	94.1	Very high	91.2	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	35%	0.348	C	S	.	.			trans	-90.9	-9.7	-174.5	-59.4	176.5	0	0	0	113.5	F132 C134 E139 D143 I144 G145 F146 H153 C155	F132-L141 HydrophobicContact CD1-CB 3.56Å; F132-L141 HydrophobicContact CD1-CD1 4.35Å; F132-L141 HydrophobicContact CE1-CB 3.66Å; F132-L141 HydrophobicContact CE1-CD1 4.03Å; F132-L141 HydrophobicContact CG-CB 4.42Å; F132-L141 HydrophobicContact CZ-CD1 4.18Å; F132-L141 WeakPolarHBondContact O-CB 3.46Å; F132-L141 PolarHBondContact O-N 2.97Å; C134-L141 HydrophobicContact CB-CD2 3.93Å; C134-L141 HydrophobicContact CB-CG 4.4Å; E139-L141 PolarHBondContact O-N 3.05Å; L141-D143 PolarHBondContact O-N 2.96Å; L141-D143 VanDerWaalsContact O-N 3.11Å; L141-I144 PolarHBondContact O-N 2.77Å; L141-G145 PolarHBondContact O-N 3.24Å; L141-F146 HydrophobicContact CB-CB 4.24Å; L141-F146 HydrophobicContact CD1-CB 3.66Å; L141-F146 HydrophobicContact CD2-CB 4.41Å; L141-F146 HydrophobicContact CG-CB 4.34Å; L141-H153 HydrophobicContact CD1-CB 4.02Å; L141-C155 HydrophobicContact CD2-CB 3.6Å
142	A	90.4	Very high	91.1	Very high	17 Å²	17	63.9 Å²	63.9	14%	0.14	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.5	-171.4	0	0	0	0	0	113.9	R118 I120 P129 V140	R118-A142 PolarHBondContact NH2-O 3Å; I120-A142 HydrophobicContact CD1-CB 3.98Å; I120-A142 HydrophobicContact CG1-CB 4.15Å; P129-A142 HydrophobicContact CB-CB 3.86Å; V140-A142 HydrophobicContact CG1-CB 3.96Å
143	D	88.7	Confident	90.9	Very high	122 Å²	122	64.8 Å²	64.8	65%	0.652	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-24.8	-177.7	-57.6	-42	0	0	0	113.4	R118 L141	R118-D143 IonicContact CZ-OD1 3.22Å; R118-D143 IonicContact NH1-OD1 2.71Å; R118-D143 PolarHBondContact NH1-OD1 2.81Å; R118-D143 IonicContact NH1-OD2 2.9Å; R118-D143 IonicContact NH2-OD1 3.83Å; R118-D143 PolarHBondContact NH2-OD1 3.45Å; L141-D143 PolarHBondContact O-N 2.96Å; L141-D143 VanDerWaalsContact O-N 3.11Å
144	I	87.4	Confident	90.8	Very high	96 Å²	96	60.3 Å²	60.3	49%	0.492	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-25.8	-179	-51.6	174.7	0	0	0	111.1	E139 V140 L141	E139-I144 HydrophobicContact CG-CD1 3.74Å; V140-I144 WeakPolarHBondContact O-CD1 3.35Å; L141-I144 PolarHBondContact O-N 2.77Å
145	G	87.9	Confident	90.7	Very high	36 Å²	36	60.4 Å²	60.4	37%	0.371	34%	0.341	S	S	.	.			trans	83.1	169.3	-168.9	0	0	0	0	0	112.3	L141	L141-G145 PolarHBondContact O-N 3.24Å
146	F	92.7	Very high	90.6	Very high	79 Å²	79	65.1 Å²	65.1	35%	0.346	35%	0.353	S	S	.	.			trans	-141.9	163.1	-174.8	74.9	-77.4	0	0	0	111.8	A122 M123 F132 L141 K148 H153 L154	A122-F146 HydrophobicContact CB-CE1 3.9Å; A122-F146 HydrophobicContact CB-CZ 3.75Å; M123-F146 HydrophobicContact CG-CE2 4.22Å; M123-F146 HydrophobicContact SD-CE2 4.28Å; F132-F146 HydrophobicContact CE1-CB 4.19Å; F132-F146 AromaticContact CE1-CD1 3.47Å; F132-F146 HydrophobicContact CE1-CD1 3.47Å; F132-F146 VanDerWaalsContact CE1-CD1 3.47Å; F132-F146 AromaticContact CE1-CE1 3.93Å; F132-F146 HydrophobicContact CE1-CE1 3.93Å; F132-F146 AromaticContact CE1-CG 3.83Å; F132-F146 HydrophobicContact CE1-CG 3.83Å; F132-F146 HydrophobicContact CZ-CB 4.26Å; F132-F146 AromaticContact CZ-CD1 3.56Å; F132-F146 HydrophobicContact CZ-CD1 3.56Å; F132-F146 AromaticContact CZ-CD2 3.91Å; F132-F146 HydrophobicContact CZ-CD2 3.91Å; F132-F146 AromaticContact CZ-CE1 3.77Å; F132-F146 HydrophobicContact CZ-CE1 3.77Å; F132-F146 HydrophobicContact CZ-CE2 4.11Å; F132-F146 AromaticContact CZ-CG 3.64Å; F132-F146 HydrophobicContact CZ-CG 3.64Å; F132-F146 HydrophobicContact CZ-CZ 4.04Å; L141-F146 HydrophobicContact CB-CB 4.24Å; L141-F146 HydrophobicContact CD1-CB 3.66Å; L141-F146 HydrophobicContact CD2-CB 4.41Å; L141-F146 HydrophobicContact CG-CB 4.34Å; F146-K148 HydrophobicContact CE2-CB 4.48Å; F146-H153 HydrophobicContact CD2-CB 3.86Å; F146-H153 HydrophobicContact CE2-CB 4.45Å; F146-H153 HydrophobicContact CG-CB 4.5Å; F146-L154 CarbonylContact C-O 3.48Å; F146-L154 WeakPolarHBondContact CA-O 3.47Å
147	V	91.6	Very high	90.4	Very high	36 Å²	36	63.2 Å²	63.2	22%	0.218	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.2	169.6	-175.6	0	0	0	0	108.5	N149 L154 R156 H159	V147-N149 PolarHBondContact O-N 3.38Å; V147-L154 PolarHBondContact N-O 2.99Å; V147-L154 PolarHBondContact O-N 2.93Å; V147-R156 HydrophobicContact CG2-CG 4.45Å; V147-H159 HydrophobicContact CB-CB 4.1Å; V147-H159 HydrophobicContact CG1-CB 4.44Å; V147-H159 HydrophobicContact CG2-CB 4.35Å
148	K	90.2	Very high	90.2	Very high	138 Å²	138	60.7 Å²	60.7	60%	0.6	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	115.5	171.6	-179	174.7	-175	-178.6	0	108.9	M123 F146 R152	M123-K148 HydrophobicContact CE-CD 4.3Å; M123-K148 HydrophobicContact CE-CG 4.15Å; M123-K148 HydrophobicContact SD-CB 4.09Å; M123-K148 HydrophobicContact SD-CD 3.56Å; M123-K148 VanDerWaalsContact SD-CD 3.56Å; M123-K148 HydrophobicContact SD-CG 3.56Å; M123-K148 VanDerWaalsContact SD-CG 3.56Å; F146-K148 HydrophobicContact CE2-CB 4.48Å; K148-R152 WeakPolarHBondContact CA-O 3.26Å
149	N	86.3	Confident	90	Very high	41 Å²	41	57.9 Å²	57.9	22%	0.219	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	107	176.8	-171.1	27.7	0	0	0	110.5	V147 G151 R152 L154 E162	V147-N149 PolarHBondContact O-N 3.38Å; N149-G151 VanDerWaalsContact C-N 3.26Å; N149-G151 PolarHBondContact O-N 3.31Å; N149-G151 VanDerWaalsContact O-N 3.16Å; N149-R152 PolarHBondContact N-O 3.28Å; N149-R152 PolarHBondContact ND2-NH2 3.38Å; N149-R152 WeakPolarHBondContact O-CB 3.27Å; N149-R152 PolarHBondContact O-N 2.74Å; N149-L154 HydrophobicContact CB-CD1 3.75Å; N149-L154 HydrophobicContact CB-CG 4.34Å; N149-E162 PolarHBondContact ND2-OE2 3.13Å
150	A	84.7	Confident	89.7	Confident	96 Å²	96	54.3 Å²	54.3	79%	0.793	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	43.2	178	0	0	0	0	0	114.3	R152	A150-R152 VanDerWaalsContact C-N 3.34Å; A150-R152 PolarHBondContact O-N 3.37Å
151	G	85.6	Confident	89.3	Confident	49 Å²	49	58.2 Å²	58.2	51%	0.505	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-5.9	-178.1	0	0	0	0	0	115.2	M123 N149	M123-G151 WeakPolarHBondContact CE-O 3.42Å; N149-G151 VanDerWaalsContact C-N 3.26Å; N149-G151 PolarHBondContact O-N 3.31Å; N149-G151 VanDerWaalsContact O-N 3.16Å
152	R	90.7	Very high	88.9	Confident	76 Å²	76	60.7 Å²	60.7	29%	0.287	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	153.8	175.3	-59.6	178.3	-72.1	158.4	5.2	111.6	D135 K148 N149 A150 L154 E162	D135-R152 HydrophobicContact CB-CB 4.34Å; D135-R152 WeakPolarHBondContact OD2-CD 3.44Å; K148-R152 WeakPolarHBondContact CA-O 3.26Å; N149-R152 PolarHBondContact N-O 3.28Å; N149-R152 PolarHBondContact ND2-NH2 3.38Å; N149-R152 WeakPolarHBondContact O-CB 3.27Å; N149-R152 PolarHBondContact O-N 2.74Å; A150-R152 VanDerWaalsContact C-N 3.34Å; A150-R152 PolarHBondContact O-N 3.37Å; R152-L154 HydrophobicContact CB-CD2 4.37Å; R152-L154 HydrophobicContact CB-CG 4.42Å; R152-E162 IonicContact CZ-OE1 3.6Å; R152-E162 IonicContact CZ-OE2 3.95Å; R152-E162 IonicContact NH1-OE1 3.78Å; R152-E162 PolarHBondContact NH1-OE1 3.41Å; R152-E162 IonicContact NH1-OE2 3.33Å; R152-E162 IonicContact NH2-OE1 2.81Å; R152-E162 PolarHBondContact NH2-OE1 3.19Å; R152-E162 IonicContact NH2-OE2 2.77Å; R152-E162 PolarHBondContact NH2-OE2 2.7Å
153	H	91.9	Very high	88.6	Confident	22 Å²	22	65.2 Å²	65.2	10%	0.102	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	105.6	175.7	47.8	-70.2	0	0	0	108.6	W127 F132 R133 C134 D135 L141 F146	W127-H153 AromaticContact CH2-CE1 3.94Å; F132-H153 AromaticContact CD2-CD2 3.7Å; F132-H153 HydrophobicContact CE2-CB 3.84Å; F132-H153 AromaticContact CE2-CD2 3.44Å; F132-H153 VanDerWaalsContact CE2-CD2 3.44Å; F132-H153 WeakPolarHBondContact CE2-CD2 3.46Å; F132-H153 AromaticContact CE2-CG 3.69Å; F132-H153 HydrophobicContact CZ-CB 3.91Å; R133-H153 PolarHBondContact O-CD2 3.41Å; R133-H153 PolarHBondContact O-NE2 3.42Å; C134-H153 WeakPolarHBondContact CA-O 3.45Å; D135-H153 PolarHBondContact N-O 3.45Å; D135-H153 VanDerWaalsContact N-O 3.13Å; L141-H153 HydrophobicContact CD1-CB 4.02Å; F146-H153 HydrophobicContact CD2-CB 3.86Å; F146-H153 HydrophobicContact CE2-CB 4.45Å; F146-H153 HydrophobicContact CG-CB 4.5Å
154	L	93	Very high	88.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.6	-174.3	-59	-178.8	0	0	0	110.6	D135 L136 F146 V147 N149 R152 C158 H159 E162	D135-L154 HydrophobicContact CB-CD2 3.79Å; L136-L154 HydrophobicContact CB-CD2 4.34Å; L136-L154 HydrophobicContact CD1-CD1 4.25Å; L136-L154 HydrophobicContact CD1-CD2 3.89Å; L136-L154 HydrophobicContact CG-CD2 3.73Å; F146-L154 CarbonylContact C-O 3.48Å; F146-L154 WeakPolarHBondContact CA-O 3.47Å; V147-L154 PolarHBondContact N-O 2.99Å; V147-L154 PolarHBondContact O-N 2.93Å; N149-L154 HydrophobicContact CB-CD1 3.75Å; N149-L154 HydrophobicContact CB-CG 4.34Å; R152-L154 HydrophobicContact CB-CD2 4.37Å; R152-L154 HydrophobicContact CB-CG 4.42Å; L154-C158 HydrophobicContact CB-CB 4.49Å; L154-H159 HydrophobicContact CB-CB 4.14Å; L154-H159 HydrophobicContact CD1-CB 4.37Å; L154-E162 WeakPolarHBondContact CD1-OE2 3.26Å
155	C	92.9	Very high	87.8	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.014	32%	0.322	C	S	.	.			trans	-65.7	153.8	164.1	72.6	0	0	0	0	109.4	C134 L141 C158 H159	C134-C155 HydrophobicContact CB-CB 4.17Å; C134-C155 PolarHBondContact SG-N 3.47Å; C134-C155 VanDerWaalsContact SG-SG 3.68Å; L141-C155 HydrophobicContact CD2-CB 3.6Å; C155-C158 PolarHBondContact O-N 3.12Å; C155-C158 VanDerWaalsContact O-N 3.09Å; C155-C158 VanDerWaalsContact SG-CB 3.57Å; C155-C158 PolarHBondContact SG-SG 3.21Å; C155-H159 PolarHBondContact O-N 2.85Å
156	R	88.8	Confident	87.3	Confident	175 Å²	175	66.5 Å²	66.5	66%	0.66	34%	0.339	S	S	*	.	H	α-helix	trans	-55.9	-42.3	-176.9	-152.9	130.4	-179.1	-149.6	0.2	113.4	V147 C158 H159 N160	V147-R156 HydrophobicContact CG2-CG 4.45Å; R156-C158 PolarHBondContact O-N 2.89Å; R156-H159 PolarHBondContact O-N 3.37Å; R156-N160 WeakPolarHBondContact O-CB 3.1Å; R156-N160 PolarHBondContact O-N 3.31Å; R156-N160 PolarHBondContact O-ND2 3.38Å; R156-N160 PolarHBondContact O-OD1 3.39Å
157	P	88	Confident	86.8	Confident	43 Å²	43	67.8 Å²	67.8	28%	0.279	35%	0.348	S	S	.	.	H	α-helix	trans	-59.5	-43.6	173.9	-25.6	35.2	0	0	0	113.7	N160 R161 H176	P157-N160 PolarHBondContact O-N 3.17Å; P157-R161 WeakPolarHBondContact O-CB 3.31Å; P157-R161 PolarHBondContact O-N 3.37Å; P157-H176 HydrophobicContact CB-CB 4.34Å; P157-H176 HydrophobicContact CG-CB 4.36Å
158	C	89.5	Confident	86.2	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.041	37%	0.37	C	S	.	.	H	α-helix	trans	-68.8	-41.1	179.5	-76.6	0	0	0	0	112	L136 L154 C155 R156 R161 E162	L136-C158 HydrophobicContact CB-CB 4.15Å; L136-C158 HydrophobicContact CD1-CB 3.94Å; L154-C158 HydrophobicContact CB-CB 4.49Å; C155-C158 PolarHBondContact O-N 3.12Å; C155-C158 VanDerWaalsContact O-N 3.09Å; C155-C158 VanDerWaalsContact SG-CB 3.57Å; C155-C158 PolarHBondContact SG-SG 3.21Å; R156-C158 PolarHBondContact O-N 2.89Å; C158-R161 PolarHBondContact O-N 3.11Å; C158-E162 PolarHBondContact O-N 3.4Å
159	H	89.2	Confident	86	Confident	37 Å²	37	66 Å²	66	17%	0.171	36%	0.357	C	S	.	.	H	α-helix	trans	-60.8	-45.7	173.8	178.7	63.3	0	0	0	111.8	V147 L154 C155 R156 R161 E162 K163	V147-H159 HydrophobicContact CB-CB 4.1Å; V147-H159 HydrophobicContact CG1-CB 4.44Å; V147-H159 HydrophobicContact CG2-CB 4.35Å; L154-H159 HydrophobicContact CB-CB 4.14Å; L154-H159 HydrophobicContact CD1-CB 4.37Å; C155-H159 PolarHBondContact O-N 2.85Å; R156-H159 PolarHBondContact O-N 3.37Å; H159-R161 VanDerWaalsContact C-N 3.26Å; H159-R161 PolarHBondContact O-N 3.08Å; H159-E162 PolarHBondContact O-N 3.46Å; H159-K163 WeakPolarHBondContact O-CB 3.42Å; H159-K163 PolarHBondContact O-N 3.18Å
160	N	86.5	Confident	85.9	Confident	25 Å²	25	70.2 Å²	70.2	13%	0.134	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-36.4	176.5	-70.5	-10.9	0	0	0	111.5	R156 P157 K163 A164 H176 I178	R156-N160 WeakPolarHBondContact O-CB 3.1Å; R156-N160 PolarHBondContact O-N 3.31Å; R156-N160 PolarHBondContact O-ND2 3.38Å; R156-N160 PolarHBondContact O-OD1 3.39Å; P157-N160 PolarHBondContact O-N 3.17Å; N160-K163 PolarHBondContact O-N 2.94Å; N160-A164 WeakPolarHBondContact O-CB 3.38Å; N160-A164 PolarHBondContact O-N 3.3Å; N160-H176 PolarHBondContact ND2-O 3.14Å; N160-I178 HydrophobicContact CB-CG1 4.15Å
161	R	85	Confident	86	Confident	124 Å²	124	67.3 Å²	67.3	47%	0.468	34%	0.341	S	S	.	.	H	α-helix	trans	-66.8	-43.1	177.1	-170.9	-176.9	-65.1	152.2	-1.2	113.7	P157 C158 H159 R165 I171	P157-R161 WeakPolarHBondContact O-CB 3.31Å; P157-R161 PolarHBondContact O-N 3.37Å; C158-R161 PolarHBondContact O-N 3.11Å; H159-R161 VanDerWaalsContact C-N 3.26Å; H159-R161 PolarHBondContact O-N 3.08Å; R161-R165 WeakPolarHBondContact O-CG 3.48Å; R161-R165 PolarHBondContact O-N 3.27Å; R161-R165 VanDerWaalsContact O-N 3.11Å; R161-I171 HydrophobicContact CB-CD1 3.55Å; R161-I171 HydrophobicContact CG-CD1 3.74Å
162	E	86	Confident	86.2	Confident	55 Å²	55	65 Å²	65	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-44.7	173.2	-74.9	-164.1	139.7	0	0	111.6	L136 N149 R152 L154 C158 H159 A164 R165 G166	L136-E162 HydrophobicContact CD1-CG 3.83Å; N149-E162 PolarHBondContact ND2-OE2 3.13Å; R152-E162 IonicContact CZ-OE1 3.6Å; R152-E162 IonicContact CZ-OE2 3.95Å; R152-E162 IonicContact NH1-OE1 3.78Å; R152-E162 PolarHBondContact NH1-OE1 3.41Å; R152-E162 IonicContact NH1-OE2 3.33Å; R152-E162 IonicContact NH2-OE1 2.81Å; R152-E162 PolarHBondContact NH2-OE1 3.19Å; R152-E162 IonicContact NH2-OE2 2.77Å; R152-E162 PolarHBondContact NH2-OE2 2.7Å; L154-E162 WeakPolarHBondContact CD1-OE2 3.26Å; C158-E162 PolarHBondContact O-N 3.4Å; H159-E162 PolarHBondContact O-N 3.46Å; E162-A164 PolarHBondContact O-N 2.98Å; E162-R165 PolarHBondContact O-N 3.16Å; E162-G166 PolarHBondContact O-N 3.34Å; E162-G166 VanDerWaalsContact O-N 3.12Å
163	K	83.8	Confident	86.1	Confident	112 Å²	112	66 Å²	66	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-40.1	179.1	-175.1	175.6	176.3	-173.5	0	112.3	H159 N160 G166 L167 I178	H159-K163 WeakPolarHBondContact O-CB 3.42Å; H159-K163 PolarHBondContact O-N 3.18Å; N160-K163 PolarHBondContact O-N 2.94Å; K163-G166 PolarHBondContact O-N 3.18Å; K163-L167 HydrophobicContact CG-CD1 4.01Å; K163-L167 WeakPolarHBondContact O-CG 3.49Å; K163-L167 PolarHBondContact O-N 2.9Å; K163-L167 VanDerWaalsContact O-N 3.16Å; K163-I178 HydrophobicContact CB-CD1 3.84Å; K163-I178 HydrophobicContact CD-CD1 3.61Å; K163-I178 HydrophobicContact CG-CD1 3.65Å
164	A	80.2	Confident	85.9	Confident	3 Å²	3	70.8 Å²	70.8	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-44.1	176.3	0	0	0	0	0	111.9	N160 E162 G166 L167 G168 K169 I171 I178	N160-A164 WeakPolarHBondContact O-CB 3.38Å; N160-A164 PolarHBondContact O-N 3.3Å; E162-A164 PolarHBondContact O-N 2.98Å; A164-G166 VanDerWaalsContact C-N 3.32Å; A164-G166 PolarHBondContact O-N 2.89Å; A164-L167 PolarHBondContact O-N 2.9Å; A164-G168 PolarHBondContact O-N 2.91Å; A164-K169 WeakPolarHBondContact CB-O 3.47Å; A164-K169 PolarHBondContact O-N 3.34Å; A164-I171 HydrophobicContact CB-CD1 4.14Å; A164-I171 HydrophobicContact CB-CG1 3.64Å; A164-I178 HydrophobicContact CB-CG1 4.45Å
165	R	79.3	Confident	85.7	Confident	207 Å²	207	73.4 Å²	73.4	78%	0.781	36%	0.363	S	S	*	.	H	α-helix	trans	-59.5	-40.8	174.9	-77.3	-179.9	174.3	-172	-2.1	112.5	R161 E162 L167	R161-R165 WeakPolarHBondContact O-CG 3.48Å; R161-R165 PolarHBondContact O-N 3.27Å; R161-R165 VanDerWaalsContact O-N 3.11Å; E162-R165 PolarHBondContact O-N 3.16Å; R165-L167 VanDerWaalsContact C-N 3.32Å; R165-L167 PolarHBondContact O-N 2.84Å
166	G	78.3	Confident	85.3	Confident	70 Å²	70	77.2 Å²	77.2	72%	0.722	38%	0.381	S	S	*	.	H	α-helix	trans	-68.5	-28.3	177.6	0	0	0	0	0	114.2	E162 K163 A164	E162-G166 PolarHBondContact O-N 3.34Å; E162-G166 VanDerWaalsContact O-N 3.12Å; K163-G166 PolarHBondContact O-N 3.18Å; A164-G166 VanDerWaalsContact C-N 3.32Å; A164-G166 PolarHBondContact O-N 2.89Å
