A0A087YFI9_POEFO Loading...

Extended synaptotagmin-3

AlphaFold DB , UniProt , Accession A0A087YFI9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 850 aa.

						>A0A087YFI9_POEFO|A0A087YFI9
MASAAQTQPGGTESLTPSAVNHILMEFVIYFGRAVAVFYPVYLTGYLGLSISWILLCMLMFTWWQKNRRWKDVRIDSAIDLVDNESHIISSELKNTLQMASWVHFTDVEKVQWVNKVLEQAWPFFGMYMEKLLRENIQQTVRMSNSALKMFKFTKIHFGHKPLRITGMRAYTHEVDQREVILDMNIDYDSDVDIDADVNAAITVGIKGLKFQGMLRVILEPLISQAPLVGGVTFFFIRRPTLQINWTGMTNLLDSPAFSSLSEEAIMEIIASLMVLPNRMCIPLIDQLKVDEMRFPLPRGVVRVHVLEAKDLVAKDTYMMGMVKGKSDPYVTLRVGNRHFKTKTIKESLAPKWNEVYEFVVHEAPGQELEIELFDEDRDKDDFLGKYNLDFGEVKREKEMDQWFHLEGVNSGDIHLKLQWLSLRTESSLLNESNAGLSCAMLAVYLDNASNLPKDQKELTVHHKHGKHSKEARLTKKNVGPNSYVEFTLDKDVQKSKVAYASKNPVWEQGFNFFVQNVKTQELTLQVKDHEKKYVLGSLNIPILRLFNISSMCLDQNFPLERSGPDSQIKLKVTLRILTEERPPPKIPVSSPSNVKQQNRQVKAGGNAAAATPAASAAAATTAAATPAPSSGAPVASSPGLPGVPLDGTNKAASPQPRRNSFLASETSKPSNPNMRRYDSHSLLSENSIASSRFDLTDGASFPQAIRDHQGSFGEINLTVRYATMRNKLMVLVHACRNLFPCSDSGTDSYVRIYLLPDNSWRHRKKTHVKRKTVKPVFEEKFEFDVSLEDAQTRQLDVSVKNNKMFRKRERTDIGMLMLDLSQIDLVKGASDWFELTIPGLSRSTRQSHF
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure 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	35.7	Very low	36	Very low	245 Å²	245	129.2 Å²	129.2	100%	1.207	84%	0.843	S	S	*	*				0	144.9	0	-63.4	166.8	176.1	0	0	107.6
2	A	34.9	Very low	37	Very low	91 Å²	91	130.6 Å²	130.6	75%	0.752	85%	0.847	S	S	*	*			cis	-173	166.2	-19.9	0	0	0	0	0	106.9
3	S	30.9	Very low	37.9	Very low	125 Å²	125	134.8 Å²	134.8	87%	0.874	85%	0.849	S	S	*	*			trans	71.8	140.2	173.4	-156	0	0	0	0	116.8
4	A	33.9	Very low	39	Very low	83 Å²	83	133.4 Å²	133.4	69%	0.686	85%	0.845	S	S	*	*			cis	-168.9	127.3	-37	0	0	0	0	0	106.1
5	A	36.8	Very low	40.2	Very low	107 Å²	107	132.8 Å²	132.8	88%	0.884	83%	0.833	S	S	*	*			trans	-83.6	132.4	163.1	0	0	0	0	0	108.5
6	Q	32.3	Very low	41.8	Very low	191 Å²	191	129.4 Å²	129.4	89%	0.893	81%	0.811	S	S	*	*			trans	-133.8	107.6	174.4	-160.1	166.5	15.5	0	0	110
7	T	40.7	Very low	43.1	Very low	136 Å²	136	127.9 Å²	127.9	83%	0.834	80%	0.803	S	S	*	*			trans	-85.5	137.8	-178.4	27.6	0	0	0	0	112.2
8	Q	34.6	Very low	44.3	Very low	179 Å²	179	125.7 Å²	125.7	84%	0.836	79%	0.792	S	S	*	*			trans	-148.5	159.7	165.3	-92.6	-67.5	-55	0	0	106.8
9	P	41.2	Very low	45.5	Very low	109 Å²	109	120.7 Å²	120.7	71%	0.708	76%	0.764	S	S	*	*				-109.2	171.2	-123.5	5.7	17.7	0	0	0	114.4
10	G	41.2	Very low	46.9	Very low	81 Å²	81	118.3 Å²	118.3	84%	0.835	75%	0.748	S	S	*	*			trans	-71.8	139.8	178.8	0	0	0	0	0	113.9
11	G	33.9	Very low	48.2	Very low	74 Å²	74	117.6 Å²	117.6	76%	0.763	74%	0.739	S	S	*	*			trans	-92.5	139	159.8	0	0	0	0	0	110.3	E13	G11-E13 PolarHBondContact O-N 3.05Å
12	T	47.9	Very low	50.1	Low	146 Å²	146	110.8 Å²	110.8	90%	0.896	70%	0.704	S	S	*	*			trans	-81.5	107.1	178.3	49.7	0	0	0	0	111	S14	T12-S14 PolarHBondContact O-N 3.27Å
13	E	48.6	Very low	52.2	Low	185 Å²	185	111 Å²	111	86%	0.864	69%	0.692	S	S	*	*			trans	-70.5	124.5	171	-66.2	-167.8	147.5	0	0	111.1	G11 L15	G11-E13 PolarHBondContact O-N 3.05Å; E13-L15 PolarHBondContact O-N 2.99Å
14	S	52.9	Low	54.4	Low	115 Å²	115	110 Å²	110	80%	0.804	68%	0.676	S	S	*	*			trans	-81.8	98.5	173.7	39.5	0	0	0	0	110.4	T12 T16	T12-S14 PolarHBondContact O-N 3.27Å; S14-T16 PolarHBondContact O-N 3.38Å
15	L	57.1	Low	56.6	Low	125 Å²	125	111.5 Å²	111.5	65%	0.654	67%	0.67	S	S	*	*			trans	-52.9	128.3	177	-72.8	167.1	0	0	0	111.6	E13 V20	E13-L15 PolarHBondContact O-N 2.99Å; L15-V20 HydrophobicContact CB-CG2 4.22Å
16	T	66.1	Low	58.7	Low	78 Å²	78	111.8 Å²	111.8	48%	0.479	65%	0.653	S	S	.	*			trans	-73.5	149.2	-178.1	57.2	0	0	0	0	111.6	S14 S18 A19 V20	S14-T16 PolarHBondContact O-N 3.38Å; T16-S18 PolarHBondContact O-N 2.98Å; T16-S18 VanDerWaalsContact O-N 3.13Å; T16-A19 WeakPolarHBondContact O-CB 3.41Å; T16-A19 PolarHBondContact O-N 3.45Å; T16-V20 PolarHBondContact O-N 3.1Å; T16-V20 VanDerWaalsContact O-N 3.12Å
17	P	63.9	Low	61.1	Low	104 Å²	104	109.5 Å²	109.5	68%	0.675	64%	0.64	S	S	*	*	H	α-helix	trans	-58.5	-29.2	-177.7	-27.4	35.7	0	0	0	114.6	N21	P17-N21 WeakPolarHBondContact O-CB 3.42Å; P17-N21 PolarHBondContact O-N 3.41Å
18	S	64.4	Low	63.1	Low	88 Å²	88	107.3 Å²	107.3	62%	0.615	63%	0.627	S	S	*	*	H	α-helix	trans	-71.2	-37.3	175	53	0	0	0	0	112.7	T16 N21 H22	T16-S18 PolarHBondContact O-N 2.98Å; T16-S18 VanDerWaalsContact O-N 3.13Å; S18-N21 PolarHBondContact O-N 2.99Å; S18-H22 PolarHBondContact O-N 2.86Å
19	A	67.5	Low	65.3	Low	32 Å²	32	102.9 Å²	102.9	26%	0.264	61%	0.608	S	S	.	*	H	α-helix	trans	-65.2	-43.1	173.8	0	0	0	0	0	111	T16 N21 H22 I23	T16-A19 WeakPolarHBondContact O-CB 3.41Å; T16-A19 PolarHBondContact O-N 3.45Å; A19-N21 PolarHBondContact O-N 3.39Å; A19-H22 PolarHBondContact O-N 3.38Å; A19-I23 WeakPolarHBondContact O-CB 3.3Å; A19-I23 VanDerWaalsContact O-CG1 3.28Å; A19-I23 WeakPolarHBondContact O-CG1 3.49Å; A19-I23 PolarHBondContact O-N 2.96Å
20	V	74	Confident	67.4	Low	72 Å²	72	106.1 Å²	106.1	44%	0.436	61%	0.607	S	S	.	*	H	α-helix	trans	-60.2	-44.7	174.4	179.7	0	0	0	0	111.1	L15 T16 I23 L24	L15-V20 HydrophobicContact CB-CG2 4.22Å; T16-V20 PolarHBondContact O-N 3.1Å; T16-V20 VanDerWaalsContact O-N 3.12Å; V20-I23 PolarHBondContact O-N 3.37Å; V20-L24 VanDerWaalsContact O-CB 3.29Å; V20-L24 WeakPolarHBondContact O-CB 3.43Å; V20-L24 PolarHBondContact O-N 3.15Å
21	N	74.1	Confident	69.4	Low	104 Å²	104	108.6 Å²	108.6	56%	0.556	60%	0.595	S	S	*	*	H	α-helix	trans	-66.8	-34.5	176.4	-78.3	-11.2	0	0	0	113.4	P17 S18 A19 M25	P17-N21 WeakPolarHBondContact O-CB 3.42Å; P17-N21 PolarHBondContact O-N 3.41Å; S18-N21 PolarHBondContact O-N 2.99Å; A19-N21 PolarHBondContact O-N 3.39Å; N21-M25 WeakPolarHBondContact O-CB 3.45Å; N21-M25 PolarHBondContact O-N 2.93Å
22	H	75.3	Confident	71.7	Confident	102 Å²	102	107 Å²	107	47%	0.472	58%	0.578	S	S	.	*	H	α-helix	trans	-65.9	-48.6	174.3	-168.6	-78.1	0	0	0	111.2	S18 A19 L24 M25 E26	S18-H22 PolarHBondContact O-N 2.86Å; A19-H22 PolarHBondContact O-N 3.38Å; H22-L24 VanDerWaalsContact C-N 3.3Å; H22-L24 PolarHBondContact O-N 2.99Å; H22-M25 PolarHBondContact O-N 3.37Å; H22-M25 VanDerWaalsContact O-N 3.14Å; H22-E26 VanDerWaalsContact CE1-CD 3.4Å; H22-E26 IonicContact CE1-OE1 2.77Å; H22-E26 IonicContact CE1-OE2 2.71Å; H22-E26 IonicContact ND1-OE2 3.73Å; H22-E26 PolarHBondContact ND1-OE2 3.14Å; H22-E26 PolarHBondContact O-N 2.91Å
23	I	78.6	Confident	73.2	Confident	96 Å²	96	108.6 Å²	108.6	49%	0.492	57%	0.568	S	S	.	*	H	α-helix	trans	-60.5	-41.4	176.7	-67.1	164.4	0	0	0	110.4	A19 V20 E26 F27	A19-I23 WeakPolarHBondContact O-CB 3.3Å; A19-I23 VanDerWaalsContact O-CG1 3.28Å; A19-I23 WeakPolarHBondContact O-CG1 3.49Å; A19-I23 PolarHBondContact O-N 2.96Å; V20-I23 PolarHBondContact O-N 3.37Å; I23-E26 PolarHBondContact O-N 3.34Å; I23-F27 VanDerWaalsContact O-CB 3.29Å; I23-F27 WeakPolarHBondContact O-CB 3.15Å; I23-F27 PolarHBondContact O-N 3.04Å
24	L	77.4	Confident	74.7	Confident	104 Å²	104	101.1 Å²	101.1	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-62.4	-43.3	174.8	-169.7	76	0	0	0	111.6	V20 H22 F27 V28	V20-L24 VanDerWaalsContact O-CB 3.29Å; V20-L24 WeakPolarHBondContact O-CB 3.43Å; V20-L24 PolarHBondContact O-N 3.15Å; H22-L24 VanDerWaalsContact C-N 3.3Å; H22-L24 PolarHBondContact O-N 2.99Å; L24-F27 PolarHBondContact O-N 3.47Å; L24-V28 WeakPolarHBondContact O-CB 3.35Å; L24-V28 VanDerWaalsContact O-CG2 3.31Å; L24-V28 WeakPolarHBondContact O-CG2 3.3Å; L24-V28 PolarHBondContact O-N 3.16Å
25	M	80.3	Confident	76.1	Confident	114 Å²	114	98.9 Å²	98.9	56%	0.562	52%	0.519	S	S	*	.	H	α-helix	trans	-69.3	-39.9	179.5	-167	172.2	71.5	0	0	112	N21 H22 V28 I29	N21-M25 WeakPolarHBondContact O-CB 3.45Å; N21-M25 PolarHBondContact O-N 2.93Å; H22-M25 PolarHBondContact O-N 3.37Å; H22-M25 VanDerWaalsContact O-N 3.14Å; M25-V28 PolarHBondContact O-N 3.07Å; M25-I29 HydrophobicContact CG-CD1 4.1Å; M25-I29 WeakPolarHBondContact O-CB 3.38Å; M25-I29 WeakPolarHBondContact O-CD1 3.26Å; M25-I29 VanDerWaalsContact O-CG1 3.24Å; M25-I29 WeakPolarHBondContact O-CG1 3.43Å; M25-I29 PolarHBondContact O-N 2.91Å
26	E	80.1	Confident	77.1	Confident	112 Å²	112	96.1 Å²	96.1	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-61.6	-42.6	170.2	-75.2	-171.8	129.6	0	0	111.6	H22 I23 V28 I29 Y30	H22-E26 VanDerWaalsContact CE1-CD 3.4Å; H22-E26 IonicContact CE1-OE1 2.77Å; H22-E26 IonicContact CE1-OE2 2.71Å; H22-E26 IonicContact ND1-OE2 3.73Å; H22-E26 PolarHBondContact ND1-OE2 3.14Å; H22-E26 PolarHBondContact O-N 2.91Å; I23-E26 PolarHBondContact O-N 3.34Å; E26-V28 PolarHBondContact O-N 3.48Å; E26-I29 PolarHBondContact O-N 3.35Å; E26-Y30 VanDerWaalsContact O-CB 3.29Å; E26-Y30 WeakPolarHBondContact O-CB 3.5Å; E26-Y30 PolarHBondContact O-N 3.37Å
27	F	84	Confident	77.6	Confident	143 Å²	143	97 Å²	97	63%	0.627	52%	0.52	S	S	*	.	H	α-helix	trans	-64.2	-39.6	176.8	-162.2	-89.2	0	0	0	111.9	I23 L24 Y30 F31	I23-F27 VanDerWaalsContact O-CB 3.29Å; I23-F27 WeakPolarHBondContact O-CB 3.15Å; I23-F27 PolarHBondContact O-N 3.04Å; L24-F27 PolarHBondContact O-N 3.47Å; F27-Y30 PolarHBondContact O-N 2.87Å; F27-F31 VanDerWaalsContact O-CB 3.22Å; F27-F31 WeakPolarHBondContact O-CB 3.44Å; F27-F31 PolarHBondContact O-N 3.49Å
28	V	82.4	Confident	78.3	Confident	91 Å²	91	98.6 Å²	98.6	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-40	173.9	168.2	0	0	0	0	111.7	L24 M25 E26 G32	L24-V28 WeakPolarHBondContact O-CB 3.35Å; L24-V28 VanDerWaalsContact O-CG2 3.31Å; L24-V28 WeakPolarHBondContact O-CG2 3.3Å; L24-V28 PolarHBondContact O-N 3.16Å; M25-V28 PolarHBondContact O-N 3.07Å; E26-V28 PolarHBondContact O-N 3.48Å; V28-G32 PolarHBondContact O-N 2.77Å
29	I	80.9	Confident	78.9	Confident	86 Å²	86	101.1 Å²	101.1	44%	0.441	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-39.7	174.5	-70.8	164.5	0	0	0	110.8	M25 E26 R33	M25-I29 HydrophobicContact CG-CD1 4.1Å; M25-I29 WeakPolarHBondContact O-CB 3.38Å; M25-I29 WeakPolarHBondContact O-CD1 3.26Å; M25-I29 VanDerWaalsContact O-CG1 3.24Å; M25-I29 WeakPolarHBondContact O-CG1 3.43Å; M25-I29 PolarHBondContact O-N 2.91Å; E26-I29 PolarHBondContact O-N 3.35Å; I29-R33 WeakPolarHBondContact O-CB 3.44Å; I29-R33 WeakPolarHBondContact O-CG 3.26Å; I29-R33 PolarHBondContact O-N 3.14Å
30	Y	84.9	Confident	79.2	Confident	176 Å²	176	102.9 Å²	102.9	69%	0.69	52%	0.522	S	S	*	.	H	α-helix	trans	-68.2	-44	177.3	-159.6	-79.6	0	0	0	111.3	E26 F27 R33 A34	E26-Y30 VanDerWaalsContact O-CB 3.29Å; E26-Y30 WeakPolarHBondContact O-CB 3.5Å; E26-Y30 PolarHBondContact O-N 3.37Å; F27-Y30 PolarHBondContact O-N 2.87Å; Y30-R33 PolarHBondContact O-N 2.88Å; Y30-A34 WeakPolarHBondContact O-CB 3.32Å; Y30-A34 PolarHBondContact O-N 3.34Å
31	F	83	Confident	79.1	Confident	133 Å²	133	102.7 Å²	102.7	58%	0.583	52%	0.521	S	S	*	.	H	α-helix	trans	-64.5	-42.4	174.7	-170.4	-95.6	0	0	0	111.5	F27 R33 A34 V35	F27-F31 VanDerWaalsContact O-CB 3.22Å; F27-F31 WeakPolarHBondContact O-CB 3.44Å; F27-F31 PolarHBondContact O-N 3.49Å; F31-R33 PolarHBondContact O-N 3.48Å; F31-A34 PolarHBondContact O-N 2.89Å; F31-V35 HydrophobicContact CD1-CG2 3.97Å; F31-V35 HydrophobicContact CE1-CG2 3.65Å; F31-V35 HydrophobicContact CZ-CG2 4.07Å; F31-V35 WeakPolarHBondContact O-CG2 3.45Å; F31-V35 PolarHBondContact O-N 3.17Å
32	G	81.9	Confident	79.1	Confident	40 Å²	40	105.3 Å²	105.3	41%	0.412	52%	0.524	S	S	.	.	H	α-helix	trans	-60.9	-41.1	173.7	0	0	0	0	0	112.8	V28 A36	V28-G32 PolarHBondContact O-N 2.77Å; G32-A36 VanDerWaalsContact O-CB 3.32Å; G32-A36 WeakPolarHBondContact O-CB 3.28Å; G32-A36 PolarHBondContact O-N 2.94Å
33	R	80.5	Confident	79	Confident	180 Å²	180	103.7 Å²	103.7	68%	0.679	52%	0.518	S	S	*	.	H	α-helix	trans	-64.8	-42.3	171.7	-80.1	175.3	163.3	173.1	-3.8	112.4	I29 Y30 F31 A36 V37	I29-R33 WeakPolarHBondContact O-CB 3.44Å; I29-R33 WeakPolarHBondContact O-CG 3.26Å; I29-R33 PolarHBondContact O-N 3.14Å; Y30-R33 PolarHBondContact O-N 2.88Å; F31-R33 PolarHBondContact O-N 3.48Å; R33-A36 PolarHBondContact O-N 3.35Å; R33-V37 WeakPolarHBondContact O-CG2 3.4Å; R33-V37 PolarHBondContact O-N 2.92Å; R33-V37 VanDerWaalsContact O-N 3.09Å
34	A	79.6	Confident	78.7	Confident	29 Å²	29	100.7 Å²	100.7	24%	0.24	51%	0.505	C	S	.	.	H	α-helix	trans	-62.4	-48	176.2	0	0	0	0	0	111.1	Y30 F31 A36 V37 F38	Y30-A34 WeakPolarHBondContact O-CB 3.32Å; Y30-A34 PolarHBondContact O-N 3.34Å; F31-A34 PolarHBondContact O-N 2.89Å; A34-A36 PolarHBondContact O-N 2.77Å; A34-V37 PolarHBondContact O-N 3.42Å; A34-V37 VanDerWaalsContact O-N 3.16Å; A34-F38 HydrophobicContact CB-CD2 4.13Å; A34-F38 HydrophobicContact CB-CE2 4.25Å; A34-F38 WeakPolarHBondContact O-CB 3.02Å; A34-F38 WeakPolarHBondContact O-CD2 3.24Å; A34-F38 PolarHBondContact O-N 2.86Å
35	V	81.6	Confident	78.4	Confident	67 Å²	67	98.3 Å²	98.3	41%	0.406	51%	0.506	S	S	.	.	H	α-helix	trans	-59.5	-44.6	174.6	172.1	0	0	0	0	110.8	F31 V37 F38 Y39	F31-V35 HydrophobicContact CD1-CG2 3.97Å; F31-V35 HydrophobicContact CE1-CG2 3.65Å; F31-V35 HydrophobicContact CZ-CG2 4.07Å; F31-V35 WeakPolarHBondContact O-CG2 3.45Å; F31-V35 PolarHBondContact O-N 3.17Å; V35-V37 PolarHBondContact O-N 3.42Å; V35-F38 PolarHBondContact O-N 3.2Å; V35-Y39 WeakPolarHBondContact O-CA 3.36Å; V35-Y39 WeakPolarHBondContact O-CB 3.12Å; V35-Y39 PolarHBondContact O-N 2.82Å
36	A	79.2	Confident	78.1	Confident	68 Å²	68	101.3 Å²	101.3	56%	0.562	51%	0.512	S	S	*	.	H	α-helix	trans	-61.4	-28.1	177.7	0	0	0	0	0	113.9	G32 R33 A34 P40	G32-A36 VanDerWaalsContact O-CB 3.32Å; G32-A36 WeakPolarHBondContact O-CB 3.28Å; G32-A36 PolarHBondContact O-N 2.94Å; R33-A36 PolarHBondContact O-N 3.35Å; A34-A36 PolarHBondContact O-N 2.77Å; A36-P40 VanDerWaalsContact O-CD 3.28Å; A36-P40 WeakPolarHBondContact O-CD 3.17Å; A36-P40 WeakPolarHBondContact O-CG 3.41Å
37	V	77.1	Confident	77.9	Confident	95 Å²	95	101.1 Å²	101.1	58%	0.576	51%	0.514	S	S	*	.	H	α-helix	trans	-88.5	-40.5	177.2	172.1	0	0	0	0	112.4	R33 A34 V35	R33-V37 WeakPolarHBondContact O-CG2 3.4Å; R33-V37 PolarHBondContact O-N 2.92Å; R33-V37 VanDerWaalsContact O-N 3.09Å; A34-V37 PolarHBondContact O-N 3.42Å; A34-V37 VanDerWaalsContact O-N 3.16Å; V35-V37 PolarHBondContact O-N 3.42Å
38	F	76.8	Confident	77.3	Confident	139 Å²	139	97.6 Å²	97.6	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-88.6	-27.3	-175.2	-66.4	-59.4	0	0	0	114.1	A34 V35 V41 Y42	A34-F38 HydrophobicContact CB-CD2 4.13Å; A34-F38 HydrophobicContact CB-CE2 4.25Å; A34-F38 WeakPolarHBondContact O-CB 3.02Å; A34-F38 WeakPolarHBondContact O-CD2 3.24Å; A34-F38 PolarHBondContact O-N 2.86Å; V35-F38 PolarHBondContact O-N 3.2Å; F38-V41 PolarHBondContact O-N 2.84Å; F38-Y42 WeakPolarHBondContact O-CB 3.37Å; F38-Y42 PolarHBondContact O-N 2.87Å
39	Y	78.3	Confident	76.6	Confident	141 Å²	141	97.3 Å²	97.3	55%	0.553	51%	0.513	S	S	*	.	H	α-helix	trans	-61.2	-43.2	178	-179.6	-96.9	0	0	0	113	V35 V41 Y42 L43	V35-Y39 WeakPolarHBondContact O-CA 3.36Å; V35-Y39 WeakPolarHBondContact O-CB 3.12Å; V35-Y39 PolarHBondContact O-N 2.82Å; Y39-V41 VanDerWaalsContact C-N 3.33Å; Y39-V41 PolarHBondContact O-N 3.35Å; Y39-Y42 PolarHBondContact O-N 2.86Å; Y39-L43 HydrophobicContact CE1-CD2 4.28Å; Y39-L43 VanDerWaalsContact O-CB 3.26Å; Y39-L43 WeakPolarHBondContact O-CB 3.37Å; Y39-L43 PolarHBondContact O-N 3.43Å
40	P	72.6	Confident	76.5	Confident	68 Å²	68	96.5 Å²	96.5	44%	0.442	51%	0.514	S	S	.	.	H	α-helix	trans	-60.1	-40.6	172.4	-24.1	34.9	0	0	0	113	A36 L43 T44	A36-P40 VanDerWaalsContact O-CD 3.28Å; A36-P40 WeakPolarHBondContact O-CD 3.17Å; A36-P40 WeakPolarHBondContact O-CG 3.41Å; P40-L43 PolarHBondContact O-N 3.49Å; P40-T44 PolarHBondContact O-N 2.92Å; P40-T44 PolarHBondContact O-OG1 3.09Å
41	V	72.9	Confident	76	Confident	69 Å²	69	94 Å²	94	42%	0.418	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-46.5	179.4	178.5	0	0	0	0	110.8	F38 Y39 L43 T44 G45 I54	F38-V41 PolarHBondContact O-N 2.84Å; Y39-V41 VanDerWaalsContact C-N 3.33Å; Y39-V41 PolarHBondContact O-N 3.35Å; V41-L43 PolarHBondContact O-N 3.44Å; V41-T44 WeakPolarHBondContact CA-OG1 3.32Å; V41-T44 PolarHBondContact O-N 3.4Å; V41-T44 PolarHBondContact O-OG1 3.23Å; V41-G45 PolarHBondContact O-N 3.16Å; V41-I54 HydrophobicContact CG1-CD1 4.33Å
42	Y	73	Confident	75.7	Confident	159 Å²	159	91.4 Å²	91.4	62%	0.624	51%	0.51	S	S	*	.	H	α-helix	trans	-58.7	-45.6	173.5	176.7	-97.5	0	0	0	111.6	F38 Y39 T44 G45 Y46	F38-Y42 WeakPolarHBondContact O-CB 3.37Å; F38-Y42 PolarHBondContact O-N 2.87Å; Y39-Y42 PolarHBondContact O-N 2.86Å; Y42-T44 PolarHBondContact O-N 2.83Å; Y42-G45 PolarHBondContact O-N 3.45Å; Y42-G45 VanDerWaalsContact O-N 3.16Å; Y42-Y46 WeakPolarHBondContact O-CB 3.48Å; Y42-Y46 PolarHBondContact O-N 2.91Å
43	L	73.8	Confident	75.4	Confident	67 Å²	67	96.8 Å²	96.8	35%	0.351	52%	0.518	S	S	.	.	H	α-helix	trans	-64.5	-39.5	179.2	-172.8	63	0	0	0	112	Y39 P40 V41 G45 Y46 L47	Y39-L43 HydrophobicContact CE1-CD2 4.28Å; Y39-L43 VanDerWaalsContact O-CB 3.26Å; Y39-L43 WeakPolarHBondContact O-CB 3.37Å; Y39-L43 PolarHBondContact O-N 3.43Å; P40-L43 PolarHBondContact O-N 3.49Å; V41-L43 PolarHBondContact O-N 3.44Å; L43-G45 VanDerWaalsContact C-N 3.33Å; L43-G45 PolarHBondContact O-N 3.36Å; L43-Y46 PolarHBondContact O-N 2.82Å; L43-L47 HydrophobicContact CD1-CD1 4.16Å; L43-L47 HydrophobicContact CD1-CG 4.37Å; L43-L47 HydrophobicContact CG-CD1 4Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 VanDerWaalsContact O-CG 3.3Å; L43-L47 WeakPolarHBondContact O-CG 3.22Å; L43-L47 PolarHBondContact O-N 3.36Å
44	T	71.6	Confident	75.3	Confident	33 Å²	33	91.1 Å²	91.1	20%	0.202	50%	0.501	C	S	.	.	H	α-helix	trans	-64	-36.2	172.8	47.2	0	0	0	0	112.9	P40 V41 Y42 G48 L49	P40-T44 PolarHBondContact O-N 2.92Å; P40-T44 PolarHBondContact O-OG1 3.09Å; V41-T44 WeakPolarHBondContact CA-OG1 3.32Å; V41-T44 PolarHBondContact O-N 3.4Å; V41-T44 PolarHBondContact O-OG1 3.23Å; Y42-T44 PolarHBondContact O-N 2.83Å; T44-G48 PolarHBondContact O-N 3.05Å; T44-L49 HydrophobicContact CG2-CD1 4.25Å; T44-L49 PolarHBondContact O-N 3.33Å
45	G	70.9	Confident	75.2	Confident	55 Å²	55	95.3 Å²	95.3	57%	0.567	52%	0.518	S	S	*	.	H	α-helix	trans	-68	-44.3	173.8	0	0	0	0	0	112.8	V41 Y42 L43 L47 G48	V41-G45 PolarHBondContact O-N 3.16Å; Y42-G45 PolarHBondContact O-N 3.45Å; Y42-G45 VanDerWaalsContact O-N 3.16Å; L43-G45 VanDerWaalsContact C-N 3.33Å; L43-G45 PolarHBondContact O-N 3.36Å; G45-L47 VanDerWaalsContact C-N 3.3Å; G45-L47 PolarHBondContact O-N 2.84Å; G45-G48 PolarHBondContact O-N 3.4Å; G45-G48 VanDerWaalsContact O-N 3.1Å
46	Y	74.8	Confident	75.2	Confident	177 Å²	177	96.6 Å²	96.6	69%	0.694	52%	0.523	S	S	*	.	H	α-helix	trans	-62.5	-35.6	177.4	-176.9	-98.8	0	0	0	112.7	Y42 L43 G48	Y42-Y46 WeakPolarHBondContact O-CB 3.48Å; Y42-Y46 PolarHBondContact O-N 2.91Å; L43-Y46 PolarHBondContact O-N 2.82Å; Y46-G48 VanDerWaalsContact C-N 3.28Å; Y46-G48 PolarHBondContact O-N 2.97Å
47	L	76.5	Confident	75.2	Confident	108 Å²	108	97.3 Å²	97.3	57%	0.565	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	4.4	176.1	-65.6	171.9	0	0	0	113.9	L43 G45 L49	L43-L47 HydrophobicContact CD1-CD1 4.16Å; L43-L47 HydrophobicContact CD1-CG 4.37Å; L43-L47 HydrophobicContact CG-CD1 4Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 VanDerWaalsContact O-CG 3.3Å; L43-L47 WeakPolarHBondContact O-CG 3.22Å; L43-L47 PolarHBondContact O-N 3.36Å; G45-L47 VanDerWaalsContact C-N 3.3Å; G45-L47 PolarHBondContact O-N 2.84Å; L47-L49 HydrophobicContact CB-CD1 4.1Å; L47-L49 HydrophobicContact CB-CG 4.13Å; L47-L49 HydrophobicContact CD1-CD1 4.43Å; L47-L49 PolarHBondContact O-N 2.82Å
48	G	70.4	Confident	75.3	Confident	68 Å²	68	98.4 Å²	98.4	70%	0.701	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	20.3	178.2	0	0	0	0	0	114.9	T44 G45 Y46	T44-G48 PolarHBondContact O-N 3.05Å; G45-G48 PolarHBondContact O-N 3.4Å; G45-G48 VanDerWaalsContact O-N 3.1Å; Y46-G48 VanDerWaalsContact C-N 3.28Å; Y46-G48 PolarHBondContact O-N 2.97Å
49	L	69.3	Low	75.6	Confident	86 Å²	86	97 Å²	97	45%	0.45	52%	0.521	S	S	.	.			trans	-79	135.1	-175.7	-67.9	169	0	0	0	111.3	T44 L47	T44-L49 HydrophobicContact CG2-CD1 4.25Å; T44-L49 PolarHBondContact O-N 3.33Å; L47-L49 HydrophobicContact CB-CD1 4.1Å; L47-L49 HydrophobicContact CB-CG 4.13Å; L47-L49 HydrophobicContact CD1-CD1 4.43Å; L47-L49 PolarHBondContact O-N 2.82Å
50	S	77	Confident	75.9	Confident	68 Å²	68	94.9 Å²	94.9	48%	0.476	52%	0.517	S	S	.	.			trans	-59.7	138	-179.1	179.5	0	0	0	0	112.7	S52 W53	S50-S52 PolarHBondContact O-N 3.33Å; S50-S52 PolarHBondContact OG-N 2.91Å; S50-S52 PolarHBondContact OG-OG 3.43Å; S50-S52 VanDerWaalsContact OG-OG 3.05Å; S50-W53 PolarHBondContact O-N 3.22Å
51	I	75.6	Confident	76.4	Confident	124 Å²	124	97 Å²	97	64%	0.636	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-26.6	175.1	-61.8	169.4	0	0	0	112.1	W53 I54 L55	I51-W53 PolarHBondContact O-N 3.2Å; I51-W53 VanDerWaalsContact O-N 3.15Å; I51-I54 PolarHBondContact O-N 3.33Å; I51-L55 HydrophobicContact CG2-CD1 4.33Å; I51-L55 PolarHBondContact O-N 2.82Å; I51-L55 VanDerWaalsContact O-N 3.14Å
52	S	76.8	Confident	76.8	Confident	79 Å²	79	96.8 Å²	96.8	55%	0.552	52%	0.519	S	S	*	.	H	α-helix	trans	-50	-35.6	172.5	-49.7	0	0	0	0	113.6	S50 L56	S50-S52 PolarHBondContact O-N 3.33Å; S50-S52 PolarHBondContact OG-N 2.91Å; S50-S52 PolarHBondContact OG-OG 3.43Å; S50-S52 VanDerWaalsContact OG-OG 3.05Å; S52-L56 WeakPolarHBondContact O-CB 3.41Å; S52-L56 PolarHBondContact O-N 3.14Å
53	W	76.1	Confident	77.2	Confident	153 Å²	153	96.4 Å²	96.4	58%	0.58	52%	0.516	S	S	*	.	H	α-helix	trans	-71.2	-37	178.2	-74.9	102.1	0	0	0	112.9	S50 I51 L55 L56 C57	S50-W53 PolarHBondContact O-N 3.22Å; I51-W53 PolarHBondContact O-N 3.2Å; I51-W53 VanDerWaalsContact O-N 3.15Å; W53-L55 VanDerWaalsContact C-N 3.35Å; W53-L56 HydrophobicContact CE3-CD2 3.84Å; W53-L56 HydrophobicContact CZ3-CD2 3.81Å; W53-L56 PolarHBondContact O-N 2.84Å; W53-C57 PolarHBondContact O-N 3.46Å; W53-C57 PolarHBondContact O-SG 2.93Å; W53-C57 VanDerWaalsContact O-SG 3.38Å
54	I	76.7	Confident	77.8	Confident	60 Å²	60	99.7 Å²	99.7	31%	0.308	52%	0.524	S	S	.	.	H	α-helix	trans	-64.6	-44.6	175.7	-53.7	176.7	0	0	0	109.3	V41 I51 C57 M58	V41-I54 HydrophobicContact CG1-CD1 4.33Å; I51-I54 PolarHBondContact O-N 3.33Å; I54-C57 PolarHBondContact O-N 2.99Å; I54-M58 PolarHBondContact O-N 3.4Å
55	L	78.8	Confident	78.3	Confident	117 Å²	117	101.8 Å²	101.8	61%	0.613	53%	0.531	S	S	*	.	H	α-helix	trans	-62.4	-42.1	175.7	-71.1	169	0	0	0	112.3	I51 W53 M58 L59	I51-L55 HydrophobicContact CG2-CD1 4.33Å; I51-L55 PolarHBondContact O-N 2.82Å; I51-L55 VanDerWaalsContact O-N 3.14Å; W53-L55 VanDerWaalsContact C-N 3.35Å; L55-M58 PolarHBondContact O-N 2.8Å; L55-L59 WeakPolarHBondContact O-CB 3.41Å; L55-L59 PolarHBondContact O-N 3.27Å
56	L	81.1	Confident	78.6	Confident	95 Å²	95	105.3 Å²	105.3	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-59.3	-47	175.2	-171.3	79.1	0	0	0	111.5	S52 W53 L59 M60	S52-L56 WeakPolarHBondContact O-CB 3.41Å; S52-L56 PolarHBondContact O-N 3.14Å; W53-L56 HydrophobicContact CE3-CD2 3.84Å; W53-L56 HydrophobicContact CZ3-CD2 3.81Å; W53-L56 PolarHBondContact O-N 2.84Å; L56-L59 PolarHBondContact O-N 2.94Å; L56-M60 WeakPolarHBondContact O-CB 3.41Å; L56-M60 PolarHBondContact O-N 3.14Å
57	C	78.8	Confident	78.8	Confident	83 Å²	83	99.5 Å²	99.5	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-64.8	-40.2	177.8	-71.9	0	0	0	0	112.3	W53 I54 M60 F61	W53-C57 PolarHBondContact O-N 3.46Å; W53-C57 PolarHBondContact O-SG 2.93Å; W53-C57 VanDerWaalsContact O-SG 3.38Å; I54-C57 PolarHBondContact O-N 2.99Å; C57-M60 PolarHBondContact O-N 3.13Å; C57-F61 VanDerWaalsContact O-CB 3.3Å; C57-F61 WeakPolarHBondContact O-CB 3.43Å; C57-F61 PolarHBondContact O-N 3.4Å
58	M	80	Confident	79	Confident	117 Å²	117	101 Å²	101	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-63.4	-42.1	174.7	-123.2	-66.3	-180	0	0	111.8	I54 L55 F61 T62	I54-M58 PolarHBondContact O-N 3.4Å; L55-M58 PolarHBondContact O-N 2.8Å; M58-F61 PolarHBondContact O-N 2.79Å; M58-T62 WeakPolarHBondContact O-CB 3.5Å; M58-T62 WeakPolarHBondContact O-CG2 3.39Å; M58-T62 PolarHBondContact O-N 2.76Å; M58-T62 PolarHBondContact O-OG1 2.93Å; M58-T62 HydrophobicContact SD-CG2 3.83Å
59	L	83	Confident	79.3	Confident	111 Å²	111	105.3 Å²	105.3	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-68.3	-42.5	178.5	-161.6	156.8	0	0	0	111.2	L55 L56 T62 W63	L55-L59 WeakPolarHBondContact O-CB 3.41Å; L55-L59 PolarHBondContact O-N 3.27Å; L56-L59 PolarHBondContact O-N 2.94Å; L59-T62 PolarHBondContact O-OG1 2.8Å; L59-W63 WeakPolarHBondContact O-CB 3.37Å; L59-W63 PolarHBondContact O-N 3.5Å
60	M	83.3	Confident	79.3	Confident	96 Å²	96	109.1 Å²	109.1	47%	0.473	51%	0.514	S	S	.	.	H	α-helix	trans	-62.4	-43.4	172.2	-84.1	-72.4	107.4	0	0	112.8	L56 C57 W63 W64	L56-M60 WeakPolarHBondContact O-CB 3.41Å; L56-M60 PolarHBondContact O-N 3.14Å; C57-M60 PolarHBondContact O-N 3.13Å; M60-W63 HydrophobicContact CE-CD2 4.3Å; M60-W63 HydrophobicContact CE-CE3 3.71Å; M60-W63 HydrophobicContact CE-CZ3 4.19Å; M60-W63 PolarHBondContact O-N 3.43Å; M60-W63 HydrophobicContact SD-CE3 4.2Å; M60-W64 VanDerWaalsContact O-CB 3.26Å; M60-W64 WeakPolarHBondContact O-CB 3.31Å; M60-W64 PolarHBondContact O-N 2.86Å
61	F	83.5	Confident	79.1	Confident	113 Å²	113	111.2 Å²	111.2	50%	0.496	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-45.9	179.2	-176.8	-97	0	0	0	112	C57 M58 W64 Q65	C57-F61 VanDerWaalsContact O-CB 3.3Å; C57-F61 WeakPolarHBondContact O-CB 3.43Å; C57-F61 PolarHBondContact O-N 3.4Å; M58-F61 PolarHBondContact O-N 2.79Å; F61-W64 HydrophobicContact CE2-CE3 4.39Å; F61-W64 HydrophobicContact CE2-CZ3 4.3Å; F61-W64 PolarHBondContact O-N 3.49Å; F61-Q65 VanDerWaalsContact O-CB 3.32Å; F61-Q65 WeakPolarHBondContact O-CB 3.37Å; F61-Q65 PolarHBondContact O-N 2.88Å
62	T	81.9	Confident	79	Confident	63 Å²	63	108.6 Å²	108.6	39%	0.387	50%	0.501	S	S	.	.	H	α-helix	trans	-67.6	-36.8	177.1	51	0	0	0	0	112.2	M58 L59 K66	M58-T62 WeakPolarHBondContact O-CB 3.5Å; M58-T62 WeakPolarHBondContact O-CG2 3.39Å; M58-T62 PolarHBondContact O-N 2.76Å; M58-T62 PolarHBondContact O-OG1 2.93Å; M58-T62 HydrophobicContact SD-CG2 3.83Å; L59-T62 PolarHBondContact O-OG1 2.8Å; T62-K66 VanDerWaalsContact O-CB 3.24Å; T62-K66 WeakPolarHBondContact O-CB 3.44Å; T62-K66 PolarHBondContact O-N 3.28Å
63	W	82.3	Confident	78.9	Confident	151 Å²	151	109.4 Å²	109.4	57%	0.572	50%	0.503	S	S	*	.	H	α-helix	trans	-64	-44.5	171.9	-177.4	70.8	0	0	0	111.9	L59 M60 K66 N67	L59-W63 WeakPolarHBondContact O-CB 3.37Å; L59-W63 PolarHBondContact O-N 3.5Å; M60-W63 HydrophobicContact CE-CD2 4.3Å; M60-W63 HydrophobicContact CE-CE3 3.71Å; M60-W63 HydrophobicContact CE-CZ3 4.19Å; M60-W63 PolarHBondContact O-N 3.43Å; M60-W63 HydrophobicContact SD-CE3 4.2Å; W63-K66 PolarHBondContact O-N 3.37Å; W63-N67 WeakPolarHBondContact O-CB 3.23Å; W63-N67 PolarHBondContact O-N 3.29Å
64	W	84.5	Confident	78.9	Confident	137 Å²	137	109.4 Å²	109.4	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-47.1	175.3	178.6	84.8	0	0	0	112.1	M60 F61 K66 N67 R68	M60-W64 VanDerWaalsContact O-CB 3.26Å; M60-W64 WeakPolarHBondContact O-CB 3.31Å; M60-W64 PolarHBondContact O-N 2.86Å; F61-W64 HydrophobicContact CE2-CE3 4.39Å; F61-W64 HydrophobicContact CE2-CZ3 4.3Å; F61-W64 PolarHBondContact O-N 3.49Å; W64-K66 VanDerWaalsContact C-N 3.33Å; W64-K66 PolarHBondContact O-N 3.32Å; W64-N67 PolarHBondContact O-N 3.1Å; W64-R68 VanDerWaalsContact CZ2-NH1 3.33Å; W64-R68 WeakPolarHBondContact O-CB 3.48Å; W64-R68 PolarHBondContact O-N 3.04Å
65	Q	82.1	Confident	78.6	Confident	76 Å²	76	111.1 Å²	111.1	36%	0.355	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-39.2	178.2	-168.9	-176.5	30.3	0	0	111.8	F61 R69	F61-Q65 VanDerWaalsContact O-CB 3.32Å; F61-Q65 WeakPolarHBondContact O-CB 3.37Å; F61-Q65 PolarHBondContact O-N 2.88Å; Q65-R69 WeakPolarHBondContact O-CG 3.29Å; Q65-R69 PolarHBondContact O-N 2.87Å
66	K	77.7	Confident	78	Confident	130 Å²	130	110.3 Å²	110.3	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-68.3	-48.4	174.5	-170.1	174.6	-177.4	179.6	0	111.3	T62 W63 W64 R68 R69 W70	T62-K66 VanDerWaalsContact O-CB 3.24Å; T62-K66 WeakPolarHBondContact O-CB 3.44Å; T62-K66 PolarHBondContact O-N 3.28Å; W63-K66 PolarHBondContact O-N 3.37Å; W64-K66 VanDerWaalsContact C-N 3.33Å; W64-K66 PolarHBondContact O-N 3.32Å; K66-R68 VanDerWaalsContact C-N 3.29Å; K66-R68 PolarHBondContact O-N 3.18Å; K66-R69 PolarHBondContact O-N 2.87Å; K66-W70 WeakPolarHBondContact O-CB 3.29Å; K66-W70 PolarHBondContact O-N 2.89Å
67	N	79.8	Confident	77.7	Confident	54 Å²	54	109 Å²	109	29%	0.289	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-36.4	178.5	-171	4.7	0	0	0	111.9	W63 W64 W70 K71	W63-N67 WeakPolarHBondContact O-CB 3.23Å; W63-N67 PolarHBondContact O-N 3.29Å; W64-N67 PolarHBondContact O-N 3.1Å; N67-W70 CarbonylContact O-C 3.53Å; N67-W70 PolarHBondContact O-N 3.4Å; N67-K71 WeakPolarHBondContact O-CG 3.36Å; N67-K71 PolarHBondContact O-N 3.36Å
68	R	80.1	Confident	77.2	Confident	140 Å²	140	107.2 Å²	107.2	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-55.3	174.6	-164.3	167.2	-173.3	162.7	1.4	111.3	W64 K66 W70 K71 D72	W64-R68 VanDerWaalsContact CZ2-NH1 3.33Å; W64-R68 WeakPolarHBondContact O-CB 3.48Å; W64-R68 PolarHBondContact O-N 3.04Å; K66-R68 VanDerWaalsContact C-N 3.29Å; K66-R68 PolarHBondContact O-N 3.18Å; R68-W70 PolarHBondContact O-N 3.37Å; R68-W70 VanDerWaalsContact O-N 3.14Å; R68-K71 WeakPolarHBondContact O-CA 3.49Å; R68-K71 WeakPolarHBondContact O-CB 3.38Å; R68-K71 PolarHBondContact O-N 2.94Å; R68-D72 VanDerWaalsContact C-OD2 3.23Å; R68-D72 PolarHBondContact O-N 3.33Å; R68-D72 VanDerWaalsContact O-OD2 3.05Å
69	R	77.6	Confident	76.7	Confident	159 Å²	159	105.9 Å²	105.9	60%	0.6	49%	0.492	S	S	*	.	H	α-helix	trans	-54.8	-35.2	174	-71.6	176	172.5	176.9	-3	113.4	Q65 K66 K71 D72 V73	Q65-R69 WeakPolarHBondContact O-CG 3.29Å; Q65-R69 PolarHBondContact O-N 2.87Å; K66-R69 PolarHBondContact O-N 2.87Å; R69-K71 VanDerWaalsContact C-N 3.3Å; R69-K71 PolarHBondContact O-N 2.98Å; R69-D72 WeakPolarHBondContact CA-OD2 3.29Å; R69-D72 PolarHBondContact N-OD2 3.14Å; R69-V73 WeakPolarHBondContact O-CG2 3.28Å; R69-V73 PolarHBondContact O-N 3.16Å; R69-V73 VanDerWaalsContact O-N 3.13Å
70	W	68.6	Low	76.1	Confident	166 Å²	166	106 Å²	106	63%	0.629	49%	0.494	S	S	*	.	H	α-helix	trans	-79	-5.2	175.8	-79.4	55.6	0	0	0	114.2	K66 N67 R68 R74	K66-W70 WeakPolarHBondContact O-CB 3.29Å; K66-W70 PolarHBondContact O-N 2.89Å; N67-W70 CarbonylContact O-C 3.53Å; N67-W70 PolarHBondContact O-N 3.4Å; R68-W70 PolarHBondContact O-N 3.37Å; R68-W70 VanDerWaalsContact O-N 3.14Å; W70-R74 VanDerWaalsContact O-CZ 3.31Å; W70-R74 PolarHBondContact O-NE 2.91Å; W70-R74 PolarHBondContact O-NH2 2.87Å
71	K	72.8	Confident	75.5	Confident	112 Å²	112	105.7 Å²	105.7	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-94.3	-48.7	164.4	-73	174.5	179.3	-171.5	0	109.8	N67 R68 R69 V73 R74 I75	N67-K71 WeakPolarHBondContact O-CG 3.36Å; N67-K71 PolarHBondContact O-N 3.36Å; R68-K71 WeakPolarHBondContact O-CA 3.49Å; R68-K71 WeakPolarHBondContact O-CB 3.38Å; R68-K71 PolarHBondContact O-N 2.94Å; R69-K71 VanDerWaalsContact C-N 3.3Å; R69-K71 PolarHBondContact O-N 2.98Å; K71-V73 PolarHBondContact O-N 3.13Å; K71-R74 CarbonylContact O-C 3.57Å; K71-R74 WeakPolarHBondContact O-CA 3.49Å; K71-R74 PolarHBondContact O-N 3.49Å; K71-I75 WeakPolarHBondContact O-CG1 3.24Å; K71-I75 PolarHBondContact O-N 2.85Å
72	D	73.4	Confident	74.9	Confident	68 Å²	68	104.6 Å²	104.6	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-50.6	-56.5	-179.9	-48.4	-29.5	0	0	0	110.4	R68 R69 R74 I75 D76	R68-D72 VanDerWaalsContact C-OD2 3.23Å; R68-D72 PolarHBondContact O-N 3.33Å; R68-D72 VanDerWaalsContact O-OD2 3.05Å; R69-D72 WeakPolarHBondContact CA-OD2 3.29Å; R69-D72 PolarHBondContact N-OD2 3.14Å; D72-R74 VanDerWaalsContact C-N 3.25Å; D72-R74 PolarHBondContact O-N 3.41Å; D72-R74 VanDerWaalsContact O-N 3.13Å; D72-I75 WeakPolarHBondContact O-CB 3.49Å; D72-I75 PolarHBondContact O-N 3.45Å; D72-D76 PolarHBondContact O-N 2.94Å
73	V	74.9	Confident	73.8	Confident	96 Å²	96	106.1 Å²	106.1	58%	0.582	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-27.6	178.4	172.7	0	0	0	0	114.2	R69 K71 S77	R69-V73 WeakPolarHBondContact O-CG2 3.28Å; R69-V73 PolarHBondContact O-N 3.16Å; R69-V73 VanDerWaalsContact O-N 3.13Å; K71-V73 PolarHBondContact O-N 3.13Å; V73-S77 WeakPolarHBondContact O-CB 3.28Å; V73-S77 PolarHBondContact O-N 3.05Å; V73-S77 VanDerWaalsContact O-N 3.16Å; V73-S77 PolarHBondContact O-OG 2.82Å
74	R	75.6	Confident	73.3	Confident	154 Å²	154	102.8 Å²	102.8	58%	0.581	50%	0.495	S	S	*	.	H	α-helix	trans	-85.2	-19.3	176.5	-84.4	-172	-65.1	154.9	2.4	113.5	W70 K71 D72 A78	W70-R74 VanDerWaalsContact O-CZ 3.31Å; W70-R74 PolarHBondContact O-NE 2.91Å; W70-R74 PolarHBondContact O-NH2 2.87Å; K71-R74 CarbonylContact O-C 3.57Å; K71-R74 WeakPolarHBondContact O-CA 3.49Å; K71-R74 PolarHBondContact O-N 3.49Å; D72-R74 VanDerWaalsContact C-N 3.25Å; D72-R74 PolarHBondContact O-N 3.41Å; D72-R74 VanDerWaalsContact O-N 3.13Å; R74-A78 VanDerWaalsContact O-CB 3.23Å; R74-A78 WeakPolarHBondContact O-CB 3.46Å; R74-A78 PolarHBondContact O-N 3.46Å
75	I	70.1	Confident	72.2	Confident	96 Å²	96	101 Å²	101	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-79.4	-48.7	171.2	-69	164.6	0	0	0	107.8	K71 D72 S77 A78 I79	K71-I75 WeakPolarHBondContact O-CG1 3.24Å; K71-I75 PolarHBondContact O-N 2.85Å; D72-I75 WeakPolarHBondContact O-CB 3.49Å; D72-I75 PolarHBondContact O-N 3.45Å; I75-S77 PolarHBondContact O-N 3.05Å; I75-A78 PolarHBondContact O-N 3.33Å; I75-I79 HydrophobicContact CG2-CD1 3.75Å; I75-I79 HydrophobicContact CG2-CG1 4.47Å; I75-I79 WeakPolarHBondContact O-CG1 3.31Å; I75-I79 PolarHBondContact O-N 3.06Å
76	D	67.7	Low	70.9	Confident	100 Å²	100	100.6 Å²	100.6	54%	0.535	50%	0.498	S	S	.	.	H	α-helix	trans	-55.6	-48.2	176.8	-61.3	-21.3	0	0	0	111.5	D72 A78 I79 D80	D72-D76 PolarHBondContact O-N 2.94Å; D76-A78 VanDerWaalsContact C-N 3.29Å; D76-A78 PolarHBondContact O-N 3.26Å; D76-I79 PolarHBondContact O-N 2.93Å; D76-D80 WeakPolarHBondContact O-CB 3.41Å; D76-D80 PolarHBondContact O-N 3.31Å
77	S	73.9	Confident	69.7	Low	66 Å²	66	99.5 Å²	99.5	46%	0.462	49%	0.494	S	S	.	.	H	α-helix	trans	-72.4	-17.2	178.4	75.1	0	0	0	0	114.5	V73 I75 L81	V73-S77 WeakPolarHBondContact O-CB 3.28Å; V73-S77 PolarHBondContact O-N 3.05Å; V73-S77 VanDerWaalsContact O-N 3.16Å; V73-S77 PolarHBondContact O-OG 2.82Å; I75-S77 PolarHBondContact O-N 3.05Å; S77-L81 VanDerWaalsContact O-CB 3.31Å; S77-L81 WeakPolarHBondContact O-CB 3.34Å; S77-L81 PolarHBondContact O-N 2.9Å
78	A	69.1	Low	68.4	Low	47 Å²	47	100.5 Å²	100.5	39%	0.388	50%	0.499	S	S	.	.	H	α-helix	trans	-84.7	-33.6	173.3	0	0	0	0	0	111.1	R74 I75 D76 V82	R74-A78 VanDerWaalsContact O-CB 3.23Å; R74-A78 WeakPolarHBondContact O-CB 3.46Å; R74-A78 PolarHBondContact O-N 3.46Å; I75-A78 PolarHBondContact O-N 3.33Å; D76-A78 VanDerWaalsContact C-N 3.29Å; D76-A78 PolarHBondContact O-N 3.26Å; A78-V82 WeakPolarHBondContact O-CB 3.41Å; A78-V82 VanDerWaalsContact O-CG2 3.28Å; A78-V82 WeakPolarHBondContact O-CG2 3.5Å; A78-V82 PolarHBondContact O-N 2.89Å
79	I	68.1	Low	67.1	Low	88 Å²	88	97.9 Å²	97.9	45%	0.451	49%	0.494	S	S	.	.	H	α-helix	trans	-65.9	-52.4	171.2	-67	164.8	0	0	0	109.6	I75 D76 L81 V82 D83	I75-I79 HydrophobicContact CG2-CD1 3.75Å; I75-I79 HydrophobicContact CG2-CG1 4.47Å; I75-I79 WeakPolarHBondContact O-CG1 3.31Å; I75-I79 PolarHBondContact O-N 3.06Å; D76-I79 PolarHBondContact O-N 2.93Å; I79-L81 VanDerWaalsContact C-N 3.26Å; I79-L81 PolarHBondContact O-N 2.97Å; I79-V82 PolarHBondContact O-N 3Å; I79-D83 PolarHBondContact O-N 3.39Å
80	D	70.9	Confident	65.9	Low	114 Å²	114	92.9 Å²	92.9	61%	0.61	48%	0.484	S	S	*	.	H	α-helix	trans	-57.3	-37.6	178	-171.3	57.1	0	0	0	112.3	D76 N84	D76-D80 WeakPolarHBondContact O-CB 3.41Å; D76-D80 PolarHBondContact O-N 3.31Å; D80-N84 WeakPolarHBondContact O-CB 3.47Å; D80-N84 PolarHBondContact O-N 3.01Å
81	L	71.6	Confident	65.2	Low	90 Å²	90	87.3 Å²	87.3	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-67.3	-44.9	173.5	-179.7	62.9	0	0	0	112.6	S77 I79 N84 E85	S77-L81 VanDerWaalsContact O-CB 3.31Å; S77-L81 WeakPolarHBondContact O-CB 3.34Å; S77-L81 PolarHBondContact O-N 2.9Å; I79-L81 VanDerWaalsContact C-N 3.26Å; I79-L81 PolarHBondContact O-N 2.97Å; L81-N84 PolarHBondContact O-N 2.9Å; L81-E85 HydrophobicContact CD1-CG 4.22Å; L81-E85 WeakPolarHBondContact O-CB 3.17Å; L81-E85 WeakPolarHBondContact O-CG 3.38Å; L81-E85 PolarHBondContact O-N 3.25Å
82	V	69.8	Low	64	Low	89 Å²	89	87.8 Å²	87.8	54%	0.539	47%	0.474	S	S	.	.	H	α-helix	trans	-68	-41.4	-179.9	166.2	0	0	0	0	111.5	A78 I79 E85 S86	A78-V82 WeakPolarHBondContact O-CB 3.41Å; A78-V82 VanDerWaalsContact O-CG2 3.28Å; A78-V82 WeakPolarHBondContact O-CG2 3.5Å; A78-V82 PolarHBondContact O-N 2.89Å; I79-V82 PolarHBondContact O-N 3Å; V82-E85 PolarHBondContact O-N 3.47Å; V82-S86 WeakPolarHBondContact O-CB 3.46Å; V82-S86 PolarHBondContact O-N 3.5Å
83	D	59.9	Low	62.7	Low	96 Å²	96	87.2 Å²	87.2	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-46.6	175.3	-74.7	-14.9	0	0	0	110.1	I79 S86 H87	I79-D83 PolarHBondContact O-N 3.39Å; D83-S86 PolarHBondContact O-N 3.31Å; D83-S86 PolarHBondContact O-OG 3.13Å; D83-H87 WeakPolarHBondContact O-CB 3.47Å; D83-H87 PolarHBondContact O-N 3.12Å
84	N	71.6	Confident	61.4	Low	80 Å²	80	91.1 Å²	91.1	43%	0.428	48%	0.48	S	S	.	.	H	α-helix	trans	-65	-42.6	176.9	-177.3	56.3	0	0	0	113	D80 L81 S86 H87 I88	D80-N84 WeakPolarHBondContact O-CB 3.47Å; D80-N84 PolarHBondContact O-N 3.01Å; L81-N84 PolarHBondContact O-N 2.9Å; N84-S86 PolarHBondContact O-N 2.88Å; N84-H87 PolarHBondContact O-N 3.33Å; N84-I88 WeakPolarHBondContact O-CB 3.46Å; N84-I88 VanDerWaalsContact O-CG1 3.31Å; N84-I88 WeakPolarHBondContact O-CG1 3.44Å; N84-I88 PolarHBondContact O-N 3.47Å
85	E	60.7	Low	60.1	Low	101 Å²	101	90.6 Å²	90.6	47%	0.472	49%	0.489	S	S	.	.	H	α-helix	trans	-61.3	-43.2	173.2	-79.6	-174.8	-176.9	0	0	111.1	L81 V82 H87 I88 I89	L81-E85 HydrophobicContact CD1-CG 4.22Å; L81-E85 WeakPolarHBondContact O-CB 3.17Å; L81-E85 WeakPolarHBondContact O-CG 3.38Å; L81-E85 PolarHBondContact O-N 3.25Å; V82-E85 PolarHBondContact O-N 3.47Å; E85-H87 VanDerWaalsContact C-N 3.32Å; E85-H87 PolarHBondContact O-N 3.28Å; E85-I88 PolarHBondContact O-N 3.45Å; E85-I89 HydrophobicContact CB-CD1 4.48Å; E85-I89 VanDerWaalsContact O-CB 3.26Å; E85-I89 WeakPolarHBondContact O-CB 3.26Å; E85-I89 WeakPolarHBondContact O-CD1 3.19Å; E85-I89 WeakPolarHBondContact O-CG1 3.37Å; E85-I89 PolarHBondContact O-N 3.39Å
86	S	55.6	Low	58.8	Low	66 Å²	66	90.8 Å²	90.8	46%	0.462	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-38.4	176.8	82.9	0	0	0	0	112.5	V82 D83 N84 S90	V82-S86 WeakPolarHBondContact O-CB 3.46Å; V82-S86 PolarHBondContact O-N 3.5Å; D83-S86 PolarHBondContact O-N 3.31Å; D83-S86 PolarHBondContact O-OG 3.13Å; N84-S86 PolarHBondContact O-N 2.88Å; S86-S90 VanDerWaalsContact O-CB 3.24Å; S86-S90 WeakPolarHBondContact O-CB 3.31Å; S86-S90 PolarHBondContact O-N 2.76Å; S86-S90 PolarHBondContact O-OG 2.85Å
87	H	51.4	Low	57.5	Low	108 Å²	108	90.1 Å²	90.1	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-73.9	-38.5	179.6	-162.5	-74.5	0	0	0	112.2	D83 N84 E85 S90 S91	D83-H87 WeakPolarHBondContact O-CB 3.47Å; D83-H87 PolarHBondContact O-N 3.12Å; N84-H87 PolarHBondContact O-N 3.33Å; E85-H87 VanDerWaalsContact C-N 3.32Å; E85-H87 PolarHBondContact O-N 3.28Å; H87-S90 PolarHBondContact O-OG 3.41Å; H87-S91 VanDerWaalsContact O-CB 3.31Å; H87-S91 WeakPolarHBondContact O-CB 3.14Å; H87-S91 PolarHBondContact O-N 3.4Å; H87-S91 PolarHBondContact O-OG 2.84Å
88	I	53.5	Low	56.2	Low	74 Å²	74	96.8 Å²	96.8	38%	0.379	51%	0.514	S	S	.	.	H	α-helix	trans	-67.5	-51.1	174	-68.9	169.1	0	0	0	109.9	N84 E85 S90 S91 E92	N84-I88 WeakPolarHBondContact O-CB 3.46Å; N84-I88 VanDerWaalsContact O-CG1 3.31Å; N84-I88 WeakPolarHBondContact O-CG1 3.44Å; N84-I88 PolarHBondContact O-N 3.47Å; E85-I88 PolarHBondContact O-N 3.45Å; I88-S90 VanDerWaalsContact C-N 3.34Å; I88-S90 PolarHBondContact O-N 2.98Å; I88-S91 PolarHBondContact O-N 3.3Å; I88-S91 PolarHBondContact O-OG 2.97Å; I88-E92 WeakPolarHBondContact O-CB 3.36Å; I88-E92 PolarHBondContact O-N 3.03Å
89	I	52.3	Low	54.7	Low	85 Å²	85	99.4 Å²	99.4	44%	0.436	52%	0.52	S	S	.	.	H	α-helix	trans	-58	-46.3	179.4	-69.9	167	0	0	0	110.9	E85 L93	E85-I89 HydrophobicContact CB-CD1 4.48Å; E85-I89 VanDerWaalsContact O-CB 3.26Å; E85-I89 WeakPolarHBondContact O-CB 3.26Å; E85-I89 WeakPolarHBondContact O-CD1 3.19Å; E85-I89 WeakPolarHBondContact O-CG1 3.37Å; E85-I89 PolarHBondContact O-N 3.39Å; I89-L93 HydrophobicContact CG2-CD1 3.64Å; I89-L93 WeakPolarHBondContact O-CB 3.3Å; I89-L93 VanDerWaalsContact O-CD1 3.3Å; I89-L93 WeakPolarHBondContact O-CD1 3.24Å; I89-L93 PolarHBondContact O-N 2.97Å
90	S	53.1	Low	53.3	Low	55 Å²	55	97.7 Å²	97.7	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-69.2	-39.1	-179.5	58	0	0	0	0	113.3	S86 H87 I88 K94	S86-S90 VanDerWaalsContact O-CB 3.24Å; S86-S90 WeakPolarHBondContact O-CB 3.31Å; S86-S90 PolarHBondContact O-N 2.76Å; S86-S90 PolarHBondContact O-OG 2.85Å; H87-S90 PolarHBondContact O-OG 3.41Å; I88-S90 VanDerWaalsContact C-N 3.34Å; I88-S90 PolarHBondContact O-N 2.98Å; S90-K94 WeakPolarHBondContact O-CB 3.35Å; S90-K94 PolarHBondContact O-N 3.02Å
91	S	53.1	Low	51.7	Low	48 Å²	48	97.6 Å²	97.6	34%	0.336	53%	0.527	S	S	.	.	H	α-helix	trans	-73.5	-39.7	177.3	57.7	0	0	0	0	112.8	H87 I88 K94 N95	H87-S91 VanDerWaalsContact O-CB 3.31Å; H87-S91 WeakPolarHBondContact O-CB 3.14Å; H87-S91 PolarHBondContact O-N 3.4Å; H87-S91 PolarHBondContact O-OG 2.84Å; I88-S91 PolarHBondContact O-N 3.3Å; I88-S91 PolarHBondContact O-OG 2.97Å; S91-K94 PolarHBondContact O-N 2.96Å; S91-N95 PolarHBondContact O-N 3.36Å; S91-N95 VanDerWaalsContact O-N 3.13Å
92	E	48.6	Very low	50.5	Low	122 Å²	122	103.7 Å²	103.7	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-75.3	-38.2	-177.3	-161.9	160.7	-146.6	0	0	112	I88 N95 T96	I88-E92 WeakPolarHBondContact O-CB 3.36Å; I88-E92 PolarHBondContact O-N 3.03Å; E92-N95 PolarHBondContact O-N 2.89Å; E92-T96 HydrophobicContact CG-CG2 4.43Å; E92-T96 WeakPolarHBondContact O-CB 3.28Å; E92-T96 VanDerWaalsContact O-CG2 3.28Å; E92-T96 WeakPolarHBondContact O-CG2 3.31Å; E92-T96 PolarHBondContact O-N 3.27Å; E92-T96 PolarHBondContact O-OG1 2.71Å
93	L	46.1	Very low	48.8	Very low	57 Å²	57	102.1 Å²	102.1	30%	0.298	53%	0.534	S	S	.	.	H	α-helix	trans	-65.9	-40	169	-91.5	115.7	0	0	0	112.6	I89 N95 T96 L97 F105	I89-L93 HydrophobicContact CG2-CD1 3.64Å; I89-L93 WeakPolarHBondContact O-CB 3.3Å; I89-L93 VanDerWaalsContact O-CD1 3.3Å; I89-L93 WeakPolarHBondContact O-CD1 3.24Å; I89-L93 PolarHBondContact O-N 2.97Å; L93-N95 PolarHBondContact O-N 3.04Å; L93-T96 PolarHBondContact O-N 2.69Å; L93-L97 HydrophobicContact CD2-CD1 3.83Å; L93-L97 HydrophobicContact CG-CD1 4.45Å; L93-L97 PolarHBondContact O-N 3.22Å; L93-L97 VanDerWaalsContact O-N 3.1Å; L93-F105 HydrophobicContact CD2-CZ 4.45Å
94	K	47.7	Very low	47.9	Very low	178 Å²	178	104.1 Å²	104.1	77%	0.774	54%	0.54	S	S	*	.	H	α-helix	trans	-63.4	-29.1	179.6	-174.1	179.8	179.8	-170.1	0	112.5	S90 S91	S90-K94 WeakPolarHBondContact O-CB 3.35Å; S90-K94 PolarHBondContact O-N 3.02Å; S91-K94 PolarHBondContact O-N 2.96Å
95	N	47	Very low	46.2	Very low	142 Å²	142	106.7 Å²	106.7	76%	0.759	55%	0.548	S	S	*	.	H	α-helix	trans	-89.6	-30.1	176.1	-71.9	-15.7	0	0	0	114.1	S91 E92 L93	S91-N95 PolarHBondContact O-N 3.36Å; S91-N95 VanDerWaalsContact O-N 3.13Å; E92-N95 PolarHBondContact O-N 2.89Å; L93-N95 PolarHBondContact O-N 3.04Å
96	T	43	Very low	45.4	Very low	100 Å²	100	108.7 Å²	108.7	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-91.6	-18.4	-174.6	53.5	0	0	0	0	114.8	E92 L93	E92-T96 HydrophobicContact CG-CG2 4.43Å; E92-T96 WeakPolarHBondContact O-CB 3.28Å; E92-T96 VanDerWaalsContact O-CG2 3.28Å; E92-T96 WeakPolarHBondContact O-CG2 3.31Å; E92-T96 PolarHBondContact O-N 3.27Å; E92-T96 PolarHBondContact O-OG1 2.71Å; L93-T96 PolarHBondContact O-N 2.69Å
97	L	41.3	Very low	45.5	Very low	87 Å²	87	109.7 Å²	109.7	46%	0.455	57%	0.568	S	S	.	*			trans	-138.4	109	-165	-91.6	164.2	0	0	0	114.1	L93 M99	L93-L97 HydrophobicContact CD2-CD1 3.83Å; L93-L97 HydrophobicContact CG-CD1 4.45Å; L93-L97 PolarHBondContact O-N 3.22Å; L93-L97 VanDerWaalsContact O-N 3.1Å; L97-M99 HydrophobicContact CB-CG 3.69Å; L97-M99 HydrophobicContact CD1-CG 4.44Å; L97-M99 HydrophobicContact CD1-SD 4.28Å; L97-M99 HydrophobicContact CD2-CE 4.48Å; L97-M99 HydrophobicContact CD2-CG 4.27Å; L97-M99 HydrophobicContact CG-CG 4.37Å; L97-M99 PolarHBondContact O-N 2.83Å
98	Q	46.3	Very low	46.4	Very low	206 Å²	206	108 Å²	108	96%	0.963	56%	0.564	S	S	*	*			trans	-68.4	76.7	158.3	-73.8	-173.5	-23.6	0	0	110
99	M	36.5	Very low	47.7	Very low	101 Å²	101	111 Å²	111	50%	0.498	58%	0.577	S	S	.	*			trans	-77	144	179.5	-64.4	-129.5	78.3	0	0	112.6	L97 V103	L97-M99 HydrophobicContact CB-CG 3.69Å; L97-M99 HydrophobicContact CD1-CG 4.44Å; L97-M99 HydrophobicContact CD1-SD 4.28Å; L97-M99 HydrophobicContact CD2-CE 4.48Å; L97-M99 HydrophobicContact CD2-CG 4.27Å; L97-M99 HydrophobicContact CG-CG 4.37Å; L97-M99 PolarHBondContact O-N 2.83Å; M99-V103 HydrophobicContact CB-CB 4.41Å; M99-V103 HydrophobicContact CE-CG2 4.03Å; M99-V103 HydrophobicContact SD-CB 4.27Å; M99-V103 HydrophobicContact SD-CG1 4.1Å; M99-V103 HydrophobicContact SD-CG2 4Å
100	A	38.7	Very low	49.3	Very low	53 Å²	53	114.3 Å²	114.3	44%	0.438	59%	0.588	S	S	.	*			trans	-68	154.4	174.6	0	0	0	0	0	112.1	W102 V103	A100-W102 PolarHBondContact O-N 3.31Å; A100-V103 PolarHBondContact O-N 3.1Å; A100-V103 VanDerWaalsContact O-N 3.14Å