167	L	81.4	Confident	85.1	Confident	106 Å²	106	70.6 Å²	70.6	56%	0.555	36%	0.363	S	S	*	.	H	α-helix	trans	-99.7	-5.6	-177.9	-64.8	173	0	0	0	113.9	K163 A164 R165 K169	K163-L167 HydrophobicContact CG-CD1 4.01Å; K163-L167 WeakPolarHBondContact O-CG 3.49Å; K163-L167 PolarHBondContact O-N 2.9Å; K163-L167 VanDerWaalsContact O-N 3.16Å; A164-L167 PolarHBondContact O-N 2.9Å; R165-L167 VanDerWaalsContact C-N 3.32Å; R165-L167 PolarHBondContact O-N 2.84Å; L167-K169 HydrophobicContact CB-CB 4.38Å; L167-K169 HydrophobicContact CB-CD 4.31Å; L167-K169 HydrophobicContact CB-CG 3.87Å; L167-K169 HydrophobicContact CD1-CD 4.38Å; L167-K169 PolarHBondContact O-N 3.13Å
168	G	79.4	Confident	85	Confident	66 Å²	66	69.5 Å²	69.5	68%	0.68	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	22.9	-170.2	0	0	0	0	0	113.6	A164	A164-G168 PolarHBondContact O-N 2.91Å
169	K	85.7	Confident	84.9	Confident	72 Å²	72	69.4 Å²	69.4	31%	0.313	35%	0.354	S	S	.	.			trans	-93.5	160.7	-179.7	-66.8	-166.1	179.1	-152.1	0	111.5	A164 L167 I178 D180	A164-K169 WeakPolarHBondContact CB-O 3.47Å; A164-K169 PolarHBondContact O-N 3.34Å; L167-K169 HydrophobicContact CB-CB 4.38Å; L167-K169 HydrophobicContact CB-CD 4.31Å; L167-K169 HydrophobicContact CB-CG 3.87Å; L167-K169 HydrophobicContact CD1-CD 4.38Å; L167-K169 PolarHBondContact O-N 3.13Å; K169-I178 HydrophobicContact CB-CG2 3.67Å; K169-I178 HydrophobicContact CD-CG2 3.71Å; K169-I178 HydrophobicContact CG-CG2 4.33Å; K169-D180 PolarHBondContact NZ-O 3.12Å; K169-D180 IonicContact NZ-OD1 3.58Å; K169-D180 PolarHBondContact NZ-OD1 3.46Å
170	Y	84.1	Confident	84.7	Confident	128 Å²	128	73.2 Å²	73.2	50%	0.502	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	159.8	176.4	-64.9	-90.4	0	0	0	111.3	I178 I179 P183 P190	Y170-I178 WeakPolarHBondContact O-CA 3.47Å; Y170-I179 PolarHBondContact O-N 3.04Å; Y170-P183 HydrophobicContact CD1-CG 4.47Å; Y170-P183 HydrophobicContact CD2-CB 4.39Å; Y170-P183 HydrophobicContact CD2-CG 3.6Å; Y170-P183 HydrophobicContact CE2-CG 3.93Å; Y170-P183 HydrophobicContact CG-CB 4.33Å; Y170-P183 HydrophobicContact CG-CG 3.9Å; Y170-P190 HydrophobicContact CD1-CB 4.02Å; Y170-P190 HydrophobicContact CD1-CG 4.15Å; Y170-P190 HydrophobicContact CG-CB 4.29Å
171	I	86	Confident	84.5	Confident	35 Å²	35	79.8 Å²	79.8	18%	0.179	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.4	173.3	-54.3	167.1	0	0	0	107.2	R161 A164 Q173 A177 P190	R161-I171 HydrophobicContact CB-CD1 3.55Å; R161-I171 HydrophobicContact CG-CD1 3.74Å; A164-I171 HydrophobicContact CB-CD1 4.14Å; A164-I171 HydrophobicContact CB-CG1 3.64Å; I171-Q173 PolarHBondContact O-N 3.28Å; I171-A177 WeakPolarHBondContact CA-O 3.36Å; I171-P190 WeakPolarHBondContact O-CG 3.42Å
172	C	90.4	Very high	84.6	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	42%	0.415	C	S	.	.			trans	-69.3	128	176.1	172.8	0	0	0	0	111	K174 H176 A177 I179 P190 H192 H195	C172-K174 PolarHBondContact O-N 3.4Å; C172-K174 PolarHBondContact SG-N 3.32Å; C172-H176 WeakPolarHBondContact O-CA 3.47Å; C172-H176 PolarHBondContact O-N 2.89Å; C172-A177 PolarHBondContact N-O 3.45Å; C172-I179 HydrophobicContact CB-CD1 3.96Å; C172-I179 HydrophobicContact CB-CG1 3.84Å; C172-P190 WeakPolarHBondContact CA-O 3.4Å; C172-H192 VanDerWaalsContact CB-CE1 3.48Å; C172-H192 WeakPolarHBondContact CB-CE1 3.37Å; C172-H192 WeakPolarHBondContact CB-ND1 3.36Å; C172-H192 PolarHBondContact SG-N 3.29Å; C172-H195 PolarHBondContact SG-CE1 2.98Å; C172-H195 PolarHBondContact SG-ND1 2.99Å
173	Q	88	Confident	84.9	Confident	97 Å²	97	79 Å²	79	45%	0.453	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.1	-180	-171	64.6	0	0	0	113.7	I171 D189 P190 Y191	I171-Q173 PolarHBondContact O-N 3.28Å; Q173-D189 HydrophobicContact CB-CB 4.22Å; Q173-D189 HydrophobicContact CG-CB 4.3Å; Q173-P190 PolarHBondContact N-O 2.84Å; Q173-Y191 HydrophobicContact CB-CD1 4.15Å; Q173-Y191 HydrophobicContact CB-CE1 3.62Å; Q173-Y191 HydrophobicContact CB-CE2 4.5Å; Q173-Y191 HydrophobicContact CG-CE1 4.29Å
174	K	88.2	Confident	85.3	Confident	123 Å²	123	73.7 Å²	73.7	54%	0.535	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-48.9	177.4	-169	-178.6	-173.5	-176.2	0	112.7	C172 Y191 H195	C172-K174 PolarHBondContact O-N 3.4Å; C172-K174 PolarHBondContact SG-N 3.32Å; K174-Y191 HydrophobicContact CB-CD1 3.79Å; K174-Y191 HydrophobicContact CB-CE1 3.98Å; K174-H195 HydrophobicContact CD-CB 3.76Å; K174-H195 PolarHBondContact NZ-O 2.82Å; K174-H195 VanDerWaalsContact NZ-O 3.11Å
175	C	88.9	Confident	85.7	Confident	55 Å²	55	77.8 Å²	77.8	37%	0.372	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-8.9	-174.2	74.1	0	0	0	0	114.2	A177 H192 H195	C175-A177 PolarHBondContact O-N 2.81Å; C175-A177 VanDerWaalsContact O-N 3.14Å; C175-A177 VanDerWaalsContact SG-CB 3.55Å; C175-A177 PolarHBondContact SG-N 3.44Å; C175-A177 VanDerWaalsContact SG-N 3.4Å; C175-H192 PolarHBondContact SG-CE1 2.9Å; C175-H192 PolarHBondContact SG-ND1 3.16Å; C175-H192 VanDerWaalsContact SG-ND1 3.35Å; C175-H195 VanDerWaalsContact SG-CE1 3.55Å
176	H	83.7	Confident	86.3	Confident	82 Å²	82	69.2 Å²	69.2	38%	0.38	38%	0.375	S	S	.	.			trans	59.7	16	-176.1	-51.3	91	0	0	0	114.8	P157 N160 C172	P157-H176 HydrophobicContact CB-CB 4.34Å; P157-H176 HydrophobicContact CG-CB 4.36Å; N160-H176 PolarHBondContact ND2-O 3.14Å; C172-H176 WeakPolarHBondContact O-CA 3.47Å; C172-H176 PolarHBondContact O-N 2.89Å
177	A	85.1	Confident	86.8	Confident	36 Å²	36	72 Å²	72	30%	0.298	37%	0.367	S	S	.	.			trans	-91	160.7	172.6	0	0	0	0	0	111.3	I171 C172 C175	I171-A177 WeakPolarHBondContact CA-O 3.36Å; C172-A177 PolarHBondContact N-O 3.45Å; C175-A177 PolarHBondContact O-N 2.81Å; C175-A177 VanDerWaalsContact O-N 3.14Å; C175-A177 VanDerWaalsContact SG-CB 3.55Å; C175-A177 PolarHBondContact SG-N 3.44Å; C175-A177 VanDerWaalsContact SG-N 3.4Å
178	I	86.4	Confident	86.9	Confident	21 Å²	21	74.2 Å²	74.2	11%	0.108	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.3	178.2	-57.7	175.9	0	0	0	108.7	N160 K163 A164 K169 Y170 H192	N160-I178 HydrophobicContact CB-CG1 4.15Å; K163-I178 HydrophobicContact CB-CD1 3.84Å; K163-I178 HydrophobicContact CD-CD1 3.61Å; K163-I178 HydrophobicContact CG-CD1 3.65Å; A164-I178 HydrophobicContact CB-CG1 4.45Å; K169-I178 HydrophobicContact CB-CG2 3.67Å; K169-I178 HydrophobicContact CD-CG2 3.71Å; K169-I178 HydrophobicContact CG-CG2 4.33Å; Y170-I178 WeakPolarHBondContact O-CA 3.47Å; I178-H192 PolarHBondContact O-NE2 3.11Å
179	I	87.9	Confident	87.5	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.015	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	109.8	172.1	-52.6	172.4	0	0	0	106.5	Y170 C172 E181 P183 P190 Y191 H192	Y170-I179 PolarHBondContact O-N 3.04Å; C172-I179 HydrophobicContact CB-CD1 3.96Å; C172-I179 HydrophobicContact CB-CG1 3.84Å; I179-E181 VanDerWaalsContact CG2-O 3.29Å; I179-E181 WeakPolarHBondContact CG2-O 3.5Å; I179-P183 HydrophobicContact CD1-CB 3.71Å; I179-P183 HydrophobicContact CG2-CB 4.34Å; I179-P190 HydrophobicContact CD1-CB 4.1Å; I179-Y191 WeakPolarHBondContact CD1-O 3.49Å; I179-H192 WeakPolarHBondContact CA-NE2 3.17Å
180	D	83.5	Confident	87.7	Confident	118 Å²	118	71.9 Å²	71.9	63%	0.631	36%	0.356	S	S	*	.			trans	-77.3	-29	-178.5	-77	-45.5	0	0	0	113	K169	K169-D180 PolarHBondContact NZ-O 3.12Å; K169-D180 IonicContact NZ-OD1 3.58Å; K169-D180 PolarHBondContact NZ-OD1 3.46Å
181	E	83.8	Confident	88.2	Confident	162 Å²	162	67.4 Å²	67.4	76%	0.757	34%	0.339	S	S	*	.	S	Bend	trans	-100.3	-169.2	177.7	-59.7	-172.4	172.5	0	0	111.6	I179	I179-E181 VanDerWaalsContact CG2-O 3.29Å; I179-E181 WeakPolarHBondContact CG2-O 3.5Å
182	Q	87.5	Confident	88.5	Confident	143 Å²	143	67.3 Å²	67.3	67%	0.668	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-69	128.3	177.4	-163.4	161.1	9	0	0	110.4	A207	Q182-A207 HydrophobicContact CB-CB 3.73Å; Q182-A207 HydrophobicContact CG-CB 3.92Å; Q182-A207 WeakPolarHBondContact O-CB 3.34Å
183	P	91	Very high	88.6	Confident	19 Å²	19	68.1 Å²	68.1	12%	0.123	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-71.8	145.3	-178.5	31.9	-37.7	0	0	0	111	Y170 I179 I185 P190	Y170-P183 HydrophobicContact CD1-CG 4.47Å; Y170-P183 HydrophobicContact CD2-CB 4.39Å; Y170-P183 HydrophobicContact CD2-CG 3.6Å; Y170-P183 HydrophobicContact CE2-CG 3.93Å; Y170-P183 HydrophobicContact CG-CB 4.33Å; Y170-P183 HydrophobicContact CG-CG 3.9Å; I179-P183 HydrophobicContact CD1-CB 3.71Å; I179-P183 HydrophobicContact CG2-CB 4.34Å; P183-I185 HydrophobicContact CB-CD1 4.2Å; P183-I185 HydrophobicContact CG-CD1 4.04Å; P183-P190 HydrophobicContact CB-CB 3.91Å
184	L	92.2	Very high	88.8	Confident	2 Å²	2	68 Å²	68	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.7	160.8	-175.7	156.6	0	0	0	107.5	F186 Y191 P193 F196 L205 A209 L216	L184-F186 HydrophobicContact CD2-CB 3.79Å; L184-Y191 PolarHBondContact N-O 3.01Å; L184-Y191 PolarHBondContact O-N 3.3Å; L184-P193 HydrophobicContact CB-CB 4.28Å; L184-P193 HydrophobicContact CB-CG 4.12Å; L184-P193 HydrophobicContact CD1-CB 4.44Å; L184-F196 HydrophobicContact CD1-CD2 4.31Å; L184-F196 HydrophobicContact CD2-CD2 4.12Å; L184-F196 HydrophobicContact CD2-CE2 4.19Å; L184-L205 HydrophobicContact CD1-CB 3.82Å; L184-L205 HydrophobicContact CD1-CD1 4.08Å; L184-A209 HydrophobicContact CD1-CB 3.63Å; L184-A209 HydrophobicContact CG-CB 4.31Å; L184-L216 HydrophobicContact CD1-CD1 4.37Å; L184-L216 HydrophobicContact CD2-CD1 3.74Å; L184-L216 HydrophobicContact CD2-CD2 4.16Å
185	I	90	Very high	89	Confident	88 Å²	88	64.5 Å²	64.5	45%	0.451	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119.7	175	-53.4	-56.3	0	0	0	108.7	P183 D189 P190	P183-I185 HydrophobicContact CB-CD1 4.2Å; P183-I185 HydrophobicContact CG-CD1 4.04Å; I185-D189 WeakPolarHBondContact CA-O 3.36Å; I185-P190 HydrophobicContact CD1-CB 3.97Å
186	F	90.5	Very high	89.3	Confident	28 Å²	28	63.8 Å²	63.8	12%	0.123	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.3	175.8	178	-126	0	0	0	108.8	L184 N188 D189 Y191 F196 E211 L216	L184-F186 HydrophobicContact CD2-CB 3.79Å; F186-N188 PolarHBondContact O-N 3.38Å; F186-N188 VanDerWaalsContact O-N 3.16Å; F186-D189 PolarHBondContact N-O 3.4Å; F186-D189 PolarHBondContact O-N 3.35Å; F186-Y191 HydrophobicContact CB-CD2 4Å; F186-Y191 HydrophobicContact CB-CE2 3.98Å; F186-Y191 HydrophobicContact CD1-CE2 4.35Å; F186-F196 HydrophobicContact CD1-CE1 4.01Å; F186-F196 HydrophobicContact CD1-CZ 4.05Å; F186-F196 HydrophobicContact CE1-CE1 4.33Å; F186-E211 HydrophobicContact CD2-CG 4.22Å; F186-E211 WeakPolarHBondContact CD2-OE2 3.49Å; F186-E211 HydrophobicContact CE2-CG 4.09Å; F186-L216 HydrophobicContact CB-CD1 4.13Å; F186-L216 HydrophobicContact CB-CD2 4.46Å; F186-L216 HydrophobicContact CD1-CD1 4.41Å; F186-L216 HydrophobicContact CD2-CD1 3.83Å; F186-L216 HydrophobicContact CD2-CD2 3.71Å; F186-L216 HydrophobicContact CD2-CG 3.64Å; F186-L216 HydrophobicContact CE2-CD1 4.3Å; F186-L216 HydrophobicContact CE2-CD2 4.34Å; F186-L216 HydrophobicContact CE2-CG 3.91Å; F186-L216 HydrophobicContact CG-CD1 3.88Å; F186-L216 HydrophobicContact CG-CD2 4.37Å; F186-L216 HydrophobicContact CG-CG 4.22Å
187	K	88.7	Confident	89.8	Confident	129 Å²	129	64.4 Å²	64.4	56%	0.561	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	37.6	-175.2	-58.8	-177.9	175.6	179.6	0	114	D189 E211	K187-D189 PolarHBondContact O-N 2.95Å; K187-E211 PolarHBondContact N-OE2 3.18Å
188	N	84.2	Confident	90.2	Very high	151 Å²	151	62.9 Å²	62.9	81%	0.807	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	3.1	-176.5	-55.1	-39	0	0	0	116.7	F186	F186-N188 PolarHBondContact O-N 3.38Å; F186-N188 VanDerWaalsContact O-N 3.16Å
189	D	91	Very high	90.5	Very high	65 Å²	65	64.5 Å²	64.5	35%	0.348	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142.4	176.2	-74	-39.8	0	0	0	111.4	Q173 I185 F186 K187 Y191	Q173-D189 HydrophobicContact CB-CB 4.22Å; Q173-D189 HydrophobicContact CG-CB 4.3Å; I185-D189 WeakPolarHBondContact CA-O 3.36Å; F186-D189 PolarHBondContact N-O 3.4Å; F186-D189 PolarHBondContact O-N 3.35Å; K187-D189 PolarHBondContact O-N 2.95Å; D189-Y191 HydrophobicContact CB-CD2 4.41Å; D189-Y191 HydrophobicContact CB-CE2 3.57Å; D189-Y191 WeakPolarHBondContact O-CD2 3.16Å; D189-Y191 WeakPolarHBondContact O-CE2 3.45Å
190	P	91.5	Very high	90.5	Very high	24 Å²	24	69.1 Å²	69.1	16%	0.156	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	137.4	177.1	31.3	-33.1	0	0	0	112	Y170 I171 C172 Q173 I179 P183 I185	Y170-P190 HydrophobicContact CD1-CB 4.02Å; Y170-P190 HydrophobicContact CD1-CG 4.15Å; Y170-P190 HydrophobicContact CG-CB 4.29Å; I171-P190 WeakPolarHBondContact O-CG 3.42Å; C172-P190 WeakPolarHBondContact CA-O 3.4Å; Q173-P190 PolarHBondContact N-O 2.84Å; I179-P190 HydrophobicContact CD1-CB 4.1Å; P183-P190 HydrophobicContact CB-CB 3.91Å; I185-P190 HydrophobicContact CD1-CB 3.97Å
191	Y	93.4	Very high	90.8	Very high	35 Å²	35	66.1 Å²	66.1	14%	0.137	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	157.5	176.3	-60.9	-93.7	0	0	0	112.2	Q173 K174 I179 L184 F186 D189 F196	Q173-Y191 HydrophobicContact CB-CD1 4.15Å; Q173-Y191 HydrophobicContact CB-CE1 3.62Å; Q173-Y191 HydrophobicContact CB-CE2 4.5Å; Q173-Y191 HydrophobicContact CG-CE1 4.29Å; K174-Y191 HydrophobicContact CB-CD1 3.79Å; K174-Y191 HydrophobicContact CB-CE1 3.98Å; I179-Y191 WeakPolarHBondContact CD1-O 3.49Å; L184-Y191 PolarHBondContact N-O 3.01Å; L184-Y191 PolarHBondContact O-N 3.3Å; F186-Y191 HydrophobicContact CB-CD2 4Å; F186-Y191 HydrophobicContact CB-CE2 3.98Å; F186-Y191 HydrophobicContact CD1-CE2 4.35Å; D189-Y191 HydrophobicContact CB-CD2 4.41Å; D189-Y191 HydrophobicContact CB-CE2 3.57Å; D189-Y191 WeakPolarHBondContact O-CD2 3.16Å; D189-Y191 WeakPolarHBondContact O-CE2 3.45Å; Y191-F196 VanDerWaalsContact CB-CE2 3.48Å; Y191-F196 AromaticContact CD1-CE2 3.95Å; Y191-F196 HydrophobicContact CD1-CE2 3.95Å; Y191-F196 AromaticContact CD1-CZ 3.92Å; Y191-F196 HydrophobicContact CD1-CZ 3.92Å; Y191-F196 HydrophobicContact CD2-CE2 4.04Å; Y191-F196 HydrophobicContact CD2-CZ 4.07Å; Y191-F196 HydrophobicContact CE1-CZ 4.26Å; Y191-F196 HydrophobicContact CE2-CZ 4.4Å; Y191-F196 AromaticContact CG-CE2 3.58Å; Y191-F196 HydrophobicContact CG-CE2 3.58Å; Y191-F196 AromaticContact CG-CZ 3.83Å; Y191-F196 HydrophobicContact CG-CZ 3.83Å
192	H	93	Very high	91.1	Very high	33 Å²	33	60.7 Å²	60.7	15%	0.153	33%	0.33	C	S	.	.			trans	-63	135.5	162.6	-62.3	96.6	0	0	0	109.9	C172 C175 I178 I179 D194 H195	C172-H192 VanDerWaalsContact CB-CE1 3.48Å; C172-H192 WeakPolarHBondContact CB-CE1 3.37Å; C172-H192 WeakPolarHBondContact CB-ND1 3.36Å; C172-H192 PolarHBondContact SG-N 3.29Å; C175-H192 PolarHBondContact SG-CE1 2.9Å; C175-H192 PolarHBondContact SG-ND1 3.16Å; C175-H192 VanDerWaalsContact SG-ND1 3.35Å; I178-H192 PolarHBondContact O-NE2 3.11Å; I179-H192 WeakPolarHBondContact CA-NE2 3.17Å; H192-D194 VanDerWaalsContact C-N 3.3Å; H192-D194 WeakPolarHBondContact CB-OD1 3.29Å; H192-D194 IonicContact CG-OD1 2.91Å; H192-D194 PolarHBondContact O-N 3.16Å; H192-H195 AromaticContact CG-CE1 3.97Å; H192-H195 AromaticContact ND1-CE1 3.43Å; H192-H195 PolarHBondContact ND1-CE1 3.44Å; H192-H195 WeakPolarHBondContact O-CB 3.46Å; H192-H195 PolarHBondContact O-N 3.27Å
193	P	92.8	Very high	91.2	Very high	16 Å²	16	60.9 Å²	60.9	10%	0.104	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-59.8	-36.1	178.3	-25.1	33.7	0	0	0	114.5	L184 H195 F196 L205 A207	L184-P193 HydrophobicContact CB-CB 4.28Å; L184-P193 HydrophobicContact CB-CG 4.12Å; L184-P193 HydrophobicContact CD1-CB 4.44Å; P193-H195 PolarHBondContact O-N 3.11Å; P193-H195 VanDerWaalsContact O-N 3.16Å; P193-F196 PolarHBondContact O-N 3.36Å; P193-F196 VanDerWaalsContact O-N 3.16Å; P193-L205 CarbonylContact C-O 3.55Å; P193-L205 WeakPolarHBondContact CB-O 3.45Å; P193-A207 HydrophobicContact CG-CB 4.39Å
194	D	91.9	Very high	91.3	Very high	95 Å²	95	67 Å²	67	51%	0.508	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-62.5	-18	-179.8	65	-7	0	0	0	114.4	H192 F196	H192-D194 VanDerWaalsContact C-N 3.3Å; H192-D194 WeakPolarHBondContact CB-OD1 3.29Å; H192-D194 IonicContact CG-OD1 2.91Å; H192-D194 PolarHBondContact O-N 3.16Å; D194-F196 PolarHBondContact O-N 3.01Å
195	H	93	Very high	91.3	Very high	50 Å²	50	67.1 Å²	67.1	23%	0.231	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-72	-11.2	176.3	-72.5	148.8	0	0	0	114	C172 K174 C175 H192 P193	C172-H195 PolarHBondContact SG-CE1 2.98Å; C172-H195 PolarHBondContact SG-ND1 2.99Å; K174-H195 HydrophobicContact CD-CB 3.76Å; K174-H195 PolarHBondContact NZ-O 2.82Å; K174-H195 VanDerWaalsContact NZ-O 3.11Å; C175-H195 VanDerWaalsContact SG-CE1 3.55Å; H192-H195 AromaticContact CG-CE1 3.97Å; H192-H195 AromaticContact ND1-CE1 3.43Å; H192-H195 PolarHBondContact ND1-CE1 3.44Å; H192-H195 WeakPolarHBondContact O-CB 3.46Å; H192-H195 PolarHBondContact O-N 3.27Å; P193-H195 PolarHBondContact O-N 3.11Å; P193-H195 VanDerWaalsContact O-N 3.16Å
196	F	93.7	Very high	91.4	Very high	39 Å²	39	66.7 Å²	66.7	17%	0.171	36%	0.358	C	S	.	.			trans	-127.7	144.9	-174.3	-60.6	-84.8	0	0	0	111.7	L184 F186 Y191 P193 D194 L205 L216	L184-F196 HydrophobicContact CD1-CD2 4.31Å; L184-F196 HydrophobicContact CD2-CD2 4.12Å; L184-F196 HydrophobicContact CD2-CE2 4.19Å; F186-F196 HydrophobicContact CD1-CE1 4.01Å; F186-F196 HydrophobicContact CD1-CZ 4.05Å; F186-F196 HydrophobicContact CE1-CE1 4.33Å; Y191-F196 VanDerWaalsContact CB-CE2 3.48Å; Y191-F196 AromaticContact CD1-CE2 3.95Å; Y191-F196 HydrophobicContact CD1-CE2 3.95Å; Y191-F196 AromaticContact CD1-CZ 3.92Å; Y191-F196 HydrophobicContact CD1-CZ 3.92Å; Y191-F196 HydrophobicContact CD2-CE2 4.04Å; Y191-F196 HydrophobicContact CD2-CZ 4.07Å; Y191-F196 HydrophobicContact CE1-CZ 4.26Å; Y191-F196 HydrophobicContact CE2-CZ 4.4Å; Y191-F196 AromaticContact CG-CE2 3.58Å; Y191-F196 HydrophobicContact CG-CE2 3.58Å; Y191-F196 AromaticContact CG-CZ 3.83Å; Y191-F196 HydrophobicContact CG-CZ 3.83Å; P193-F196 PolarHBondContact O-N 3.36Å; P193-F196 VanDerWaalsContact O-N 3.16Å; D194-F196 PolarHBondContact O-N 3.01Å; F196-L205 HydrophobicContact CB-CB 4.36Å; F196-L205 HydrophobicContact CB-CD1 3.65Å; F196-L205 HydrophobicContact CB-CG 4.23Å; F196-L205 WeakPolarHBondContact O-CB 3.4Å; F196-L205 PolarHBondContact O-N 3.47Å; F196-L216 HydrophobicContact CB-CD1 4Å; F196-L216 HydrophobicContact CD1-CD1 3.57Å; F196-L216 HydrophobicContact CD2-CD1 4.17Å; F196-L216 HydrophobicContact CE1-CD1 4.01Å; F196-L216 HydrophobicContact CG-CD1 3.65Å; F196-L216 HydrophobicContact CZ-CD1 4.48Å
197	N	94.7	Very high	91.4	Very high	96 Å²	96	66.6 Å²	66.6	51%	0.513	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-115.7	145.1	173.4	-66.4	-22.9	0	0	0	108.9	A199 G202 K203 E204	N197-A199 PolarHBondContact O-N 3.45Å; N197-G202 WeakPolarHBondContact CB-O 3.38Å; N197-K203 CarbonylContact C-O 3.58Å; N197-K203 WeakPolarHBondContact CA-O 3.11Å; N197-E204 WeakPolarHBondContact OD1-CA 3.48Å
198	C	93.2	Very high	91.4	Very high	3 Å²	3	64.4 Å²	64.4	2%	0.02	36%	0.357	C	S	.	.			trans	-58.3	126.4	176.9	177.6	0	0	0	0	110.7	N200 C201 G202 K203 L205 C218	C198-N200 PolarHBondContact O-N 3.43Å; C198-N200 VanDerWaalsContact O-N 3.13Å; C198-C201 WeakPolarHBondContact CB-SG 3.49Å; C198-C201 PolarHBondContact O-N 2.86Å; C198-G202 VanDerWaalsContact O-CA 3.29Å; C198-G202 WeakPolarHBondContact O-CA 3.49Å; C198-G202 PolarHBondContact O-N 3Å; C198-K203 PolarHBondContact N-O 2.83Å; C198-L205 HydrophobicContact CB-CD2 3.64Å; C198-C218 HydrophobicContact CB-CB 4.11Å; C198-C218 PolarHBondContact SG-N 3.11Å; C198-C218 VanDerWaalsContact SG-SG 3.65Å
199	A	92	Very high	91.7	Very high	55 Å²	55	57.7 Å²	57.7	46%	0.455	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.5	179.3	0	0	0	0	0	113.3	N197 E215 L216 Y217	N197-A199 PolarHBondContact O-N 3.45Å; A199-E215 HydrophobicContact CB-CB 4.11Å; A199-L216 PolarHBondContact N-O 3.12Å; A199-Y217 HydrophobicContact CB-CD1 4.37Å; A199-Y217 HydrophobicContact CB-CE1 3.96Å; A199-Y217 HydrophobicContact CB-CE2 4.45Å
200	N	87.8	Confident	91.5	Very high	100 Å²	100	59.6 Å²	59.6	54%	0.535	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-42.4	-178.9	-174.4	53	0	0	0	114.2	C198 Y217 C221	C198-N200 PolarHBondContact O-N 3.43Å; C198-N200 VanDerWaalsContact O-N 3.13Å; N200-Y217 HydrophobicContact CB-CD1 3.86Å; N200-Y217 HydrophobicContact CB-CE1 3.98Å; N200-C221 HydrophobicContact CB-CB 3.99Å; N200-C221 PolarHBondContact ND2-SG 3.35Å
201	C	89.9	Confident	91.5	Very high	56 Å²	56	62.5 Å²	62.5	38%	0.378	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-5.4	-172.1	72.5	0	0	0	0	114.9	C198 K203 C218 C221	C198-C201 WeakPolarHBondContact CB-SG 3.49Å; C198-C201 PolarHBondContact O-N 2.86Å; C201-K203 PolarHBondContact O-N 3.35Å; C201-K203 VanDerWaalsContact O-N 3.11Å; C201-C218 VanDerWaalsContact SG-SG 3.64Å; C201-C221 VanDerWaalsContact SG-SG 3.66Å
202	G	90.3	Very high	91	Very high	47 Å²	47	63.6 Å²	63.6	49%	0.485	34%	0.344	S	S	.	.			trans	70.3	-2	179.1	0	0	0	0	0	115.7	N197 C198	N197-G202 WeakPolarHBondContact CB-O 3.38Å; C198-G202 VanDerWaalsContact O-CA 3.29Å; C198-G202 WeakPolarHBondContact O-CA 3.49Å; C198-G202 PolarHBondContact O-N 3Å
203	K	90.2	Very high	90.6	Very high	148 Å²	148	71.7 Å²	71.7	64%	0.643	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-67.6	143.5	176.8	-67.7	-174.5	177.1	-172.9	0	111.2	N197 C198 C201 L205	N197-K203 CarbonylContact C-O 3.58Å; N197-K203 WeakPolarHBondContact CA-O 3.11Å; C198-K203 PolarHBondContact N-O 2.83Å; C201-K203 PolarHBondContact O-N 3.35Å; C201-K203 VanDerWaalsContact O-N 3.11Å; K203-L205 PolarHBondContact O-N 3.07Å
204	E	93.1	Very high	90.3	Very high	146 Å²	146	72.6 Å²	72.6	68%	0.682	39%	0.392	S	S	*	.	B	Isolated β-bridge	trans	-51.8	133.9	169.4	-68.5	175.3	179.8	0	0	110.1	N197	N197-E204 WeakPolarHBondContact OD1-CA 3.48Å
205	L	93.3	Very high	90.3	Very high	6 Å²	6	73 Å²	73	3%	0.031	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-82.4	155.3	-177.2	-67.9	-176.5	0	0	0	111.3	L184 P193 F196 C198 K203 A209 L216 C218	L184-L205 HydrophobicContact CD1-CB 3.82Å; L184-L205 HydrophobicContact CD1-CD1 4.08Å; P193-L205 CarbonylContact C-O 3.55Å; P193-L205 WeakPolarHBondContact CB-O 3.45Å; F196-L205 HydrophobicContact CB-CB 4.36Å; F196-L205 HydrophobicContact CB-CD1 3.65Å; F196-L205 HydrophobicContact CB-CG 4.23Å; F196-L205 WeakPolarHBondContact O-CB 3.4Å; F196-L205 PolarHBondContact O-N 3.47Å; C198-L205 HydrophobicContact CB-CD2 3.64Å; K203-L205 PolarHBondContact O-N 3.07Å; L205-A209 HydrophobicContact CB-CB 4.07Å; L205-A209 HydrophobicContact CD1-CB 3.84Å; L205-A209 HydrophobicContact CD2-CB 4.07Å; L205-A209 HydrophobicContact CG-CB 4.23Å; L205-L216 HydrophobicContact CD1-CB 3.42Å; L205-L216 VanDerWaalsContact CD1-CB 3.42Å; L205-L216 HydrophobicContact CD1-CD1 4.03Å; L205-L216 HydrophobicContact CD1-CG 4.29Å; L205-C218 HydrophobicContact CD2-CB 3.68Å
206	T	90.6	Very high	90.3	Very high	78 Å²	78	71.2 Å²	71.2	48%	0.479	38%	0.382	S	S	.	.			trans	-108.7	174.3	169.7	63.7	0	0	0	0	109.4	D208 A209	T206-D208 PolarHBondContact O-N 3.4Å; T206-D208 PolarHBondContact OG1-N 3.14Å; T206-A209 WeakPolarHBondContact O-CB 3.46Å; T206-A209 PolarHBondContact O-N 3.31Å
207	A	90.3	Very high	90.1	Very high	27 Å²	27	70.6 Å²	70.6	22%	0.223	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-18.5	174.1	0	0	0	0	0	113.6	Q182 P193 A209	Q182-A207 HydrophobicContact CB-CB 3.73Å; Q182-A207 HydrophobicContact CG-CB 3.92Å; Q182-A207 WeakPolarHBondContact O-CB 3.34Å; P193-A207 HydrophobicContact CG-CB 4.39Å; A207-A209 VanDerWaalsContact C-N 3.3Å; A207-A209 PolarHBondContact O-N 2.8Å
208	D	88.4	Confident	89.9	Confident	82 Å²	82	66.9 Å²	66.9	44%	0.439	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	1.5	178.3	-58.1	-51.7	0	0	0	114.5	T206 R210	T206-D208 PolarHBondContact O-N 3.4Å; T206-D208 PolarHBondContact OG1-N 3.14Å; D208-R210 PolarHBondContact O-NH1 3.48Å; D208-R210 VanDerWaalsContact O-NH1 3.12Å
209	A	91	Very high	89.5	Confident	11 Å²	11	69.7 Å²	69.7	9%	0.091	38%	0.375	C	S	.	.			trans	-56.3	153.9	175.5	0	0	0	0	0	112.1	L184 L205 T206 A207 Y217	L184-A209 HydrophobicContact CD1-CB 3.63Å; L184-A209 HydrophobicContact CG-CB 4.31Å; L205-A209 HydrophobicContact CB-CB 4.07Å; L205-A209 HydrophobicContact CD1-CB 3.84Å; L205-A209 HydrophobicContact CD2-CB 4.07Å; L205-A209 HydrophobicContact CG-CB 4.23Å; T206-A209 WeakPolarHBondContact O-CB 3.46Å; T206-A209 PolarHBondContact O-N 3.31Å; A207-A209 VanDerWaalsContact C-N 3.3Å; A207-A209 PolarHBondContact O-N 2.8Å; A209-Y217 WeakPolarHBondContact CA-O 3.44Å
210	R	88.4	Confident	89.1	Confident	104 Å²	104	70.8 Å²	70.8	39%	0.392	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.3	-179.6	-62.4	-66	178.3	-106	1	109.9	D208 Y217 L219 H222	D208-R210 PolarHBondContact O-NH1 3.48Å; D208-R210 VanDerWaalsContact O-NH1 3.12Å; R210-Y217 PolarHBondContact N-O 3.25Å; R210-Y217 PolarHBondContact O-N 2.93Å; R210-L219 HydrophobicContact CG-CD1 4.21Å; R210-H222 HydrophobicContact CB-CB 4.03Å; R210-H222 VanDerWaalsContact CB-CD2 3.49Å; R210-H222 WeakPolarHBondContact CB-CD2 3.41Å; R210-H222 HydrophobicContact CG-CB 4.34Å
211	E	89.8	Confident	89	Confident	86 Å²	86	66.5 Å²	66.5	40%	0.402	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	127.2	172.8	-173.8	179.2	159.4	0	0	109.5	F186 K187 E215 L216	F186-E211 HydrophobicContact CD2-CG 4.22Å; F186-E211 WeakPolarHBondContact CD2-OE2 3.49Å; F186-E211 HydrophobicContact CE2-CG 4.09Å; K187-E211 PolarHBondContact N-OE2 3.18Å; E211-E215 CarbonylContact C-O 3.57Å; E211-E215 WeakPolarHBondContact CA-O 3.41Å; E211-L216 HydrophobicContact CB-CD2 4.13Å
212	L	84.6	Confident	88.7	Confident	57 Å²	57	66.5 Å²	66.5	30%	0.298	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	119.8	173.9	-175.2	64.8	0	0	0	108.8	G214 E215 Y217 M225	L212-G214 PolarHBondContact O-N 3.34Å; L212-E215 PolarHBondContact N-O 3.16Å; L212-E215 PolarHBondContact O-N 3.41Å; L212-E215 VanDerWaalsContact O-N 3.13Å; L212-Y217 HydrophobicContact CB-CD2 3.86Å; L212-Y217 HydrophobicContact CB-CE2 3.88Å; L212-M225 HydrophobicContact CD2-CB 4.48Å
213	K	83.9	Confident	88.2	Confident	204 Å²	204	68.4 Å²	68.4	89%	0.887	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	33.3	-179.4	-58.8	179.4	-179.8	179.4	0	114.1
214	G	86.8	Confident	87.5	Confident	35 Å²	35	66.7 Å²	66.7	36%	0.361	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	4.4	178.3	0	0	0	0	0	115.4	L212	L212-G214 PolarHBondContact O-N 3.34Å
215	E	91	Very high	86.6	Confident	104 Å²	104	65.1 Å²	65.1	49%	0.486	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	153.5	173.2	-67.4	-175.2	153.5	0	0	111	A199 E211 L212 Y217	A199-E215 HydrophobicContact CB-CB 4.11Å; E211-E215 CarbonylContact C-O 3.57Å; E211-E215 WeakPolarHBondContact CA-O 3.41Å; L212-E215 PolarHBondContact N-O 3.16Å; L212-E215 PolarHBondContact O-N 3.41Å; L212-E215 VanDerWaalsContact O-N 3.13Å; E215-Y217 HydrophobicContact CB-CE2 3.67Å; E215-Y217 PolarHBondContact OE2-OH 3.34Å
216	L	92.4	Very high	85.6	Confident	11 Å²	11	68.1 Å²	68.1	6%	0.058	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132	179.5	-70.9	167.2	0	0	0	111.7	L184 F186 F196 A199 L205 E211	L184-L216 HydrophobicContact CD1-CD1 4.37Å; L184-L216 HydrophobicContact CD2-CD1 3.74Å; L184-L216 HydrophobicContact CD2-CD2 4.16Å; F186-L216 HydrophobicContact CB-CD1 4.13Å; F186-L216 HydrophobicContact CB-CD2 4.46Å; F186-L216 HydrophobicContact CD1-CD1 4.41Å; F186-L216 HydrophobicContact CD2-CD1 3.83Å; F186-L216 HydrophobicContact CD2-CD2 3.71Å; F186-L216 HydrophobicContact CD2-CG 3.64Å; F186-L216 HydrophobicContact CE2-CD1 4.3Å; F186-L216 HydrophobicContact CE2-CD2 4.34Å; F186-L216 HydrophobicContact CE2-CG 3.91Å; F186-L216 HydrophobicContact CG-CD1 3.88Å; F186-L216 HydrophobicContact CG-CD2 4.37Å; F186-L216 HydrophobicContact CG-CG 4.22Å; F196-L216 HydrophobicContact CB-CD1 4Å; F196-L216 HydrophobicContact CD1-CD1 3.57Å; F196-L216 HydrophobicContact CD2-CD1 4.17Å; F196-L216 HydrophobicContact CE1-CD1 4.01Å; F196-L216 HydrophobicContact CG-CD1 3.65Å; F196-L216 HydrophobicContact CZ-CD1 4.48Å; A199-L216 PolarHBondContact N-O 3.12Å; L205-L216 HydrophobicContact CD1-CB 3.42Å; L205-L216 VanDerWaalsContact CD1-CB 3.42Å; L205-L216 HydrophobicContact CD1-CD1 4.03Å; L205-L216 HydrophobicContact CD1-CG 4.29Å; E211-L216 HydrophobicContact CB-CD2 4.13Å
217	Y	90.1	Very high	84.8	Confident	27 Å²	27	66.5 Å²	66.5	11%	0.106	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.4	178	-62.6	-97	0	0	0	109.3	A199 N200 A209 R210 L212 E215 C221	A199-Y217 HydrophobicContact CB-CD1 4.37Å; A199-Y217 HydrophobicContact CB-CE1 3.96Å; A199-Y217 HydrophobicContact CB-CE2 4.45Å; N200-Y217 HydrophobicContact CB-CD1 3.86Å; N200-Y217 HydrophobicContact CB-CE1 3.98Å; A209-Y217 WeakPolarHBondContact CA-O 3.44Å; R210-Y217 PolarHBondContact N-O 3.25Å; R210-Y217 PolarHBondContact O-N 2.93Å; L212-Y217 HydrophobicContact CB-CD2 3.86Å; L212-Y217 HydrophobicContact CB-CE2 3.88Å; E215-Y217 HydrophobicContact CB-CE2 3.67Å; E215-Y217 PolarHBondContact OE2-OH 3.34Å; Y217-C221 HydrophobicContact CD1-CB 4.41Å
218	C	90.4	Very high	84.4	Confident	17 Å²	17	66.9 Å²	66.9	12%	0.115	36%	0.357	C	S	.	.			trans	-65	150.5	167.8	68	0	0	0	0	109.3	C198 C201 L205 P220 C221 H222	C198-C218 HydrophobicContact CB-CB 4.11Å; C198-C218 PolarHBondContact SG-N 3.11Å; C198-C218 VanDerWaalsContact SG-SG 3.65Å; C201-C218 VanDerWaalsContact SG-SG 3.64Å; L205-C218 HydrophobicContact CD2-CB 3.68Å; C218-P220 VanDerWaalsContact C-CD 3.47Å; C218-P220 VanDerWaalsContact C-N 3.3Å; C218-P220 VanDerWaalsContact O-N 3.16Å; C218-C221 WeakPolarHBondContact O-CA 3.29Å; C218-C221 PolarHBondContact O-N 3.47Å; C218-C221 PolarHBondContact SG-SG 2.69Å; C218-H222 PolarHBondContact O-N 3.02Å
219	L	85.4	Confident	84.2	Confident	62 Å²	62	67.8 Å²	67.8	33%	0.325	36%	0.361	S	S	.	.	H	α-helix	trans	-47.8	-46.2	-176.8	-172.4	69.2	0	0	0	112.8	R210 C221 H222 D223	R210-L219 HydrophobicContact CG-CD1 4.21Å; L219-C221 VanDerWaalsContact C-N 3.32Å; L219-C221 PolarHBondContact O-N 3.4Å; L219-H222 PolarHBondContact O-N 2.9Å; L219-D223 WeakPolarHBondContact O-CB 3.46Å; L219-D223 PolarHBondContact O-N 2.85Å
220	P	84.4	Confident	84	Confident	79 Å²	79	67.2 Å²	67.2	51%	0.513	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-30.4	176.4	-23.1	34.3	0	0	0	115.1	C218 K224	C218-P220 VanDerWaalsContact C-CD 3.47Å; C218-P220 VanDerWaalsContact C-N 3.3Å; C218-P220 VanDerWaalsContact O-N 3.16Å; P220-K224 WeakPolarHBondContact O-CB 3.05Å; P220-K224 WeakPolarHBondContact O-CD 3.15Å; P220-K224 WeakPolarHBondContact O-CG 2.94Å; P220-K224 PolarHBondContact O-N 3.05Å
221	C	84.6	Confident	83.9	Confident	9 Å²	9	63.8 Å²	63.8	6%	0.061	35%	0.353	C	S	.	.	H	α-helix	trans	-79.5	-41.2	177.2	-72	0	0	0	0	111.2	N200 C201 Y217 C218 L219 D223 K224 M225	N200-C221 HydrophobicContact CB-CB 3.99Å; N200-C221 PolarHBondContact ND2-SG 3.35Å; C201-C221 VanDerWaalsContact SG-SG 3.66Å; Y217-C221 HydrophobicContact CD1-CB 4.41Å; C218-C221 WeakPolarHBondContact O-CA 3.29Å; C218-C221 PolarHBondContact O-N 3.47Å; C218-C221 PolarHBondContact SG-SG 2.69Å; L219-C221 VanDerWaalsContact C-N 3.32Å; L219-C221 PolarHBondContact O-N 3.4Å; C221-D223 VanDerWaalsContact C-N 3.34Å; C221-K224 PolarHBondContact O-N 3.44Å; C221-M225 WeakPolarHBondContact O-CG 3.49Å; C221-M225 PolarHBondContact O-N 3.46Å
222	H	84.7	Confident	83.8	Confident	57 Å²	57	62.2 Å²	62.2	26%	0.264	36%	0.355	S	S	.	.	H	α-helix	trans	-57.3	-48.9	174.3	175.2	-88.9	0	0	0	110.9	R210 C218 L219 K224 M225	R210-H222 HydrophobicContact CB-CB 4.03Å; R210-H222 VanDerWaalsContact CB-CD2 3.49Å; R210-H222 WeakPolarHBondContact CB-CD2 3.41Å; R210-H222 HydrophobicContact CG-CB 4.34Å; C218-H222 PolarHBondContact O-N 3.02Å; L219-H222 PolarHBondContact O-N 2.9Å; H222-K224 VanDerWaalsContact C-N 3.33Å; H222-K224 PolarHBondContact O-N 2.83Å; H222-M225 WeakPolarHBondContact O-CB 3.42Å; H222-M225 PolarHBondContact O-N 3.36Å; H222-M225 VanDerWaalsContact O-N 3.08Å
223	D	79.8	Confident	84	Confident	87 Å²	87	61.4 Å²	61.4	47%	0.465	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-40.2	-177.5	-64.9	-12.8	0	0	0	111.5	L219 C221 M225 G226 V227	L219-D223 WeakPolarHBondContact O-CB 3.46Å; L219-D223 PolarHBondContact O-N 2.85Å; C221-D223 VanDerWaalsContact C-N 3.34Å; D223-M225 PolarHBondContact O-N 3.43Å; D223-G226 PolarHBondContact O-N 2.98Å; D223-G226 VanDerWaalsContact O-N 3.11Å; D223-V227 WeakPolarHBondContact O-CG2 3.48Å