101	S	38.9	Very low	50.9	Low	111 Å²	111	112 Å²	112	78%	0.776	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	5.4	-169.1	53.3	0	0	0	0	117.6	H104	S101-H104 PolarHBondContact O-CE1 3.04Å
102	W	45.7	Very low	52.5	Low	219 Å²	219	115.4 Å²	115.4	83%	0.83	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-6.3	178.4	57.4	-83.2	0	0	0	113.9	A100	A100-W102 PolarHBondContact O-N 3.31Å
103	V	34.4	Very low	54.6	Low	56 Å²	56	118.2 Å²	118.2	34%	0.339	59%	0.588	S	S	.	*			trans	-87.5	121.7	162.9	-176.3	0	0	0	0	107.8	M99 A100	M99-V103 HydrophobicContact CB-CB 4.41Å; M99-V103 HydrophobicContact CE-CG2 4.03Å; M99-V103 HydrophobicContact SD-CB 4.27Å; M99-V103 HydrophobicContact SD-CG1 4.1Å; M99-V103 HydrophobicContact SD-CG2 4Å; A100-V103 PolarHBondContact O-N 3.1Å; A100-V103 VanDerWaalsContact O-N 3.14Å
104	H	39.4	Very low	56.7	Low	137 Å²	137	116.9 Å²	116.9	63%	0.634	58%	0.582	S	S	*	*			trans	-136.3	132.7	179.2	-84.9	25.3	0	0	0	109.9	S101	S101-H104 PolarHBondContact O-CE1 3.04Å
105	F	36.5	Very low	58.9	Low	135 Å²	135	109.5 Å²	109.5	59%	0.592	55%	0.551	S	S	*	*			trans	-80.6	146.3	170.4	-65.5	-86.4	0	0	0	110.4	L93 D107	L93-F105 HydrophobicContact CD2-CZ 4.45Å; F105-D107 VanDerWaalsContact C-N 3.31Å; F105-D107 PolarHBondContact O-N 2.68Å
106	T	43.8	Very low	61.1	Low	142 Å²	142	109 Å²	109	87%	0.871	54%	0.542	S	S	*	.	S	Bend	trans	-88.5	48	-159.1	44.8	0	0	0	0	114.9
107	D	58.2	Low	63.5	Low	88 Å²	88	108 Å²	108	47%	0.471	54%	0.536	S	S	.	.			trans	-98.8	-8.2	-178.8	-90.5	53.1	0	0	0	114.4	F105 R169	F105-D107 VanDerWaalsContact C-N 3.31Å; F105-D107 PolarHBondContact O-N 2.68Å; D107-R169 WeakPolarHBondContact O-CG 3.39Å; D107-R169 IonicContact OD2-CZ 3.59Å; D107-R169 VanDerWaalsContact OD2-CZ 3.31Å; D107-R169 IonicContact OD2-NE 3.89Å; D107-R169 PolarHBondContact OD2-NE 3.34Å; D107-R169 IonicContact OD2-NH2 3.33Å; D107-R169 PolarHBondContact OD2-NH2 3.36Å
108	V	69.6	Low	65.9	Low	71 Å²	71	105.7 Å²	105.7	43%	0.43	52%	0.523	S	S	.	.			trans	-131.8	112.4	-171.3	-177.4	0	0	0	0	110.9
109	E	82.1	Confident	68.1	Low	137 Å²	137	101.9 Å²	101.9	64%	0.64	51%	0.506	S	S	*	.	B	Isolated β-bridge	trans	-81.7	142	-178.9	-63.6	-166.7	158.9	0	0	112.6	V111 G167 M168	E109-V111 PolarHBondContact O-N 3.3Å; E109-G167 CarbonylContact O-C 3.5Å; E109-G167 WeakPolarHBondContact O-CA 3.09Å; E109-M168 PolarHBondContact N-O 3.31Å; E109-M168 PolarHBondContact O-N 2.98Å
110	K	84.5	Confident	70.8	Confident	155 Å²	155	104.3 Å²	104.3	67%	0.674	52%	0.516	S	S	*	.			trans	-92.1	92.3	178.8	-72.5	178.4	178.2	172.1	0	111.5	Q112	K110-Q112 VanDerWaalsContact C-N 3.28Å; K110-Q112 PolarHBondContact O-N 3.47Å
111	V	86.7	Confident	73.4	Confident	8 Å²	8	103.7 Å²	103.7	5%	0.048	51%	0.51	C	S	.	.			trans	-81.2	59.4	-168.5	-149.3	0	0	0	0	114.2	E109 W113 V114 N115 M168	E109-V111 PolarHBondContact O-N 3.3Å; V111-W113 HydrophobicContact CG1-CD2 4.41Å; V111-W113 HydrophobicContact CG1-CG 4.46Å; V111-W113 HydrophobicContact CG1-CZ2 4.25Å; V111-W113 PolarHBondContact O-N 3.13Å; V111-W113 VanDerWaalsContact O-N 3.1Å; V111-V114 HydrophobicContact CB-CB 4.37Å; V111-V114 HydrophobicContact CB-CG2 4.37Å; V111-V114 HydrophobicContact CG1-CB 3.91Å; V111-V114 HydrophobicContact CG1-CG2 3.45Å; V111-V114 VanDerWaalsContact CG1-CG2 3.45Å; V111-V114 PolarHBondContact O-N 3.2Å; V111-V114 VanDerWaalsContact O-N 3.07Å; V111-N115 PolarHBondContact O-N 3.41Å; V111-M168 HydrophobicContact CG2-CB 3.37Å; V111-M168 HydrophobicContact CG2-CE 4.01Å; V111-M168 HydrophobicContact CG2-CG 4.37Å; V111-M168 HydrophobicContact CG2-SD 4.2Å
112	Q	88.5	Confident	75.9	Confident	118 Å²	118	99.2 Å²	99.2	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-61.4	-22.3	-175.4	-64.5	-62.7	-5.2	0	0	114.7	K110 N115 K116	K110-Q112 VanDerWaalsContact C-N 3.28Å; K110-Q112 PolarHBondContact O-N 3.47Å; Q112-N115 PolarHBondContact OE1-ND2 2.89Å; Q112-K116 PolarHBondContact O-N 3.42Å
113	W	91.3	Very high	78.1	Confident	182 Å²	182	92.7 Å²	92.7	69%	0.689	46%	0.462	S	S	*	.	H	α-helix	trans	-73.7	-36.3	175.5	69.7	-97.4	0	0	0	112.1	V111 N115 K116 V117	V111-W113 HydrophobicContact CG1-CD2 4.41Å; V111-W113 HydrophobicContact CG1-CG 4.46Å; V111-W113 HydrophobicContact CG1-CZ2 4.25Å; V111-W113 PolarHBondContact O-N 3.13Å; V111-W113 VanDerWaalsContact O-N 3.1Å; W113-N115 VanDerWaalsContact C-N 3.33Å; W113-N115 PolarHBondContact O-N 3.45Å; W113-K116 PolarHBondContact O-N 2.8Å; W113-V117 HydrophobicContact CE3-CG2 4.22Å; W113-V117 HydrophobicContact CZ3-CG2 4.48Å; W113-V117 WeakPolarHBondContact O-CG2 3.43Å; W113-V117 PolarHBondContact O-N 2.91Å; W113-V117 VanDerWaalsContact O-N 3.1Å
114	V	91.4	Very high	80.8	Confident	29 Å²	29	96.9 Å²	96.9	18%	0.176	48%	0.476	C	S	.	.	H	α-helix	trans	-65.6	-38.6	175	173.7	0	0	0	0	110.6	V111 K116 V117 L118 I165	V111-V114 HydrophobicContact CB-CB 4.37Å; V111-V114 HydrophobicContact CB-CG2 4.37Å; V111-V114 HydrophobicContact CG1-CB 3.91Å; V111-V114 HydrophobicContact CG1-CG2 3.45Å; V111-V114 VanDerWaalsContact CG1-CG2 3.45Å; V111-V114 PolarHBondContact O-N 3.2Å; V111-V114 VanDerWaalsContact O-N 3.07Å; V114-K116 VanDerWaalsContact C-N 3.27Å; V114-K116 PolarHBondContact O-N 3.26Å; V114-V117 CarbonylContact O-C 3.47Å; V114-V117 PolarHBondContact O-N 3.32Å; V114-L118 HydrophobicContact CG1-CD1 3.95Å; V114-L118 HydrophobicContact CG1-CG 4.11Å; V114-L118 WeakPolarHBondContact O-CG 3.24Å; V114-L118 PolarHBondContact O-N 2.64Å; V114-I165 HydrophobicContact CG1-CD1 3.74Å
115	N	93.1	Very high	83.2	Confident	22 Å²	22	94 Å²	94	12%	0.118	46%	0.462	C	S	.	.	H	α-helix	trans	-58.1	-39	175.2	-69.7	-30.5	0	0	0	112.2	V111 Q112 W113 L118 E119 I165	V111-N115 PolarHBondContact O-N 3.41Å; Q112-N115 PolarHBondContact OE1-ND2 2.89Å; W113-N115 VanDerWaalsContact C-N 3.33Å; W113-N115 PolarHBondContact O-N 3.45Å; N115-L118 PolarHBondContact O-N 3Å; N115-E119 WeakPolarHBondContact O-CB 3.4Å; N115-E119 PolarHBondContact O-N 3.19Å; N115-I165 PolarHBondContact ND2-O 3.19Å; N115-I165 PolarHBondContact OD1-N 3.06Å; N115-I165 PolarHBondContact OD1-O 2.99Å
116	K	92.7	Very high	85.6	Confident	132 Å²	132	88.5 Å²	88.5	57%	0.574	44%	0.443	S	S	*	.	H	α-helix	trans	-69.4	-34.7	174.4	-67	178.9	179	-176.2	0	113.1	Q112 W113 V114 Q120	Q112-K116 PolarHBondContact O-N 3.42Å; W113-K116 PolarHBondContact O-N 2.8Å; V114-K116 VanDerWaalsContact C-N 3.27Å; V114-K116 PolarHBondContact O-N 3.26Å; K116-Q120 WeakPolarHBondContact O-CG 3.43Å; K116-Q120 PolarHBondContact O-N 3.45Å
117	V	93.9	Very high	87.8	Confident	79 Å²	79	87.9 Å²	87.9	48%	0.479	43%	0.432	S	S	.	.	H	α-helix	trans	-68.1	-42.2	173.6	174.3	0	0	0	0	110.5	W113 V114 Q120 A121	W113-V117 HydrophobicContact CE3-CG2 4.22Å; W113-V117 HydrophobicContact CZ3-CG2 4.48Å; W113-V117 WeakPolarHBondContact O-CG2 3.43Å; W113-V117 PolarHBondContact O-N 2.91Å; W113-V117 VanDerWaalsContact O-N 3.1Å; V114-V117 CarbonylContact O-C 3.47Å; V114-V117 PolarHBondContact O-N 3.32Å; V117-Q120 PolarHBondContact O-N 3.08Å; V117-A121 WeakPolarHBondContact O-CB 3.38Å; V117-A121 PolarHBondContact O-N 2.86Å
118	L	92	Very high	89.2	Confident	38 Å²	38	88.3 Å²	88.3	20%	0.199	43%	0.428	C	S	.	.	H	α-helix	trans	-62.5	-41.1	175.3	-71.9	171.6	0	0	0	112	V114 N115 Q120 A121 W122 L163 I165	V114-L118 HydrophobicContact CG1-CD1 3.95Å; V114-L118 HydrophobicContact CG1-CG 4.11Å; V114-L118 WeakPolarHBondContact O-CG 3.24Å; V114-L118 PolarHBondContact O-N 2.64Å; N115-L118 PolarHBondContact O-N 3Å; L118-Q120 PolarHBondContact O-N 2.72Å; L118-A121 PolarHBondContact O-N 2.88Å; L118-W122 WeakPolarHBondContact O-CA 3.32Å; L118-W122 WeakPolarHBondContact O-CB 3.44Å; L118-W122 PolarHBondContact O-N 2.88Å; L118-L163 HydrophobicContact CD1-CB 4.48Å; L118-I165 HydrophobicContact CD1-CD1 4.17Å; L118-I165 HydrophobicContact CD1-CG1 4.14Å
119	E	92.6	Very high	90.1	Very high	127 Å²	127	86.6 Å²	86.6	59%	0.593	42%	0.416	S	S	*	.	H	α-helix	trans	-59.3	-43.2	174.7	-175.3	174	-145.5	0	0	112.3	N115 P162	N115-E119 WeakPolarHBondContact O-CB 3.4Å; N115-E119 PolarHBondContact O-N 3.19Å; E119-P162 HydrophobicContact CB-CG 4.12Å; E119-P162 HydrophobicContact CG-CG 4.39Å
120	Q	92.4	Very high	90.5	Very high	152 Å²	152	83.3 Å²	83.3	71%	0.71	40%	0.4	S	S	*	.	H	α-helix	trans	-74.3	-34.7	176.2	-67.2	175.6	15.3	0	0	113.1	K116 V117 L118	K116-Q120 WeakPolarHBondContact O-CG 3.43Å; K116-Q120 PolarHBondContact O-N 3.45Å; V117-Q120 PolarHBondContact O-N 3.08Å; L118-Q120 PolarHBondContact O-N 2.72Å
121	A	93	Very high	90.8	Very high	39 Å²	39	81.6 Å²	81.6	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-81.5	-12.7	-179.6	0	0	0	0	0	113.7	V117 L118 P123 F124 F125	V117-A121 WeakPolarHBondContact O-CB 3.38Å; V117-A121 PolarHBondContact O-N 2.86Å; L118-A121 PolarHBondContact O-N 2.88Å; A121-P123 VanDerWaalsContact C-CD 3.43Å; A121-F124 WeakPolarHBondContact O-CB 3.39Å; A121-F124 PolarHBondContact O-N 3.29Å; A121-F125 PolarHBondContact O-N 2.8Å
122	W	92.9	Very high	90.8	Very high	17 Å²	17	82.2 Å²	82.2	6%	0.064	40%	0.396	C	S	.	.	H	α-helix	trans	-53.1	-39.9	-171	-163.2	-115.3	0	0	0	115.5	L118 F124 F125 G126 F158 G159 P162 L163 Y188	L118-W122 WeakPolarHBondContact O-CA 3.32Å; L118-W122 WeakPolarHBondContact O-CB 3.44Å; L118-W122 PolarHBondContact O-N 2.88Å; W122-F124 VanDerWaalsContact C-N 3.32Å; W122-F124 PolarHBondContact O-N 3.4Å; W122-F125 HydrophobicContact CD2-CD1 4.29Å; W122-F125 HydrophobicContact CE3-CB 4.22Å; W122-F125 AromaticContact CE3-CD1 3.67Å; W122-F125 HydrophobicContact CE3-CD1 3.67Å; W122-F125 HydrophobicContact CE3-CE1 4.38Å; W122-F125 HydrophobicContact CE3-CG 4.15Å; W122-F125 AromaticContact CH2-CD1 3.55Å; W122-F125 HydrophobicContact CH2-CD1 3.55Å; W122-F125 AromaticContact CH2-CE1 3.49Å; W122-F125 HydrophobicContact CH2-CE1 3.49Å; W122-F125 VanDerWaalsContact CH2-CE1 3.49Å; W122-F125 HydrophobicContact CZ2-CD1 4.17Å; W122-F125 HydrophobicContact CZ2-CE1 4.33Å; W122-F125 AromaticContact CZ3-CD1 3.25Å; W122-F125 HydrophobicContact CZ3-CD1 3.25Å; W122-F125 AromaticContact CZ3-CE1 3.51Å; W122-F125 HydrophobicContact CZ3-CE1 3.51Å; W122-F125 HydrophobicContact CZ3-CG 4Å; W122-F125 HydrophobicContact CZ3-CZ 4.43Å; W122-F125 PolarHBondContact O-N 3.21Å; W122-G126 PolarHBondContact O-N 3.29Å; W122-F158 HydrophobicContact CZ2-CB 4.15Å; W122-G159 PolarHBondContact NE1-O 3.27Å; W122-P162 HydrophobicContact CB-CB 4.27Å; W122-P162 HydrophobicContact CD2-CB 3.83Å; W122-P162 HydrophobicContact CE3-CB 3.81Å; W122-P162 HydrophobicContact CG-CB 4.02Å; W122-P162 HydrophobicContact CZ3-CB 4.45Å; W122-L163 HydrophobicContact CH2-CB 4.17Å; W122-L163 HydrophobicContact CZ3-CB 3.72Å; W122-Y188 HydrophobicContact CH2-CD2 4.39Å; W122-Y188 AromaticContact CH2-CE2 3.6Å; W122-Y188 HydrophobicContact CH2-CE2 3.6Å; W122-Y188 AromaticContact CZ2-CE2 3.62Å; W122-Y188 HydrophobicContact CZ2-CE2 3.62Å
123	P	91.4	Very high	90.8	Very high	82 Å²	82	77.4 Å²	77.4	53%	0.532	37%	0.374	S	S	.	.	H	α-helix	trans	-60.6	-40.6	175.7	-23.9	35.5	0	0	0	112.7	A121 G126 M127	A121-P123 VanDerWaalsContact C-CD 3.43Å; P123-G126 PolarHBondContact O-N 2.69Å; P123-M127 WeakPolarHBondContact O-CG 3.38Å; P123-M127 PolarHBondContact O-N 2.72Å
124	F	91.5	Very high	90.8	Very high	145 Å²	145	72.3 Å²	72.3	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-71.8	-35.8	178.3	-54.3	-79.3	0	0	0	111.7	A121 W122 G126 M127 Y128	A121-F124 WeakPolarHBondContact O-CB 3.39Å; A121-F124 PolarHBondContact O-N 3.29Å; W122-F124 VanDerWaalsContact C-N 3.32Å; W122-F124 PolarHBondContact O-N 3.4Å; F124-G126 VanDerWaalsContact C-N 3.35Å; F124-M127 HydrophobicContact CD1-SD 4.46Å; F124-M127 PolarHBondContact O-N 3.02Å; F124-Y128 WeakPolarHBondContact O-CB 3.49Å; F124-Y128 PolarHBondContact O-N 3.03Å
125	F	88.3	Confident	90.6	Very high	76 Å²	76	76.1 Å²	76.1	33%	0.333	37%	0.37	S	S	.	.	H	α-helix	trans	-60.9	-44	169.9	-179.8	-98.8	0	0	0	111.2	A121 W122 M127 Y128 M129	A121-F125 PolarHBondContact O-N 2.8Å; W122-F125 HydrophobicContact CD2-CD1 4.29Å; W122-F125 HydrophobicContact CE3-CB 4.22Å; W122-F125 AromaticContact CE3-CD1 3.67Å; W122-F125 HydrophobicContact CE3-CD1 3.67Å; W122-F125 HydrophobicContact CE3-CE1 4.38Å; W122-F125 HydrophobicContact CE3-CG 4.15Å; W122-F125 AromaticContact CH2-CD1 3.55Å; W122-F125 HydrophobicContact CH2-CD1 3.55Å; W122-F125 AromaticContact CH2-CE1 3.49Å; W122-F125 HydrophobicContact CH2-CE1 3.49Å; W122-F125 VanDerWaalsContact CH2-CE1 3.49Å; W122-F125 HydrophobicContact CZ2-CD1 4.17Å; W122-F125 HydrophobicContact CZ2-CE1 4.33Å; W122-F125 AromaticContact CZ3-CD1 3.25Å; W122-F125 HydrophobicContact CZ3-CD1 3.25Å; W122-F125 AromaticContact CZ3-CE1 3.51Å; W122-F125 HydrophobicContact CZ3-CE1 3.51Å; W122-F125 HydrophobicContact CZ3-CG 4Å; W122-F125 HydrophobicContact CZ3-CZ 4.43Å; W122-F125 PolarHBondContact O-N 3.21Å; F125-M127 PolarHBondContact O-N 3.39Å; F125-Y128 PolarHBondContact O-N 3.14Å; F125-M129 HydrophobicContact CD1-CG 3.95Å; F125-M129 HydrophobicContact CD2-CG 4.23Å; F125-M129 HydrophobicContact CE1-CG 3.53Å; F125-M129 HydrophobicContact CE1-SD 4.43Å; F125-M129 HydrophobicContact CE2-CG 3.84Å; F125-M129 HydrophobicContact CE2-SD 4.04Å; F125-M129 HydrophobicContact CG-CG 4.29Å; F125-M129 HydrophobicContact CZ-CG 3.47Å; F125-M129 VanDerWaalsContact CZ-CG 3.47Å; F125-M129 HydrophobicContact CZ-SD 3.8Å; F125-M129 WeakPolarHBondContact O-CB 3.41Å; F125-M129 VanDerWaalsContact O-CG 3.3Å; F125-M129 WeakPolarHBondContact O-CG 3.19Å; F125-M129 PolarHBondContact O-N 2.87Å
126	G	87.6	Confident	90.1	Very high	19 Å²	19	79.6 Å²	79.6	20%	0.196	39%	0.389	C	S	.	.	H	α-helix	trans	-57.1	-46.6	173.8	0	0	0	0	0	113	W122 P123 F124 M129 E130	W122-G126 PolarHBondContact O-N 3.29Å; P123-G126 PolarHBondContact O-N 2.69Å; F124-G126 VanDerWaalsContact C-N 3.35Å; G126-M129 PolarHBondContact O-N 3.1Å; G126-E130 PolarHBondContact O-N 2.88Å
127	M	89.5	Confident	89.8	Confident	129 Å²	129	76.3 Å²	76.3	64%	0.635	38%	0.377	S	S	*	.	H	α-helix	trans	-61.6	-43.1	175.5	-67.4	170.9	68.5	0	0	112.5	P123 F124 F125 K131	P123-M127 WeakPolarHBondContact O-CG 3.38Å; P123-M127 PolarHBondContact O-N 2.72Å; F124-M127 HydrophobicContact CD1-SD 4.46Å; F124-M127 PolarHBondContact O-N 3.02Å; F125-M127 PolarHBondContact O-N 3.39Å; M127-K131 PolarHBondContact O-N 2.9Å; M127-K131 VanDerWaalsContact O-N 3.12Å
128	Y	89.2	Confident	89.5	Confident	98 Å²	98	73.6 Å²	73.6	38%	0.384	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-45.4	176.1	174	-95.6	0	0	0	111.8	F124 F125 K131 L132 M280	F124-Y128 WeakPolarHBondContact O-CB 3.49Å; F124-Y128 PolarHBondContact O-N 3.03Å; F125-Y128 PolarHBondContact O-N 3.14Å; Y128-K131 WeakPolarHBondContact O-CB 3.36Å; Y128-K131 PolarHBondContact O-N 2.85Å; Y128-L132 HydrophobicContact CE1-CB 4.5Å; Y128-L132 HydrophobicContact CE1-CD2 4.2Å; Y128-L132 WeakPolarHBondContact O-CB 3.35Å; Y128-L132 PolarHBondContact O-N 2.85Å; Y128-M280 HydrophobicContact CE1-CE 4.04Å; Y128-M280 WeakPolarHBondContact OH-CE 3.48Å
129	M	88.3	Confident	89.1	Confident	35 Å²	35	76 Å²	76	17%	0.172	37%	0.369	C	S	.	.	H	α-helix	trans	-68.4	-33.3	180	-70.4	-60.5	-66.4	0	0	112.5	F125 G126 L132 L133 F158	F125-M129 HydrophobicContact CD1-CG 3.95Å; F125-M129 HydrophobicContact CD2-CG 4.23Å; F125-M129 HydrophobicContact CE1-CG 3.53Å; F125-M129 HydrophobicContact CE1-SD 4.43Å; F125-M129 HydrophobicContact CE2-CG 3.84Å; F125-M129 HydrophobicContact CE2-SD 4.04Å; F125-M129 HydrophobicContact CG-CG 4.29Å; F125-M129 HydrophobicContact CZ-CG 3.47Å; F125-M129 VanDerWaalsContact CZ-CG 3.47Å; F125-M129 HydrophobicContact CZ-SD 3.8Å; F125-M129 WeakPolarHBondContact O-CB 3.41Å; F125-M129 VanDerWaalsContact O-CG 3.3Å; F125-M129 WeakPolarHBondContact O-CG 3.19Å; F125-M129 PolarHBondContact O-N 2.87Å; G126-M129 PolarHBondContact O-N 3.1Å; M129-L132 HydrophobicContact CE-CD2 4.07Å; M129-L132 HydrophobicContact SD-CD2 3.75Å; M129-L133 WeakPolarHBondContact O-CB 3.23Å; M129-L133 WeakPolarHBondContact O-CG 3.48Å; M129-L133 PolarHBondContact O-N 2.86Å; M129-F158 HydrophobicContact CB-CD2 3.94Å; M129-F158 HydrophobicContact CB-CE2 3.43Å; M129-F158 VanDerWaalsContact CB-CE2 3.43Å; M129-F158 HydrophobicContact CB-CZ 3.87Å; M129-F158 HydrophobicContact CE-CE1 4.34Å; M129-F158 HydrophobicContact CE-CZ 3.92Å; M129-F158 HydrophobicContact CG-CE2 4.36Å; M129-F158 HydrophobicContact CG-CZ 4.44Å
130	E	90.3	Very high	88.5	Confident	67 Å²	67	73.9 Å²	73.9	31%	0.313	37%	0.365	S	S	.	.	H	α-helix	trans	-61.4	-47.3	169.1	177.2	168.2	-148.6	0	0	111.3	G126 L133 R134 I156	G126-E130 PolarHBondContact O-N 2.88Å; E130-L133 PolarHBondContact O-N 3.1Å; E130-R134 HydrophobicContact CG-CG 4.28Å; E130-R134 WeakPolarHBondContact O-CB 3.2Å; E130-R134 VanDerWaalsContact O-CG 3.3Å; E130-R134 WeakPolarHBondContact O-CG 3.27Å; E130-R134 PolarHBondContact O-N 2.84Å; E130-R134 IonicContact OE1-CZ 2.84Å; E130-R134 IonicContact OE1-NE 2.72Å; E130-R134 PolarHBondContact OE1-NE 2.88Å; E130-R134 IonicContact OE1-NH2 3.84Å; E130-R134 PolarHBondContact OE1-NH2 3.46Å; E130-I156 HydrophobicContact CB-CB 4.34Å; E130-I156 HydrophobicContact CB-CG2 3.98Å; E130-I156 HydrophobicContact CG-CB 4.13Å; E130-I156 HydrophobicContact CG-CD1 3.98Å; E130-I156 HydrophobicContact CG-CG2 4.33Å
131	K	89.7	Confident	88.2	Confident	119 Å²	119	68.5 Å²	68.5	52%	0.517	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-48.9	176.2	-170.9	179.2	177.4	-179.8	0	111.5	M127 Y128 L133 R134 E135	M127-K131 PolarHBondContact O-N 2.9Å; M127-K131 VanDerWaalsContact O-N 3.12Å; Y128-K131 WeakPolarHBondContact O-CB 3.36Å; Y128-K131 PolarHBondContact O-N 2.85Å; K131-L133 VanDerWaalsContact C-N 3.33Å; K131-L133 PolarHBondContact O-N 3.37Å; K131-R134 PolarHBondContact O-N 3.01Å; K131-E135 WeakPolarHBondContact CE-OE1 3.19Å; K131-E135 WeakPolarHBondContact CE-OE2 3.27Å; K131-E135 VanDerWaalsContact CG-CD 3.47Å; K131-E135 HydrophobicContact CG-CG 4.24Å; K131-E135 WeakPolarHBondContact CG-OE1 3.19Å; K131-E135 IonicContact NZ-OE2 3.2Å; K131-E135 WeakPolarHBondContact O-CB 3.08Å; K131-E135 PolarHBondContact O-N 3.46Å
132	L	86.4	Confident	87.8	Confident	22 Å²	22	69.8 Å²	69.8	12%	0.115	34%	0.339	C	S	.	.	H	α-helix	trans	-57.2	-44	178	-177.4	69.6	0	0	0	112.3	Y128 M129 N136 I137 M280	Y128-L132 HydrophobicContact CE1-CB 4.5Å; Y128-L132 HydrophobicContact CE1-CD2 4.2Å; Y128-L132 WeakPolarHBondContact O-CB 3.35Å; Y128-L132 PolarHBondContact O-N 2.85Å; M129-L132 HydrophobicContact CE-CD2 4.07Å; M129-L132 HydrophobicContact SD-CD2 3.75Å; L132-N136 HydrophobicContact CD1-CB 4.31Å; L132-N136 WeakPolarHBondContact O-CB 3.4Å; L132-N136 PolarHBondContact O-N 2.81Å; L132-N136 VanDerWaalsContact O-N 3.1Å; L132-I137 HydrophobicContact CD2-CD1 4.41Å; L132-I137 HydrophobicContact CG-CD1 4.17Å; L132-I137 PolarHBondContact O-N 3.09Å; L132-I137 VanDerWaalsContact O-N 3.12Å; L132-M280 HydrophobicContact CD1-CE 4.07Å; L132-M280 HydrophobicContact CD2-CE 3.76Å; L132-M280 HydrophobicContact CD2-SD 4.31Å
133	L	89.7	Confident	87.1	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.089	35%	0.351	C	S	.	.	I	π-helix	trans	-65.9	-47.7	176.8	-82	167.4	0	0	0	111.8	M129 E130 K131 I137 Q138 F153 I156 F158 I194	M129-L133 WeakPolarHBondContact O-CB 3.23Å; M129-L133 WeakPolarHBondContact O-CG 3.48Å; M129-L133 PolarHBondContact O-N 2.86Å; E130-L133 PolarHBondContact O-N 3.1Å; K131-L133 VanDerWaalsContact C-N 3.33Å; K131-L133 PolarHBondContact O-N 3.37Å; L133-I137 HydrophobicContact CD2-CB 4.16Å; L133-I137 HydrophobicContact CD2-CD1 3.68Å; L133-I137 HydrophobicContact CD2-CG1 4.5Å; L133-I137 HydrophobicContact CD2-CG2 4.14Å; L133-I137 HydrophobicContact CG-CD1 4.21Å; L133-Q138 WeakPolarHBondContact O-CB 3.41Å; L133-Q138 PolarHBondContact O-N 2.98Å; L133-F153 HydrophobicContact CB-CD2 4.1Å; L133-F153 HydrophobicContact CB-CE2 3.97Å; L133-F153 HydrophobicContact CD2-CE1 4.28Å; L133-F153 HydrophobicContact CD2-CE2 3.82Å; L133-F153 HydrophobicContact CD2-CZ 3.61Å; L133-F153 HydrophobicContact CG-CE2 4.49Å; L133-F153 WeakPolarHBondContact O-CD2 3.13Å; L133-F153 WeakPolarHBondContact O-CE2 3.24Å; L133-I156 HydrophobicContact CB-CD1 3.63Å; L133-I156 HydrophobicContact CD1-CD1 4.02Å; L133-I156 HydrophobicContact CD1-CG1 4.09Å; L133-I156 HydrophobicContact CD1-CG2 3.73Å; L133-I156 HydrophobicContact CG-CD1 4.49Å; L133-F158 HydrophobicContact CD1-CE2 3.73Å; L133-F158 HydrophobicContact CD1-CZ 3.72Å; L133-I194 HydrophobicContact CD1-CD1 4.17Å
134	R	91.4	Very high	86.4	Confident	75 Å²	75	72.3 Å²	72.3	28%	0.283	36%	0.355	S	S	.	.	I	π-helix	trans	-71.1	-38.2	-175.8	-70.2	-176.4	-176.8	-69.4	1.4	113.7	E130 K131 Q138 F153 T154 I156	E130-R134 HydrophobicContact CG-CG 4.28Å; E130-R134 WeakPolarHBondContact O-CB 3.2Å; E130-R134 VanDerWaalsContact O-CG 3.3Å; E130-R134 WeakPolarHBondContact O-CG 3.27Å; E130-R134 PolarHBondContact O-N 2.84Å; E130-R134 IonicContact OE1-CZ 2.84Å; E130-R134 IonicContact OE1-NE 2.72Å; E130-R134 PolarHBondContact OE1-NE 2.88Å; E130-R134 IonicContact OE1-NH2 3.84Å; E130-R134 PolarHBondContact OE1-NH2 3.46Å; K131-R134 PolarHBondContact O-N 3.01Å; R134-Q138 WeakPolarHBondContact O-CB 3.1Å; R134-Q138 PolarHBondContact O-NE2 3.06Å; R134-F153 PolarHBondContact NH1-O 2.79Å; R134-T154 PolarHBondContact NH2-O 2.9Å; R134-I156 HydrophobicContact CG-CD1 3.67Å
135	E	86.8	Confident	85.7	Confident	109 Å²	109	68 Å²	68	51%	0.509	34%	0.338	S	S	.	.	I	π-helix	trans	-88.5	-55	-175.7	-64.8	179.1	-177.6	0	0	111.4	K131 Q139	K131-E135 WeakPolarHBondContact CE-OE1 3.19Å; K131-E135 WeakPolarHBondContact CE-OE2 3.27Å; K131-E135 VanDerWaalsContact CG-CD 3.47Å; K131-E135 HydrophobicContact CG-CG 4.24Å; K131-E135 WeakPolarHBondContact CG-OE1 3.19Å; K131-E135 IonicContact NZ-OE2 3.2Å; K131-E135 WeakPolarHBondContact O-CB 3.08Å; K131-E135 PolarHBondContact O-N 3.46Å; E135-Q139 WeakPolarHBondContact O-CB 3.27Å
136	N	81.9	Confident	85	Confident	94 Å²	94	68.1 Å²	68.1	50%	0.503	35%	0.349	S	S	.	.	I	π-helix	trans	-93.4	-52.2	-169.3	-64.1	-13.5	0	0	0	113	L132 T140	L132-N136 HydrophobicContact CD1-CB 4.31Å; L132-N136 WeakPolarHBondContact O-CB 3.4Å; L132-N136 PolarHBondContact O-N 2.81Å; L132-N136 VanDerWaalsContact O-N 3.1Å; N136-T140 WeakPolarHBondContact O-CB 3.37Å; N136-T140 PolarHBondContact O-N 3.41Å; N136-T140 PolarHBondContact O-OG1 2.99Å
137	I	86.3	Confident	84.6	Confident	64 Å²	64	68.9 Å²	68.9	33%	0.328	35%	0.353	S	S	.	.	I	π-helix	trans	-73.1	-44.6	-172.4	-60.5	169.7	0	0	0	110.5	L132 L133 Q139 T140 V141	L132-I137 HydrophobicContact CD2-CD1 4.41Å; L132-I137 HydrophobicContact CG-CD1 4.17Å; L132-I137 PolarHBondContact O-N 3.09Å; L132-I137 VanDerWaalsContact O-N 3.12Å; L133-I137 HydrophobicContact CD2-CB 4.16Å; L133-I137 HydrophobicContact CD2-CD1 3.68Å; L133-I137 HydrophobicContact CD2-CG1 4.5Å; L133-I137 HydrophobicContact CD2-CG2 4.14Å; L133-I137 HydrophobicContact CG-CD1 4.21Å; I137-Q139 VanDerWaalsContact C-N 3.27Å; I137-Q139 PolarHBondContact O-N 2.79Å; I137-T140 WeakPolarHBondContact O-CA 3.34Å; I137-T140 WeakPolarHBondContact O-CB 3.21Å; I137-T140 PolarHBondContact O-N 2.78Å; I137-T140 VanDerWaalsContact O-N 3.07Å; I137-V141 HydrophobicContact CG2-CG2 4.22Å; I137-V141 WeakPolarHBondContact O-CG2 3.2Å; I137-V141 PolarHBondContact O-N 3.15Å
138	Q	89.1	Confident	84.3	Confident	22 Å²	22	63.8 Å²	63.8	10%	0.103	33%	0.328	C	S	.	.	H	α-helix	trans	-54.6	-43	176	-176.3	-178.6	-113.4	0	0	112.1	L133 R134 V141 R142 F151 K152 F153	L133-Q138 WeakPolarHBondContact O-CB 3.41Å; L133-Q138 PolarHBondContact O-N 2.98Å; R134-Q138 WeakPolarHBondContact O-CB 3.1Å; R134-Q138 PolarHBondContact O-NE2 3.06Å; Q138-V141 PolarHBondContact O-N 2.82Å; Q138-R142 WeakPolarHBondContact O-CG 3.25Å; Q138-R142 PolarHBondContact O-N 2.85Å; Q138-F151 HydrophobicContact CG-CD1 4.15Å; Q138-F151 HydrophobicContact CG-CE1 4.42Å; Q138-K152 VanDerWaalsContact OE1-CA 3.26Å; Q138-F153 HydrophobicContact CB-CD2 3.86Å; Q138-F153 HydrophobicContact CB-CE2 3.96Å; Q138-F153 HydrophobicContact CG-CD2 4.29Å
139	Q	83.2	Confident	84	Confident	87 Å²	87	64.6 Å²	64.6	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-70.5	-38.8	177.9	-171.7	60.1	16.5	0	0	111.5	E135 I137 V141 R142 M143	E135-Q139 WeakPolarHBondContact O-CB 3.27Å; I137-Q139 VanDerWaalsContact C-N 3.27Å; I137-Q139 PolarHBondContact O-N 2.79Å; Q139-V141 VanDerWaalsContact C-N 3.34Å; Q139-V141 PolarHBondContact O-N 2.72Å; Q139-R142 PolarHBondContact O-N 3.26Å; Q139-M143 HydrophobicContact CG-CG 4.44Å; Q139-M143 WeakPolarHBondContact O-CG 3.49Å; Q139-M143 PolarHBondContact O-N 3.44Å; Q139-M143 VanDerWaalsContact O-N 3.16Å
140	T	81	Confident	83.8	Confident	83 Å²	83	69 Å²	69	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-42.9	173.3	-57.1	0	0	0	0	112	N136 I137 M143 S144	N136-T140 WeakPolarHBondContact O-CB 3.37Å; N136-T140 PolarHBondContact O-N 3.41Å; N136-T140 PolarHBondContact O-OG1 2.99Å; I137-T140 WeakPolarHBondContact O-CA 3.34Å; I137-T140 WeakPolarHBondContact O-CB 3.21Å; I137-T140 PolarHBondContact O-N 2.78Å; I137-T140 VanDerWaalsContact O-N 3.07Å; T140-M143 PolarHBondContact O-N 2.91Å; T140-S144 PolarHBondContact O-N 3.07Å
141	V	84.4	Confident	83.8	Confident	39 Å²	39	66.8 Å²	66.8	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-68	-38.5	177.4	175.8	0	0	0	0	112.1	I137 Q138 Q139 M143 S144 L148 F151	I137-V141 HydrophobicContact CG2-CG2 4.22Å; I137-V141 WeakPolarHBondContact O-CG2 3.2Å; I137-V141 PolarHBondContact O-N 3.15Å; Q138-V141 PolarHBondContact O-N 2.82Å; Q139-V141 VanDerWaalsContact C-N 3.34Å; Q139-V141 PolarHBondContact O-N 2.72Å; V141-M143 PolarHBondContact O-N 2.74Å; V141-S144 PolarHBondContact O-N 2.86Å; V141-S144 PolarHBondContact O-OG 2.82Å; V141-L148 HydrophobicContact CG1-CD1 3.93Å; V141-L148 WeakPolarHBondContact O-CB 3.47Å; V141-F151 HydrophobicContact CB-CD1 3.81Å; V141-F151 HydrophobicContact CB-CE1 3.99Å; V141-F151 HydrophobicContact CB-CG 4.39Å; V141-F151 HydrophobicContact CG1-CB 4.21Å; V141-F151 HydrophobicContact CG1-CD1 3.5Å; V141-F151 HydrophobicContact CG1-CD2 3.97Å; V141-F151 HydrophobicContact CG1-CE1 3.79Å; V141-F151 HydrophobicContact CG1-CE2 4.22Å; V141-F151 HydrophobicContact CG1-CG 3.61Å; V141-F151 HydrophobicContact CG1-CZ 4.14Å; V141-F151 HydrophobicContact CG2-CE1 4.36Å
142	R	86.2	Confident	84	Confident	66 Å²	66	66 Å²	66	25%	0.249	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-30.3	173.6	-76.8	177.9	-176.6	144.9	9.9	113.9	Q138 Q139 F151	Q138-R142 WeakPolarHBondContact O-CG 3.25Å; Q138-R142 PolarHBondContact O-N 2.85Å; Q139-R142 PolarHBondContact O-N 3.26Å; R142-F151 HydrophobicContact CG-CB 4.19Å; R142-F151 PolarHBondContact NE-O 2.97Å; R142-F151 PolarHBondContact NH2-O 2.94Å
143	M	76.4	Confident	84.3	Confident	66 Å²	66	65.7 Å²	65.7	33%	0.325	34%	0.339	S	S	.	.	H	α-helix	trans	-91.7	-10.9	-174	-59.6	-85.9	-80.6	0	0	112.5	Q139 T140 V141 Y500	Q139-M143 HydrophobicContact CG-CG 4.44Å; Q139-M143 WeakPolarHBondContact O-CG 3.49Å; Q139-M143 PolarHBondContact O-N 3.44Å; Q139-M143 VanDerWaalsContact O-N 3.16Å; T140-M143 PolarHBondContact O-N 2.91Å; V141-M143 PolarHBondContact O-N 2.74Å; M143-Y500 HydrophobicContact CB-CE2 4.43Å; M143-Y500 HydrophobicContact CE-CD2 3.78Å; M143-Y500 WeakPolarHBondContact O-CE2 3.36Å; M143-Y500 HydrophobicContact SD-CD2 3.57Å; M143-Y500 VanDerWaalsContact SD-CD2 3.57Å; M143-Y500 HydrophobicContact SD-CE2 4.34Å; M143-Y500 HydrophobicContact SD-CG 4.33Å
144	S	77.4	Confident	84.5	Confident	87 Å²	87	67.5 Å²	67.5	61%	0.608	35%	0.351	S	S	*	.	H	α-helix	trans	-80.7	-30.9	-177.9	69.9	0	0	0	0	114.1	T140 V141	T140-S144 PolarHBondContact O-N 3.07Å; V141-S144 PolarHBondContact O-N 2.86Å; V141-S144 PolarHBondContact O-OG 2.82Å
145	N	76.1	Confident	84.6	Confident	54 Å²	54	68.5 Å²	68.5	29%	0.289	36%	0.357	S	S	.	.			trans	-146.8	138.8	-179	-173.6	-39.1	0	0	0	111	A147 L148	N145-A147 PolarHBondContact O-N 2.94Å; N145-A147 WeakPolarHBondContact OD1-CB 3.44Å; N145-A147 PolarHBondContact OD1-N 2.62Å; N145-L148 HydrophobicContact CB-CB 4.43Å; N145-L148 HydrophobicContact CB-CD1 3.97Å; N145-L148 HydrophobicContact CB-CG 4.04Å; N145-L148 PolarHBondContact O-N 2.9Å
146	S	74.3	Confident	84.9	Confident	79 Å²	79	64 Å²	64	55%	0.552	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-61.1	-26.3	180	62	0	0	0	0	114	L148 K149	S146-L148 VanDerWaalsContact C-N 3.34Å; S146-K149 WeakPolarHBondContact O-CD 3.4Å; S146-K149 VanDerWaalsContact O-CG 3.31Å; S146-K149 WeakPolarHBondContact O-CG 3.43Å
147	A	79.7	Confident	85.4	Confident	35 Å²	35	63.1 Å²	63.1	29%	0.289	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-76.3	-18	173.4	0	0	0	0	0	113.7	N145 A257 F258	N145-A147 PolarHBondContact O-N 2.94Å; N145-A147 WeakPolarHBondContact OD1-CB 3.44Å; N145-A147 PolarHBondContact OD1-N 2.62Å; A147-A257 HydrophobicContact CB-CB 3.51Å; A147-F258 HydrophobicContact CB-CE1 4.4Å; A147-F258 HydrophobicContact CB-CE2 4.21Å; A147-F258 HydrophobicContact CB-CZ 3.66Å
148	L	82.8	Confident	85.5	Confident	22 Å²	22	61.1 Å²	61.1	12%	0.115	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-92.8	4.8	178.5	-62.5	177.6	0	0	0	113.2	V141 N145 S146 M150 F151 V198 F258	V141-L148 HydrophobicContact CG1-CD1 3.93Å; V141-L148 WeakPolarHBondContact O-CB 3.47Å; N145-L148 HydrophobicContact CB-CB 4.43Å; N145-L148 HydrophobicContact CB-CD1 3.97Å; N145-L148 HydrophobicContact CB-CG 4.04Å; N145-L148 PolarHBondContact O-N 2.9Å; S146-L148 VanDerWaalsContact C-N 3.34Å; L148-M150 PolarHBondContact O-N 2.69Å; L148-F151 HydrophobicContact CB-CB 4.38Å; L148-F151 WeakPolarHBondContact O-CB 3.43Å; L148-F151 PolarHBondContact O-N 3.2Å; L148-V198 HydrophobicContact CD2-CG1 3.56Å; L148-F258 HydrophobicContact CD1-CE1 4.34Å; L148-F258 HydrophobicContact CD1-CZ 4.47Å; L148-F258 HydrophobicContact CD2-CE1 4Å; L148-F258 HydrophobicContact CD2-CE2 4.09Å; L148-F258 HydrophobicContact CD2-CZ 3.38Å; L148-F258 HydrophobicContact CG-CE1 4Å; L148-F258 HydrophobicContact CG-CZ 3.69Å
149	K	82.1	Confident	85.4	Confident	115 Å²	115	60.5 Å²	60.5	50%	0.5	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-26.3	-179	-76.4	175.8	177.9	176.5	0	114.6	S146	S146-K149 WeakPolarHBondContact O-CD 3.4Å; S146-K149 VanDerWaalsContact O-CG 3.31Å; S146-K149 WeakPolarHBondContact O-CG 3.43Å
150	M	85.6	Confident	85.6	Confident	126 Å²	126	64 Å²	64	62%	0.621	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-6.2	176.7	-69.9	-173.9	68.6	0	0	114.3	L148 K152	L148-M150 PolarHBondContact O-N 2.69Å; M150-K152 PolarHBondContact O-N 2.79Å
151	F	89.9	Confident	86	Confident	22 Å²	22	65.5 Å²	65.5	10%	0.096	33%	0.333	C	S	.	.			trans	-51.3	129.5	-173.1	178.5	-94.7	0	0	0	112	Q138 V141 R142 L148 F153 A196 D197 V198	Q138-F151 HydrophobicContact CG-CD1 4.15Å; Q138-F151 HydrophobicContact CG-CE1 4.42Å; V141-F151 HydrophobicContact CB-CD1 3.81Å; V141-F151 HydrophobicContact CB-CE1 3.99Å; V141-F151 HydrophobicContact CB-CG 4.39Å; V141-F151 HydrophobicContact CG1-CB 4.21Å; V141-F151 HydrophobicContact CG1-CD1 3.5Å; V141-F151 HydrophobicContact CG1-CD2 3.97Å; V141-F151 HydrophobicContact CG1-CE1 3.79Å; V141-F151 HydrophobicContact CG1-CE2 4.22Å; V141-F151 HydrophobicContact CG1-CG 3.61Å; V141-F151 HydrophobicContact CG1-CZ 4.14Å; V141-F151 HydrophobicContact CG2-CE1 4.36Å; R142-F151 HydrophobicContact CG-CB 4.19Å; R142-F151 PolarHBondContact NE-O 2.97Å; R142-F151 PolarHBondContact NH2-O 2.94Å; L148-F151 HydrophobicContact CB-CB 4.38Å; L148-F151 WeakPolarHBondContact O-CB 3.43Å; L148-F151 PolarHBondContact O-N 3.2Å; F151-F153 HydrophobicContact CE1-CD2 4.18Å; F151-F153 HydrophobicContact CE1-CE1 4.15Å; F151-F153 AromaticContact CE1-CE2 3.76Å; F151-F153 HydrophobicContact CE1-CE2 3.76Å; F151-F153 AromaticContact CE1-CZ 3.73Å; F151-F153 HydrophobicContact CE1-CZ 3.73Å; F151-F153 HydrophobicContact CZ-CD1 4.27Å; F151-F153 AromaticContact CZ-CE1 3.76Å; F151-F153 HydrophobicContact CZ-CE1 3.76Å; F151-F153 HydrophobicContact CZ-CE2 4.22Å; F151-F153 AromaticContact CZ-CZ 3.72Å; F151-F153 HydrophobicContact CZ-CZ 3.72Å; F151-A196 HydrophobicContact CE2-CB 3.66Å; F151-A196 HydrophobicContact CZ-CB 3.78Å; F151-D197 CarbonylContact C-O 3.54Å; F151-D197 VanDerWaalsContact CA-O 3.28Å; F151-D197 WeakPolarHBondContact CA-O 3.38Å; F151-V198 HydrophobicContact CD2-CG2 4.19Å; F151-V198 HydrophobicContact CE2-CG2 4.46Å
152	K	93	Very high	86.4	Confident	101 Å²	101	65.1 Å²	65.1	44%	0.439	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	127.5	-177.4	-173.4	-163.4	170.4	-166.5	0	111.1	Q138 M150 T154 A196 D197	Q138-K152 VanDerWaalsContact OE1-CA 3.26Å; M150-K152 PolarHBondContact O-N 2.79Å; K152-T154 PolarHBondContact O-N 3.37Å; K152-A196 CarbonylContact O-C 3.6Å; K152-A196 VanDerWaalsContact O-CA 3.24Å; K152-A196 WeakPolarHBondContact O-CA 3.46Å; K152-D197 PolarHBondContact N-O 2.88Å; K152-D197 PolarHBondContact O-N 2.77Å
153	F	93.9	Very high	86.6	Confident	17 Å²	17	63.7 Å²	63.7	8%	0.075	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	124.2	166.4	-66.4	-68.4	0	0	0	109.7	L133 R134 Q138 F151 I156 I194 A196	L133-F153 HydrophobicContact CB-CD2 4.1Å; L133-F153 HydrophobicContact CB-CE2 3.97Å; L133-F153 HydrophobicContact CD2-CE1 4.28Å; L133-F153 HydrophobicContact CD2-CE2 3.82Å; L133-F153 HydrophobicContact CD2-CZ 3.61Å; L133-F153 HydrophobicContact CG-CE2 4.49Å; L133-F153 WeakPolarHBondContact O-CD2 3.13Å; L133-F153 WeakPolarHBondContact O-CE2 3.24Å; R134-F153 PolarHBondContact NH1-O 2.79Å; Q138-F153 HydrophobicContact CB-CD2 3.86Å; Q138-F153 HydrophobicContact CB-CE2 3.96Å; Q138-F153 HydrophobicContact CG-CD2 4.29Å; F151-F153 HydrophobicContact CE1-CD2 4.18Å; F151-F153 HydrophobicContact CE1-CE1 4.15Å; F151-F153 AromaticContact CE1-CE2 3.76Å; F151-F153 HydrophobicContact CE1-CE2 3.76Å; F151-F153 AromaticContact CE1-CZ 3.73Å; F151-F153 HydrophobicContact CE1-CZ 3.73Å; F151-F153 HydrophobicContact CZ-CD1 4.27Å; F151-F153 AromaticContact CZ-CE1 3.76Å; F151-F153 HydrophobicContact CZ-CE1 3.76Å; F151-F153 HydrophobicContact CZ-CE2 4.22Å; F151-F153 AromaticContact CZ-CZ 3.72Å; F151-F153 HydrophobicContact CZ-CZ 3.72Å; F153-I156 HydrophobicContact CB-CD1 3.68Å; F153-I156 HydrophobicContact CB-CG1 4.01Å; F153-I156 HydrophobicContact CD1-CD1 4.48Å; F153-I156 HydrophobicContact CD1-CG1 4.36Å; F153-I156 HydrophobicContact CD2-CD1 4.26Å; F153-I156 HydrophobicContact CG-CD1 3.91Å; F153-I156 HydrophobicContact CG-CG1 4.23Å; F153-I194 HydrophobicContact CD1-CG2 3.82Å; F153-I194 HydrophobicContact CE1-CG2 3.97Å; F153-A196 HydrophobicContact CD1-CB 3.9Å; F153-A196 HydrophobicContact CE1-CB 4.3Å
154	T	93.1	Very high	87.4	Confident	54 Å²	54	67.1 Å²	67.1	33%	0.331	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-59.3	173.3	47.1	0	0	0	0	109.2	R134 K152 D195 D197	R134-T154 PolarHBondContact NH2-O 2.9Å; K152-T154 PolarHBondContact O-N 3.37Å; T154-D195 PolarHBondContact N-O 3.12Å; T154-D195 WeakPolarHBondContact OG1-CB 3.17Å; T154-D195 PolarHBondContact OG1-O 3.39Å; T154-D195 VanDerWaalsContact OG1-O 3.1Å; T154-D197 HydrophobicContact CG2-CB 4.48Å; T154-D197 WeakPolarHBondContact CG2-OD1 3.21Å; T154-D197 WeakPolarHBondContact CG2-OD2 3.49Å
155	K	93	Very high	88.1	Confident	96 Å²	96	63.5 Å²	63.5	42%	0.417	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139	179	-166	-178.5	-172.9	-179.5	0	110.7	D193 I194 D195	K155-D193 VanDerWaalsContact CE-OD2 3.31Å; K155-D193 WeakPolarHBondContact CE-OD2 3.05Å; K155-D193 IonicContact NZ-OD2 2.67Å; K155-D193 PolarHBondContact NZ-OD2 2.97Å; K155-I194 CarbonylContact O-C 3.57Å; K155-I194 WeakPolarHBondContact O-CA 3.19Å; K155-D195 HydrophobicContact CB-CB 3.95Å; K155-D195 PolarHBondContact N-O 2.9Å; K155-D195 PolarHBondContact O-N 2.83Å
156	I	93.6	Very high	88.7	Confident	15 Å²	15	64 Å²	64	8%	0.077	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	122.1	169.7	-67.2	158.6	0	0	0	108	E130 L133 R134 F153 F158 I194	E130-I156 HydrophobicContact CB-CB 4.34Å; E130-I156 HydrophobicContact CB-CG2 3.98Å; E130-I156 HydrophobicContact CG-CB 4.13Å; E130-I156 HydrophobicContact CG-CD1 3.98Å; E130-I156 HydrophobicContact CG-CG2 4.33Å; L133-I156 HydrophobicContact CB-CD1 3.63Å; L133-I156 HydrophobicContact CD1-CD1 4.02Å; L133-I156 HydrophobicContact CD1-CG1 4.09Å; L133-I156 HydrophobicContact CD1-CG2 3.73Å; L133-I156 HydrophobicContact CG-CD1 4.49Å; R134-I156 HydrophobicContact CG-CD1 3.67Å; F153-I156 HydrophobicContact CB-CD1 3.68Å; F153-I156 HydrophobicContact CB-CG1 4.01Å; F153-I156 HydrophobicContact CD1-CD1 4.48Å; F153-I156 HydrophobicContact CD1-CG1 4.36Å; F153-I156 HydrophobicContact CD2-CD1 4.26Å; F153-I156 HydrophobicContact CG-CD1 3.91Å; F153-I156 HydrophobicContact CG-CG1 4.23Å; I156-F158 HydrophobicContact CG2-CD2 4.1Å; I156-F158 HydrophobicContact CG2-CE2 3.74Å; I156-I194 HydrophobicContact CG1-CG2 4.18Å; I156-I194 HydrophobicContact CG2-CG1 4.26Å
157	H	91.9	Very high	89.4	Confident	76 Å²	76	60.3 Å²	60.3	35%	0.352	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	122.4	173.2	-174.2	-108.1	0	0	0	109.5	G159 H160 V192 D193	H157-G159 PolarHBondContact ND1-N 3.14Å; H157-G159 PolarHBondContact O-N 3.07Å; H157-H160 AromaticContact CE1-CE1 3.65Å; H157-H160 AromaticContact CE1-NE2 3.65Å; H157-H160 AromaticContact NE2-CE1 3.52Å; H157-H160 AromaticContact NE2-NE2 3.94Å; H157-V192 CarbonylContact O-C 3.54Å; H157-D193 HydrophobicContact CB-CB 4.36Å; H157-D193 PolarHBondContact N-O 3.39Å; H157-D193 PolarHBondContact O-N 2.77Å
158	F	88.4	Confident	89.8	Confident	22 Å²	22	60.3 Å²	60.3	10%	0.096	29%	0.286	C	S	.	.			trans	-84.9	10.1	-177.7	-79.4	-95.2	0	0	0	114	W122 M129 L133 I156 Y188 S190 V192 I194	W122-F158 HydrophobicContact CZ2-CB 4.15Å; M129-F158 HydrophobicContact CB-CD2 3.94Å; M129-F158 HydrophobicContact CB-CE2 3.43Å; M129-F158 VanDerWaalsContact CB-CE2 3.43Å; M129-F158 HydrophobicContact CB-CZ 3.87Å; M129-F158 HydrophobicContact CE-CE1 4.34Å; M129-F158 HydrophobicContact CE-CZ 3.92Å; M129-F158 HydrophobicContact CG-CE2 4.36Å; M129-F158 HydrophobicContact CG-CZ 4.44Å; L133-F158 HydrophobicContact CD1-CE2 3.73Å; L133-F158 HydrophobicContact CD1-CZ 3.72Å; I156-F158 HydrophobicContact CG2-CD2 4.1Å; I156-F158 HydrophobicContact CG2-CE2 3.74Å; F158-Y188 PolarHBondContact O-OH 2.69Å; F158-S190 PolarHBondContact O-OG 3.26Å; F158-S190 VanDerWaalsContact O-OG 3.04Å; F158-V192 HydrophobicContact CD1-CG2 4.28Å; F158-I194 HydrophobicContact CE1-CD1 4.3Å; F158-I194 HydrophobicContact CE2-CD1 4.23Å; F158-I194 HydrophobicContact CZ-CD1 3.97Å
159	G	87.1	Confident	89.9	Confident	9 Å²	9	63.7 Å²	63.7	9%	0.093	30%	0.297	C	S	.	.			trans	72.1	175.2	-173.2	0	0	0	0	0	112.1	W122 H157	W122-G159 PolarHBondContact NE1-O 3.27Å; H157-G159 PolarHBondContact ND1-N 3.14Å; H157-G159 PolarHBondContact O-N 3.07Å
160	H	87.3	Confident	90.1	Very high	161 Å²	161	60.8 Å²	60.8	75%	0.745	30%	0.295	S	S	*	.	S	Bend	trans	-94.2	-8.7	-176.1	-58.8	-60.8	0	0	0	114.1	H157	H157-H160 AromaticContact CE1-CE1 3.65Å; H157-H160 AromaticContact CE1-NE2 3.65Å; H157-H160 AromaticContact NE2-CE1 3.52Å; H157-H160 AromaticContact NE2-NE2 3.94Å
161	K	90.5	Very high	89.8	Confident	113 Å²	113	56.9 Å²	56.9	49%	0.491	27%	0.273	S	S	.	.	S	Bend	trans	-88.3	120.5	-179	-178.4	172.6	163.1	-160	0	109.9	D189	K161-D189 VanDerWaalsContact CD-O 3.24Å; K161-D189 WeakPolarHBondContact CD-O 3.4Å; K161-D189 WeakPolarHBondContact CE-O 3.42Å; K161-D189 PolarHBondContact NZ-O 2.89Å
162	P	91.4	Very high	88.7	Confident	31 Å²	31	60.9 Å²	60.9	20%	0.201	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-76.4	164.2	-174.9	32.3	-37.6	0	0	0	113.6	E119 W122	E119-P162 HydrophobicContact CB-CG 4.12Å; E119-P162 HydrophobicContact CG-CG 4.39Å; W122-P162 HydrophobicContact CB-CB 4.27Å; W122-P162 HydrophobicContact CD2-CB 3.83Å; W122-P162 HydrophobicContact CE3-CB 3.81Å; W122-P162 HydrophobicContact CG-CB 4.02Å; W122-P162 HydrophobicContact CZ3-CB 4.45Å
163	L	91.5	Very high	86.9	Confident	37 Å²	37	64.6 Å²	64.6	19%	0.194	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-53.5	134.2	162.5	-167.8	69.5	0	0	0	111.5	L118 W122 I186 Y188	L118-L163 HydrophobicContact CD1-CB 4.48Å; W122-L163 HydrophobicContact CH2-CB 4.17Å; W122-L163 HydrophobicContact CZ3-CB 3.72Å; L163-I186 HydrophobicContact CD1-CG2 3.44Å; L163-I186 VanDerWaalsContact CD1-CG2 3.44Å; L163-I186 HydrophobicContact CD2-CD1 4.16Å; L163-I186 HydrophobicContact CG-CG2 4.28Å; L163-Y188 HydrophobicContact CD1-CD2 4.18Å; L163-Y188 HydrophobicContact CD1-CG 4.32Å
164	R	91.8	Very high	85.1	Confident	137 Å²	137	67.8 Å²	67.8	52%	0.517	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.2	174.2	-175.2	168.5	71.4	149.8	0	110.8	T166 D187	R164-T166 HydrophobicContact CG-CG2 4.47Å; R164-D187 WeakPolarHBondContact CB-O 3.26Å; R164-D187 IonicContact CZ-OD2 2.69Å; R164-D187 PolarHBondContact N-O 3.08Å; R164-D187 IonicContact NE-OD2 3.27Å; R164-D187 PolarHBondContact NE-OD2 3.07Å; R164-D187 IonicContact NH2-OD2 3.79Å; R164-D187 PolarHBondContact NH2-OD2 3.36Å; R164-D187 PolarHBondContact O-N 3.08Å
165	I	93.2	Very high	83.5	Confident	11 Å²	11	67.1 Å²	67.1	6%	0.056	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.5	164.7	-57.8	-179.7	0	0	0	107.2	V114 N115 L118 G167 M184	V114-I165 HydrophobicContact CG1-CD1 3.74Å; N115-I165 PolarHBondContact ND2-O 3.19Å; N115-I165 PolarHBondContact OD1-N 3.06Å; N115-I165 PolarHBondContact OD1-O 2.99Å; L118-I165 HydrophobicContact CD1-CD1 4.17Å; L118-I165 HydrophobicContact CD1-CG1 4.14Å; I165-G167 WeakPolarHBondContact CG2-O 3.42Å; I165-M184 HydrophobicContact CD1-SD 3.82Å; I165-M184 HydrophobicContact CG2-CB 4.35Å
166	T	89.3	Confident	82	Confident	64 Å²	64	66.5 Å²	66.5	39%	0.393	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-29	-179.1	59.3	0	0	0	0	112.2	R164 N185 D187	R164-T166 HydrophobicContact CG-CG2 4.47Å; T166-N185 PolarHBondContact N-O 3.34Å; T166-N185 VanDerWaalsContact OG1-CB 3.26Å; T166-N185 WeakPolarHBondContact OG1-CB 3.35Å; T166-N185 PolarHBondContact OG1-O 3.24Å; T166-D187 HydrophobicContact CG2-CB 3.64Å
167	G	88.1	Confident	80.8	Confident	2 Å²	2	74.8 Å²	74.8	2%	0.021	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	160.6	172.4	0	0	0	0	0	112	E109 I165 N185	E109-G167 CarbonylContact O-C 3.5Å; E109-G167 WeakPolarHBondContact O-CA 3.09Å; I165-G167 WeakPolarHBondContact CG2-O 3.42Å; G167-N185 PolarHBondContact O-N 2.75Å
168	M	87.9	Confident	80.1	Confident	36 Å²	36	79.6 Å²	79.6	18%	0.177	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.3	178.7	-174.5	177.9	75.8	0	0	110.9	E109 V111 D183 M184	E109-M168 PolarHBondContact N-O 3.31Å; E109-M168 PolarHBondContact O-N 2.98Å; V111-M168 HydrophobicContact CG2-CB 3.37Å; V111-M168 HydrophobicContact CG2-CE 4.01Å; V111-M168 HydrophobicContact CG2-CG 4.37Å; V111-M168 HydrophobicContact CG2-SD 4.2Å; M168-D183 CarbonylContact C-O 3.57Å; M168-D183 VanDerWaalsContact CA-O 3.27Å; M168-D183 WeakPolarHBondContact CA-O 3.49Å; M168-M184 HydrophobicContact CG-CG 4.07Å; M168-M184 HydrophobicContact SD-CE 3.99Å; M168-M184 HydrophobicContact SD-CG 4.45Å
169	R	85.8	Confident	80	Confident	93 Å²	93	79.1 Å²	79.1	35%	0.351	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.2	171.7	-174.8	176.7	-163.7	-156	6.8	109.4	D107 Y171 L182 D183	D107-R169 WeakPolarHBondContact O-CG 3.39Å; D107-R169 IonicContact OD2-CZ 3.59Å; D107-R169 VanDerWaalsContact OD2-CZ 3.31Å; D107-R169 IonicContact OD2-NE 3.89Å; D107-R169 PolarHBondContact OD2-NE 3.34Å; D107-R169 IonicContact OD2-NH2 3.33Å; D107-R169 PolarHBondContact OD2-NH2 3.36Å; R169-Y171 HydrophobicContact CG-CE2 4.14Å; R169-Y171 PolarHBondContact NH1-OH 2.95Å; R169-Y171 VanDerWaalsContact NH1-OH 3.1Å; R169-L182 CarbonylContact O-C 3.57Å; R169-L182 WeakPolarHBondContact O-CA 3.48Å; R169-D183 PolarHBondContact N-O 3.46Å; R169-D183 PolarHBondContact O-N 3.34Å
170	A	85.3	Confident	80	Confident	54 Å²	54	81.1 Å²	81.1	45%	0.446	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.6	169.9	0	0	0	0	0	109.7	L182	A170-L182 HydrophobicContact CB-CD2 3.69Å
171	Y	79.3	Confident	80.1	Confident	44 Å²	44	73.9 Å²	73.9	17%	0.173	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.2	178.5	-73.8	-104.4	0	0	0	110.5	R169 I181 D183 P365	R169-Y171 HydrophobicContact CG-CE2 4.14Å; R169-Y171 PolarHBondContact NH1-OH 2.95Å; R169-Y171 VanDerWaalsContact NH1-OH 3.1Å; Y171-I181 HydrophobicContact CD2-CG2 4.11Å; Y171-I181 PolarHBondContact N-O 3.1Å; Y171-D183 HydrophobicContact CE2-CB 4.12Å; Y171-D183 VanDerWaalsContact CE2-OD2 3.23Å; Y171-D183 WeakPolarHBondContact CE2-OD2 3.44Å; Y171-D183 PolarHBondContact OH-OD2 3.07Å; Y171-P365 HydrophobicContact CD1-CG 4.18Å; Y171-P365 HydrophobicContact CE1-CG 3.75Å
172	T	66.9	Low	80.1	Confident	106 Å²	106	69.9 Å²	69.9	65%	0.65	34%	0.343	S	S	*	.			trans	-117.6	-21.2	-171.9	46.4	0	0	0	0	115
173	H	55.2	Low	80	Confident	178 Å²	178	68.7 Å²	68.7	82%	0.824	34%	0.335	S	S	*	.	S	Bend	trans	-110.9	-12.1	-168.7	-62.6	-77	0	0	0	115.6
174	E	56.2	Low	80	Confident	85 Å²	85	68.4 Å²	68.4	40%	0.397	33%	0.333	S	S	.	.	S	Bend	trans	-124.8	15.6	-175.2	-60.1	-166.1	155.2	0	0	114.7	P365 K395	E174-P365 VanDerWaalsContact OE2-CD 3.24Å; E174-P365 WeakPolarHBondContact OE2-CD 3.33Å; E174-P365 WeakPolarHBondContact OE2-CG 3.39Å; E174-K395 PolarHBondContact O-NZ 3.49Å