224	K	75.5	Confident	83.8	Confident	111 Å²	111	61.8 Å²	61.8	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-26.6	175.4	-77.7	174.6	-173.7	-179.2	0	114	P220 C221 H222 G226 V227 P236	P220-K224 WeakPolarHBondContact O-CB 3.05Å; P220-K224 WeakPolarHBondContact O-CD 3.15Å; P220-K224 WeakPolarHBondContact O-CG 2.94Å; P220-K224 PolarHBondContact O-N 3.05Å; C221-K224 PolarHBondContact O-N 3.44Å; H222-K224 VanDerWaalsContact C-N 3.33Å; H222-K224 PolarHBondContact O-N 2.83Å; K224-G226 PolarHBondContact O-N 2.93Å; K224-V227 PolarHBondContact O-N 3.43Å; K224-V227 VanDerWaalsContact O-N 3.14Å; K224-P236 HydrophobicContact CD-CG 4.2Å; K224-P236 HydrophobicContact CG-CG 3.97Å
225	M	73.5	Confident	83.4	Confident	114 Å²	114	68.6 Å²	68.6	56%	0.562	37%	0.365	S	S	*	.	H	α-helix	trans	-69.1	-22.4	178.4	-66	-70.6	-79.6	0	0	112.5	L212 C221 H222 D223	L212-M225 HydrophobicContact CD2-CB 4.48Å; C221-M225 WeakPolarHBondContact O-CG 3.49Å; C221-M225 PolarHBondContact O-N 3.46Å; H222-M225 WeakPolarHBondContact O-CB 3.42Å; H222-M225 PolarHBondContact O-N 3.36Å; H222-M225 VanDerWaalsContact O-N 3.08Å; D223-M225 PolarHBondContact O-N 3.43Å
226	G	72.1	Confident	82.9	Confident	68 Å²	68	65.5 Å²	65.5	70%	0.701	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.5	172.3	0	0	0	0	0	114.1	D223 K224	D223-G226 PolarHBondContact O-N 2.98Å; D223-G226 VanDerWaalsContact O-N 3.11Å; K224-G226 PolarHBondContact O-N 2.93Å
227	V	74.8	Confident	82.5	Confident	44 Å²	44	65.2 Å²	65.2	27%	0.267	35%	0.352	S	S	.	.	S	Bend	trans	-92.1	126.9	-173.1	-176.3	0	0	0	0	110.4	D223 K224 I229 P236 I237	D223-V227 WeakPolarHBondContact O-CG2 3.48Å; K224-V227 PolarHBondContact O-N 3.43Å; K224-V227 VanDerWaalsContact O-N 3.14Å; V227-I229 PolarHBondContact O-N 3.22Å; V227-P236 HydrophobicContact CB-CB 3.97Å; V227-P236 HydrophobicContact CG1-CB 3.5Å; V227-P236 VanDerWaalsContact CG1-CB 3.5Å; V227-I237 VanDerWaalsContact CG1-O 3.26Å; V227-I237 WeakPolarHBondContact CG1-O 3.26Å
228	P	81.4	Confident	81.9	Confident	35 Å²	35	72.2 Å²	72.2	23%	0.227	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-46	130.2	171.4	-35.8	42	0	0	0	113	P236 I237 V241 Q248	P228-P236 CarbonylContact O-C 3.55Å; P228-P236 WeakPolarHBondContact O-CA 3.16Å; P228-I237 HydrophobicContact CB-CB 4.29Å; P228-I237 HydrophobicContact CB-CD1 4.05Å; P228-I237 WeakPolarHBondContact O-CG1 3.39Å; P228-I237 PolarHBondContact O-N 3.09Å; P228-V241 HydrophobicContact CB-CG1 4.36Å; P228-V241 HydrophobicContact CB-CG2 3.96Å; P228-V241 HydrophobicContact CG-CG2 3.98Å; P228-Q248 HydrophobicContact CB-CB 4.29Å
229	I	83.2	Confident	81.6	Confident	101 Å²	101	74.8 Å²	74.8	52%	0.518	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-99.7	127.7	178.6	-59.4	178.4	0	0	0	109.7	V227 G231	V227-I229 PolarHBondContact O-N 3.22Å; I229-G231 PolarHBondContact O-N 3.48Å
230	C	88.4	Confident	81.7	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-67.8	124.2	178.8	175.8	0	0	0	0	112.4	A232 C233 R234 R235 I237 Q248 H250 H253	C230-A232 PolarHBondContact O-N 3.44Å; C230-A232 VanDerWaalsContact O-N 3.12Å; C230-C233 VanDerWaalsContact CB-SG 3.57Å; C230-C233 VanDerWaalsContact SG-SG 3.67Å; C230-R234 VanDerWaalsContact O-CA 3.26Å; C230-R234 WeakPolarHBondContact O-CA 3.38Å; C230-R234 PolarHBondContact O-N 2.95Å; C230-R235 PolarHBondContact N-O 3.44Å; C230-I237 HydrophobicContact CB-CD1 3.94Å; C230-I237 HydrophobicContact CB-CG1 3.72Å; C230-Q248 CarbonylContact C-O 3.6Å; C230-Q248 VanDerWaalsContact CA-O 3.29Å; C230-Q248 WeakPolarHBondContact CA-O 3.48Å; C230-H250 WeakPolarHBondContact CB-ND1 3.4Å; C230-H250 PolarHBondContact SG-N 2.93Å; C230-H250 VanDerWaalsContact SG-N 3.38Å; C230-H250 PolarHBondContact SG-ND1 3.33Å; C230-H253 PolarHBondContact SG-ND1 2.82Å; C230-H253 VanDerWaalsContact SG-ND1 3.42Å
231	G	85.4	Confident	82	Confident	31 Å²	31	80 Å²	80	32%	0.32	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.2	-179.7	0	0	0	0	0	115.3	I229 Q248	I229-G231 PolarHBondContact O-N 3.48Å; G231-Q248 PolarHBondContact N-O 3.24Å
232	A	88.6	Confident	82.4	Confident	53 Å²	53	81.4 Å²	81.4	44%	0.438	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-65.9	174.9	0	0	0	0	0	113.2	C230 W249 H253	C230-A232 PolarHBondContact O-N 3.44Å; C230-A232 VanDerWaalsContact O-N 3.12Å; A232-W249 HydrophobicContact CB-CE3 3.97Å; A232-W249 HydrophobicContact CB-CZ3 3.98Å; A232-H253 HydrophobicContact CB-CB 3.71Å
233	C	88.4	Confident	82.7	Confident	41 Å²	41	84.2 Å²	84.2	28%	0.277	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-8.2	-173.8	69.6	0	0	0	0	115.1	C230 R235 H250 H253	C230-C233 VanDerWaalsContact CB-SG 3.57Å; C230-C233 VanDerWaalsContact SG-SG 3.67Å; C233-R235 PolarHBondContact O-N 3.5Å; C233-H250 VanDerWaalsContact SG-CE1 3.54Å; C233-H250 PolarHBondContact SG-ND1 2.81Å; C233-H250 VanDerWaalsContact SG-ND1 3.37Å; C233-H253 VanDerWaalsContact CB-CE1 3.48Å; C233-H253 WeakPolarHBondContact CB-CE1 3.09Å; C233-H253 PolarHBondContact SG-CE1 3.37Å; C233-H253 PolarHBondContact SG-ND1 3.45Å; C233-H253 VanDerWaalsContact SG-ND1 3.41Å
234	R	79.9	Confident	83.2	Confident	211 Å²	211	80.4 Å²	80.4	80%	0.796	43%	0.431	S	S	*	.			trans	56.6	26.6	-176.8	-55.8	179	-179.6	-102.1	2.8	114.4	C230	C230-R234 VanDerWaalsContact O-CA 3.26Å; C230-R234 WeakPolarHBondContact O-CA 3.38Å; C230-R234 PolarHBondContact O-N 2.95Å
235	R	77.2	Confident	83.7	Confident	179 Å²	179	77.8 Å²	77.8	68%	0.675	42%	0.421	S	S	*	.	S	Bend	trans	-103.9	151.6	173.3	-61.6	-179.3	-177.9	168.2	-0.2	110.8	C230 C233	C230-R235 PolarHBondContact N-O 3.44Å; C233-R235 PolarHBondContact O-N 3.5Å
236	P	80.9	Confident	84.3	Confident	39 Å²	39	76.7 Å²	76.7	25%	0.253	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-55.3	138.4	170.5	-21.5	32.5	0	0	0	111	K224 V227 P228 H250	K224-P236 HydrophobicContact CD-CG 4.2Å; K224-P236 HydrophobicContact CG-CG 3.97Å; V227-P236 HydrophobicContact CB-CB 3.97Å; V227-P236 HydrophobicContact CG1-CB 3.5Å; V227-P236 VanDerWaalsContact CG1-CB 3.5Å; P228-P236 CarbonylContact O-C 3.55Å; P228-P236 WeakPolarHBondContact O-CA 3.16Å; P236-H250 PolarHBondContact O-NE2 2.82Å
237	I	83.5	Confident	85.1	Confident	5 Å²	5	79.1 Å²	79.1	3%	0.026	43%	0.43	C	S	.	.			trans	-94.2	105.4	177	-55.9	161.4	0	0	0	108.1	V227 P228 C230 R240 V241 Q248 W249	V227-I237 VanDerWaalsContact CG1-O 3.26Å; V227-I237 WeakPolarHBondContact CG1-O 3.26Å; P228-I237 HydrophobicContact CB-CB 4.29Å; P228-I237 HydrophobicContact CB-CD1 4.05Å; P228-I237 WeakPolarHBondContact O-CG1 3.39Å; P228-I237 PolarHBondContact O-N 3.09Å; C230-I237 HydrophobicContact CB-CD1 3.94Å; C230-I237 HydrophobicContact CB-CG1 3.72Å; I237-R240 WeakPolarHBondContact CG2-O 3.47Å; I237-V241 HydrophobicContact CB-CG2 4.18Å; I237-V241 HydrophobicContact CD1-CG1 4.11Å; I237-V241 HydrophobicContact CD1-CG2 4.37Å; I237-V241 HydrophobicContact CG2-CG2 3.77Å; I237-Q248 HydrophobicContact CD1-CB 4.04Å; I237-W249 VanDerWaalsContact CD1-C 3.44Å
238	E	78.6	Confident	85.8	Confident	174 Å²	174	80.5 Å²	80.5	81%	0.813	43%	0.433	S	S	*	.			trans	-86.7	116.5	170.8	-65.1	174.9	-172.9	0	0	108.3
239	G	82.4	Confident	86.4	Confident	71 Å²	71	80.3 Å²	80.3	73%	0.732	43%	0.428	S	S	*	.	S	Bend	trans	99.4	-128.5	178.2	0	0	0	0	0	114.8
240	R	88	Confident	86.8	Confident	207 Å²	207	77.6 Å²	77.6	78%	0.781	41%	0.413	S	S	*	.			trans	-74.4	128.6	-172.3	-71	-169.6	-69	177.8	-2.5	111.7	I237 V251	I237-R240 WeakPolarHBondContact CG2-O 3.47Å; R240-V251 HydrophobicContact CB-CG2 4.01Å
241	V	90.6	Very high	86.9	Confident	44 Å²	44	79.3 Å²	79.3	27%	0.267	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.8	179.8	-179	0	0	0	0	110	P228 I237 Q248	P228-V241 HydrophobicContact CB-CG1 4.36Å; P228-V241 HydrophobicContact CB-CG2 3.96Å; P228-V241 HydrophobicContact CG-CG2 3.98Å; I237-V241 HydrophobicContact CB-CG2 4.18Å; I237-V241 HydrophobicContact CD1-CG1 4.11Å; I237-V241 HydrophobicContact CD1-CG2 4.37Å; I237-V241 HydrophobicContact CG2-CG2 3.77Å; V241-Q248 HydrophobicContact CG1-CB 3.77Å; V241-Q248 HydrophobicContact CG1-CG 4.05Å
242	V	92.8	Very high	87.3	Confident	37 Å²	37	84.8 Å²	84.8	22%	0.224	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.5	166.6	-179.5	0	0	0	0	108.5	A244 Q248 W249 V251 F254	V242-A244 HydrophobicContact CG1-CB 4.33Å; V242-Q248 CarbonylContact O-C 3.57Å; V242-Q248 WeakPolarHBondContact O-CA 3.48Å; V242-W249 HydrophobicContact CB-CB 4.26Å; V242-W249 PolarHBondContact N-O 2.94Å; V242-W249 PolarHBondContact O-N 2.74Å; V242-V251 HydrophobicContact CG2-CB 4.42Å; V242-V251 HydrophobicContact CG2-CG2 4.02Å; V242-F254 HydrophobicContact CB-CB 4.46Å; V242-F254 HydrophobicContact CG1-CB 4.21Å; V242-F254 HydrophobicContact CG1-CD1 3.71Å; V242-F254 HydrophobicContact CG1-CE1 4.27Å; V242-F254 HydrophobicContact CG1-CG 3.94Å
243	N	91.6	Very high	87.5	Confident	116 Å²	116	85.6 Å²	85.6	62%	0.62	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	107.5	174.8	-61	-67.4	0	0	0	108.7	Q248	N243-Q248 PolarHBondContact OD1-NE2 3.14Å
244	A	90.1	Very high	87.7	Confident	8 Å²	8	84.1 Å²	84.1	7%	0.066	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	146.9	-178.9	0	0	0	0	0	110.7	V242 G246 K247 W249 F254	V242-A244 HydrophobicContact CG1-CB 4.33Å; A244-G246 PolarHBondContact O-N 2.81Å; A244-K247 PolarHBondContact N-O 3.45Å; A244-K247 CarbonylContact O-C 3.58Å; A244-K247 PolarHBondContact O-N 3.23Å; A244-W249 PolarHBondContact O-NE1 3.43Å; A244-F254 HydrophobicContact CB-CD2 4.3Å; A244-F254 HydrophobicContact CB-CE1 4.01Å; A244-F254 HydrophobicContact CB-CE2 3.56Å; A244-F254 HydrophobicContact CB-CZ 3.39Å
245	M	86	Confident	88.4	Confident	55 Å²	55	76.4 Å²	76.4	27%	0.271	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	34.7	176.1	-52.5	162.5	60.1	0	0	113.8	K247 F254 E270 G273 A275	M245-K247 PolarHBondContact O-N 3.13Å; M245-F254 HydrophobicContact SD-CE2 3.94Å; M245-F254 HydrophobicContact SD-CZ 4.47Å; M245-E270 VanDerWaalsContact CG-CD 3.43Å; M245-E270 HydrophobicContact CG-CG 4.06Å; M245-E270 WeakPolarHBondContact CG-OE1 3.18Å; M245-E270 WeakPolarHBondContact CG-OE2 3.1Å; M245-G273 WeakPolarHBondContact CE-O 3.36Å; M245-A275 HydrophobicContact SD-CB 3.94Å
246	G	85.9	Confident	89.3	Confident	91 Å²	91	67.9 Å²	67.9	94%	0.938	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	12.7	-177	0	0	0	0	0	115	A244	A244-G246 PolarHBondContact O-N 2.81Å
247	K	88.4	Confident	89.9	Confident	120 Å²	120	68.4 Å²	68.4	52%	0.522	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	164.7	179.3	-66.3	-179.4	-177.2	178.8	0	110.8	A244 M245 W249	A244-K247 PolarHBondContact N-O 3.45Å; A244-K247 CarbonylContact O-C 3.58Å; A244-K247 PolarHBondContact O-N 3.23Å; M245-K247 PolarHBondContact O-N 3.13Å; K247-W249 HydrophobicContact CB-CZ2 3.75Å; K247-W249 HydrophobicContact CD-CH2 4.15Å; K247-W249 HydrophobicContact CD-CZ2 3.84Å; K247-W249 HydrophobicContact CG-CZ2 4.38Å; K247-W249 PolarHBondContact O-NE1 2.82Å
248	Q	91.2	Very high	90.2	Very high	72 Å²	72	74.4 Å²	74.4	34%	0.336	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.9	176.1	-61.3	-175.1	-58.2	0	0	109.3	P228 C230 G231 I237 V241 V242 N243	P228-Q248 HydrophobicContact CB-CB 4.29Å; C230-Q248 CarbonylContact C-O 3.6Å; C230-Q248 VanDerWaalsContact CA-O 3.29Å; C230-Q248 WeakPolarHBondContact CA-O 3.48Å; G231-Q248 PolarHBondContact N-O 3.24Å; I237-Q248 HydrophobicContact CD1-CB 4.04Å; V241-Q248 HydrophobicContact CG1-CB 3.77Å; V241-Q248 HydrophobicContact CG1-CG 4.05Å; V242-Q248 CarbonylContact O-C 3.57Å; V242-Q248 WeakPolarHBondContact O-CA 3.48Å; N243-Q248 PolarHBondContact OD1-NE2 3.14Å
249	W	93.3	Very high	91	Very high	32 Å²	32	68 Å²	68	12%	0.121	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.7	-174.1	-44.6	81.8	0	0	0	111.2	A232 I237 V242 A244 K247 F254	A232-W249 HydrophobicContact CB-CE3 3.97Å; A232-W249 HydrophobicContact CB-CZ3 3.98Å; I237-W249 VanDerWaalsContact CD1-C 3.44Å; V242-W249 HydrophobicContact CB-CB 4.26Å; V242-W249 PolarHBondContact N-O 2.94Å; V242-W249 PolarHBondContact O-N 2.74Å; A244-W249 PolarHBondContact O-NE1 3.43Å; K247-W249 HydrophobicContact CB-CZ2 3.75Å; K247-W249 HydrophobicContact CD-CH2 4.15Å; K247-W249 HydrophobicContact CD-CZ2 3.84Å; K247-W249 HydrophobicContact CG-CZ2 4.38Å; K247-W249 PolarHBondContact O-NE1 2.82Å; W249-F254 HydrophobicContact CB-CB 3.98Å; W249-F254 HydrophobicContact CB-CD2 4.5Å; W249-F254 AromaticContact CD1-CD2 3.9Å; W249-F254 HydrophobicContact CD2-CD2 4.01Å; W249-F254 HydrophobicContact CG-CB 4.3Å; W249-F254 AromaticContact CG-CD2 3.91Å; W249-F254 HydrophobicContact CG-CD2 3.91Å; W249-F254 HydrophobicContact CG-CG 4.43Å
250	H	90.6	Very high	91.5	Very high	43 Å²	43	72 Å²	72	20%	0.199	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	146.4	159.6	-70.1	98.2	0	0	0	109.1	C230 C233 P236 E252 H253 F254	C230-H250 WeakPolarHBondContact CB-ND1 3.4Å; C230-H250 PolarHBondContact SG-N 2.93Å; C230-H250 VanDerWaalsContact SG-N 3.38Å; C230-H250 PolarHBondContact SG-ND1 3.33Å; C233-H250 VanDerWaalsContact SG-CE1 3.54Å; C233-H250 PolarHBondContact SG-ND1 2.81Å; C233-H250 VanDerWaalsContact SG-ND1 3.37Å; P236-H250 PolarHBondContact O-NE2 2.82Å; H250-E252 PolarHBondContact O-N 3.48Å; H250-E252 VanDerWaalsContact O-N 3.17Å; H250-H253 HydrophobicContact CB-CB 4.07Å; H250-H253 AromaticContact CG-ND1 3.65Å; H250-H253 AromaticContact ND1-CE1 3.75Å; H250-H253 AromaticContact ND1-ND1 3.28Å; H250-H253 PolarHBondContact ND1-ND1 2.78Å; H250-H253 PolarHBondContact O-N 2.94Å; H250-F254 PolarHBondContact O-N 3.02Å; H250-F254 VanDerWaalsContact O-N 3.14Å
251	V	92.4	Very high	91.6	Very high	36 Å²	36	69.2 Å²	69.2	22%	0.218	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-37	178	179.8	0	0	0	0	112	R240 V242 L264	R240-V251 HydrophobicContact CB-CG2 4.01Å; V242-V251 HydrophobicContact CG2-CB 4.42Å; V242-V251 HydrophobicContact CG2-CG2 4.02Å; V251-L264 HydrophobicContact CG1-CD2 3.87Å
252	E	92.4	Very high	91.7	Very high	146 Å²	146	69.6 Å²	69.6	68%	0.682	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-22.1	-179.9	-64.9	168.3	-163.9	0	0	113.6	H250 V255	H250-E252 PolarHBondContact O-N 3.48Å; H250-E252 VanDerWaalsContact O-N 3.17Å; E252-V255 VanDerWaalsContact O-CG1 3.31Å; E252-V255 WeakPolarHBondContact O-CG1 3.27Å
253	H	92.2	Very high	91.8	Very high	70 Å²	70	68.3 Å²	68.3	32%	0.324	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-10.5	-177.8	-65	153.5	0	0	0	113.6	C230 A232 C233 H250 V255	C230-H253 PolarHBondContact SG-ND1 2.82Å; C230-H253 VanDerWaalsContact SG-ND1 3.42Å; A232-H253 HydrophobicContact CB-CB 3.71Å; C233-H253 VanDerWaalsContact CB-CE1 3.48Å; C233-H253 WeakPolarHBondContact CB-CE1 3.09Å; C233-H253 PolarHBondContact SG-CE1 3.37Å; C233-H253 PolarHBondContact SG-ND1 3.45Å; C233-H253 VanDerWaalsContact SG-ND1 3.41Å; H250-H253 HydrophobicContact CB-CB 4.07Å; H250-H253 AromaticContact CG-ND1 3.65Å; H250-H253 AromaticContact ND1-CE1 3.75Å; H250-H253 AromaticContact ND1-ND1 3.28Å; H250-H253 PolarHBondContact ND1-ND1 2.78Å; H250-H253 PolarHBondContact O-N 2.94Å; H253-V255 PolarHBondContact O-N 2.89Å