175	V	60.1	Low	80	Confident	39 Å²	39	64.2 Å²	64.2	24%	0.236	32%	0.321	C	S	.	.	S	Bend	trans	-118.1	151	-164.8	-174.7	0	0	0	0	110.5	E179 I181	V175-E179 HydrophobicContact CG1-CG 3.32Å; V175-I181 HydrophobicContact CG1-CD1 3.92Å; V175-I181 HydrophobicContact CG1-CG1 3.95Å; V175-I181 HydrophobicContact CG2-CD1 4.13Å; V175-I181 HydrophobicContact CG2-CG1 4.47Å
176	D	61.7	Low	79.9	Confident	84 Å²	84	64.1 Å²	64.1	45%	0.449	32%	0.32	S	S	.	.			trans	-66.3	146	172.9	-167.4	-8	0	0	0	110.2	R178 E179	D176-R178 PolarHBondContact O-N 2.81Å; D176-E179 HydrophobicContact CB-CG 4.36Å; D176-E179 PolarHBondContact N-OE1 3.42Å; D176-E179 PolarHBondContact O-N 3.07Å
177	Q	67	Low	80.1	Confident	188 Å²	188	62.8 Å²	62.8	88%	0.879	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	6.8	178.7	-61.3	-178.9	-7.2	0	0	113.4
178	R	78	Confident	80.3	Confident	177 Å²	177	63.4 Å²	63.4	67%	0.668	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-2.6	-174	-61.2	178.1	176.3	-160.4	-1.1	113.5	D176 L222	D176-R178 PolarHBondContact O-N 2.81Å; R178-L222 WeakPolarHBondContact O-CB 3.42Å; R178-L222 WeakPolarHBondContact O-CG 3.34Å; R178-L222 PolarHBondContact O-N 2.89Å
179	E	86.1	Confident	80.6	Confident	12 Å²	12	64.5 Å²	64.5	6%	0.056	32%	0.319	C	S	.	.			trans	-137.9	159.8	-178.9	69.1	-172	138.5	0	0	110.4	V175 D176 I181 I218 L219 E220 R299	V175-E179 HydrophobicContact CG1-CG 3.32Å; D176-E179 HydrophobicContact CB-CG 4.36Å; D176-E179 PolarHBondContact N-OE1 3.42Å; D176-E179 PolarHBondContact O-N 3.07Å; E179-I181 HydrophobicContact CG-CG1 4.43Å; E179-I218 HydrophobicContact CB-CG2 4.21Å; E179-L219 CarbonylContact C-O 3.52Å; E179-L219 VanDerWaalsContact CA-O 3.27Å; E179-L219 WeakPolarHBondContact CA-O 3.31Å; E179-E220 HydrophobicContact CB-CB 4.26Å; E179-E220 HydrophobicContact CB-CG 4.32Å; E179-R299 IonicContact OE1-CZ 2.72Å; E179-R299 IonicContact OE1-NH1 3.87Å; E179-R299 PolarHBondContact OE1-NH1 2.85Å; E179-R299 IonicContact OE1-NH2 3.41Å; E179-R299 PolarHBondContact OE1-NH2 3.01Å; E179-R299 IonicContact OE2-CZ 2.76Å; E179-R299 IonicContact OE2-NH1 2.72Å; E179-R299 IonicContact OE2-NH2 2.64Å; E179-R299 PolarHBondContact OE2-NH2 3.07Å
180	V	88.1	Confident	80.8	Confident	51 Å²	51	60.2 Å²	60.2	31%	0.309	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.4	166.7	-177.6	0	0	0	0	108.8	L182 I218 L219 L222	V180-L182 HydrophobicContact CG1-CD2 4.07Å; V180-L182 HydrophobicContact CG1-CG 4.19Å; V180-I218 WeakPolarHBondContact O-CA 2.9Å; V180-L219 HydrophobicContact CB-CB 4.17Å; V180-L219 HydrophobicContact CB-CD1 4.23Å; V180-L219 HydrophobicContact CB-CG 4.4Å; V180-L219 PolarHBondContact N-O 2.72Å; V180-L219 PolarHBondContact O-N 2.88Å; V180-L222 HydrophobicContact CG2-CD1 4.05Å; V180-L222 HydrophobicContact CG2-CD2 4.18Å
181	I	88.6	Confident	81	Confident	10 Å²	10	64 Å²	64	5%	0.051	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.3	179	-59.1	-178.6	0	0	0	109.6	Y171 V175 E179 R216 I218	Y171-I181 HydrophobicContact CD2-CG2 4.11Å; Y171-I181 PolarHBondContact N-O 3.1Å; V175-I181 HydrophobicContact CG1-CD1 3.92Å; V175-I181 HydrophobicContact CG1-CG1 3.95Å; V175-I181 HydrophobicContact CG2-CD1 4.13Å; V175-I181 HydrophobicContact CG2-CG1 4.47Å; E179-I181 HydrophobicContact CG-CG1 4.43Å; I181-R216 HydrophobicContact CG2-CG 3.91Å; I181-I218 HydrophobicContact CD1-CD1 4.43Å; I181-I218 HydrophobicContact CG1-CD1 4.37Å; I181-I218 HydrophobicContact CG1-CG1 4.18Å; I181-I218 HydrophobicContact CG1-CG2 4.3Å
182	L	90.1	Very high	81.6	Confident	29 Å²	29	61.9 Å²	61.9	15%	0.152	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119.7	-179	-57.8	173.1	0	0	0	109.5	R169 A170 V180 M184 V217 L219	R169-L182 CarbonylContact O-C 3.57Å; R169-L182 WeakPolarHBondContact O-CA 3.48Å; A170-L182 HydrophobicContact CB-CD2 3.69Å; V180-L182 HydrophobicContact CG1-CD2 4.07Å; V180-L182 HydrophobicContact CG1-CG 4.19Å; L182-M184 HydrophobicContact CB-CE 3.97Å; L182-M184 HydrophobicContact CD1-CE 3.98Å; L182-V217 HydrophobicContact CB-CB 4.38Å; L182-V217 PolarHBondContact N-O 2.9Å; L182-V217 PolarHBondContact O-N 2.82Å; L182-L219 HydrophobicContact CD1-CD1 4.3Å
183	D	90.4	Very high	82.9	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.032	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.1	173.2	-73	-8.5	0	0	0	110.1	M168 R169 Y171 M214 L215 R216 I237	M168-D183 CarbonylContact C-O 3.57Å; M168-D183 VanDerWaalsContact CA-O 3.27Å; M168-D183 WeakPolarHBondContact CA-O 3.49Å; R169-D183 PolarHBondContact N-O 3.46Å; R169-D183 PolarHBondContact O-N 3.34Å; Y171-D183 HydrophobicContact CE2-CB 4.12Å; Y171-D183 VanDerWaalsContact CE2-OD2 3.23Å; Y171-D183 WeakPolarHBondContact CE2-OD2 3.44Å; Y171-D183 PolarHBondContact OH-OD2 3.07Å; D183-M214 HydrophobicContact CB-CG 4.11Å; D183-M214 HydrophobicContact CB-SD 4.14Å; D183-L215 WeakPolarHBondContact CA-O 3.32Å; D183-R216 WeakPolarHBondContact OD1-CA 3.3Å; D183-R216 WeakPolarHBondContact OD1-CB 3.14Å; D183-R216 WeakPolarHBondContact OD1-CG 3.24Å; D183-R216 IonicContact OD1-CZ 2.55Å; D183-R216 IonicContact OD1-NE 2.62Å; D183-R216 PolarHBondContact OD1-NE 2.83Å; D183-R216 IonicContact OD1-NH2 2.68Å; D183-R216 IonicContact OD2-CZ 3.61Å; D183-R216 IonicContact OD2-NE 3.31Å; D183-R216 IonicContact OD2-NH2 3.41Å; D183-R216 PolarHBondContact OD2-NH2 3.41Å; D183-I237 WeakPolarHBondContact OD2-CD1 3.35Å
184	M	91.1	Very high	84.7	Confident	30 Å²	30	50.8 Å²	50.8	15%	0.148	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117.9	-174.1	-59.6	-179.2	-171.5	0	0	109.8	I165 M168 L182 I186 L215 V217	I165-M184 HydrophobicContact CD1-SD 3.82Å; I165-M184 HydrophobicContact CG2-CB 4.35Å; M168-M184 HydrophobicContact CG-CG 4.07Å; M168-M184 HydrophobicContact SD-CE 3.99Å; M168-M184 HydrophobicContact SD-CG 4.45Å; L182-M184 HydrophobicContact CB-CE 3.97Å; L182-M184 HydrophobicContact CD1-CE 3.98Å; M184-I186 PolarHBondContact O-N 2.82Å; M184-I186 VanDerWaalsContact O-N 3.13Å; M184-L215 PolarHBondContact N-O 3.39Å; M184-L215 PolarHBondContact O-N 3.42Å; M184-V217 HydrophobicContact CE-CB 4.24Å; M184-V217 HydrophobicContact CE-CG2 3.92Å; M184-V217 HydrophobicContact SD-CG2 3.97Å
185	N	91.1	Very high	86.5	Confident	50 Å²	50	48.8 Å²	48.8	27%	0.267	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	96.7	175.9	-75.4	-33	0	0	0	109.7	T166 G167 M214	T166-N185 PolarHBondContact N-O 3.34Å; T166-N185 VanDerWaalsContact OG1-CB 3.26Å; T166-N185 WeakPolarHBondContact OG1-CB 3.35Å; T166-N185 PolarHBondContact OG1-O 3.24Å; G167-N185 PolarHBondContact O-N 2.75Å; N185-M214 WeakPolarHBondContact OD1-CE 3.44Å
186	I	91.9	Very high	88.1	Confident	9 Å²	9	47.2 Å²	47.2	5%	0.046	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	138	-177.3	-73.3	-177.8	0	0	0	111	L163 M184 F211 Q212 G213 L215 F236	L163-I186 HydrophobicContact CD1-CG2 3.44Å; L163-I186 VanDerWaalsContact CD1-CG2 3.44Å; L163-I186 HydrophobicContact CD2-CD1 4.16Å; L163-I186 HydrophobicContact CG-CG2 4.28Å; M184-I186 PolarHBondContact O-N 2.82Å; M184-I186 VanDerWaalsContact O-N 3.13Å; I186-F211 HydrophobicContact CG2-CD1 3.84Å; I186-F211 HydrophobicContact CG2-CE1 3.87Å; I186-Q212 WeakPolarHBondContact O-CA 3.33Å; I186-Q212 WeakPolarHBondContact O-CG 2.9Å; I186-G213 WeakPolarHBondContact CB-O 3.33Å; I186-G213 PolarHBondContact N-O 2.69Å; I186-G213 PolarHBondContact O-N 3.03Å; I186-G213 VanDerWaalsContact O-N 3.09Å; I186-L215 HydrophobicContact CD1-CB 3.59Å; I186-L215 HydrophobicContact CD1-CD2 3.73Å; I186-L215 HydrophobicContact CD1-CG 4.22Å; I186-L215 HydrophobicContact CG1-CB 4.26Å; I186-F236 HydrophobicContact CD1-CE1 4.33Å; I186-F236 HydrophobicContact CD1-CZ 4.09Å
187	D	92.8	Very high	89.5	Confident	36 Å²	36	45.9 Å²	45.9	19%	0.193	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130.2	171	167.3	43.5	0	0	0	109.3	R164 T166	R164-D187 WeakPolarHBondContact CB-O 3.26Å; R164-D187 IonicContact CZ-OD2 2.69Å; R164-D187 PolarHBondContact N-O 3.08Å; R164-D187 IonicContact NE-OD2 3.27Å; R164-D187 PolarHBondContact NE-OD2 3.07Å; R164-D187 IonicContact NH2-OD2 3.79Å; R164-D187 PolarHBondContact NH2-OD2 3.36Å; R164-D187 PolarHBondContact O-N 3.08Å; T166-D187 HydrophobicContact CG2-CB 3.64Å
188	Y	93.1	Very high	90.4	Very high	14 Å²	14	37.1 Å²	37.1	6%	0.055	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	133.9	-178.7	-175.7	-107.6	0	0	0	110.1	W122 F158 L163 S190 V192 L209 K210 F211	W122-Y188 HydrophobicContact CH2-CD2 4.39Å; W122-Y188 AromaticContact CH2-CE2 3.6Å; W122-Y188 HydrophobicContact CH2-CE2 3.6Å; W122-Y188 AromaticContact CZ2-CE2 3.62Å; W122-Y188 HydrophobicContact CZ2-CE2 3.62Å; F158-Y188 PolarHBondContact O-OH 2.69Å; L163-Y188 HydrophobicContact CD1-CD2 4.18Å; L163-Y188 HydrophobicContact CD1-CG 4.32Å; Y188-S190 WeakPolarHBondContact OH-CB 3.07Å; Y188-V192 HydrophobicContact CE1-CG2 3.94Å; Y188-V192 VanDerWaalsContact OH-CG2 3.25Å; Y188-V192 WeakPolarHBondContact OH-CG2 3.36Å; Y188-L209 HydrophobicContact CD1-CD2 4.34Å; Y188-L209 HydrophobicContact CD1-CG 4.1Å; Y188-L209 HydrophobicContact CE1-CB 4.18Å; Y188-L209 HydrophobicContact CE1-CD2 3.88Å; Y188-L209 HydrophobicContact CE1-CG 3.91Å; Y188-K210 CarbonylContact O-C 3.59Å; Y188-K210 VanDerWaalsContact O-CA 3.3Å; Y188-K210 WeakPolarHBondContact O-CA 3.13Å; Y188-F211 WeakPolarHBondContact CB-O 3.27Å; Y188-F211 HydrophobicContact CD1-CB 4.27Å; Y188-F211 PolarHBondContact N-O 2.88Å; Y188-F211 PolarHBondContact O-N 2.8Å
189	D	93.3	Very high	90.6	Very high	59 Å²	59	31 Å²	31	32%	0.316	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	95.6	-178.5	-179.8	9.5	0	0	0	106.8	K161 K210	K161-D189 VanDerWaalsContact CD-O 3.24Å; K161-D189 WeakPolarHBondContact CD-O 3.4Å; K161-D189 WeakPolarHBondContact CE-O 3.42Å; K161-D189 PolarHBondContact NZ-O 2.89Å; D189-K210 HydrophobicContact CB-CG 4.45Å; D189-K210 WeakPolarHBondContact OD1-CD 3.49Å; D189-K210 WeakPolarHBondContact OD1-CE 3.37Å; D189-K210 WeakPolarHBondContact OD1-CG 3.37Å; D189-K210 IonicContact OD1-NZ 2.62Å; D189-K210 PolarHBondContact OD1-NZ 2.89Å; D189-K210 IonicContact OD2-NZ 3.52Å; D189-K210 PolarHBondContact OD2-NZ 2.97Å
190	S	90.5	Very high	90.1	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.028	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	146	-168.9	-174	0	0	0	0	111.9	F158 Y188 V192 G208 L209	F158-S190 PolarHBondContact O-OG 3.26Å; F158-S190 VanDerWaalsContact O-OG 3.04Å; Y188-S190 WeakPolarHBondContact OH-CB 3.07Å; S190-V192 PolarHBondContact O-N 2.74Å; S190-G208 WeakPolarHBondContact O-CA 3.44Å; S190-L209 PolarHBondContact N-O 2.8Å; S190-L209 VanDerWaalsContact N-O 3.12Å; S190-L209 PolarHBondContact O-N 2.74Å
191	D	90	Very high	89.6	Confident	133 Å²	133	37.1 Å²	37.1	71%	0.711	22%	0.224	S	C	*	.			trans	-74.6	69.3	172.3	-55.3	-53.5	0	0	0	109.9
192	V	91.9	Very high	89.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.226	C	C	.	.			trans	-68.7	133.4	173.3	172.2	0	0	0	0	109.4	H157 F158 Y188 S190 I194 I206 K207 G208 L209	H157-V192 CarbonylContact O-C 3.54Å; F158-V192 HydrophobicContact CD1-CG2 4.28Å; Y188-V192 HydrophobicContact CE1-CG2 3.94Å; Y188-V192 VanDerWaalsContact OH-CG2 3.25Å; Y188-V192 WeakPolarHBondContact OH-CG2 3.36Å; S190-V192 PolarHBondContact O-N 2.74Å; V192-I194 HydrophobicContact CG1-CD1 3.47Å; V192-I194 VanDerWaalsContact CG1-CD1 3.47Å; V192-I194 HydrophobicContact CG1-CG1 3.63Å; V192-I206 HydrophobicContact CG1-CG2 4.21Å; V192-I206 CarbonylContact O-C 3.48Å; V192-K207 CarbonylContact O-C 3.52Å; V192-K207 WeakPolarHBondContact O-CA 3.46Å; V192-G208 PolarHBondContact O-N 2.78Å; V192-G208 VanDerWaalsContact O-N 3.16Å; V192-L209 HydrophobicContact CB-CB 4.02Å; V192-L209 HydrophobicContact CG2-CB 3.73Å; V192-L209 HydrophobicContact CG2-CD2 4.29Å
193	D	93.2	Very high	89.5	Confident	37 Å²	37	40 Å²	40	20%	0.198	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	90.6	179.8	-172.7	4.3	0	0	0	110	K155 H157 I206 K207	K155-D193 VanDerWaalsContact CE-OD2 3.31Å; K155-D193 WeakPolarHBondContact CE-OD2 3.05Å; K155-D193 IonicContact NZ-OD2 2.67Å; K155-D193 PolarHBondContact NZ-OD2 2.97Å; H157-D193 HydrophobicContact CB-CB 4.36Å; H157-D193 PolarHBondContact N-O 3.39Å; H157-D193 PolarHBondContact O-N 2.77Å; D193-I206 WeakPolarHBondContact CA-O 3.38Å; D193-K207 IonicContact OD1-NZ 3.65Å; D193-K207 PolarHBondContact OD1-NZ 2.85Å
194	I	94.1	Very high	89.5	Confident	14 Å²	14	40.4 Å²	40.4	7%	0.072	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.5	179.7	-62.6	169.1	0	0	0	108.3	L133 F153 K155 I156 F158 V192 G205 I206	L133-I194 HydrophobicContact CD1-CD1 4.17Å; F153-I194 HydrophobicContact CD1-CG2 3.82Å; F153-I194 HydrophobicContact CE1-CG2 3.97Å; K155-I194 CarbonylContact O-C 3.57Å; K155-I194 WeakPolarHBondContact O-CA 3.19Å; I156-I194 HydrophobicContact CG1-CG2 4.18Å; I156-I194 HydrophobicContact CG2-CG1 4.26Å; F158-I194 HydrophobicContact CE1-CD1 4.3Å; F158-I194 HydrophobicContact CE2-CD1 4.23Å; F158-I194 HydrophobicContact CZ-CD1 3.97Å; V192-I194 HydrophobicContact CG1-CD1 3.47Å; V192-I194 VanDerWaalsContact CG1-CD1 3.47Å; V192-I194 HydrophobicContact CG1-CG1 3.63Å; I194-G205 CarbonylContact O-C 3.57Å; I194-G205 WeakPolarHBondContact O-CA 3.5Å; I194-I206 HydrophobicContact CB-CB 4.4Å; I194-I206 PolarHBondContact N-O 2.77Å; I194-I206 PolarHBondContact O-N 2.96Å
195	D	93.7	Very high	89.6	Confident	42 Å²	42	39.1 Å²	39.1	23%	0.225	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	142.7	175.1	-67.5	-51.6	0	0	0	110.7	T154 K155 K207	T154-D195 PolarHBondContact N-O 3.12Å; T154-D195 WeakPolarHBondContact OG1-CB 3.17Å; T154-D195 PolarHBondContact OG1-O 3.39Å; T154-D195 VanDerWaalsContact OG1-O 3.1Å; K155-D195 HydrophobicContact CB-CB 3.95Å; K155-D195 PolarHBondContact N-O 2.9Å; K155-D195 PolarHBondContact O-N 2.83Å; D195-K207 WeakPolarHBondContact OD1-CE 3.4Å; D195-K207 IonicContact OD1-NZ 3.15Å; D195-K207 PolarHBondContact OD1-NZ 2.78Å; D195-K207 IonicContact OD2-NZ 2.65Å; D195-K207 PolarHBondContact OD2-NZ 2.71Å
196	A	92.6	Very high	89.7	Confident	7 Å²	7	38.1 Å²	38.1	6%	0.058	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	135	178	0	0	0	0	0	112.6	F151 K152 F153 T203 V204	F151-A196 HydrophobicContact CE2-CB 3.66Å; F151-A196 HydrophobicContact CZ-CB 3.78Å; K152-A196 CarbonylContact O-C 3.6Å; K152-A196 VanDerWaalsContact O-CA 3.24Å; K152-A196 WeakPolarHBondContact O-CA 3.46Å; F153-A196 HydrophobicContact CD1-CB 3.9Å; F153-A196 HydrophobicContact CE1-CB 4.3Å; A196-T203 WeakPolarHBondContact O-CA 3.41Å; A196-V204 PolarHBondContact N-O 2.86Å; A196-V204 PolarHBondContact O-N 3.42Å; A196-V204 VanDerWaalsContact O-O 3.13Å
197	D	91.8	Very high	89.6	Confident	55 Å²	55	41.2 Å²	41.2	29%	0.294	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	122.1	168.1	-56.1	-22.6	0	0	0	107.7	F151 K152 T154 T203	F151-D197 CarbonylContact C-O 3.54Å; F151-D197 VanDerWaalsContact CA-O 3.28Å; F151-D197 WeakPolarHBondContact CA-O 3.38Å; K152-D197 PolarHBondContact N-O 2.88Å; K152-D197 PolarHBondContact O-N 2.77Å; T154-D197 HydrophobicContact CG2-CB 4.48Å; T154-D197 WeakPolarHBondContact CG2-OD1 3.21Å; T154-D197 WeakPolarHBondContact CG2-OD2 3.49Å; D197-T203 WeakPolarHBondContact OD1-CG2 3.4Å
198	V	85.7	Confident	89.6	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-43.5	175.8	-178.1	0	0	0	0	110.1	L148 F151 I202 V204 L252 F258	L148-V198 HydrophobicContact CD2-CG1 3.56Å; F151-V198 HydrophobicContact CD2-CG2 4.19Å; F151-V198 HydrophobicContact CE2-CG2 4.46Å; V198-I202 HydrophobicContact CB-CB 4.31Å; V198-I202 HydrophobicContact CB-CG2 4.11Å; V198-I202 HydrophobicContact CG2-CG2 4.29Å; V198-I202 PolarHBondContact N-O 2.62Å; V198-V204 HydrophobicContact CG2-CB 4.45Å; V198-V204 HydrophobicContact CG2-CG2 3.9Å; V198-L252 HydrophobicContact CB-CD1 4.39Å; V198-L252 HydrophobicContact CG1-CD1 3.84Å; V198-L252 HydrophobicContact CG2-CD1 4.15Å; V198-F258 HydrophobicContact CG1-CE2 4.4Å
199	N	82	Confident	89.4	Confident	48 Å²	48	40.4 Å²	40.4	26%	0.257	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	-179.6	167.3	67.8	41	0	0	0	109	A201 I202	N199-A201 PolarHBondContact O-N 2.73Å; N199-A201 PolarHBondContact OD1-N 2.99Å; N199-I202 PolarHBondContact N-O 2.74Å; N199-I202 PolarHBondContact O-N 3.09Å; N199-I202 PolarHBondContact OD1-N 3.26Å
200	A	75.8	Confident	89.3	Confident	102 Å²	102	41.3 Å²	41.3	84%	0.843	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-2.8	-176	0	0	0	0	0	116.2
201	A	78.7	Confident	89.3	Confident	90 Å²	90	42 Å²	42	74%	0.744	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.7	-8.3	177.8	0	0	0	0	0	114.3	N199	N199-A201 PolarHBondContact O-N 2.73Å; N199-A201 PolarHBondContact OD1-N 2.99Å
202	I	86.2	Confident	89.3	Confident	17 Å²	17	41.2 Å²	41.2	9%	0.087	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	110.2	-176.9	-59.4	174.8	0	0	0	108.9	V198 N199 V204 N251 L252	V198-I202 HydrophobicContact CB-CB 4.31Å; V198-I202 HydrophobicContact CB-CG2 4.11Å; V198-I202 HydrophobicContact CG2-CG2 4.29Å; V198-I202 PolarHBondContact N-O 2.62Å; N199-I202 PolarHBondContact N-O 2.74Å; N199-I202 PolarHBondContact O-N 3.09Å; N199-I202 PolarHBondContact OD1-N 3.26Å; I202-V204 HydrophobicContact CG2-CG2 4.14Å; I202-N251 WeakPolarHBondContact CD1-O 3.36Å; I202-N251 HydrophobicContact CG2-CB 4.33Å; I202-L252 HydrophobicContact CG2-CB 4.24Å; I202-L252 HydrophobicContact CG2-CD1 4.38Å
203	T	89	Confident	89.2	Confident	84 Å²	84	42 Å²	42	52%	0.515	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.5	166	58.4	0	0	0	0	109.7	A196 D197	A196-T203 WeakPolarHBondContact O-CA 3.41Å; D197-T203 WeakPolarHBondContact OD1-CG2 3.4Å
204	V	91.1	Very high	88.9	Confident	14 Å²	14	43.9 Å²	43.9	9%	0.085	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142.2	176.9	-178.1	0	0	0	0	107.8	A196 V198 I202 W246 T247 M249 L252	A196-V204 PolarHBondContact N-O 2.86Å; A196-V204 PolarHBondContact O-N 3.42Å; A196-V204 VanDerWaalsContact O-O 3.13Å; V198-V204 HydrophobicContact CG2-CB 4.45Å; V198-V204 HydrophobicContact CG2-CG2 3.9Å; I202-V204 HydrophobicContact CG2-CG2 4.14Å; V204-W246 HydrophobicContact CG1-CE3 3.91Å; V204-W246 HydrophobicContact CG1-CZ3 4.22Å; V204-T247 CarbonylContact C-O 3.54Å; V204-T247 WeakPolarHBondContact CA-O 3.31Å; V204-M249 HydrophobicContact CG1-SD 4.5Å; V204-L252 HydrophobicContact CG2-CB 3.81Å; V204-L252 HydrophobicContact CG2-CD2 4.18Å; V204-L252 HydrophobicContact CG2-CG 4.48Å
205	G	92.3	Very high	88.7	Confident	3 Å²	3	44 Å²	44	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	165.8	176.1	0	0	0	0	0	112.7	I194 W246 T247	I194-G205 CarbonylContact O-C 3.57Å; I194-G205 WeakPolarHBondContact O-CA 3.5Å; G205-W246 CarbonylContact O-C 3.55Å; G205-W246 WeakPolarHBondContact O-CA 3.43Å; G205-T247 WeakPolarHBondContact CA-OG1 3.4Å; G205-T247 PolarHBondContact N-O 2.85Å; G205-T247 PolarHBondContact O-N 2.81Å; G205-T247 PolarHBondContact O-OG1 3.34Å
206	I	93.4	Very high	88.6	Confident	29 Å²	29	42.2 Å²	42.2	15%	0.149	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.9	171.8	-64.9	173.9	0	0	0	105.6	V192 D193 I194 I244 W246	V192-I206 HydrophobicContact CG1-CG2 4.21Å; V192-I206 CarbonylContact O-C 3.48Å; D193-I206 WeakPolarHBondContact CA-O 3.38Å; I194-I206 HydrophobicContact CB-CB 4.4Å; I194-I206 PolarHBondContact N-O 2.77Å; I194-I206 PolarHBondContact O-N 2.96Å; I206-I244 HydrophobicContact CB-CG2 4.25Å; I206-I244 HydrophobicContact CD1-CD1 4.39Å; I206-I244 HydrophobicContact CD1-CG2 3.94Å; I206-I244 HydrophobicContact CG1-CG2 3.66Å; I206-I244 HydrophobicContact CG2-CG2 3.82Å; I206-W246 HydrophobicContact CD1-CE3 4.37Å; I206-W246 HydrophobicContact CD1-CH2 4.21Å; I206-W246 HydrophobicContact CD1-CZ3 3.87Å; I206-W246 HydrophobicContact CG1-CD2 4.48Å; I206-W246 HydrophobicContact CG1-CE3 3.74Å; I206-W246 HydrophobicContact CG1-CH2 4.46Å; I206-W246 HydrophobicContact CG1-CZ3 3.74Å
207	K	91.4	Very high	88.6	Confident	74 Å²	74	42.6 Å²	42.6	32%	0.322	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	8.9	-179.4	-54.2	-60.6	165.4	-174.6	0	113.3	V192 D193 D195 N245 T247	V192-K207 CarbonylContact O-C 3.52Å; V192-K207 WeakPolarHBondContact O-CA 3.46Å; D193-K207 IonicContact OD1-NZ 3.65Å; D193-K207 PolarHBondContact OD1-NZ 2.85Å; D195-K207 WeakPolarHBondContact OD1-CE 3.4Å; D195-K207 IonicContact OD1-NZ 3.15Å; D195-K207 PolarHBondContact OD1-NZ 2.78Å; D195-K207 IonicContact OD2-NZ 2.65Å; D195-K207 PolarHBondContact OD2-NZ 2.71Å; K207-N245 PolarHBondContact N-O 2.96Å; K207-T247 WeakPolarHBondContact CE-OG1 3.38Å; K207-T247 HydrophobicContact CG-CG2 3.53Å
208	G	91	Very high	88.6	Confident	3 Å²	3	40 Å²	40	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	141.5	175.9	0	0	0	0	0	110.4	S190 V192 N245	S190-G208 WeakPolarHBondContact O-CA 3.44Å; V192-G208 PolarHBondContact O-N 2.78Å; V192-G208 VanDerWaalsContact O-N 3.16Å; G208-N245 PolarHBondContact O-N 3.09Å
209	L	90.6	Very high	88.8	Confident	29 Å²	29	41.6 Å²	41.6	15%	0.152	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	118.1	-179.6	170.4	60.2	0	0	0	108.7	Y188 S190 V192 F211 L242 I244	Y188-L209 HydrophobicContact CD1-CD2 4.34Å; Y188-L209 HydrophobicContact CD1-CG 4.1Å; Y188-L209 HydrophobicContact CE1-CB 4.18Å; Y188-L209 HydrophobicContact CE1-CD2 3.88Å; Y188-L209 HydrophobicContact CE1-CG 3.91Å; S190-L209 PolarHBondContact N-O 2.8Å; S190-L209 VanDerWaalsContact N-O 3.12Å; S190-L209 PolarHBondContact O-N 2.74Å; V192-L209 HydrophobicContact CB-CB 4.02Å; V192-L209 HydrophobicContact CG2-CB 3.73Å; V192-L209 HydrophobicContact CG2-CD2 4.29Å; L209-F211 HydrophobicContact CD1-CB 4.47Å; L209-L242 HydrophobicContact CD1-CD1 3.57Å; L209-I244 HydrophobicContact CD1-CD1 4.34Å; L209-I244 HydrophobicContact CD1-CG1 3.79Å
210	K	91.4	Very high	89.1	Confident	79 Å²	79	42.2 Å²	42.2	34%	0.343	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.2	165.3	-43.3	-162.4	-179.6	-123.2	0	109.2	Y188 D189 Q243	Y188-K210 CarbonylContact O-C 3.59Å; Y188-K210 VanDerWaalsContact O-CA 3.3Å; Y188-K210 WeakPolarHBondContact O-CA 3.13Å; D189-K210 HydrophobicContact CB-CG 4.45Å; D189-K210 WeakPolarHBondContact OD1-CD 3.49Å; D189-K210 WeakPolarHBondContact OD1-CE 3.37Å; D189-K210 WeakPolarHBondContact OD1-CG 3.37Å; D189-K210 IonicContact OD1-NZ 2.62Å; D189-K210 PolarHBondContact OD1-NZ 2.89Å; D189-K210 IonicContact OD2-NZ 3.52Å; D189-K210 PolarHBondContact OD2-NZ 2.97Å; K210-Q243 HydrophobicContact CB-CB 4.16Å; K210-Q243 PolarHBondContact N-O 3.42Å; K210-Q243 PolarHBondContact O-N 2.91Å
211	F	88.6	Confident	89.7	Confident	18 Å²	18	39.3 Å²	39.3	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	120.5	-172.9	178.4	-85.3	0	0	0	109.7	I186 Y188 L209 F236 P240 T241 L242 M274	I186-F211 HydrophobicContact CG2-CD1 3.84Å; I186-F211 HydrophobicContact CG2-CE1 3.87Å; Y188-F211 WeakPolarHBondContact CB-O 3.27Å; Y188-F211 HydrophobicContact CD1-CB 4.27Å; Y188-F211 PolarHBondContact N-O 2.88Å; Y188-F211 PolarHBondContact O-N 2.8Å; L209-F211 HydrophobicContact CD1-CB 4.47Å; F211-F236 HydrophobicContact CE1-CD1 4.38Å; F211-F236 AromaticContact CE1-CE1 3.47Å; F211-F236 HydrophobicContact CE1-CE1 3.47Å; F211-F236 VanDerWaalsContact CE1-CE1 3.47Å; F211-F236 HydrophobicContact CE1-CE2 4.09Å; F211-F236 AromaticContact CE1-CZ 3.3Å; F211-F236 HydrophobicContact CE1-CZ 3.3Å; F211-F236 AromaticContact CZ-CD1 3.95Å; F211-F236 HydrophobicContact CZ-CD1 3.95Å; F211-F236 HydrophobicContact CZ-CD2 4.09Å; F211-F236 AromaticContact CZ-CE1 3.42Å; F211-F236 HydrophobicContact CZ-CE1 3.42Å; F211-F236 VanDerWaalsContact CZ-CE1 3.42Å; F211-F236 AromaticContact CZ-CE2 3.57Å; F211-F236 HydrophobicContact CZ-CE2 3.57Å; F211-F236 HydrophobicContact CZ-CG 4.27Å; F211-F236 AromaticContact CZ-CZ 3.22Å; F211-F236 HydrophobicContact CZ-CZ 3.22Å; F211-P240 HydrophobicContact CD2-CB 4.29Å; F211-P240 HydrophobicContact CD2-CG 4.5Å; F211-P240 HydrophobicContact CE1-CB 4.34Å; F211-P240 HydrophobicContact CE2-CB 3.38Å; F211-P240 HydrophobicContact CE2-CG 3.41Å; F211-P240 VanDerWaalsContact CE2-CG 3.41Å; F211-P240 HydrophobicContact CZ-CB 3.39Å; F211-P240 HydrophobicContact CZ-CG 3.69Å; F211-T241 WeakPolarHBondContact CA-O 3.28Å; F211-L242 HydrophobicContact CD2-CD1 3.8Å; F211-M274 HydrophobicContact CD2-CE 4.23Å; F211-M274 HydrophobicContact CE2-CE 3.29Å; F211-M274 HydrophobicContact CE2-SD 3.85Å; F211-M274 HydrophobicContact CZ-CE 3.51Å
212	Q	90.8	Very high	90.1	Very high	117 Å²	117	38.3 Å²	38.3	55%	0.547	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.7	176.5	178.6	-173.7	8.4	0	0	110.2	I186 P240 T241	I186-Q212 WeakPolarHBondContact O-CA 3.33Å; I186-Q212 WeakPolarHBondContact O-CG 2.9Å; Q212-P240 CarbonylContact O-C 3.43Å; Q212-P240 WeakPolarHBondContact O-CA 3.26Å; Q212-P240 WeakPolarHBondContact O-CB 3.47Å; Q212-T241 WeakPolarHBondContact CB-OG1 3.46Å; Q212-T241 PolarHBondContact N-O 2.9Å; Q212-T241 VanDerWaalsContact N-O 3.08Å; Q212-T241 PolarHBondContact O-N 3.38Å; Q212-T241 PolarHBondContact O-OG1 3.28Å
213	G	88.9	Confident	90.2	Very high	17 Å²	17	39.8 Å²	39.8	18%	0.175	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.2	166.6	179	0	0	0	0	0	113.9	I186	I186-G213 WeakPolarHBondContact CB-O 3.33Å; I186-G213 PolarHBondContact N-O 2.69Å; I186-G213 PolarHBondContact O-N 3.03Å; I186-G213 VanDerWaalsContact O-N 3.09Å
214	M	87.7	Confident	90.2	Very high	75 Å²	75	41.4 Å²	41.4	37%	0.369	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	107.6	174.8	-168.4	-179.5	-67.9	0	0	109.4	D183 N185 F236 I237	D183-M214 HydrophobicContact CB-CG 4.11Å; D183-M214 HydrophobicContact CB-SD 4.14Å; N185-M214 WeakPolarHBondContact OD1-CE 3.44Å; M214-F236 WeakPolarHBondContact O-CD1 3.32Å; M214-I237 HydrophobicContact CG-CD1 4.02Å; M214-I237 PolarHBondContact O-N 2.8Å; M214-I237 HydrophobicContact SD-CD1 3.77Å
215	L	90.9	Very high	89.9	Confident	18 Å²	18	47.7 Å²	47.7	9%	0.094	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126	172	-177.4	76.8	0	0	0	108.8	D183 M184 I186 V217 F234 F235 F236	D183-L215 WeakPolarHBondContact CA-O 3.32Å; M184-L215 PolarHBondContact N-O 3.39Å; M184-L215 PolarHBondContact O-N 3.42Å; I186-L215 HydrophobicContact CD1-CB 3.59Å; I186-L215 HydrophobicContact CD1-CD2 3.73Å; I186-L215 HydrophobicContact CD1-CG 4.22Å; I186-L215 HydrophobicContact CG1-CB 4.26Å; L215-V217 HydrophobicContact CD2-CG2 3.76Å; L215-V217 HydrophobicContact CG-CG2 4.18Å; L215-F234 HydrophobicContact CD1-CB 4.13Å; L215-F234 HydrophobicContact CD1-CD2 4.03Å; L215-F234 HydrophobicContact CD2-CB 4.25Å; L215-F234 HydrophobicContact CD2-CD2 4.36Å; L215-F234 HydrophobicContact CG-CB 4.32Å; L215-F235 WeakPolarHBondContact CD1-O 3.48Å; L215-F236 HydrophobicContact CB-CD1 4.18Å; L215-F236 HydrophobicContact CB-CE1 3.6Å; L215-F236 HydrophobicContact CB-CZ 3.8Å; L215-F236 HydrophobicContact CD1-CD1 4.34Å; L215-F236 HydrophobicContact CD1-CD2 3.78Å; L215-F236 HydrophobicContact CD1-CE1 3.97Å; L215-F236 HydrophobicContact CD1-CE2 3.37Å; L215-F236 HydrophobicContact CD1-CG 4.24Å; L215-F236 HydrophobicContact CD1-CZ 3.46Å; L215-F236 VanDerWaalsContact CD1-CZ 3.46Å; L215-F236 HydrophobicContact CG-CE1 4.41Å; L215-F236 HydrophobicContact CG-CZ 4.16Å
216	R	91	Very high	89.5	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.015	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	134.1	163.5	-177.1	156.2	-72.1	175.6	3.9	109.6	I181 D183 I218 F234 F235 I237 P365	I181-R216 HydrophobicContact CG2-CG 3.91Å; D183-R216 WeakPolarHBondContact OD1-CA 3.3Å; D183-R216 WeakPolarHBondContact OD1-CB 3.14Å; D183-R216 WeakPolarHBondContact OD1-CG 3.24Å; D183-R216 IonicContact OD1-CZ 2.55Å; D183-R216 IonicContact OD1-NE 2.62Å; D183-R216 PolarHBondContact OD1-NE 2.83Å; D183-R216 IonicContact OD1-NH2 2.68Å; D183-R216 IonicContact OD2-CZ 3.61Å; D183-R216 IonicContact OD2-NE 3.31Å; D183-R216 IonicContact OD2-NH2 3.41Å; D183-R216 PolarHBondContact OD2-NH2 3.41Å; R216-I218 HydrophobicContact CG-CD1 4.42Å; R216-I218 HydrophobicContact CG-CG1 3.91Å; R216-F234 WeakPolarHBondContact O-CA 3.32Å; R216-F234 VanDerWaalsContact O-CB 3.31Å; R216-F234 WeakPolarHBondContact O-CB 3.47Å; R216-F235 HydrophobicContact CB-CD2 4.26Å; R216-F235 HydrophobicContact CB-CE2 3.76Å; R216-F235 HydrophobicContact CB-CZ 3.94Å; R216-F235 HydrophobicContact CG-CE1 4.49Å; R216-F235 HydrophobicContact CG-CE2 4.13Å; R216-F235 HydrophobicContact CG-CZ 3.84Å; R216-F235 PolarHBondContact N-O 2.88Å; R216-F235 PolarHBondContact O-N 3.35Å; R216-F235 VanDerWaalsContact O-N 3.13Å; R216-I237 HydrophobicContact CB-CD1 4.02Å; R216-I237 HydrophobicContact CB-CG1 3.8Å; R216-P365 PolarHBondContact NH1-O 2.84Å; R216-P365 PolarHBondContact NH2-O 2.84Å
217	V	92.3	Very high	89.3	Confident	14 Å²	14	54.1 Å²	54.1	9%	0.085	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.4	169.6	-175.1	0	0	0	0	107.7	L182 M184 L215 L219 V232 T233 F234	L182-V217 HydrophobicContact CB-CB 4.38Å; L182-V217 PolarHBondContact N-O 2.9Å; L182-V217 PolarHBondContact O-N 2.82Å; M184-V217 HydrophobicContact CE-CB 4.24Å; M184-V217 HydrophobicContact CE-CG2 3.92Å; M184-V217 HydrophobicContact SD-CG2 3.97Å; L215-V217 HydrophobicContact CD2-CG2 3.76Å; L215-V217 HydrophobicContact CG-CG2 4.18Å; V217-L219 HydrophobicContact CG1-CD2 4.17Å; V217-V232 HydrophobicContact CG1-CG1 3.67Å; V217-T233 CarbonylContact C-O 3.56Å; V217-F234 HydrophobicContact CG2-CB 4.09Å
218	I	90.9	Very high	89.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.3	176.4	-51.3	-170.8	0	0	0	108.1	E179 V180 I181 R216 E220 T233 F235 E363	E179-I218 HydrophobicContact CB-CG2 4.21Å; V180-I218 WeakPolarHBondContact O-CA 2.9Å; I181-I218 HydrophobicContact CD1-CD1 4.43Å; I181-I218 HydrophobicContact CG1-CD1 4.37Å; I181-I218 HydrophobicContact CG1-CG1 4.18Å; I181-I218 HydrophobicContact CG1-CG2 4.3Å; R216-I218 HydrophobicContact CG-CD1 4.42Å; R216-I218 HydrophobicContact CG-CG1 3.91Å; I218-E220 HydrophobicContact CG2-CB 4.07Å; I218-T233 PolarHBondContact N-O 3.17Å; I218-T233 PolarHBondContact O-N 2.72Å; I218-F235 HydrophobicContact CD1-CE1 3.93Å; I218-F235 HydrophobicContact CD1-CZ 3.94Å; I218-F235 HydrophobicContact CG1-CE1 4.27Å; I218-F235 HydrophobicContact CG1-CZ 4.45Å; I218-E363 HydrophobicContact CD1-CG 4.49Å; I218-E363 WeakPolarHBondContact CD1-OE1 3.42Å
219	L	90.9	Very high	89.2	Confident	39 Å²	39	56.4 Å²	56.4	20%	0.204	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	103.4	174.2	-52.5	-178.2	0	0	0	107.8	E179 V180 L182 V217 V229 V232	E179-L219 CarbonylContact C-O 3.52Å; E179-L219 VanDerWaalsContact CA-O 3.27Å; E179-L219 WeakPolarHBondContact CA-O 3.31Å; V180-L219 HydrophobicContact CB-CB 4.17Å; V180-L219 HydrophobicContact CB-CD1 4.23Å; V180-L219 HydrophobicContact CB-CG 4.4Å; V180-L219 PolarHBondContact N-O 2.72Å; V180-L219 PolarHBondContact O-N 2.88Å; L182-L219 HydrophobicContact CD1-CD1 4.3Å; V217-L219 HydrophobicContact CG1-CD2 4.17Å; L219-V229 HydrophobicContact CB-CG1 3.81Å; L219-V229 HydrophobicContact CB-CG2 4.03Å; L219-V229 HydrophobicContact CD1-CG2 4.31Å; L219-V229 HydrophobicContact CD2-CG1 4.35Å; L219-V232 HydrophobicContact CD2-CB 4.38Å; L219-V232 HydrophobicContact CD2-CG1 4Å; L219-V232 HydrophobicContact CD2-CG2 3.89Å
220	E	87.8	Confident	89.1	Confident	60 Å²	60	55 Å²	55	28%	0.28	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	144.9	-171.4	-171.7	-169.2	-179.3	0	0	111	E179 I218 G231	E179-E220 HydrophobicContact CB-CB 4.26Å; E179-E220 HydrophobicContact CB-CG 4.32Å; I218-E220 HydrophobicContact CG2-CB 4.07Å; E220-G231 PolarHBondContact N-O 2.91Å; E220-G231 VanDerWaalsContact N-O 3.07Å; E220-G231 CarbonylContact O-C 3.41Å; E220-G231 WeakPolarHBondContact O-CA 3.35Å; E220-G231 PolarHBondContact O-N 2.79Å; E220-G231 VanDerWaalsContact O-O 3.05Å
221	P	88	Confident	89.1	Confident	41 Å²	41	51.3 Å²	51.3	27%	0.266	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-75.2	150.3	-17.5	31.8	-34.4	0	0	0	110.4	I223 G230 L288	P221-I223 HydrophobicContact CG-CG2 4.34Å; P221-G230 PolarHBondContact O-N 3.25Å; P221-L288 HydrophobicContact CG-CD1 3.88Å
222	L	88.1	Confident	89.2	Confident	70 Å²	70	52 Å²	52	37%	0.366	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	132.5	164.9	-65.4	178.4	0	0	0	109.9	R178 V180 L228 V229	R178-L222 WeakPolarHBondContact O-CB 3.42Å; R178-L222 WeakPolarHBondContact O-CG 3.34Å; R178-L222 PolarHBondContact O-N 2.89Å; V180-L222 HydrophobicContact CG2-CD1 4.05Å; V180-L222 HydrophobicContact CG2-CD2 4.18Å; L222-L228 WeakPolarHBondContact CA-O 3.42Å; L222-V229 HydrophobicContact CD2-CG2 4.06Å
223	I	88.8	Confident	89.2	Confident	48 Å²	48	46.4 Å²	46.4	25%	0.246	27%	0.273	C	S	.	.			trans	-124.9	150.6	-175.6	55.7	167	0	0	0	111	P221 Q225 L228 I285	P221-I223 HydrophobicContact CG-CG2 4.34Å; I223-Q225 WeakPolarHBondContact CD1-O 3.4Å; I223-Q225 WeakPolarHBondContact CG1-O 3.48Å; I223-Q225 PolarHBondContact O-N 3.29Å; I223-L228 VanDerWaalsContact CG1-C 3.43Å; I223-L228 PolarHBondContact N-O 2.73Å; I223-L228 WeakPolarHBondContact O-CA 3.42Å; I223-L228 WeakPolarHBondContact O-CD2 3.38Å; I223-I285 HydrophobicContact CD1-CD1 4.27Å; I223-I285 HydrophobicContact CD1-CG2 4.25Å
224	S	87.4	Confident	89.3	Confident	118 Å²	118	48 Å²	48	83%	0.825	28%	0.275	S	S	*	.	S	Bend	trans	-81.8	9.6	-177.2	54.7	0	0	0	0	114.8
225	Q	86.1	Confident	89.4	Confident	146 Å²	146	44.8 Å²	44.8	68%	0.682	26%	0.259	S	S	*	.	S	Bend	trans	-130.3	149.8	-180	-61.5	-176	5.3	0	0	109.5	I223 L228	I223-Q225 WeakPolarHBondContact CD1-O 3.4Å; I223-Q225 WeakPolarHBondContact CG1-O 3.48Å; I223-Q225 PolarHBondContact O-N 3.29Å; Q225-L228 WeakPolarHBondContact O-CA 3.48Å; Q225-L228 PolarHBondContact O-N 2.78Å
226	A	84.6	Confident	89.3	Confident	95 Å²	95	44.7 Å²	44.7	79%	0.785	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	135.8	175.9	0	0	0	0	0	110.8
227	P	88.8	Confident	88.7	Confident	72 Å²	72	45.4 Å²	45.4	47%	0.468	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.1	21.9	14.5	36.1	-37	0	0	0	116	V229 L284	P227-V229 PolarHBondContact O-N 2.92Å; P227-L284 HydrophobicContact CG-CB 4.16Å; P227-L284 HydrophobicContact CG-CD1 4.43Å
228	L	89.3	Confident	88.1	Confident	106 Å²	106	51.9 Å²	51.9	56%	0.555	29%	0.285	S	S	*	.	S	Bend	trans	66.7	-12.5	-179.1	-55.4	176.1	0	0	0	115.8	L222 I223 Q225	L222-L228 WeakPolarHBondContact CA-O 3.42Å; I223-L228 VanDerWaalsContact CG1-C 3.43Å; I223-L228 PolarHBondContact N-O 2.73Å; I223-L228 WeakPolarHBondContact O-CA 3.42Å; I223-L228 WeakPolarHBondContact O-CD2 3.38Å; Q225-L228 WeakPolarHBondContact O-CA 3.48Å; Q225-L228 PolarHBondContact O-N 2.78Å
229	V	90.6	Very high	87.7	Confident	19 Å²	19	56 Å²	56	12%	0.115	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.8	176.5	177.4	0	0	0	0	108.6	L219 L222 P227 G231 L284	L219-V229 HydrophobicContact CB-CG1 3.81Å; L219-V229 HydrophobicContact CB-CG2 4.03Å; L219-V229 HydrophobicContact CD1-CG2 4.31Å; L219-V229 HydrophobicContact CD2-CG1 4.35Å; L222-V229 HydrophobicContact CD2-CG2 4.06Å; P227-V229 PolarHBondContact O-N 2.92Å; V229-G231 WeakPolarHBondContact CG1-O 3.48Å; V229-L284 HydrophobicContact CB-CD1 4.04Å; V229-L284 HydrophobicContact CG1-CD1 3.99Å
230	G	88.8	Confident	87.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-37.3	177.3	0	0	0	0	0	113.4	P221 L284 I285 L288	P221-G230 PolarHBondContact O-N 3.25Å; G230-L284 WeakPolarHBondContact O-CA 3.13Å; G230-L284 PolarHBondContact O-N 2.92Å; G230-I285 PolarHBondContact O-N 3.26Å; G230-L288 WeakPolarHBondContact O-CD2 3.18Å
231	G	90.7	Very high	87.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	160.6	179.9	0	0	0	0	0	113.4	E220 V229 I282	E220-G231 PolarHBondContact N-O 2.91Å; E220-G231 VanDerWaalsContact N-O 3.07Å; E220-G231 CarbonylContact O-C 3.41Å; E220-G231 WeakPolarHBondContact O-CA 3.35Å; E220-G231 PolarHBondContact O-N 2.79Å; E220-G231 VanDerWaalsContact O-O 3.05Å; V229-G231 WeakPolarHBondContact CG1-O 3.48Å; G231-I282 WeakPolarHBondContact CA-O 3.48Å
232	V	91.8	Very high	87.4	Confident	32 Å²	32	55.2 Å²	55.2	19%	0.194	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	120.6	175.9	-174.7	0	0	0	0	108.5	V217 L219 F234 C281 I282 L284	V217-V232 HydrophobicContact CG1-CG1 3.67Å; L219-V232 HydrophobicContact CD2-CB 4.38Å; L219-V232 HydrophobicContact CD2-CG1 4Å; L219-V232 HydrophobicContact CD2-CG2 3.89Å; V232-F234 HydrophobicContact CG1-CD1 4.41Å; V232-C281 WeakPolarHBondContact O-CA 3.36Å; V232-I282 PolarHBondContact N-O 2.9Å; V232-I282 PolarHBondContact O-N 3.12Å; V232-L284 HydrophobicContact CG2-CD1 3.91Å; V232-L284 HydrophobicContact CG2-CD2 4.3Å; V232-L284 HydrophobicContact CG2-CG 4.21Å
233	T	90.4	Very high	87.5	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.4	-178.2	-61	0	0	0	0	109.7	V217 I218 R279 M280 C281	V217-T233 CarbonylContact C-O 3.56Å; I218-T233 PolarHBondContact N-O 3.17Å; I218-T233 PolarHBondContact O-N 2.72Å; T233-R279 HydrophobicContact CG2-CB 3.77Å; T233-R279 HydrophobicContact CG2-CG 4.27Å; T233-M280 CarbonylContact C-O 3.54Å; T233-M280 WeakPolarHBondContact CA-O 3.45Å; T233-C281 HydrophobicContact CG2-CB 4.45Å; T233-C281 PolarHBondContact OG1-SG 3.45Å
234	F	90.7	Very high	87.5	Confident	51 Å²	51	55.9 Å²	55.9	22%	0.224	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	149.1	-176.7	60.6	-91.5	0	0	0	114	L215 R216 V217 V232 M280 I282	L215-F234 HydrophobicContact CD1-CB 4.13Å; L215-F234 HydrophobicContact CD1-CD2 4.03Å; L215-F234 HydrophobicContact CD2-CB 4.25Å; L215-F234 HydrophobicContact CD2-CD2 4.36Å; L215-F234 HydrophobicContact CG-CB 4.32Å; R216-F234 WeakPolarHBondContact O-CA 3.32Å; R216-F234 VanDerWaalsContact O-CB 3.31Å; R216-F234 WeakPolarHBondContact O-CB 3.47Å; V217-F234 HydrophobicContact CG2-CB 4.09Å; V232-F234 HydrophobicContact CG1-CD1 4.41Å; F234-M280 HydrophobicContact CD2-CB 4.07Å; F234-M280 HydrophobicContact CE1-CB 4.35Å; F234-M280 HydrophobicContact CE1-CG 4.01Å; F234-M280 HydrophobicContact CE1-SD 4.48Å; F234-M280 HydrophobicContact CE2-CB 3.76Å; F234-M280 HydrophobicContact CE2-CG 3.83Å; F234-M280 HydrophobicContact CE2-SD 3.67Å; F234-M280 HydrophobicContact CZ-CB 3.92Å; F234-M280 HydrophobicContact CZ-CE 3.89Å; F234-M280 HydrophobicContact CZ-CG 3.52Å; F234-M280 HydrophobicContact CZ-SD 3.48Å; F234-M280 WeakPolarHBondContact CZ-SD 3.39Å; F234-M280 PolarHBondContact N-O 3.47Å; F234-M280 PolarHBondContact O-N 3.47Å; F234-I282 HydrophobicContact CE1-CD1 3.85Å; F234-I282 HydrophobicContact CE1-CG1 4.19Å; F234-I282 HydrophobicContact CZ-CD1 4.36Å
235	F	89.9	Confident	87.7	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	160.7	-176.2	50.6	-89.8	0	0	0	109.9	L215 R216 I218 L276 N278 R279 E363	L215-F235 WeakPolarHBondContact CD1-O 3.48Å; R216-F235 HydrophobicContact CB-CD2 4.26Å; R216-F235 HydrophobicContact CB-CE2 3.76Å; R216-F235 HydrophobicContact CB-CZ 3.94Å; R216-F235 HydrophobicContact CG-CE1 4.49Å; R216-F235 HydrophobicContact CG-CE2 4.13Å; R216-F235 HydrophobicContact CG-CZ 3.84Å; R216-F235 PolarHBondContact N-O 2.88Å; R216-F235 PolarHBondContact O-N 3.35Å; R216-F235 VanDerWaalsContact O-N 3.13Å; I218-F235 HydrophobicContact CD1-CE1 3.93Å; I218-F235 HydrophobicContact CD1-CZ 3.94Å; I218-F235 HydrophobicContact CG1-CE1 4.27Å; I218-F235 HydrophobicContact CG1-CZ 4.45Å; F235-L276 HydrophobicContact CD1-CD2 4.22Å; F235-L276 HydrophobicContact CD2-CD1 4.08Å; F235-L276 HydrophobicContact CD2-CD2 3.78Å; F235-L276 HydrophobicContact CD2-CG 3.64Å; F235-L276 HydrophobicContact CE1-CD2 4.33Å; F235-L276 HydrophobicContact CE2-CD1 3.78Å; F235-L276 HydrophobicContact CE2-CD2 3.9Å; F235-L276 HydrophobicContact CE2-CG 3.84Å; F235-L276 HydrophobicContact CG-CD2 3.95Å; F235-L276 HydrophobicContact CG-CG 4.24Å; F235-L276 HydrophobicContact CZ-CD2 4.18Å; F235-N278 WeakPolarHBondContact CB-O 3.29Å; F235-R279 HydrophobicContact CD1-CB 4.29Å; F235-R279 HydrophobicContact CD1-CG 3.75Å; F235-R279 HydrophobicContact CE1-CG 4.3Å; F235-R279 HydrophobicContact CG-CG 4.41Å; F235-E363 HydrophobicContact CE2-CG 4.23Å; F235-E363 HydrophobicContact CZ-CG 3.75Å
236	F	87.6	Confident	87.8	Confident	16 Å²	16	50.6 Å²	50.6	7%	0.07	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	135.8	172.7	-70.7	-88.4	0	0	0	110.6	I186 F211 M214 L215 P240 M274 V275	I186-F236 HydrophobicContact CD1-CE1 4.33Å; I186-F236 HydrophobicContact CD1-CZ 4.09Å; F211-F236 HydrophobicContact CE1-CD1 4.38Å; F211-F236 AromaticContact CE1-CE1 3.47Å; F211-F236 HydrophobicContact CE1-CE1 3.47Å; F211-F236 VanDerWaalsContact CE1-CE1 3.47Å; F211-F236 HydrophobicContact CE1-CE2 4.09Å; F211-F236 AromaticContact CE1-CZ 3.3Å; F211-F236 HydrophobicContact CE1-CZ 3.3Å; F211-F236 AromaticContact CZ-CD1 3.95Å; F211-F236 HydrophobicContact CZ-CD1 3.95Å; F211-F236 HydrophobicContact CZ-CD2 4.09Å; F211-F236 AromaticContact CZ-CE1 3.42Å; F211-F236 HydrophobicContact CZ-CE1 3.42Å; F211-F236 VanDerWaalsContact CZ-CE1 3.42Å; F211-F236 AromaticContact CZ-CE2 3.57Å; F211-F236 HydrophobicContact CZ-CE2 3.57Å; F211-F236 HydrophobicContact CZ-CG 4.27Å; F211-F236 AromaticContact CZ-CZ 3.22Å; F211-F236 HydrophobicContact CZ-CZ 3.22Å; M214-F236 WeakPolarHBondContact O-CD1 3.32Å; L215-F236 HydrophobicContact CB-CD1 4.18Å; L215-F236 HydrophobicContact CB-CE1 3.6Å; L215-F236 HydrophobicContact CB-CZ 3.8Å; L215-F236 HydrophobicContact CD1-CD1 4.34Å; L215-F236 HydrophobicContact CD1-CD2 3.78Å; L215-F236 HydrophobicContact CD1-CE1 3.97Å; L215-F236 HydrophobicContact CD1-CE2 3.37Å; L215-F236 HydrophobicContact CD1-CG 4.24Å; L215-F236 HydrophobicContact CD1-CZ 3.46Å; L215-F236 VanDerWaalsContact CD1-CZ 3.46Å; L215-F236 HydrophobicContact CG-CE1 4.41Å; L215-F236 HydrophobicContact CG-CZ 4.16Å; F236-P240 HydrophobicContact CB-CG 4.45Å; F236-P240 HydrophobicContact CD1-CB 4.2Å; F236-P240 HydrophobicContact CG-CB 4.4Å; F236-P240 HydrophobicContact CG-CG 4.25Å; F236-M274 HydrophobicContact CD2-CB 4.07Å; F236-M274 HydrophobicContact CD2-CE 3.91Å; F236-M274 HydrophobicContact CE2-CE 3.6Å; F236-M274 HydrophobicContact CZ-CE 4.45Å; F236-M274 PolarHBondContact N-O 3.05Å; F236-V275 HydrophobicContact CB-CG1 4.13Å; F236-V275 WeakPolarHBondContact O-CA 3.4Å
237	I	78.8	Confident	88	Confident	20 Å²	20	48.9 Å²	48.9	10%	0.103	24%	0.243	C	C	.	.	S	Bend	trans	-72.7	-56.5	-176.9	-62.5	175.4	0	0	0	110	D183 M214 R216 G366	D183-I237 WeakPolarHBondContact OD2-CD1 3.35Å; M214-I237 HydrophobicContact CG-CD1 4.02Å; M214-I237 PolarHBondContact O-N 2.8Å; M214-I237 HydrophobicContact SD-CD1 3.77Å; R216-I237 HydrophobicContact CB-CD1 4.02Å; R216-I237 HydrophobicContact CB-CG1 3.8Å; I237-G366 WeakPolarHBondContact CG2-O 3.38Å
238	R	79.4	Confident	87.7	Confident	150 Å²	150	46.7 Å²	46.7	57%	0.566	23%	0.234	S	C	*	.	S	Bend	trans	-98.5	162.2	170.2	-59.8	-174.8	-175.2	-173.3	-2.3	109.7	P240 V275 E368	R238-P240 WeakPolarHBondContact O-CD 3.45Å; R238-V275 WeakPolarHBondContact O-CG1 3.17Å; R238-E368 IonicContact CZ-OE1 2.75Å; R238-E368 IonicContact CZ-OE2 3.63Å; R238-E368 VanDerWaalsContact NE-CD 3.28Å; R238-E368 IonicContact NE-OE1 2.69Å; R238-E368 PolarHBondContact NE-OE1 3.48Å; R238-E368 IonicContact NE-OE2 3.03Å; R238-E368 PolarHBondContact NE-OE2 3.48Å; R238-E368 VanDerWaalsContact NE-OE2 3.12Å; R238-E368 IonicContact NH2-OE1 3.61Å; R238-E368 PolarHBondContact NH2-OE1 2.66Å; R238-E368 IonicContact NH2-OE2 2.74Å; R238-E368 PolarHBondContact NH2-OE2 2.65Å
239	R	82.6	Confident	87.4	Confident	85 Å²	85	42.4 Å²	42.4	32%	0.321	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-58.4	121	171.1	-67.6	-178.3	178.1	-154.9	-1.9	109.5	V275 G336	R239-V275 HydrophobicContact CG-CG1 4.23Å; R239-G336 PolarHBondContact NE-O 3.49Å; R239-G336 PolarHBondContact NH2-O 2.89Å
240	P	86.8	Confident	87	Confident	10 Å²	10	44.3 Å²	44.3	7%	0.065	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-72.9	150.2	-178.3	29.2	-34.2	0	0	0	111.3	F211 Q212 F236 R238 L242 M274	F211-P240 HydrophobicContact CD2-CB 4.29Å; F211-P240 HydrophobicContact CD2-CG 4.5Å; F211-P240 HydrophobicContact CE1-CB 4.34Å; F211-P240 HydrophobicContact CE2-CB 3.38Å; F211-P240 HydrophobicContact CE2-CG 3.41Å; F211-P240 VanDerWaalsContact CE2-CG 3.41Å; F211-P240 HydrophobicContact CZ-CB 3.39Å; F211-P240 HydrophobicContact CZ-CG 3.69Å; Q212-P240 CarbonylContact O-C 3.43Å; Q212-P240 WeakPolarHBondContact O-CA 3.26Å; Q212-P240 WeakPolarHBondContact O-CB 3.47Å; F236-P240 HydrophobicContact CB-CG 4.45Å; F236-P240 HydrophobicContact CD1-CB 4.2Å; F236-P240 HydrophobicContact CG-CB 4.4Å; F236-P240 HydrophobicContact CG-CG 4.25Å; R238-P240 WeakPolarHBondContact O-CD 3.45Å; P240-L242 PolarHBondContact O-N 3.25Å; P240-L242 VanDerWaalsContact O-N 3.13Å; P240-M274 HydrophobicContact CG-SD 4.44Å
241	T	87.1	Confident	86.8	Confident	86 Å²	86	48.2 Å²	48.2	53%	0.528	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	101.9	173.4	43.7	0	0	0	0	109.3	F211 Q212	F211-T241 WeakPolarHBondContact CA-O 3.28Å; Q212-T241 WeakPolarHBondContact CB-OG1 3.46Å; Q212-T241 PolarHBondContact N-O 2.9Å; Q212-T241 VanDerWaalsContact N-O 3.08Å; Q212-T241 PolarHBondContact O-N 3.38Å; Q212-T241 PolarHBondContact O-OG1 3.28Å
242	L	88.1	Confident	86.4	Confident	28 Å²	28	49.3 Å²	49.3	15%	0.147	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.4	-178.6	-175.8	72.9	0	0	0	109.6	L209 F211 P240 I244 M267 I270	L209-L242 HydrophobicContact CD1-CD1 3.57Å; F211-L242 HydrophobicContact CD2-CD1 3.8Å; P240-L242 PolarHBondContact O-N 3.25Å; P240-L242 VanDerWaalsContact O-N 3.13Å; L242-I244 HydrophobicContact CD1-CD1 4.23Å; L242-I244 HydrophobicContact CD1-CG1 4.24Å; L242-I244 HydrophobicContact CD2-CD1 4.04Å; L242-I244 HydrophobicContact CG-CD1 4.18Å; L242-I244 HydrophobicContact CG-CG1 4.17Å; L242-M267 VanDerWaalsContact C-CE 3.48Å; L242-M267 HydrophobicContact CB-CE 4.02Å; L242-M267 HydrophobicContact CD2-CE 3.83Å; L242-M267 HydrophobicContact CD2-SD 3.96Å; L242-M267 HydrophobicContact CG-CE 3.6Å; L242-M267 HydrophobicContact CG-SD 4.32Å; L242-M267 WeakPolarHBondContact O-CE 3.38Å; L242-I270 HydrophobicContact CD2-CB 3.91Å; L242-I270 HydrophobicContact CD2-CG2 3.61Å
243	Q	89.7	Confident	86	Confident	118 Å²	118	49.4 Å²	49.4	55%	0.551	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	129.4	168.7	-56.9	179.1	-7	0	0	108.9	K210	K210-Q243 HydrophobicContact CB-CB 4.16Å; K210-Q243 PolarHBondContact N-O 3.42Å; K210-Q243 PolarHBondContact O-N 2.91Å
244	I	88.9	Confident	85.7	Confident	15 Å²	15	54.2 Å²	54.2	8%	0.077	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.8	-175.3	-66.8	-179.4	0	0	0	109	I206 L209 L242 W246 M267 I270	I206-I244 HydrophobicContact CB-CG2 4.25Å; I206-I244 HydrophobicContact CD1-CD1 4.39Å; I206-I244 HydrophobicContact CD1-CG2 3.94Å; I206-I244 HydrophobicContact CG1-CG2 3.66Å; I206-I244 HydrophobicContact CG2-CG2 3.82Å; L209-I244 HydrophobicContact CD1-CD1 4.34Å; L209-I244 HydrophobicContact CD1-CG1 3.79Å; L242-I244 HydrophobicContact CD1-CD1 4.23Å; L242-I244 HydrophobicContact CD1-CG1 4.24Å; L242-I244 HydrophobicContact CD2-CD1 4.04Å; L242-I244 HydrophobicContact CG-CD1 4.18Å; L242-I244 HydrophobicContact CG-CG1 4.17Å; I244-W246 HydrophobicContact CB-CD2 4.45Å; I244-W246 HydrophobicContact CB-CZ2 4.2Å; I244-W246 HydrophobicContact CD1-CH2 4.34Å; I244-W246 HydrophobicContact CD1-CZ2 3.89Å; I244-W246 HydrophobicContact CG2-CD2 3.55Å; I244-W246 VanDerWaalsContact CG2-CE2 3.4Å; I244-W246 HydrophobicContact CG2-CE3 4.08Å; I244-W246 HydrophobicContact CG2-CG 3.88Å; I244-W246 HydrophobicContact CG2-CH2 4.33Å; I244-W246 HydrophobicContact CG2-CZ2 3.83Å; I244-W246 HydrophobicContact CG2-CZ3 4.44Å; I244-W246 VanDerWaalsContact O-CD1 3.27Å; I244-W246 PolarHBondContact O-N 3.44Å; I244-M267 HydrophobicContact CB-CE 4.13Å; I244-M267 HydrophobicContact CB-SD 3.92Å; I244-M267 HydrophobicContact CD1-CE 4.39Å; I244-M267 HydrophobicContact CD1-SD 3.77Å; I244-M267 HydrophobicContact CG1-CE 3.98Å; I244-M267 HydrophobicContact CG1-SD 3.88Å; I244-I270 HydrophobicContact CD1-CD1 4.14Å
245	N	90.5	Very high	85.3	Confident	94 Å²	94	52.6 Å²	52.6	50%	0.503	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	92.3	173.8	-68.2	-14.5	0	0	0	108.8	K207 G208	K207-N245 PolarHBondContact N-O 2.96Å; G208-N245 PolarHBondContact O-N 3.09Å
246	W	88.3	Confident	84.7	Confident	58 Å²	58	58.4 Å²	58.4	22%	0.22	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	148.3	-177.1	-58	95.2	0	0	0	113.8	V204 G205 I206 I244 M249 I266 M267 I270	V204-W246 HydrophobicContact CG1-CE3 3.91Å; V204-W246 HydrophobicContact CG1-CZ3 4.22Å; G205-W246 CarbonylContact O-C 3.55Å; G205-W246 WeakPolarHBondContact O-CA 3.43Å; I206-W246 HydrophobicContact CD1-CE3 4.37Å; I206-W246 HydrophobicContact CD1-CH2 4.21Å; I206-W246 HydrophobicContact CD1-CZ3 3.87Å; I206-W246 HydrophobicContact CG1-CD2 4.48Å; I206-W246 HydrophobicContact CG1-CE3 3.74Å; I206-W246 HydrophobicContact CG1-CH2 4.46Å; I206-W246 HydrophobicContact CG1-CZ3 3.74Å; I244-W246 HydrophobicContact CB-CD2 4.45Å; I244-W246 HydrophobicContact CB-CZ2 4.2Å; I244-W246 HydrophobicContact CD1-CH2 4.34Å; I244-W246 HydrophobicContact CD1-CZ2 3.89Å; I244-W246 HydrophobicContact CG2-CD2 3.55Å; I244-W246 VanDerWaalsContact CG2-CE2 3.4Å; I244-W246 HydrophobicContact CG2-CE3 4.08Å; I244-W246 HydrophobicContact CG2-CG 3.88Å; I244-W246 HydrophobicContact CG2-CH2 4.33Å; I244-W246 HydrophobicContact CG2-CZ2 3.83Å; I244-W246 HydrophobicContact CG2-CZ3 4.44Å; I244-W246 VanDerWaalsContact O-CD1 3.27Å; I244-W246 PolarHBondContact O-N 3.44Å; W246-M249 HydrophobicContact CB-CB 3.75Å; W246-M249 HydrophobicContact CB-CG 4.3Å; W246-M249 HydrophobicContact CD2-CE 4.27Å; W246-M249 HydrophobicContact CD2-SD 4.24Å; W246-M249 HydrophobicContact CE3-SD 4.28Å; W246-M249 HydrophobicContact CG-CB 4.22Å; W246-M249 HydrophobicContact CG-CG 4.26Å; W246-M249 HydrophobicContact CZ2-CE 4.25Å; W246-I266 HydrophobicContact CH2-CG2 4.25Å; W246-I266 HydrophobicContact CZ2-CG2 4.11Å; W246-M267 HydrophobicContact CZ2-SD 4.14Å; W246-I270 HydrophobicContact CH2-CD1 4.25Å; W246-I270 HydrophobicContact CZ2-CD1 4.3Å
247	T	89.1	Confident	84.3	Confident	59 Å²	59	59.8 Å²	59.8	36%	0.362	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.6	164.7	49.3	0	0	0	0	110.4	V204 G205 K207 M249	V204-T247 CarbonylContact C-O 3.54Å; V204-T247 WeakPolarHBondContact CA-O 3.31Å; G205-T247 WeakPolarHBondContact CA-OG1 3.4Å; G205-T247 PolarHBondContact N-O 2.85Å; G205-T247 PolarHBondContact O-N 2.81Å; G205-T247 PolarHBondContact O-OG1 3.34Å; K207-T247 WeakPolarHBondContact CE-OG1 3.38Å; K207-T247 HydrophobicContact CG-CG2 3.53Å; T247-M249 PolarHBondContact O-N 2.65Å
248	G	82.9	Confident	84.5	Confident	27 Å²	27	59.2 Å²	59.2	28%	0.278	32%	0.318	S	S	.	.	S	Bend	trans	75.1	-5.5	179	0	0	0	0	0	115.8	T250 N251	G248-T250 PolarHBondContact O-N 2.83Å; G248-T250 VanDerWaalsContact O-N 3.15Å; G248-N251 VanDerWaalsContact O-CB 3.26Å; G248-N251 WeakPolarHBondContact O-CB 3.42Å; G248-N251 PolarHBondContact O-N 3.49Å
249	M	82.1	Confident	84.3	Confident	16 Å²	16	56.1 Å²	56.1	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-53.8	-34.5	-178.2	-173.6	63.4	154.4	0	0	114.3	V204 W246 T247 N251 L252 L253 I266	V204-M249 HydrophobicContact CG1-SD 4.5Å; W246-M249 HydrophobicContact CB-CB 3.75Å; W246-M249 HydrophobicContact CB-CG 4.3Å; W246-M249 HydrophobicContact CD2-CE 4.27Å; W246-M249 HydrophobicContact CD2-SD 4.24Å; W246-M249 HydrophobicContact CE3-SD 4.28Å; W246-M249 HydrophobicContact CG-CB 4.22Å; W246-M249 HydrophobicContact CG-CG 4.26Å; W246-M249 HydrophobicContact CZ2-CE 4.25Å; T247-M249 PolarHBondContact O-N 2.65Å; M249-N251 PolarHBondContact O-N 3.31Å; M249-L252 WeakPolarHBondContact O-CB 3.17Å; M249-L252 PolarHBondContact O-N 3.2Å; M249-L252 HydrophobicContact SD-CD2 4.05Å; M249-L253 HydrophobicContact CG-CD1 4.31Å; M249-L253 HydrophobicContact CG-CG 4.39Å; M249-L253 PolarHBondContact O-N 2.9Å; M249-I266 HydrophobicContact CE-CB 4.18Å; M249-I266 HydrophobicContact CE-CD1 3.55Å; M249-I266 HydrophobicContact CE-CG1 4.44Å; M249-I266 HydrophobicContact CE-CG2 4.15Å
250	T	83.8	Confident	84.1	Confident	58 Å²	58	57.3 Å²	57.3	36%	0.356	34%	0.342	S	S	.	.	H	α-helix	trans	-56.8	-39.8	173.7	51.1	0	0	0	0	112.1	G248 L252 L253 D254 W761	G248-T250 PolarHBondContact O-N 2.83Å; G248-T250 VanDerWaalsContact O-N 3.15Å; T250-L252 PolarHBondContact O-N 2.88Å; T250-L253 PolarHBondContact O-N 2.93Å; T250-D254 WeakPolarHBondContact O-CB 3.47Å; T250-D254 PolarHBondContact O-N 2.88Å; T250-W761 HydrophobicContact CG2-CE3 4.08Å; T250-W761 HydrophobicContact CG2-CZ3 3.9Å
251	N	84.4	Confident	83.9	Confident	83 Å²	83	59.8 Å²	59.8	44%	0.444	35%	0.354	S	S	.	.	H	α-helix	trans	-68.3	-27.4	179.3	-51.5	-26.3	0	0	0	111.7	I202 G248 M249	I202-N251 WeakPolarHBondContact CD1-O 3.36Å; I202-N251 HydrophobicContact CG2-CB 4.33Å; G248-N251 VanDerWaalsContact O-CB 3.26Å; G248-N251 WeakPolarHBondContact O-CB 3.42Å; G248-N251 PolarHBondContact O-N 3.49Å; M249-N251 PolarHBondContact O-N 3.31Å
252	L	82	Confident	83.9	Confident	22 Å²	22	58 Å²	58	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-74.3	-46	172.5	-178.5	62.9	0	0	0	111.2	V198 I202 V204 M249 T250 S255 F258	V198-L252 HydrophobicContact CB-CD1 4.39Å; V198-L252 HydrophobicContact CG1-CD1 3.84Å; V198-L252 HydrophobicContact CG2-CD1 4.15Å; I202-L252 HydrophobicContact CG2-CB 4.24Å; I202-L252 HydrophobicContact CG2-CD1 4.38Å; V204-L252 HydrophobicContact CG2-CB 3.81Å; V204-L252 HydrophobicContact CG2-CD2 4.18Å; V204-L252 HydrophobicContact CG2-CG 4.48Å; M249-L252 WeakPolarHBondContact O-CB 3.17Å; M249-L252 PolarHBondContact O-N 3.2Å; M249-L252 HydrophobicContact SD-CD2 4.05Å; T250-L252 PolarHBondContact O-N 2.88Å; L252-S255 WeakPolarHBondContact O-CB 3.24Å; L252-S255 PolarHBondContact O-N 2.84Å; L252-F258 HydrophobicContact CD1-CD2 3.37Å; L252-F258 HydrophobicContact CD1-CE2 3.63Å; L252-F258 HydrophobicContact CD1-CG 4.14Å; L252-F258 HydrophobicContact CG-CD2 4.18Å
253	L	83.6	Confident	83.6	Confident	34 Å²	34	59.7 Å²	59.7	18%	0.178	35%	0.352	C	S	.	.	H	α-helix	trans	-73.8	-30	-178	-60	-175.2	0	0	0	113	M249 T250 S255 S259 L261 I266	M249-L253 HydrophobicContact CG-CD1 4.31Å; M249-L253 HydrophobicContact CG-CG 4.39Å; M249-L253 PolarHBondContact O-N 2.9Å; T250-L253 PolarHBondContact O-N 2.93Å; L253-S255 PolarHBondContact O-N 3.09Å; L253-S259 WeakPolarHBondContact O-CA 3.49Å; L253-S259 WeakPolarHBondContact O-CB 3.33Å; L253-L261 HydrophobicContact CD2-CB 4.17Å; L253-I266 HydrophobicContact CD2-CD1 4Å
254	D	82.6	Confident	83.3	Confident	103 Å²	103	60.8 Å²	60.8	55%	0.551	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-4.7	170.6	-76	-41.1	0	0	0	112.9	T250	T250-D254 WeakPolarHBondContact O-CB 3.47Å; T250-D254 PolarHBondContact O-N 2.88Å
255	S	82.9	Confident	83	Confident	16 Å²	16	61.1 Å²	61.1	11%	0.112	36%	0.362	C	S	.	.	S	Bend	trans	-68.3	132.7	173.3	-178.3	0	0	0	0	111.6	L252 L253 A257 F258 S259	L252-S255 WeakPolarHBondContact O-CB 3.24Å; L252-S255 PolarHBondContact O-N 2.84Å; L253-S255 PolarHBondContact O-N 3.09Å; S255-A257 PolarHBondContact O-N 3.13Å; S255-A257 PolarHBondContact OG-N 2.72Å; S255-F258 PolarHBondContact O-N 2.77Å; S255-S259 WeakPolarHBondContact O-CB 3.46Å; S255-S259 PolarHBondContact O-N 3.32Å
256	P	78.6	Confident	82.7	Confident	129 Å²	129	57.9 Å²	57.9	84%	0.838	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-13.3	173.5	-26.1	35.1	0	0	0	115.4
257	A	79.1	Confident	82.5	Confident	44 Å²	44	56.5 Å²	56.5	36%	0.364	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-14.2	176	0	0	0	0	0	114.3	A147 S255	A147-A257 HydrophobicContact CB-CB 3.51Å; S255-A257 PolarHBondContact O-N 3.13Å; S255-A257 PolarHBondContact OG-N 2.72Å
258	F	81.1	Confident	82.2	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.035	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	4.3	-173.8	-50.3	-65.9	0	0	0	113.7	A147 L148 V198 L252 S255 S260 L261	A147-F258 HydrophobicContact CB-CE1 4.4Å; A147-F258 HydrophobicContact CB-CE2 4.21Å; A147-F258 HydrophobicContact CB-CZ 3.66Å; L148-F258 HydrophobicContact CD1-CE1 4.34Å; L148-F258 HydrophobicContact CD1-CZ 4.47Å; L148-F258 HydrophobicContact CD2-CE1 4Å; L148-F258 HydrophobicContact CD2-CE2 4.09Å; L148-F258 HydrophobicContact CD2-CZ 3.38Å; L148-F258 HydrophobicContact CG-CE1 4Å; L148-F258 HydrophobicContact CG-CZ 3.69Å; V198-F258 HydrophobicContact CG1-CE2 4.4Å; L252-F258 HydrophobicContact CD1-CD2 3.37Å; L252-F258 HydrophobicContact CD1-CE2 3.63Å; L252-F258 HydrophobicContact CD1-CG 4.14Å; L252-F258 HydrophobicContact CG-CD2 4.18Å; S255-F258 PolarHBondContact O-N 2.77Å; F258-S260 PolarHBondContact O-N 2.93Å; F258-L261 HydrophobicContact CB-CD1 4.26Å; F258-L261 HydrophobicContact CD1-CD1 4.11Å; F258-L261 WeakPolarHBondContact O-CB 3.15Å; F258-L261 PolarHBondContact O-N 3.25Å
259	S	76.8	Confident	82.3	Confident	85 Å²	85	61.9 Å²	61.9	59%	0.594	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	0.6	-178.2	62.4	0	0	0	0	116	L253 S255	L253-S259 WeakPolarHBondContact O-CA 3.49Å; L253-S259 WeakPolarHBondContact O-CB 3.33Å; S255-S259 WeakPolarHBondContact O-CB 3.46Å; S255-S259 PolarHBondContact O-N 3.32Å
260	S	78.8	Confident	82.4	Confident	111 Å²	111	63.5 Å²	63.5	78%	0.776	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-3.4	168.4	63.5	0	0	0	0	113.5	F258	F258-S260 PolarHBondContact O-N 2.93Å
261	L	82.1	Confident	82.4	Confident	61 Å²	61	61.2 Å²	61.2	32%	0.319	35%	0.352	S	S	.	.			trans	-95.2	146.2	176.3	-58.8	180	0	0	0	110.2	L253 F258 I266	L253-L261 HydrophobicContact CD2-CB 4.17Å; F258-L261 HydrophobicContact CB-CD1 4.26Å; F258-L261 HydrophobicContact CD1-CD1 4.11Å; F258-L261 WeakPolarHBondContact O-CB 3.15Å; F258-L261 PolarHBondContact O-N 3.25Å; L261-I266 HydrophobicContact CB-CD1 4.26Å; L261-I266 HydrophobicContact CB-CG1 4.45Å; L261-I266 HydrophobicContact CD1-CD1 4.11Å; L261-I266 HydrophobicContact CD1-CG1 4.21Å
262	S	86.1	Confident	82.3	Confident	48 Å²	48	58.6 Å²	58.6	34%	0.336	34%	0.34	S	S	.	.			trans	-102.6	168.9	165	63.6	0	0	0	0	110.6	E264 A265 I266	S262-E264 VanDerWaalsContact C-N 3.29Å; S262-A265 PolarHBondContact O-N 3.33Å; S262-A265 WeakPolarHBondContact OG-CB 3.49Å; S262-A265 PolarHBondContact OG-N 3.21Å; S262-I266 PolarHBondContact O-N 2.72Å
263	E	81.9	Confident	82.2	Confident	65 Å²	65	62.6 Å²	62.6	30%	0.304	36%	0.361	S	S	.	.	H	α-helix	trans	-54.4	-49.3	166	-177.6	-179.8	-164.6	0	0	110.1	A265 I266 M267 R762	E263-A265 PolarHBondContact O-N 3.12Å; E263-I266 PolarHBondContact O-N 2.82Å; E263-I266 VanDerWaalsContact O-N 3.11Å; E263-M267 VanDerWaalsContact O-CG 3.26Å; E263-M267 WeakPolarHBondContact O-CG 3.48Å; E263-M267 PolarHBondContact O-N 2.91Å; E263-R762 IonicContact OE2-NH2 2.75Å; E263-R762 PolarHBondContact OE2-NH2 2.95Å
264	E	82.6	Confident	82.2	Confident	140 Å²	140	63.8 Å²	63.8	65%	0.654	37%	0.366	S	S	*	.	H	α-helix	trans	-57.4	-46.3	178.5	-66.8	159.3	173	0	0	112.3	S262 I266 M267 E268	S262-E264 VanDerWaalsContact C-N 3.29Å; E264-I266 VanDerWaalsContact C-N 3.26Å; E264-I266 PolarHBondContact O-N 3.15Å; E264-M267 CarbonylContact O-C 3.51Å; E264-M267 WeakPolarHBondContact O-CA 3.2Å; E264-M267 WeakPolarHBondContact O-CB 3.15Å; E264-M267 PolarHBondContact O-N 2.87Å; E264-M267 VanDerWaalsContact O-N 3.07Å; E264-E268 WeakPolarHBondContact O-CG 3.35Å; E264-E268 PolarHBondContact O-N 3.02Å
265	A	84.4	Confident	82.3	Confident	23 Å²	23	59 Å²	59	19%	0.19	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-32.7	177.6	0	0	0	0	0	112.8	S262 E263 I269	S262-A265 PolarHBondContact O-N 3.33Å; S262-A265 WeakPolarHBondContact OG-CB 3.49Å; S262-A265 PolarHBondContact OG-N 3.21Å; E263-A265 PolarHBondContact O-N 3.12Å; A265-I269 WeakPolarHBondContact O-CD1 3.47Å; A265-I269 WeakPolarHBondContact O-CG1 3.45Å; A265-I269 PolarHBondContact O-N 2.87Å
266	I	84.3	Confident	82.4	Confident	26 Å²	26	58.9 Å²	58.9	13%	0.133	34%	0.339	C	S	.	.	H	α-helix	trans	-74.5	-36	175.1	-72.2	168.7	0	0	0	110.9	W246 M249 L253 L261 S262 E263 E264 I269 I270	W246-I266 HydrophobicContact CH2-CG2 4.25Å; W246-I266 HydrophobicContact CZ2-CG2 4.11Å; M249-I266 HydrophobicContact CE-CB 4.18Å; M249-I266 HydrophobicContact CE-CD1 3.55Å; M249-I266 HydrophobicContact CE-CG1 4.44Å; M249-I266 HydrophobicContact CE-CG2 4.15Å; L253-I266 HydrophobicContact CD2-CD1 4Å; L261-I266 HydrophobicContact CB-CD1 4.26Å; L261-I266 HydrophobicContact CB-CG1 4.45Å; L261-I266 HydrophobicContact CD1-CD1 4.11Å; L261-I266 HydrophobicContact CD1-CG1 4.21Å; S262-I266 PolarHBondContact O-N 2.72Å; E263-I266 PolarHBondContact O-N 2.82Å; E263-I266 VanDerWaalsContact O-N 3.11Å; E264-I266 VanDerWaalsContact C-N 3.26Å; E264-I266 PolarHBondContact O-N 3.15Å; I266-I269 PolarHBondContact O-N 2.82Å; I266-I270 HydrophobicContact CG2-CD1 4.17Å; I266-I270 VanDerWaalsContact O-CG1 3.31Å; I266-I270 WeakPolarHBondContact O-CG1 3.49Å; I266-I270 PolarHBondContact O-N 2.99Å
267	M	84.1	Confident	82.1	Confident	28 Å²	28	55.7 Å²	55.7	14%	0.138	32%	0.318	C	S	.	.	H	α-helix	trans	-65.5	-40.8	172.7	-61	-71.7	-77.4	0	0	111.6	L242 I244 W246 E263 E264 I270 A271	L242-M267 VanDerWaalsContact C-CE 3.48Å; L242-M267 HydrophobicContact CB-CE 4.02Å; L242-M267 HydrophobicContact CD2-CE 3.83Å; L242-M267 HydrophobicContact CD2-SD 3.96Å; L242-M267 HydrophobicContact CG-CE 3.6Å; L242-M267 HydrophobicContact CG-SD 4.32Å; L242-M267 WeakPolarHBondContact O-CE 3.38Å; I244-M267 HydrophobicContact CB-CE 4.13Å; I244-M267 HydrophobicContact CB-SD 3.92Å; I244-M267 HydrophobicContact CD1-CE 4.39Å; I244-M267 HydrophobicContact CD1-SD 3.77Å; I244-M267 HydrophobicContact CG1-CE 3.98Å; I244-M267 HydrophobicContact CG1-SD 3.88Å; W246-M267 HydrophobicContact CZ2-SD 4.14Å; E263-M267 VanDerWaalsContact O-CG 3.26Å; E263-M267 WeakPolarHBondContact O-CG 3.48Å; E263-M267 PolarHBondContact O-N 2.91Å; E264-M267 CarbonylContact O-C 3.51Å; E264-M267 WeakPolarHBondContact O-CA 3.2Å; E264-M267 WeakPolarHBondContact O-CB 3.15Å; E264-M267 PolarHBondContact O-N 2.87Å; E264-M267 VanDerWaalsContact O-N 3.07Å; M267-I270 PolarHBondContact O-N 2.93Å; M267-A271 WeakPolarHBondContact O-CB 3.4Å; M267-A271 PolarHBondContact O-N 2.86Å
268	E	82.3	Confident	82.2	Confident	115 Å²	115	56.4 Å²	56.4	54%	0.537	32%	0.316	S	S	.	.	H	α-helix	trans	-61.7	-44.3	171.9	-72.9	-171.4	148.6	0	0	112.2	E264 I270 A271 S272	E264-E268 WeakPolarHBondContact O-CG 3.35Å; E264-E268 PolarHBondContact O-N 3.02Å; E268-I270 VanDerWaalsContact C-N 3.35Å; E268-I270 PolarHBondContact O-N 2.84Å; E268-A271 PolarHBondContact O-N 3.11Å; E268-S272 VanDerWaalsContact O-CB 3.25Å; E268-S272 WeakPolarHBondContact O-CB 3.44Å; E268-S272 PolarHBondContact O-N 2.79Å; E268-S272 PolarHBondContact O-OG 3.13Å
269	I	84.1	Confident	82.4	Confident	85 Å²	85	57.2 Å²	57.2	44%	0.436	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-48.1	174.9	-73.4	162.3	0	0	0	110.1	A265 I266 S272 L273	A265-I269 WeakPolarHBondContact O-CD1 3.47Å; A265-I269 WeakPolarHBondContact O-CG1 3.45Å; A265-I269 PolarHBondContact O-N 2.87Å; I266-I269 PolarHBondContact O-N 2.82Å; I269-S272 PolarHBondContact O-N 2.87Å; I269-S272 PolarHBondContact O-OG 3.02Å; I269-L273 HydrophobicContact CG2-CD1 4.34Å; I269-L273 WeakPolarHBondContact O-CG 3.28Å; I269-L273 PolarHBondContact O-N 3.44Å
270	I	84.4	Confident	82.7	Confident	50 Å²	50	56 Å²	56	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-49	178.1	-64.9	163.6	0	0	0	110.7	L242 I244 W246 I266 M267 E268 S272 L273 M274	L242-I270 HydrophobicContact CD2-CB 3.91Å; L242-I270 HydrophobicContact CD2-CG2 3.61Å; I244-I270 HydrophobicContact CD1-CD1 4.14Å; W246-I270 HydrophobicContact CH2-CD1 4.25Å; W246-I270 HydrophobicContact CZ2-CD1 4.3Å; I266-I270 HydrophobicContact CG2-CD1 4.17Å; I266-I270 VanDerWaalsContact O-CG1 3.31Å; I266-I270 WeakPolarHBondContact O-CG1 3.49Å; I266-I270 PolarHBondContact O-N 2.99Å; M267-I270 PolarHBondContact O-N 2.93Å; E268-I270 VanDerWaalsContact C-N 3.35Å; E268-I270 PolarHBondContact O-N 2.84Å; I270-S272 VanDerWaalsContact C-N 3.31Å; I270-S272 PolarHBondContact O-N 2.8Å; I270-L273 PolarHBondContact O-N 2.91Å; I270-L273 VanDerWaalsContact O-N 3.16Å; I270-M274 HydrophobicContact CG2-SD 4.3Å; I270-M274 WeakPolarHBondContact O-CG 3.36Å; I270-M274 PolarHBondContact O-N 3.39Å
271	A	83.6	Confident	83	Confident	9 Å²	9	51.5 Å²	51.5	7%	0.074	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-37.9	178.4	0	0	0	0	0	112.6	M267 E268 L273 M274 V275	M267-A271 WeakPolarHBondContact O-CB 3.4Å; M267-A271 PolarHBondContact O-N 2.86Å; E268-A271 PolarHBondContact O-N 3.11Å; A271-L273 VanDerWaalsContact C-N 3.26Å; A271-L273 PolarHBondContact O-N 3.28Å; A271-M274 PolarHBondContact O-N 3.36Å; A271-M274 VanDerWaalsContact O-N 3.1Å; A271-V275 PolarHBondContact O-N 2.95Å
272	S	81.9	Confident	83.2	Confident	28 Å²	28	51.3 Å²	51.3	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-28.8	177.6	78.4	0	0	0	0	113.1	E268 I269 I270 M274 N278 N337	E268-S272 VanDerWaalsContact O-CB 3.25Å; E268-S272 WeakPolarHBondContact O-CB 3.44Å; E268-S272 PolarHBondContact O-N 2.79Å; E268-S272 PolarHBondContact O-OG 3.13Å; I269-S272 PolarHBondContact O-N 2.87Å; I269-S272 PolarHBondContact O-OG 3.02Å; I270-S272 VanDerWaalsContact C-N 3.31Å; I270-S272 PolarHBondContact O-N 2.8Å; S272-M274 VanDerWaalsContact C-N 3.33Å; S272-N278 PolarHBondContact O-ND2 3.4Å; S272-N337 WeakPolarHBondContact CB-OD1 3.29Å; S272-N337 PolarHBondContact O-ND2 3.44Å
273	L	81.3	Confident	83.3	Confident	106 Å²	106	51.8 Å²	51.8	56%	0.555	27%	0.273	S	S	*	.	H	α-helix	trans	-79	-15.9	176.3	-68	169.1	0	0	0	113	I269 I270 A271 N278	I269-L273 HydrophobicContact CG2-CD1 4.34Å; I269-L273 WeakPolarHBondContact O-CG 3.28Å; I269-L273 PolarHBondContact O-N 3.44Å; I270-L273 PolarHBondContact O-N 2.91Å; I270-L273 VanDerWaalsContact O-N 3.16Å; A271-L273 VanDerWaalsContact C-N 3.26Å; A271-L273 PolarHBondContact O-N 3.28Å; L273-N278 WeakPolarHBondContact O-CB 3.45Å
274	M	83.1	Confident	83.6	Confident	60 Å²	60	52.5 Å²	52.5	30%	0.296	28%	0.279	S	S	.	.	H	α-helix	trans	-95.6	-10.2	-178.2	-63.7	-177.7	73.5	0	0	113.6	F211 F236 P240 I270 A271 S272	F211-M274 HydrophobicContact CD2-CE 4.23Å; F211-M274 HydrophobicContact CE2-CE 3.29Å; F211-M274 HydrophobicContact CE2-SD 3.85Å; F211-M274 HydrophobicContact CZ-CE 3.51Å; F236-M274 HydrophobicContact CD2-CB 4.07Å; F236-M274 HydrophobicContact CD2-CE 3.91Å; F236-M274 HydrophobicContact CE2-CE 3.6Å; F236-M274 HydrophobicContact CZ-CE 4.45Å; F236-M274 PolarHBondContact N-O 3.05Å; P240-M274 HydrophobicContact CG-SD 4.44Å; I270-M274 HydrophobicContact CG2-SD 4.3Å; I270-M274 WeakPolarHBondContact O-CG 3.36Å; I270-M274 PolarHBondContact O-N 3.39Å; A271-M274 PolarHBondContact O-N 3.36Å; A271-M274 VanDerWaalsContact O-N 3.1Å; S272-M274 VanDerWaalsContact C-N 3.33Å
275	V	85.2	Confident	83.8	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.012	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-110.7	163.7	-179.6	-60.8	0	0	0	0	112.8	F236 R238 R239 A271 N278	F236-V275 HydrophobicContact CB-CG1 4.13Å; F236-V275 WeakPolarHBondContact O-CA 3.4Å; R238-V275 WeakPolarHBondContact O-CG1 3.17Å; R239-V275 HydrophobicContact CG-CG1 4.23Å; A271-V275 PolarHBondContact O-N 2.95Å; V275-N278 WeakPolarHBondContact O-CB 3.21Å; V275-N278 PolarHBondContact O-N 2.95Å; V275-N278 PolarHBondContact O-ND2 2.97Å
276	L	84.2	Confident	83.4	Confident	13 Å²	13	55.6 Å²	55.6	7%	0.068	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	140.3	175.4	-71.3	172	0	0	0	112.3	F235 R279 H362 E363	F235-L276 HydrophobicContact CD1-CD2 4.22Å; F235-L276 HydrophobicContact CD2-CD1 4.08Å; F235-L276 HydrophobicContact CD2-CD2 3.78Å; F235-L276 HydrophobicContact CD2-CG 3.64Å; F235-L276 HydrophobicContact CE1-CD2 4.33Å; F235-L276 HydrophobicContact CE2-CD1 3.78Å; F235-L276 HydrophobicContact CE2-CD2 3.9Å; F235-L276 HydrophobicContact CE2-CG 3.84Å; F235-L276 HydrophobicContact CG-CD2 3.95Å; F235-L276 HydrophobicContact CG-CG 4.24Å; F235-L276 HydrophobicContact CZ-CD2 4.18Å; L276-R279 HydrophobicContact CD2-CG 4.02Å; L276-H362 HydrophobicContact CD1-CB 4.22Å; L276-H362 HydrophobicContact CD2-CB 4.23Å; L276-E363 HydrophobicContact CD1-CB 4.43Å; L276-E363 HydrophobicContact CD1-CG 4.33Å
277	P	73.4	Confident	83.1	Confident	63 Å²	63	63.5 Å²	63.5	41%	0.409	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	cis	-82.9	1.2	9.2	34.7	-37.8	0	0	0	114.9	R279	P277-R279 PolarHBondContact O-N 3.04Å
278	N	80.8	Confident	82.8	Confident	58 Å²	58	63.9 Å²	63.9	31%	0.31	34%	0.335	S	S	.	.			trans	-68.8	126.1	178.5	-55.5	-73.9	0	0	0	110	F235 S272 L273 V275	F235-N278 WeakPolarHBondContact CB-O 3.29Å; S272-N278 PolarHBondContact O-ND2 3.4Å; L273-N278 WeakPolarHBondContact O-CB 3.45Å; V275-N278 WeakPolarHBondContact O-CB 3.21Å; V275-N278 PolarHBondContact O-N 2.95Å; V275-N278 PolarHBondContact O-ND2 2.97Å
279	R	84.3	Confident	82.5	Confident	25 Å²	25	63.3 Å²	63.3	9%	0.094	33%	0.331	C	S	.	.			trans	-124.7	129.5	174.6	-58.8	-171	-179.4	-142.6	-5.7	109.4	T233 F235 L276 P277 H362 E363	T233-R279 HydrophobicContact CG2-CB 3.77Å; T233-R279 HydrophobicContact CG2-CG 4.27Å; F235-R279 HydrophobicContact CD1-CB 4.29Å; F235-R279 HydrophobicContact CD1-CG 3.75Å; F235-R279 HydrophobicContact CE1-CG 4.3Å; F235-R279 HydrophobicContact CG-CG 4.41Å; L276-R279 HydrophobicContact CD2-CG 4.02Å; P277-R279 PolarHBondContact O-N 3.04Å; R279-H362 PolarHBondContact NH2-O 3.12Å; R279-H362 VanDerWaalsContact NH2-O 3.09Å; R279-E363 IonicContact CZ-OE1 2.72Å; R279-E363 IonicContact NH1-OE1 3.14Å; R279-E363 PolarHBondContact NH1-OE1 2.88Å; R279-E363 IonicContact NH2-OE1 2.74Å; R279-E363 PolarHBondContact NH2-OE1 2.85Å
280	M	83.3	Confident	82.2	Confident	60 Å²	60	61 Å²	61	30%	0.296	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	125.8	167.1	-176	160	173.3	0	0	108.3	Y128 L132 T233 F234	Y128-M280 HydrophobicContact CE1-CE 4.04Å; Y128-M280 WeakPolarHBondContact OH-CE 3.48Å; L132-M280 HydrophobicContact CD1-CE 4.07Å; L132-M280 HydrophobicContact CD2-CE 3.76Å; L132-M280 HydrophobicContact CD2-SD 4.31Å; T233-M280 CarbonylContact C-O 3.54Å; T233-M280 WeakPolarHBondContact CA-O 3.45Å; F234-M280 HydrophobicContact CD2-CB 4.07Å; F234-M280 HydrophobicContact CE1-CB 4.35Å; F234-M280 HydrophobicContact CE1-CG 4.01Å; F234-M280 HydrophobicContact CE1-SD 4.48Å; F234-M280 HydrophobicContact CE2-CB 3.76Å; F234-M280 HydrophobicContact CE2-CG 3.83Å; F234-M280 HydrophobicContact CE2-SD 3.67Å; F234-M280 HydrophobicContact CZ-CB 3.92Å; F234-M280 HydrophobicContact CZ-CE 3.89Å; F234-M280 HydrophobicContact CZ-CG 3.52Å; F234-M280 HydrophobicContact CZ-SD 3.48Å; F234-M280 WeakPolarHBondContact CZ-SD 3.39Å; F234-M280 PolarHBondContact N-O 3.47Å; F234-M280 PolarHBondContact O-N 3.47Å
281	C	85.9	Confident	81.8	Confident	17 Å²	17	60.5 Å²	60.5	12%	0.115	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.5	-174.6	-176.8	0	0	0	0	110.8	V232 T233 M293 R294	V232-C281 WeakPolarHBondContact O-CA 3.36Å; T233-C281 HydrophobicContact CG2-CB 4.45Å; T233-C281 PolarHBondContact OG1-SG 3.45Å; C281-M293 WeakPolarHBondContact SG-CB 3.44Å; C281-M293 WeakPolarHBondContact SG-CE 3.43Å; C281-M293 VanDerWaalsContact SG-SD 3.63Å; C281-R294 HydrophobicContact CB-CG 3.98Å
282	I	86.9	Confident	81.6	Confident	56 Å²	56	64.1 Å²	64.1	29%	0.287	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	105.8	178.4	-57.6	-178.9	0	0	0	107.6	G231 V232 F234	G231-I282 WeakPolarHBondContact CA-O 3.48Å; V232-I282 PolarHBondContact N-O 2.9Å; V232-I282 PolarHBondContact O-N 3.12Å; F234-I282 HydrophobicContact CE1-CD1 3.85Å; F234-I282 HydrophobicContact CE1-CG1 4.19Å; F234-I282 HydrophobicContact CZ-CD1 4.36Å
283	P	87.7	Confident	81.5	Confident	58 Å²	58	63.1 Å²	63.1	38%	0.377	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	142.5	171.4	28.8	-33.6	0	0	0	110.3	V290 M293	P283-V290 HydrophobicContact CB-CG2 4.12Å; P283-V290 HydrophobicContact CG-CG2 4.02Å; P283-M293 HydrophobicContact CB-CE 4.27Å
284	L	87.8	Confident	81.4	Confident	81 Å²	81	63.1 Å²	63.1	42%	0.424	32%	0.318	S	S	.	.	S	Bend	trans	-103.4	-9.7	173.4	-56.8	-176.2	0	0	0	112.5	P227 V229 G230 V232	P227-L284 HydrophobicContact CG-CB 4.16Å; P227-L284 HydrophobicContact CG-CD1 4.43Å; V229-L284 HydrophobicContact CB-CD1 4.04Å; V229-L284 HydrophobicContact CG1-CD1 3.99Å; G230-L284 WeakPolarHBondContact O-CA 3.13Å; G230-L284 PolarHBondContact O-N 2.92Å; V232-L284 HydrophobicContact CG2-CD1 3.91Å; V232-L284 HydrophobicContact CG2-CD2 4.3Å; V232-L284 HydrophobicContact CG2-CG 4.21Å
285	I	86.4	Confident	81.4	Confident	51 Å²	51	61.9 Å²	61.9	26%	0.262	31%	0.312	S	S	.	.	S	Bend	trans	-134.7	143.4	176.6	70.4	-178.4	0	0	0	110.7	I223 G230 Q287 L288	I223-I285 HydrophobicContact CD1-CD1 4.27Å; I223-I285 HydrophobicContact CD1-CG2 4.25Å; G230-I285 PolarHBondContact O-N 3.26Å; I285-Q287 VanDerWaalsContact C-N 3.31Å; I285-Q287 PolarHBondContact O-N 3.12Å; I285-L288 HydrophobicContact CD1-CB 4.3Å; I285-L288 HydrophobicContact CG1-CB 3.79Å; I285-L288 HydrophobicContact CG1-CD2 4.39Å
286	D	77.2	Confident	81.4	Confident	176 Å²	176	62.9 Å²	62.9	94%	0.941	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.1	-174.8	-61	-50.7	0	0	0	114.4	L288	D286-L288 VanDerWaalsContact C-N 3.29Å; D286-L288 PolarHBondContact O-N 2.73Å
287	Q	76.3	Confident	81.6	Confident	192 Å²	192	65.7 Å²	65.7	90%	0.897	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	6.7	-174.3	-61.6	-173.5	5.6	0	0	113.8	I285	I285-Q287 VanDerWaalsContact C-N 3.31Å; I285-Q287 PolarHBondContact O-N 3.12Å
288	L	79.1	Confident	82.4	Confident	36 Å²	36	63 Å²	63	19%	0.188	32%	0.315	C	S	.	.	S	Bend	trans	-91.6	139.1	-171	-169.6	55.9	0	0	0	113.1	P221 G230 I285 D286 V290 M293	P221-L288 HydrophobicContact CG-CD1 3.88Å; G230-L288 WeakPolarHBondContact O-CD2 3.18Å; I285-L288 HydrophobicContact CD1-CB 4.3Å; I285-L288 HydrophobicContact CG1-CB 3.79Å; I285-L288 HydrophobicContact CG1-CD2 4.39Å; D286-L288 VanDerWaalsContact C-N 3.29Å; D286-L288 PolarHBondContact O-N 2.73Å; L288-V290 PolarHBondContact O-N 2.91Å; L288-M293 HydrophobicContact CD2-CE 3.42Å; L288-M293 VanDerWaalsContact CD2-CE 3.42Å; L288-M293 HydrophobicContact CD2-SD 3.46Å; L288-M293 WeakPolarHBondContact CD2-SD 3.48Å; L288-M293 HydrophobicContact CG-CE 3.68Å; L288-M293 HydrophobicContact CG-SD 4.09Å
289	K	76.3	Confident	82.8	Confident	104 Å²	104	64.3 Å²	64.3	45%	0.452	32%	0.316	S	S	.	.			trans	-71.9	88.4	174.4	-74.2	-171	-176.6	-173.1	0	111.6	D291 E292 M293	K289-D291 WeakPolarHBondContact CB-OD1 3.38Å; K289-D291 PolarHBondContact O-N 2.85Å; K289-E292 HydrophobicContact CB-CB 4.17Å; K289-E292 HydrophobicContact CB-CG 4.14Å; K289-E292 HydrophobicContact CD-CG 4.04Å; K289-E292 WeakPolarHBondContact CD-OE1 3.27Å; K289-E292 VanDerWaalsContact CD-OE2 3.3Å; K289-E292 WeakPolarHBondContact CD-OE2 3.48Å; K289-E292 IonicContact NZ-OE1 3.4Å; K289-E292 PolarHBondContact NZ-OE1 3.41Å; K289-E292 IonicContact NZ-OE2 2.67Å; K289-E292 PolarHBondContact O-N 2.84Å; K289-E292 VanDerWaalsContact O-N 3.12Å; K289-M293 PolarHBondContact O-N 2.84Å
290	V	77.6	Confident	83.1	Confident	36 Å²	36	63.1 Å²	63.1	22%	0.218	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-24	178.6	-173.2	0	0	0	0	112.2	P283 L288 M293 R294	P283-V290 HydrophobicContact CB-CG2 4.12Å; P283-V290 HydrophobicContact CG-CG2 4.02Å; L288-V290 PolarHBondContact O-N 2.91Å; V290-M293 HydrophobicContact CB-CE 4.34Å; V290-M293 HydrophobicContact CG1-CE 4.49Å; V290-M293 HydrophobicContact CG2-CE 4.11Å; V290-R294 HydrophobicContact CG1-CG 4.13Å; V290-R294 WeakPolarHBondContact O-CB 3.3Å; V290-R294 VanDerWaalsContact O-CG 3.28Å; V290-R294 WeakPolarHBondContact O-CG 3.42Å; V290-R294 PolarHBondContact O-N 2.86Å
291	D	75	Confident	83.7	Confident	39 Å²	39	60.2 Å²	60.2	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-45	171.1	61	-58.8	0	0	0	112.2	K289 M293 R294 F295 Y445 K572	K289-D291 WeakPolarHBondContact CB-OD1 3.38Å; K289-D291 PolarHBondContact O-N 2.85Å; D291-M293 PolarHBondContact O-N 2.78Å; D291-R294 PolarHBondContact O-N 2.8Å; D291-F295 PolarHBondContact O-N 2.55Å; D291-Y445 HydrophobicContact CB-CD1 4.46Å; D291-Y445 HydrophobicContact CB-CE1 3.75Å; D291-Y445 HydrophobicContact CB-CE2 4.31Å; D291-K572 IonicContact OD2-NZ 2.69Å; D291-K572 PolarHBondContact OD2-NZ 3.24Å
292	E	79.3	Confident	84.1	Confident	85 Å²	85	59.4 Å²	59.4	40%	0.397	29%	0.292	S	S	.	.	H	α-helix	trans	-69.7	-31.2	-177.9	-69.1	178.5	-176.6	0	0	112.2	K289 F295 P296 K572	K289-E292 HydrophobicContact CB-CB 4.17Å; K289-E292 HydrophobicContact CB-CG 4.14Å; K289-E292 HydrophobicContact CD-CG 4.04Å; K289-E292 WeakPolarHBondContact CD-OE1 3.27Å; K289-E292 VanDerWaalsContact CD-OE2 3.3Å; K289-E292 WeakPolarHBondContact CD-OE2 3.48Å; K289-E292 IonicContact NZ-OE1 3.4Å; K289-E292 PolarHBondContact NZ-OE1 3.41Å; K289-E292 IonicContact NZ-OE2 2.67Å; K289-E292 PolarHBondContact O-N 2.84Å; K289-E292 VanDerWaalsContact O-N 3.12Å; E292-F295 CarbonylContact O-C 3.54Å; E292-P296 WeakPolarHBondContact O-CA 3.42Å; E292-P296 WeakPolarHBondContact O-CB 3.35Å; E292-P296 VanDerWaalsContact O-N 3.11Å; E292-K572 IonicContact OE1-NZ 2.64Å; E292-K572 PolarHBondContact OE1-NZ 3.36Å
293	M	81.4	Confident	84.4	Confident	7 Å²	7	57.3 Å²	57.3	3%	0.034	28%	0.28	C	S	.	.	H	α-helix	trans	-79.6	-32.5	174.3	-63.6	-174.8	-69.3	0	0	114.1	C281 P283 L288 K289 V290 D291	C281-M293 WeakPolarHBondContact SG-CB 3.44Å; C281-M293 WeakPolarHBondContact SG-CE 3.43Å; C281-M293 VanDerWaalsContact SG-SD 3.63Å; P283-M293 HydrophobicContact CB-CE 4.27Å; L288-M293 HydrophobicContact CD2-CE 3.42Å; L288-M293 VanDerWaalsContact CD2-CE 3.42Å; L288-M293 HydrophobicContact CD2-SD 3.46Å; L288-M293 WeakPolarHBondContact CD2-SD 3.48Å; L288-M293 HydrophobicContact CG-CE 3.68Å; L288-M293 HydrophobicContact CG-SD 4.09Å; K289-M293 PolarHBondContact O-N 2.84Å; V290-M293 HydrophobicContact CB-CE 4.34Å; V290-M293 HydrophobicContact CG1-CE 4.49Å; V290-M293 HydrophobicContact CG2-CE 4.11Å; D291-M293 PolarHBondContact O-N 2.78Å
294	R	78.5	Confident	84.8	Confident	106 Å²	106	54.6 Å²	54.6	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-77.6	-34.5	177.4	-75.1	179.4	-176.9	173	5.7	112.2	C281 V290 D291 P296 E508	C281-R294 HydrophobicContact CB-CG 3.98Å; V290-R294 HydrophobicContact CG1-CG 4.13Å; V290-R294 WeakPolarHBondContact O-CB 3.3Å; V290-R294 VanDerWaalsContact O-CG 3.28Å; V290-R294 WeakPolarHBondContact O-CG 3.42Å; V290-R294 PolarHBondContact O-N 2.86Å; D291-R294 PolarHBondContact O-N 2.8Å; R294-P296 VanDerWaalsContact C-CD 3.49Å; R294-E508 IonicContact CZ-OE2 2.74Å; R294-E508 IonicContact NH1-OE2 3.54Å; R294-E508 PolarHBondContact NH1-OE2 2.84Å
295	F	82.6	Confident	85.2	Confident	35 Å²	35	52 Å²	52	15%	0.154	25%	0.248	C	C	.	.	S	Bend	trans	-130.5	69.3	176.2	-167.1	-107.9	0	0	0	111	D291 E292 A443 Y445 G510	D291-F295 PolarHBondContact O-N 2.55Å; E292-F295 CarbonylContact O-C 3.54Å; F295-A443 HydrophobicContact CE1-CB 4.37Å; F295-Y445 HydrophobicContact CB-CD2 4.18Å; F295-Y445 HydrophobicContact CD1-CD2 4.4Å; F295-G510 VanDerWaalsContact CZ-C 3.49Å; F295-G510 VanDerWaalsContact CZ-CA 3.49Å
296	P	86.2	Confident	85.7	Confident	23 Å²	23	49.6 Å²	49.6	15%	0.149	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-67.3	153.3	175	29	-34.3	0	0	0	110.3	E292 R294	E292-P296 WeakPolarHBondContact O-CA 3.42Å; E292-P296 WeakPolarHBondContact O-CB 3.35Å; E292-P296 VanDerWaalsContact O-N 3.11Å; R294-P296 VanDerWaalsContact C-CD 3.49Å
297	L	87.9	Confident	86.6	Confident	72 Å²	72	42.7 Å²	42.7	38%	0.377	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-60.3	136.3	170.9	-71.6	175.4	0	0	0	109.5	A443 T574	L297-A443 HydrophobicContact CD2-CB 3.83Å; L297-T574 HydrophobicContact CD1-CG2 4.3Å; L297-T574 HydrophobicContact CD2-CG2 4.1Å
298	P	90.5	Very high	87.6	Confident	6 Å²	6	35.6 Å²	35.6	4%	0.039	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-54.8	149.1	175.2	-25.1	33.8	0	0	0	112.4	G300 V360 V361 L423 M441	P298-G300 PolarHBondContact O-N 3.49Å; P298-V360 HydrophobicContact CB-CG1 3.49Å; P298-V360 VanDerWaalsContact CB-CG1 3.49Å; P298-V360 HydrophobicContact CG-CG1 3.17Å; P298-V361 CarbonylContact C-O 3.6Å; P298-V361 WeakPolarHBondContact CB-O 3.34Å; P298-L423 HydrophobicContact CB-CD1 4.32Å; P298-L423 WeakPolarHBondContact O-CD1 3.36Å; P298-M441 HydrophobicContact CB-CE 4.41Å; P298-M441 HydrophobicContact CG-CE 3.78Å; P298-M441 HydrophobicContact CG-SD 4.24Å
299	R	88.3	Confident	88.4	Confident	85 Å²	85	33.9 Å²	33.9	32%	0.321	16%	0.157	S	C	.	.	S	Bend	trans	-67.3	-29.6	175.5	-57.6	-63.8	-175.8	163.1	1	111.6	E179 V361 E363 W420	E179-R299 IonicContact OE1-CZ 2.72Å; E179-R299 IonicContact OE1-NH1 3.87Å; E179-R299 PolarHBondContact OE1-NH1 2.85Å; E179-R299 IonicContact OE1-NH2 3.41Å; E179-R299 PolarHBondContact OE1-NH2 3.01Å; E179-R299 IonicContact OE2-CZ 2.76Å; E179-R299 IonicContact OE2-NH1 2.72Å; E179-R299 IonicContact OE2-NH2 2.64Å; E179-R299 PolarHBondContact OE2-NH2 3.07Å; R299-V361 PolarHBondContact N-O 2.76Å; R299-E363 IonicContact CZ-OE2 2.78Å; R299-E363 VanDerWaalsContact CZ-OE2 3.31Å; R299-E363 IonicContact NE-OE1 3.63Å; R299-E363 IonicContact NE-OE2 3.82Å; R299-E363 PolarHBondContact NE-OE2 3.15Å; R299-E363 IonicContact NH2-OE1 2.72Å; R299-E363 PolarHBondContact NH2-OE1 3.33Å; R299-E363 IonicContact NH2-OE2 3.7Å; R299-E363 PolarHBondContact NH2-OE2 2.9Å; R299-W420 HydrophobicContact CB-CH2 4.18Å; R299-W420 HydrophobicContact CB-CZ2 4.25Å; R299-W420 WeakPolarHBondContact O-CZ2 3.32Å
300	G	92.1	Very high	89.3	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	-174.3	177.6	0	0	0	0	0	112.5	P298 V361 L421	P298-G300 PolarHBondContact O-N 3.49Å; G300-V361 PolarHBondContact N-O 3.04Å; G300-V361 PolarHBondContact O-N 2.76Å; G300-L421 WeakPolarHBondContact CA-O 3.2Å
301	V	94.3	Very high	89.9	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.3	169.3	172	0	0	0	0	107.7	E358 F359 L421 L423 M441 F514 L578	V301-E358 HydrophobicContact CG1-CB 4.25Å; V301-F359 CarbonylContact C-O 3.55Å; V301-F359 VanDerWaalsContact CA-O 3.26Å; V301-F359 WeakPolarHBondContact CA-O 3.5Å; V301-F359 WeakPolarHBondContact CG1-O 3.31Å; V301-L421 HydrophobicContact CB-CB 4.2Å; V301-L421 HydrophobicContact CB-CD1 4.44Å; V301-L421 HydrophobicContact CG1-CD1 4.16Å; V301-L421 PolarHBondContact N-O 2.99Å; V301-L421 WeakPolarHBondContact O-CA 3.31Å; V301-L421 VanDerWaalsContact O-CB 3.28Å; V301-L421 WeakPolarHBondContact O-CB 3.23Å; V301-L421 PolarHBondContact O-N 2.95Å; V301-L423 HydrophobicContact CG2-CD2 4.3Å; V301-M441 HydrophobicContact CG2-SD 3.7Å; V301-F514 HydrophobicContact CB-CE1 4.46Å; V301-F514 HydrophobicContact CG1-CE1 3.69Å; V301-F514 HydrophobicContact CG1-CZ 4.02Å; V301-F514 HydrophobicContact CG2-CE1 3.86Å; V301-L578 HydrophobicContact CB-CD2 3.99Å; V301-L578 HydrophobicContact CG1-CD1 4.45Å; V301-L578 HydrophobicContact CG2-CD2 3.73Å
302	V	94.3	Very high	90.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.6	171.4	173.9	0	0	0	0	109.2	V304 F359 V361 F391 V394 L418 Q419 W420	V302-V304 HydrophobicContact CG1-CG2 3.97Å; V302-F359 PolarHBondContact N-O 3.05Å; V302-F359 PolarHBondContact O-N 3.38Å; V302-V361 HydrophobicContact CB-CG2 4.15Å; V302-V361 HydrophobicContact CG2-CG2 3.77Å; V302-F391 HydrophobicContact CB-CD1 3.99Å; V302-F391 HydrophobicContact CB-CE1 3.78Å; V302-F391 HydrophobicContact CG1-CD1 4.02Å; V302-F391 HydrophobicContact CG1-CE1 3.71Å; V302-F391 HydrophobicContact CG2-CD1 3.69Å; V302-F391 HydrophobicContact CG2-CE1 4.03Å; V302-F391 HydrophobicContact CG2-CG 4.29Å; V302-V394 HydrophobicContact CG1-CG1 4.09Å; V302-V394 HydrophobicContact CG2-CG1 4.14Å; V302-L418 HydrophobicContact CG1-CB 4.49Å; V302-L418 HydrophobicContact CG1-CD2 4.3Å; V302-Q419 WeakPolarHBondContact CA-O 3.32Å; V302-W420 HydrophobicContact CG2-CD2 4.46Å; V302-W420 HydrophobicContact CG2-CE3 3.5Å; V302-W420 HydrophobicContact CG2-CZ3 3.89Å
303	R	94.7	Very high	90.9	Very high	12 Å²	12	30.7 Å²	30.7	5%	0.045	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.2	171.5	-177.3	178.5	-69.2	141	-0.5	108.3	V356 Y357 E358 L418 Q419 L421 S438 E580	R303-V356 HydrophobicContact CG-CG1 3.54Å; R303-Y357 WeakPolarHBondContact CA-O 3.44Å; R303-E358 HydrophobicContact CB-CG 4.35Å; R303-E358 HydrophobicContact CG-CG 4.17Å; R303-E358 IonicContact CZ-OE1 3.92Å; R303-E358 VanDerWaalsContact CZ-OE1 3.24Å; R303-E358 IonicContact NE-OE1 2.86Å; R303-E358 PolarHBondContact NE-OE1 3.23Å; R303-E358 IonicContact NH2-OE1 2.62Å; R303-E358 PolarHBondContact NH2-OE1 2.98Å; R303-L418 WeakPolarHBondContact O-CA 3.27Å; R303-Q419 HydrophobicContact CB-CB 4.43Å; R303-Q419 PolarHBondContact N-O 3.32Å; R303-Q419 PolarHBondContact O-N 2.79Å; R303-L421 HydrophobicContact CB-CD1 4.12Å; R303-S438 PolarHBondContact NH2-O 3.38Å; R303-E580 IonicContact NH1-OE1 3.95Å; R303-E580 PolarHBondContact NH1-OE1 3.25Å
304	V	95.7	Very high	90.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114.1	-178.3	-175	0	0	0	0	108	V302 V306 L333 V356 Y357 F359 L369 L418	V302-V304 HydrophobicContact CG1-CG2 3.97Å; V304-V306 HydrophobicContact CG1-CG2 4.34Å; V304-L333 HydrophobicContact CB-CD1 4.49Å; V304-L333 HydrophobicContact CG1-CD1 4.09Å; V304-V356 WeakPolarHBondContact O-CA 3.15Å; V304-Y357 PolarHBondContact N-O 3.23Å; V304-Y357 PolarHBondContact O-N 3.13Å; V304-F359 HydrophobicContact CB-CE2 4.34Å; V304-F359 HydrophobicContact CG2-CD2 3.76Å; V304-F359 HydrophobicContact CG2-CE2 3.9Å; V304-L369 HydrophobicContact CG1-CD2 4.03Å; V304-L369 HydrophobicContact CG2-CD2 3.8Å; V304-L418 HydrophobicContact CG2-CD2 4.16Å
305	H	96	Very high	90.6	Very high	27 Å²	27	28.7 Å²	28.7	13%	0.125	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	112.7	170	-51.7	-112.4	0	0	0	107.8	L307 E355 V356 K417 Q419	H305-L307 HydrophobicContact CB-CD2 3.91Å; H305-L307 HydrophobicContact CB-CG 4.34Å; H305-L307 PolarHBondContact O-N 2.87Å; H305-E355 CarbonylContact C-O 3.34Å; H305-E355 WeakPolarHBondContact CA-O 3.47Å; H305-V356 HydrophobicContact CB-CG2 4.37Å; H305-V356 VanDerWaalsContact ND1-CG2 3.33Å; H305-V356 WeakPolarHBondContact ND1-CG2 3.49Å; H305-K417 HydrophobicContact CB-CB 4.1Å; H305-K417 PolarHBondContact CD2-O 2.85Å; H305-K417 PolarHBondContact N-O 2.99Å; H305-K417 PolarHBondContact O-N 3.26Å; H305-K417 VanDerWaalsContact O-N 3.09Å; H305-Q419 PolarHBondContact NE2-OE1 2.79Å
306	V	96.8	Very high	89.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	98.4	171.5	-177.1	0	0	0	0	107.2	V304 V331 L333 T342 W353 N354 E355 Y357 I414 L416	V304-V306 HydrophobicContact CG1-CG2 4.34Å; V306-V331 HydrophobicContact CG1-CG2 3.97Å; V306-L333 HydrophobicContact CG2-CD1 3.7Å; V306-L333 HydrophobicContact CG2-CD2 4.17Å; V306-L333 HydrophobicContact CG2-CG 4.27Å; V306-T342 HydrophobicContact CG1-CG2 4.26Å; V306-W353 HydrophobicContact CG1-CB 4.3Å; V306-W353 HydrophobicContact CG1-CD2 4.16Å; V306-W353 HydrophobicContact CG1-CE3 3.67Å; V306-W353 HydrophobicContact CG1-CG 4.45Å; V306-W353 HydrophobicContact CG1-CZ3 4.3Å; V306-N354 VanDerWaalsContact O-CA 3.29Å; V306-N354 WeakPolarHBondContact O-CA 3.48Å; V306-N354 PolarHBondContact O-N 3.1Å; V306-E355 PolarHBondContact N-O 2.75Å; V306-E355 PolarHBondContact O-N 2.68Å; V306-Y357 HydrophobicContact CG2-CD2 4.3Å; V306-Y357 HydrophobicContact CG2-CE2 4.45Å; V306-I414 HydrophobicContact CG1-CD1 4.37Å; V306-L416 HydrophobicContact CB-CD2 4.26Å; V306-L416 HydrophobicContact CG1-CD2 4.27Å; V306-L416 HydrophobicContact CG2-CD2 4Å
307	L	96.5	Very high	88.4	Confident	31 Å²	31	31.7 Å²	31.7	16%	0.162	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-68	-172.2	-59.2	177.5	0	0	0	110	H305 K352 W353 N354 H415 K417	H305-L307 HydrophobicContact CB-CD2 3.91Å; H305-L307 HydrophobicContact CB-CG 4.34Å; H305-L307 PolarHBondContact O-N 2.87Å; L307-K352 CarbonylContact O-C 3.55Å; L307-K352 WeakPolarHBondContact O-CA 3.29Å; L307-W353 PolarHBondContact O-N 3.08Å; L307-N354 PolarHBondContact O-N 3.15Å; L307-N354 VanDerWaalsContact O-N 3.11Å; L307-H415 HydrophobicContact CB-CB 4.45Å; L307-H415 PolarHBondContact N-O 3.49Å; L307-K417 HydrophobicContact CD1-CB 3.94Å
308	E	96.9	Very high	86.7	Confident	43 Å²	43	33.7 Å²	33.7	20%	0.201	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	168.8	-173.5	54	-173.6	-104.4	0	0	112.7	P351 K352 W403 H415	E308-P351 CarbonylContact C-O 3.48Å; E308-P351 WeakPolarHBondContact CA-O 3.36Å; E308-P351 WeakPolarHBondContact CB-O 3.49Å; E308-K352 HydrophobicContact CB-CB 4.22Å; E308-K352 HydrophobicContact CB-CG 3.83Å; E308-K352 IonicContact OE1-NZ 3.26Å; E308-K352 PolarHBondContact OE1-NZ 2.87Å; E308-K352 IonicContact OE2-NZ 2.64Å; E308-K352 PolarHBondContact OE2-NZ 3.06Å; E308-W403 HydrophobicContact CG-CH2 3.86Å; E308-W403 HydrophobicContact CG-CZ2 4.17Å; E308-H415 HydrophobicContact CG-CB 3.85Å; E308-H415 PolarHBondContact O-N 2.95Å
309	A	96.4	Very high	84.7	Confident	1 Å²	1	40 Å²	40	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	169.6	165.3	0	0	0	0	0	109.9	L312 A350 P351 W353 L373 D413 I414	A309-L312 HydrophobicContact CB-CD1 4.07Å; A309-L312 HydrophobicContact CB-CD2 4.08Å; A309-L312 HydrophobicContact CB-CG 4.18Å; A309-A350 CarbonylContact O-C 3.53Å; A309-A350 WeakPolarHBondContact O-CA 3.47Å; A309-P351 HydrophobicContact CB-CG 3.97Å; A309-P351 PolarHBondContact N-O 3.01Å; A309-W353 HydrophobicContact CB-CH2 3.87Å; A309-W353 HydrophobicContact CB-CZ3 3.72Å; A309-L373 HydrophobicContact CB-CD2 4.41Å; A309-D413 CarbonylContact C-O 3.6Å; A309-D413 VanDerWaalsContact CA-O 3.24Å; A309-D413 WeakPolarHBondContact CA-O 3.07Å; A309-D413 WeakPolarHBondContact CB-O 3.26Å; A309-I414 HydrophobicContact CB-CB 4.44Å; A309-I414 HydrophobicContact CB-CG1 4.44Å
310	K	93.8	Very high	82.7	Confident	65 Å²	65	45.3 Å²	45.3	28%	0.283	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	165.7	175.5	68.2	-178.3	170.3	134.8	0	110.7	L312 L349 W403 G412 D413	K310-L312 PolarHBondContact O-N 2.94Å; K310-L349 CarbonylContact C-O 3.53Å; K310-L349 WeakPolarHBondContact CA-O 3.39Å; K310-W403 HydrophobicContact CB-CH2 4.13Å; K310-W403 HydrophobicContact CB-CZ3 4.06Å; K310-W403 HydrophobicContact CD-CE3 4.07Å; K310-W403 HydrophobicContact CD-CH2 3.81Å; K310-W403 HydrophobicContact CD-CZ2 4.35Å; K310-W403 HydrophobicContact CD-CZ3 3.67Å; K310-W403 HydrophobicContact CG-CE3 4.16Å; K310-W403 HydrophobicContact CG-CH2 3.92Å; K310-W403 HydrophobicContact CG-CZ3 3.5Å; K310-W403 VanDerWaalsContact CG-CZ3 3.5Å; K310-G412 WeakPolarHBondContact O-CA 3.41Å; K310-D413 WeakPolarHBondContact CE-OD2 3.3Å; K310-D413 HydrophobicContact CG-CB 4.26Å; K310-D413 PolarHBondContact N-O 3.29Å; K310-D413 IonicContact NZ-OD2 3.63Å; K310-D413 PolarHBondContact NZ-OD2 2.98Å; K310-D413 PolarHBondContact O-N 2.8Å; K310-D413 VanDerWaalsContact O-N 3.15Å
311	D	90.6	Very high	80.9	Confident	99 Å²	99	48.2 Å²	48.2	53%	0.529	25%	0.253	S	S	.	.	S	Bend	trans	54.2	25.5	171.5	-54.3	-43.5	0	0	0	114.3	L349 S411 G412	D311-L349 PolarHBondContact N-O 3.36Å; D311-S411 CarbonylContact O-C 2.97Å; D311-S411 VanDerWaalsContact O-CB 3.29Å; D311-S411 WeakPolarHBondContact O-CB 3.08Å; D311-S411 PolarHBondContact O-OG 2.86Å; D311-G412 PolarHBondContact O-N 2.8Å