254	F	94.5	Very high	91.7	Very high	10 Å²	10	68.1 Å²	68.1	4%	0.044	36%	0.362	C	S	.	.			trans	-84.1	94	169.8	-166.5	-119.4	0	0	0	108.9	V242 A244 M245 W249 H250 P262 F263 H268 A275	V242-F254 HydrophobicContact CB-CB 4.46Å; V242-F254 HydrophobicContact CG1-CB 4.21Å; V242-F254 HydrophobicContact CG1-CD1 3.71Å; V242-F254 HydrophobicContact CG1-CE1 4.27Å; V242-F254 HydrophobicContact CG1-CG 3.94Å; A244-F254 HydrophobicContact CB-CD2 4.3Å; A244-F254 HydrophobicContact CB-CE1 4.01Å; A244-F254 HydrophobicContact CB-CE2 3.56Å; A244-F254 HydrophobicContact CB-CZ 3.39Å; M245-F254 HydrophobicContact SD-CE2 3.94Å; M245-F254 HydrophobicContact SD-CZ 4.47Å; W249-F254 HydrophobicContact CB-CB 3.98Å; W249-F254 HydrophobicContact CB-CD2 4.5Å; W249-F254 AromaticContact CD1-CD2 3.9Å; W249-F254 HydrophobicContact CD2-CD2 4.01Å; W249-F254 HydrophobicContact CG-CB 4.3Å; W249-F254 AromaticContact CG-CD2 3.91Å; W249-F254 HydrophobicContact CG-CD2 3.91Å; W249-F254 HydrophobicContact CG-CG 4.43Å; H250-F254 PolarHBondContact O-N 3.02Å; H250-F254 VanDerWaalsContact O-N 3.14Å; F254-P262 WeakPolarHBondContact O-CA 3.39Å; F254-F263 HydrophobicContact CD1-CB 4.27Å; F254-F263 AromaticContact CD1-CD2 3.33Å; F254-F263 HydrophobicContact CD1-CD2 3.33Å; F254-F263 HydrophobicContact CD1-CE2 4.02Å; F254-F263 HydrophobicContact CD1-CG 4.15Å; F254-F263 AromaticContact CE1-CD2 3.46Å; F254-F263 HydrophobicContact CE1-CD2 3.46Å; F254-F263 VanDerWaalsContact CE1-CD2 3.46Å; F254-F263 AromaticContact CE1-CE2 3.82Å; F254-F263 HydrophobicContact CE1-CE2 3.82Å; F254-F263 HydrophobicContact CE1-CG 4.22Å; F254-F263 HydrophobicContact CG-CD2 4.02Å; F254-F263 HydrophobicContact CZ-CD2 4.24Å; F254-F263 HydrophobicContact CZ-CE2 4.15Å; F254-F263 WeakPolarHBondContact O-CD2 3.45Å; F254-F263 PolarHBondContact O-N 3.21Å; F254-H268 HydrophobicContact CE1-CB 4.08Å; F254-H268 AromaticContact CE1-CD2 3.9Å; F254-H268 AromaticContact CE1-CE1 3.95Å; F254-H268 AromaticContact CE1-CG 3.63Å; F254-H268 AromaticContact CE1-ND1 3.68Å; F254-H268 HydrophobicContact CZ-CB 4.4Å; F254-H268 AromaticContact CZ-CD2 3.59Å; F254-H268 AromaticContact CZ-CG 3.81Å; F254-H268 AromaticContact CZ-NE2 3.78Å; F254-A275 HydrophobicContact CE2-CB 3.94Å; F254-A275 HydrophobicContact CZ-CB 3.75Å
255	V	94.7	Very high	91.6	Very high	49 Å²	49	71.6 Å²	71.6	30%	0.297	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-121.1	156.4	-170.3	-58	0	0	0	0	112.4	E252 H253 A257 E260 K261 P262 F263	E252-V255 VanDerWaalsContact O-CG1 3.31Å; E252-V255 WeakPolarHBondContact O-CG1 3.27Å; H253-V255 PolarHBondContact O-N 2.89Å; V255-A257 PolarHBondContact O-N 3.11Å; V255-E260 WeakPolarHBondContact CG1-O 3.2Å; V255-K261 WeakPolarHBondContact CA-O 3.44Å; V255-P262 HydrophobicContact CG1-CB 4.14Å; V255-F263 WeakPolarHBondContact O-CE2 3.34Å
256	C	94.8	Very high	91.8	Very high	1 Å²	1	76 Å²	76	1%	0.007	42%	0.418	C	S	.	.			trans	-66.6	128.2	170.4	171.6	0	0	0	0	110.5	K258 C259 E260 K261 F263 A275 C277	C256-K258 PolarHBondContact O-N 3.5Å; C256-K258 PolarHBondContact SG-N 3.1Å; C256-K258 VanDerWaalsContact SG-N 3.43Å; C256-C259 VanDerWaalsContact CB-SG 3.54Å; C256-C259 PolarHBondContact O-N 3.01Å; C256-C259 VanDerWaalsContact SG-SG 3.66Å; C256-E260 VanDerWaalsContact O-CA 3.27Å; C256-E260 WeakPolarHBondContact O-CA 3.45Å; C256-E260 PolarHBondContact O-N 2.8Å; C256-K261 PolarHBondContact N-O 2.99Å; C256-F263 HydrophobicContact CB-CE1 4.34Å; C256-F263 HydrophobicContact CB-CZ 3.98Å; C256-A275 CarbonylContact C-O 3.59Å; C256-A275 WeakPolarHBondContact CA-O 3.42Å; C256-C277 HydrophobicContact CB-CB 4.2Å; C256-C277 PolarHBondContact SG-N 2.85Å
257	A	93.3	Very high	92.1	Very high	49 Å²	49	80.5 Å²	80.5	41%	0.405	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-13	-179.1	0	0	0	0	0	114.9	V255 L274 A275 Y276	V255-A257 PolarHBondContact O-N 3.11Å; A257-L274 HydrophobicContact CB-CB 4.07Å; A257-L274 HydrophobicContact CB-CD1 4.37Å; A257-L274 HydrophobicContact CB-CD2 4.4Å; A257-A275 WeakPolarHBondContact CB-O 3.32Å; A257-A275 PolarHBondContact N-O 2.84Å; A257-Y276 HydrophobicContact CB-CD1 4.42Å; A257-Y276 HydrophobicContact CB-CE1 4.03Å
258	K	91.4	Very high	92.3	Very high	131 Å²	131	77.5 Å²	77.5	57%	0.57	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-38.7	-179.5	-175.6	58.1	179.7	176.4	0	114.1	C256 Y276 H280	C256-K258 PolarHBondContact O-N 3.5Å; C256-K258 PolarHBondContact SG-N 3.1Å; C256-K258 VanDerWaalsContact SG-N 3.43Å; K258-Y276 HydrophobicContact CB-CD1 4.39Å; K258-H280 HydrophobicContact CB-CB 3.89Å; K258-H280 HydrophobicContact CG-CB 4.16Å
259	C	93.7	Very high	92.4	Very high	39 Å²	39	76.3 Å²	76.3	26%	0.264	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-2.2	-178.2	61.2	0	0	0	0	114.8	C256 K261 H280	C256-C259 VanDerWaalsContact CB-SG 3.54Å; C256-C259 PolarHBondContact O-N 3.01Å; C256-C259 VanDerWaalsContact SG-SG 3.66Å; C259-K261 HydrophobicContact CB-CG 4.38Å; C259-K261 PolarHBondContact O-N 3.44Å; C259-H280 WeakPolarHBondContact CB-CE1 3.37Å; C259-H280 PolarHBondContact SG-CE1 3.5Å; C259-H280 PolarHBondContact SG-ND1 3.49Å
260	E	92.8	Very high	92.4	Very high	156 Å²	156	79.3 Å²	79.3	73%	0.729	40%	0.403	S	S	*	.			trans	59.3	12.5	178	-55.8	180	175.2	0	0	114.2	V255 C256	V255-E260 WeakPolarHBondContact CG1-O 3.2Å; C256-E260 VanDerWaalsContact O-CA 3.27Å; C256-E260 WeakPolarHBondContact O-CA 3.45Å; C256-E260 PolarHBondContact O-N 2.8Å
261	K	91.2	Very high	92.3	Very high	148 Å²	148	83.3 Å²	83.3	64%	0.643	42%	0.417	S	S	*	.			trans	-78	132.8	174.9	-65.2	-174.3	-179.2	-177	0	110	V255 C256 C259	V255-K261 WeakPolarHBondContact CA-O 3.44Å; C256-K261 PolarHBondContact N-O 2.99Å; C259-K261 HydrophobicContact CB-CG 4.38Å; C259-K261 PolarHBondContact O-N 3.44Å
262	P	92.9	Very high	92.2	Very high	52 Å²	52	91 Å²	91	34%	0.338	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-66.1	145.1	176	26.6	-33.1	0	0	0	111.2	F254 V255 L264	F254-P262 WeakPolarHBondContact O-CA 3.39Å; V255-P262 HydrophobicContact CG1-CB 4.14Å; P262-L264 HydrophobicContact CB-CD2 3.92Å; P262-L264 HydrophobicContact CB-CG 4.02Å; P262-L264 HydrophobicContact CG-CD1 4.34Å; P262-L264 HydrophobicContact CG-CD2 4.07Å; P262-L264 HydrophobicContact CG-CG 4.01Å
263	F	93.6	Very high	92	Very high	11 Å²	11	86.8 Å²	86.8	5%	0.048	44%	0.443	C	S	.	.			trans	-72.6	-29.6	179.6	-68.1	-76.9	0	0	0	112.6	F254 V255 C256 G265 H266 H268 A275 Y276 C277	F254-F263 HydrophobicContact CD1-CB 4.27Å; F254-F263 AromaticContact CD1-CD2 3.33Å; F254-F263 HydrophobicContact CD1-CD2 3.33Å; F254-F263 HydrophobicContact CD1-CE2 4.02Å; F254-F263 HydrophobicContact CD1-CG 4.15Å; F254-F263 AromaticContact CE1-CD2 3.46Å; F254-F263 HydrophobicContact CE1-CD2 3.46Å; F254-F263 VanDerWaalsContact CE1-CD2 3.46Å; F254-F263 AromaticContact CE1-CE2 3.82Å; F254-F263 HydrophobicContact CE1-CE2 3.82Å; F254-F263 HydrophobicContact CE1-CG 4.22Å; F254-F263 HydrophobicContact CG-CD2 4.02Å; F254-F263 HydrophobicContact CZ-CD2 4.24Å; F254-F263 HydrophobicContact CZ-CE2 4.15Å; F254-F263 WeakPolarHBondContact O-CD2 3.45Å; F254-F263 PolarHBondContact O-N 3.21Å; V255-F263 WeakPolarHBondContact O-CE2 3.34Å; C256-F263 HydrophobicContact CB-CE1 4.34Å; C256-F263 HydrophobicContact CB-CZ 3.98Å; F263-G265 PolarHBondContact O-N 2.9Å; F263-H266 VanDerWaalsContact O-CB 3.24Å; F263-H266 WeakPolarHBondContact O-CB 2.96Å; F263-H266 PolarHBondContact O-CD2 2.77Å; F263-H266 PolarHBondContact O-N 3.16Å; F263-H268 HydrophobicContact CD1-CB 3.65Å; F263-H268 HydrophobicContact CD2-CB 4.13Å; F263-H268 HydrophobicContact CE1-CB 3.38Å; F263-H268 HydrophobicContact CE2-CB 3.9Å; F263-H268 HydrophobicContact CG-CB 4.02Å; F263-H268 HydrophobicContact CZ-CB 3.53Å; F263-A275 HydrophobicContact CE2-CB 3.69Å; F263-A275 HydrophobicContact CZ-CB 3.83Å; F263-Y276 WeakPolarHBondContact CE1-O 3.12Å; F263-C277 HydrophobicContact CE1-CB 4.12Å
264	L	90.4	Very high	91.9	Very high	111 Å²	111	87.4 Å²	87.4	58%	0.581	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	30.2	178.3	-55.8	-179.1	0	0	0	114.6	V251 P262	V251-L264 HydrophobicContact CG1-CD2 3.87Å; P262-L264 HydrophobicContact CB-CD2 3.92Å; P262-L264 HydrophobicContact CB-CG 4.02Å; P262-L264 HydrophobicContact CG-CD1 4.34Å; P262-L264 HydrophobicContact CG-CD2 4.07Å; P262-L264 HydrophobicContact CG-CG 4.01Å
265	G	87.8	Confident	91.9	Very high	82 Å²	82	87.1 Å²	87.1	85%	0.845	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	-7.6	-177.5	0	0	0	0	0	115.2	F263	F263-G265 PolarHBondContact O-N 2.9Å
266	H	90.8	Very high	91.9	Very high	146 Å²	146	86 Å²	86	68%	0.676	44%	0.438	S	S	*	.	S	Bend	trans	-66.2	153.1	168.2	-67.2	-77.9	0	0	0	111.4	F263 H268	F263-H266 VanDerWaalsContact O-CB 3.24Å; F263-H266 WeakPolarHBondContact O-CB 2.96Å; F263-H266 PolarHBondContact O-CD2 2.77Å; F263-H266 PolarHBondContact O-N 3.16Å; H266-H268 PolarHBondContact O-N 3.5Å
267	R	91.8	Very high	91.8	Very high	186 Å²	186	87.2 Å²	87.2	70%	0.702	45%	0.446	S	S	*	.			trans	-60	132.6	179.3	-171	176.6	-177	176.6	1.7	111	Y269	R267-Y269 HydrophobicContact CG-CE2 4.3Å
268	H	93	Very high	91.6	Very high	58 Å²	58	90 Å²	90	27%	0.269	45%	0.451	S	S	.	.			trans	-110.7	157.9	172	67.9	-79.5	0	0	0	111.1	F254 F263 H266 E270	F254-H268 HydrophobicContact CE1-CB 4.08Å; F254-H268 AromaticContact CE1-CD2 3.9Å; F254-H268 AromaticContact CE1-CE1 3.95Å; F254-H268 AromaticContact CE1-CG 3.63Å; F254-H268 AromaticContact CE1-ND1 3.68Å; F254-H268 HydrophobicContact CZ-CB 4.4Å; F254-H268 AromaticContact CZ-CD2 3.59Å; F254-H268 AromaticContact CZ-CG 3.81Å; F254-H268 AromaticContact CZ-NE2 3.78Å; F263-H268 HydrophobicContact CD1-CB 3.65Å; F263-H268 HydrophobicContact CD2-CB 4.13Å; F263-H268 HydrophobicContact CE1-CB 3.38Å; F263-H268 HydrophobicContact CE2-CB 3.9Å; F263-H268 HydrophobicContact CG-CB 4.02Å; F263-H268 HydrophobicContact CZ-CB 3.53Å; H266-H268 PolarHBondContact O-N 3.5Å; H268-E270 IonicContact CD2-OE1 3.31Å; H268-E270 IonicContact NE2-OE1 2.88Å; H268-E270 PolarHBondContact NE2-OE1 2.86Å
269	Y	92.8	Very high	91.4	Very high	46 Å²	46	87.7 Å²	87.7	18%	0.18	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.6	177.6	-64.2	-95.1	0	0	0	109.8	R267 A275 Y276 E278 Y281	R267-Y269 HydrophobicContact CG-CE2 4.3Å; Y269-A275 CarbonylContact O-C 3.58Å; Y269-A275 WeakPolarHBondContact O-CA 3.42Å; Y269-Y276 PolarHBondContact N-O 2.88Å; Y269-Y276 PolarHBondContact O-N 3.44Å; Y269-E278 HydrophobicContact CD2-CB 4.29Å; Y269-E278 HydrophobicContact CE2-CB 3.63Å; Y269-E278 HydrophobicContact CE2-CG 3.88Å; Y269-Y281 HydrophobicContact CD1-CD1 4.26Å; Y269-Y281 HydrophobicContact CD1-CE1 4.46Å; Y269-Y281 HydrophobicContact CD1-CG 4.42Å; Y269-Y281 HydrophobicContact CG-CD1 4.25Å; Y269-Y281 HydrophobicContact CG-CD2 4.27Å; Y269-Y281 AromaticContact CG-CG 3.98Å; Y269-Y281 HydrophobicContact CG-CG 3.98Å
270	E	92.3	Very high	91.2	Very high	96 Å²	96	87.6 Å²	87.6	45%	0.449	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.4	-174.2	-61.3	-176.5	-167.6	0	0	111.4	M245 H268 L274	M245-E270 VanDerWaalsContact CG-CD 3.43Å; M245-E270 HydrophobicContact CG-CG 4.06Å; M245-E270 WeakPolarHBondContact CG-OE1 3.18Å; M245-E270 WeakPolarHBondContact CG-OE2 3.1Å; H268-E270 IonicContact CD2-OE1 3.31Å; H268-E270 IonicContact NE2-OE1 2.88Å; H268-E270 PolarHBondContact NE2-OE1 2.86Å; E270-L274 WeakPolarHBondContact CA-O 3.22Å
271	R	89.8	Confident	91.1	Very high	127 Å²	127	82.7 Å²	82.7	48%	0.479	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	128.7	174.5	-165.2	69.6	171.8	-179.5	-1.2	110.4	G273 L274 Y276 Y281 F285	R271-G273 PolarHBondContact O-N 3.38Å; R271-G273 VanDerWaalsContact O-N 3.16Å; R271-L274 PolarHBondContact N-O 3.3Å; R271-L274 PolarHBondContact O-N 3Å; R271-Y276 HydrophobicContact CB-CD2 4.28Å; R271-Y276 HydrophobicContact CB-CE2 3.98Å; R271-Y281 HydrophobicContact CB-CE2 4.14Å; R271-F285 HydrophobicContact CB-CD2 4.34Å; R271-F285 HydrophobicContact CB-CE2 3.84Å; R271-F285 HydrophobicContact CB-CZ 4.06Å; R271-F285 HydrophobicContact CG-CD1 4.24Å; R271-F285 HydrophobicContact CG-CD2 4.16Å; R271-F285 HydrophobicContact CG-CE1 3.91Å; R271-F285 HydrophobicContact CG-CE2 3.83Å; R271-F285 HydrophobicContact CG-CG 4.36Å; R271-F285 HydrophobicContact CG-CZ 3.7Å
272	K	89.3	Confident	90.8	Very high	198 Å²	198	78.1 Å²	78.1	86%	0.861	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	36.5	-179.3	-64.3	-174.8	175.2	-175.7	0	113.8	L274	K272-L274 VanDerWaalsContact C-N 3.34Å; K272-L274 PolarHBondContact O-N 3.3Å
273	G	87.8	Confident	90.4	Very high	57 Å²	57	81.7 Å²	81.7	59%	0.588	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	29.1	-178.6	0	0	0	0	0	114	M245 R271	M245-G273 WeakPolarHBondContact CE-O 3.36Å; R271-G273 PolarHBondContact O-N 3.38Å; R271-G273 VanDerWaalsContact O-N 3.16Å
274	L	92	Very high	90	Very high	82 Å²	82	85.2 Å²	85.2	43%	0.429	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.4	168.8	-64.5	174.5	0	0	0	110.1	A257 E270 R271 K272 Y276	A257-L274 HydrophobicContact CB-CB 4.07Å; A257-L274 HydrophobicContact CB-CD1 4.37Å; A257-L274 HydrophobicContact CB-CD2 4.4Å; E270-L274 WeakPolarHBondContact CA-O 3.22Å; R271-L274 PolarHBondContact N-O 3.3Å; R271-L274 PolarHBondContact O-N 3Å; K272-L274 VanDerWaalsContact C-N 3.34Å; K272-L274 PolarHBondContact O-N 3.3Å; L274-Y276 HydrophobicContact CB-CE2 3.73Å; L274-Y276 WeakPolarHBondContact CD1-OH 3.42Å
275	A	93.9	Very high	89.8	Confident	5 Å²	5	83.6 Å²	83.6	4%	0.041	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.3	176.8	0	0	0	0	0	111.2	M245 F254 C256 A257 F263 Y269	M245-A275 HydrophobicContact SD-CB 3.94Å; F254-A275 HydrophobicContact CE2-CB 3.94Å; F254-A275 HydrophobicContact CZ-CB 3.75Å; C256-A275 CarbonylContact C-O 3.59Å; C256-A275 WeakPolarHBondContact CA-O 3.42Å; A257-A275 WeakPolarHBondContact CB-O 3.32Å; A257-A275 PolarHBondContact N-O 2.84Å; F263-A275 HydrophobicContact CE2-CB 3.69Å; F263-A275 HydrophobicContact CZ-CB 3.83Å; Y269-A275 CarbonylContact O-C 3.58Å; Y269-A275 WeakPolarHBondContact O-CA 3.42Å
276	Y	94.5	Very high	89.6	Confident	25 Å²	25	80.7 Å²	80.7	10%	0.098	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147	179	-60.3	-89.9	0	0	0	110.6	A257 K258 F263 Y269 R271 L274 H280 Y281 L284 F285	A257-Y276 HydrophobicContact CB-CD1 4.42Å; A257-Y276 HydrophobicContact CB-CE1 4.03Å; K258-Y276 HydrophobicContact CB-CD1 4.39Å; F263-Y276 WeakPolarHBondContact CE1-O 3.12Å; Y269-Y276 PolarHBondContact N-O 2.88Å; Y269-Y276 PolarHBondContact O-N 3.44Å; R271-Y276 HydrophobicContact CB-CD2 4.28Å; R271-Y276 HydrophobicContact CB-CE2 3.98Å; L274-Y276 HydrophobicContact CB-CE2 3.73Å; L274-Y276 WeakPolarHBondContact CD1-OH 3.42Å; Y276-H280 HydrophobicContact CD1-CB 4.48Å; Y276-Y281 HydrophobicContact CD2-CD2 4.48Å; Y276-L284 HydrophobicContact CD1-CD1 3.81Å; Y276-L284 HydrophobicContact CE1-CD1 3.49Å; Y276-L284 VanDerWaalsContact CE1-CD1 3.49Å; Y276-F285 AromaticContact CD2-CE2 3.95Å; Y276-F285 HydrophobicContact CD2-CE2 3.95Å; Y276-F285 HydrophobicContact CE1-CE2 4.38Å; Y276-F285 AromaticContact CE2-CE2 3.72Å; Y276-F285 HydrophobicContact CE2-CE2 3.72Å; Y276-F285 HydrophobicContact CE2-CZ 4.09Å; Y276-F285 HydrophobicContact CG-CE2 4.37Å; Y276-F285 AromaticContact CZ-CE2 3.94Å
277	C	92.5	Very high	89.3	Confident	26 Å²	26	78.1 Å²	78.1	18%	0.176	38%	0.382	C	S	.	.			trans	-73.1	158.2	164.2	66.9	0	0	0	0	109.8	C256 F263 T279 H280 Y281	C256-C277 HydrophobicContact CB-CB 4.2Å; C256-C277 PolarHBondContact SG-N 2.85Å; F263-C277 HydrophobicContact CE1-CB 4.12Å; C277-T279 VanDerWaalsContact C-N 3.26Å; C277-T279 PolarHBondContact O-N 2.89Å; C277-T279 PolarHBondContact SG-OG1 2.89Å; C277-H280 PolarHBondContact O-N 3.47Å; C277-H280 VanDerWaalsContact O-N 3.13Å; C277-H280 PolarHBondContact SG-ND1 3.46Å; C277-Y281 WeakPolarHBondContact O-CB 3.31Å; C277-Y281 PolarHBondContact O-N 2.95Å
278	E	88.7	Confident	89	Confident	108 Å²	108	72.4 Å²	72.4	51%	0.505	37%	0.368	S	S	.	.	H	α-helix	trans	-48.8	-47.4	-176.9	-171.6	165	-162.7	0	0	113.1	Y269 H280 Y281 N282	Y269-E278 HydrophobicContact CD2-CB 4.29Å; Y269-E278 HydrophobicContact CE2-CB 3.63Å; Y269-E278 HydrophobicContact CE2-CG 3.88Å; E278-H280 PolarHBondContact O-N 3.44Å; E278-Y281 PolarHBondContact O-N 3.21Å; E278-N282 WeakPolarHBondContact O-CB 3.41Å; E278-N282 VanDerWaalsContact O-CG 3.27Å; E278-N282 PolarHBondContact O-N 3.31Å; E278-N282 PolarHBondContact O-ND2 3.37Å
279	T	87.4	Confident	88.9	Confident	83 Å²	83	69.6 Å²	69.6	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-59.7	-49.1	-179.8	53.3	0	0	0	0	112.4	C277 Q283	C277-T279 VanDerWaalsContact C-N 3.26Å; C277-T279 PolarHBondContact O-N 2.89Å; C277-T279 PolarHBondContact SG-OG1 2.89Å; T279-Q283 WeakPolarHBondContact O-CB 3.48Å; T279-Q283 WeakPolarHBondContact O-CG 3.49Å; T279-Q283 PolarHBondContact O-N 2.91Å