312	L	89.8	Confident	78.8	Confident	4 Å²	4	56 Å²	56	2%	0.021	29%	0.291	C	S	.	.			trans	-63.3	145	-178.8	-63.6	-178.5	0	0	0	111.6	A309 K310 A314 P329 L349 P351 L373 L406	A309-L312 HydrophobicContact CB-CD1 4.07Å; A309-L312 HydrophobicContact CB-CD2 4.08Å; A309-L312 HydrophobicContact CB-CG 4.18Å; K310-L312 PolarHBondContact O-N 2.94Å; L312-A314 PolarHBondContact O-N 2.98Å; L312-P329 HydrophobicContact CD1-CB 3.86Å; L312-P329 HydrophobicContact CD1-CG 4.03Å; L312-L349 HydrophobicContact CB-CB 4.43Å; L312-L349 PolarHBondContact N-O 3.39Å; L312-P351 HydrophobicContact CD1-CG 3.83Å; L312-L373 HydrophobicContact CD1-CD2 4.41Å; L312-L373 HydrophobicContact CD2-CD2 3.96Å; L312-L406 HydrophobicContact CD2-CD1 3.77Å
313	V	84.8	Confident	77	Confident	28 Å²	28	59.3 Å²	59.3	17%	0.17	31%	0.311	C	S	.	.			trans	-68.6	102.4	176.4	-175.8	0	0	0	0	110	K315 L384 V409 S411	V313-K315 HydrophobicContact CG1-CD 4.28Å; V313-K315 PolarHBondContact O-N 3.03Å; V313-K315 VanDerWaalsContact O-N 3.16Å; V313-L384 VanDerWaalsContact O-CD2 3.23Å; V313-L384 WeakPolarHBondContact O-CD2 3.19Å; V313-V409 HydrophobicContact CG2-CB 3.94Å; V313-V409 HydrophobicContact CG2-CG1 4.3Å; V313-S411 WeakPolarHBondContact CG2-O 3.26Å
314	A	80.2	Confident	75.4	Confident	6 Å²	6	65.3 Å²	65.3	5%	0.05	34%	0.338	C	S	.	.			trans	-51	124.6	165.2	0	0	0	0	0	110.5	L312 K324 G325 L349	L312-A314 PolarHBondContact O-N 2.98Å; A314-K324 HydrophobicContact CB-CD 4.01Å; A314-K324 HydrophobicContact CB-CG 4.14Å; A314-K324 WeakPolarHBondContact O-CE 3.47Å; A314-K324 PolarHBondContact O-NZ 3.27Å; A314-G325 VanDerWaalsContact CB-O 3.3Å; A314-G325 WeakPolarHBondContact CB-O 3.44Å; A314-L349 HydrophobicContact CB-CD1 3.88Å; A314-L349 HydrophobicContact CB-CD2 3.74Å; A314-L349 HydrophobicContact CB-CG 4.44Å
315	K	75.3	Confident	74.2	Confident	66 Å²	66	65.9 Å²	65.9	29%	0.287	34%	0.343	S	S	.	.			trans	-107	-43	172.3	-65.8	-64.7	-157.6	63.2	0	111.8	V313 T317 S327 D375 D382 F383 L384	V313-K315 HydrophobicContact CG1-CD 4.28Å; V313-K315 PolarHBondContact O-N 3.03Å; V313-K315 VanDerWaalsContact O-N 3.16Å; K315-T317 PolarHBondContact O-OG1 2.82Å; K315-S327 PolarHBondContact N-OG 2.89Å; K315-D375 WeakPolarHBondContact CB-OD2 3.49Å; K315-D382 HydrophobicContact CB-CB 4.39Å; K315-D382 WeakPolarHBondContact CB-OD2 3.49Å; K315-D382 VanDerWaalsContact CD-OD2 3.24Å; K315-D382 WeakPolarHBondContact CD-OD2 3.43Å; K315-D382 HydrophobicContact CG-CB 4.34Å; K315-D382 VanDerWaalsContact CG-OD2 3.26Å; K315-D382 WeakPolarHBondContact CG-OD2 3.47Å; K315-D382 IonicContact NZ-OD1 2.78Å; K315-D382 PolarHBondContact NZ-OD1 2.73Å; K315-D382 IonicContact NZ-OD2 2.74Å; K315-D382 PolarHBondContact NZ-OD2 2.94Å; K315-F383 WeakPolarHBondContact CE-O 3.27Å; K315-F383 PolarHBondContact NZ-O 3.16Å; K315-L384 HydrophobicContact CG-CD2 3.63Å
316	D	64.2	Low	73.3	Confident	43 Å²	43	69.6 Å²	69.6	23%	0.23	36%	0.359	C	S	.	.			trans	-49.7	146.6	177.8	-164.1	3.1	0	0	0	113	Y318 G325	D316-Y318 VanDerWaalsContact OD2-CE2 3.26Å; D316-Y318 WeakPolarHBondContact OD2-CE2 3.13Å; D316-G325 VanDerWaalsContact O-CA 3.26Å; D316-G325 WeakPolarHBondContact O-CA 3.26Å; D316-G325 PolarHBondContact O-N 2.78Å
317	T	56.4	Low	72.7	Confident	77 Å²	77	69.6 Å²	69.6	47%	0.472	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	107.5	-167.6	-65.2	0	0	0	0	111.9	K315	K315-T317 PolarHBondContact O-OG1 2.82Å
318	Y	54.1	Low	72.4	Confident	115 Å²	115	69.1 Å²	69.1	45%	0.451	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	152.7	179.7	-79.9	-103.9	0	0	0	112.2	D316 V323	D316-Y318 VanDerWaalsContact OD2-CE2 3.26Å; D316-Y318 WeakPolarHBondContact OD2-CE2 3.13Å; Y318-V323 PolarHBondContact N-O 2.71Å; Y318-V323 PolarHBondContact O-N 2.81Å
319	M	46.7	Very low	72.2	Confident	138 Å²	138	67 Å²	67	68%	0.68	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	71.4	178.9	-62.9	-165.7	-63	0	0	114.4	G321 M322 V323	M319-G321 PolarHBondContact O-N 2.77Å; M319-M322 WeakPolarHBondContact O-CB 3.33Å; M319-M322 PolarHBondContact O-N 3.07Å; M319-V323 HydrophobicContact CE-CG2 3.73Å
320	M	47.4	Very low	72.2	Confident	197 Å²	197	67.8 Å²	67.8	97%	0.97	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	26.1	160.7	-151.3	77.4	167.9	0	0	115.1
321	G	53.2	Low	72.3	Confident	60 Å²	60	64.7 Å²	64.7	62%	0.619	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	4.7	-178.5	0	0	0	0	0	115.7	M319	M319-G321 PolarHBondContact O-N 2.77Å
322	M	51.8	Low	72.6	Confident	164 Å²	164	61.2 Å²	61.2	81%	0.808	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-19.1	-174.3	-64.1	-172.7	174.1	0	0	114.9	M319	M319-M322 WeakPolarHBondContact O-CB 3.33Å; M319-M322 PolarHBondContact O-N 3.07Å
323	V	54.8	Low	72.8	Confident	70 Å²	70	61.1 Å²	61.1	42%	0.424	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.4	178.1	-176.3	0	0	0	0	110.1	Y318 M319 G325	Y318-V323 PolarHBondContact N-O 2.71Å; Y318-V323 PolarHBondContact O-N 2.81Å; M319-V323 HydrophobicContact CE-CG2 3.73Å; V323-G325 PolarHBondContact O-N 3.35Å
324	K	61	Low	73.1	Confident	138 Å²	138	62 Å²	62	60%	0.6	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	120.1	171.6	-157.1	-178.2	-166.9	-155.3	0	108.7	A314	A314-K324 HydrophobicContact CB-CD 4.01Å; A314-K324 HydrophobicContact CB-CG 4.14Å; A314-K324 WeakPolarHBondContact O-CE 3.47Å; A314-K324 PolarHBondContact O-NZ 3.27Å
325	G	70.6	Confident	73.3	Confident	11 Å²	11	62.1 Å²	62.1	11%	0.113	32%	0.318	C	S	.	.			trans	-74	-166.2	177.3	0	0	0	0	0	112	A314 D316 V323	A314-G325 VanDerWaalsContact CB-O 3.3Å; A314-G325 WeakPolarHBondContact CB-O 3.44Å; D316-G325 VanDerWaalsContact O-CA 3.26Å; D316-G325 WeakPolarHBondContact O-CA 3.26Å; D316-G325 PolarHBondContact O-N 2.78Å; V323-G325 PolarHBondContact O-N 3.35Å
326	K	77.7	Confident	73.4	Confident	106 Å²	106	59.8 Å²	59.8	46%	0.461	31%	0.313	S	S	.	.			trans	-123.6	137.6	165.5	-59.3	175.5	-171.9	163.7	0	107.7	E347 L349	K326-E347 HydrophobicContact CB-CB 4.41Å; K326-E347 VanDerWaalsContact CD-C 3.49Å; K326-E347 HydrophobicContact CD-CB 4.26Å; K326-E347 WeakPolarHBondContact CD-O 3.37Å; K326-E347 PolarHBondContact NZ-O 2.59Å; K326-E347 VanDerWaalsContact NZ-O 3.07Å; K326-L349 HydrophobicContact CB-CD2 4.27Å; K326-L349 HydrophobicContact CB-CG 4.38Å; K326-L349 HydrophobicContact CG-CG 4.44Å
327	S	84.9	Confident	73.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.316	C	S	.	.			trans	-58.6	156	175.5	-62.8	0	0	0	0	113.8	K315 P329 E347 S348 D375	K315-S327 PolarHBondContact N-OG 2.89Å; S327-P329 WeakPolarHBondContact O-CD 3.36Å; S327-E347 CarbonylContact O-C 3.52Å; S327-E347 WeakPolarHBondContact O-CA 3.45Å; S327-E347 PolarHBondContact O-N 3.15Å; S327-S348 PolarHBondContact O-N 3.2Å; S327-D375 WeakPolarHBondContact CA-OD1 3.48Å; S327-D375 WeakPolarHBondContact CA-OD2 3.3Å; S327-D375 VanDerWaalsContact CB-OD1 3.27Å; S327-D375 WeakPolarHBondContact CB-OD1 3.5Å; S327-D375 WeakPolarHBondContact CB-OD2 3.39Å; S327-D375 PolarHBondContact OG-OD2 3.25Å
328	D	90.1	Very high	74.8	Confident	20 Å²	20	61.2 Å²	61.2	11%	0.107	31%	0.311	C	S	.	.			trans	-99.9	68.7	163.5	-81.9	9.4	0	0	0	109.4	T344 I345 K346 E347 D375 E376	D328-T344 HydrophobicContact CB-CG2 3.94Å; D328-T344 WeakPolarHBondContact O-CG2 3.2Å; D328-I345 CarbonylContact C-O 3.58Å; D328-I345 WeakPolarHBondContact CA-O 3.44Å; D328-K346 WeakPolarHBondContact OD1-CA 3.23Å; D328-K346 WeakPolarHBondContact OD1-CB 3.14Å; D328-K346 WeakPolarHBondContact OD2-CG 3.33Å; D328-K346 IonicContact OD2-NZ 3.89Å; D328-K346 PolarHBondContact OD2-NZ 3.04Å; D328-E347 PolarHBondContact OD1-N 2.89Å; D328-D375 PolarHBondContact N-OD1 2.84Å; D328-E376 PolarHBondContact O-N 3.25Å
329	P	93.4	Very high	76.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144.9	-171.1	29.3	-40.5	0	0	0	114.9	L312 S327 I345 S348 P351 W353 F374 L384	L312-P329 HydrophobicContact CD1-CB 3.86Å; L312-P329 HydrophobicContact CD1-CG 4.03Å; S327-P329 WeakPolarHBondContact O-CD 3.36Å; P329-I345 WeakPolarHBondContact CD-O 3.43Å; P329-I345 PolarHBondContact O-N 3.32Å; P329-S348 WeakPolarHBondContact CD-O 3.37Å; P329-S348 VanDerWaalsContact CG-O 3.23Å; P329-S348 WeakPolarHBondContact CG-O 3.36Å; P329-P351 HydrophobicContact CB-CG 4.26Å; P329-P351 HydrophobicContact CG-CB 3.76Å; P329-P351 HydrophobicContact CG-CG 3.59Å; P329-W353 HydrophobicContact CB-CZ2 4.17Å; P329-W353 HydrophobicContact CG-CZ2 4.47Å; P329-F374 CarbonylContact C-O 3.38Å; P329-F374 WeakPolarHBondContact CA-O 3.41Å; P329-L384 HydrophobicContact CB-CD1 3.75Å
330	Y	95.8	Very high	78.5	Confident	17 Å²	17	58.6 Å²	58.6	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	164.8	161.5	73.3	-91.6	0	0	0	111	T332 K341 L373 F374 E376 D381	Y330-T332 HydrophobicContact CD2-CG2 4.23Å; Y330-T332 HydrophobicContact CE2-CG2 3.6Å; Y330-K341 HydrophobicContact CD2-CD 3.52Å; Y330-K341 HydrophobicContact CD2-CG 3.58Å; Y330-K341 HydrophobicContact CE2-CD 3.44Å; Y330-K341 VanDerWaalsContact CE2-CD 3.44Å; Y330-K341 HydrophobicContact CE2-CG 3.93Å; Y330-K341 HydrophobicContact CG-CD 4.13Å; Y330-K341 VanDerWaalsContact CG-CE 3.45Å; Y330-K341 HydrophobicContact CG-CG 4.29Å; Y330-L373 WeakPolarHBondContact O-CA 3.26Å; Y330-F374 HydrophobicContact CD1-CB 4.19Å; Y330-F374 WeakPolarHBondContact CD1-O 2.89Å; Y330-F374 HydrophobicContact CE1-CB 3.5Å; Y330-F374 HydrophobicContact CE2-CB 4.03Å; Y330-F374 AromaticContact CE2-CD2 3.97Å; Y330-F374 HydrophobicContact CE2-CD2 3.97Å; Y330-F374 HydrophobicContact CE2-CG 4.39Å; Y330-F374 AromaticContact CZ-CD2 3.97Å; Y330-F374 AromaticContact CZ-CG 3.95Å; Y330-F374 PolarHBondContact N-O 3.38Å; Y330-F374 PolarHBondContact O-N 2.91Å; Y330-F374 WeakPolarHBondContact OH-CB 3.45Å; Y330-E376 HydrophobicContact CD1-CB 3.95Å; Y330-E376 HydrophobicContact CE1-CB 4.12Å; Y330-D381 HydrophobicContact CE1-CB 4.32Å; Y330-D381 VanDerWaalsContact CE1-OD2 3.23Å; Y330-D381 WeakPolarHBondContact CE1-OD2 3.02Å; Y330-D381 PolarHBondContact OH-OD2 3.21Å
331	V	96.6	Very high	80.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.2	176.3	-163	0	0	0	0	109.4	V306 L333 K341 T342 W353 I371 L373 I414	V306-V331 HydrophobicContact CG1-CG2 3.97Å; V331-L333 HydrophobicContact CG1-CD2 4.07Å; V331-K341 WeakPolarHBondContact O-CA 3.25Å; V331-T342 HydrophobicContact CB-CG2 3.79Å; V331-T342 HydrophobicContact CG2-CG2 4.19Å; V331-T342 PolarHBondContact N-OG1 3.35Å; V331-T342 PolarHBondContact O-N 3.46Å; V331-T342 PolarHBondContact O-OG1 3.36Å; V331-W353 HydrophobicContact CG2-CD2 4.05Å; V331-W353 HydrophobicContact CG2-CE3 3.96Å; V331-W353 HydrophobicContact CG2-CH2 3.35Å; V331-W353 HydrophobicContact CG2-CZ2 3.48Å; V331-W353 VanDerWaalsContact CG2-CZ2 3.48Å; V331-W353 HydrophobicContact CG2-CZ3 3.61Å; V331-I371 HydrophobicContact CG1-CG2 3.64Å; V331-L373 HydrophobicContact CG1-CD1 4.27Å; V331-L373 HydrophobicContact CG1-CG 4.25Å; V331-L373 HydrophobicContact CG2-CD2 4.41Å; V331-L373 HydrophobicContact CG2-CG 4.17Å; V331-I414 HydrophobicContact CG1-CD1 4.08Å; V331-I414 HydrophobicContact CG2-CD1 4.05Å
332	T	95.4	Very high	82.8	Confident	26 Å²	26	50.6 Å²	50.6	16%	0.16	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139.1	157.9	74.1	0	0	0	0	110.1	Y330 F340 I371 E372 F374	Y330-T332 HydrophobicContact CD2-CG2 4.23Å; Y330-T332 HydrophobicContact CE2-CG2 3.6Å; T332-F340 CarbonylContact C-O 3.6Å; T332-F340 VanDerWaalsContact CA-O 3.28Å; T332-F340 WeakPolarHBondContact CA-O 3.22Å; T332-I371 WeakPolarHBondContact O-CA 3.24Å; T332-E372 PolarHBondContact N-O 3.04Å; T332-E372 PolarHBondContact O-N 2.87Å; T332-E372 PolarHBondContact OG1-O 3.31Å; T332-F374 HydrophobicContact CG2-CD2 4.18Å; T332-F374 HydrophobicContact CG2-CE2 4.16Å
333	L	95.1	Very high	84.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.4	170.6	-58.9	-179.1	0	0	0	108.2	V304 V306 V331 H339 F340 Y357 F359 L369 I371	V304-L333 HydrophobicContact CB-CD1 4.49Å; V304-L333 HydrophobicContact CG1-CD1 4.09Å; V306-L333 HydrophobicContact CG2-CD1 3.7Å; V306-L333 HydrophobicContact CG2-CD2 4.17Å; V306-L333 HydrophobicContact CG2-CG 4.27Å; V331-L333 HydrophobicContact CG1-CD2 4.07Å; L333-H339 CarbonylContact O-C 3.38Å; L333-H339 WeakPolarHBondContact O-CA 3.28Å; L333-F340 PolarHBondContact N-O 2.88Å; L333-F340 PolarHBondContact O-N 2.89Å; L333-Y357 HydrophobicContact CD1-CD2 3.54Å; L333-Y357 HydrophobicContact CD1-CE2 4.23Å; L333-Y357 HydrophobicContact CD1-CG 3.89Å; L333-F359 HydrophobicContact CB-CE2 4.28Å; L333-F359 HydrophobicContact CB-CZ 3.7Å; L333-F359 HydrophobicContact CD1-CE2 4.03Å; L333-F359 HydrophobicContact CD1-CZ 4.18Å; L333-L369 HydrophobicContact CB-CD1 4.22Å; L333-L369 HydrophobicContact CD2-CD1 4.44Å; L333-I371 HydrophobicContact CD2-CB 4.38Å; L333-I371 HydrophobicContact CD2-CG1 3.64Å; L333-I371 HydrophobicContact CD2-CG2 4.28Å
334	R	89.6	Confident	86.7	Confident	47 Å²	47	48 Å²	48	18%	0.177	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.3	-177.1	-176.9	164.4	55.7	70.8	3.7	111	R338 H339 E370 E372	R334-R338 WeakPolarHBondContact CA-O 3.09Å; R334-H339 HydrophobicContact CB-CB 4.37Å; R334-H339 HydrophobicContact CG-CB 4.37Å; R334-E370 HydrophobicContact CB-CB 4.32Å; R334-E370 IonicContact CZ-OE1 2.71Å; R334-E370 IonicContact CZ-OE2 3.7Å; R334-E370 PolarHBondContact N-O 2.72Å; R334-E370 IonicContact NH1-OE1 2.62Å; R334-E370 PolarHBondContact NH1-OE1 2.81Å; R334-E370 IonicContact NH1-OE2 2.71Å; R334-E370 PolarHBondContact NH1-OE2 3.26Å; R334-E370 IonicContact NH2-OE1 3.45Å; R334-E370 IonicContact NH2-OE2 2.99Å; R334-E370 PolarHBondContact NH2-OE2 3.16Å; R334-E370 PolarHBondContact O-N 2.92Å; R334-E372 IonicContact CZ-OE1 3.55Å; R334-E372 IonicContact NE-OE1 3.77Å; R334-E372 IonicContact NH2-OE1 3.53Å; R334-E372 PolarHBondContact NH2-OE1 3Å
335	V	86	Confident	88.3	Confident	8 Å²	8	43.6 Å²	43.6	5%	0.048	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	98.4	178.3	174.9	0	0	0	0	107.8	N337 R338 F359 Q367 L369 F391	V335-N337 PolarHBondContact O-N 2.92Å; V335-R338 PolarHBondContact N-O 3.01Å; V335-R338 PolarHBondContact O-N 2.87Å; V335-F359 HydrophobicContact CB-CD1 3.62Å; V335-F359 HydrophobicContact CB-CE1 3.94Å; V335-F359 HydrophobicContact CB-CG 4.37Å; V335-F359 HydrophobicContact CG1-CD1 4.34Å; V335-F359 HydrophobicContact CG2-CB 4.28Å; V335-F359 HydrophobicContact CG2-CD1 3.33Å; V335-F359 HydrophobicContact CG2-CD2 4.32Å; V335-F359 HydrophobicContact CG2-CE1 3.55Å; V335-F359 HydrophobicContact CG2-CE2 4.49Å; V335-F359 HydrophobicContact CG2-CG 3.73Å; V335-F359 HydrophobicContact CG2-CZ 4.12Å; V335-Q367 HydrophobicContact CG1-CG 4.33Å; V335-L369 HydrophobicContact CG2-CB 4.5Å; V335-L369 HydrophobicContact CG2-CD1 3.66Å; V335-F391 HydrophobicContact CG1-CE2 3.85Å; V335-F391 HydrophobicContact CG1-CZ 4.48Å; V335-F391 HydrophobicContact CG2-CE2 3.88Å; V335-F391 HydrophobicContact CG2-CZ 3.73Å
336	G	76.5	Confident	89.2	Confident	18 Å²	18	49.8 Å²	49.8	19%	0.186	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-93.6	-175.8	0	0	0	0	0	112.9	R239	R239-G336 PolarHBondContact NE-O 3.49Å; R239-G336 PolarHBondContact NH2-O 2.89Å
337	N	70.9	Confident	89.6	Confident	54 Å²	54	49.8 Å²	49.8	29%	0.289	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-11.2	179.3	-67.9	-22.8	0	0	0	114.2	S272 V335	S272-N337 WeakPolarHBondContact CB-OD1 3.29Å; S272-N337 PolarHBondContact O-ND2 3.44Å; V335-N337 PolarHBondContact O-N 2.92Å
338	R	78.5	Confident	89.7	Confident	95 Å²	95	51 Å²	51	36%	0.358	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.2	171	-66.1	-172.7	73.8	165.8	3.9	109.3	R334 V335	R334-R338 WeakPolarHBondContact CA-O 3.09Å; V335-R338 PolarHBondContact N-O 3.01Å; V335-R338 PolarHBondContact O-N 2.87Å
339	H	86.4	Confident	89.6	Confident	139 Å²	139	52.7 Å²	52.7	64%	0.644	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	153.3	171.1	65.6	-85.3	0	0	0	110.6	L333 R334	L333-H339 CarbonylContact O-C 3.38Å; L333-H339 WeakPolarHBondContact O-CA 3.28Å; R334-H339 HydrophobicContact CB-CB 4.37Å; R334-H339 HydrophobicContact CG-CB 4.37Å
340	F	92.1	Very high	89.6	Confident	59 Å²	59	55.2 Å²	55.2	26%	0.259	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.2	170.1	-60.1	-79.5	0	0	0	109.4	T332 L333 Y357 F359	T332-F340 CarbonylContact C-O 3.6Å; T332-F340 VanDerWaalsContact CA-O 3.28Å; T332-F340 WeakPolarHBondContact CA-O 3.22Å; L333-F340 PolarHBondContact N-O 2.88Å; L333-F340 PolarHBondContact O-N 2.89Å; F340-Y357 HydrophobicContact CB-CD1 3.64Å; F340-Y357 HydrophobicContact CB-CE1 3.51Å; F340-Y357 HydrophobicContact CB-CG 4.49Å; F340-Y357 AromaticContact CD1-CD1 3.84Å; F340-Y357 HydrophobicContact CD1-CD1 3.84Å; F340-Y357 AromaticContact CD1-CE1 3.95Å; F340-Y357 HydrophobicContact CD1-CE1 3.95Å; F340-Y357 AromaticContact CD2-CD1 3.63Å; F340-Y357 HydrophobicContact CD2-CD1 3.63Å; F340-Y357 HydrophobicContact CD2-CE1 4.36Å; F340-Y357 HydrophobicContact CD2-CG 4.26Å; F340-Y357 HydrophobicContact CE1-CD1 4.33Å; F340-Y357 HydrophobicContact CE2-CD1 4.14Å; F340-Y357 AromaticContact CG-CD1 3.45Å; F340-Y357 HydrophobicContact CG-CD1 3.45Å; F340-Y357 VanDerWaalsContact CG-CD1 3.45Å; F340-Y357 AromaticContact CG-CE1 3.73Å; F340-Y357 HydrophobicContact CG-CE1 3.73Å; F340-Y357 HydrophobicContact CG-CG 4.42Å; F340-Y357 HydrophobicContact CZ-CD1 4.45Å; F340-F359 AromaticContact CD2-CE1 3.65Å; F340-F359 HydrophobicContact CD2-CE1 3.65Å; F340-F359 HydrophobicContact CD2-CE2 4.45Å; F340-F359 AromaticContact CD2-CZ 3.54Å; F340-F359 HydrophobicContact CD2-CZ 3.54Å; F340-F359 HydrophobicContact CE2-CD1 4.22Å; F340-F359 AromaticContact CE2-CE1 3.63Å; F340-F359 HydrophobicContact CE2-CE1 3.63Å; F340-F359 AromaticContact CE2-CZ 3.84Å; F340-F359 HydrophobicContact CE2-CZ 3.84Å
341	K	94.8	Very high	89.5	Confident	83 Å²	83	54.4 Å²	54.4	36%	0.361	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.6	168.5	165.9	161.5	175.9	166.1	0	107.8	Y330 V331 Y357 E376 D381	Y330-K341 HydrophobicContact CD2-CD 3.52Å; Y330-K341 HydrophobicContact CD2-CG 3.58Å; Y330-K341 HydrophobicContact CE2-CD 3.44Å; Y330-K341 VanDerWaalsContact CE2-CD 3.44Å; Y330-K341 HydrophobicContact CE2-CG 3.93Å; Y330-K341 HydrophobicContact CG-CD 4.13Å; Y330-K341 VanDerWaalsContact CG-CE 3.45Å; Y330-K341 HydrophobicContact CG-CG 4.29Å; V331-K341 WeakPolarHBondContact O-CA 3.25Å; K341-Y357 PolarHBondContact O-OH 3.32Å; K341-E376 WeakPolarHBondContact CE-OE1 3.43Å; K341-E376 IonicContact NZ-OE1 2.71Å; K341-E376 PolarHBondContact NZ-OE1 2.9Å; K341-D381 IonicContact NZ-OD2 2.6Å
342	T	96.6	Very high	89.5	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.043	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-70.1	170.7	172.4	63.3	0	0	0	0	111	V306 V331 W353 E355 Y357	V306-T342 HydrophobicContact CG1-CG2 4.26Å; V331-T342 HydrophobicContact CB-CG2 3.79Å; V331-T342 HydrophobicContact CG2-CG2 4.19Å; V331-T342 PolarHBondContact N-OG1 3.35Å; V331-T342 PolarHBondContact O-N 3.46Å; V331-T342 PolarHBondContact O-OG1 3.36Å; T342-W353 HydrophobicContact CG2-CG 4.5Å; T342-W353 PolarHBondContact OG1-NE1 2.82Å; T342-E355 WeakPolarHBondContact CA-OE2 3.35Å; T342-E355 WeakPolarHBondContact CB-OE2 3.13Å; T342-Y357 WeakPolarHBondContact CA-OH 3.42Å; T342-Y357 HydrophobicContact CG2-CE2 4.13Å
343	K	94.9	Very high	89.6	Confident	144 Å²	144	59.5 Å²	59.5	63%	0.626	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-60.2	144	159.1	-68.3	-175.9	-157.3	82	0	110.3	W353 E355	K343-W353 PolarHBondContact O-NE1 2.91Å; K343-E355 VanDerWaalsContact CG-OE1 3.31Å; K343-E355 WeakPolarHBondContact CG-OE1 3.49Å; K343-E355 PolarHBondContact N-OE2 2.88Å; K343-E355 IonicContact NZ-OE1 2.66Å; K343-E355 PolarHBondContact NZ-OE1 3.1Å
344	T	94.6	Very high	89.6	Confident	36 Å²	36	64.3 Å²	64.3	22%	0.221	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-73.2	134	167.1	-41.5	0	0	0	0	109.9	D328 E376	D328-T344 HydrophobicContact CB-CG2 3.94Å; D328-T344 WeakPolarHBondContact O-CG2 3.2Å; T344-E376 VanDerWaalsContact CB-OE2 3.27Å; T344-E376 WeakPolarHBondContact CB-OE2 3.3Å; T344-E376 HydrophobicContact CG2-CB 3.53Å; T344-E376 HydrophobicContact CG2-CG 4.32Å; T344-E376 WeakPolarHBondContact CG2-OE2 3.4Å; T344-E376 PolarHBondContact OG1-OE1 2.88Å; T344-E376 PolarHBondContact OG1-OE2 3.49Å
345	I	93.3	Very high	89.8	Confident	44 Å²	44	63.2 Å²	63.2	23%	0.226	31%	0.309	C	S	.	.			trans	-112	119.8	175.2	-68.5	-179.5	0	0	0	108.4	D328 P329 P351 K352 W353	D328-I345 CarbonylContact C-O 3.58Å; D328-I345 WeakPolarHBondContact CA-O 3.44Å; P329-I345 WeakPolarHBondContact CD-O 3.43Å; P329-I345 PolarHBondContact O-N 3.32Å; I345-P351 HydrophobicContact CB-CB 3.96Å; I345-P351 HydrophobicContact CD1-CB 4Å; I345-P351 HydrophobicContact CG2-CB 3.98Å; I345-K352 VanDerWaalsContact CD1-O 3.25Å; I345-K352 WeakPolarHBondContact CD1-O 3.31Å; I345-W353 HydrophobicContact CD1-CB 4.4Å; I345-W353 VanDerWaalsContact CD1-CD1 3.45Å; I345-W353 HydrophobicContact CD1-CD2 4.29Å; I345-W353 HydrophobicContact CD1-CG 3.81Å
346	K	90	Very high	90.2	Very high	142 Å²	142	65.5 Å²	65.5	62%	0.617	32%	0.324	S	S	*	.			trans	-78.7	148.5	-171.1	-59.7	-161.8	163.8	-73.3	0	114.2	D328 S348	D328-K346 WeakPolarHBondContact OD1-CA 3.23Å; D328-K346 WeakPolarHBondContact OD1-CB 3.14Å; D328-K346 WeakPolarHBondContact OD2-CG 3.33Å; D328-K346 IonicContact OD2-NZ 3.89Å; D328-K346 PolarHBondContact OD2-NZ 3.04Å; K346-S348 VanDerWaalsContact C-N 3.35Å; K346-S348 PolarHBondContact O-N 2.64Å
347	E	85.9	Confident	91.1	Very high	106 Å²	106	66.3 Å²	66.3	50%	0.495	32%	0.321	S	S	.	.	S	Bend	trans	44	51.5	173	-62.9	-177	-152.6	0	0	113.8	K326 S327 D328	K326-E347 HydrophobicContact CB-CB 4.41Å; K326-E347 VanDerWaalsContact CD-C 3.49Å; K326-E347 HydrophobicContact CD-CB 4.26Å; K326-E347 WeakPolarHBondContact CD-O 3.37Å; K326-E347 PolarHBondContact NZ-O 2.59Å; K326-E347 VanDerWaalsContact NZ-O 3.07Å; S327-E347 CarbonylContact O-C 3.52Å; S327-E347 WeakPolarHBondContact O-CA 3.45Å; S327-E347 PolarHBondContact O-N 3.15Å; D328-E347 PolarHBondContact OD1-N 2.89Å
348	S	87.6	Confident	92.2	Very high	26 Å²	26	64.7 Å²	64.7	18%	0.182	31%	0.312	C	S	.	.			trans	-143	130.1	-177.9	-167.5	0	0	0	0	114.1	S327 P329 K346 A350	S327-S348 PolarHBondContact O-N 3.2Å; P329-S348 WeakPolarHBondContact CD-O 3.37Å; P329-S348 VanDerWaalsContact CG-O 3.23Å; P329-S348 WeakPolarHBondContact CG-O 3.36Å; K346-S348 VanDerWaalsContact C-N 3.35Å; K346-S348 PolarHBondContact O-N 2.64Å; S348-A350 PolarHBondContact OG-N 2.84Å; S348-A350 VanDerWaalsContact OG-N 3.15Å; S348-A350 PolarHBondContact OG-O 2.8Å
349	L	88.2	Confident	92.8	Very high	55 Å²	55	60.2 Å²	60.2	29%	0.288	30%	0.295	S	S	.	.	S	Bend	trans	-96.3	0.7	168.3	-49.2	-179	0	0	0	112.3	K310 D311 L312 A314 K326	K310-L349 CarbonylContact C-O 3.53Å; K310-L349 WeakPolarHBondContact CA-O 3.39Å; D311-L349 PolarHBondContact N-O 3.36Å; L312-L349 HydrophobicContact CB-CB 4.43Å; L312-L349 PolarHBondContact N-O 3.39Å; A314-L349 HydrophobicContact CB-CD1 3.88Å; A314-L349 HydrophobicContact CB-CD2 3.74Å; A314-L349 HydrophobicContact CB-CG 4.44Å; K326-L349 HydrophobicContact CB-CD2 4.27Å; K326-L349 HydrophobicContact CB-CG 4.38Å; K326-L349 HydrophobicContact CG-CG 4.44Å
350	A	92	Very high	93.1	Very high	52 Å²	52	54.1 Å²	54.1	43%	0.43	27%	0.267	S	S	.	.	S	Bend	trans	-133.9	63.5	172.6	0	0	0	0	0	110.5	A309 S348	A309-A350 CarbonylContact O-C 3.53Å; A309-A350 WeakPolarHBondContact O-CA 3.47Å; S348-A350 PolarHBondContact OG-N 2.84Å; S348-A350 VanDerWaalsContact OG-N 3.15Å; S348-A350 PolarHBondContact OG-O 2.8Å
351	P	94.8	Very high	93.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.			trans	-68.4	149.2	-178.4	31.6	-39	0	0	0	111.9	E308 A309 L312 P329 I345 W353	E308-P351 CarbonylContact C-O 3.48Å; E308-P351 WeakPolarHBondContact CA-O 3.36Å; E308-P351 WeakPolarHBondContact CB-O 3.49Å; A309-P351 HydrophobicContact CB-CG 3.97Å; A309-P351 PolarHBondContact N-O 3.01Å; L312-P351 HydrophobicContact CD1-CG 3.83Å; P329-P351 HydrophobicContact CB-CG 4.26Å; P329-P351 HydrophobicContact CG-CB 3.76Å; P329-P351 HydrophobicContact CG-CG 3.59Å; I345-P351 HydrophobicContact CB-CB 3.96Å; I345-P351 HydrophobicContact CD1-CB 4Å; I345-P351 HydrophobicContact CG2-CB 3.98Å; P351-W353 HydrophobicContact CB-CD2 4.4Å; P351-W353 HydrophobicContact CB-CH2 3.96Å; P351-W353 HydrophobicContact CB-CZ2 3.73Å; P351-W353 HydrophobicContact CB-CZ3 4.35Å; P351-W353 HydrophobicContact CG-CE3 4.41Å; P351-W353 HydrophobicContact CG-CH2 3.25Å; P351-W353 HydrophobicContact CG-CZ2 3.46Å; P351-W353 VanDerWaalsContact CG-CZ2 3.46Å; P351-W353 HydrophobicContact CG-CZ3 3.76Å
352	K	96.4	Very high	92.7	Very high	114 Å²	114	48.1 Å²	48.1	50%	0.496	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	95.5	177.5	-58.2	-172.5	-179.6	-73.5	0	110.3	L307 E308 I345	L307-K352 CarbonylContact O-C 3.55Å; L307-K352 WeakPolarHBondContact O-CA 3.29Å; E308-K352 HydrophobicContact CB-CB 4.22Å; E308-K352 HydrophobicContact CB-CG 3.83Å; E308-K352 IonicContact OE1-NZ 3.26Å; E308-K352 PolarHBondContact OE1-NZ 2.87Å; E308-K352 IonicContact OE2-NZ 2.64Å; E308-K352 PolarHBondContact OE2-NZ 3.06Å; I345-K352 VanDerWaalsContact CD1-O 3.25Å; I345-K352 WeakPolarHBondContact CD1-O 3.31Å
353	W	96.4	Very high	92.1	Very high	19 Å²	19	48 Å²	48	7%	0.072	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-48.1	-175.7	-61.7	-80.9	0	0	0	112.6	V306 L307 A309 P329 V331 T342 K343 I345 P351 E355 L373 I414	V306-W353 HydrophobicContact CG1-CB 4.3Å; V306-W353 HydrophobicContact CG1-CD2 4.16Å; V306-W353 HydrophobicContact CG1-CE3 3.67Å; V306-W353 HydrophobicContact CG1-CG 4.45Å; V306-W353 HydrophobicContact CG1-CZ3 4.3Å; L307-W353 PolarHBondContact O-N 3.08Å; A309-W353 HydrophobicContact CB-CH2 3.87Å; A309-W353 HydrophobicContact CB-CZ3 3.72Å; P329-W353 HydrophobicContact CB-CZ2 4.17Å; P329-W353 HydrophobicContact CG-CZ2 4.47Å; V331-W353 HydrophobicContact CG2-CD2 4.05Å; V331-W353 HydrophobicContact CG2-CE3 3.96Å; V331-W353 HydrophobicContact CG2-CH2 3.35Å; V331-W353 HydrophobicContact CG2-CZ2 3.48Å; V331-W353 VanDerWaalsContact CG2-CZ2 3.48Å; V331-W353 HydrophobicContact CG2-CZ3 3.61Å; T342-W353 HydrophobicContact CG2-CG 4.5Å; T342-W353 PolarHBondContact OG1-NE1 2.82Å; K343-W353 PolarHBondContact O-NE1 2.91Å; I345-W353 HydrophobicContact CD1-CB 4.4Å; I345-W353 VanDerWaalsContact CD1-CD1 3.45Å; I345-W353 HydrophobicContact CD1-CD2 4.29Å; I345-W353 HydrophobicContact CD1-CG 3.81Å; P351-W353 HydrophobicContact CB-CD2 4.4Å; P351-W353 HydrophobicContact CB-CH2 3.96Å; P351-W353 HydrophobicContact CB-CZ2 3.73Å; P351-W353 HydrophobicContact CB-CZ3 4.35Å; P351-W353 HydrophobicContact CG-CE3 4.41Å; P351-W353 HydrophobicContact CG-CH2 3.25Å; P351-W353 HydrophobicContact CG-CZ2 3.46Å; P351-W353 VanDerWaalsContact CG-CZ2 3.46Å; P351-W353 HydrophobicContact CG-CZ3 3.76Å; W353-E355 VanDerWaalsContact C-N 3.27Å; W353-E355 HydrophobicContact CB-CG 4.1Å; W353-E355 PolarHBondContact O-N 2.95Å; W353-L373 HydrophobicContact CH2-CD2 4.11Å; W353-I414 HydrophobicContact CZ3-CD1 4.46Å
354	N	95.5	Very high	91.6	Very high	103 Å²	103	41.4 Å²	41.4	55%	0.551	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	53.1	42.8	-173.1	-55.6	-87.8	0	0	0	112.8	V306 L307	V306-N354 VanDerWaalsContact O-CA 3.29Å; V306-N354 WeakPolarHBondContact O-CA 3.48Å; V306-N354 PolarHBondContact O-N 3.1Å; L307-N354 PolarHBondContact O-N 3.15Å; L307-N354 VanDerWaalsContact O-N 3.11Å
355	E	95.3	Very high	90.8	Very high	23 Å²	23	40.6 Å²	40.6	11%	0.107	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	144.5	-177.7	-61.5	-166.8	136.7	0	0	111.2	H305 V306 T342 K343 W353 Y357	H305-E355 CarbonylContact C-O 3.34Å; H305-E355 WeakPolarHBondContact CA-O 3.47Å; V306-E355 PolarHBondContact N-O 2.75Å; V306-E355 PolarHBondContact O-N 2.68Å; T342-E355 WeakPolarHBondContact CA-OE2 3.35Å; T342-E355 WeakPolarHBondContact CB-OE2 3.13Å; K343-E355 VanDerWaalsContact CG-OE1 3.31Å; K343-E355 WeakPolarHBondContact CG-OE1 3.49Å; K343-E355 PolarHBondContact N-OE2 2.88Å; K343-E355 IonicContact NZ-OE1 2.66Å; K343-E355 PolarHBondContact NZ-OE1 3.1Å; W353-E355 VanDerWaalsContact C-N 3.27Å; W353-E355 HydrophobicContact CB-CG 4.1Å; W353-E355 PolarHBondContact O-N 2.95Å; E355-Y357 HydrophobicContact CB-CE2 3.76Å; E355-Y357 PolarHBondContact OE2-OH 2.71Å
356	V	94.5	Very high	90	Very high	57 Å²	57	38.9 Å²	38.9	35%	0.345	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.8	-172	-170.5	0	0	0	0	110.8	R303 V304 H305 L437	R303-V356 HydrophobicContact CG-CG1 3.54Å; V304-V356 WeakPolarHBondContact O-CA 3.15Å; H305-V356 HydrophobicContact CB-CG2 4.37Å; H305-V356 VanDerWaalsContact ND1-CG2 3.33Å; H305-V356 WeakPolarHBondContact ND1-CG2 3.49Å; V356-L437 HydrophobicContact CB-CD2 4.23Å; V356-L437 HydrophobicContact CG1-CD2 3.77Å
357	Y	94.3	Very high	89.8	Confident	34 Å²	34	32.9 Å²	32.9	13%	0.133	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.4	-177.7	-62.7	-84.5	0	0	0	110.8	R303 V304 V306 L333 F340 K341 T342 E355	R303-Y357 WeakPolarHBondContact CA-O 3.44Å; V304-Y357 PolarHBondContact N-O 3.23Å; V304-Y357 PolarHBondContact O-N 3.13Å; V306-Y357 HydrophobicContact CG2-CD2 4.3Å; V306-Y357 HydrophobicContact CG2-CE2 4.45Å; L333-Y357 HydrophobicContact CD1-CD2 3.54Å; L333-Y357 HydrophobicContact CD1-CE2 4.23Å; L333-Y357 HydrophobicContact CD1-CG 3.89Å; F340-Y357 HydrophobicContact CB-CD1 3.64Å; F340-Y357 HydrophobicContact CB-CE1 3.51Å; F340-Y357 HydrophobicContact CB-CG 4.49Å; F340-Y357 AromaticContact CD1-CD1 3.84Å; F340-Y357 HydrophobicContact CD1-CD1 3.84Å; F340-Y357 AromaticContact CD1-CE1 3.95Å; F340-Y357 HydrophobicContact CD1-CE1 3.95Å; F340-Y357 AromaticContact CD2-CD1 3.63Å; F340-Y357 HydrophobicContact CD2-CD1 3.63Å; F340-Y357 HydrophobicContact CD2-CE1 4.36Å; F340-Y357 HydrophobicContact CD2-CG 4.26Å; F340-Y357 HydrophobicContact CE1-CD1 4.33Å; F340-Y357 HydrophobicContact CE2-CD1 4.14Å; F340-Y357 AromaticContact CG-CD1 3.45Å; F340-Y357 HydrophobicContact CG-CD1 3.45Å; F340-Y357 VanDerWaalsContact CG-CD1 3.45Å; F340-Y357 AromaticContact CG-CE1 3.73Å; F340-Y357 HydrophobicContact CG-CE1 3.73Å; F340-Y357 HydrophobicContact CG-CG 4.42Å; F340-Y357 HydrophobicContact CZ-CD1 4.45Å; K341-Y357 PolarHBondContact O-OH 3.32Å; T342-Y357 WeakPolarHBondContact CA-OH 3.42Å; T342-Y357 HydrophobicContact CG2-CE2 4.13Å; E355-Y357 HydrophobicContact CB-CE2 3.76Å; E355-Y357 PolarHBondContact OE2-OH 2.71Å
358	E	93.4	Very high	89.9	Confident	21 Å²	21	28.8 Å²	28.8	10%	0.098	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124	-177.4	-65.6	179.3	148.9	0	0	109.9	V301 R303 S438 F514	V301-E358 HydrophobicContact CG1-CB 4.25Å; R303-E358 HydrophobicContact CB-CG 4.35Å; R303-E358 HydrophobicContact CG-CG 4.17Å; R303-E358 IonicContact CZ-OE1 3.92Å; R303-E358 VanDerWaalsContact CZ-OE1 3.24Å; R303-E358 IonicContact NE-OE1 2.86Å; R303-E358 PolarHBondContact NE-OE1 3.23Å; R303-E358 IonicContact NH2-OE1 2.62Å; R303-E358 PolarHBondContact NH2-OE1 2.98Å; E358-S438 PolarHBondContact OE1-N 2.91Å; E358-S438 WeakPolarHBondContact OE2-CB 3.39Å; E358-S438 PolarHBondContact OE2-OG 3.3Å; E358-F514 HydrophobicContact CB-CD2 4.26Å; E358-F514 HydrophobicContact CB-CE1 4.15Å; E358-F514 HydrophobicContact CB-CE2 3.75Å; E358-F514 HydrophobicContact CB-CZ 3.68Å; E358-F514 WeakPolarHBondContact O-CE2 3.41Å; E358-F514 WeakPolarHBondContact O-CZ 3.03Å
359	F	92.7	Very high	90.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132	-176.4	-66.7	-84	0	0	0	111.2	V301 V302 V304 L333 V335 F340 L369 F391	V301-F359 CarbonylContact C-O 3.55Å; V301-F359 VanDerWaalsContact CA-O 3.26Å; V301-F359 WeakPolarHBondContact CA-O 3.5Å; V301-F359 WeakPolarHBondContact CG1-O 3.31Å; V302-F359 PolarHBondContact N-O 3.05Å; V302-F359 PolarHBondContact O-N 3.38Å; V304-F359 HydrophobicContact CB-CE2 4.34Å; V304-F359 HydrophobicContact CG2-CD2 3.76Å; V304-F359 HydrophobicContact CG2-CE2 3.9Å; L333-F359 HydrophobicContact CB-CE2 4.28Å; L333-F359 HydrophobicContact CB-CZ 3.7Å; L333-F359 HydrophobicContact CD1-CE2 4.03Å; L333-F359 HydrophobicContact CD1-CZ 4.18Å; V335-F359 HydrophobicContact CB-CD1 3.62Å; V335-F359 HydrophobicContact CB-CE1 3.94Å; V335-F359 HydrophobicContact CB-CG 4.37Å; V335-F359 HydrophobicContact CG1-CD1 4.34Å; V335-F359 HydrophobicContact CG2-CB 4.28Å; V335-F359 HydrophobicContact CG2-CD1 3.33Å; V335-F359 HydrophobicContact CG2-CD2 4.32Å; V335-F359 HydrophobicContact CG2-CE1 3.55Å; V335-F359 HydrophobicContact CG2-CE2 4.49Å; V335-F359 HydrophobicContact CG2-CG 3.73Å; V335-F359 HydrophobicContact CG2-CZ 4.12Å; F340-F359 AromaticContact CD2-CE1 3.65Å; F340-F359 HydrophobicContact CD2-CE1 3.65Å; F340-F359 HydrophobicContact CD2-CE2 4.45Å; F340-F359 AromaticContact CD2-CZ 3.54Å; F340-F359 HydrophobicContact CD2-CZ 3.54Å; F340-F359 HydrophobicContact CE2-CD1 4.22Å; F340-F359 AromaticContact CE2-CE1 3.63Å; F340-F359 HydrophobicContact CE2-CE1 3.63Å; F340-F359 AromaticContact CE2-CZ 3.84Å; F340-F359 HydrophobicContact CE2-CZ 3.84Å; F359-L369 HydrophobicContact CD2-CD1 4.48Å; F359-L369 HydrophobicContact CE2-CD1 3.99Å; F359-L369 HydrophobicContact CZ-CD1 4.14Å; F359-F391 HydrophobicContact CB-CZ 4.42Å
360	V	91.9	Very high	90.2	Very high	11 Å²	11	26.7 Å²	26.7	7%	0.067	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.2	174	-178.8	0	0	0	0	108.8	P298 Q367 M441 N512 F514	P298-V360 HydrophobicContact CB-CG1 3.49Å; P298-V360 VanDerWaalsContact CB-CG1 3.49Å; P298-V360 HydrophobicContact CG-CG1 3.17Å; V360-Q367 PolarHBondContact O-NE2 3.13Å; V360-M441 HydrophobicContact CG1-SD 4.19Å; V360-M441 HydrophobicContact CG2-SD 3.98Å; V360-N512 HydrophobicContact CG2-CB 4.13Å; V360-F514 HydrophobicContact CG2-CE1 4.06Å; V360-F514 HydrophobicContact CG2-CE2 4.43Å; V360-F514 HydrophobicContact CG2-CZ 3.63Å
361	V	91.3	Very high	90.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	108.9	-177.5	-177.2	0	0	0	0	109.2	P298 R299 G300 V302 E363 A364 Q367 F391 W420	P298-V361 CarbonylContact C-O 3.6Å; P298-V361 WeakPolarHBondContact CB-O 3.34Å; R299-V361 PolarHBondContact N-O 2.76Å; G300-V361 PolarHBondContact N-O 3.04Å; G300-V361 PolarHBondContact O-N 2.76Å; V302-V361 HydrophobicContact CB-CG2 4.15Å; V302-V361 HydrophobicContact CG2-CG2 3.77Å; V361-E363 WeakPolarHBondContact CG1-O 3.24Å; V361-A364 HydrophobicContact CG1-CB 3.97Å; V361-Q367 HydrophobicContact CG1-CB 4.49Å; V361-F391 HydrophobicContact CB-CD2 4.42Å; V361-F391 HydrophobicContact CG1-CB 3.99Å; V361-F391 HydrophobicContact CG1-CD2 3.94Å; V361-F391 HydrophobicContact CG1-CG 4.23Å; V361-F391 HydrophobicContact CG2-CB 4.37Å; V361-F391 HydrophobicContact CG2-CD1 4.33Å; V361-F391 HydrophobicContact CG2-CD2 3.59Å; V361-F391 HydrophobicContact CG2-CE2 3.84Å; V361-F391 HydrophobicContact CG2-CG 3.86Å; V361-F391 HydrophobicContact CG2-CZ 4.28Å; V361-W420 HydrophobicContact CB-CH2 4.23Å; V361-W420 HydrophobicContact CB-CZ3 4.17Å; V361-W420 HydrophobicContact CG1-CH2 4.05Å; V361-W420 HydrophobicContact CG1-CZ3 3.99Å; V361-W420 HydrophobicContact CG2-CZ3 4.38Å
362	H	87.7	Confident	90.4	Very high	16 Å²	16	26.3 Å²	26.3	7%	0.074	13%	0.132	C	C	.	.	S	Bend	trans	-85.5	-25.4	-177	-77.7	-82	0	0	0	112.7	L276 R279	L276-H362 HydrophobicContact CD1-CB 4.22Å; L276-H362 HydrophobicContact CD2-CB 4.23Å; R279-H362 PolarHBondContact NH2-O 3.12Å; R279-H362 VanDerWaalsContact NH2-O 3.09Å
363	E	84.2	Confident	90.3	Very high	5 Å²	5	20.9 Å²	20.9	2%	0.023	11%	0.108	C	C	.	.	S	Bend	trans	-144.2	147.8	165	-65.1	-53.6	161.6	0	0	111.4	I218 F235 L276 R279 R299 V361 Q367	I218-E363 HydrophobicContact CD1-CG 4.49Å; I218-E363 WeakPolarHBondContact CD1-OE1 3.42Å; F235-E363 HydrophobicContact CE2-CG 4.23Å; F235-E363 HydrophobicContact CZ-CG 3.75Å; L276-E363 HydrophobicContact CD1-CB 4.43Å; L276-E363 HydrophobicContact CD1-CG 4.33Å; R279-E363 IonicContact CZ-OE1 2.72Å; R279-E363 IonicContact NH1-OE1 3.14Å; R279-E363 PolarHBondContact NH1-OE1 2.88Å; R279-E363 IonicContact NH2-OE1 2.74Å; R279-E363 PolarHBondContact NH2-OE1 2.85Å; R299-E363 IonicContact CZ-OE2 2.78Å; R299-E363 VanDerWaalsContact CZ-OE2 3.31Å; R299-E363 IonicContact NE-OE1 3.63Å; R299-E363 IonicContact NE-OE2 3.82Å; R299-E363 PolarHBondContact NE-OE2 3.15Å; R299-E363 IonicContact NH2-OE1 2.72Å; R299-E363 PolarHBondContact NH2-OE1 3.33Å; R299-E363 IonicContact NH2-OE2 3.7Å; R299-E363 PolarHBondContact NH2-OE2 2.9Å; V361-E363 WeakPolarHBondContact CG1-O 3.24Å; E363-Q367 WeakPolarHBondContact O-CB 3.25Å
364	A	83.3	Confident	90.2	Very high	5 Å²	5	21.8 Å²	21.8	4%	0.041	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-154.3	128.7	168.7	0	0	0	0	0	108.5	V361 F391 K395 W420	V361-A364 HydrophobicContact CG1-CB 3.97Å; A364-F391 HydrophobicContact CB-CB 4.11Å; A364-K395 HydrophobicContact CB-CB 4.28Å; A364-K395 HydrophobicContact CB-CD 3.82Å; A364-K395 WeakPolarHBondContact O-CD 3.13Å; A364-K395 PolarHBondContact O-NZ 3.07Å; A364-W420 HydrophobicContact CB-CH2 3.93Å; A364-W420 HydrophobicContact CB-CZ3 3.97Å
365	P	77.8	Confident	90	Very high	19 Å²	19	17 Å²	17	12%	0.123	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	cis	-72.9	165.4	7.2	31.5	-37.7	0	0	0	114.3	Y171 E174 R216	Y171-P365 HydrophobicContact CD1-CG 4.18Å; Y171-P365 HydrophobicContact CE1-CG 3.75Å; E174-P365 VanDerWaalsContact OE2-CD 3.24Å; E174-P365 WeakPolarHBondContact OE2-CD 3.33Å; E174-P365 WeakPolarHBondContact OE2-CG 3.39Å; R216-P365 PolarHBondContact NH1-O 2.84Å; R216-P365 PolarHBondContact NH2-O 2.84Å
366	G	77.3	Confident	89.7	Confident	8 Å²	8	19.5 Å²	19.5	8%	0.082	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.7	-39.6	171.4	0	0	0	0	0	115.1	I237 E368 D390	I237-G366 WeakPolarHBondContact CG2-O 3.38Å; G366-E368 PolarHBondContact O-N 2.89Å; G366-D390 VanDerWaalsContact N-CG 3.25Å; G366-D390 PolarHBondContact N-OD1 3.35Å; G366-D390 PolarHBondContact N-OD2 3.34Å
367	Q	84.7	Confident	89.1	Confident	16 Å²	16	19.9 Å²	19.9	8%	0.075	10%	0.099	C	C	.	.			trans	-73.4	126	175	-168.1	-179.3	-32.4	0	0	108.7	V335 V360 V361 E363 F391	V335-Q367 HydrophobicContact CG1-CG 4.33Å; V360-Q367 PolarHBondContact O-NE2 3.13Å; V361-Q367 HydrophobicContact CG1-CB 4.49Å; E363-Q367 WeakPolarHBondContact O-CB 3.25Å; Q367-F391 HydrophobicContact CB-CD2 4.19Å; Q367-F391 HydrophobicContact CG-CD2 4.16Å; Q367-F391 HydrophobicContact CG-CE2 4.42Å; Q367-F391 WeakPolarHBondContact O-CB 3.45Å; Q367-F391 WeakPolarHBondContact O-CD2 3.46Å; Q367-F391 WeakPolarHBondContact O-CG 3.3Å; Q367-F391 PolarHBondContact O-N 2.86Å
368	E	87.9	Confident	87.9	Confident	21 Å²	21	30.3 Å²	30.3	10%	0.098	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	153	-173.3	-78.9	158.9	-133.1	0	0	113.2	R238 G366 L389 D390	R238-E368 IonicContact CZ-OE1 2.75Å; R238-E368 IonicContact CZ-OE2 3.63Å; R238-E368 VanDerWaalsContact NE-CD 3.28Å; R238-E368 IonicContact NE-OE1 2.69Å; R238-E368 PolarHBondContact NE-OE1 3.48Å; R238-E368 IonicContact NE-OE2 3.03Å; R238-E368 PolarHBondContact NE-OE2 3.48Å; R238-E368 VanDerWaalsContact NE-OE2 3.12Å; R238-E368 IonicContact NH2-OE1 3.61Å; R238-E368 PolarHBondContact NH2-OE1 2.66Å; R238-E368 IonicContact NH2-OE2 2.74Å; R238-E368 PolarHBondContact NH2-OE2 2.65Å; G366-E368 PolarHBondContact O-N 2.89Å; E368-L389 CarbonylContact C-O 3.58Å; E368-L389 VanDerWaalsContact CA-O 3.27Å; E368-L389 WeakPolarHBondContact CA-O 3.02Å; E368-D390 HydrophobicContact CG-CB 4.24Å
369	L	91.8	Very high	87.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	111.9	160.3	179.3	62.6	0	0	0	108.4	V304 L333 V335 F359 I371 N388 L389 F391 L418	V304-L369 HydrophobicContact CG1-CD2 4.03Å; V304-L369 HydrophobicContact CG2-CD2 3.8Å; L333-L369 HydrophobicContact CB-CD1 4.22Å; L333-L369 HydrophobicContact CD2-CD1 4.44Å; V335-L369 HydrophobicContact CG2-CB 4.5Å; V335-L369 HydrophobicContact CG2-CD1 3.66Å; F359-L369 HydrophobicContact CD2-CD1 4.48Å; F359-L369 HydrophobicContact CE2-CD1 3.99Å; F359-L369 HydrophobicContact CZ-CD1 4.14Å; L369-I371 HydrophobicContact CD2-CD1 3.89Å; L369-I371 HydrophobicContact CD2-CG1 4.19Å; L369-I371 HydrophobicContact CG-CD1 3.88Å; L369-I371 HydrophobicContact CG-CG1 3.94Å; L369-N388 WeakPolarHBondContact O-CA 3.32Å; L369-L389 PolarHBondContact N-O 3.1Å; L369-L389 PolarHBondContact O-N 3.49Å; L369-F391 HydrophobicContact CB-CE1 3.78Å; L369-F391 HydrophobicContact CB-CE2 4.41Å; L369-F391 HydrophobicContact CB-CZ 3.65Å; L369-F391 HydrophobicContact CD1-CZ 4.43Å; L369-F391 HydrophobicContact CD2-CE1 4.49Å; L369-F391 HydrophobicContact CG-CZ 4.49Å; L369-L418 HydrophobicContact CD2-CD2 3.93Å
370	E	91.7	Very high	86.4	Confident	36 Å²	36	44.1 Å²	44.1	17%	0.168	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	119.3	173.7	-58.9	177.9	-106.9	0	0	108.1	R334	R334-E370 HydrophobicContact CB-CB 4.32Å; R334-E370 IonicContact CZ-OE1 2.71Å; R334-E370 IonicContact CZ-OE2 3.7Å; R334-E370 PolarHBondContact N-O 2.72Å; R334-E370 IonicContact NH1-OE1 2.62Å; R334-E370 PolarHBondContact NH1-OE1 2.81Å; R334-E370 IonicContact NH1-OE2 2.71Å; R334-E370 PolarHBondContact NH1-OE2 3.26Å; R334-E370 IonicContact NH2-OE1 3.45Å; R334-E370 IonicContact NH2-OE2 2.99Å; R334-E370 PolarHBondContact NH2-OE2 3.16Å; R334-E370 PolarHBondContact O-N 2.92Å
371	I	95.1	Very high	86.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.4	-179.3	-62.2	127.3	0	0	0	107.9	V331 T332 L333 L369 L373 K386 Y387 I414 L416	V331-I371 HydrophobicContact CG1-CG2 3.64Å; T332-I371 WeakPolarHBondContact O-CA 3.24Å; L333-I371 HydrophobicContact CD2-CB 4.38Å; L333-I371 HydrophobicContact CD2-CG1 3.64Å; L333-I371 HydrophobicContact CD2-CG2 4.28Å; L369-I371 HydrophobicContact CD2-CD1 3.89Å; L369-I371 HydrophobicContact CD2-CG1 4.19Å; L369-I371 HydrophobicContact CG-CD1 3.88Å; L369-I371 HydrophobicContact CG-CG1 3.94Å; I371-L373 HydrophobicContact CG2-CD1 3.88Å; I371-K386 CarbonylContact O-C 3.46Å; I371-K386 WeakPolarHBondContact O-CA 3.41Å; I371-K386 VanDerWaalsContact O-CB 3.26Å; I371-K386 WeakPolarHBondContact O-CB 3.45Å; I371-Y387 WeakPolarHBondContact CA-O 3.41Å; I371-Y387 WeakPolarHBondContact CB-O 3.44Å; I371-Y387 HydrophobicContact CD1-CD1 4.03Å; I371-Y387 PolarHBondContact N-O 3.34Å; I371-Y387 PolarHBondContact O-N 3.34Å; I371-I414 HydrophobicContact CG2-CD1 4.16Å; I371-L416 HydrophobicContact CD1-CD1 3.6Å; I371-L416 HydrophobicContact CG1-CD1 4.21Å
372	E	95.1	Very high	86	Confident	45 Å²	45	48.5 Å²	48.5	21%	0.21	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.2	177	-59.4	165.1	-158.5	0	0	109.1	T332 R334 F374 K386	T332-E372 PolarHBondContact N-O 3.04Å; T332-E372 PolarHBondContact O-N 2.87Å; T332-E372 PolarHBondContact OG1-O 3.31Å; R334-E372 IonicContact CZ-OE1 3.55Å; R334-E372 IonicContact NE-OE1 3.77Å; R334-E372 IonicContact NH2-OE1 3.53Å; R334-E372 PolarHBondContact NH2-OE1 3Å; E372-F374 HydrophobicContact CB-CD2 4.37Å; E372-F374 HydrophobicContact CB-CE2 3.53Å; E372-F374 HydrophobicContact CB-CZ 4.05Å; E372-K386 HydrophobicContact CG-CB 4.15Å
373	L	94.9	Very high	86.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142.4	179.3	-70.7	81.1	0	0	0	110.6	A309 L312 Y330 V331 W353 I371 L384 G385 L406 I414	A309-L373 HydrophobicContact CB-CD2 4.41Å; L312-L373 HydrophobicContact CD1-CD2 4.41Å; L312-L373 HydrophobicContact CD2-CD2 3.96Å; Y330-L373 WeakPolarHBondContact O-CA 3.26Å; V331-L373 HydrophobicContact CG1-CD1 4.27Å; V331-L373 HydrophobicContact CG1-CG 4.25Å; V331-L373 HydrophobicContact CG2-CD2 4.41Å; V331-L373 HydrophobicContact CG2-CG 4.17Å; W353-L373 HydrophobicContact CH2-CD2 4.11Å; I371-L373 HydrophobicContact CG2-CD1 3.88Å; L373-L384 HydrophobicContact CB-CB 3.93Å; L373-L384 PolarHBondContact O-N 3.46Å; L373-G385 PolarHBondContact N-O 2.8Å; L373-L406 HydrophobicContact CD1-CD1 3.95Å; L373-L406 HydrophobicContact CD1-CD2 3.66Å; L373-L406 HydrophobicContact CD1-CG 4.49Å; L373-L406 HydrophobicContact CD2-CD1 3.9Å; L373-L406 HydrophobicContact CG-CD1 4.43Å; L373-I414 HydrophobicContact CD1-CD1 4.2Å; L373-I414 HydrophobicContact CD2-CD1 4.46Å
374	F	94.1	Very high	86.5	Confident	37 Å²	37	50.5 Å²	50.5	16%	0.162	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	151	-176.2	-64.1	-87.5	0	0	0	111.4	P329 Y330 T332 E372 D381 D382 F383 L384	P329-F374 CarbonylContact C-O 3.38Å; P329-F374 WeakPolarHBondContact CA-O 3.41Å; Y330-F374 HydrophobicContact CD1-CB 4.19Å; Y330-F374 WeakPolarHBondContact CD1-O 2.89Å; Y330-F374 HydrophobicContact CE1-CB 3.5Å; Y330-F374 HydrophobicContact CE2-CB 4.03Å; Y330-F374 AromaticContact CE2-CD2 3.97Å; Y330-F374 HydrophobicContact CE2-CD2 3.97Å; Y330-F374 HydrophobicContact CE2-CG 4.39Å; Y330-F374 AromaticContact CZ-CD2 3.97Å; Y330-F374 AromaticContact CZ-CG 3.95Å; Y330-F374 PolarHBondContact N-O 3.38Å; Y330-F374 PolarHBondContact O-N 2.91Å; Y330-F374 WeakPolarHBondContact OH-CB 3.45Å; T332-F374 HydrophobicContact CG2-CD2 4.18Å; T332-F374 HydrophobicContact CG2-CE2 4.16Å; E372-F374 HydrophobicContact CB-CD2 4.37Å; E372-F374 HydrophobicContact CB-CE2 3.53Å; E372-F374 HydrophobicContact CB-CZ 4.05Å; F374-D381 HydrophobicContact CB-CB 4.31Å; F374-D382 CarbonylContact C-O 3.58Å; F374-D382 VanDerWaalsContact CA-O 3.31Å; F374-D382 WeakPolarHBondContact CA-O 3.34Å; F374-F383 HydrophobicContact CD1-CB 4.49Å; F374-F383 HydrophobicContact CD1-CD2 4.39Å; F374-F383 HydrophobicContact CE1-CB 4.44Å; F374-F383 AromaticContact CE1-CD2 3.94Å; F374-F383 HydrophobicContact CE1-CD2 3.94Å; F374-F383 HydrophobicContact CZ-CD2 4.27Å; F374-L384 VanDerWaalsContact C-CD1 3.46Å