280	H	89	Confident	88.7	Confident	36 Å²	36	71.5 Å²	71.5	17%	0.167	36%	0.364	C	S	.	.	H	α-helix	trans	-74.5	-32	180	-67.6	121.4	0	0	0	112.7	K258 C259 Y276 C277 E278 Q283 L284	K258-H280 HydrophobicContact CB-CB 3.89Å; K258-H280 HydrophobicContact CG-CB 4.16Å; C259-H280 WeakPolarHBondContact CB-CE1 3.37Å; C259-H280 PolarHBondContact SG-CE1 3.5Å; C259-H280 PolarHBondContact SG-ND1 3.49Å; Y276-H280 HydrophobicContact CD1-CB 4.48Å; C277-H280 PolarHBondContact O-N 3.47Å; C277-H280 VanDerWaalsContact O-N 3.13Å; C277-H280 PolarHBondContact SG-ND1 3.46Å; E278-H280 PolarHBondContact O-N 3.44Å; H280-Q283 PolarHBondContact CD2-OE1 2.99Å; H280-Q283 PolarHBondContact O-N 3.44Å; H280-L284 WeakPolarHBondContact O-CB 3.43Å; H280-L284 VanDerWaalsContact O-CG 3.23Å; H280-L284 WeakPolarHBondContact O-CG 3.4Å; H280-L284 PolarHBondContact O-N 3.32Å
281	Y	90.8	Very high	88.5	Confident	54 Å²	54	72.9 Å²	72.9	21%	0.212	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-49	173.7	-175.6	-92.1	0	0	0	110.4	Y269 R271 Y276 C277 E278 L284 F285	Y269-Y281 HydrophobicContact CD1-CD1 4.26Å; Y269-Y281 HydrophobicContact CD1-CE1 4.46Å; Y269-Y281 HydrophobicContact CD1-CG 4.42Å; Y269-Y281 HydrophobicContact CG-CD1 4.25Å; Y269-Y281 HydrophobicContact CG-CD2 4.27Å; Y269-Y281 AromaticContact CG-CG 3.98Å; Y269-Y281 HydrophobicContact CG-CG 3.98Å; R271-Y281 HydrophobicContact CB-CE2 4.14Å; Y276-Y281 HydrophobicContact CD2-CD2 4.48Å; C277-Y281 WeakPolarHBondContact O-CB 3.31Å; C277-Y281 PolarHBondContact O-N 2.95Å; E278-Y281 PolarHBondContact O-N 3.21Å; Y281-L284 PolarHBondContact O-N 3.46Å; Y281-F285 AromaticContact CD2-CD2 3.62Å; Y281-F285 HydrophobicContact CD2-CD2 3.62Å; Y281-F285 HydrophobicContact CD2-CE2 4.2Å; Y281-F285 AromaticContact CE2-CD2 3.78Å; Y281-F285 HydrophobicContact CE2-CD2 3.78Å; Y281-F285 HydrophobicContact CE2-CE2 4.46Å; Y281-F285 HydrophobicContact CE2-CG 4.48Å; Y281-F285 HydrophobicContact CG-CD2 4.17Å; Y281-F285 WeakPolarHBondContact O-CA 3.43Å; Y281-F285 WeakPolarHBondContact O-CB 3.23Å; Y281-F285 WeakPolarHBondContact O-CD2 3.46Å; Y281-F285 PolarHBondContact O-N 3.16Å
282	N	86.4	Confident	88.5	Confident	52 Å²	52	68.5 Å²	68.5	28%	0.278	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-40.6	177.6	-72	-14.7	0	0	0	111.6	E278 L284 G286 V295	E278-N282 WeakPolarHBondContact O-CB 3.41Å; E278-N282 VanDerWaalsContact O-CG 3.27Å; E278-N282 PolarHBondContact O-N 3.31Å; E278-N282 PolarHBondContact O-ND2 3.37Å; N282-L284 PolarHBondContact O-N 3.08Å; N282-G286 WeakPolarHBondContact O-CA 3.29Å; N282-G286 PolarHBondContact O-N 3.24Å; N282-V295 HydrophobicContact CB-CG1 3.95Å; N282-V295 VanDerWaalsContact O-CG1 3.32Å; N282-V295 WeakPolarHBondContact O-CG1 3.4Å; N282-V295 WeakPolarHBondContact O-CG2 3.23Å
283	Q	83.6	Confident	88.3	Confident	126 Å²	126	65.5 Å²	65.5	59%	0.589	35%	0.352	S	S	*	.	H	α-helix	trans	-63.9	-35.3	175.6	-74.6	172.1	10.2	0	0	114.2	T279 H280	T279-Q283 WeakPolarHBondContact O-CB 3.48Å; T279-Q283 WeakPolarHBondContact O-CG 3.49Å; T279-Q283 PolarHBondContact O-N 2.91Å; H280-Q283 PolarHBondContact CD2-OE1 2.99Å; H280-Q283 PolarHBondContact O-N 3.44Å
284	L	85.8	Confident	88.2	Confident	85 Å²	85	71 Å²	71	45%	0.445	36%	0.356	S	S	.	.	H	α-helix	trans	-91.4	-31.3	-176	-67.6	172.4	0	0	0	113.3	Y276 H280 Y281 N282	Y276-L284 HydrophobicContact CD1-CD1 3.81Å; Y276-L284 HydrophobicContact CE1-CD1 3.49Å; Y276-L284 VanDerWaalsContact CE1-CD1 3.49Å; H280-L284 WeakPolarHBondContact O-CB 3.43Å; H280-L284 VanDerWaalsContact O-CG 3.23Å; H280-L284 WeakPolarHBondContact O-CG 3.4Å; H280-L284 PolarHBondContact O-N 3.32Å; Y281-L284 PolarHBondContact O-N 3.46Å; N282-L284 PolarHBondContact O-N 3.08Å
285	F	86.6	Confident	87.9	Confident	77 Å²	77	68.9 Å²	68.9	34%	0.338	35%	0.345	S	S	.	.	H	α-helix	trans	-132.7	-5.3	-169.2	-48.7	-64	0	0	0	114	R271 Y276 Y281	R271-F285 HydrophobicContact CB-CD2 4.34Å; R271-F285 HydrophobicContact CB-CE2 3.84Å; R271-F285 HydrophobicContact CB-CZ 4.06Å; R271-F285 HydrophobicContact CG-CD1 4.24Å; R271-F285 HydrophobicContact CG-CD2 4.16Å; R271-F285 HydrophobicContact CG-CE1 3.91Å; R271-F285 HydrophobicContact CG-CE2 3.83Å; R271-F285 HydrophobicContact CG-CG 4.36Å; R271-F285 HydrophobicContact CG-CZ 3.7Å; Y276-F285 AromaticContact CD2-CE2 3.95Å; Y276-F285 HydrophobicContact CD2-CE2 3.95Å; Y276-F285 HydrophobicContact CE1-CE2 4.38Å; Y276-F285 AromaticContact CE2-CE2 3.72Å; Y276-F285 HydrophobicContact CE2-CE2 3.72Å; Y276-F285 HydrophobicContact CE2-CZ 4.09Å; Y276-F285 HydrophobicContact CG-CE2 4.37Å; Y276-F285 AromaticContact CZ-CE2 3.94Å; Y281-F285 AromaticContact CD2-CD2 3.62Å; Y281-F285 HydrophobicContact CD2-CD2 3.62Å; Y281-F285 HydrophobicContact CD2-CE2 4.2Å; Y281-F285 AromaticContact CE2-CD2 3.78Å; Y281-F285 HydrophobicContact CE2-CD2 3.78Å; Y281-F285 HydrophobicContact CE2-CE2 4.46Å; Y281-F285 HydrophobicContact CE2-CG 4.48Å; Y281-F285 HydrophobicContact CG-CD2 4.17Å; Y281-F285 WeakPolarHBondContact O-CA 3.43Å; Y281-F285 WeakPolarHBondContact O-CB 3.23Å; Y281-F285 WeakPolarHBondContact O-CD2 3.46Å; Y281-F285 PolarHBondContact O-N 3.16Å
286	G	82.8	Confident	87.5	Confident	22 Å²	22	69.3 Å²	69.3	23%	0.227	35%	0.347	C	S	.	.	S	Bend	trans	-75.9	155.2	177.1	0	0	0	0	0	112.1	N282 V288	N282-G286 WeakPolarHBondContact O-CA 3.29Å; N282-G286 PolarHBondContact O-N 3.24Å; G286-V288 PolarHBondContact O-N 2.93Å
287	D	84.3	Confident	86.9	Confident	91 Å²	91	76.7 Å²	76.7	49%	0.487	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.4	127.7	176.9	-71.9	-52	0	0	0	110.8	V295 I296 V300 A307	D287-V295 WeakPolarHBondContact O-CA 3.36Å; D287-I296 HydrophobicContact CB-CD1 4.05Å; D287-I296 WeakPolarHBondContact O-CG1 3.42Å; D287-I296 PolarHBondContact O-N 3.24Å; D287-V300 HydrophobicContact CB-CG1 4.35Å; D287-V300 HydrophobicContact CB-CG2 4.38Å; D287-A307 HydrophobicContact CB-CB 3.76Å
288	V	85.9	Confident	86.4	Confident	66 Å²	66	78.6 Å²	78.6	40%	0.4	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-92.5	126	178	-178.1	0	0	0	0	109.4	G286 F290	G286-V288 PolarHBondContact O-N 2.93Å; V288-F290 PolarHBondContact O-N 3.2Å
289	C	90	Very high	86.2	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-64.2	121.9	176.4	178.6	0	0	0	0	110.7	H291 C292 N293 R294 I296 A307 C309 C312	C289-H291 PolarHBondContact O-N 3.47Å; C289-H291 VanDerWaalsContact O-N 3.14Å; C289-C292 WeakPolarHBondContact CB-SG 3.38Å; C289-N293 VanDerWaalsContact O-CA 3.23Å; C289-N293 WeakPolarHBondContact O-CA 3.41Å; C289-N293 PolarHBondContact O-N 2.98Å; C289-R294 WeakPolarHBondContact CB-O 3.21Å; C289-R294 PolarHBondContact N-O 2.85Å; C289-I296 HydrophobicContact CB-CD1 4.2Å; C289-I296 HydrophobicContact CB-CG1 3.72Å; C289-A307 CarbonylContact C-O 3.57Å; C289-A307 WeakPolarHBondContact CA-O 3.12Å; C289-C309 WeakPolarHBondContact CB-SG 3.18Å; C289-C309 PolarHBondContact SG-N 3.24Å; C289-C309 VanDerWaalsContact SG-N 3.36Å; C289-C312 WeakPolarHBondContact SG-CB 3.45Å
290	F	88.5	Confident	86.2	Confident	85 Å²	85	78.4 Å²	78.4	37%	0.373	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.8	-179.4	-177.3	-117.6	0	0	0	114	V288 K306 A307 W308 K334	V288-F290 PolarHBondContact O-N 3.2Å; F290-K306 HydrophobicContact CB-CB 4.28Å; F290-K306 HydrophobicContact CB-CD 4.12Å; F290-K306 HydrophobicContact CD1-CD 3.68Å; F290-K306 HydrophobicContact CD2-CD 3.56Å; F290-K306 HydrophobicContact CE1-CD 3.87Å; F290-K306 HydrophobicContact CE2-CD 3.76Å; F290-K306 HydrophobicContact CG-CD 3.51Å; F290-K306 HydrophobicContact CZ-CD 3.9Å; F290-A307 PolarHBondContact N-O 3.22Å; F290-W308 HydrophobicContact CD1-CZ2 4.35Å; F290-W308 AromaticContact CD1-NE1 3.83Å; F290-K334 HydrophobicContact CE1-CG 4.04Å
291	H	87.9	Confident	86.3	Confident	125 Å²	125	77.5 Å²	77.5	58%	0.579	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-49.1	-178.7	-176.2	50	0	0	0	113.3	C289 C312	C289-H291 PolarHBondContact O-N 3.47Å; C289-H291 VanDerWaalsContact O-N 3.14Å; H291-C312 HydrophobicContact CB-CB 3.91Å
292	C	90.6	Very high	86.3	Confident	35 Å²	35	78.8 Å²	78.8	24%	0.236	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-4.1	-175.3	72.1	0	0	0	0	113.7	C289 R294	C289-C292 WeakPolarHBondContact CB-SG 3.38Å; C292-R294 PolarHBondContact O-N 3.02Å; C292-R294 VanDerWaalsContact O-N 3.15Å
293	N	85.9	Confident	86.3	Confident	135 Å²	135	77.1 Å²	77.1	72%	0.722	42%	0.415	S	S	*	.			trans	54.1	29.8	179.9	-151.4	33.7	0	0	0	114.2	C289	C289-N293 VanDerWaalsContact O-CA 3.23Å; C289-N293 WeakPolarHBondContact O-CA 3.41Å; C289-N293 PolarHBondContact O-N 2.98Å
294	R	85.1	Confident	86.4	Confident	174 Å²	174	72.4 Å²	72.4	66%	0.657	39%	0.394	S	S	*	.	S	Bend	trans	-114.2	152.3	175.1	-67.8	-179.8	-73.1	-174.8	-2.6	109.7	C289 C292 I296	C289-R294 WeakPolarHBondContact CB-O 3.21Å; C289-R294 PolarHBondContact N-O 2.85Å; C292-R294 PolarHBondContact O-N 3.02Å; C292-R294 VanDerWaalsContact O-N 3.15Å; R294-I296 PolarHBondContact O-N 3.32Å
295	V	85.3	Confident	86.3	Confident	36 Å²	36	76.5 Å²	76.5	22%	0.218	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-60.1	133.4	172	-174.7	0	0	0	0	109.1	N282 D287 E297	N282-V295 HydrophobicContact CB-CG1 3.95Å; N282-V295 VanDerWaalsContact O-CG1 3.32Å; N282-V295 WeakPolarHBondContact O-CG1 3.4Å; N282-V295 WeakPolarHBondContact O-CG2 3.23Å; D287-V295 WeakPolarHBondContact O-CA 3.36Å; V295-E297 PolarHBondContact O-N 3.29Å
296	I	86	Confident	86.3	Confident	14 Å²	14	75.9 Å²	75.9	7%	0.072	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-76.1	117.7	-178.5	-59.1	163.2	0	0	0	108.6	D287 C289 R294 V300 A307 W308	D287-I296 HydrophobicContact CB-CD1 4.05Å; D287-I296 WeakPolarHBondContact O-CG1 3.42Å; D287-I296 PolarHBondContact O-N 3.24Å; C289-I296 HydrophobicContact CB-CD1 4.2Å; C289-I296 HydrophobicContact CB-CG1 3.72Å; R294-I296 PolarHBondContact O-N 3.32Å; I296-V300 HydrophobicContact CB-CG2 4.14Å; I296-V300 HydrophobicContact CD1-CG1 3.94Å; I296-V300 HydrophobicContact CD1-CG2 4.26Å; I296-V300 HydrophobicContact CG2-CG2 3.84Å; I296-A307 HydrophobicContact CD1-CB 3.6Å; I296-W308 VanDerWaalsContact CD1-C 3.45Å
297	E	81.1	Confident	86.7	Confident	180 Å²	180	75.3 Å²	75.3	84%	0.841	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-90.9	123.7	169.2	-64.5	175.3	-172.7	0	0	108.7	V295	V295-E297 PolarHBondContact O-N 3.29Å
298	G	81.7	Confident	87	Confident	67 Å²	67	71.2 Å²	71.2	69%	0.691	38%	0.384	S	S	*	.	S	Bend	trans	87.5	-139	179.9	0	0	0	0	0	114	V300	G298-V300 PolarHBondContact O-N 3.08Å
299	D	85.7	Confident	87.3	Confident	131 Å²	131	69.3 Å²	69.3	70%	0.701	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-66.8	126.4	-173.7	-67.5	-33	0	0	0	112.4	V310	D299-V310 HydrophobicContact CB-CG2 3.64Å
300	V	88.2	Confident	87.3	Confident	55 Å²	55	72.8 Å²	72.8	33%	0.333	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.3	176.7	179.9	0	0	0	0	109.5	D287 I296 G298 A307	D287-V300 HydrophobicContact CB-CG1 4.35Å; D287-V300 HydrophobicContact CB-CG2 4.38Å; I296-V300 HydrophobicContact CB-CG2 4.14Å; I296-V300 HydrophobicContact CD1-CG1 3.94Å; I296-V300 HydrophobicContact CD1-CG2 4.26Å; I296-V300 HydrophobicContact CG2-CG2 3.84Å; G298-V300 PolarHBondContact O-N 3.08Å; V300-A307 HydrophobicContact CG1-CB 3.88Å
301	V	90.8	Very high	87.3	Confident	18 Å²	18	74.4 Å²	74.4	11%	0.109	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.6	166.8	-177.9	0	0	0	0	107.9	A307 W308 V310 F313 L324	V301-A307 WeakPolarHBondContact O-CA 3.22Å; V301-W308 HydrophobicContact CB-CB 4.45Å; V301-W308 PolarHBondContact N-O 2.96Å; V301-W308 PolarHBondContact O-N 3.45Å; V301-V310 HydrophobicContact CG2-CG2 4.26Å; V301-F313 HydrophobicContact CB-CB 4.39Å; V301-F313 HydrophobicContact CB-CG 4.44Å; V301-F313 HydrophobicContact CG1-CB 4.27Å; V301-F313 HydrophobicContact CG1-CD1 3.85Å; V301-F313 HydrophobicContact CG1-CD2 4.09Å; V301-F313 HydrophobicContact CG1-CE1 4.22Å; V301-F313 HydrophobicContact CG1-CE2 4.41Å; V301-F313 HydrophobicContact CG1-CG 3.81Å; V301-F313 HydrophobicContact CG1-CZ 4.49Å; V301-F313 HydrophobicContact CG2-CB 4.39Å; V301-L324 HydrophobicContact CG1-CD2 3.98Å; V301-L324 HydrophobicContact CG1-CG 4.08Å
302	S	90.1	Very high	87.4	Confident	81 Å²	81	69.5 Å²	69.5	57%	0.566	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	123.6	174.8	-54.1	0	0	0	0	110.5
303	A	87.4	Confident	87.6	Confident	17 Å²	17	67.8 Å²	67.8	14%	0.14	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	163.3	-178	0	0	0	0	0	108.4	N305 K306 W308 F313 L324 F328	A303-N305 PolarHBondContact O-N 3.32Å; A303-K306 PolarHBondContact N-O 3.21Å; A303-K306 PolarHBondContact O-N 2.97Å; A303-K306 VanDerWaalsContact O-O 3.05Å; A303-W308 VanDerWaalsContact C-CH2 3.49Å; A303-W308 VanDerWaalsContact C-CZ3 3.45Å; A303-W308 HydrophobicContact CB-CE3 4.33Å; A303-W308 HydrophobicContact CB-CH2 3.97Å; A303-W308 HydrophobicContact CB-CZ3 3.53Å; A303-W308 WeakPolarHBondContact O-CH2 3.3Å; A303-W308 WeakPolarHBondContact O-CZ3 3.41Å; A303-F313 HydrophobicContact CB-CE2 4.1Å; A303-F313 HydrophobicContact CB-CZ 4.24Å; A303-L324 HydrophobicContact CB-CD2 4.16Å; A303-F328 HydrophobicContact CB-CZ 4.32Å
304	L	85.5	Confident	87.9	Confident	27 Å²	27	62.4 Å²	62.4	14%	0.141	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	42.4	35.1	172.2	-34.8	174	0	0	0	115.7	K306 W308 F328 E330 P335	L304-K306 PolarHBondContact O-N 2.89Å; L304-W308 HydrophobicContact CB-CH2 3.87Å; L304-W308 HydrophobicContact CD1-CH2 4.21Å; L304-W308 HydrophobicContact CD1-CZ2 4.27Å; L304-W308 HydrophobicContact CG-CH2 4.06Å; L304-F328 HydrophobicContact CD2-CE2 4.16Å; L304-E330 HydrophobicContact CD1-CG 4.15Å; L304-E330 HydrophobicContact CD2-CB 3.73Å; L304-E330 HydrophobicContact CD2-CG 3.84Å; L304-E330 HydrophobicContact CG-CG 4.46Å; L304-P335 HydrophobicContact CD1-CB 4.41Å
305	N	82.8	Confident	88.3	Confident	171 Å²	171	54.1 Å²	54.1	91%	0.914	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	32.1	-173	-66.8	61.8	0	0	0	115.5	A303	A303-N305 PolarHBondContact O-N 3.32Å
306	K	87.1	Confident	88.6	Confident	63 Å²	63	54.9 Å²	54.9	27%	0.274	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	172.9	176.3	-58	175.2	-174.3	-60.3	0	110.6	F290 A303 L304 W308	F290-K306 HydrophobicContact CB-CB 4.28Å; F290-K306 HydrophobicContact CB-CD 4.12Å; F290-K306 HydrophobicContact CD1-CD 3.68Å; F290-K306 HydrophobicContact CD2-CD 3.56Å; F290-K306 HydrophobicContact CE1-CD 3.87Å; F290-K306 HydrophobicContact CE2-CD 3.76Å; F290-K306 HydrophobicContact CG-CD 3.51Å; F290-K306 HydrophobicContact CZ-CD 3.9Å; A303-K306 PolarHBondContact N-O 3.21Å; A303-K306 PolarHBondContact O-N 2.97Å; A303-K306 VanDerWaalsContact O-O 3.05Å; L304-K306 PolarHBondContact O-N 2.89Å; K306-W308 VanDerWaalsContact C-CZ3 3.43Å; K306-W308 HydrophobicContact CB-CH2 3.51Å; K306-W308 HydrophobicContact CB-CZ2 3.79Å; K306-W308 HydrophobicContact CB-CZ3 3.9Å; K306-W308 HydrophobicContact CD-CZ2 4.2Å; K306-W308 HydrophobicContact CG-CH2 4.43Å; K306-W308 WeakPolarHBondContact O-CZ3 3.44Å
307	A	90.6	Very high	88.8	Confident	10 Å²	10	57.3 Å²	57.3	8%	0.083	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.5	177.5	0	0	0	0	0	110.7	D287 C289 F290 I296 V300 V301	D287-A307 HydrophobicContact CB-CB 3.76Å; C289-A307 CarbonylContact C-O 3.57Å; C289-A307 WeakPolarHBondContact CA-O 3.12Å; F290-A307 PolarHBondContact N-O 3.22Å; I296-A307 HydrophobicContact CD1-CB 3.6Å; V300-A307 HydrophobicContact CG1-CB 3.88Å; V301-A307 WeakPolarHBondContact O-CA 3.22Å
308	W	91.8	Very high	89.3	Confident	6 Å²	6	51.1 Å²	51.1	2%	0.023	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.3	174.3	-60.6	-102.5	0	0	0	110.7	F290 I296 V301 A303 L304 K306 F313	F290-W308 HydrophobicContact CD1-CZ2 4.35Å; F290-W308 AromaticContact CD1-NE1 3.83Å; I296-W308 VanDerWaalsContact CD1-C 3.45Å; V301-W308 HydrophobicContact CB-CB 4.45Å; V301-W308 PolarHBondContact N-O 2.96Å; V301-W308 PolarHBondContact O-N 3.45Å; A303-W308 VanDerWaalsContact C-CH2 3.49Å; A303-W308 VanDerWaalsContact C-CZ3 3.45Å; A303-W308 HydrophobicContact CB-CE3 4.33Å; A303-W308 HydrophobicContact CB-CH2 3.97Å; A303-W308 HydrophobicContact CB-CZ3 3.53Å; A303-W308 WeakPolarHBondContact O-CH2 3.3Å; A303-W308 WeakPolarHBondContact O-CZ3 3.41Å; L304-W308 HydrophobicContact CB-CH2 3.87Å; L304-W308 HydrophobicContact CD1-CH2 4.21Å; L304-W308 HydrophobicContact CD1-CZ2 4.27Å; L304-W308 HydrophobicContact CG-CH2 4.06Å; K306-W308 VanDerWaalsContact C-CZ3 3.43Å; K306-W308 HydrophobicContact CB-CH2 3.51Å; K306-W308 HydrophobicContact CB-CZ2 3.79Å; K306-W308 HydrophobicContact CB-CZ3 3.9Å; K306-W308 HydrophobicContact CD-CZ2 4.2Å; K306-W308 HydrophobicContact CG-CH2 4.43Å; K306-W308 WeakPolarHBondContact O-CZ3 3.44Å; W308-F313 HydrophobicContact CB-CB 4.02Å; W308-F313 HydrophobicContact CB-CD2 4.23Å; W308-F313 AromaticContact CD2-CD2 3.82Å; W308-F313 HydrophobicContact CD2-CD2 3.82Å; W308-F313 HydrophobicContact CD2-CE2 4.31Å; W308-F313 HydrophobicContact CE3-CD2 4.03Å; W308-F313 HydrophobicContact CE3-CE2 4.26Å; W308-F313 HydrophobicContact CG-CB 4.47Å; W308-F313 AromaticContact CG-CD2 3.91Å; W308-F313 HydrophobicContact CG-CD2 3.91Å; W308-F313 HydrophobicContact CZ3-CE2 4.48Å