375	D	90.9	Very high	86.9	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	129	167.9	-144.5	-20	0	0	0	108.2	K315 S327 D328 D377 D381 D382 L384	K315-D375 WeakPolarHBondContact CB-OD2 3.49Å; S327-D375 WeakPolarHBondContact CA-OD1 3.48Å; S327-D375 WeakPolarHBondContact CA-OD2 3.3Å; S327-D375 VanDerWaalsContact CB-OD1 3.27Å; S327-D375 WeakPolarHBondContact CB-OD1 3.5Å; S327-D375 WeakPolarHBondContact CB-OD2 3.39Å; S327-D375 PolarHBondContact OG-OD2 3.25Å; D328-D375 PolarHBondContact N-OD1 2.84Å; D375-D377 PolarHBondContact O-N 2.82Å; D375-D381 CarbonylContact O-C 3.59Å; D375-D381 WeakPolarHBondContact O-CA 3.23Å; D375-D381 WeakPolarHBondContact O-CB 3.31Å; D375-D382 HydrophobicContact CB-CB 4.17Å; D375-D382 PolarHBondContact N-O 3.46Å; D375-D382 PolarHBondContact O-N 2.86Å; D375-D382 VanDerWaalsContact O-N 3.17Å; D375-L384 HydrophobicContact CB-CD1 4.15Å; D375-L384 HydrophobicContact CB-CD2 4.22Å; D375-L384 HydrophobicContact CB-CG 4.22Å
376	E	88.9	Confident	87.7	Confident	75 Å²	75	53.1 Å²	53.1	35%	0.35	25%	0.245	S	C	.	.			trans	-85	100.5	-179.8	-173.8	163.3	-108.7	0	0	111.7	D328 Y330 K341 T344	D328-E376 PolarHBondContact O-N 3.25Å; Y330-E376 HydrophobicContact CD1-CB 3.95Å; Y330-E376 HydrophobicContact CE1-CB 4.12Å; K341-E376 WeakPolarHBondContact CE-OE1 3.43Å; K341-E376 IonicContact NZ-OE1 2.71Å; K341-E376 PolarHBondContact NZ-OE1 2.9Å; T344-E376 VanDerWaalsContact CB-OE2 3.27Å; T344-E376 WeakPolarHBondContact CB-OE2 3.3Å; T344-E376 HydrophobicContact CG2-CB 3.53Å; T344-E376 HydrophobicContact CG2-CG 4.32Å; T344-E376 WeakPolarHBondContact CG2-OE2 3.4Å; T344-E376 PolarHBondContact OG1-OE1 2.88Å; T344-E376 PolarHBondContact OG1-OE2 3.49Å
377	D	81.8	Confident	88.5	Confident	65 Å²	65	55.1 Å²	55.1	35%	0.348	25%	0.25	S	S	.	.			trans	-103.6	171.2	-169	-125.4	-47.4	0	0	0	113	D375 D381	D375-D377 PolarHBondContact O-N 2.82Å; D377-D381 PolarHBondContact N-OD1 2.53Å
378	R	70.4	Confident	88.8	Confident	253 Å²	253	56.7 Å²	56.7	96%	0.955	26%	0.259	S	S	*	.	S	Bend	trans	-82	-16	-178.6	-71.6	-171.4	-177.5	176.1	4.4	114.9
379	D	75.2	Confident	88.9	Confident	148 Å²	148	55.8 Å²	55.8	79%	0.791	26%	0.255	S	S	*	.	S	Bend	trans	-130.2	-47.3	-177.8	64.2	-19.7	0	0	0	113.4
380	K	78.6	Confident	88.7	Confident	163 Å²	163	57.7 Å²	57.7	71%	0.709	27%	0.265	S	S	*	.	S	Bend	trans	-152.9	110.9	172.4	-171.4	-148.2	166.2	-164.3	0	113	D382	K380-D382 PolarHBondContact O-N 3.12Å
381	D	86.1	Confident	88.7	Confident	45 Å²	45	56 Å²	56	24%	0.241	26%	0.257	C	S	.	.			trans	-42.6	122.9	175	-59	17.9	0	0	0	112.8	Y330 K341 F374 D375 D377	Y330-D381 HydrophobicContact CE1-CB 4.32Å; Y330-D381 VanDerWaalsContact CE1-OD2 3.23Å; Y330-D381 WeakPolarHBondContact CE1-OD2 3.02Å; Y330-D381 PolarHBondContact OH-OD2 3.21Å; K341-D381 IonicContact NZ-OD2 2.6Å; F374-D381 HydrophobicContact CB-CB 4.31Å; D375-D381 CarbonylContact O-C 3.59Å; D375-D381 WeakPolarHBondContact O-CA 3.23Å; D375-D381 WeakPolarHBondContact O-CB 3.31Å; D377-D381 PolarHBondContact N-OD1 2.53Å
382	D	87.8	Confident	88.3	Confident	58 Å²	58	56 Å²	56	31%	0.31	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.6	-168.2	-161.4	9.1	0	0	0	111.8	K315 F374 D375 K380 L384	K315-D382 HydrophobicContact CB-CB 4.39Å; K315-D382 WeakPolarHBondContact CB-OD2 3.49Å; K315-D382 VanDerWaalsContact CD-OD2 3.24Å; K315-D382 WeakPolarHBondContact CD-OD2 3.43Å; K315-D382 HydrophobicContact CG-CB 4.34Å; K315-D382 VanDerWaalsContact CG-OD2 3.26Å; K315-D382 WeakPolarHBondContact CG-OD2 3.47Å; K315-D382 IonicContact NZ-OD1 2.78Å; K315-D382 PolarHBondContact NZ-OD1 2.73Å; K315-D382 IonicContact NZ-OD2 2.74Å; K315-D382 PolarHBondContact NZ-OD2 2.94Å; F374-D382 CarbonylContact C-O 3.58Å; F374-D382 VanDerWaalsContact CA-O 3.31Å; F374-D382 WeakPolarHBondContact CA-O 3.34Å; D375-D382 HydrophobicContact CB-CB 4.17Å; D375-D382 PolarHBondContact N-O 3.46Å; D375-D382 PolarHBondContact O-N 2.86Å; D375-D382 VanDerWaalsContact O-N 3.17Å; K380-D382 PolarHBondContact O-N 3.12Å; D382-L384 PolarHBondContact O-N 3.36Å
383	F	91.4	Very high	87.9	Confident	63 Å²	63	57.3 Å²	57.3	28%	0.276	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.9	-167.6	179.4	-106.1	0	0	0	112.3	K315 F374 G385 K386 V409	K315-F383 WeakPolarHBondContact CE-O 3.27Å; K315-F383 PolarHBondContact NZ-O 3.16Å; F374-F383 HydrophobicContact CD1-CB 4.49Å; F374-F383 HydrophobicContact CD1-CD2 4.39Å; F374-F383 HydrophobicContact CE1-CB 4.44Å; F374-F383 AromaticContact CE1-CD2 3.94Å; F374-F383 HydrophobicContact CE1-CD2 3.94Å; F374-F383 HydrophobicContact CZ-CD2 4.27Å; F383-G385 WeakPolarHBondContact CE2-O 3.47Å; F383-G385 VanDerWaalsContact CZ-CA 3.41Å; F383-K386 HydrophobicContact CE2-CB 4.06Å; F383-K386 HydrophobicContact CZ-CB 3.83Å; F383-K386 HydrophobicContact CZ-CD 4.35Å; F383-K386 HydrophobicContact CZ-CG 3.97Å; F383-V409 HydrophobicContact CD1-CG1 4.44Å; F383-V409 HydrophobicContact CE1-CG1 4.39Å
384	L	91	Very high	87.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-1.1	-176.6	-59.8	-176.6	0	0	0	114.3	V313 K315 P329 L373 F374 D375 D382 V409	V313-L384 VanDerWaalsContact O-CD2 3.23Å; V313-L384 WeakPolarHBondContact O-CD2 3.19Å; K315-L384 HydrophobicContact CG-CD2 3.63Å; P329-L384 HydrophobicContact CB-CD1 3.75Å; L373-L384 HydrophobicContact CB-CB 3.93Å; L373-L384 PolarHBondContact O-N 3.46Å; F374-L384 VanDerWaalsContact C-CD1 3.46Å; D375-L384 HydrophobicContact CB-CD1 4.15Å; D375-L384 HydrophobicContact CB-CD2 4.22Å; D375-L384 HydrophobicContact CB-CG 4.22Å; D382-L384 PolarHBondContact O-N 3.36Å; L384-V409 WeakPolarHBondContact O-CG1 3.47Å
385	G	92.4	Very high	87.5	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.7	167.3	177	0	0	0	0	0	113.1	L373 F383 E407	L373-G385 PolarHBondContact N-O 2.8Å; F383-G385 WeakPolarHBondContact CE2-O 3.47Å; F383-G385 VanDerWaalsContact CZ-CA 3.41Å; G385-E407 WeakPolarHBondContact CA-O 3.35Å
386	K	94.5	Very high	87.3	Confident	78 Å²	78	63.1 Å²	63.1	34%	0.339	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	164.3	178.8	68.5	177.1	-174.1	164.5	0	112.7	I371 E372 F383 L406 E407	I371-K386 CarbonylContact O-C 3.46Å; I371-K386 WeakPolarHBondContact O-CA 3.41Å; I371-K386 VanDerWaalsContact O-CB 3.26Å; I371-K386 WeakPolarHBondContact O-CB 3.45Å; E372-K386 HydrophobicContact CG-CB 4.15Å; F383-K386 HydrophobicContact CE2-CB 4.06Å; F383-K386 HydrophobicContact CZ-CB 3.83Å; F383-K386 HydrophobicContact CZ-CD 4.35Å; F383-K386 HydrophobicContact CZ-CG 3.97Å; K386-L406 CarbonylContact O-C 3.55Å; K386-L406 WeakPolarHBondContact O-CA 3.22Å; K386-E407 WeakPolarHBondContact CE-OE2 3.25Å; K386-E407 HydrophobicContact CG-CB 4.01Å; K386-E407 PolarHBondContact N-O 3.02Å; K386-E407 IonicContact NZ-OE2 2.64Å; K386-E407 PolarHBondContact O-N 2.79Å
387	Y	93.7	Very high	87.2	Confident	51 Å²	51	62.2 Å²	62.2	20%	0.2	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	142.5	169.4	-172.5	-105.9	0	0	0	110.7	I371 L389 F404 H405	I371-Y387 WeakPolarHBondContact CA-O 3.41Å; I371-Y387 WeakPolarHBondContact CB-O 3.44Å; I371-Y387 HydrophobicContact CD1-CD1 4.03Å; I371-Y387 PolarHBondContact N-O 3.34Å; I371-Y387 PolarHBondContact O-N 3.34Å; Y387-L389 HydrophobicContact CD1-CB 4.36Å; Y387-L389 HydrophobicContact CE1-CB 3.9Å; Y387-L389 HydrophobicContact CE1-CD1 4.24Å; Y387-F404 HydrophobicContact CD1-CB 3.93Å; Y387-F404 HydrophobicContact CD1-CD1 4.08Å; Y387-F404 HydrophobicContact CD1-CG 4.12Å; Y387-F404 HydrophobicContact CD2-CB 4.33Å; Y387-F404 HydrophobicContact CE1-CB 3.97Å; Y387-F404 AromaticContact CE1-CD1 3.29Å; Y387-F404 HydrophobicContact CE1-CD1 3.29Å; Y387-F404 AromaticContact CE1-CE1 3.94Å; Y387-F404 HydrophobicContact CE1-CE1 3.94Å; Y387-F404 AromaticContact CE1-CG 3.79Å; Y387-F404 HydrophobicContact CE1-CG 3.79Å; Y387-F404 HydrophobicContact CE2-CB 4.39Å; Y387-F404 HydrophobicContact CE2-CD1 4.34Å; Y387-F404 HydrophobicContact CG-CB 4.11Å; Y387-F404 AromaticContact CZ-CD1 3.47Å; Y387-F404 VanDerWaalsContact CZ-CD1 3.47Å; Y387-F404 WeakPolarHBondContact OH-CD1 3.44Å; Y387-H405 WeakPolarHBondContact CD2-O 3.28Å
388	N	90.9	Very high	87.6	Confident	49 Å²	49	61 Å²	61	26%	0.262	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.3	177.2	-77.6	28.4	0	0	0	109.8	L369	L369-N388 WeakPolarHBondContact O-CA 3.32Å
389	L	90.1	Very high	88.6	Confident	2 Å²	2	53 Å²	53	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.1	-177.8	-177.4	64.2	0	0	0	111.3	E368 L369 Y387 E393 V394 F404 L418	E368-L389 CarbonylContact C-O 3.58Å; E368-L389 VanDerWaalsContact CA-O 3.27Å; E368-L389 WeakPolarHBondContact CA-O 3.02Å; L369-L389 PolarHBondContact N-O 3.1Å; L369-L389 PolarHBondContact O-N 3.49Å; Y387-L389 HydrophobicContact CD1-CB 4.36Å; Y387-L389 HydrophobicContact CE1-CB 3.9Å; Y387-L389 HydrophobicContact CE1-CD1 4.24Å; L389-E393 HydrophobicContact CD1-CB 4.48Å; L389-V394 HydrophobicContact CD2-CG2 3.93Å; L389-V394 HydrophobicContact CG-CG2 4.35Å; L389-F404 HydrophobicContact CD1-CE1 4.37Å; L389-F404 HydrophobicContact CD2-CZ 4.48Å; L389-L418 HydrophobicContact CD2-CD1 3.94Å; L389-L418 HydrophobicContact CD2-CD2 3.51Å; L389-L418 HydrophobicContact CD2-CG 4.38Å
390	D	89	Confident	89.4	Confident	39 Å²	39	46.2 Å²	46.2	21%	0.209	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	126.6	173.5	-174.4	-13	0	0	0	110.2	G366 E368 G392 E393	G366-D390 VanDerWaalsContact N-CG 3.25Å; G366-D390 PolarHBondContact N-OD1 3.35Å; G366-D390 PolarHBondContact N-OD2 3.34Å; E368-D390 HydrophobicContact CG-CB 4.24Å; D390-G392 PolarHBondContact O-N 2.9Å; D390-G392 VanDerWaalsContact O-N 3.09Å; D390-G392 PolarHBondContact OD1-N 2.89Å; D390-E393 WeakPolarHBondContact O-CB 3.13Å; D390-E393 PolarHBondContact O-N 3.06Å
391	F	90	Very high	90.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-12.4	174.4	-67.9	-51.2	0	0	0	113.7	V302 V335 F359 V361 A364 Q367 L369 E393 V394 K395 W420	V302-F391 HydrophobicContact CB-CD1 3.99Å; V302-F391 HydrophobicContact CB-CE1 3.78Å; V302-F391 HydrophobicContact CG1-CD1 4.02Å; V302-F391 HydrophobicContact CG1-CE1 3.71Å; V302-F391 HydrophobicContact CG2-CD1 3.69Å; V302-F391 HydrophobicContact CG2-CE1 4.03Å; V302-F391 HydrophobicContact CG2-CG 4.29Å; V335-F391 HydrophobicContact CG1-CE2 3.85Å; V335-F391 HydrophobicContact CG1-CZ 4.48Å; V335-F391 HydrophobicContact CG2-CE2 3.88Å; V335-F391 HydrophobicContact CG2-CZ 3.73Å; F359-F391 HydrophobicContact CB-CZ 4.42Å; V361-F391 HydrophobicContact CB-CD2 4.42Å; V361-F391 HydrophobicContact CG1-CB 3.99Å; V361-F391 HydrophobicContact CG1-CD2 3.94Å; V361-F391 HydrophobicContact CG1-CG 4.23Å; V361-F391 HydrophobicContact CG2-CB 4.37Å; V361-F391 HydrophobicContact CG2-CD1 4.33Å; V361-F391 HydrophobicContact CG2-CD2 3.59Å; V361-F391 HydrophobicContact CG2-CE2 3.84Å; V361-F391 HydrophobicContact CG2-CG 3.86Å; V361-F391 HydrophobicContact CG2-CZ 4.28Å; A364-F391 HydrophobicContact CB-CB 4.11Å; Q367-F391 HydrophobicContact CB-CD2 4.19Å; Q367-F391 HydrophobicContact CG-CD2 4.16Å; Q367-F391 HydrophobicContact CG-CE2 4.42Å; Q367-F391 WeakPolarHBondContact O-CB 3.45Å; Q367-F391 WeakPolarHBondContact O-CD2 3.46Å; Q367-F391 WeakPolarHBondContact O-CG 3.3Å; Q367-F391 PolarHBondContact O-N 2.86Å; L369-F391 HydrophobicContact CB-CE1 3.78Å; L369-F391 HydrophobicContact CB-CE2 4.41Å; L369-F391 HydrophobicContact CB-CZ 3.65Å; L369-F391 HydrophobicContact CD1-CZ 4.43Å; L369-F391 HydrophobicContact CD2-CE1 4.49Å; L369-F391 HydrophobicContact CG-CZ 4.49Å; F391-E393 VanDerWaalsContact C-N 3.31Å; F391-V394 HydrophobicContact CD1-CG2 4.18Å; F391-V394 PolarHBondContact O-N 3.06Å; F391-K395 WeakPolarHBondContact O-CB 3.16Å; F391-K395 PolarHBondContact O-N 2.87Å; F391-W420 HydrophobicContact CB-CZ3 4.43Å
392	G	87.4	Confident	90.6	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-38.8	166.1	0	0	0	0	0	113.3	D390 K395 R396	D390-G392 PolarHBondContact O-N 2.9Å; D390-G392 VanDerWaalsContact O-N 3.09Å; D390-G392 PolarHBondContact OD1-N 2.89Å; G392-K395 PolarHBondContact O-N 3.29Å; G392-R396 WeakPolarHBondContact O-CB 3.33Å; G392-R396 PolarHBondContact O-N 2.77Å
393	E	87.8	Confident	91	Very high	71 Å²	71	46.2 Å²	46.2	33%	0.332	21%	0.208	S	C	.	.	H	α-helix	trans	-67.5	-45.5	176.4	-58.4	-176.7	-163.6	0	0	110.4	L389 D390 F391 K395 R396 E397	L389-E393 HydrophobicContact CD1-CB 4.48Å; D390-E393 WeakPolarHBondContact O-CB 3.13Å; D390-E393 PolarHBondContact O-N 3.06Å; F391-E393 VanDerWaalsContact C-N 3.31Å; E393-K395 PolarHBondContact O-N 3.26Å; E393-R396 PolarHBondContact O-N 2.84Å; E393-E397 PolarHBondContact O-N 3.23Å
394	V	90.8	Very high	91.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.1	-40	175.6	-165.8	0	0	0	0	111.8	V302 L389 F391 R396 K398 M400 L418 W420	V302-V394 HydrophobicContact CG1-CG1 4.09Å; V302-V394 HydrophobicContact CG2-CG1 4.14Å; L389-V394 HydrophobicContact CD2-CG2 3.93Å; L389-V394 HydrophobicContact CG-CG2 4.35Å; F391-V394 HydrophobicContact CD1-CG2 4.18Å; F391-V394 PolarHBondContact O-N 3.06Å; V394-R396 VanDerWaalsContact C-N 3.29Å; V394-R396 PolarHBondContact O-N 2.99Å; V394-K398 VanDerWaalsContact O-CA 3.27Å; V394-K398 WeakPolarHBondContact O-CA 3.39Å; V394-K398 PolarHBondContact O-N 2.91Å; V394-M400 HydrophobicContact CB-SD 4.38Å; V394-M400 HydrophobicContact CG2-SD 3.87Å; V394-L418 HydrophobicContact CG1-CB 3.95Å; V394-L418 HydrophobicContact CG2-CB 4.4Å; V394-L418 HydrophobicContact CG2-CD2 4.05Å; V394-W420 HydrophobicContact CG1-CB 4.33Å
395	K	88.4	Confident	91.3	Very high	51 Å²	51	49.2 Å²	49.2	22%	0.222	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-34.3	175.4	176	-169	168.9	-158.2	0	112.2	E174 A364 F391 G392 E393 K398 W420	E174-K395 PolarHBondContact O-NZ 3.49Å; A364-K395 HydrophobicContact CB-CB 4.28Å; A364-K395 HydrophobicContact CB-CD 3.82Å; A364-K395 WeakPolarHBondContact O-CD 3.13Å; A364-K395 PolarHBondContact O-NZ 3.07Å; F391-K395 WeakPolarHBondContact O-CB 3.16Å; F391-K395 PolarHBondContact O-N 2.87Å; G392-K395 PolarHBondContact O-N 3.29Å; E393-K395 PolarHBondContact O-N 3.26Å; K395-K398 WeakPolarHBondContact O-CD 3.09Å; K395-K398 WeakPolarHBondContact O-CE 2.9Å; K395-K398 PolarHBondContact O-NZ 3.01Å; K395-K398 VanDerWaalsContact O-NZ 3.08Å; K395-W420 HydrophobicContact CB-CD2 4.01Å; K395-W420 HydrophobicContact CB-CE3 3.74Å; K395-W420 HydrophobicContact CB-CH2 4.15Å; K395-W420 HydrophobicContact CB-CZ2 4.38Å; K395-W420 HydrophobicContact CB-CZ3 3.82Å; K395-W420 HydrophobicContact CD-CH2 4.48Å; K395-W420 HydrophobicContact CG-CD2 4.39Å; K395-W420 HydrophobicContact CG-CE3 4.47Å; K395-W420 HydrophobicContact CG-CH2 4.23Å; K395-W420 HydrophobicContact CG-CZ2 4.11Å; K395-W420 HydrophobicContact CG-CZ3 4.41Å
396	R	86.6	Confident	91.4	Very high	112 Å²	112	49.2 Å²	49.2	42%	0.423	22%	0.222	S	C	.	.	H	α-helix	trans	-79.4	-50.6	179.5	-176.8	-179.1	65	-114.8	-3.6	111.8	G392 E393 V394	G392-R396 WeakPolarHBondContact O-CB 3.33Å; G392-R396 PolarHBondContact O-N 2.77Å; E393-R396 PolarHBondContact O-N 2.84Å; V394-R396 VanDerWaalsContact C-N 3.29Å; V394-R396 PolarHBondContact O-N 2.99Å
397	E	86.9	Confident	91.3	Very high	56 Å²	56	50.6 Å²	50.6	26%	0.262	23%	0.23	S	C	.	.	H	α-helix	trans	-78.9	-18.6	-177.4	-66.1	-166.7	-157.5	0	0	113.8	E393 E399 M400	E393-E397 PolarHBondContact O-N 3.23Å; E397-E399 PolarHBondContact O-N 3.13Å; E397-M400 HydrophobicContact CB-CG 3.97Å
398	K	89.6	Confident	90.9	Very high	40 Å²	40	51.5 Å²	51.5	17%	0.174	25%	0.254	C	S	.	.	S	Bend	trans	66.2	-42.1	-176.6	-50.5	-61.2	178.1	175	0	115.2	V394 K395 W420 E581 P583	V394-K398 VanDerWaalsContact O-CA 3.27Å; V394-K398 WeakPolarHBondContact O-CA 3.39Å; V394-K398 PolarHBondContact O-N 2.91Å; K395-K398 WeakPolarHBondContact O-CD 3.09Å; K395-K398 WeakPolarHBondContact O-CE 2.9Å; K395-K398 PolarHBondContact O-NZ 3.01Å; K395-K398 VanDerWaalsContact O-NZ 3.08Å; K398-W420 PolarHBondContact O-N 3.28Å; K398-E581 WeakPolarHBondContact CB-O 2.95Å; K398-E581 HydrophobicContact CD-CB 4.04Å; K398-E581 WeakPolarHBondContact CE-OE2 3.44Å; K398-E581 HydrophobicContact CG-CB 4.42Å; K398-E581 IonicContact NZ-OE2 3.59Å; K398-E581 PolarHBondContact NZ-OE2 3.16Å; K398-P583 HydrophobicContact CB-CB 4.49Å; K398-P583 HydrophobicContact CG-CB 4.48Å
399	E	92.4	Very high	90.8	Very high	86 Å²	86	50.5 Å²	50.5	40%	0.402	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	128.3	174.8	-175.8	172.5	-163.6	0	0	109.5	E397 K417 L418 Q419	E397-E399 PolarHBondContact O-N 3.13Å; E399-K417 WeakPolarHBondContact OE1-CE 3.44Å; E399-K417 IonicContact OE1-NZ 2.81Å; E399-K417 PolarHBondContact OE1-NZ 3.32Å; E399-L418 WeakPolarHBondContact CA-O 3.37Å; E399-Q419 HydrophobicContact CG-CG 4.34Å
400	M	92.6	Very high	90.5	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.025	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.2	174.7	-57.2	176.2	82.2	0	0	108	V394 E397 F404 K417 L418	V394-M400 HydrophobicContact CB-SD 4.38Å; V394-M400 HydrophobicContact CG2-SD 3.87Å; E397-M400 HydrophobicContact CB-CG 3.97Å; M400-F404 HydrophobicContact CE-CE1 4.48Å; M400-F404 HydrophobicContact CE-CZ 4.33Å; M400-K417 CarbonylContact O-C 3.6Å; M400-K417 VanDerWaalsContact O-CA 3.25Å; M400-K417 WeakPolarHBondContact O-CA 3.42Å; M400-L418 HydrophobicContact CB-CB 4.44Å; M400-L418 HydrophobicContact CB-CD1 4.28Å; M400-L418 PolarHBondContact N-O 3.33Å; M400-L418 PolarHBondContact O-N 2.86Å
401	D	95.5	Very high	90.5	Very high	78 Å²	78	58.7 Å²	58.7	42%	0.417	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	85	178.3	-159.6	-33.5	0	0	0	107.2	H415 K417	D401-H415 IonicContact OD1-CD2 2.68Å; D401-H415 IonicContact OD1-CE1 2.76Å; D401-H415 IonicContact OD1-NE2 3.31Å; D401-H415 PolarHBondContact OD1-NE2 2.77Å; D401-K417 HydrophobicContact CB-CB 4.49Å; D401-K417 HydrophobicContact CB-CG 4.29Å; D401-K417 WeakPolarHBondContact OD2-CD 3.39Å; D401-K417 IonicContact OD2-NZ 2.72Å; D401-K417 PolarHBondContact OD2-NZ 3.21Å
402	Q	94.3	Very high	90.6	Very high	85 Å²	85	58.8 Å²	58.8	40%	0.397	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157	-160.3	-58.3	-169.3	39.7	0	0	112.4	F404 H415 L416	Q402-F404 HydrophobicContact CB-CE2 3.95Å; Q402-F404 HydrophobicContact CB-CZ 3.94Å; Q402-F404 WeakPolarHBondContact O-CD2 3.36Å; Q402-F404 WeakPolarHBondContact O-CE2 3.46Å; Q402-H415 PolarHBondContact O-CD2 2.78Å; Q402-L416 PolarHBondContact N-O 2.94Å; Q402-L416 VanDerWaalsContact N-O 3.15Å; Q402-L416 PolarHBondContact O-N 2.83Å; Q402-L416 VanDerWaalsContact O-N 3.12Å
403	W	95.8	Very high	91	Very high	103 Å²	103	60.1 Å²	60.1	39%	0.39	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.4	170.1	-73.5	85.6	0	0	0	109.9	E308 K310 D413 I414 H415	E308-W403 HydrophobicContact CG-CH2 3.86Å; E308-W403 HydrophobicContact CG-CZ2 4.17Å; K310-W403 HydrophobicContact CB-CH2 4.13Å; K310-W403 HydrophobicContact CB-CZ3 4.06Å; K310-W403 HydrophobicContact CD-CE3 4.07Å; K310-W403 HydrophobicContact CD-CH2 3.81Å; K310-W403 HydrophobicContact CD-CZ2 4.35Å; K310-W403 HydrophobicContact CD-CZ3 3.67Å; K310-W403 HydrophobicContact CG-CE3 4.16Å; K310-W403 HydrophobicContact CG-CH2 3.92Å; K310-W403 HydrophobicContact CG-CZ3 3.5Å; K310-W403 VanDerWaalsContact CG-CZ3 3.5Å; W403-D413 HydrophobicContact CE3-CB 3.68Å; W403-D413 HydrophobicContact CZ3-CB 4.3Å; W403-I414 WeakPolarHBondContact CA-O 3.41Å; W403-H415 HydrophobicContact CD2-CB 3.74Å; W403-H415 AromaticContact CE2-CG 3.87Å; W403-H415 HydrophobicContact CE3-CB 3.8Å; W403-H415 HydrophobicContact CG-CB 4.41Å; W403-H415 HydrophobicContact CH2-CB 3.86Å; W403-H415 HydrophobicContact CZ2-CB 3.76Å; W403-H415 HydrophobicContact CZ3-CB 3.86Å; W403-H415 AromaticContact NE1-CG 3.92Å; W403-H415 AromaticContact NE1-ND1 4Å
404	F	94.4	Very high	91.4	Very high	11 Å²	11	56.8 Å²	56.8	5%	0.048	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.7	-179.8	-60.4	-85.6	0	0	0	109.4	Y387 L389 M400 Q402 D413 I414 L416 L418	Y387-F404 HydrophobicContact CD1-CB 3.93Å; Y387-F404 HydrophobicContact CD1-CD1 4.08Å; Y387-F404 HydrophobicContact CD1-CG 4.12Å; Y387-F404 HydrophobicContact CD2-CB 4.33Å; Y387-F404 HydrophobicContact CE1-CB 3.97Å; Y387-F404 AromaticContact CE1-CD1 3.29Å; Y387-F404 HydrophobicContact CE1-CD1 3.29Å; Y387-F404 AromaticContact CE1-CE1 3.94Å; Y387-F404 HydrophobicContact CE1-CE1 3.94Å; Y387-F404 AromaticContact CE1-CG 3.79Å; Y387-F404 HydrophobicContact CE1-CG 3.79Å; Y387-F404 HydrophobicContact CE2-CB 4.39Å; Y387-F404 HydrophobicContact CE2-CD1 4.34Å; Y387-F404 HydrophobicContact CG-CB 4.11Å; Y387-F404 AromaticContact CZ-CD1 3.47Å; Y387-F404 VanDerWaalsContact CZ-CD1 3.47Å; Y387-F404 WeakPolarHBondContact OH-CD1 3.44Å; L389-F404 HydrophobicContact CD1-CE1 4.37Å; L389-F404 HydrophobicContact CD2-CZ 4.48Å; M400-F404 HydrophobicContact CE-CE1 4.48Å; M400-F404 HydrophobicContact CE-CZ 4.33Å; Q402-F404 HydrophobicContact CB-CE2 3.95Å; Q402-F404 HydrophobicContact CB-CZ 3.94Å; Q402-F404 WeakPolarHBondContact O-CD2 3.36Å; Q402-F404 WeakPolarHBondContact O-CE2 3.46Å; F404-D413 CarbonylContact O-C 3.59Å; F404-D413 WeakPolarHBondContact O-CA 3.45Å; F404-I414 HydrophobicContact CB-CG2 4.13Å; F404-I414 PolarHBondContact N-O 3.45Å; F404-I414 PolarHBondContact O-N 3.3Å; F404-L416 HydrophobicContact CD2-CB 3.99Å; F404-L416 HydrophobicContact CD2-CD1 4.24Å; F404-L416 HydrophobicContact CD2-CG 4.24Å; F404-L416 HydrophobicContact CE2-CB 3.86Å; F404-L418 HydrophobicContact CE2-CD1 4.01Å; F404-L418 HydrophobicContact CZ-CD1 4.11Å
405	H	94.5	Very high	91.7	Very high	114 Å²	114	58.3 Å²	58.3	53%	0.528	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138.6	179.7	-170.8	59.1	0	0	0	111	Y387 G412 D413	Y387-H405 WeakPolarHBondContact CD2-O 3.28Å; H405-G412 PolarHBondContact ND1-O 2.83Å; H405-D413 IonicContact CE1-OD1 3.26Å; H405-D413 IonicContact CG-OD1 2.91Å; H405-D413 IonicContact ND1-OD1 3.44Å; H405-D413 PolarHBondContact ND1-OD1 2.98Å
406	L	93.7	Very high	92.1	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-87.9	125.2	-174	-62	177.5	0	0	0	112.7	L312 L373 K386 V409 G412 I414	L312-L406 HydrophobicContact CD2-CD1 3.77Å; L373-L406 HydrophobicContact CD1-CD1 3.95Å; L373-L406 HydrophobicContact CD1-CD2 3.66Å; L373-L406 HydrophobicContact CD1-CG 4.49Å; L373-L406 HydrophobicContact CD2-CD1 3.9Å; L373-L406 HydrophobicContact CG-CD1 4.43Å; K386-L406 CarbonylContact O-C 3.55Å; K386-L406 WeakPolarHBondContact O-CA 3.22Å; L406-V409 HydrophobicContact CB-CG2 3.9Å; L406-G412 WeakPolarHBondContact CB-O 3.44Å; L406-G412 WeakPolarHBondContact CG-O 3.49Å; L406-G412 PolarHBondContact N-O 2.95Å; L406-I414 HydrophobicContact CD2-CB 4.31Å; L406-I414 HydrophobicContact CD2-CG2 3.77Å
407	E	92	Very high	92.5	Very high	107 Å²	107	52.5 Å²	52.5	50%	0.5	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-73.7	151.3	172.8	-62.1	-172.8	169.2	0	0	112.3	G385 K386 V409	G385-E407 WeakPolarHBondContact CA-O 3.35Å; K386-E407 WeakPolarHBondContact CE-OE2 3.25Å; K386-E407 HydrophobicContact CG-CB 4.01Å; K386-E407 PolarHBondContact N-O 3.02Å; K386-E407 IonicContact NZ-OE2 2.64Å; K386-E407 PolarHBondContact O-N 2.79Å; E407-V409 VanDerWaalsContact C-N 3.33Å
408	G	86.3	Confident	92.9	Very high	69 Å²	69	49.8 Å²	49.8	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	5.2	172.5	0	0	0	0	0	115.1
409	V	88.5	Confident	93.1	Very high	28 Å²	28	48.7 Å²	48.7	17%	0.17	26%	0.257	C	S	.	.	S	Bend	trans	-134.7	166.2	176.4	-73.7	0	0	0	0	111.4	V313 F383 L384 L406 E407 S411	V313-V409 HydrophobicContact CG2-CB 3.94Å; V313-V409 HydrophobicContact CG2-CG1 4.3Å; F383-V409 HydrophobicContact CD1-CG1 4.44Å; F383-V409 HydrophobicContact CE1-CG1 4.39Å; L384-V409 WeakPolarHBondContact O-CG1 3.47Å; L406-V409 HydrophobicContact CB-CG2 3.9Å; E407-V409 VanDerWaalsContact C-N 3.33Å; V409-S411 WeakPolarHBondContact CG2-O 3.26Å
410	N	84.3	Confident	93.2	Very high	166 Å²	166	44.9 Å²	44.9	89%	0.888	24%	0.239	S	C	*	.	S	Bend	trans	-84.4	-18.1	-178.3	-65.4	-10.9	0	0	0	113.7
411	S	87.9	Confident	93.2	Very high	47 Å²	47	44.8 Å²	44.8	33%	0.329	24%	0.238	S	C	.	.	S	Bend	trans	-159.8	153.1	177.1	67.6	0	0	0	0	110.5	D311 V313 V409	D311-S411 CarbonylContact O-C 2.97Å; D311-S411 VanDerWaalsContact O-CB 3.29Å; D311-S411 WeakPolarHBondContact O-CB 3.08Å; D311-S411 PolarHBondContact O-OG 2.86Å; V313-S411 WeakPolarHBondContact CG2-O 3.26Å; V409-S411 WeakPolarHBondContact CG2-O 3.26Å
412	G	92.3	Very high	93.1	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.021	22%	0.223	C	C	.	.			trans	138	127.1	175.8	0	0	0	0	0	111.5	K310 D311 H405 L406	K310-G412 WeakPolarHBondContact O-CA 3.41Å; D311-G412 PolarHBondContact O-N 2.8Å; H405-G412 PolarHBondContact ND1-O 2.83Å; L406-G412 WeakPolarHBondContact CB-O 3.44Å; L406-G412 WeakPolarHBondContact CG-O 3.49Å; L406-G412 PolarHBondContact N-O 2.95Å
413	D	95.5	Very high	92.9	Very high	31 Å²	31	39.2 Å²	39.2	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.8	169.8	-52.9	-26	0	0	0	109.3	A309 K310 W403 F404 H405	A309-D413 CarbonylContact C-O 3.6Å; A309-D413 VanDerWaalsContact CA-O 3.24Å; A309-D413 WeakPolarHBondContact CA-O 3.07Å; A309-D413 WeakPolarHBondContact CB-O 3.26Å; K310-D413 WeakPolarHBondContact CE-OD2 3.3Å; K310-D413 HydrophobicContact CG-CB 4.26Å; K310-D413 PolarHBondContact N-O 3.29Å; K310-D413 IonicContact NZ-OD2 3.63Å; K310-D413 PolarHBondContact NZ-OD2 2.98Å; K310-D413 PolarHBondContact O-N 2.8Å; K310-D413 VanDerWaalsContact O-N 3.15Å; W403-D413 HydrophobicContact CE3-CB 3.68Å; W403-D413 HydrophobicContact CZ3-CB 4.3Å; F404-D413 CarbonylContact O-C 3.59Å; F404-D413 WeakPolarHBondContact O-CA 3.45Å; H405-D413 IonicContact CE1-OD1 3.26Å; H405-D413 IonicContact CG-OD1 2.91Å; H405-D413 IonicContact ND1-OD1 3.44Å; H405-D413 PolarHBondContact ND1-OD1 2.98Å
414	I	96.2	Very high	92.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131	172.7	-170.4	170.5	0	0	0	110.9	V306 A309 V331 W353 I371 L373 W403 F404 L406 L416	V306-I414 HydrophobicContact CG1-CD1 4.37Å; A309-I414 HydrophobicContact CB-CB 4.44Å; A309-I414 HydrophobicContact CB-CG1 4.44Å; V331-I414 HydrophobicContact CG1-CD1 4.08Å; V331-I414 HydrophobicContact CG2-CD1 4.05Å; W353-I414 HydrophobicContact CZ3-CD1 4.46Å; I371-I414 HydrophobicContact CG2-CD1 4.16Å; L373-I414 HydrophobicContact CD1-CD1 4.2Å; L373-I414 HydrophobicContact CD2-CD1 4.46Å; W403-I414 WeakPolarHBondContact CA-O 3.41Å; F404-I414 HydrophobicContact CB-CG2 4.13Å; F404-I414 PolarHBondContact N-O 3.45Å; F404-I414 PolarHBondContact O-N 3.3Å; L406-I414 HydrophobicContact CD2-CB 4.31Å; L406-I414 HydrophobicContact CD2-CG2 3.77Å; I414-L416 HydrophobicContact CD1-CD2 3.83Å; I414-L416 HydrophobicContact CD1-CG 4.35Å; I414-L416 HydrophobicContact CG1-CD2 3.95Å; I414-L416 HydrophobicContact CG1-CG 4.15Å; I414-L416 HydrophobicContact CG2-CD1 4.4Å; I414-L416 HydrophobicContact CG2-CG 4.33Å
415	H	97.7	Very high	92.2	Very high	32 Å²	32	41.5 Å²	41.5	15%	0.148	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.1	173.3	-171.9	-170.9	0	0	0	109.4	L307 E308 D401 Q402 W403	L307-H415 HydrophobicContact CB-CB 4.45Å; L307-H415 PolarHBondContact N-O 3.49Å; E308-H415 HydrophobicContact CG-CB 3.85Å; E308-H415 PolarHBondContact O-N 2.95Å; D401-H415 IonicContact OD1-CD2 2.68Å; D401-H415 IonicContact OD1-CE1 2.76Å; D401-H415 IonicContact OD1-NE2 3.31Å; D401-H415 PolarHBondContact OD1-NE2 2.77Å; Q402-H415 PolarHBondContact O-CD2 2.78Å; W403-H415 HydrophobicContact CD2-CB 3.74Å; W403-H415 AromaticContact CE2-CG 3.87Å; W403-H415 HydrophobicContact CE3-CB 3.8Å; W403-H415 HydrophobicContact CG-CB 4.41Å; W403-H415 HydrophobicContact CH2-CB 3.86Å; W403-H415 HydrophobicContact CZ2-CB 3.76Å; W403-H415 HydrophobicContact CZ3-CB 3.86Å; W403-H415 AromaticContact NE1-CG 3.92Å; W403-H415 AromaticContact NE1-ND1 4Å
416	L	96.6	Very high	91.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.8	175.2	-59	177.1	0	0	0	109.9	V306 I371 Q402 F404 I414 L418	V306-L416 HydrophobicContact CB-CD2 4.26Å; V306-L416 HydrophobicContact CG1-CD2 4.27Å; V306-L416 HydrophobicContact CG2-CD2 4Å; I371-L416 HydrophobicContact CD1-CD1 3.6Å; I371-L416 HydrophobicContact CG1-CD1 4.21Å; Q402-L416 PolarHBondContact N-O 2.94Å; Q402-L416 VanDerWaalsContact N-O 3.15Å; Q402-L416 PolarHBondContact O-N 2.83Å; Q402-L416 VanDerWaalsContact O-N 3.12Å; F404-L416 HydrophobicContact CD2-CB 3.99Å; F404-L416 HydrophobicContact CD2-CD1 4.24Å; F404-L416 HydrophobicContact CD2-CG 4.24Å; F404-L416 HydrophobicContact CE2-CB 3.86Å; I414-L416 HydrophobicContact CD1-CD2 3.83Å; I414-L416 HydrophobicContact CD1-CG 4.35Å; I414-L416 HydrophobicContact CG1-CD2 3.95Å; I414-L416 HydrophobicContact CG1-CG 4.15Å; I414-L416 HydrophobicContact CG2-CD1 4.4Å; I414-L416 HydrophobicContact CG2-CG 4.33Å; L416-L418 HydrophobicContact CB-CD1 3.82Å
417	K	95.9	Very high	90.8	Very high	41 Å²	41	43.5 Å²	43.5	18%	0.178	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.7	164.8	175.7	-173.1	-166.7	65.2	0	108.7	H305 L307 E399 M400 D401	H305-K417 HydrophobicContact CB-CB 4.1Å; H305-K417 PolarHBondContact CD2-O 2.85Å; H305-K417 PolarHBondContact N-O 2.99Å; H305-K417 PolarHBondContact O-N 3.26Å; H305-K417 VanDerWaalsContact O-N 3.09Å; L307-K417 HydrophobicContact CD1-CB 3.94Å; E399-K417 WeakPolarHBondContact OE1-CE 3.44Å; E399-K417 IonicContact OE1-NZ 2.81Å; E399-K417 PolarHBondContact OE1-NZ 3.32Å; M400-K417 CarbonylContact O-C 3.6Å; M400-K417 VanDerWaalsContact O-CA 3.25Å; M400-K417 WeakPolarHBondContact O-CA 3.42Å; D401-K417 HydrophobicContact CB-CB 4.49Å; D401-K417 HydrophobicContact CB-CG 4.29Å; D401-K417 WeakPolarHBondContact OD2-CD 3.39Å; D401-K417 IonicContact OD2-NZ 2.72Å; D401-K417 PolarHBondContact OD2-NZ 3.21Å
418	L	95.2	Very high	90	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.6	-177.7	-57.8	100.4	0	0	0	110.3	V302 R303 V304 L369 L389 V394 E399 M400 F404 L416	V302-L418 HydrophobicContact CG1-CB 4.49Å; V302-L418 HydrophobicContact CG1-CD2 4.3Å; R303-L418 WeakPolarHBondContact O-CA 3.27Å; V304-L418 HydrophobicContact CG2-CD2 4.16Å; L369-L418 HydrophobicContact CD2-CD2 3.93Å; L389-L418 HydrophobicContact CD2-CD1 3.94Å; L389-L418 HydrophobicContact CD2-CD2 3.51Å; L389-L418 HydrophobicContact CD2-CG 4.38Å; V394-L418 HydrophobicContact CG1-CB 3.95Å; V394-L418 HydrophobicContact CG2-CB 4.4Å; V394-L418 HydrophobicContact CG2-CD2 4.05Å; E399-L418 WeakPolarHBondContact CA-O 3.37Å; M400-L418 HydrophobicContact CB-CB 4.44Å; M400-L418 HydrophobicContact CB-CD1 4.28Å; M400-L418 PolarHBondContact N-O 3.33Å; M400-L418 PolarHBondContact O-N 2.86Å; F404-L418 HydrophobicContact CE2-CD1 4.01Å; F404-L418 HydrophobicContact CZ-CD1 4.11Å; L416-L418 HydrophobicContact CB-CD1 3.82Å
419	Q	93.8	Very high	89.7	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.075	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.2	178.7	-57.8	174.9	-72.8	0	0	110.3	V302 R303 H305 E399 E580	V302-Q419 WeakPolarHBondContact CA-O 3.32Å; R303-Q419 HydrophobicContact CB-CB 4.43Å; R303-Q419 PolarHBondContact N-O 3.32Å; R303-Q419 PolarHBondContact O-N 2.79Å; H305-Q419 PolarHBondContact NE2-OE1 2.79Å; E399-Q419 HydrophobicContact CG-CG 4.34Å; Q419-E580 PolarHBondContact NE2-OE1 2.9Å; Q419-E580 PolarHBondContact NE2-OE2 3.18Å
420	W	94.4	Very high	89.2	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.027	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	117.2	171.9	-178	-86.2	0	0	0	110.8	R299 V302 V361 A364 F391 V394 K395 K398 S422	R299-W420 HydrophobicContact CB-CH2 4.18Å; R299-W420 HydrophobicContact CB-CZ2 4.25Å; R299-W420 WeakPolarHBondContact O-CZ2 3.32Å; V302-W420 HydrophobicContact CG2-CD2 4.46Å; V302-W420 HydrophobicContact CG2-CE3 3.5Å; V302-W420 HydrophobicContact CG2-CZ3 3.89Å; V361-W420 HydrophobicContact CB-CH2 4.23Å; V361-W420 HydrophobicContact CB-CZ3 4.17Å; V361-W420 HydrophobicContact CG1-CH2 4.05Å; V361-W420 HydrophobicContact CG1-CZ3 3.99Å; V361-W420 HydrophobicContact CG2-CZ3 4.38Å; A364-W420 HydrophobicContact CB-CH2 3.93Å; A364-W420 HydrophobicContact CB-CZ3 3.97Å; F391-W420 HydrophobicContact CB-CZ3 4.43Å; V394-W420 HydrophobicContact CG1-CB 4.33Å; K395-W420 HydrophobicContact CB-CD2 4.01Å; K395-W420 HydrophobicContact CB-CE3 3.74Å; K395-W420 HydrophobicContact CB-CH2 4.15Å; K395-W420 HydrophobicContact CB-CZ2 4.38Å; K395-W420 HydrophobicContact CB-CZ3 3.82Å; K395-W420 HydrophobicContact CD-CH2 4.48Å; K395-W420 HydrophobicContact CG-CD2 4.39Å; K395-W420 HydrophobicContact CG-CE3 4.47Å; K395-W420 HydrophobicContact CG-CH2 4.23Å; K395-W420 HydrophobicContact CG-CZ2 4.11Å; K395-W420 HydrophobicContact CG-CZ3 4.41Å; K398-W420 PolarHBondContact O-N 3.28Å; W420-S422 PolarHBondContact NE1-OG 3.28Å
421	L	93.3	Very high	88.6	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	107.1	177.1	-52.5	175.1	0	0	0	109.3	G300 V301 R303 L578 T579 E580	G300-L421 WeakPolarHBondContact CA-O 3.2Å; V301-L421 HydrophobicContact CB-CB 4.2Å; V301-L421 HydrophobicContact CB-CD1 4.44Å; V301-L421 HydrophobicContact CG1-CD1 4.16Å; V301-L421 PolarHBondContact N-O 2.99Å; V301-L421 WeakPolarHBondContact O-CA 3.31Å; V301-L421 VanDerWaalsContact O-CB 3.28Å; V301-L421 WeakPolarHBondContact O-CB 3.23Å; V301-L421 PolarHBondContact O-N 2.95Å; R303-L421 HydrophobicContact CB-CD1 4.12Å; L421-L578 HydrophobicContact CB-CB 4.15Å; L421-L578 HydrophobicContact CB-CD2 4.28Å; L421-L578 HydrophobicContact CD1-CB 4.17Å; L421-L578 HydrophobicContact CD1-CD1 4.04Å; L421-T579 WeakPolarHBondContact CA-O 3.25Å; L421-E580 HydrophobicContact CD2-CB 4.37Å; L421-E580 HydrophobicContact CD2-CG 3.3Å
422	S	92.1	Very high	87.6	Confident	13 Å²	13	43.2 Å²	43.2	9%	0.091	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	144.3	174.2	-78	0	0	0	0	111.3	W420 T579 E581	W420-S422 PolarHBondContact NE1-OG 3.28Å; S422-T579 PolarHBondContact N-O 3.07Å; S422-T579 PolarHBondContact O-N 2.92Å; S422-T579 PolarHBondContact O-OG1 2.89Å; S422-T579 VanDerWaalsContact O-OG1 3.14Å; S422-E581 WeakPolarHBondContact CB-OE1 3.17Å; S422-E581 PolarHBondContact OG-OE1 3.32Å; S422-E581 PolarHBondContact OG-OE2 3.46Å
423	L	91.5	Very high	86.2	Confident	33 Å²	33	45.4 Å²	45.4	17%	0.173	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	116.4	178.2	-59.3	-167.2	0	0	0	110.8	P298 V301 M441 R576 L578	P298-L423 HydrophobicContact CB-CD1 4.32Å; P298-L423 WeakPolarHBondContact O-CD1 3.36Å; V301-L423 HydrophobicContact CG2-CD2 4.3Å; L423-M441 HydrophobicContact CD1-CE 3.57Å; L423-M441 HydrophobicContact CD2-CE 3.93Å; L423-M441 HydrophobicContact CD2-SD 4.46Å; L423-M441 HydrophobicContact CG-CE 4.44Å; L423-R576 HydrophobicContact CB-CB 3.88Å; L423-R576 HydrophobicContact CB-CG 4.06Å; L423-R576 HydrophobicContact CD1-CB 4.32Å; L423-R576 HydrophobicContact CD1-CG 4.2Å; L423-R576 HydrophobicContact CD2-CB 4.11Å; L423-R576 HydrophobicContact CG-CB 4.32Å; L423-L578 HydrophobicContact CD2-CD2 3.51Å
424	R	89.6	Confident	84.4	Confident	92 Å²	92	52.5 Å²	52.5	35%	0.347	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	158.3	179.6	-61.5	-66.8	179.2	153.6	-9.1	112.8	L429 R576 I577 T579 E581	R424-L429 HydrophobicContact CB-CD1 4.01Å; R424-L429 HydrophobicContact CG-CD1 3.95Å; R424-R576 WeakPolarHBondContact O-CA 3.35Å; R424-I577 PolarHBondContact N-O 2.81Å; R424-I577 PolarHBondContact O-N 3.35Å; R424-T579 HydrophobicContact CB-CG2 3.98Å; R424-T579 HydrophobicContact CG-CG2 3.67Å; R424-T579 WeakPolarHBondContact CG-OG1 3.37Å; R424-E581 IonicContact CZ-OE1 2.59Å; R424-E581 IonicContact NE-OE1 2.64Å; R424-E581 IonicContact NH2-OE1 3.85Å; R424-E581 PolarHBondContact NH2-OE1 3.43Å
425	T	84.8	Confident	82.8	Confident	70 Å²	70	56.2 Å²	56.2	43%	0.429	32%	0.315	S	S	.	.			trans	-108.1	3.7	178.8	48.6	0	0	0	0	113.5	M552	T425-M552 WeakPolarHBondContact O-CE 3.33Å
426	E	80.8	Confident	81.7	Confident	93 Å²	93	56.6 Å²	56.6	44%	0.435	33%	0.327	S	S	.	.			trans	-97	110.4	-172.8	-72.1	171.3	-138.5	0	0	111.3	S428 L429 I577	E426-S428 PolarHBondContact O-N 3.17Å; E426-L429 HydrophobicContact CB-CD1 3.91Å; E426-L429 HydrophobicContact CB-CG 3.94Å; E426-L429 PolarHBondContact O-N 2.7Å; E426-I577 WeakPolarHBondContact O-CD1 3.27Å
427	S	78.4	Confident	81.2	Confident	65 Å²	65	58.5 Å²	58.5	46%	0.455	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-51.9	-28.5	178.7	176.8	0	0	0	0	114.3	L429 F547	S427-L429 PolarHBondContact O-N 2.92Å; S427-F547 WeakPolarHBondContact OG-CD1 3.39Å; S427-F547 VanDerWaalsContact OG-CE1 3.24Å; S427-F547 WeakPolarHBondContact OG-CE1 3.29Å
428	S	76.1	Confident	80.9	Confident	102 Å²	102	57 Å²	57	71%	0.713	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-69	-17	179.9	37.4	0	0	0	0	114.1	E426	E426-S428 PolarHBondContact O-N 3.17Å
429	L	78	Confident	80.7	Confident	71 Å²	71	57.2 Å²	57.2	37%	0.372	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-92.7	4.1	-178.7	-54.8	179.5	0	0	0	113.2	R424 E426 S427 N431 I577 T579	R424-L429 HydrophobicContact CB-CD1 4.01Å; R424-L429 HydrophobicContact CG-CD1 3.95Å; E426-L429 HydrophobicContact CB-CD1 3.91Å; E426-L429 HydrophobicContact CB-CG 3.94Å; E426-L429 PolarHBondContact O-N 2.7Å; S427-L429 PolarHBondContact O-N 2.92Å; L429-N431 PolarHBondContact O-N 3.36Å; L429-N431 VanDerWaalsContact O-N 3.08Å; L429-I577 HydrophobicContact CB-CG2 4.42Å; L429-T579 HydrophobicContact CB-CG2 3.7Å; L429-T579 HydrophobicContact CD1-CG2 4.01Å; L429-T579 HydrophobicContact CG-CG2 4.49Å
430	L	78.9	Confident	80.6	Confident	38 Å²	38	56.5 Å²	56.5	20%	0.199	33%	0.33	C	S	.	.			trans	-70.5	100	179.1	-176.1	75.2	0	0	0	111.3	E432 C439 V518 F547 I577	L430-E432 HydrophobicContact CD2-CG 4.18Å; L430-E432 HydrophobicContact CG-CG 4.17Å; L430-C439 HydrophobicContact CD1-CB 3.88Å; L430-V518 HydrophobicContact CD1-CG2 3.97Å; L430-V518 HydrophobicContact CD2-CG2 4.49Å; L430-F547 HydrophobicContact CD1-CZ 4.23Å; L430-F547 HydrophobicContact CD2-CE1 4.16Å; L430-F547 HydrophobicContact CD2-CZ 4.06Å; L430-I577 HydrophobicContact CB-CD1 4.31Å; L430-I577 HydrophobicContact CD1-CG1 4.35Å; L430-I577 HydrophobicContact CD1-CG2 4.49Å
431	N	71.6	Confident	80.6	Confident	134 Å²	134	56.2 Å²	56.2	72%	0.717	33%	0.329	S	S	*	.			trans	-96.7	97.7	172.2	-169	14.4	0	0	0	110.6	L429 S433	L429-N431 PolarHBondContact O-N 3.36Å; L429-N431 VanDerWaalsContact O-N 3.08Å; N431-S433 PolarHBondContact O-N 2.92Å; N431-S433 VanDerWaalsContact O-N 3.08Å
432	E	67.6	Low	80.6	Confident	66 Å²	66	56.1 Å²	56.1	31%	0.308	33%	0.329	S	S	.	.			trans	-75.3	93.8	176.9	-74.2	176.9	174.4	0	0	110.4	L430 K519	L430-E432 HydrophobicContact CD2-CG 4.18Å; L430-E432 HydrophobicContact CG-CG 4.17Å; E432-K519 IonicContact OE1-NZ 3.52Å; E432-K519 PolarHBondContact OE1-NZ 3.46Å; E432-K519 IonicContact OE2-NZ 2.7Å; E432-K519 PolarHBondContact OE2-NZ 3.35Å
433	S	62.6	Low	80.7	Confident	48 Å²	48	55.7 Å²	55.7	34%	0.336	33%	0.326	S	S	.	.			trans	-76.2	131.5	178.1	85.1	0	0	0	0	112	N431 A435	N431-S433 PolarHBondContact O-N 2.92Å; N431-S433 VanDerWaalsContact O-N 3.08Å; S433-A435 PolarHBondContact O-N 3Å
434	N	57	Low	80.8	Confident	179 Å²	179	54.1 Å²	54.1	96%	0.957	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	0.3	173.1	-73.5	-20	0	0	0	113.9	G436	N434-G436 VanDerWaalsContact C-N 3.31Å; N434-G436 PolarHBondContact O-N 3.37Å
435	A	62.6	Low	81	Confident	79 Å²	79	50.7 Å²	50.7	65%	0.653	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-2.6	-178.7	0	0	0	0	0	114.1	S433 L437	S433-A435 PolarHBondContact O-N 3Å; A435-L437 HydrophobicContact CB-CD1 4.2Å; A435-L437 HydrophobicContact CB-CG 4.07Å; A435-L437 PolarHBondContact O-N 3.43Å
436	G	74.9	Confident	81.5	Confident	39 Å²	39	47.4 Å²	47.4	40%	0.402	29%	0.285	S	S	.	.	S	Bend	trans	73.4	10.2	-175.2	0	0	0	0	0	114.3	N434 Q516	N434-G436 VanDerWaalsContact C-N 3.31Å; N434-G436 PolarHBondContact O-N 3.37Å; G436-Q516 PolarHBondContact O-NE2 2.99Å
437	L	86.2	Confident	82	Confident	41 Å²	41	44.2 Å²	44.2	22%	0.215	27%	0.271	C	S	.	.			trans	-75.9	154.7	172.2	-60.6	174.7	0	0	0	110.8	V356 A435	V356-L437 HydrophobicContact CB-CD2 4.23Å; V356-L437 HydrophobicContact CG1-CD2 3.77Å; A435-L437 HydrophobicContact CB-CD1 4.2Å; A435-L437 HydrophobicContact CB-CG 4.07Å; A435-L437 PolarHBondContact O-N 3.43Å
438	S	90.1	Very high	82.7	Confident	9 Å²	9	43.1 Å²	43.1	6%	0.063	26%	0.26	C	S	.	.			trans	-76.1	131.8	-175.7	-51.7	0	0	0	0	112.1	R303 E358 F514 V515	R303-S438 PolarHBondContact NH2-O 3.38Å; E358-S438 PolarHBondContact OE1-N 2.91Å; E358-S438 WeakPolarHBondContact OE2-CB 3.39Å; E358-S438 PolarHBondContact OE2-OG 3.3Å; S438-F514 WeakPolarHBondContact OG-CB 3.39Å; S438-V515 CarbonylContact C-O 3.57Å; S438-V515 WeakPolarHBondContact CA-O 3.1Å
439	C	90.6	Very high	83.5	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.034	23%	0.226	C	C	.	.	S	Bend	trans	-96.8	-17.6	176.3	62.3	0	0	0	0	112.7	L430 V515 Q516 L578	L430-C439 HydrophobicContact CD1-CB 3.88Å; C439-V515 PolarHBondContact N-O 2.55Å; C439-V515 PolarHBondContact SG-O 2.89Å; C439-Q516 PolarHBondContact SG-O 3.26Å; C439-L578 PolarHBondContact O-N 3.45Å
440	A	92	Very high	84.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	165.5	177.1	0	0	0	0	0	112.2	V515 V518 L575 R576	A440-V515 HydrophobicContact CB-CB 3.99Å; A440-V515 HydrophobicContact CB-CG1 4.32Å; A440-V515 PolarHBondContact N-O 3.39Å; A440-V515 VanDerWaalsContact N-O 3.12Å; A440-V515 WeakPolarHBondContact O-CB 3.47Å; A440-V515 PolarHBondContact O-N 3.16Å; A440-V518 HydrophobicContact CB-CG2 4.33Å; A440-L575 HydrophobicContact CB-CD1 3.79Å; A440-L575 HydrophobicContact CB-CG 4.45Å; A440-R576 CarbonylContact C-O 3.49Å; A440-R576 VanDerWaalsContact CA-O 3.24Å; A440-R576 WeakPolarHBondContact CA-O 3.22Å; A440-R576 VanDerWaalsContact CB-O 3.32Å; A440-R576 WeakPolarHBondContact CB-O 3.31Å
441	M	93.9	Very high	84.6	Confident	1 Å²	1	38 Å²	38	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.8	172.6	-176.4	-167.3	75.2	0	0	109.2	P298 V301 V360 L423 F513 F514 R576 L578	P298-M441 HydrophobicContact CB-CE 4.41Å; P298-M441 HydrophobicContact CG-CE 3.78Å; P298-M441 HydrophobicContact CG-SD 4.24Å; V301-M441 HydrophobicContact CG2-SD 3.7Å; V360-M441 HydrophobicContact CG1-SD 4.19Å; V360-M441 HydrophobicContact CG2-SD 3.98Å; L423-M441 HydrophobicContact CD1-CE 3.57Å; L423-M441 HydrophobicContact CD2-CE 3.93Å; L423-M441 HydrophobicContact CD2-SD 4.46Å; L423-M441 HydrophobicContact CG-CE 4.44Å; M441-F513 WeakPolarHBondContact CA-O 3.41Å; M441-F514 HydrophobicContact CB-CD1 4.46Å; M441-F514 HydrophobicContact CG-CD1 4.32Å; M441-F514 HydrophobicContact CG-CE1 4.34Å; M441-R576 PolarHBondContact N-O 2.85Å; M441-R576 PolarHBondContact O-N 2.76Å; M441-L578 HydrophobicContact CB-CD2 4.03Å; M441-L578 HydrophobicContact CB-CG 4.44Å
442	L	94.3	Very high	85.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.4	-179.2	-173.4	77	0	0	0	109.6	V444 N512 F513 V515 L523 I543 L546 V573 L575	L442-V444 HydrophobicContact CD2-CG2 3.97Å; L442-V444 HydrophobicContact CG-CG2 3.93Å; L442-N512 WeakPolarHBondContact O-CA 3.22Å; L442-F513 HydrophobicContact CB-CB 4.35Å; L442-F513 HydrophobicContact CD2-CD2 4.49Å; L442-F513 PolarHBondContact N-O 3.31Å; L442-F513 PolarHBondContact O-N 3.12Å; L442-V515 HydrophobicContact CB-CG2 3.91Å; L442-L523 HydrophobicContact CD2-CB 4.18Å; L442-L523 HydrophobicContact CD2-CD1 4.23Å; L442-L523 HydrophobicContact CD2-CD2 4.05Å; L442-L523 HydrophobicContact CD2-CG 4.38Å; L442-I543 HydrophobicContact CD1-CD1 4.13Å; L442-I543 HydrophobicContact CD2-CD1 3.57Å; L442-I543 HydrophobicContact CG-CD1 4.47Å; L442-L546 HydrophobicContact CD1-CD1 3.59Å; L442-V573 HydrophobicContact CD1-CG1 3.69Å; L442-V573 HydrophobicContact CG-CG1 4.31Å; L442-L575 HydrophobicContact CB-CD1 4.28Å; L442-L575 HydrophobicContact CD1-CB 4.16Å; L442-L575 HydrophobicContact CD1-CD1 3.95Å
443	A	94	Very high	86.2	Confident	4 Å²	4	28.6 Å²	28.6	3%	0.033	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.7	172.1	0	0	0	0	0	109.5	F295 L297 N512 T574	F295-A443 HydrophobicContact CE1-CB 4.37Å; L297-A443 HydrophobicContact CD2-CB 3.83Å; A443-N512 WeakPolarHBondContact CB-OD1 3.49Å; A443-T574 PolarHBondContact N-O 3.1Å; A443-T574 PolarHBondContact O-N 2.94Å
444	V	93.9	Very high	86.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	111.6	-176.2	179.6	0	0	0	0	109	L442 F487 G510 F511 F513 L523 V573	L442-V444 HydrophobicContact CD2-CG2 3.97Å; L442-V444 HydrophobicContact CG-CG2 3.93Å; V444-F487 HydrophobicContact CG1-CD1 4.37Å; V444-F487 HydrophobicContact CG1-CE1 3.66Å; V444-F487 HydrophobicContact CG1-CZ 3.87Å; V444-G510 CarbonylContact O-C 3.5Å; V444-G510 WeakPolarHBondContact O-CA 3.21Å; V444-F511 HydrophobicContact CB-CB 4.44Å; V444-F511 PolarHBondContact N-O 3.07Å; V444-F511 PolarHBondContact O-N 2.86Å; V444-F513 HydrophobicContact CB-CE2 4.25Å; V444-F513 HydrophobicContact CG2-CD2 4.01Å; V444-F513 HydrophobicContact CG2-CE2 3.95Å; V444-L523 HydrophobicContact CG1-CD2 4.38Å; V444-L523 HydrophobicContact CG2-CD2 3.74Å; V444-V573 HydrophobicContact CG1-CG2 4.32Å; V444-V573 HydrophobicContact CG2-CG1 4.39Å
445	Y	93.3	Very high	87.4	Confident	21 Å²	21	24.1 Å²	24.1	8%	0.082	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	119.3	171.2	178.8	-99.8	0	0	0	110.4	D291 F295 D447 L571 K572	D291-Y445 HydrophobicContact CB-CD1 4.46Å; D291-Y445 HydrophobicContact CB-CE1 3.75Å; D291-Y445 HydrophobicContact CB-CE2 4.31Å; F295-Y445 HydrophobicContact CB-CD2 4.18Å; F295-Y445 HydrophobicContact CD1-CD2 4.4Å; Y445-D447 HydrophobicContact CD1-CB 4.39Å; Y445-D447 HydrophobicContact CE1-CB 3.92Å; Y445-L571 WeakPolarHBondContact O-CA 3.45Å; Y445-K572 HydrophobicContact CD1-CB 4.41Å; Y445-K572 PolarHBondContact N-O 3.48Å; Y445-K572 PolarHBondContact O-N 3.04Å
446	L	94	Very high	87.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	109.2	175.6	174.2	65.3	0	0	0	109	V485 F487 W507 E508 Q509 F511 I569 L571	L446-V485 HydrophobicContact CD1-CG2 4.07Å; L446-V485 HydrophobicContact CD2-CB 3.8Å; L446-V485 HydrophobicContact CD2-CG1 4.4Å; L446-V485 HydrophobicContact CD2-CG2 3.62Å; L446-F487 HydrophobicContact CB-CE2 4.39Å; L446-F487 HydrophobicContact CB-CZ 4.16Å; L446-F487 HydrophobicContact CD1-CZ 4.39Å; L446-F487 HydrophobicContact CD2-CE2 4.09Å; L446-F487 HydrophobicContact CD2-CZ 4.35Å; L446-W507 HydrophobicContact CD1-CE3 3.66Å; L446-W507 HydrophobicContact CD1-CZ3 3.95Å; L446-W507 HydrophobicContact CD2-CB 3.79Å; L446-W507 HydrophobicContact CD2-CD2 3.78Å; L446-W507 HydrophobicContact CD2-CE3 3.78Å; L446-W507 HydrophobicContact CD2-CG 3.83Å; L446-W507 HydrophobicContact CG-CB 3.96Å; L446-W507 HydrophobicContact CG-CD2 4.17Å; L446-W507 HydrophobicContact CG-CE3 3.72Å; L446-W507 HydrophobicContact CG-CG 4.32Å; L446-W507 HydrophobicContact CG-CZ3 4.49Å; L446-E508 WeakPolarHBondContact O-CA 3.34Å; L446-E508 PolarHBondContact O-N 2.74Å; L446-E508 VanDerWaalsContact O-N 3.13Å; L446-Q509 WeakPolarHBondContact CB-O 3.49Å; L446-Q509 PolarHBondContact N-O 2.84Å; L446-Q509 PolarHBondContact O-N 3.02Å; L446-F511 HydrophobicContact CB-CE2 4.02Å; L446-F511 HydrophobicContact CD2-CE2 4.22Å; L446-I569 HydrophobicContact CD1-CD1 3.79Å; L446-I569 HydrophobicContact CD1-CG1 4.03Å; L446-L571 HydrophobicContact CB-CD2 4.37Å; L446-L571 HydrophobicContact CD1-CD2 3.54Å
447	D	91.5	Very high	86.9	Confident	27 Å²	27	32.2 Å²	32.2	14%	0.144	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-77	179.3	-176.7	-32	0	0	0	109.9	Y445 W507 E508 K570	Y445-D447 HydrophobicContact CD1-CB 4.39Å; Y445-D447 HydrophobicContact CE1-CB 3.92Å; D447-W507 PolarHBondContact O-N 2.7Å; D447-E508 PolarHBondContact O-N 2.81Å; D447-E508 VanDerWaalsContact O-N 3.16Å; D447-K570 HydrophobicContact CB-CB 4.21Å; D447-K570 HydrophobicContact CB-CD 4.19Å; D447-K570 HydrophobicContact CB-CG 4.14Å; D447-K570 PolarHBondContact N-O 3.49Å; D447-K570 WeakPolarHBondContact OD2-CD 3.12Å; D447-K570 WeakPolarHBondContact OD2-CE 3.4Å; D447-K570 IonicContact OD2-NZ 2.74Å; D447-K570 PolarHBondContact OD2-NZ 3.14Å
448	N	92.6	Very high	85.8	Confident	42 Å²	42	34 Å²	34	23%	0.225	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	169.7	-175	70.8	80	0	0	0	112	P505 V506 K570	N448-P505 CarbonylContact C-O 3.43Å; N448-P505 WeakPolarHBondContact CA-O 3.37Å; N448-P505 VanDerWaalsContact CB-O 3.28Å; N448-P505 WeakPolarHBondContact CB-O 3.38Å; N448-V506 HydrophobicContact CB-CB 4.43Å; N448-V506 HydrophobicContact CB-CG2 3.99Å; N448-K570 PolarHBondContact O-N 2.68Å
449	A	93.8	Very high	84.3	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	160.9	161	0	0	0	0	0	110.8	L452 N504 P505 W507 Q568 I569	A449-L452 HydrophobicContact CB-CD1 4.25Å; A449-L452 HydrophobicContact CB-CD2 4.15Å; A449-L452 HydrophobicContact CB-CG 4.19Å; A449-N504 CarbonylContact O-C 3.48Å; A449-N504 WeakPolarHBondContact O-CA 3.42Å; A449-P505 HydrophobicContact CB-CG 3.95Å; A449-P505 PolarHBondContact N-O 3.45Å; A449-P505 WeakPolarHBondContact O-CD 3.34Å; A449-W507 HydrophobicContact CB-CH2 3.88Å; A449-W507 HydrophobicContact CB-CZ3 3.66Å; A449-Q568 CarbonylContact C-O 3.43Å; A449-Q568 VanDerWaalsContact CA-O 3.27Å; A449-Q568 WeakPolarHBondContact CA-O 3.35Å; A449-Q568 VanDerWaalsContact CB-O 3.3Å; A449-Q568 WeakPolarHBondContact CB-O 3.47Å; A449-I569 HydrophobicContact CB-CB 4.25Å; A449-I569 HydrophobicContact CB-CD1 4.5Å; A449-I569 HydrophobicContact CB-CG1 4.12Å
450	S	91.9	Very high	82.5	Confident	25 Å²	25	40.5 Å²	40.5	18%	0.175	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.4	179.1	64.6	0	0	0	0	112	L452 N504 S567 Q568	S450-L452 VanDerWaalsContact C-N 3.27Å; S450-L452 PolarHBondContact O-N 2.63Å; S450-L452 VanDerWaalsContact O-N 3.16Å; S450-N504 WeakPolarHBondContact CA-OD1 3.14Å; S450-S567 WeakPolarHBondContact O-CA 3.35Å; S450-Q568 PolarHBondContact N-O 2.82Å; S450-Q568 PolarHBondContact O-N 3.32Å
451	N	88.3	Confident	80.6	Confident	78 Å²	78	45 Å²	45	42%	0.417	23%	0.231	S	C	.	.	S	Bend	trans	54.4	32.9	172.9	-56	-40	0	0	0	115.1	K503 N504 D566 S567	N451-K503 PolarHBondContact N-O 3.05Å; N451-N504 PolarHBondContact N-OD1 2.96Å; N451-D566 HydrophobicContact CB-CB 4.32Å; N451-D566 WeakPolarHBondContact CB-O 3.27Å; N451-D566 PolarHBondContact ND2-O 2.83Å; N451-S567 PolarHBondContact O-OG 2.75Å
452	L	88.3	Confident	78.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.			trans	-60.7	146.8	-179.5	-67	-176.4	0	0	0	112.3	A449 S450 P481 K503 P505 V527 L560	A449-L452 HydrophobicContact CB-CD1 4.25Å; A449-L452 HydrophobicContact CB-CD2 4.15Å; A449-L452 HydrophobicContact CB-CG 4.19Å; S450-L452 VanDerWaalsContact C-N 3.27Å; S450-L452 PolarHBondContact O-N 2.63Å; S450-L452 VanDerWaalsContact O-N 3.16Å; L452-P481 HydrophobicContact CB-CG 4.26Å; L452-K503 WeakPolarHBondContact CB-O 3.05Å; L452-K503 PolarHBondContact N-O 3.27Å; L452-K503 VanDerWaalsContact O-CD 3.25Å; L452-K503 WeakPolarHBondContact O-CD 3.49Å; L452-K503 WeakPolarHBondContact O-CE 3.34Å; L452-K503 WeakPolarHBondContact O-CG 3.5Å; L452-K503 PolarHBondContact O-NZ 2.77Å; L452-P505 HydrophobicContact CD1-CG 3.61Å; L452-V527 HydrophobicContact CD1-CG1 3.91Å; L452-V527 HydrophobicContact CD2-CG1 4.38Å; L452-L560 HydrophobicContact CD2-CD1 3.57Å
453	P	85.6	Confident	76.1	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.019	30%	0.304	C	S	.	.			trans	-67.4	150.7	169.1	28.8	-33.6	0	0	0	111	E458 L459 P481 L536	P453-E458 HydrophobicContact CB-CB 4.12Å; P453-L459 HydrophobicContact CB-CD1 4.18Å; P453-L459 HydrophobicContact CG-CD1 3.84Å; P453-P481 WeakPolarHBondContact O-CG 3.3Å; P453-L536 HydrophobicContact CG-CB 4.34Å; P453-L536 HydrophobicContact CG-CD2 4.28Å; P453-L536 VanDerWaalsContact CG-O 3.31Å; P453-L536 WeakPolarHBondContact CG-O 3.35Å
454	K	75.1	Confident	73.5	Confident	67 Å²	67	69.4 Å²	69.4	29%	0.291	34%	0.341	S	S	.	.	S	Bend	trans	-84.7	-25.2	176.9	-63.4	170.9	179.9	161.2	0	114.3	E458 N478 Y534	K454-E458 WeakPolarHBondContact CB-OE2 3.3Å; K454-E458 WeakPolarHBondContact CG-OE2 3.18Å; K454-E458 PolarHBondContact N-OE2 3.22Å; K454-N478 WeakPolarHBondContact CE-OD1 3.39Å; K454-N478 PolarHBondContact NZ-OD1 3.16Å; K454-Y534 PolarHBondContact O-OH 2.57Å
455	D	68.8	Low	71	Confident	66 Å²	66	78.6 Å²	78.6	35%	0.353	38%	0.384	S	S	.	.	S	Bend	trans	-161.8	153.2	-172.5	-96	-46.2	0	0	0	108.3	K457 E458 K532 Y534	D455-K457 PolarHBondContact O-N 3.46Å; D455-E458 WeakPolarHBondContact O-CB 3.49Å; D455-E458 PolarHBondContact O-N 2.91Å; D455-K532 IonicContact OD1-NZ 3.86Å; D455-K532 PolarHBondContact OD1-NZ 3.38Å; D455-K532 IonicContact OD2-NZ 3.92Å; D455-Y534 WeakPolarHBondContact CA-OH 3.47Å
456	Q	63.2	Low	68.6	Low	118 Å²	118	81 Å²	81	55%	0.551	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-9.2	176.5	-159.3	172.7	5.2	0	0	114.2	L459 T460 Y534	Q456-L459 HydrophobicContact CG-CD2 4.32Å; Q456-L459 VanDerWaalsContact O-CB 3.25Å; Q456-L459 WeakPolarHBondContact O-CB 3.33Å; Q456-T460 PolarHBondContact O-OG1 2.9Å; Q456-Y534 HydrophobicContact CB-CD2 4Å; Q456-Y534 HydrophobicContact CB-CE2 4.34Å
457	K	63.6	Low	65.8	Low	170 Å²	170	90.7 Å²	90.7	74%	0.739	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-29.8	171.2	-63.3	-179.1	-178.4	178.4	0	112.8	D455 L459 T460 V461	D455-K457 PolarHBondContact O-N 3.46Å; K457-L459 VanDerWaalsContact C-N 3.27Å; K457-T460 PolarHBondContact O-N 2.88Å; K457-T460 PolarHBondContact O-OG1 2.87Å; K457-V461 WeakPolarHBondContact O-CG2 3.47Å
458	E	63.4	Low	63.6	Low	77 Å²	77	98.8 Å²	98.8	36%	0.36	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-69.6	-31.4	175.6	-159.2	167.4	-178.7	0	0	110.6	P453 K454 D455 T460 K503	P453-E458 HydrophobicContact CB-CB 4.12Å; K454-E458 WeakPolarHBondContact CB-OE2 3.3Å; K454-E458 WeakPolarHBondContact CG-OE2 3.18Å; K454-E458 PolarHBondContact N-OE2 3.22Å; D455-E458 WeakPolarHBondContact O-CB 3.49Å; D455-E458 PolarHBondContact O-N 2.91Å; E458-T460 PolarHBondContact O-N 2.98Å; E458-K503 IonicContact OE1-NZ 2.85Å; E458-K503 PolarHBondContact OE1-NZ 3.26Å; E458-K503 IonicContact OE2-NZ 2.65Å; E458-K503 PolarHBondContact OE2-NZ 2.86Å
459	L	59	Low	60.8	Low	51 Å²	51	102.4 Å²	102.4	27%	0.267	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-57.1	-28.3	172	-127.6	78.2	0	0	0	114.8	P453 Q456 K457	P453-L459 HydrophobicContact CB-CD1 4.18Å; P453-L459 HydrophobicContact CG-CD1 3.84Å; Q456-L459 HydrophobicContact CG-CD2 4.32Å; Q456-L459 VanDerWaalsContact O-CB 3.25Å; Q456-L459 WeakPolarHBondContact O-CB 3.33Å; K457-L459 VanDerWaalsContact C-N 3.27Å
460	T	52.5	Low	58.3	Low	101 Å²	101	111.3 Å²	111.3	62%	0.62	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-111.4	-5.3	-164.5	36.9	0	0	0	0	114.5	Q456 K457 E458	Q456-T460 PolarHBondContact O-OG1 2.9Å; K457-T460 PolarHBondContact O-N 2.88Å; K457-T460 PolarHBondContact O-OG1 2.87Å; E458-T460 PolarHBondContact O-N 2.98Å
461	V	50.8	Low	56.1	Low	95 Å²	95	118.4 Å²	118.4	58%	0.576	59%	0.59	S	S	*	*	S	Bend	trans	-73.5	-34.4	-174.5	163.2	0	0	0	0	113.5	K457	K457-V461 WeakPolarHBondContact O-CG2 3.47Å
462	H	50.8	Low	53.5	Low	144 Å²	144	119.8 Å²	119.8	67%	0.667	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-8.5	-166.6	-75.4	-84.8	0	0	0	116.3	K464	H462-K464 PolarHBondContact O-N 2.92Å
463	H	44	Very low	51	Low	186 Å²	186	130.4 Å²	130.4	86%	0.861	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	1.4	174.3	-83.2	-42.4	0	0	0	114.8
464	K	39.4	Very low	49.1	Very low	187 Å²	187	139 Å²	139	81%	0.813	70%	0.698	S	S	*	*			trans	-116.5	95.9	167.7	-71.2	-168.1	176.2	-176	0	111.1	H462	H462-K464 PolarHBondContact O-N 2.92Å
465	H	42.1	Very low	47.3	Very low	193 Å²	193	142.1 Å²	142.1	89%	0.894	72%	0.723	S	S	*	*			trans	-57.4	139.7	160.3	-89.9	50.2	0	0	0	110
466	G	42.5	Very low	46.2	Very low	70 Å²	70	148.4 Å²	148.4	72%	0.722	75%	0.747	S	S	*	*			trans	103.8	61.5	165.5	0	0	0	0	0	117.6
467	K	34.8	Very low	45.3	Very low	204 Å²	204	151.8 Å²	151.8	89%	0.887	76%	0.76	S	S	*	*				178.7	137.9	120	-97.7	163.3	-176.4	178.2	0	112.4
468	H	45.2	Very low	44.5	Very low	198 Å²	198	149.8 Å²	149.8	92%	0.917	76%	0.757	S	S	*	*			trans	-65.5	130.5	163.1	-75	-89.3	0	0	0	110
469	S	34.5	Very low	44.6	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	77%	0.765	S	S	*	*			trans	-107.3	137.6	159.3	53.8	0	0	0	0	109.1
470	K	39.7	Very low	45.1	Very low	186 Å²	186	148.4 Å²	148.4	81%	0.809	76%	0.758	S	S	*	*			trans	-82.9	144.5	-176.2	-68	-175.3	175.1	-173.2	0	111.8	A472	K470-A472 PolarHBondContact O-N 2.9Å
471	E	46.1	Very low	46.5	Very low	174 Å²	174	143.8 Å²	143.8	81%	0.813	73%	0.73	S	S	*	*			trans	52.1	64.3	142.8	-64.5	167.8	172.6	0	0	117.6	R473	E471-R473 VanDerWaalsContact C-N 3.34Å; E471-R473 PolarHBondContact O-N 2.83Å
472	A	34.8	Very low	48.2	Very low	108 Å²	108	140.5 Å²	140.5	89%	0.893	71%	0.709	S	S	*	*			trans	-71.2	88.1	161.5	0	0	0	0	0	111.1	K470	K470-A472 PolarHBondContact O-N 2.9Å
473	R	35.6	Very low	50	Low	223 Å²	223	133.6 Å²	133.6	84%	0.842	68%	0.677	S	S	*	*			trans	-18.2	134.8	178.5	-65.3	176.2	175.5	172.9	-3	118.1	E471 T475	E471-R473 VanDerWaalsContact C-N 3.34Å; E471-R473 PolarHBondContact O-N 2.83Å; R473-T475 VanDerWaalsContact C-N 3.35Å; R473-T475 PolarHBondContact O-N 2.88Å
474	L	44.6	Very low	52.4	Low	183 Å²	183	125.9 Å²	125.9	96%	0.958	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	70.9	174.6	-73.5	150.7	0	0	0	114.5
475	T	37.7	Very low	55.1	Low	132 Å²	132	117 Å²	117	81%	0.81	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145	-13.4	165.2	46	0	0	0	0	115.4	R473 K477	R473-T475 VanDerWaalsContact C-N 3.35Å; R473-T475 PolarHBondContact O-N 2.88Å; T475-K477 PolarHBondContact O-N 3.4Å; T475-K477 VanDerWaalsContact O-N 3.08Å
476	K	45.9	Very low	57.7	Low	198 Å²	198	109 Å²	109	86%	0.861	57%	0.565	S	S	*	*	S	Bend	trans	-81.5	96.6	-175.7	-146.1	172.7	-169.3	179.5	0	111.4	N478	K476-N478 PolarHBondContact O-N 2.87Å
477	K	43.1	Very low	60.3	Low	190 Å²	190	105.7 Å²	105.7	83%	0.826	53%	0.531	S	S	*	.			trans	-45.8	124.6	176.5	-167.7	173.4	-175.3	176.7	0	110.2	T475 V479	T475-K477 PolarHBondContact O-N 3.4Å; T475-K477 VanDerWaalsContact O-N 3.08Å; K477-V479 PolarHBondContact O-N 3.2Å
478	N	47.8	Very low	63.1	Low	128 Å²	128	97.5 Å²	97.5	68%	0.684	50%	0.498	S	S	*	.			trans	-84.2	57.3	-160.5	-158.2	23.6	0	0	0	112.8	K454 K476 G480	K454-N478 WeakPolarHBondContact CE-OD1 3.39Å; K454-N478 PolarHBondContact NZ-OD1 3.16Å; K476-N478 PolarHBondContact O-N 2.87Å; N478-G480 PolarHBondContact O-N 2.86Å
479	V	64.8	Low	65.4	Low	87 Å²	87	88.4 Å²	88.4	53%	0.527	46%	0.456	S	S	.	.			trans	-63.4	130.3	-177.3	-168.1	0	0	0	0	110.2	K477 A501	K477-V479 PolarHBondContact O-N 3.2Å; V479-A501 HydrophobicContact CG1-CB 3.91Å
480	G	69.8	Low	68	Low	11 Å²	11	87.3 Å²	87.3	11%	0.113	44%	0.441	C	S	.	.			trans	-80.1	176.1	171.8	0	0	0	0	0	113	N478 A501	N478-G480 PolarHBondContact O-N 2.86Å; G480-A501 WeakPolarHBondContact CA-O 3.45Å; G480-A501 PolarHBondContact N-O 2.87Å
481	P	81.4	Confident	70.2	Confident	4 Å²	4	88 Å²	88	3%	0.026	44%	0.444	C	S	.	.			trans	-64.6	158.7	174	29.8	-36.6	0	0	0	112.3	L452 P453 A501 S502 L536	L452-P481 HydrophobicContact CB-CG 4.26Å; P453-P481 WeakPolarHBondContact O-CG 3.3Å; P481-A501 PolarHBondContact O-N 2.9Å; P481-A501 VanDerWaalsContact O-N 3.17Å; P481-S502 WeakPolarHBondContact CD-O 3.37Å; P481-S502 WeakPolarHBondContact CG-O 3.31Å; P481-S502 PolarHBondContact O-N 2.78Å; P481-L536 HydrophobicContact CB-CD1 3.87Å; P481-L536 HydrophobicContact CG-CD1 4.28Å
482	N	87	Confident	72.2	Confident	26 Å²	26	82.7 Å²	82.7	14%	0.139	42%	0.421	C	S	.	.			trans	-97.1	87.4	168.6	-71.2	-21.9	0	0	0	107.5	A499 Y500 A501 D529 H530 E531	N482-A499 CarbonylContact C-O 3.56Å; N482-Y500 HydrophobicContact CB-CD1 4.05Å; N482-Y500 WeakPolarHBondContact OD1-CA 3.47Å; N482-A501 PolarHBondContact OD1-N 3.16Å; N482-D529 CarbonylContact O-C 3.59Å; N482-D529 WeakPolarHBondContact O-CA 3.49Å; N482-H530 HydrophobicContact CB-CB 4.19Å; N482-H530 WeakPolarHBondContact O-CB 3.25Å; N482-H530 PolarHBondContact O-N 2.91Å; N482-E531 PolarHBondContact ND2-OE1 3.38Å
483	S	89.9	Confident	75	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	145.1	-163.4	60.1	0	0	0	0	114.2	A499 K528	S483-A499 PolarHBondContact N-O 3Å; S483-A499 PolarHBondContact O-N 2.62Å; S483-K528 WeakPolarHBondContact CA-O 3.27Å
484	Y	93.4	Very high	77.8	Confident	23 Å²	23	72.2 Å²	72.2	9%	0.09	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.3	167.5	74.2	-82.4	0	0	0	109.9	E486 K495 V527 K528 H530	Y484-E486 HydrophobicContact CE2-CB 4.1Å; Y484-K495 HydrophobicContact CE2-CD 4.18Å; Y484-V527 CarbonylContact O-C 3.5Å; Y484-V527 WeakPolarHBondContact O-CA 3.43Å; Y484-K528 HydrophobicContact CD1-CB 4.15Å; Y484-K528 WeakPolarHBondContact CD1-O 3.38Å; Y484-K528 HydrophobicContact CE1-CB 3.55Å; Y484-K528 HydrophobicContact CE2-CB 4.24Å; Y484-K528 PolarHBondContact N-O 3Å; Y484-K528 PolarHBondContact O-N 2.98Å; Y484-H530 HydrophobicContact CD1-CB 4.28Å
485	V	96	Very high	80.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.6	175.5	-175.1	0	0	0	0	109.2	L446 F487 K495 S496 W507 L525 V527 I569	L446-V485 HydrophobicContact CD1-CG2 4.07Å; L446-V485 HydrophobicContact CD2-CB 3.8Å; L446-V485 HydrophobicContact CD2-CG1 4.4Å; L446-V485 HydrophobicContact CD2-CG2 3.62Å; V485-F487 HydrophobicContact CB-CE2 4.17Å; V485-F487 HydrophobicContact CG1-CD2 3.92Å; V485-F487 HydrophobicContact CG1-CE1 4.23Å; V485-F487 HydrophobicContact CG1-CE2 3.55Å; V485-F487 HydrophobicContact CG1-CG 4.4Å; V485-F487 HydrophobicContact CG1-CZ 3.73Å; V485-K495 CarbonylContact O-C 3.54Å; V485-K495 WeakPolarHBondContact O-CA 3.25Å; V485-S496 PolarHBondContact N-OG 2.98Å; V485-S496 PolarHBondContact O-N 3.01Å; V485-W507 HydrophobicContact CG2-CD2 4.27Å; V485-W507 HydrophobicContact CG2-CE3 4.15Å; V485-W507 HydrophobicContact CG2-CH2 3.5Å; V485-W507 VanDerWaalsContact CG2-CH2 3.5Å; V485-W507 HydrophobicContact CG2-CZ2 3.67Å; V485-W507 HydrophobicContact CG2-CZ3 3.76Å; V485-L525 HydrophobicContact CG1-CD1 4.13Å; V485-L525 HydrophobicContact CG1-CD2 3.65Å; V485-L525 HydrophobicContact CG1-CG 3.57Å; V485-V527 HydrophobicContact CG2-CG2 4.4Å; V485-I569 HydrophobicContact CG2-CD1 4.16Å
486	E	96.3	Very high	82.7	Confident	26 Å²	26	63.1 Å²	63.1	12%	0.121	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.3	170	-170.6	167.1	97.6	0	0	108.3	Y484 V493 K495 L525 Q526 K528	Y484-E486 HydrophobicContact CE2-CB 4.1Å; E486-V493 HydrophobicContact CG-CG1 3.81Å; E486-K495 HydrophobicContact CG-CD 4.34Å; E486-K495 HydrophobicContact CG-CG 4.22Å; E486-K495 VanDerWaalsContact OE2-CE 3.22Å; E486-K495 WeakPolarHBondContact OE2-CE 3.36Å; E486-K495 IonicContact OE2-NZ 2.72Å; E486-K495 PolarHBondContact OE2-NZ 3.04Å; E486-L525 WeakPolarHBondContact O-CA 3.28Å; E486-Q526 PolarHBondContact N-O 2.64Å; E486-Q526 PolarHBondContact O-N 3.49Å; E486-K528 HydrophobicContact CB-CD 4.43Å; E486-K528 IonicContact OE1-NZ 3.24Å; E486-K528 PolarHBondContact OE1-NZ 2.88Å
487	F	96.8	Very high	84.8	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137	174.7	-67.8	-84.4	0	0	0	109.2	V444 L446 V485 V493 Q494 F511 F513 L523 T524 L525 L571	V444-F487 HydrophobicContact CG1-CD1 4.37Å; V444-F487 HydrophobicContact CG1-CE1 3.66Å; V444-F487 HydrophobicContact CG1-CZ 3.87Å; L446-F487 HydrophobicContact CB-CE2 4.39Å; L446-F487 HydrophobicContact CB-CZ 4.16Å; L446-F487 HydrophobicContact CD1-CZ 4.39Å; L446-F487 HydrophobicContact CD2-CE2 4.09Å; L446-F487 HydrophobicContact CD2-CZ 4.35Å; V485-F487 HydrophobicContact CB-CE2 4.17Å; V485-F487 HydrophobicContact CG1-CD2 3.92Å; V485-F487 HydrophobicContact CG1-CE1 4.23Å; V485-F487 HydrophobicContact CG1-CE2 3.55Å; V485-F487 HydrophobicContact CG1-CG 4.4Å; V485-F487 HydrophobicContact CG1-CZ 3.73Å; F487-V493 CarbonylContact O-C 3.58Å; F487-V493 VanDerWaalsContact O-CA 3.3Å; F487-V493 WeakPolarHBondContact O-CA 3.17Å; F487-Q494 PolarHBondContact N-O 3.1Å; F487-Q494 PolarHBondContact O-N 2.82Å; F487-F511 HydrophobicContact CD2-CD2 4.09Å; F487-F511 HydrophobicContact CD2-CE2 4.15Å; F487-F511 HydrophobicContact CD2-CG 4.34Å; F487-F511 HydrophobicContact CD2-CZ 4.43Å; F487-F511 AromaticContact CE2-CD2 3.67Å; F487-F511 HydrophobicContact CE2-CD2 3.67Å; F487-F511 AromaticContact CE2-CE2 3.55Å; F487-F511 HydrophobicContact CE2-CE2 3.55Å; F487-F511 HydrophobicContact CE2-CG 4.36Å; F487-F511 HydrophobicContact CE2-CZ 4.14Å; F487-F511 HydrophobicContact CZ-CD2 4.36Å; F487-F511 HydrophobicContact CZ-CE2 4.43Å; F487-F513 HydrophobicContact CB-CE1 4.1Å; F487-F513 HydrophobicContact CB-CE2 4.3Å; F487-F513 HydrophobicContact CB-CZ 3.46Å; F487-F513 VanDerWaalsContact CB-CZ 3.46Å; F487-F513 HydrophobicContact CG-CZ 4.09Å; F487-L523 HydrophobicContact CB-CD1 4.41Å; F487-L523 HydrophobicContact CD1-CD1 4.17Å; F487-L523 HydrophobicContact CD1-CD2 4.27Å; F487-L523 HydrophobicContact CD1-CG 4.39Å; F487-T524 CarbonylContact C-O 3.49Å; F487-T524 WeakPolarHBondContact CA-O 3.41Å; F487-L525 HydrophobicContact CD1-CB 4.22Å; F487-L525 HydrophobicContact CD1-CD1 4.22Å; F487-L525 HydrophobicContact CD1-CG 4.09Å; F487-L525 HydrophobicContact CE1-CB 4.34Å; F487-L525 HydrophobicContact CE1-CD1 3.52Å; F487-L525 HydrophobicContact CE1-CG 3.84Å; F487-L525 HydrophobicContact CZ-CD1 4.07Å; F487-L525 HydrophobicContact CZ-CG 4.45Å; F487-L571 HydrophobicContact CE1-CD2 4.49Å; F487-L571 HydrophobicContact CZ-CD2 4.28Å
488	T	95.4	Very high	86.8	Confident	33 Å²	33	52 Å²	52	20%	0.202	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.7	176.7	-58.4	0	0	0	0	109.8	D492 V493 T524	T488-D492 WeakPolarHBondContact CA-O 3.4Å; T488-V493 HydrophobicContact CG2-CG2 4.13Å; T488-T524 PolarHBondContact N-O 2.98Å; T488-T524 PolarHBondContact O-N 2.67Å
489	L	93.5	Very high	88.6	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	104.4	166.1	-170.4	77.4	0	0	0	107.5	K491 D492 F513 F514 V515 Q521 I543	L489-K491 PolarHBondContact O-N 3.25Å; L489-D492 PolarHBondContact N-O 3.46Å; L489-D492 PolarHBondContact O-N 2.8Å; L489-F513 HydrophobicContact CB-CB 4.44Å; L489-F513 HydrophobicContact CB-CD1 4.06Å; L489-F513 HydrophobicContact CB-CG 4.42Å; L489-F513 HydrophobicContact CD2-CB 3.68Å; L489-F513 HydrophobicContact CD2-CG 4.49Å; L489-F514 VanDerWaalsContact CD2-O 3.29Å; L489-F514 WeakPolarHBondContact CD2-O 3.49Å; L489-V515 HydrophobicContact CD2-CG2 4.02Å; L489-Q521 HydrophobicContact CD1-CB 4.21Å; L489-I543 HydrophobicContact CD1-CD1 4.21Å; L489-I543 HydrophobicContact CD1-CG1 4.18Å
490	D	87.3	Confident	89.4	Confident	96 Å²	96	44.5 Å²	44.5	51%	0.513	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	-85.1	-168.8	-65.5	2.2	0	0	0	114.7	Q521	D490-Q521 PolarHBondContact OD2-NE2 3.45Å
491	K	85.9	Confident	89.9	Confident	200 Å²	200	46.5 Å²	46.5	87%	0.87	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-17.8	-176.9	-61	178.4	-174.4	170.5	0	113.3	L489	L489-K491 PolarHBondContact O-N 3.25Å
492	D	89.4	Confident	89.9	Confident	62 Å²	62	48.2 Å²	48.2	33%	0.332	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	131.3	175.2	-172	13.8	0	0	0	109.5	T488 L489 Q494 F513	T488-D492 WeakPolarHBondContact CA-O 3.4Å; L489-D492 PolarHBondContact N-O 3.46Å; L489-D492 PolarHBondContact O-N 2.8Å; D492-Q494 PolarHBondContact OD2-NE2 3.38Å; D492-F513 HydrophobicContact CB-CD1 4.4Å; D492-F513 WeakPolarHBondContact OD2-CD1 3.37Å
493	V	93.9	Very high	89.8	Confident	66 Å²	66	49.9 Å²	49.9	40%	0.4	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	101.9	-175.7	-176.7	0	0	0	0	109.5	E486 F487 T488	E486-V493 HydrophobicContact CG-CG1 3.81Å; F487-V493 CarbonylContact O-C 3.58Å; F487-V493 VanDerWaalsContact O-CA 3.3Å; F487-V493 WeakPolarHBondContact O-CA 3.17Å; T488-V493 HydrophobicContact CG2-CG2 4.13Å
494	Q	93.3	Very high	89.7	Confident	45 Å²	45	54 Å²	54	21%	0.21	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	149.1	-178.6	-56.9	-176.3	28.6	0	0	110.4	F487 D492 F511 N512 F513	F487-Q494 PolarHBondContact N-O 3.1Å; F487-Q494 PolarHBondContact O-N 2.82Å; D492-Q494 PolarHBondContact OD2-NE2 3.38Å; Q494-F511 HydrophobicContact CB-CD1 3.94Å; Q494-N512 PolarHBondContact NE2-O 3.28Å; Q494-F513 HydrophobicContact CB-CE1 3.85Å; Q494-F513 HydrophobicContact CB-CZ 3.88Å; Q494-F513 HydrophobicContact CG-CD1 4.37Å; Q494-F513 HydrophobicContact CG-CE1 3.6Å; Q494-F513 HydrophobicContact CG-CZ 4.04Å
495	K	93.8	Very high	89.5	Confident	113 Å²	113	52.9 Å²	52.9	49%	0.491	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	139.5	-170.4	-49.8	-168.2	-170.9	-156	0	112	Y484 V485 E486	Y484-K495 HydrophobicContact CE2-CD 4.18Å; V485-K495 CarbonylContact O-C 3.54Å; V485-K495 WeakPolarHBondContact O-CA 3.25Å; E486-K495 HydrophobicContact CG-CD 4.34Å; E486-K495 HydrophobicContact CG-CG 4.22Å; E486-K495 VanDerWaalsContact OE2-CE 3.22Å; E486-K495 WeakPolarHBondContact OE2-CE 3.36Å; E486-K495 IonicContact OE2-NZ 2.72Å; E486-K495 PolarHBondContact OE2-NZ 3.04Å
496	S	93	Very high	89.1	Confident	11 Å²	11	57 Å²	57	8%	0.077	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-74.4	161.2	174.2	79.7	0	0	0	0	112.4	V485 W507	V485-S496 PolarHBondContact N-OG 2.98Å; V485-S496 PolarHBondContact O-N 3.01Å; S496-W507 PolarHBondContact OG-NE1 2.72Å
497	K	88.1	Confident	88.8	Confident	132 Å²	132	56.5 Å²	56.5	57%	0.574	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-54.3	153.6	158.4	-60.1	167.9	-169.8	169.5	0	110	W507	K497-W507 PolarHBondContact O-NE1 2.78Å
498	V	86.9	Confident	88.3	Confident	24 Å²	24	61 Å²	61	15%	0.145	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-83.8	128	178.9	-173.8	0	0	0	0	110.8	Y500 H530	V498-Y500 HydrophobicContact CB-CD2 4.23Å; V498-Y500 HydrophobicContact CB-CE2 3.62Å; V498-Y500 HydrophobicContact CG1-CD1 4.19Å; V498-Y500 HydrophobicContact CG1-CD2 3.98Å; V498-Y500 HydrophobicContact CG1-CE1 3.88Å; V498-Y500 HydrophobicContact CG1-CE2 3.69Å; V498-Y500 HydrophobicContact CG1-CG 4.24Å; V498-Y500 WeakPolarHBondContact O-CD2 3.39Å; V498-H530 HydrophobicContact CG1-CB 3.72Å; V498-H530 HydrophobicContact CG2-CB 4.31Å
499	A	84.5	Confident	88	Confident	8 Å²	8	60.7 Å²	60.7	7%	0.066	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-97.1	108	170.5	0	0	0	0	0	109.3	N482 S483 P505	N482-A499 CarbonylContact C-O 3.56Å; S483-A499 PolarHBondContact N-O 3Å; S483-A499 PolarHBondContact O-N 2.62Å; A499-P505 HydrophobicContact CB-CB 3.35Å
500	Y	82.1	Confident	87.8	Confident	48 Å²	48	61.7 Å²	61.7	19%	0.188	32%	0.321	C	S	.	.			trans	-84.6	143.9	-173.9	-66.2	-93.1	0	0	0	112.8	M143 N482 V498 S502 H530	M143-Y500 HydrophobicContact CB-CE2 4.43Å; M143-Y500 HydrophobicContact CE-CD2 3.78Å; M143-Y500 WeakPolarHBondContact O-CE2 3.36Å; M143-Y500 HydrophobicContact SD-CD2 3.57Å; M143-Y500 VanDerWaalsContact SD-CD2 3.57Å; M143-Y500 HydrophobicContact SD-CE2 4.34Å; M143-Y500 HydrophobicContact SD-CG 4.33Å; N482-Y500 HydrophobicContact CB-CD1 4.05Å; N482-Y500 WeakPolarHBondContact OD1-CA 3.47Å; V498-Y500 HydrophobicContact CB-CD2 4.23Å; V498-Y500 HydrophobicContact CB-CE2 3.62Å; V498-Y500 HydrophobicContact CG1-CD1 4.19Å; V498-Y500 HydrophobicContact CG1-CD2 3.98Å; V498-Y500 HydrophobicContact CG1-CE1 3.88Å; V498-Y500 HydrophobicContact CG1-CE2 3.69Å; V498-Y500 HydrophobicContact CG1-CG 4.24Å; V498-Y500 WeakPolarHBondContact O-CD2 3.39Å; Y500-S502 PolarHBondContact O-N 2.64Å; Y500-S502 VanDerWaalsContact O-N 3.1Å; Y500-H530 AromaticContact CE1-CD2 3.93Å
501	A	80	Confident	88	Confident	54 Å²	54	58 Å²	58	45%	0.446	30%	0.3	S	S	.	.	S	Bend	trans	57.1	17	169.7	0	0	0	0	0	117.6	V479 G480 P481 N482	V479-A501 HydrophobicContact CG1-CB 3.91Å; G480-A501 WeakPolarHBondContact CA-O 3.45Å; G480-A501 PolarHBondContact N-O 2.87Å; P481-A501 PolarHBondContact O-N 2.9Å; P481-A501 VanDerWaalsContact O-N 3.17Å; N482-A501 PolarHBondContact OD1-N 3.16Å
502	S	82.3	Confident	88.3	Confident	40 Å²	40	49.2 Å²	49.2	28%	0.28	26%	0.263	S	S	.	.			trans	-117.1	135.8	-175.3	-170.3	0	0	0	0	113.5	P481 Y500 N504	P481-S502 WeakPolarHBondContact CD-O 3.37Å; P481-S502 WeakPolarHBondContact CG-O 3.31Å; P481-S502 PolarHBondContact O-N 2.78Å; Y500-S502 PolarHBondContact O-N 2.64Å; Y500-S502 VanDerWaalsContact O-N 3.1Å; S502-N504 VanDerWaalsContact C-N 3.34Å; S502-N504 PolarHBondContact OG-N 3.11Å; S502-N504 PolarHBondContact OG-O 3.43Å
503	K	84.4	Confident	88.6	Confident	60 Å²	60	46.2 Å²	46.2	26%	0.261	25%	0.247	S	C	.	.	S	Bend	trans	-76.1	-22.7	164.9	-86.7	-153.7	166.7	-132.4	0	113.4	N451 L452 E458 P505	N451-K503 PolarHBondContact N-O 3.05Å; L452-K503 WeakPolarHBondContact CB-O 3.05Å; L452-K503 PolarHBondContact N-O 3.27Å; L452-K503 VanDerWaalsContact O-CD 3.25Å; L452-K503 WeakPolarHBondContact O-CD 3.49Å; L452-K503 WeakPolarHBondContact O-CE 3.34Å; L452-K503 WeakPolarHBondContact O-CG 3.5Å; L452-K503 PolarHBondContact O-NZ 2.77Å; E458-K503 IonicContact OE1-NZ 2.85Å; E458-K503 PolarHBondContact OE1-NZ 3.26Å; E458-K503 IonicContact OE2-NZ 2.65Å; E458-K503 PolarHBondContact OE2-NZ 2.86Å; K503-P505 VanDerWaalsContact C-CD 3.4Å; K503-P505 WeakPolarHBondContact O-CD 3.42Å
504	N	87.6	Confident	88.5	Confident	86 Å²	86	44.8 Å²	44.8	46%	0.46	24%	0.235	S	C	.	.	S	Bend	trans	-119.4	73.4	179.2	-59.3	-17.9	0	0	0	107.6	A449 S450 N451 S502	A449-N504 CarbonylContact O-C 3.48Å; A449-N504 WeakPolarHBondContact O-CA 3.42Å; S450-N504 WeakPolarHBondContact CA-OD1 3.14Å; N451-N504 PolarHBondContact N-OD1 2.96Å; S502-N504 VanDerWaalsContact C-N 3.34Å; S502-N504 PolarHBondContact OG-N 3.11Å; S502-N504 PolarHBondContact OG-O 3.43Å
505	P	89.2	Confident	88.5	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	23%	0.225	C	C	.	.			trans	-71.2	140.3	-179.8	31.6	-38.2	0	0	0	111	N448 A449 L452 A499 K503 W507	N448-P505 CarbonylContact C-O 3.43Å; N448-P505 WeakPolarHBondContact CA-O 3.37Å; N448-P505 VanDerWaalsContact CB-O 3.28Å; N448-P505 WeakPolarHBondContact CB-O 3.38Å; A449-P505 HydrophobicContact CB-CG 3.95Å; A449-P505 PolarHBondContact N-O 3.45Å; A449-P505 WeakPolarHBondContact O-CD 3.34Å; L452-P505 HydrophobicContact CD1-CG 3.61Å; A499-P505 HydrophobicContact CB-CB 3.35Å; K503-P505 VanDerWaalsContact C-CD 3.4Å; K503-P505 WeakPolarHBondContact O-CD 3.42Å; P505-W507 HydrophobicContact CB-CD2 4.39Å; P505-W507 HydrophobicContact CB-CH2 3.9Å; P505-W507 HydrophobicContact CB-CZ2 3.64Å; P505-W507 HydrophobicContact CB-CZ3 4.33Å; P505-W507 HydrophobicContact CG-CE3 4.45Å; P505-W507 HydrophobicContact CG-CH2 3.27Å; P505-W507 HydrophobicContact CG-CZ2 3.51Å; P505-W507 HydrophobicContact CG-CZ3 3.79Å
506	V	88.1	Confident	88.3	Confident	86 Å²	86	42 Å²	42	52%	0.521	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.2	171.2	-179.9	0	0	0	0	107.4	N448 E508	N448-V506 HydrophobicContact CB-CB 4.43Å; N448-V506 HydrophobicContact CB-CG2 3.99Å; V506-E508 HydrophobicContact CG1-CG 3.82Å
507	W	88.6	Confident	88.1	Confident	16 Å²	16	43.9 Å²	43.9	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	-36.6	-176.1	-67.4	-72.1	0	0	0	113.2	L446 D447 A449 V485 S496 K497 P505 Q509 V527 I569	L446-W507 HydrophobicContact CD1-CE3 3.66Å; L446-W507 HydrophobicContact CD1-CZ3 3.95Å; L446-W507 HydrophobicContact CD2-CB 3.79Å; L446-W507 HydrophobicContact CD2-CD2 3.78Å; L446-W507 HydrophobicContact CD2-CE3 3.78Å; L446-W507 HydrophobicContact CD2-CG 3.83Å; L446-W507 HydrophobicContact CG-CB 3.96Å; L446-W507 HydrophobicContact CG-CD2 4.17Å; L446-W507 HydrophobicContact CG-CE3 3.72Å; L446-W507 HydrophobicContact CG-CG 4.32Å; L446-W507 HydrophobicContact CG-CZ3 4.49Å; D447-W507 PolarHBondContact O-N 2.7Å; A449-W507 HydrophobicContact CB-CH2 3.88Å; A449-W507 HydrophobicContact CB-CZ3 3.66Å; V485-W507 HydrophobicContact CG2-CD2 4.27Å; V485-W507 HydrophobicContact CG2-CE3 4.15Å; V485-W507 HydrophobicContact CG2-CH2 3.5Å; V485-W507 VanDerWaalsContact CG2-CH2 3.5Å; V485-W507 HydrophobicContact CG2-CZ2 3.67Å; V485-W507 HydrophobicContact CG2-CZ3 3.76Å; S496-W507 PolarHBondContact OG-NE1 2.72Å; K497-W507 PolarHBondContact O-NE1 2.78Å; P505-W507 HydrophobicContact CB-CD2 4.39Å; P505-W507 HydrophobicContact CB-CH2 3.9Å; P505-W507 HydrophobicContact CB-CZ2 3.64Å; P505-W507 HydrophobicContact CB-CZ3 4.33Å; P505-W507 HydrophobicContact CG-CE3 4.45Å; P505-W507 HydrophobicContact CG-CH2 3.27Å; P505-W507 HydrophobicContact CG-CZ2 3.51Å; P505-W507 HydrophobicContact CG-CZ3 3.79Å; W507-Q509 WeakPolarHBondContact O-CG 3.4Å; W507-Q509 PolarHBondContact O-N 3.25Å; W507-Q509 PolarHBondContact O-NE2 3.47Å; W507-V527 HydrophobicContact CH2-CG1 4.38Å; W507-I569 HydrophobicContact CZ3-CD1 4.28Å
508	E	87.9	Confident	88	Confident	95 Å²	95	37.7 Å²	37.7	44%	0.444	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	45.8	53.3	179.7	-65	176.5	-174.3	0	0	113	R294 L446 D447 V506	R294-E508 IonicContact CZ-OE2 2.74Å; R294-E508 IonicContact NH1-OE2 3.54Å; R294-E508 PolarHBondContact NH1-OE2 2.84Å; L446-E508 WeakPolarHBondContact O-CA 3.34Å; L446-E508 PolarHBondContact O-N 2.74Å; L446-E508 VanDerWaalsContact O-N 3.13Å; D447-E508 PolarHBondContact O-N 2.81Å; D447-E508 VanDerWaalsContact O-N 3.16Å; V506-E508 HydrophobicContact CG1-CG 3.82Å
509	Q	87.9	Confident	88	Confident	26 Å²	26	42.2 Å²	42.2	12%	0.121	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.1	-171.6	-88.1	156.1	79.3	0	0	112.5	L446 W507 F511	L446-Q509 WeakPolarHBondContact CB-O 3.49Å; L446-Q509 PolarHBondContact N-O 2.84Å; L446-Q509 PolarHBondContact O-N 3.02Å; W507-Q509 WeakPolarHBondContact O-CG 3.4Å; W507-Q509 PolarHBondContact O-N 3.25Å; W507-Q509 PolarHBondContact O-NE2 3.47Å; Q509-F511 HydrophobicContact CB-CE2 3.81Å; Q509-F511 HydrophobicContact CB-CZ 3.94Å
510	G	89.6	Confident	88.1	Confident	26 Å²	26	46.8 Å²	46.8	27%	0.268	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	143.7	172.7	0	0	0	0	0	113.3	F295 V444	F295-G510 VanDerWaalsContact CZ-C 3.49Å; F295-G510 VanDerWaalsContact CZ-CA 3.49Å; V444-G510 CarbonylContact O-C 3.5Å; V444-G510 WeakPolarHBondContact O-CA 3.21Å
511	F	91.8	Very high	88.6	Confident	18 Å²	18	44.9 Å²	44.9	8%	0.079	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.7	178.7	-55.8	-88.7	0	0	0	109.1	V444 L446 F487 Q494 Q509 F513	V444-F511 HydrophobicContact CB-CB 4.44Å; V444-F511 PolarHBondContact N-O 3.07Å; V444-F511 PolarHBondContact O-N 2.86Å; L446-F511 HydrophobicContact CB-CE2 4.02Å; L446-F511 HydrophobicContact CD2-CE2 4.22Å; F487-F511 HydrophobicContact CD2-CD2 4.09Å; F487-F511 HydrophobicContact CD2-CE2 4.15Å; F487-F511 HydrophobicContact CD2-CG 4.34Å; F487-F511 HydrophobicContact CD2-CZ 4.43Å; F487-F511 AromaticContact CE2-CD2 3.67Å; F487-F511 HydrophobicContact CE2-CD2 3.67Å; F487-F511 AromaticContact CE2-CE2 3.55Å; F487-F511 HydrophobicContact CE2-CE2 3.55Å; F487-F511 HydrophobicContact CE2-CG 4.36Å; F487-F511 HydrophobicContact CE2-CZ 4.14Å; F487-F511 HydrophobicContact CZ-CD2 4.36Å; F487-F511 HydrophobicContact CZ-CE2 4.43Å; Q494-F511 HydrophobicContact CB-CD1 3.94Å; Q509-F511 HydrophobicContact CB-CE2 3.81Å; Q509-F511 HydrophobicContact CB-CZ 3.94Å; F511-F513 HydrophobicContact CB-CD2 4.49Å; F511-F513 HydrophobicContact CB-CE2 3.61Å; F511-F513 HydrophobicContact CB-CZ 3.98Å
512	N	92.9	Very high	89.3	Confident	16 Å²	16	46.3 Å²	46.3	9%	0.086	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.7	177	-70.8	-52.8	0	0	0	109.3	V360 L442 A443 Q494	V360-N512 HydrophobicContact CG2-CB 4.13Å; L442-N512 WeakPolarHBondContact O-CA 3.22Å; A443-N512 WeakPolarHBondContact CB-OD1 3.49Å; Q494-N512 PolarHBondContact NE2-O 3.28Å
513	F	93.8	Very high	89.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	151.1	177.5	-54.7	-93.3	0	0	0	110.5	M441 L442 V444 F487 L489 D492 Q494 F511 L523	M441-F513 WeakPolarHBondContact CA-O 3.41Å; L442-F513 HydrophobicContact CB-CB 4.35Å; L442-F513 HydrophobicContact CD2-CD2 4.49Å; L442-F513 PolarHBondContact N-O 3.31Å; L442-F513 PolarHBondContact O-N 3.12Å; V444-F513 HydrophobicContact CB-CE2 4.25Å; V444-F513 HydrophobicContact CG2-CD2 4.01Å; V444-F513 HydrophobicContact CG2-CE2 3.95Å; F487-F513 HydrophobicContact CB-CE1 4.1Å; F487-F513 HydrophobicContact CB-CE2 4.3Å; F487-F513 HydrophobicContact CB-CZ 3.46Å; F487-F513 VanDerWaalsContact CB-CZ 3.46Å; F487-F513 HydrophobicContact CG-CZ 4.09Å; L489-F513 HydrophobicContact CB-CB 4.44Å; L489-F513 HydrophobicContact CB-CD1 4.06Å; L489-F513 HydrophobicContact CB-CG 4.42Å; L489-F513 HydrophobicContact CD2-CB 3.68Å; L489-F513 HydrophobicContact CD2-CG 4.49Å; D492-F513 HydrophobicContact CB-CD1 4.4Å; D492-F513 WeakPolarHBondContact OD2-CD1 3.37Å; Q494-F513 HydrophobicContact CB-CE1 3.85Å; Q494-F513 HydrophobicContact CB-CZ 3.88Å; Q494-F513 HydrophobicContact CG-CD1 4.37Å; Q494-F513 HydrophobicContact CG-CE1 3.6Å; Q494-F513 HydrophobicContact CG-CZ 4.04Å; F511-F513 HydrophobicContact CB-CD2 4.49Å; F511-F513 HydrophobicContact CB-CE2 3.61Å; F511-F513 HydrophobicContact CB-CZ 3.98Å; F513-L523 HydrophobicContact CD2-CD1 4.39Å; F513-L523 HydrophobicContact CE2-CD1 4.23Å; F513-L523 HydrophobicContact CZ-CD1 4.45Å
514	F	93.5	Very high	90.5	Very high	36 Å²	36	43.3 Å²	43.3	16%	0.158	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.4	175.2	-70.1	-57.7	0	0	0	110.8	V301 E358 V360 S438 M441 L489	V301-F514 HydrophobicContact CB-CE1 4.46Å; V301-F514 HydrophobicContact CG1-CE1 3.69Å; V301-F514 HydrophobicContact CG1-CZ 4.02Å; V301-F514 HydrophobicContact CG2-CE1 3.86Å; E358-F514 HydrophobicContact CB-CD2 4.26Å; E358-F514 HydrophobicContact CB-CE1 4.15Å; E358-F514 HydrophobicContact CB-CE2 3.75Å; E358-F514 HydrophobicContact CB-CZ 3.68Å; E358-F514 WeakPolarHBondContact O-CE2 3.41Å; E358-F514 WeakPolarHBondContact O-CZ 3.03Å; V360-F514 HydrophobicContact CG2-CE1 4.06Å; V360-F514 HydrophobicContact CG2-CE2 4.43Å; V360-F514 HydrophobicContact CG2-CZ 3.63Å; S438-F514 WeakPolarHBondContact OG-CB 3.39Å; M441-F514 HydrophobicContact CB-CD1 4.46Å; M441-F514 HydrophobicContact CG-CD1 4.32Å; M441-F514 HydrophobicContact CG-CE1 4.34Å; L489-F514 VanDerWaalsContact CD2-O 3.29Å; L489-F514 WeakPolarHBondContact CD2-O 3.49Å
515	V	92.2	Very high	90.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.6	-174.1	178.7	0	0	0	0	108.5	S438 C439 A440 L442 L489 V518 Q521 I543 L575	S438-V515 CarbonylContact C-O 3.57Å; S438-V515 WeakPolarHBondContact CA-O 3.1Å; C439-V515 PolarHBondContact N-O 2.55Å; C439-V515 PolarHBondContact SG-O 2.89Å; A440-V515 HydrophobicContact CB-CB 3.99Å; A440-V515 HydrophobicContact CB-CG1 4.32Å; A440-V515 PolarHBondContact N-O 3.39Å; A440-V515 VanDerWaalsContact N-O 3.12Å; A440-V515 WeakPolarHBondContact O-CB 3.47Å; A440-V515 PolarHBondContact O-N 3.16Å; L442-V515 HydrophobicContact CB-CG2 3.91Å; L489-V515 HydrophobicContact CD2-CG2 4.02Å; V515-V518 HydrophobicContact CG1-CG2 3.95Å; V515-Q521 VanDerWaalsContact CG1-OE1 3.3Å; V515-I543 HydrophobicContact CG1-CG2 4.23Å; V515-L575 HydrophobicContact CG2-CD1 4.11Å
516	Q	90.9	Very high	91.2	Very high	100 Å²	100	42 Å²	42	47%	0.467	22%	0.218	S	C	.	.	S	Bend	trans	-86.8	-37.8	176.7	-68.7	178	-20.6	0	0	111.5	G436 C439	G436-Q516 PolarHBondContact O-NE2 2.99Å; C439-Q516 PolarHBondContact SG-O 3.26Å
517	N	87.9	Confident	91.5	Very high	50 Å²	50	37.9 Å²	37.9	27%	0.267	19%	0.193	S	C	.	.			trans	-145.5	105.3	-179.9	-172.9	-33.3	0	0	0	111.5	K519 T520 Q521	N517-K519 PolarHBondContact O-N 3.33Å; N517-K519 WeakPolarHBondContact OD1-CA 3.36Å; N517-K519 WeakPolarHBondContact OD1-CB 3.42Å; N517-K519 PolarHBondContact OD1-N 3.26Å; N517-T520 WeakPolarHBondContact CB-OG1 3.47Å; N517-T520 VanDerWaalsContact CG-OG1 3.31Å; N517-T520 PolarHBondContact O-N 3.32Å; N517-T520 PolarHBondContact OD1-N 3.01Å; N517-Q521 WeakPolarHBondContact O-CB 3.35Å; N517-Q521 VanDerWaalsContact O-CG 3.31Å; N517-Q521 WeakPolarHBondContact O-CG 3.22Å; N517-Q521 PolarHBondContact O-N 3.45Å
518	V	86.3	Confident	91.7	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-33.6	179	169.8	0	0	0	0	113.1	L430 A440 V515 I543 L544 F547	L430-V518 HydrophobicContact CD1-CG2 3.97Å; L430-V518 HydrophobicContact CD2-CG2 4.49Å; A440-V518 HydrophobicContact CB-CG2 4.33Å; V515-V518 HydrophobicContact CG1-CG2 3.95Å; V518-I543 HydrophobicContact CG1-CG2 4.33Å; V518-L544 HydrophobicContact CG1-CD1 4.44Å; V518-L544 PolarHBondContact O-N 3.2Å; V518-L544 VanDerWaalsContact O-N 3.13Å; V518-F547 HydrophobicContact CB-CE2 4.23Å; V518-F547 HydrophobicContact CG1-CD2 3.58Å; V518-F547 HydrophobicContact CG1-CE2 3.42Å; V518-F547 VanDerWaalsContact CG1-CE2 3.42Å; V518-F547 HydrophobicContact CG1-CG 4.3Å; V518-F547 HydrophobicContact CG1-CZ 3.99Å; V518-F547 HydrophobicContact CG2-CE2 3.81Å; V518-F547 HydrophobicContact CG2-CZ 4.09Å
519	K	85.9	Confident	91.7	Very high	119 Å²	119	34.1 Å²	34.1	52%	0.517	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-30.4	-172.7	-55.6	-176.3	179.8	74.9	0	112.7	E432 N517	E432-K519 IonicContact OE1-NZ 3.52Å; E432-K519 PolarHBondContact OE1-NZ 3.46Å; E432-K519 IonicContact OE2-NZ 2.7Å; E432-K519 PolarHBondContact OE2-NZ 3.35Å; N517-K519 PolarHBondContact O-N 3.33Å; N517-K519 WeakPolarHBondContact OD1-CA 3.36Å; N517-K519 WeakPolarHBondContact OD1-CB 3.42Å; N517-K519 PolarHBondContact OD1-N 3.26Å
520	T	88.2	Confident	91.5	Very high	104 Å²	104	36.4 Å²	36.4	64%	0.638	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-26	-172.9	60.7	0	0	0	0	114.1	N517	N517-T520 WeakPolarHBondContact CB-OG1 3.47Å; N517-T520 VanDerWaalsContact CG-OG1 3.31Å; N517-T520 PolarHBondContact O-N 3.32Å; N517-T520 PolarHBondContact OD1-N 3.01Å
521	Q	91.9	Very high	90.9	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.037	20%	0.2	C	C	.	.			trans	-81.5	149.2	-177.5	-64.9	-178.4	-54.1	0	0	112	L489 D490 V515 N517 I543	L489-Q521 HydrophobicContact CD1-CB 4.21Å; D490-Q521 PolarHBondContact OD2-NE2 3.45Å; V515-Q521 VanDerWaalsContact CG1-OE1 3.3Å; N517-Q521 WeakPolarHBondContact O-CB 3.35Å; N517-Q521 VanDerWaalsContact O-CG 3.31Å; N517-Q521 WeakPolarHBondContact O-CG 3.22Å; N517-Q521 PolarHBondContact O-N 3.45Å; Q521-I543 HydrophobicContact CB-CG1 4.37Å; Q521-I543 WeakPolarHBondContact O-CG1 3.39Å; Q521-I543 PolarHBondContact O-N 3.04Å; Q521-I543 VanDerWaalsContact O-N 3.1Å
522	E	94.4	Very high	90.2	Very high	84 Å²	84	45.6 Å²	45.6	39%	0.393	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.4	179.2	61.9	178.7	-162.9	0	0	111	T524 N540	E522-T524 PolarHBondContact O-N 3.03Å; E522-N540 WeakPolarHBondContact CB-OD1 3.36Å; E522-N540 PolarHBondContact OE1-ND2 2.92Å; E522-N540 PolarHBondContact OE2-ND2 3.4Å; E522-N540 PolarHBondContact OE2-OD1 2.7Å
523	L	95.7	Very high	89.7	Confident	2 Å²	2	52 Å²	52	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	104	175.1	-179.9	71.3	0	0	0	108.8	L442 V444 F487 F513 N540 I541 I543	L442-L523 HydrophobicContact CD2-CB 4.18Å; L442-L523 HydrophobicContact CD2-CD1 4.23Å; L442-L523 HydrophobicContact CD2-CD2 4.05Å; L442-L523 HydrophobicContact CD2-CG 4.38Å; V444-L523 HydrophobicContact CG1-CD2 4.38Å; V444-L523 HydrophobicContact CG2-CD2 3.74Å; F487-L523 HydrophobicContact CB-CD1 4.41Å; F487-L523 HydrophobicContact CD1-CD1 4.17Å; F487-L523 HydrophobicContact CD1-CD2 4.27Å; F487-L523 HydrophobicContact CD1-CG 4.39Å; F513-L523 HydrophobicContact CD2-CD1 4.39Å; F513-L523 HydrophobicContact CE2-CD1 4.23Å; F513-L523 HydrophobicContact CZ-CD1 4.45Å; L523-N540 PolarHBondContact O-OD1 2.86Å; L523-I541 HydrophobicContact CB-CB 4.43Å; L523-I541 PolarHBondContact N-O 2.64Å; L523-I541 PolarHBondContact O-N 2.8Å; L523-I543 HydrophobicContact CB-CD1 3.96Å
524	T	96	Very high	89.2	Confident	34 Å²	34	53.5 Å²	53.5	21%	0.209	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	133.8	169.7	-75.3	0	0	0	0	110.1	F487 T488 E522 Q526	F487-T524 CarbonylContact C-O 3.49Å; F487-T524 WeakPolarHBondContact CA-O 3.41Å; T488-T524 PolarHBondContact N-O 2.98Å; T488-T524 PolarHBondContact O-N 2.67Å; E522-T524 PolarHBondContact O-N 3.03Å; T524-Q526 HydrophobicContact CG2-CG 4.13Å
525	L	96.4	Very high	89.1	Confident	2 Å²	2	54 Å²	54	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130	175.4	-175.8	170.9	0	0	0	108.9	V485 E486 F487 V527 S538 L539 I569 L571	V485-L525 HydrophobicContact CG1-CD1 4.13Å; V485-L525 HydrophobicContact CG1-CD2 3.65Å; V485-L525 HydrophobicContact CG1-CG 3.57Å; E486-L525 WeakPolarHBondContact O-CA 3.28Å; F487-L525 HydrophobicContact CD1-CB 4.22Å; F487-L525 HydrophobicContact CD1-CD1 4.22Å; F487-L525 HydrophobicContact CD1-CG 4.09Å; F487-L525 HydrophobicContact CE1-CB 4.34Å; F487-L525 HydrophobicContact CE1-CD1 3.52Å; F487-L525 HydrophobicContact CE1-CG 3.84Å; F487-L525 HydrophobicContact CZ-CD1 4.07Å; F487-L525 HydrophobicContact CZ-CG 4.45Å; L525-V527 HydrophobicContact CD2-CG2 3.76Å; L525-S538 CarbonylContact O-C 3.59Å; L525-S538 VanDerWaalsContact O-CA 3.28Å; L525-S538 WeakPolarHBondContact O-CA 3.41Å; L525-L539 HydrophobicContact CB-CB 4.24Å; L525-L539 HydrophobicContact CD1-CD2 4.36Å; L525-L539 PolarHBondContact N-O 2.92Å; L525-L539 PolarHBondContact O-N 2.83Å; L525-I569 HydrophobicContact CD1-CD1 3.87Å; L525-I569 HydrophobicContact CD2-CD1 3.96Å; L525-L571 HydrophobicContact CD1-CD1 3.5Å; L525-L571 VanDerWaalsContact CD1-CD1 3.5Å; L525-L571 HydrophobicContact CD1-CD2 4.03Å; L525-L571 HydrophobicContact CD1-CG 4.36Å
526	Q	95.4	Very high	88.9	Confident	58 Å²	58	54 Å²	54	27%	0.271	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	116.1	172.7	-60.1	-179.7	10.5	0	0	110.5	E486 T524 K528	E486-Q526 PolarHBondContact N-O 2.64Å; E486-Q526 PolarHBondContact O-N 3.49Å; T524-Q526 HydrophobicContact CG2-CG 4.13Å; Q526-K528 HydrophobicContact CB-CD 4.48Å; Q526-K528 HydrophobicContact CB-CG 4.4Å
527	V	94.2	Very high	89	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	126.5	169.1	-168.8	0	0	0	0	107.5	L452 Y484 V485 W507 L525 V535 L536 G537 L560 I569	L452-V527 HydrophobicContact CD1-CG1 3.91Å; L452-V527 HydrophobicContact CD2-CG1 4.38Å; Y484-V527 CarbonylContact O-C 3.5Å; Y484-V527 WeakPolarHBondContact O-CA 3.43Å; V485-V527 HydrophobicContact CG2-CG2 4.4Å; W507-V527 HydrophobicContact CH2-CG1 4.38Å; L525-V527 HydrophobicContact CD2-CG2 3.76Å; V527-V535 CarbonylContact O-C 3.54Å; V527-V535 WeakPolarHBondContact O-CA 3.19Å; V527-L536 HydrophobicContact CB-CB 4.26Å; V527-L536 HydrophobicContact CG1-CB 4.12Å; V527-L536 HydrophobicContact CG1-CD1 4.25Å; V527-L536 PolarHBondContact O-N 3Å; V527-G537 PolarHBondContact N-O 3.21Å; V527-L560 HydrophobicContact CG2-CD1 4.05Å; V527-L560 HydrophobicContact CG2-CD2 4.02Å; V527-I569 HydrophobicContact CG2-CD1 4.01Å