309	C	90.7	Very high	89.8	Confident	25 Å²	25	53.5 Å²	53.5	17%	0.169	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	147.2	162.4	-47.4	0	0	0	0	109.3	C289 N311 C312 F313	C289-C309 WeakPolarHBondContact CB-SG 3.18Å; C289-C309 PolarHBondContact SG-N 3.24Å; C289-C309 VanDerWaalsContact SG-N 3.36Å; C309-N311 PolarHBondContact O-N 3.31Å; C309-C312 HydrophobicContact CB-CB 3.94Å; C309-C312 WeakPolarHBondContact O-CA 3.35Å; C309-C312 PolarHBondContact O-N 2.76Å; C309-F313 PolarHBondContact O-N 3Å
310	V	89.7	Confident	90.1	Very high	74 Å²	74	51.2 Å²	51.2	45%	0.448	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-39.2	172.1	-178.8	0	0	0	0	112.1	D299 V301	D299-V310 HydrophobicContact CB-CG2 3.64Å; V301-V310 HydrophobicContact CG2-CG2 4.26Å
311	N	89.2	Confident	90.3	Very high	118 Å²	118	54.3 Å²	54.3	63%	0.631	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-21.7	-179.9	-78.3	-40.1	0	0	0	115.1	C309 K321	C309-N311 PolarHBondContact O-N 3.31Å; N311-K321 PolarHBondContact O-NZ 2.95Å; N311-K321 PolarHBondContact OD1-NZ 3.2Å
312	C	90.9	Very high	90.3	Very high	22 Å²	22	54 Å²	54	15%	0.149	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-16.4	-175.7	-74.3	0	0	0	0	113.1	C289 H291 C309 A314	C289-C312 WeakPolarHBondContact SG-CB 3.45Å; H291-C312 HydrophobicContact CB-CB 3.91Å; C309-C312 HydrophobicContact CB-CB 3.94Å; C309-C312 WeakPolarHBondContact O-CA 3.35Å; C309-C312 PolarHBondContact O-N 2.76Å; C312-A314 VanDerWaalsContact C-N 3.34Å; C312-A314 PolarHBondContact O-N 2.96Å
313	F	93.2	Very high	90.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.304	C	S	.	.			trans	-72.8	92.7	174.1	-167.6	-118.3	0	0	0	109	V301 A303 W308 C309 L322 F328 P335	V301-F313 HydrophobicContact CB-CB 4.39Å; V301-F313 HydrophobicContact CB-CG 4.44Å; V301-F313 HydrophobicContact CG1-CB 4.27Å; V301-F313 HydrophobicContact CG1-CD1 3.85Å; V301-F313 HydrophobicContact CG1-CD2 4.09Å; V301-F313 HydrophobicContact CG1-CE1 4.22Å; V301-F313 HydrophobicContact CG1-CE2 4.41Å; V301-F313 HydrophobicContact CG1-CG 3.81Å; V301-F313 HydrophobicContact CG1-CZ 4.49Å; V301-F313 HydrophobicContact CG2-CB 4.39Å; A303-F313 HydrophobicContact CB-CE2 4.1Å; A303-F313 HydrophobicContact CB-CZ 4.24Å; W308-F313 HydrophobicContact CB-CB 4.02Å; W308-F313 HydrophobicContact CB-CD2 4.23Å; W308-F313 AromaticContact CD2-CD2 3.82Å; W308-F313 HydrophobicContact CD2-CD2 3.82Å; W308-F313 HydrophobicContact CD2-CE2 4.31Å; W308-F313 HydrophobicContact CE3-CD2 4.03Å; W308-F313 HydrophobicContact CE3-CE2 4.26Å; W308-F313 HydrophobicContact CG-CB 4.47Å; W308-F313 AromaticContact CG-CD2 3.91Å; W308-F313 HydrophobicContact CG-CD2 3.91Å; W308-F313 HydrophobicContact CZ3-CE2 4.48Å; C309-F313 PolarHBondContact O-N 3Å; F313-L322 HydrophobicContact CD1-CB 3.63Å; F313-L322 WeakPolarHBondContact CD1-O 3.42Å; F313-L322 HydrophobicContact CE1-CB 3.61Å; F313-L322 HydrophobicContact CG-CB 4.46Å; F313-L322 HydrophobicContact CZ-CB 4.45Å; F313-L322 PolarHBondContact O-N 2.87Å; F313-F328 HydrophobicContact CE1-CD1 4.41Å; F313-F328 HydrophobicContact CE1-CE1 4.08Å; F313-F328 HydrophobicContact CZ-CD1 4.18Å; F313-F328 AromaticContact CZ-CE1 3.75Å; F313-F328 HydrophobicContact CZ-CE1 3.75Å; F313-F328 HydrophobicContact CZ-CE2 4.2Å; F313-F328 AromaticContact CZ-CZ 3.77Å; F313-F328 HydrophobicContact CZ-CZ 3.77Å; F313-P335 HydrophobicContact CD2-CG 4.13Å; F313-P335 HydrophobicContact CE2-CB 3.92Å; F313-P335 HydrophobicContact CE2-CG 3.71Å; F313-P335 HydrophobicContact CZ-CB 4.1Å; F313-P335 HydrophobicContact CZ-CG 4.33Å
314	A	93	Very high	90.4	Very high	21 Å²	21	57.9 Å²	57.9	17%	0.174	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-141.5	155.1	-175.1	0	0	0	0	0	110.6	C312 S316 T320	C312-A314 VanDerWaalsContact C-N 3.34Å; C312-A314 PolarHBondContact O-N 2.96Å; A314-S316 PolarHBondContact O-N 2.95Å; A314-T320 CarbonylContact C-O 3.48Å; A314-T320 VanDerWaalsContact CA-O 3.3Å; A314-T320 WeakPolarHBondContact CA-O 3.47Å
315	C	93.8	Very high	90.6	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.007	36%	0.36	C	S	.	.			trans	-60.5	125.8	178.7	179.3	0	0	0	0	110.8	T317 C318 N319 T320 L322 P335 C337	C315-T317 PolarHBondContact O-N 3.34Å; C315-T317 VanDerWaalsContact O-N 3.11Å; C315-T317 PolarHBondContact SG-OG1 3.36Å; C315-C318 VanDerWaalsContact CB-SG 3.52Å; C315-C318 PolarHBondContact O-N 3.45Å; C315-N319 VanDerWaalsContact O-CA 3.22Å; C315-N319 WeakPolarHBondContact O-CA 3.44Å; C315-N319 PolarHBondContact O-N 2.94Å; C315-T320 PolarHBondContact N-O 3Å; C315-L322 HydrophobicContact CB-CD1 4.07Å; C315-L322 HydrophobicContact CB-CG 4.38Å; C315-P335 CarbonylContact C-O 3.58Å; C315-P335 VanDerWaalsContact CA-O 3.31Å; C315-P335 WeakPolarHBondContact CA-O 3.4Å; C315-C337 HydrophobicContact CB-CB 4.03Å; C315-C337 PolarHBondContact SG-N 2.94Å
316	S	90.7	Very high	91	Very high	51 Å²	51	61.4 Å²	61.4	36%	0.357	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.9	-177.5	56.9	0	0	0	0	114.9	A314 P335 V336	A314-S316 PolarHBondContact O-N 2.95Å; S316-P335 PolarHBondContact N-O 2.94Å; S316-P335 PolarHBondContact OG-O 3.22Å; S316-V336 VanDerWaalsContact OG-CG2 3.29Å; S316-V336 WeakPolarHBondContact OG-CG2 3.49Å
317	T	90.1	Very high	91	Very high	65 Å²	65	66.6 Å²	66.6	40%	0.399	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-21.8	-177.1	52.4	0	0	0	0	114.1	C315 V336 C340 F344	C315-T317 PolarHBondContact O-N 3.34Å; C315-T317 VanDerWaalsContact O-N 3.11Å; C315-T317 PolarHBondContact SG-OG1 3.36Å; T317-V336 HydrophobicContact CG2-CG1 4.36Å; T317-V336 HydrophobicContact CG2-CG2 4.22Å; T317-C340 WeakPolarHBondContact OG1-CB 3.44Å; T317-C340 PolarHBondContact OG1-SG 2.56Å; T317-F344 HydrophobicContact CG2-CE1 4.07Å; T317-F344 HydrophobicContact CG2-CZ 4.15Å
318	C	93.3	Very high	91	Very high	50 Å²	50	68.7 Å²	68.7	34%	0.338	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	1.7	-179.8	70.9	0	0	0	0	114.6	C315 T320 C340	C315-C318 VanDerWaalsContact CB-SG 3.52Å; C315-C318 PolarHBondContact O-N 3.45Å; C318-T320 PolarHBondContact O-N 3.26Å; C318-T320 PolarHBondContact SG-OG1 3.44Å; C318-C340 VanDerWaalsContact CB-SG 3.59Å; C318-C340 VanDerWaalsContact SG-SG 3.6Å
319	N	90.9	Very high	90.9	Very high	117 Å²	117	70.5 Å²	70.5	63%	0.626	38%	0.376	S	S	*	.			trans	56.6	11.3	179.1	-62.8	69.7	0	0	0	115.2	C315 K321	C315-N319 VanDerWaalsContact O-CA 3.22Å; C315-N319 WeakPolarHBondContact O-CA 3.44Å; C315-N319 PolarHBondContact O-N 2.94Å; N319-K321 PolarHBondContact O-N 3.49Å
320	T	92.5	Very high	90.7	Very high	83 Å²	83	74 Å²	74	51%	0.509	39%	0.39	S	S	.	.			trans	-66.4	127.4	173.7	-53.5	0	0	0	0	109.4	A314 C315 C318 L322	A314-T320 CarbonylContact C-O 3.48Å; A314-T320 VanDerWaalsContact CA-O 3.3Å; A314-T320 WeakPolarHBondContact CA-O 3.47Å; C315-T320 PolarHBondContact N-O 3Å; C318-T320 PolarHBondContact O-N 3.26Å; C318-T320 PolarHBondContact SG-OG1 3.44Å; T320-L322 PolarHBondContact O-N 3.09Å
321	K	92.1	Very high	90.6	Very high	121 Å²	121	73.3 Å²	73.3	53%	0.526	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-55.5	134.1	176.3	-68.4	179.7	-177.7	-81.5	0	110.1	N311 N319	N311-K321 PolarHBondContact O-NZ 2.95Å; N311-K321 PolarHBondContact OD1-NZ 3.2Å; N319-K321 PolarHBondContact O-N 3.49Å
322	L	91.1	Very high	90.3	Very high	12 Å²	12	73.6 Å²	73.6	6%	0.063	38%	0.382	C	S	.	.			trans	-113	159.6	178	-64.3	176	0	0	0	109.1	F313 C315 T320 N326 F328 P335 C337	F313-L322 HydrophobicContact CD1-CB 3.63Å; F313-L322 WeakPolarHBondContact CD1-O 3.42Å; F313-L322 HydrophobicContact CE1-CB 3.61Å; F313-L322 HydrophobicContact CG-CB 4.46Å; F313-L322 HydrophobicContact CZ-CB 4.45Å; F313-L322 PolarHBondContact O-N 2.87Å; C315-L322 HydrophobicContact CB-CD1 4.07Å; C315-L322 HydrophobicContact CB-CG 4.38Å; T320-L322 PolarHBondContact O-N 3.09Å; L322-N326 HydrophobicContact CD2-CB 4.12Å; L322-F328 HydrophobicContact CD1-CB 4.12Å; L322-P335 HydrophobicContact CD1-CB 3.85Å; L322-P335 HydrophobicContact CD1-CG 4.26Å; L322-C337 HydrophobicContact CD2-CB 3.99Å
323	T	91.3	Very high	89.9	Confident	69 Å²	69	76.3 Å²	76.3	42%	0.423	39%	0.394	S	S	.	.			trans	-131.4	163.9	169	65.7	0	0	0	0	107.6	K325 N326	T323-K325 PolarHBondContact O-N 3.3Å; T323-K325 PolarHBondContact OG1-N 2.97Å; T323-N326 PolarHBondContact N-OD1 3.01Å; T323-N326 WeakPolarHBondContact O-CB 3.45Å; T323-N326 PolarHBondContact O-N 3.06Å; T323-N326 PolarHBondContact O-OD1 2.8Å; T323-N326 PolarHBondContact OG1-OD1 3.05Å
324	L	88.3	Confident	89.6	Confident	109 Å²	109	80.7 Å²	80.7	57%	0.571	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.3	174.3	-64.9	176.6	0	0	0	113.2	V301 A303	V301-L324 HydrophobicContact CG1-CD2 3.98Å; V301-L324 HydrophobicContact CG1-CG 4.08Å; A303-L324 HydrophobicContact CB-CD2 4.16Å
325	K	89.9	Confident	89.5	Confident	201 Å²	201	79.9 Å²	79.9	87%	0.874	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-19.8	173.7	-61.5	-176.7	179.3	179.6	0	113	T323	T323-K325 PolarHBondContact O-N 3.3Å; T323-K325 PolarHBondContact OG1-N 2.97Å
326	N	90.2	Very high	89.4	Confident	71 Å²	71	79.9 Å²	79.9	38%	0.38	41%	0.406	S	S	.	.	S	Bend	trans	-80.7	141.7	-179.8	-60.2	115.7	0	0	0	110.6	L322 T323 F328	L322-N326 HydrophobicContact CD2-CB 4.12Å; T323-N326 PolarHBondContact N-OD1 3.01Å; T323-N326 WeakPolarHBondContact O-CB 3.45Å; T323-N326 PolarHBondContact O-N 3.06Å; T323-N326 PolarHBondContact O-OD1 2.8Å; T323-N326 PolarHBondContact OG1-OD1 3.05Å; N326-F328 WeakPolarHBondContact O-CD1 3.33Å; N326-F328 PolarHBondContact O-N 3.1Å
327	K	88.9	Confident	89.6	Confident	173 Å²	173	78.2 Å²	78.2	75%	0.752	39%	0.394	S	S	*	.			trans	-75.2	112.7	169.4	-64.6	-170.2	178.5	-174.2	0	109.5	K338	K327-K338 PolarHBondContact O-N 3.35Å
328	F	90.5	Very high	89.6	Confident	54 Å²	54	80.6 Å²	80.6	24%	0.237	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	161.9	172.1	60.7	-91	0	0	0	109.7	A303 L304 F313 L322 N326 P335 V336	A303-F328 HydrophobicContact CB-CZ 4.32Å; L304-F328 HydrophobicContact CD2-CE2 4.16Å; F313-F328 HydrophobicContact CE1-CD1 4.41Å; F313-F328 HydrophobicContact CE1-CE1 4.08Å; F313-F328 HydrophobicContact CZ-CD1 4.18Å; F313-F328 AromaticContact CZ-CE1 3.75Å; F313-F328 HydrophobicContact CZ-CE1 3.75Å; F313-F328 HydrophobicContact CZ-CE2 4.2Å; F313-F328 AromaticContact CZ-CZ 3.77Å; F313-F328 HydrophobicContact CZ-CZ 3.77Å; L322-F328 HydrophobicContact CD1-CB 4.12Å; N326-F328 WeakPolarHBondContact O-CD1 3.33Å; N326-F328 PolarHBondContact O-N 3.1Å; F328-P335 HydrophobicContact CB-CB 4.45Å; F328-P335 HydrophobicContact CD2-CB 3.84Å; F328-P335 HydrophobicContact CE2-CB 4.4Å; F328-P335 HydrophobicContact CG-CB 4.22Å; F328-V336 CarbonylContact C-O 3.5Å; F328-V336 WeakPolarHBondContact CA-O 3.34Å; F328-V336 WeakPolarHBondContact CB-O 3.44Å
329	V	88.7	Confident	89.5	Confident	43 Å²	43	86.2 Å²	86.2	26%	0.261	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.7	173	-59.6	0	0	0	0	109.3	V336 Y341	V329-V336 HydrophobicContact CG2-CB 3.84Å; V329-V336 HydrophobicContact CG2-CG1 4.34Å; V329-V336 PolarHBondContact N-O 3.3Å; V329-V336 PolarHBondContact O-N 3.24Å; V329-Y341 HydrophobicContact CB-CD2 4.44Å; V329-Y341 HydrophobicContact CG1-CD1 4.18Å; V329-Y341 HydrophobicContact CG1-CD2 4.44Å; V329-Y341 HydrophobicContact CG1-CE1 4.49Å; V329-Y341 HydrophobicContact CG1-CG 4.13Å; V329-Y341 HydrophobicContact CG2-CD2 3.49Å; V329-Y341 VanDerWaalsContact CG2-CD2 3.49Å; V329-Y341 HydrophobicContact CG2-CE2 4.13Å; V329-Y341 HydrophobicContact CG2-CG 3.69Å
330	E	87.4	Confident	89.6	Confident	99 Å²	99	81.3 Å²	81.3	46%	0.463	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	125.5	169.4	-173.2	177.4	163	0	0	109.8	L304	L304-E330 HydrophobicContact CD1-CG 4.15Å; L304-E330 HydrophobicContact CD2-CB 3.73Å; L304-E330 HydrophobicContact CD2-CG 3.84Å; L304-E330 HydrophobicContact CG-CG 4.46Å
331	F	86.4	Confident	89.5	Confident	60 Å²	60	80 Å²	80	26%	0.263	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	119.3	169.1	-179.3	-108.9	0	0	0	108.7	M333 K334 V336 F344 L348 L352	F331-M333 VanDerWaalsContact C-N 3.31Å; F331-M333 PolarHBondContact O-N 3.47Å; F331-K334 PolarHBondContact N-O 2.84Å; F331-K334 PolarHBondContact O-N 2.77Å; F331-K334 VanDerWaalsContact O-O 3.12Å; F331-V336 HydrophobicContact CB-CG2 3.71Å; F331-V336 HydrophobicContact CD1-CG2 4.42Å; F331-V336 HydrophobicContact CG-CG2 4.48Å; F331-F344 HydrophobicContact CB-CE2 4.5Å; F331-F344 AromaticContact CD1-CE2 3.88Å; F331-F344 HydrophobicContact CD1-CE2 3.88Å; F331-F344 AromaticContact CD1-CZ 3.99Å; F331-F344 HydrophobicContact CD1-CZ 3.99Å; F331-F344 AromaticContact CD2-CE2 3.89Å; F331-F344 HydrophobicContact CD2-CE2 3.89Å; F331-F344 HydrophobicContact CE1-CE2 4Å; F331-F344 HydrophobicContact CE1-CZ 4.17Å; F331-F344 HydrophobicContact CE2-CE2 4.01Å; F331-F344 AromaticContact CG-CE2 3.81Å; F331-F344 HydrophobicContact CG-CE2 3.81Å; F331-F344 HydrophobicContact CG-CZ 4.3Å; F331-F344 HydrophobicContact CZ-CE2 4.07Å; F331-L348 HydrophobicContact CE2-CD1 4.2Å; F331-L348 HydrophobicContact CE2-CD2 4.22Å; F331-L348 HydrophobicContact CE2-CG 4.47Å; F331-L348 HydrophobicContact CZ-CD2 4.18Å; F331-L352 HydrophobicContact CD2-CD1 3.52Å; F331-L352 HydrophobicContact CD2-CD2 3.64Å; F331-L352 HydrophobicContact CD2-CG 4.19Å; F331-L352 HydrophobicContact CE2-CD1 3.8Å; F331-L352 HydrophobicContact CE2-CD2 3.85Å; F331-L352 HydrophobicContact CE2-CG 4.3Å
332	D	84	Confident	89.4	Confident	124 Å²	124	79.1 Å²	79.1	66%	0.663	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	48.1	-179.1	-163.6	32.9	0	0	0	112.5	K334	D332-K334 PolarHBondContact O-N 2.91Å; D332-K334 VanDerWaalsContact O-N 3.08Å
333	M	81.8	Confident	89.4	Confident	78 Å²	78	86.9 Å²	86.9	38%	0.384	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	18.4	-177.1	-53.3	-63.9	-59.9	0	0	115.1	F331	F331-M333 VanDerWaalsContact C-N 3.31Å; F331-M333 PolarHBondContact O-N 3.47Å
334	K	86.6	Confident	89.3	Confident	93 Å²	93	85 Å²	85	40%	0.404	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148.3	179.8	-67.5	170.9	-175.7	165.5	0	111.4	F290 F331 D332	F290-K334 HydrophobicContact CE1-CG 4.04Å; F331-K334 PolarHBondContact N-O 2.84Å; F331-K334 PolarHBondContact O-N 2.77Å; F331-K334 VanDerWaalsContact O-O 3.12Å; D332-K334 PolarHBondContact O-N 2.91Å; D332-K334 VanDerWaalsContact O-N 3.08Å
335	P	91.3	Very high	89.4	Confident	4 Å²	4	83.8 Å²	83.8	3%	0.026	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.8	179.8	31.8	-35	0	0	0	111.2	L304 F313 C315 S316 L322 F328	L304-P335 HydrophobicContact CD1-CB 4.41Å; F313-P335 HydrophobicContact CD2-CG 4.13Å; F313-P335 HydrophobicContact CE2-CB 3.92Å; F313-P335 HydrophobicContact CE2-CG 3.71Å; F313-P335 HydrophobicContact CZ-CB 4.1Å; F313-P335 HydrophobicContact CZ-CG 4.33Å; C315-P335 CarbonylContact C-O 3.58Å; C315-P335 VanDerWaalsContact CA-O 3.31Å; C315-P335 WeakPolarHBondContact CA-O 3.4Å; S316-P335 PolarHBondContact N-O 2.94Å; S316-P335 PolarHBondContact OG-O 3.22Å; L322-P335 HydrophobicContact CD1-CB 3.85Å; L322-P335 HydrophobicContact CD1-CG 4.26Å; F328-P335 HydrophobicContact CB-CB 4.45Å; F328-P335 HydrophobicContact CD2-CB 3.84Å; F328-P335 HydrophobicContact CE2-CB 4.4Å; F328-P335 HydrophobicContact CG-CB 4.22Å
336	V	91.7	Very high	89.3	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.4	173.2	177.8	0	0	0	0	109.2	S316 T317 F328 V329 F331 C340 F344	S316-V336 VanDerWaalsContact OG-CG2 3.29Å; S316-V336 WeakPolarHBondContact OG-CG2 3.49Å; T317-V336 HydrophobicContact CG2-CG1 4.36Å; T317-V336 HydrophobicContact CG2-CG2 4.22Å; F328-V336 CarbonylContact C-O 3.5Å; F328-V336 WeakPolarHBondContact CA-O 3.34Å; F328-V336 WeakPolarHBondContact CB-O 3.44Å; V329-V336 HydrophobicContact CG2-CB 3.84Å; V329-V336 HydrophobicContact CG2-CG1 4.34Å; V329-V336 PolarHBondContact N-O 3.3Å; V329-V336 PolarHBondContact O-N 3.24Å; F331-V336 HydrophobicContact CB-CG2 3.71Å; F331-V336 HydrophobicContact CD1-CG2 4.42Å; F331-V336 HydrophobicContact CG-CG2 4.48Å; V336-C340 HydrophobicContact CG1-CB 3.68Å; V336-F344 HydrophobicContact CG1-CE1 4.42Å; V336-F344 HydrophobicContact CG1-CZ 4.25Å; V336-F344 HydrophobicContact CG2-CZ 4.43Å
337	C	93.7	Very high	89.2	Confident	17 Å²	17	81.3 Å²	81.3	12%	0.115	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	150.8	178.5	78.2	0	0	0	0	110.9	C315 L322 K339 C340 Y341	C315-C337 HydrophobicContact CB-CB 4.03Å; C315-C337 PolarHBondContact SG-N 2.94Å; L322-C337 HydrophobicContact CD2-CB 3.99Å; C337-K339 PolarHBondContact O-N 2.97Å; C337-K339 VanDerWaalsContact O-N 3.15Å; C337-C340 PolarHBondContact O-N 2.84Å; C337-C340 PolarHBondContact SG-N 3.15Å; C337-C340 VanDerWaalsContact SG-N 3.39Å; C337-Y341 PolarHBondContact O-N 3.19Å
338	K	90.9	Very high	89.2	Confident	115 Å²	115	75.8 Å²	75.8	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-51	-42.2	179.8	-165.9	-171.9	-178.9	-151.1	0	113.3	K327 C340 Y341 E342	K327-K338 PolarHBondContact O-N 3.35Å; K338-C340 VanDerWaalsContact C-N 3.3Å; K338-C340 PolarHBondContact O-N 2.9Å; K338-Y341 PolarHBondContact O-N 2.92Å; K338-E342 WeakPolarHBondContact CE-OE1 3.46Å; K338-E342 IonicContact NZ-OE1 2.9Å; K338-E342 PolarHBondContact NZ-OE1 2.95Å; K338-E342 WeakPolarHBondContact O-CG 3.31Å; K338-E342 PolarHBondContact O-N 2.71Å
339	K	91.7	Very high	89	Confident	167 Å²	167	75.6 Å²	75.6	73%	0.726	36%	0.364	S	S	*	.	H	α-helix	trans	-61	-36.4	178.9	-66.4	-176.4	-179	-179.6	0	112.9	C337 K343	C337-K339 PolarHBondContact O-N 2.97Å; C337-K339 VanDerWaalsContact O-N 3.15Å; K339-K343 WeakPolarHBondContact O-CG 2.96Å
340	C	92.5	Very high	88.9	Confident	15 Å²	15	80 Å²	80	10%	0.101	38%	0.379	C	S	.	.	H	α-helix	trans	-78.6	-37.5	176.3	-76.5	0	0	0	0	111.9	T317 C318 V336 C337 K338 E342 K343 F344	T317-C340 WeakPolarHBondContact OG1-CB 3.44Å; T317-C340 PolarHBondContact OG1-SG 2.56Å; C318-C340 VanDerWaalsContact CB-SG 3.59Å; C318-C340 VanDerWaalsContact SG-SG 3.6Å; V336-C340 HydrophobicContact CG1-CB 3.68Å; C337-C340 PolarHBondContact O-N 2.84Å; C337-C340 PolarHBondContact SG-N 3.15Å; C337-C340 VanDerWaalsContact SG-N 3.39Å; K338-C340 VanDerWaalsContact C-N 3.3Å; K338-C340 PolarHBondContact O-N 2.9Å; C340-E342 VanDerWaalsContact C-N 3.29Å; C340-E342 PolarHBondContact O-N 3.22Å; C340-K343 WeakPolarHBondContact O-CB 3.42Å; C340-K343 PolarHBondContact O-N 3.07Å; C340-K343 VanDerWaalsContact O-N 3.15Å; C340-F344 VanDerWaalsContact O-CD1 3.25Å; C340-F344 WeakPolarHBondContact O-CD1 3.45Å
341	Y	90.1	Very high	88.9	Confident	55 Å²	55	82.4 Å²	82.4	22%	0.216	39%	0.385	C	S	.	.	H	α-helix	trans	-61.3	-39.1	174.6	-177.7	-110	0	0	0	112	V329 C337 K338 K343 F344 K349 L352	V329-Y341 HydrophobicContact CB-CD2 4.44Å; V329-Y341 HydrophobicContact CG1-CD1 4.18Å; V329-Y341 HydrophobicContact CG1-CD2 4.44Å; V329-Y341 HydrophobicContact CG1-CE1 4.49Å; V329-Y341 HydrophobicContact CG1-CG 4.13Å; V329-Y341 HydrophobicContact CG2-CD2 3.49Å; V329-Y341 VanDerWaalsContact CG2-CD2 3.49Å; V329-Y341 HydrophobicContact CG2-CE2 4.13Å; V329-Y341 HydrophobicContact CG2-CG 3.69Å; C337-Y341 PolarHBondContact O-N 3.19Å; K338-Y341 PolarHBondContact O-N 2.92Å; Y341-K343 PolarHBondContact O-N 3.19Å; Y341-F344 HydrophobicContact CD2-CD2 4.16Å; Y341-F344 WeakPolarHBondContact O-CB 3.48Å; Y341-F344 PolarHBondContact O-N 3.08Å; Y341-K349 HydrophobicContact CE1-CD 4.21Å; Y341-K349 HydrophobicContact CE1-CG 4.42Å; Y341-K349 HydrophobicContact CE2-CG 4.09Å; Y341-L352 HydrophobicContact CE2-CD1 3.97Å
342	E	89.8	Confident	88.8	Confident	103 Å²	103	81.1 Å²	81.1	48%	0.481	38%	0.38	S	S	.	.	H	α-helix	trans	-59	-33.4	176.4	-76.7	168.6	-172.7	0	0	112.3	K338 C340 F344 K349	K338-E342 WeakPolarHBondContact CE-OE1 3.46Å; K338-E342 IonicContact NZ-OE1 2.9Å; K338-E342 PolarHBondContact NZ-OE1 2.95Å; K338-E342 WeakPolarHBondContact O-CG 3.31Å; K338-E342 PolarHBondContact O-N 2.71Å; C340-E342 VanDerWaalsContact C-N 3.29Å; C340-E342 PolarHBondContact O-N 3.22Å; E342-F344 VanDerWaalsContact C-N 3.3Å; E342-F344 PolarHBondContact O-N 2.87Å; E342-K349 PolarHBondContact O-NZ 2.9Å
343	K	91	Very high	88.7	Confident	175 Å²	175	81.7 Å²	81.7	76%	0.761	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.1	177.1	-63.7	178	-177.7	-174.6	0	114.4	K339 C340 Y341	K339-K343 WeakPolarHBondContact O-CG 2.96Å; C340-K343 WeakPolarHBondContact O-CB 3.42Å; C340-K343 PolarHBondContact O-N 3.07Å; C340-K343 VanDerWaalsContact O-N 3.15Å; Y341-K343 PolarHBondContact O-N 3.19Å
344	F	89.5	Confident	88.8	Confident	28 Å²	28	85 Å²	85	12%	0.123	39%	0.389	C	S	.	.	S	Bend	trans	-67.3	145.5	178.8	-80.8	19.6	0	0	0	111.2	T317 F331 V336 C340 Y341 E342 L348 K349 L352	T317-F344 HydrophobicContact CG2-CE1 4.07Å; T317-F344 HydrophobicContact CG2-CZ 4.15Å; F331-F344 HydrophobicContact CB-CE2 4.5Å; F331-F344 AromaticContact CD1-CE2 3.88Å; F331-F344 HydrophobicContact CD1-CE2 3.88Å; F331-F344 AromaticContact CD1-CZ 3.99Å; F331-F344 HydrophobicContact CD1-CZ 3.99Å; F331-F344 AromaticContact CD2-CE2 3.89Å; F331-F344 HydrophobicContact CD2-CE2 3.89Å; F331-F344 HydrophobicContact CE1-CE2 4Å; F331-F344 HydrophobicContact CE1-CZ 4.17Å; F331-F344 HydrophobicContact CE2-CE2 4.01Å; F331-F344 AromaticContact CG-CE2 3.81Å; F331-F344 HydrophobicContact CG-CE2 3.81Å; F331-F344 HydrophobicContact CG-CZ 4.3Å; F331-F344 HydrophobicContact CZ-CE2 4.07Å; V336-F344 HydrophobicContact CG1-CE1 4.42Å; V336-F344 HydrophobicContact CG1-CZ 4.25Å; V336-F344 HydrophobicContact CG2-CZ 4.43Å; C340-F344 VanDerWaalsContact O-CD1 3.25Å; C340-F344 WeakPolarHBondContact O-CD1 3.45Å; Y341-F344 HydrophobicContact CD2-CD2 4.16Å; Y341-F344 WeakPolarHBondContact O-CB 3.48Å; Y341-F344 PolarHBondContact O-N 3.08Å; E342-F344 VanDerWaalsContact C-N 3.3Å; E342-F344 PolarHBondContact O-N 2.87Å; F344-L348 HydrophobicContact CB-CD2 4.41Å; F344-L348 HydrophobicContact CD2-CD2 3.54Å; F344-L348 HydrophobicContact CD2-CG 4.19Å; F344-L348 HydrophobicContact CE2-CD2 3.98Å; F344-L348 HydrophobicContact CG-CD2 4.14Å; F344-K349 HydrophobicContact CB-CD 4.24Å; F344-K349 HydrophobicContact CB-CG 3.83Å; F344-K349 WeakPolarHBondContact O-CE 3.39Å; F344-K349 PolarHBondContact O-NZ 3.26Å; F344-L352 HydrophobicContact CD2-CD1 4.24Å; F344-L352 HydrophobicContact CE2-CD1 4.46Å
345	P	91.2	Very high	88.5	Confident	84 Å²	84	85.2 Å²	85.2	55%	0.545	39%	0.394	S	S	.	.			trans	-52.1	140.5	173.6	-26.7	34.8	0	0	0	111.9	E347 L348 K349	P345-E347 PolarHBondContact O-N 2.99Å; P345-L348 HydrophobicContact CB-CB 4.36Å; P345-L348 WeakPolarHBondContact O-CB 3.39Å; P345-L348 PolarHBondContact O-N 3.44Å; P345-K349 PolarHBondContact O-N 2.97Å
346	L	87.3	Confident	87.7	Confident	117 Å²	117	88.1 Å²	88.1	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-57.7	-38.6	-176	-164.1	75.6	0	0	0	112.2	K349 K350	L346-K349 PolarHBondContact O-N 3.16Å; L346-K350 WeakPolarHBondContact O-CG 3.23Å; L346-K350 PolarHBondContact O-N 3.32Å
347	E	88.2	Confident	87	Confident	104 Å²	104	93 Å²	93	49%	0.486	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-43.2	175.8	179.7	57.3	-159.1	0	0	112	P345 K350 R351	P345-E347 PolarHBondContact O-N 2.99Å; E347-K350 PolarHBondContact O-N 3.34Å; E347-R351 WeakPolarHBondContact O-CG 3.44Å; E347-R351 PolarHBondContact O-N 2.96Å; E347-R351 VanDerWaalsContact O-N 3.11Å; E347-R351 IonicContact OE1-CZ 2.85Å; E347-R351 VanDerWaalsContact OE1-CZ 3.31Å; E347-R351 IonicContact OE1-NE 2.89Å; E347-R351 PolarHBondContact OE1-NE 3.44Å; E347-R351 IonicContact OE1-NH2 3.45Å; E347-R351 PolarHBondContact OE1-NH2 3.04Å
348	L	88.3	Confident	86.1	Confident	56 Å²	56	96.1 Å²	96.1	29%	0.293	46%	0.459	S	S	.	.	H	α-helix	trans	-66.5	-43.5	177.7	-177.3	61	0	0	0	111.4	F331 F344 P345 K350 R351 L352	F331-L348 HydrophobicContact CE2-CD1 4.2Å; F331-L348 HydrophobicContact CE2-CD2 4.22Å; F331-L348 HydrophobicContact CE2-CG 4.47Å; F331-L348 HydrophobicContact CZ-CD2 4.18Å; F344-L348 HydrophobicContact CB-CD2 4.41Å; F344-L348 HydrophobicContact CD2-CD2 3.54Å; F344-L348 HydrophobicContact CD2-CG 4.19Å; F344-L348 HydrophobicContact CE2-CD2 3.98Å; F344-L348 HydrophobicContact CG-CD2 4.14Å; P345-L348 HydrophobicContact CB-CB 4.36Å; P345-L348 WeakPolarHBondContact O-CB 3.39Å; P345-L348 PolarHBondContact O-N 3.44Å; L348-K350 VanDerWaalsContact C-N 3.33Å; L348-K350 PolarHBondContact O-N 3.12Å; L348-R351 PolarHBondContact O-N 2.83Å; L348-L352 HydrophobicContact CD1-CG 4.47Å; L348-L352 HydrophobicContact CG-CD1 4.15Å; L348-L352 WeakPolarHBondContact O-CG 3.44Å; L348-L352 PolarHBondContact O-N 2.91Å
349	K	87.2	Confident	84.9	Confident	51 Å²	51	96.8 Å²	96.8	22%	0.222	47%	0.468	C	S	.	.	H	α-helix	trans	-60.6	-40.8	176.6	-69.9	-173.7	-70.9	-158.6	0	112.1	Y341 E342 F344 P345 L346 L352 K353	Y341-K349 HydrophobicContact CE1-CD 4.21Å; Y341-K349 HydrophobicContact CE1-CG 4.42Å; Y341-K349 HydrophobicContact CE2-CG 4.09Å; E342-K349 PolarHBondContact O-NZ 2.9Å; F344-K349 HydrophobicContact CB-CD 4.24Å; F344-K349 HydrophobicContact CB-CG 3.83Å; F344-K349 WeakPolarHBondContact O-CE 3.39Å; F344-K349 PolarHBondContact O-NZ 3.26Å; P345-K349 PolarHBondContact O-N 2.97Å; L346-K349 PolarHBondContact O-N 3.16Å; K349-L352 PolarHBondContact O-N 2.78Å; K349-K353 PolarHBondContact O-N 3.15Å
350	K	86.4	Confident	83.4	Confident	134 Å²	134	92 Å²	92	58%	0.583	47%	0.466	S	S	*	.	H	α-helix	trans	-61.2	-44.8	174.7	-76.5	-178.1	180	-179.4	0	111.9	L346 E347 L348 K353 K354	L346-K350 WeakPolarHBondContact O-CG 3.23Å; L346-K350 PolarHBondContact O-N 3.32Å; E347-K350 PolarHBondContact O-N 3.34Å; L348-K350 VanDerWaalsContact C-N 3.33Å; L348-K350 PolarHBondContact O-N 3.12Å; K350-K353 PolarHBondContact O-N 3.44Å; K350-K354 PolarHBondContact O-N 3.47Å; K350-K354 VanDerWaalsContact O-N 3.08Å
351	R	87	Confident	81.6	Confident	151 Å²	151	102.1 Å²	102.1	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-62.5	-43.8	176.8	-69.8	178.5	-169.3	-175.1	2	112.3	E347 L348 K354 L355	E347-R351 WeakPolarHBondContact O-CG 3.44Å; E347-R351 PolarHBondContact O-N 2.96Å; E347-R351 VanDerWaalsContact O-N 3.11Å; E347-R351 IonicContact OE1-CZ 2.85Å; E347-R351 VanDerWaalsContact OE1-CZ 3.31Å; E347-R351 IonicContact OE1-NE 2.89Å; E347-R351 PolarHBondContact OE1-NE 3.44Å; E347-R351 IonicContact OE1-NH2 3.45Å; E347-R351 PolarHBondContact OE1-NH2 3.04Å; L348-R351 PolarHBondContact O-N 2.83Å; R351-K354 PolarHBondContact O-N 3.04Å; R351-L355 WeakPolarHBondContact O-CG 3.29Å; R351-L355 PolarHBondContact O-N 3.4Å
352	L	84.6	Confident	79.4	Confident	32 Å²	32	111.2 Å²	111.2	17%	0.168	54%	0.543	C	S	.	.	H	α-helix	trans	-64.9	-39.5	178.1	-69.7	171	0	0	0	112.6	F331 Y341 F344 L348 K349 L355 A356	F331-L352 HydrophobicContact CD2-CD1 3.52Å; F331-L352 HydrophobicContact CD2-CD2 3.64Å; F331-L352 HydrophobicContact CD2-CG 4.19Å; F331-L352 HydrophobicContact CE2-CD1 3.8Å; F331-L352 HydrophobicContact CE2-CD2 3.85Å; F331-L352 HydrophobicContact CE2-CG 4.3Å; Y341-L352 HydrophobicContact CE2-CD1 3.97Å; F344-L352 HydrophobicContact CD2-CD1 4.24Å; F344-L352 HydrophobicContact CE2-CD1 4.46Å; L348-L352 HydrophobicContact CD1-CG 4.47Å; L348-L352 HydrophobicContact CG-CD1 4.15Å; L348-L352 WeakPolarHBondContact O-CG 3.44Å; L348-L352 PolarHBondContact O-N 2.91Å; K349-L352 PolarHBondContact O-N 2.78Å; L352-L355 HydrophobicContact CD2-CD1 4.41Å; L352-L355 PolarHBondContact O-N 3.45Å; L352-A356 PolarHBondContact O-N 2.98Å
353	K	82.7	Confident	78.9	Confident	136 Å²	136	111.7 Å²	111.7	59%	0.591	55%	0.546	S	S	*	.	H	α-helix	trans	-62.3	-44.3	174.8	-169.4	-179.6	178.6	-172.4	0	111.3	K349 K350 L355 A356 E357	K349-K353 PolarHBondContact O-N 3.15Å; K350-K353 PolarHBondContact O-N 3.44Å; K353-L355 VanDerWaalsContact C-N 3.32Å; K353-L355 PolarHBondContact O-N 3.47Å; K353-A356 PolarHBondContact O-N 3.35Å; K353-E357 VanDerWaalsContact CE-OE1 3.27Å; K353-E357 WeakPolarHBondContact CE-OE1 3.14Å; K353-E357 VanDerWaalsContact O-CG 3.31Å; K353-E357 WeakPolarHBondContact O-CG 3.38Å; K353-E357 PolarHBondContact O-N 3.28Å
354	K	83.8	Confident	78.2	Confident	149 Å²	149	108.3 Å²	108.3	65%	0.648	53%	0.534	S	S	*	.	H	α-helix	trans	-60.8	-40.4	174.9	-168.7	178.7	-179.3	-179	0	111.9	K350 R351 E357 T358	K350-K354 PolarHBondContact O-N 3.47Å; K350-K354 VanDerWaalsContact O-N 3.08Å; R351-K354 PolarHBondContact O-N 3.04Å; K354-E357 PolarHBondContact O-N 3.11Å; K354-T358 WeakPolarHBondContact O-CG2 3.4Å; K354-T358 PolarHBondContact O-N 3.2Å; K354-T358 VanDerWaalsContact O-N 3.07Å; K354-T358 PolarHBondContact O-OG1 3.45Å
355	L	79.1	Confident	77.6	Confident	97 Å²	97	112.8 Å²	112.8	51%	0.508	56%	0.557	S	S	.	*	H	α-helix	trans	-64.6	-45.1	175.6	-78.2	165.1	0	0	0	112.4	R351 L352 K353 E357 T358 L359	R351-L355 WeakPolarHBondContact O-CG 3.29Å; R351-L355 PolarHBondContact O-N 3.4Å; L352-L355 HydrophobicContact CD2-CD1 4.41Å; L352-L355 PolarHBondContact O-N 3.45Å; K353-L355 VanDerWaalsContact C-N 3.32Å; K353-L355 PolarHBondContact O-N 3.47Å; L355-E357 VanDerWaalsContact C-N 3.34Å; L355-E357 PolarHBondContact O-N 3.43Å; L355-T358 WeakPolarHBondContact CA-OG1 3.46Å; L355-T358 PolarHBondContact O-N 3.12Å; L355-T358 PolarHBondContact O-OG1 2.83Å; L355-L359 PolarHBondContact O-N 3.31Å
356	A	75.5	Confident	76.8	Confident	64 Å²	64	114.5 Å²	114.5	53%	0.529	56%	0.558	S	S	.	*	H	α-helix	trans	-62.9	-39.8	176.8	0	0	0	0	0	112.1	L352 K353 T358 L359 G360	L352-A356 PolarHBondContact O-N 2.98Å; K353-A356 PolarHBondContact O-N 3.35Å; A356-T358 VanDerWaalsContact C-N 3.33Å; A356-T358 PolarHBondContact O-N 3.08Å; A356-L359 PolarHBondContact O-N 2.68Å; A356-G360 PolarHBondContact O-N 3.22Å
357	E	76.4	Confident	76.1	Confident	104 Å²	104	114.3 Å²	114.3	49%	0.486	55%	0.554	S	S	.	*	H	α-helix	trans	-64.6	-35.1	174.8	-72.8	168	-177.1	0	0	112.4	K353 K354 L355	K353-E357 VanDerWaalsContact CE-OE1 3.27Å; K353-E357 WeakPolarHBondContact CE-OE1 3.14Å; K353-E357 VanDerWaalsContact O-CG 3.31Å; K353-E357 WeakPolarHBondContact O-CG 3.38Å; K353-E357 PolarHBondContact O-N 3.28Å; K354-E357 PolarHBondContact O-N 3.11Å; L355-E357 VanDerWaalsContact C-N 3.34Å; L355-E357 PolarHBondContact O-N 3.43Å
358	T	74.3	Confident	75.3	Confident	81 Å²	81	115 Å²	115	50%	0.497	56%	0.559	S	S	.	*	H	α-helix	trans	-74	-33.1	174.9	48.1	0	0	0	0	113.7	K354 L355 A356	K354-T358 WeakPolarHBondContact O-CG2 3.4Å; K354-T358 PolarHBondContact O-N 3.2Å; K354-T358 VanDerWaalsContact O-N 3.07Å; K354-T358 PolarHBondContact O-OG1 3.45Å; L355-T358 WeakPolarHBondContact CA-OG1 3.46Å; L355-T358 PolarHBondContact O-N 3.12Å; L355-T358 PolarHBondContact O-OG1 2.83Å; A356-T358 VanDerWaalsContact C-N 3.33Å; A356-T358 PolarHBondContact O-N 3.08Å
359	L	66	Low	74.4	Confident	130 Å²	130	119.2 Å²	119.2	68%	0.681	58%	0.578	S	S	*	*	H	α-helix	trans	-75.2	-30.5	177.6	-77.2	161.7	0	0	0	112.4	L355 A356 R361	L355-L359 PolarHBondContact O-N 3.31Å; A356-L359 PolarHBondContact O-N 2.68Å; L359-R361 VanDerWaalsContact C-N 3.27Å; L359-R361 PolarHBondContact O-N 3.06Å
360	G	59.6	Low	73.4	Confident	66 Å²	66	124.5 Å²	124.5	68%	0.68	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	0.6	176.4	0	0	0	0	0	115.4	A356	A356-G360 PolarHBondContact O-N 3.22Å
361	R	56.5	Low	72.4	Confident	227 Å²	227	123.7 Å²	123.7	86%	0.857	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	2	178.6	-77.7	-177.3	177	-176.8	0.3	113.9	L359	L359-R361 VanDerWaalsContact C-N 3.27Å; L359-R361 PolarHBondContact O-N 3.06Å
362	K	42.8	Very low	71	Confident	247 Å²	247	121.2 Å²	121.2	100%	1.074	61%	0.611	S	S	*	*			trans	-114.8	0	170.3	-72.7	-173.6	176.5	-174.9	0	108.6

Retrieved 362 of 362 residues in 64.5 ms (Link to these results)

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