528	K	92.2	Very high	89.3	Confident	26 Å²	26	47.7 Å²	47.7	11%	0.113	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.6	-172.9	-72.8	177.1	179.4	174.5	0	111.8	S483 Y484 E486 Q526 Y534 V535	S483-K528 WeakPolarHBondContact CA-O 3.27Å; Y484-K528 HydrophobicContact CD1-CB 4.15Å; Y484-K528 WeakPolarHBondContact CD1-O 3.38Å; Y484-K528 HydrophobicContact CE1-CB 3.55Å; Y484-K528 HydrophobicContact CE2-CB 4.24Å; Y484-K528 PolarHBondContact N-O 3Å; Y484-K528 PolarHBondContact O-N 2.98Å; E486-K528 HydrophobicContact CB-CD 4.43Å; E486-K528 IonicContact OE1-NZ 3.24Å; E486-K528 PolarHBondContact OE1-NZ 2.88Å; Q526-K528 HydrophobicContact CB-CD 4.48Å; Q526-K528 HydrophobicContact CB-CG 4.4Å; K528-Y534 WeakPolarHBondContact CA-O 3.46Å; K528-V535 HydrophobicContact CG-CG2 4.19Å
529	D	88.4	Confident	89.7	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.032	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	133.8	167.9	-177.5	-94.7	0	0	0	110.7	N482 E531 K532 K533 Y534 L536	N482-D529 CarbonylContact O-C 3.59Å; N482-D529 WeakPolarHBondContact O-CA 3.49Å; D529-E531 PolarHBondContact O-N 3.37Å; D529-E531 PolarHBondContact OD1-N 3.06Å; D529-E531 VanDerWaalsContact OD1-N 3.14Å; D529-K532 WeakPolarHBondContact OD1-CB 3.12Å; D529-K532 PolarHBondContact OD1-N 2.75Å; D529-K533 WeakPolarHBondContact O-CA 3.36Å; D529-K533 PolarHBondContact O-N 3.47Å; D529-Y534 HydrophobicContact CB-CD1 3.79Å; D529-Y534 HydrophobicContact CB-CE1 3.24Å; D529-Y534 PolarHBondContact N-O 2.78Å; D529-L536 HydrophobicContact CB-CD1 4.47Å
530	H	83.7	Confident	90.2	Very high	74 Å²	74	45.5 Å²	45.5	34%	0.343	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-39.4	-174.5	173.1	61	0	0	0	113.4	N482 Y484 V498 Y500	N482-H530 HydrophobicContact CB-CB 4.19Å; N482-H530 WeakPolarHBondContact O-CB 3.25Å; N482-H530 PolarHBondContact O-N 2.91Å; Y484-H530 HydrophobicContact CD1-CB 4.28Å; V498-H530 HydrophobicContact CG1-CB 3.72Å; V498-H530 HydrophobicContact CG2-CB 4.31Å; Y500-H530 AromaticContact CE1-CD2 3.93Å
531	E	77.8	Confident	90.4	Very high	119 Å²	119	40.6 Å²	40.6	56%	0.556	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-47.9	-172.1	-66.6	174.4	-159.6	0	0	111	N482 D529	N482-E531 PolarHBondContact ND2-OE1 3.38Å; D529-E531 PolarHBondContact O-N 3.37Å; D529-E531 PolarHBondContact OD1-N 3.06Å; D529-E531 VanDerWaalsContact OD1-N 3.14Å
532	K	76.9	Confident	90.5	Very high	117 Å²	117	43.1 Å²	43.1	51%	0.509	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-9	-174.1	-65.5	174.5	-97.5	174.7	0	113.6	D455 D529 Y534	D455-K532 IonicContact OD1-NZ 3.86Å; D455-K532 PolarHBondContact OD1-NZ 3.38Å; D455-K532 IonicContact OD2-NZ 3.92Å; D529-K532 WeakPolarHBondContact OD1-CB 3.12Å; D529-K532 PolarHBondContact OD1-N 2.75Å; K532-Y534 HydrophobicContact CB-CD1 3.47Å; K532-Y534 VanDerWaalsContact CB-CD1 3.47Å; K532-Y534 HydrophobicContact CB-CE1 3.63Å; K532-Y534 HydrophobicContact CD-CD1 4.44Å; K532-Y534 HydrophobicContact CD-CE1 3.98Å; K532-Y534 HydrophobicContact CG-CE1 4.39Å; K532-Y534 PolarHBondContact O-N 2.65Å
533	K	81.4	Confident	90.4	Very high	151 Å²	151	39.1 Å²	39.1	66%	0.657	19%	0.192	S	C	*	.			trans	57.4	10.5	174.9	-60.3	-174.1	179.8	179.3	0	117.5	D529	D529-K533 WeakPolarHBondContact O-CA 3.36Å; D529-K533 PolarHBondContact O-N 3.47Å
534	Y	85	Confident	90.2	Very high	32 Å²	32	43.1 Å²	43.1	13%	0.125	21%	0.213	C	C	.	.			trans	-73.3	153.5	171.5	68.2	-75.5	0	0	0	110.9	K454 D455 Q456 K528 D529 K532 L536	K454-Y534 PolarHBondContact O-OH 2.57Å; D455-Y534 WeakPolarHBondContact CA-OH 3.47Å; Q456-Y534 HydrophobicContact CB-CD2 4Å; Q456-Y534 HydrophobicContact CB-CE2 4.34Å; K528-Y534 WeakPolarHBondContact CA-O 3.46Å; D529-Y534 HydrophobicContact CB-CD1 3.79Å; D529-Y534 HydrophobicContact CB-CE1 3.24Å; D529-Y534 PolarHBondContact N-O 2.78Å; K532-Y534 HydrophobicContact CB-CD1 3.47Å; K532-Y534 VanDerWaalsContact CB-CD1 3.47Å; K532-Y534 HydrophobicContact CB-CE1 3.63Å; K532-Y534 HydrophobicContact CD-CD1 4.44Å; K532-Y534 HydrophobicContact CD-CE1 3.98Å; K532-Y534 HydrophobicContact CG-CE1 4.39Å; K532-Y534 PolarHBondContact O-N 2.65Å; Y534-L536 HydrophobicContact CD2-CD2 4.15Å; Y534-L536 HydrophobicContact CE2-CD2 3.34Å; Y534-L536 HydrophobicContact CE2-CG 4.39Å
535	V	89.8	Confident	89.8	Confident	47 Å²	47	47.2 Å²	47.2	29%	0.285	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	130.4	179.5	178.2	0	0	0	0	109.7	V527 K528 G537	V527-V535 CarbonylContact O-C 3.54Å; V527-V535 WeakPolarHBondContact O-CA 3.19Å; K528-V535 HydrophobicContact CG-CG2 4.19Å; V535-G537 WeakPolarHBondContact CG1-O 3.44Å
536	L	89.2	Confident	89.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-21.7	175.3	-62.5	175.3	0	0	0	112.3	P453 P481 V527 D529 Y534 S563	P453-L536 HydrophobicContact CG-CB 4.34Å; P453-L536 HydrophobicContact CG-CD2 4.28Å; P453-L536 VanDerWaalsContact CG-O 3.31Å; P453-L536 WeakPolarHBondContact CG-O 3.35Å; P481-L536 HydrophobicContact CB-CD1 3.87Å; P481-L536 HydrophobicContact CG-CD1 4.28Å; V527-L536 HydrophobicContact CB-CB 4.26Å; V527-L536 HydrophobicContact CG1-CB 4.12Å; V527-L536 HydrophobicContact CG1-CD1 4.25Å; V527-L536 PolarHBondContact O-N 3Å; D529-L536 HydrophobicContact CB-CD1 4.47Å; Y534-L536 HydrophobicContact CD2-CD2 4.15Å; Y534-L536 HydrophobicContact CE2-CD2 3.34Å; Y534-L536 HydrophobicContact CE2-CG 4.39Å; L536-S563 WeakPolarHBondContact O-CA 3.39Å; L536-S563 WeakPolarHBondContact O-CB 3.12Å; L536-S563 PolarHBondContact O-OG 3.35Å
537	G	91.6	Very high	88.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	156.7	174.9	0	0	0	0	0	110.5	V527 V535 E561	V527-G537 PolarHBondContact N-O 3.21Å; V535-G537 WeakPolarHBondContact CG1-O 3.44Å; G537-E561 CarbonylContact C-O 3.5Å; G537-E561 WeakPolarHBondContact CA-O 3.24Å
538	S	94.2	Very high	87.9	Confident	17 Å²	17	52.9 Å²	52.9	12%	0.119	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	150.9	177.5	52.1	0	0	0	0	111.3	L525 E561	L525-S538 CarbonylContact O-C 3.59Å; L525-S538 VanDerWaalsContact O-CA 3.28Å; L525-S538 WeakPolarHBondContact O-CA 3.41Å; S538-E561 PolarHBondContact N-O 2.85Å; S538-E561 WeakPolarHBondContact O-CA 3.31Å; S538-E561 WeakPolarHBondContact O-CB 3.32Å; S538-E561 PolarHBondContact O-N 3.1Å; S538-E561 PolarHBondContact OG-O 2.82Å
539	L	96	Very high	87.5	Confident	17 Å²	17	53.9 Å²	53.9	9%	0.089	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.6	171.8	173.2	67.6	0	0	0	107.9	L525 I541 F558 L560 I569 L571	L525-L539 HydrophobicContact CB-CB 4.24Å; L525-L539 HydrophobicContact CD1-CD2 4.36Å; L525-L539 PolarHBondContact N-O 2.92Å; L525-L539 PolarHBondContact O-N 2.83Å; L539-I541 HydrophobicContact CD2-CD1 3.99Å; L539-I541 HydrophobicContact CD2-CG1 4.22Å; L539-I541 HydrophobicContact CG-CD1 4.41Å; L539-I541 HydrophobicContact CG-CG1 4.08Å; L539-F558 HydrophobicContact CD1-CB 4.05Å; L539-F558 HydrophobicContact CD1-CD1 4.14Å; L539-F558 HydrophobicContact CD1-CG 4.42Å; L539-F558 HydrophobicContact CD2-CB 3.5Å; L539-F558 HydrophobicContact CD2-CD1 3.97Å; L539-F558 HydrophobicContact CD2-CD2 4.25Å; L539-F558 HydrophobicContact CD2-CG 3.66Å; L539-F558 HydrophobicContact CG-CB 4.43Å; L539-L560 HydrophobicContact CB-CD2 4.28Å; L539-I569 HydrophobicContact CD2-CG2 3.99Å; L539-L571 HydrophobicContact CD2-CD1 3.56Å
540	N	95.4	Very high	86.9	Confident	57 Å²	57	58.5 Å²	58.5	31%	0.305	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.3	175.2	-172.3	14.8	0	0	0	109.6	E522 L523	E522-N540 WeakPolarHBondContact CB-OD1 3.36Å; E522-N540 PolarHBondContact OE1-ND2 2.92Å; E522-N540 PolarHBondContact OE2-ND2 3.4Å; E522-N540 PolarHBondContact OE2-OD1 2.7Å; L523-N540 PolarHBondContact O-OD1 2.86Å
541	I	93.6	Very high	86.7	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	97.3	-178	-51.3	179.5	0	0	0	108.9	L523 L539 I543 L554 F558 L571 V573	L523-I541 HydrophobicContact CB-CB 4.43Å; L523-I541 PolarHBondContact N-O 2.64Å; L523-I541 PolarHBondContact O-N 2.8Å; L539-I541 HydrophobicContact CD2-CD1 3.99Å; L539-I541 HydrophobicContact CD2-CG1 4.22Å; L539-I541 HydrophobicContact CG-CD1 4.41Å; L539-I541 HydrophobicContact CG-CG1 4.08Å; I541-I543 PolarHBondContact O-N 3.17Å; I541-L554 HydrophobicContact CG2-CD1 4.45Å; I541-F558 HydrophobicContact CD1-CE1 4.05Å; I541-F558 HydrophobicContact CD1-CZ 4.09Å; I541-L571 HydrophobicContact CD1-CD1 4.41Å; I541-V573 HydrophobicContact CD1-CG2 4.14Å
542	P	93.8	Very high	87.2	Confident	61 Å²	61	53.6 Å²	53.6	40%	0.396	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	126.7	171	-25.8	35.6	0	0	0	110.8	L544 R545	P542-L544 PolarHBondContact O-N 3.35Å; P542-R545 VanDerWaalsContact O-CB 3.27Å; P542-R545 WeakPolarHBondContact O-CB 3.24Å; P542-R545 PolarHBondContact O-N 3.07Å
543	I	92.3	Very high	87.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-64.1	-32.5	-170.3	-58.3	-53.3	0	0	0	111.5	L442 L489 V515 V518 Q521 L523 I541 R545 L546 L575	L442-I543 HydrophobicContact CD1-CD1 4.13Å; L442-I543 HydrophobicContact CD2-CD1 3.57Å; L442-I543 HydrophobicContact CG-CD1 4.47Å; L489-I543 HydrophobicContact CD1-CD1 4.21Å; L489-I543 HydrophobicContact CD1-CG1 4.18Å; V515-I543 HydrophobicContact CG1-CG2 4.23Å; V518-I543 HydrophobicContact CG1-CG2 4.33Å; Q521-I543 HydrophobicContact CB-CG1 4.37Å; Q521-I543 WeakPolarHBondContact O-CG1 3.39Å; Q521-I543 PolarHBondContact O-N 3.04Å; Q521-I543 VanDerWaalsContact O-N 3.1Å; L523-I543 HydrophobicContact CB-CD1 3.96Å; I541-I543 PolarHBondContact O-N 3.17Å; I543-R545 PolarHBondContact O-N 3.29Å; I543-R545 VanDerWaalsContact O-N 3.07Å; I543-L546 WeakPolarHBondContact O-CB 3.36Å; I543-L546 PolarHBondContact O-N 2.83Å; I543-L575 HydrophobicContact CG2-CD1 3.96Å; I543-L575 HydrophobicContact CG2-CD2 3.55Å; I543-L575 HydrophobicContact CG2-CG 4.42Å
544	L	89.9	Confident	88.4	Confident	85 Å²	85	42.9 Å²	42.9	45%	0.445	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-50.8	-28.8	171.5	-173.6	62.3	0	0	0	114.1	V518 P542 L546 F547	V518-L544 HydrophobicContact CG1-CD1 4.44Å; V518-L544 PolarHBondContact O-N 3.2Å; V518-L544 VanDerWaalsContact O-N 3.13Å; P542-L544 PolarHBondContact O-N 3.35Å; L544-L546 PolarHBondContact O-N 3.44Å; L544-F547 PolarHBondContact O-N 3.38Å
545	R	89.4	Confident	88.7	Confident	120 Å²	120	45.1 Å²	45.1	45%	0.453	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-61.5	-29.6	177.7	-177.4	175.6	170.1	-174.7	-6.9	112.5	P542 I543 F547 I549 L554	P542-R545 VanDerWaalsContact O-CB 3.27Å; P542-R545 WeakPolarHBondContact O-CB 3.24Å; P542-R545 PolarHBondContact O-N 3.07Å; I543-R545 PolarHBondContact O-N 3.29Å; I543-R545 VanDerWaalsContact O-N 3.07Å; R545-F547 VanDerWaalsContact C-N 3.33Å; R545-F547 PolarHBondContact O-N 3.36Å; R545-I549 HydrophobicContact CG-CD1 4.34Å; R545-I549 WeakPolarHBondContact O-CD1 3.27Å; R545-I549 WeakPolarHBondContact O-CG1 3.44Å; R545-L554 HydrophobicContact CG-CD1 4.47Å
546	L	88.2	Confident	88.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-74.1	-22.2	-177.2	-68.8	154.6	0	0	0	112.9	L442 I543 L544 N548 I549 M552 L554 V573 L575	L442-L546 HydrophobicContact CD1-CD1 3.59Å; I543-L546 WeakPolarHBondContact O-CB 3.36Å; I543-L546 PolarHBondContact O-N 2.83Å; L544-L546 PolarHBondContact O-N 3.44Å; L546-N548 VanDerWaalsContact C-N 3.35Å; L546-N548 PolarHBondContact O-N 2.64Å; L546-I549 PolarHBondContact O-N 2.93Å; L546-M552 WeakPolarHBondContact O-CA 3.41Å; L546-L554 HydrophobicContact CD2-CB 4.02Å; L546-L554 HydrophobicContact CD2-CD1 3.75Å; L546-L554 HydrophobicContact CD2-CG 3.84Å; L546-L554 HydrophobicContact CG-CD1 4.36Å; L546-V573 HydrophobicContact CD1-CG1 3.78Å; L546-V573 HydrophobicContact CD2-CG1 4.14Å; L546-V573 WeakPolarHBondContact CD2-O 3.46Å; L546-L575 HydrophobicContact CB-CB 4.08Å; L546-L575 HydrophobicContact CB-CD2 3.95Å; L546-L575 HydrophobicContact CD1-CB 4.03Å; L546-L575 HydrophobicContact CD1-CD2 4.34Å
547	F	81.6	Confident	89.1	Confident	30 Å²	30	50 Å²	50	13%	0.132	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-69.3	-30.4	-179.5	-95.9	-120.7	0	0	0	113.5	S427 L430 V518 L544 R545 I549 M552 L575 I577	S427-F547 WeakPolarHBondContact OG-CD1 3.39Å; S427-F547 VanDerWaalsContact OG-CE1 3.24Å; S427-F547 WeakPolarHBondContact OG-CE1 3.29Å; L430-F547 HydrophobicContact CD1-CZ 4.23Å; L430-F547 HydrophobicContact CD2-CE1 4.16Å; L430-F547 HydrophobicContact CD2-CZ 4.06Å; V518-F547 HydrophobicContact CB-CE2 4.23Å; V518-F547 HydrophobicContact CG1-CD2 3.58Å; V518-F547 HydrophobicContact CG1-CE2 3.42Å; V518-F547 VanDerWaalsContact CG1-CE2 3.42Å; V518-F547 HydrophobicContact CG1-CG 4.3Å; V518-F547 HydrophobicContact CG1-CZ 3.99Å; V518-F547 HydrophobicContact CG2-CE2 3.81Å; V518-F547 HydrophobicContact CG2-CZ 4.09Å; L544-F547 PolarHBondContact O-N 3.38Å; R545-F547 VanDerWaalsContact C-N 3.33Å; R545-F547 PolarHBondContact O-N 3.36Å; F547-I549 PolarHBondContact O-N 2.97Å; F547-M552 HydrophobicContact CD1-CE 4.04Å; F547-M552 HydrophobicContact CD2-CE 4.2Å; F547-M552 HydrophobicContact CE1-CE 4.06Å; F547-M552 HydrophobicContact CE2-CE 4.19Å; F547-M552 HydrophobicContact CE2-SD 4.39Å; F547-M552 HydrophobicContact CG-CE 4.11Å; F547-M552 HydrophobicContact CZ-CE 4.14Å; F547-L575 HydrophobicContact CD2-CD2 3.69Å; F547-L575 HydrophobicContact CE2-CD2 3.5Å; F547-L575 HydrophobicContact CE2-CG 4.47Å; F547-I577 HydrophobicContact CE1-CD1 4.14Å; F547-I577 HydrophobicContact CZ-CD1 3.67Å; F547-I577 HydrophobicContact CZ-CG1 4.03Å
548	N	75.5	Confident	89.3	Confident	149 Å²	149	50.1 Å²	50.1	80%	0.797	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-87.1	12.5	-177.7	-65.5	-9.5	0	0	0	113.1	L546	L546-N548 VanDerWaalsContact C-N 3.35Å; L546-N548 PolarHBondContact O-N 2.64Å
549	I	83.7	Confident	89.3	Confident	48 Å²	48	53.7 Å²	53.7	25%	0.246	30%	0.298	C	S	.	.	S	Bend	trans	-124.3	138.5	-169.9	-59.3	177.3	0	0	0	109.9	R545 L546 F547 S551 M552 C553 L554	R545-I549 HydrophobicContact CG-CD1 4.34Å; R545-I549 WeakPolarHBondContact O-CD1 3.27Å; R545-I549 WeakPolarHBondContact O-CG1 3.44Å; L546-I549 PolarHBondContact O-N 2.93Å; F547-I549 PolarHBondContact O-N 2.97Å; I549-S551 PolarHBondContact O-N 3.39Å; I549-M552 PolarHBondContact O-N 2.99Å; I549-C553 VanDerWaalsContact CG2-O 3.31Å; I549-C553 WeakPolarHBondContact CG2-O 3.42Å; I549-L554 HydrophobicContact CD1-CD1 4.09Å; I549-L554 HydrophobicContact CD1-CD2 3.54Å; I549-L554 HydrophobicContact CD1-CG 3.66Å
550	S	76.1	Confident	89.2	Confident	103 Å²	103	53.4 Å²	53.4	72%	0.72	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-49.8	130.2	177.9	50.7	0	0	0	0	112	M552	S550-M552 PolarHBondContact O-N 2.71Å; S550-M552 VanDerWaalsContact O-N 3.07Å
551	S	79.1	Confident	89	Confident	82 Å²	82	56.2 Å²	56.2	57%	0.573	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	57.7	16.9	-178.5	-52.1	0	0	0	0	115.2	I549 C553 R576	I549-S551 PolarHBondContact O-N 3.39Å; S551-C553 PolarHBondContact O-N 2.83Å; S551-R576 PolarHBondContact O-NH1 2.71Å
552	M	89.1	Confident	88.7	Confident	7 Å²	7	65.2 Å²	65.2	3%	0.034	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	50	40.6	-178.1	-62.5	-179.8	171.8	0	0	113.5	T425 L546 F547 I549 S550 L575 I577	T425-M552 WeakPolarHBondContact O-CE 3.33Å; L546-M552 WeakPolarHBondContact O-CA 3.41Å; F547-M552 HydrophobicContact CD1-CE 4.04Å; F547-M552 HydrophobicContact CD2-CE 4.2Å; F547-M552 HydrophobicContact CE1-CE 4.06Å; F547-M552 HydrophobicContact CE2-CE 4.19Å; F547-M552 HydrophobicContact CE2-SD 4.39Å; F547-M552 HydrophobicContact CG-CE 4.11Å; F547-M552 HydrophobicContact CZ-CE 4.14Å; I549-M552 PolarHBondContact O-N 2.99Å; S550-M552 PolarHBondContact O-N 2.71Å; S550-M552 VanDerWaalsContact O-N 3.07Å; M552-L575 HydrophobicContact CB-CB 4.27Å; M552-L575 WeakPolarHBondContact CB-O 3.43Å; M552-L575 PolarHBondContact O-N 3.06Å; M552-I577 HydrophobicContact CE-CD1 3.93Å; M552-I577 HydrophobicContact SD-CD1 4.28Å
553	C	91.1	Very high	88.5	Confident	34 Å²	34	63.2 Å²	63.2	23%	0.23	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.7	-173.3	-171.3	0	0	0	0	111.5	I549 S551 V573 T574	I549-C553 VanDerWaalsContact CG2-O 3.31Å; I549-C553 WeakPolarHBondContact CG2-O 3.42Å; S551-C553 PolarHBondContact O-N 2.83Å; C553-V573 WeakPolarHBondContact CA-O 3.46Å; C553-T574 HydrophobicContact CB-CG2 4.46Å; C553-T574 PolarHBondContact SG-OG1 3.19Å
554	L	91.5	Very high	88	Confident	10 Å²	10	63.9 Å²	63.9	5%	0.052	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	112.3	168.1	-85.5	168.8	0	0	0	108.6	I541 R545 L546 I549 F558 K572 V573	I541-L554 HydrophobicContact CG2-CD1 4.45Å; R545-L554 HydrophobicContact CG-CD1 4.47Å; L546-L554 HydrophobicContact CD2-CB 4.02Å; L546-L554 HydrophobicContact CD2-CD1 3.75Å; L546-L554 HydrophobicContact CD2-CG 3.84Å; L546-L554 HydrophobicContact CG-CD1 4.36Å; I549-L554 HydrophobicContact CD1-CD1 4.09Å; I549-L554 HydrophobicContact CD1-CD2 3.54Å; I549-L554 HydrophobicContact CD1-CG 3.66Å; L554-F558 HydrophobicContact CB-CZ 4.19Å; L554-F558 HydrophobicContact CD1-CZ 4.27Å; L554-K572 CarbonylContact O-C 3.6Å; L554-K572 VanDerWaalsContact O-CA 3.27Å; L554-K572 WeakPolarHBondContact O-CA 3.44Å; L554-V573 HydrophobicContact CB-CB 4.43Å; L554-V573 PolarHBondContact N-O 2.82Å; L554-V573 PolarHBondContact O-N 2.75Å
555	D	92.3	Very high	87.6	Confident	78 Å²	78	65.6 Å²	65.6	42%	0.417	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	97.3	173.6	-166.9	-14.8	0	0	0	108.5	K572	D555-K572 HydrophobicContact CB-CB 4.36Å; D555-K572 HydrophobicContact CB-CG 4.01Å; D555-K572 WeakPolarHBondContact OD2-CD 3.41Å; D555-K572 VanDerWaalsContact OD2-CE 3.3Å; D555-K572 WeakPolarHBondContact OD2-CE 3.37Å
556	Q	92.9	Very high	87.5	Confident	73 Å²	73	65 Å²	65	34%	0.341	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	167.8	-175.4	62.9	166.1	105.6	0	0	113.3	F558 L571	Q556-F558 HydrophobicContact CG-CD1 4.44Å; Q556-F558 HydrophobicContact CG-CD2 3.92Å; Q556-F558 HydrophobicContact CG-CE1 4.01Å; Q556-F558 HydrophobicContact CG-CE2 3.42Å; Q556-F558 VanDerWaalsContact CG-CE2 3.42Å; Q556-F558 HydrophobicContact CG-CG 4.41Å; Q556-F558 HydrophobicContact CG-CZ 3.48Å; Q556-F558 VanDerWaalsContact CG-CZ 3.48Å; Q556-F558 WeakPolarHBondContact O-CD2 3.44Å; Q556-F558 WeakPolarHBondContact O-CE2 3.37Å; Q556-L571 PolarHBondContact N-O 3.26Å; Q556-L571 VanDerWaalsContact N-O 3.15Å; Q556-L571 PolarHBondContact O-N 2.93Å; Q556-L571 VanDerWaalsContact O-N 3.1Å
557	N	94.3	Very high	87.8	Confident	76 Å²	76	65.2 Å²	65.2	41%	0.406	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138	159.4	-66.8	9.8	0	0	0	109.7	Q568 K570	N557-Q568 PolarHBondContact ND2-OE1 2.8Å; N557-K570 WeakPolarHBondContact OD1-CB 3.14Å; N557-K570 WeakPolarHBondContact OD1-CG 3.43Å
558	F	94.9	Very high	88.4	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.018	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.1	173.3	-65.6	-96.3	0	0	0	109.3	L539 I541 L554 Q556 Q568 I569 L571	L539-F558 HydrophobicContact CD1-CB 4.05Å; L539-F558 HydrophobicContact CD1-CD1 4.14Å; L539-F558 HydrophobicContact CD1-CG 4.42Å; L539-F558 HydrophobicContact CD2-CB 3.5Å; L539-F558 HydrophobicContact CD2-CD1 3.97Å; L539-F558 HydrophobicContact CD2-CD2 4.25Å; L539-F558 HydrophobicContact CD2-CG 3.66Å; L539-F558 HydrophobicContact CG-CB 4.43Å; I541-F558 HydrophobicContact CD1-CE1 4.05Å; I541-F558 HydrophobicContact CD1-CZ 4.09Å; L554-F558 HydrophobicContact CB-CZ 4.19Å; L554-F558 HydrophobicContact CD1-CZ 4.27Å; Q556-F558 HydrophobicContact CG-CD1 4.44Å; Q556-F558 HydrophobicContact CG-CD2 3.92Å; Q556-F558 HydrophobicContact CG-CE1 4.01Å; Q556-F558 HydrophobicContact CG-CE2 3.42Å; Q556-F558 VanDerWaalsContact CG-CE2 3.42Å; Q556-F558 HydrophobicContact CG-CG 4.41Å; Q556-F558 HydrophobicContact CG-CZ 3.48Å; Q556-F558 VanDerWaalsContact CG-CZ 3.48Å; Q556-F558 WeakPolarHBondContact O-CD2 3.44Å; Q556-F558 WeakPolarHBondContact O-CE2 3.37Å; F558-Q568 CarbonylContact O-C 3.5Å; F558-Q568 VanDerWaalsContact O-CA 3.25Å; F558-Q568 WeakPolarHBondContact O-CA 3.36Å; F558-I569 HydrophobicContact CB-CG2 4.09Å; F558-I569 PolarHBondContact N-O 3.1Å; F558-I569 PolarHBondContact O-N 3.17Å; F558-L571 HydrophobicContact CD2-CB 4Å; F558-L571 HydrophobicContact CD2-CD1 4.01Å; F558-L571 HydrophobicContact CD2-CG 4.23Å; F558-L571 HydrophobicContact CE2-CB 3.84Å; F558-L571 HydrophobicContact CE2-CD1 4.32Å
559	P	94.8	Very high	89.4	Confident	91 Å²	91	60.1 Å²	60.1	59%	0.591	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.5	169	30.3	-33.9	0	0	0	109.9
560	L	93.6	Very high	89.9	Confident	11 Å²	11	61 Å²	61	6%	0.058	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-90.5	119.2	175.8	-71.9	169.5	0	0	0	110.3	L452 V527 L539 S563 S567 I569	L452-L560 HydrophobicContact CD2-CD1 3.57Å; V527-L560 HydrophobicContact CG2-CD1 4.05Å; V527-L560 HydrophobicContact CG2-CD2 4.02Å; L539-L560 HydrophobicContact CB-CD2 4.28Å; L560-S563 VanDerWaalsContact CB-CB 3.48Å; L560-S563 VanDerWaalsContact O-CB 3.25Å; L560-S563 WeakPolarHBondContact O-CB 3.28Å; L560-S567 PolarHBondContact N-O 2.83Å; L560-I569 HydrophobicContact CD1-CB 4.36Å; L560-I569 HydrophobicContact CD2-CB 4.12Å; L560-I569 HydrophobicContact CD2-CG2 3.67Å; L560-I569 HydrophobicContact CG-CB 4.25Å; L560-I569 HydrophobicContact CG-CG2 4.1Å
561	E	91.7	Very high	90.8	Very high	116 Å²	116	56 Å²	56	54%	0.542	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-63.3	154.6	166.7	-61.4	-173.9	-172.8	0	0	110.6	G537 S538 S563	G537-E561 CarbonylContact C-O 3.5Å; G537-E561 WeakPolarHBondContact CA-O 3.24Å; S538-E561 PolarHBondContact N-O 2.85Å; S538-E561 WeakPolarHBondContact O-CA 3.31Å; S538-E561 WeakPolarHBondContact O-CB 3.32Å; S538-E561 PolarHBondContact O-N 3.1Å; S538-E561 PolarHBondContact OG-O 2.82Å; E561-S563 PolarHBondContact O-N 2.83Å; E561-S563 VanDerWaalsContact O-N 3.1Å
562	R	86.5	Confident	91.5	Very high	192 Å²	192	53.3 Å²	53.3	73%	0.725	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	34.3	176.5	-48.5	178.4	-171.2	-165.5	1.3	112.2
563	S	89.4	Confident	91.7	Very high	18 Å²	18	53 Å²	53	13%	0.126	28%	0.275	C	S	.	.	S	Bend	trans	-124.5	-162.5	-176.3	-154.9	0	0	0	0	111.4	L536 L560 E561 S567	L536-S563 WeakPolarHBondContact O-CA 3.39Å; L536-S563 WeakPolarHBondContact O-CB 3.12Å; L536-S563 PolarHBondContact O-OG 3.35Å; L560-S563 VanDerWaalsContact CB-CB 3.48Å; L560-S563 VanDerWaalsContact O-CB 3.25Å; L560-S563 WeakPolarHBondContact O-CB 3.28Å; E561-S563 PolarHBondContact O-N 2.83Å; E561-S563 VanDerWaalsContact O-N 3.1Å; S563-S567 WeakPolarHBondContact OG-CB 3.39Å; S563-S567 PolarHBondContact OG-OG 2.86Å
564	G	83.4	Confident	91.8	Very high	15 Å²	15	52 Å²	52	16%	0.155	27%	0.268	C	S	.	.			trans	-75.5	164.4	167.5	0	0	0	0	0	112.3	D566 S567	G564-D566 VanDerWaalsContact C-N 3.35Å; G564-D566 PolarHBondContact O-N 2.86Å; G564-S567 WeakPolarHBondContact CA-OG 3.33Å; G564-S567 PolarHBondContact N-OG 3.02Å; G564-S567 WeakPolarHBondContact O-CB 3.39Å; G564-S567 PolarHBondContact O-N 3.35Å; G564-S567 PolarHBondContact O-OG 2.94Å
565	P	80.9	Confident	91.9	Very high	120 Å²	120	51.5 Å²	51.5	78%	0.779	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-37.8	-174	24.9	-34	0	0	0	113.3
566	D	87.9	Confident	92	Very high	108 Å²	108	49.2 Å²	49.2	58%	0.578	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	13.3	-179.8	-50.3	-69.5	0	0	0	112.7	N451 G564 Q568	N451-D566 HydrophobicContact CB-CB 4.32Å; N451-D566 WeakPolarHBondContact CB-O 3.27Å; N451-D566 PolarHBondContact ND2-O 2.83Å; G564-D566 VanDerWaalsContact C-N 3.35Å; G564-D566 PolarHBondContact O-N 2.86Å; D566-Q568 PolarHBondContact O-N 3.21Å
567	S	92.8	Very high	92	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.028	24%	0.235	C	C	.	.			trans	-78.5	119.7	-175.4	-58.5	0	0	0	0	111.3	S450 N451 L560 S563 G564	S450-S567 WeakPolarHBondContact O-CA 3.35Å; N451-S567 PolarHBondContact O-OG 2.75Å; L560-S567 PolarHBondContact N-O 2.83Å; S563-S567 WeakPolarHBondContact OG-CB 3.39Å; S563-S567 PolarHBondContact OG-OG 2.86Å; G564-S567 WeakPolarHBondContact CA-OG 3.33Å; G564-S567 PolarHBondContact N-OG 3.02Å; G564-S567 WeakPolarHBondContact O-CB 3.39Å; G564-S567 PolarHBondContact O-N 3.35Å; G564-S567 PolarHBondContact O-OG 2.94Å
568	Q	95	Very high	91.9	Very high	72 Å²	72	42.9 Å²	42.9	34%	0.336	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	159.8	-177.9	-58.6	-178.8	3.2	0	0	111.5	A449 S450 N557 F558 D566	A449-Q568 CarbonylContact C-O 3.43Å; A449-Q568 VanDerWaalsContact CA-O 3.27Å; A449-Q568 WeakPolarHBondContact CA-O 3.35Å; A449-Q568 VanDerWaalsContact CB-O 3.3Å; A449-Q568 WeakPolarHBondContact CB-O 3.47Å; S450-Q568 PolarHBondContact N-O 2.82Å; S450-Q568 PolarHBondContact O-N 3.32Å; N557-Q568 PolarHBondContact ND2-OE1 2.8Å; F558-Q568 CarbonylContact O-C 3.5Å; F558-Q568 VanDerWaalsContact O-CA 3.25Å; F558-Q568 WeakPolarHBondContact O-CA 3.36Å; D566-Q568 PolarHBondContact O-N 3.21Å
569	I	95.6	Very high	91.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131	172.3	-167.4	161.5	0	0	0	109.9	L446 A449 V485 W507 L525 V527 L539 F558 L560 L571	L446-I569 HydrophobicContact CD1-CD1 3.79Å; L446-I569 HydrophobicContact CD1-CG1 4.03Å; A449-I569 HydrophobicContact CB-CB 4.25Å; A449-I569 HydrophobicContact CB-CD1 4.5Å; A449-I569 HydrophobicContact CB-CG1 4.12Å; V485-I569 HydrophobicContact CG2-CD1 4.16Å; W507-I569 HydrophobicContact CZ3-CD1 4.28Å; L525-I569 HydrophobicContact CD1-CD1 3.87Å; L525-I569 HydrophobicContact CD2-CD1 3.96Å; V527-I569 HydrophobicContact CG2-CD1 4.01Å; L539-I569 HydrophobicContact CD2-CG2 3.99Å; F558-I569 HydrophobicContact CB-CG2 4.09Å; F558-I569 PolarHBondContact N-O 3.1Å; F558-I569 PolarHBondContact O-N 3.17Å; L560-I569 HydrophobicContact CD1-CB 4.36Å; L560-I569 HydrophobicContact CD2-CB 4.12Å; L560-I569 HydrophobicContact CD2-CG2 3.67Å; L560-I569 HydrophobicContact CG-CB 4.25Å; L560-I569 HydrophobicContact CG-CG2 4.1Å; I569-L571 HydrophobicContact CD1-CD2 4.3Å; I569-L571 HydrophobicContact CG1-CD2 4.07Å; I569-L571 HydrophobicContact CG1-CG 4.21Å; I569-L571 HydrophobicContact CG2-CD1 4.07Å; I569-L571 HydrophobicContact CG2-CG 4.26Å
570	K	95.3	Very high	91	Very high	66 Å²	66	44.4 Å²	44.4	29%	0.287	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.7	176.9	-174.6	179	169.5	-144.8	0	109.6	D447 N448 N557	D447-K570 HydrophobicContact CB-CB 4.21Å; D447-K570 HydrophobicContact CB-CD 4.19Å; D447-K570 HydrophobicContact CB-CG 4.14Å; D447-K570 PolarHBondContact N-O 3.49Å; D447-K570 WeakPolarHBondContact OD2-CD 3.12Å; D447-K570 WeakPolarHBondContact OD2-CE 3.4Å; D447-K570 IonicContact OD2-NZ 2.74Å; D447-K570 PolarHBondContact OD2-NZ 3.14Å; N448-K570 PolarHBondContact O-N 2.68Å; N557-K570 WeakPolarHBondContact OD1-CB 3.14Å; N557-K570 WeakPolarHBondContact OD1-CG 3.43Å
571	L	94.6	Very high	90.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144.5	-177	-56.8	169.1	0	0	0	110.5	Y445 L446 F487 L525 L539 I541 Q556 F558 I569 V573	Y445-L571 WeakPolarHBondContact O-CA 3.45Å; L446-L571 HydrophobicContact CB-CD2 4.37Å; L446-L571 HydrophobicContact CD1-CD2 3.54Å; F487-L571 HydrophobicContact CE1-CD2 4.49Å; F487-L571 HydrophobicContact CZ-CD2 4.28Å; L525-L571 HydrophobicContact CD1-CD1 3.5Å; L525-L571 VanDerWaalsContact CD1-CD1 3.5Å; L525-L571 HydrophobicContact CD1-CD2 4.03Å; L525-L571 HydrophobicContact CD1-CG 4.36Å; L539-L571 HydrophobicContact CD2-CD1 3.56Å; I541-L571 HydrophobicContact CD1-CD1 4.41Å; Q556-L571 PolarHBondContact N-O 3.26Å; Q556-L571 VanDerWaalsContact N-O 3.15Å; Q556-L571 PolarHBondContact O-N 2.93Å; Q556-L571 VanDerWaalsContact O-N 3.1Å; F558-L571 HydrophobicContact CD2-CB 4Å; F558-L571 HydrophobicContact CD2-CD1 4.01Å; F558-L571 HydrophobicContact CD2-CG 4.23Å; F558-L571 HydrophobicContact CE2-CB 3.84Å; F558-L571 HydrophobicContact CE2-CD1 4.32Å; I569-L571 HydrophobicContact CD1-CD2 4.3Å; I569-L571 HydrophobicContact CG1-CD2 4.07Å; I569-L571 HydrophobicContact CG1-CG 4.21Å; I569-L571 HydrophobicContact CG2-CD1 4.07Å; I569-L571 HydrophobicContact CG2-CG 4.26Å; L571-V573 HydrophobicContact CB-CG2 4.13Å
572	K	93.2	Very high	89	Confident	25 Å²	25	51.9 Å²	51.9	11%	0.109	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	101.1	171.2	-178.7	-175.6	-162.2	-175.8	0	108.5	D291 E292 Y445 L554 D555	D291-K572 IonicContact OD2-NZ 2.69Å; D291-K572 PolarHBondContact OD2-NZ 3.24Å; E292-K572 IonicContact OE1-NZ 2.64Å; E292-K572 PolarHBondContact OE1-NZ 3.36Å; Y445-K572 HydrophobicContact CD1-CB 4.41Å; Y445-K572 PolarHBondContact N-O 3.48Å; Y445-K572 PolarHBondContact O-N 3.04Å; L554-K572 CarbonylContact O-C 3.6Å; L554-K572 VanDerWaalsContact O-CA 3.27Å; L554-K572 WeakPolarHBondContact O-CA 3.44Å; D555-K572 HydrophobicContact CB-CB 4.36Å; D555-K572 HydrophobicContact CB-CG 4.01Å; D555-K572 WeakPolarHBondContact OD2-CD 3.41Å; D555-K572 VanDerWaalsContact OD2-CE 3.3Å; D555-K572 WeakPolarHBondContact OD2-CE 3.37Å
573	V	94.3	Very high	87.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115.8	-172.4	-179.2	0	0	0	0	108.7	L442 V444 I541 L546 C553 L554 L571	L442-V573 HydrophobicContact CD1-CG1 3.69Å; L442-V573 HydrophobicContact CG-CG1 4.31Å; V444-V573 HydrophobicContact CG1-CG2 4.32Å; V444-V573 HydrophobicContact CG2-CG1 4.39Å; I541-V573 HydrophobicContact CD1-CG2 4.14Å; L546-V573 HydrophobicContact CD1-CG1 3.78Å; L546-V573 HydrophobicContact CD2-CG1 4.14Å; L546-V573 WeakPolarHBondContact CD2-O 3.46Å; C553-V573 WeakPolarHBondContact CA-O 3.46Å; L554-V573 HydrophobicContact CB-CB 4.43Å; L554-V573 PolarHBondContact N-O 2.82Å; L554-V573 PolarHBondContact O-N 2.75Å; L571-V573 HydrophobicContact CB-CG2 4.13Å
574	T	93.5	Very high	86.1	Confident	12 Å²	12	49.3 Å²	49.3	7%	0.074	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.2	-173.3	-54.3	0	0	0	0	110.4	L297 A443 C553 R576	L297-T574 HydrophobicContact CD1-CG2 4.3Å; L297-T574 HydrophobicContact CD2-CG2 4.1Å; A443-T574 PolarHBondContact N-O 3.1Å; A443-T574 PolarHBondContact O-N 2.94Å; C553-T574 HydrophobicContact CB-CG2 4.46Å; C553-T574 PolarHBondContact SG-OG1 3.19Å; T574-R576 VanDerWaalsContact CG2-NH1 3.27Å
575	L	94.1	Very high	84.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	138.5	177	-172.9	62.5	0	0	0	110.5	A440 L442 V515 I543 L546 F547 M552	A440-L575 HydrophobicContact CB-CD1 3.79Å; A440-L575 HydrophobicContact CB-CG 4.45Å; L442-L575 HydrophobicContact CB-CD1 4.28Å; L442-L575 HydrophobicContact CD1-CB 4.16Å; L442-L575 HydrophobicContact CD1-CD1 3.95Å; V515-L575 HydrophobicContact CG2-CD1 4.11Å; I543-L575 HydrophobicContact CG2-CD1 3.96Å; I543-L575 HydrophobicContact CG2-CD2 3.55Å; I543-L575 HydrophobicContact CG2-CG 4.42Å; L546-L575 HydrophobicContact CB-CB 4.08Å; L546-L575 HydrophobicContact CB-CD2 3.95Å; L546-L575 HydrophobicContact CD1-CB 4.03Å; L546-L575 HydrophobicContact CD1-CD2 4.34Å; F547-L575 HydrophobicContact CD2-CD2 3.69Å; F547-L575 HydrophobicContact CE2-CD2 3.5Å; F547-L575 HydrophobicContact CE2-CG 4.47Å; M552-L575 HydrophobicContact CB-CB 4.27Å; M552-L575 WeakPolarHBondContact CB-O 3.43Å; M552-L575 PolarHBondContact O-N 3.06Å
576	R	93.6	Very high	82.7	Confident	31 Å²	31	56.8 Å²	56.8	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.4	174.9	-66.8	-67.4	176	-100.1	7.2	109.6	L423 R424 A440 M441 S551 T574	L423-R576 HydrophobicContact CB-CB 3.88Å; L423-R576 HydrophobicContact CB-CG 4.06Å; L423-R576 HydrophobicContact CD1-CB 4.32Å; L423-R576 HydrophobicContact CD1-CG 4.2Å; L423-R576 HydrophobicContact CD2-CB 4.11Å; L423-R576 HydrophobicContact CG-CB 4.32Å; R424-R576 WeakPolarHBondContact O-CA 3.35Å; A440-R576 CarbonylContact C-O 3.49Å; A440-R576 VanDerWaalsContact CA-O 3.24Å; A440-R576 WeakPolarHBondContact CA-O 3.22Å; A440-R576 VanDerWaalsContact CB-O 3.32Å; A440-R576 WeakPolarHBondContact CB-O 3.31Å; M441-R576 PolarHBondContact N-O 2.85Å; M441-R576 PolarHBondContact O-N 2.76Å; S551-R576 PolarHBondContact O-NH1 2.71Å; T574-R576 VanDerWaalsContact CG2-NH1 3.27Å
577	I	92	Very high	80.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	137.7	176.3	-66.1	161.6	0	0	0	108.1	R424 E426 L429 L430 F547 M552 T579	R424-I577 PolarHBondContact N-O 2.81Å; R424-I577 PolarHBondContact O-N 3.35Å; E426-I577 WeakPolarHBondContact O-CD1 3.27Å; L429-I577 HydrophobicContact CB-CG2 4.42Å; L430-I577 HydrophobicContact CB-CD1 4.31Å; L430-I577 HydrophobicContact CD1-CG1 4.35Å; L430-I577 HydrophobicContact CD1-CG2 4.49Å; F547-I577 HydrophobicContact CE1-CD1 4.14Å; F547-I577 HydrophobicContact CZ-CD1 3.67Å; F547-I577 HydrophobicContact CZ-CG1 4.03Å; M552-I577 HydrophobicContact CE-CD1 3.93Å; M552-I577 HydrophobicContact SD-CD1 4.28Å; I577-T579 HydrophobicContact CG2-CG2 3.99Å
578	L	92.6	Very high	77.9	Confident	16 Å²	16	64.3 Å²	64.3	8%	0.084	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.2	178.8	-64.4	-177.2	0	0	0	109.1	V301 L421 L423 C439 M441	V301-L578 HydrophobicContact CB-CD2 3.99Å; V301-L578 HydrophobicContact CG1-CD1 4.45Å; V301-L578 HydrophobicContact CG2-CD2 3.73Å; L421-L578 HydrophobicContact CB-CB 4.15Å; L421-L578 HydrophobicContact CB-CD2 4.28Å; L421-L578 HydrophobicContact CD1-CB 4.17Å; L421-L578 HydrophobicContact CD1-CD1 4.04Å; L423-L578 HydrophobicContact CD2-CD2 3.51Å; C439-L578 PolarHBondContact O-N 3.45Å; M441-L578 HydrophobicContact CB-CD2 4.03Å; M441-L578 HydrophobicContact CB-CG 4.44Å
579	T	88.4	Confident	75.1	Confident	18 Å²	18	66.9 Å²	66.9	11%	0.11	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.3	-176	62.8	0	0	0	0	111.6	L421 S422 R424 L429 I577 E581	L421-T579 WeakPolarHBondContact CA-O 3.25Å; S422-T579 PolarHBondContact N-O 3.07Å; S422-T579 PolarHBondContact O-N 2.92Å; S422-T579 PolarHBondContact O-OG1 2.89Å; S422-T579 VanDerWaalsContact O-OG1 3.14Å; R424-T579 HydrophobicContact CB-CG2 3.98Å; R424-T579 HydrophobicContact CG-CG2 3.67Å; R424-T579 WeakPolarHBondContact CG-OG1 3.37Å; L429-T579 HydrophobicContact CB-CG2 3.7Å; L429-T579 HydrophobicContact CD1-CG2 4.01Å; L429-T579 HydrophobicContact CG-CG2 4.49Å; I577-T579 HydrophobicContact CG2-CG2 3.99Å; T579-E581 PolarHBondContact O-N 3.34Å
580	E	83.4	Confident	72.2	Confident	109 Å²	109	72 Å²	72	51%	0.509	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	112	169.2	-68.5	173.4	-173.3	0	0	109.1	R303 Q419 L421	R303-E580 IonicContact NH1-OE1 3.95Å; R303-E580 PolarHBondContact NH1-OE1 3.25Å; Q419-E580 PolarHBondContact NE2-OE1 2.9Å; Q419-E580 PolarHBondContact NE2-OE2 3.18Å; L421-E580 HydrophobicContact CD2-CB 4.37Å; L421-E580 HydrophobicContact CD2-CG 3.3Å
581	E	75.6	Confident	69	Low	48 Å²	48	73.6 Å²	73.6	22%	0.224	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-80.2	119.1	171.5	-78.3	174.9	-175.1	0	0	108.9	K398 S422 R424 T579	K398-E581 WeakPolarHBondContact CB-O 2.95Å; K398-E581 HydrophobicContact CD-CB 4.04Å; K398-E581 WeakPolarHBondContact CE-OE2 3.44Å; K398-E581 HydrophobicContact CG-CB 4.42Å; K398-E581 IonicContact NZ-OE2 3.59Å; K398-E581 PolarHBondContact NZ-OE2 3.16Å; S422-E581 WeakPolarHBondContact CB-OE1 3.17Å; S422-E581 PolarHBondContact OG-OE1 3.32Å; S422-E581 PolarHBondContact OG-OE2 3.46Å; R424-E581 IonicContact CZ-OE1 2.59Å; R424-E581 IonicContact NE-OE1 2.64Å; R424-E581 IonicContact NH2-OE1 3.85Å; R424-E581 PolarHBondContact NH2-OE1 3.43Å; T579-E581 PolarHBondContact O-N 3.34Å
582	R	66.5	Low	66.1	Low	235 Å²	235	79.6 Å²	79.6	89%	0.887	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-64.2	136.3	172	-66.1	-177.3	-177.3	171.5	2	109.2
583	P	60.3	Low	63.2	Low	57 Å²	57	83.5 Å²	83.5	37%	0.37	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-59.7	148.4	173.1	24.9	-33.2	0	0	0	110.3	K398	K398-P583 HydrophobicContact CB-CB 4.49Å; K398-P583 HydrophobicContact CG-CB 4.48Å
584	P	55.3	Low	60.2	Low	99 Å²	99	91 Å²	91	64%	0.643	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58	145.1	171.2	26.6	-34	0	0	0	109.5	K586	P584-K586 PolarHBondContact O-N 2.89Å
585	P	46.5	Very low	57.2	Low	120 Å²	120	97 Å²	97	78%	0.779	55%	0.547	S	S	*	.			trans	-63.1	110	-176.4	25.5	-33.8	0	0	0	110	I587	P585-I587 PolarHBondContact O-N 3.42Å
586	K	46.4	Very low	54.4	Low	173 Å²	173	105.7 Å²	105.7	75%	0.752	59%	0.585	S	S	*	*			trans	-56.5	108.4	175.6	-66.9	-175.7	178.4	-177.9	0	108.5	P584 P588	P584-K586 PolarHBondContact O-N 2.89Å; K586-P588 WeakPolarHBondContact O-CD 3.32Å
587	I	43.8	Very low	51.5	Low	149 Å²	149	113.9 Å²	113.9	76%	0.764	62%	0.624	S	S	*	*			trans	-63.5	124.6	175.1	-59.7	176.6	0	0	0	106.7	P585 V589	P585-I587 PolarHBondContact O-N 3.42Å; I587-V589 PolarHBondContact O-N 3.06Å
588	P	37	Very low	48.5	Very low	120 Å²	120	122.9 Å²	122.9	78%	0.779	67%	0.666	S	S	*	*			trans	-70.7	98.6	-178.9	27.7	-33.5	0	0	0	109.4	K586 S590	K586-P588 WeakPolarHBondContact O-CD 3.32Å; P588-S590 PolarHBondContact O-N 3.29Å
589	V	35.8	Very low	45.5	Very low	126 Å²	126	129.7 Å²	129.7	76%	0.764	70%	0.702	S	S	*	*			trans	-60	105.8	168.1	-180	0	0	0	0	107.4	I587 S591	I587-V589 PolarHBondContact O-N 3.06Å; V589-S591 PolarHBondContact O-N 3.36Å
590	S	34	Very low	42.6	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	74%	0.741	S	S	*	*			trans	-63.5	111.6	177.7	55.7	0	0	0	0	109	P588	P588-S590 PolarHBondContact O-N 3.29Å
591	S	29	Very low	40.2	Very low	101 Å²	101	144.2 Å²	144.2	71%	0.706	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-51.8	134.9	177.2	-42.4	0	0	0	0	110	V589 S593	V589-S591 PolarHBondContact O-N 3.36Å; S591-S593 PolarHBondContact O-N 3.09Å; S591-S593 VanDerWaalsContact O-N 3.1Å
592	P	33.4	Very low	38	Very low	126 Å²	126	148.3 Å²	148.3	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-57	122.1	178.3	23.3	-32.7	0	0	0	109	N594	P592-N594 PolarHBondContact O-N 3.45Å
593	S	31.6	Very low	36.2	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69	123.3	-167.2	38.6	0	0	0	0	111.2	S591 V595	S591-S593 PolarHBondContact O-N 3.09Å; S591-S593 VanDerWaalsContact O-N 3.1Å; S593-V595 PolarHBondContact O-N 3.36Å
594	N	32.3	Very low	34.7	Very low	157 Å²	157	149.6 Å²	149.6	84%	0.84	81%	0.812	S	S	*	*			trans	-55.7	102.7	175	-91.4	-59.7	0	0	0	110.7	P592 K596	P592-N594 PolarHBondContact O-N 3.45Å; N594-K596 VanDerWaalsContact C-N 3.31Å; N594-K596 PolarHBondContact O-N 2.83Å
595	V	30.6	Very low	33.3	Very low	139 Å²	139	148.8 Å²	148.8	84%	0.842	82%	0.822	S	S	*	*			trans	-69.6	89.6	174.3	-178.7	0	0	0	0	108.3	S593 Q597	S593-V595 PolarHBondContact O-N 3.36Å; V595-Q597 PolarHBondContact O-N 2.85Å
596	K	34.2	Very low	32.3	Very low	183 Å²	183	146.6 Å²	146.6	80%	0.796	82%	0.82	S	S	*	*			trans	-58.9	125.9	175.6	-77.3	-174.9	174.9	179.5	0	109.8	N594 Q598	N594-K596 VanDerWaalsContact C-N 3.31Å; N594-K596 PolarHBondContact O-N 2.83Å; K596-Q598 PolarHBondContact O-N 3.08Å; K596-Q598 VanDerWaalsContact O-N 3.14Å
597	Q	32.2	Very low	31.4	Very low	202 Å²	202	146.2 Å²	146.2	94%	0.944	83%	0.827	S	S	*	*			trans	-57	117.1	163.2	-69	177.1	-21	0	0	108.9	V595	V595-Q597 PolarHBondContact O-N 2.85Å
598	Q	29.1	Very low	30.7	Very low	189 Å²	189	143.8 Å²	143.8	88%	0.883	83%	0.829	S	S	*	*			trans	-130.1	69.6	174.7	-166.4	175.9	9.4	0	0	110.3	K596	K596-Q598 PolarHBondContact O-N 3.08Å; K596-Q598 VanDerWaalsContact O-N 3.14Å
599	N	29.6	Very low	30.3	Very low	159 Å²	159	142.8 Å²	142.8	85%	0.85	83%	0.831	S	S	*	*			trans	-154.7	92.4	166.2	-147.3	-10.7	0	0	0	114.3
600	R	28.3	Very low	29.8	Very low	245 Å²	245	141.7 Å²	141.7	93%	0.925	84%	0.835	S	S	*	*			trans	-170.5	118.7	141.7	-112.7	170.9	176.3	169.1	-0.8	111.7
601	Q	32	Very low	29.5	Very low	188 Å²	188	141.6 Å²	141.6	88%	0.879	84%	0.841	S	S	*	*			trans	-87.2	130	164.7	-79.3	179.6	-54.7	0	0	110.8
602	V	29.9	Very low	29.4	Very low	134 Å²	134	143.3 Å²	143.3	81%	0.812	85%	0.847	S	S	*	*			trans	16.8	116.8	142	-171.6	0	0	0	0	118.1
603	K	28.6	Very low	29.9	Very low	217 Å²	217	142.7 Å²	142.7	94%	0.943	84%	0.843	S	S	*	*				-148.1	158.5	127.8	-115.9	176.3	-172.3	-178.4	0	109.8
604	A	28.6	Very low	29.6	Very low	101 Å²	101	141.8 Å²	141.8	84%	0.835	84%	0.842	S	S	*	*			trans	-125.5	158.4	-157.2	0	0	0	0	0	114.5
605	G	26.7	Very low	29.4	Very low	83 Å²	83	138.6 Å²	138.6	86%	0.856	84%	0.837	S	S	*	*			trans	103.3	143.1	151.6	0	0	0	0	0	117.2
606	G	26.1	Very low	29.2	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	84%	0.838	S	S	*	*			trans	111.2	81.6	149.7	0	0	0	0	0	118.7
607	N	27.4	Very low	28.8	Very low	165 Å²	165	133.3 Å²	133.3	88%	0.882	84%	0.835	S	S	*	*			trans	35	139	135.6	-65.5	0.3	0	0	0	123.7
608	A	28.2	Very low	28.5	Very low	98 Å²	98	128.6 Å²	128.6	81%	0.81	83%	0.83	S	S	*	*			trans	97.3	131.7	133.1	0	0	0	0	0	122.3
609	A	27.8	Very low	28.5	Very low	99 Å²	99	123.9 Å²	123.9	82%	0.818	82%	0.824	S	S	*	*			trans	63.5	100.6	139.6	0	0	0	0	0	121.7
610	A	27.1	Very low	28.5	Very low	104 Å²	104	120.8 Å²	120.8	86%	0.86	82%	0.821	S	S	*	*			trans	5.2	130.2	138.1	0	0	0	0	0	121.2
611	A	27.6	Very low	28.5	Very low	104 Å²	104	114.9 Å²	114.9	86%	0.86	81%	0.812	S	S	*	*			trans	-160.4	135.1	134.7	0	0	0	0	0	112.7
612	T	25.8	Very low	28.4	Very low	138 Å²	138	112.4 Å²	112.4	85%	0.847	81%	0.81	S	S	*	*			trans	-102.1	173.3	154.7	6.9	0	0	0	0	107.7
613	P	44.4	Very low	28.4	Very low	113 Å²	113	110.2 Å²	110.2	73%	0.734	81%	0.806	S	S	*	*			cis	-139.8	-169.7	4.4	40.5	-20	0	0	0	116.2
614	A	25.2	Very low	28.5	Very low	87 Å²	87	104.7 Å²	104.7	72%	0.719	80%	0.801	S	S	*	*			trans	81.2	114.1	136.5	0	0	0	0	0	123.7
615	A	27.6	Very low	28.5	Very low	89 Å²	89	104.6 Å²	104.6	74%	0.736	80%	0.8	S	S	*	*				81.5	139	118.2	0	0	0	0	0	123.6
616	S	26.6	Very low	28.7	Very low	122 Å²	122	106.9 Å²	106.9	85%	0.853	80%	0.798	S	S	*	*			trans	65.2	156.4	153.7	64.3	0	0	0	0	119.7
617	A	26.4	Very low	29.5	Very low	89 Å²	89	109.2 Å²	109.2	74%	0.736	80%	0.799	S	S	*	*			cis	-170.7	158.6	-29.5	0	0	0	0	0	109.3
618	A	26.1	Very low	29.6	Very low	103 Å²	103	105.6 Å²	105.6	85%	0.851	79%	0.792	S	S	*	*			trans	62.4	168.8	163.5	0	0	0	0	0	117.9
619	A	27.5	Very low	30.5	Very low	91 Å²	91	106.5 Å²	106.5	75%	0.752	79%	0.79	S	S	*	*			cis	-166.5	148.9	-41.8	0	0	0	0	0	111.2
620	A	30.3	Very low	30.5	Very low	94 Å²	94	107.8 Å²	107.8	78%	0.777	79%	0.793	S	S	*	*			trans	60.3	177.4	159.6	0	0	0	0	0	116.7
621	T	28.9	Very low	30.7	Very low	121 Å²	121	108.8 Å²	108.8	74%	0.742	79%	0.794	S	S	*	*			cis	-149.5	149.8	-0.5	-27.7	0	0	0	0	109.7
622	T	29.9	Very low	30.8	Very low	135 Å²	135	107.6 Å²	107.6	83%	0.828	79%	0.792	S	S	*	*				153.7	154.1	108.4	44.8	0	0	0	0	107.5
623	A	29.1	Very low	30.9	Very low	88 Å²	88	105.7 Å²	105.7	73%	0.727	79%	0.79	S	S	*	*			cis	-149.3	140.8	-10.9	0	0	0	0	0	106.5
624	A	30.7	Very low	30.6	Very low	102 Å²	102	105.8 Å²	105.8	84%	0.843	79%	0.79	S	S	*	*				57.5	141.9	88	0	0	0	0	0	115.1
625	A	28.9	Very low	30.7	Very low	99 Å²	99	108 Å²	108	82%	0.818	80%	0.795	S	S	*	*			cis	-149.8	172.5	14.4	0	0	0	0	0	114.2
626	T	30	Very low	30.7	Very low	131 Å²	131	107.8 Å²	107.8	80%	0.804	79%	0.793	S	S	*	*			trans	-122.5	167.2	174.7	-30.9	0	0	0	0	109.7
627	P	43.7	Very low	30.8	Very low	122 Å²	122	107.8 Å²	107.8	79%	0.792	79%	0.793	S	S	*	*			trans	-132.4	152.9	134.1	37.2	-28.1	0	0	0	114.6
628	A	29.3	Very low	31.1	Very low	89 Å²	89	109.1 Å²	109.1	74%	0.736	80%	0.796	S	S	*	*			trans	-114	-161.7	166.3	0	0	0	0	0	107.1
629	P	47.6	Very low	31.7	Very low	116 Å²	116	110.6 Å²	110.6	75%	0.753	80%	0.797	S	S	*	*			cis	-138.6	179.8	-3.6	43.5	-26.5	0	0	0	115.2
630	S	27.9	Very low	31.6	Very low	126 Å²	126	109.6 Å²	109.6	88%	0.881	80%	0.796	S	S	*	*				173.8	169.6	122.5	46	0	0	0	0	111.2
631	S	32.3	Very low	31.8	Very low	126 Å²	126	113.2 Å²	113.2	88%	0.881	80%	0.802	S	S	*	*			trans	-131.7	141	-163.2	56.2	0	0	0	0	113.5
632	G	27.7	Very low	32.6	Very low	79 Å²	79	113.1 Å²	113.1	81%	0.814	80%	0.803	S	S	*	*			trans	-175.3	125.9	168.9	0	0	0	0	0	114.1
633	A	28	Very low	32.6	Very low	98 Å²	98	109.8 Å²	109.8	81%	0.81	80%	0.795	S	S	*	*			trans	-84.3	171.6	160.1	0	0	0	0	0	108.6
634	P	38.6	Very low	33.1	Very low	114 Å²	114	112.4 Å²	112.4	74%	0.74	80%	0.802	S	S	*	*			cis	-153.2	179.5	31.8	45.3	-23.7	0	0	0	119.1
635	V	28	Very low	34	Very low	135 Å²	135	112.3 Å²	112.3	82%	0.818	79%	0.793	S	S	*	*			trans	53.3	118.1	136.9	170.1	0	0	0	0	122
636	A	28	Very low	34.3	Very low	83 Å²	83	115.3 Å²	115.3	69%	0.686	79%	0.794	S	S	*	*			trans	81	142.3	138.4	0	0	0	0	0	125.1
637	S	28.7	Very low	34.3	Very low	123 Å²	123	116 Å²	116	86%	0.86	79%	0.793	S	S	*	*			trans	89.3	143.1	143.1	72.9	0	0	0	0	120.5
638	S	31.3	Very low	33.7	Very low	116 Å²	116	113 Å²	113	81%	0.811	78%	0.783	S	S	*	*			trans	-93.4	149.1	-174.8	-42.1	0	0	0	0	112
639	P	39.4	Very low	33.7	Very low	134 Å²	134	114.6 Å²	114.6	87%	0.87	79%	0.785	S	S	*	*			trans	-79	145.1	173.1	32.6	-34.2	0	0	0	112.4
640	G	26.3	Very low	32.9	Very low	70 Å²	70	115.6 Å²	115.6	72%	0.722	78%	0.783	S	S	*	*			trans	-112.1	175.3	162	0	0	0	0	0	111.3
641	L	33.6	Very low	33	Very low	171 Å²	171	118.3 Å²	118.3	90%	0.895	78%	0.78	S	S	*	*			trans	-133.7	158.4	176.9	-82.6	170.4	0	0	0	110.9
642	P	45.8	Very low	32.8	Very low	119 Å²	119	117.2 Å²	117.2	77%	0.773	78%	0.778	S	S	*	*			trans	-84.5	174.6	-161	37.2	-39.1	0	0	0	113.4
643	G	30.5	Very low	32.8	Very low	65 Å²	65	118.3 Å²	118.3	67%	0.67	78%	0.78	S	S	*	*			cis	93	138.1	22.9	0	0	0	0	0	110.9
644	V	37.9	Very low	32.7	Very low	142 Å²	142	119 Å²	119	86%	0.861	78%	0.778	S	S	*	*			cis	-151.1	-138.6	2.4	-137.3	0	0	0	0	106.2
645	P	50.4	Low	32.8	Very low	100 Å²	100	119.4 Å²	119.4	65%	0.649	78%	0.781	S	S	*	*			cis	-129	151.3	-38.9	26.5	-5.1	0	0	0	116.7
646	L	35.7	Very low	32.9	Very low	162 Å²	162	121.3 Å²	121.3	85%	0.848	78%	0.781	S	S	*	*			trans	67.3	160.9	143.1	-62.3	169.6	0	0	0	119.9
647	D	30	Very low	34.1	Very low	147 Å²	147	122 Å²	122	79%	0.786	78%	0.778	S	S	*	*			cis	-148.1	157.4	13.3	-157.4	5.6	0	0	0	115.6
648	G	30.3	Very low	33.9	Very low	57 Å²	57	127.4 Å²	127.4	59%	0.588	78%	0.78	S	S	*	*			trans	72	145.9	155.5	0	0	0	0	0	121.1
649	T	28.9	Very low	33.6	Very low	124 Å²	124	132 Å²	132	76%	0.761	78%	0.779	S	S	*	*			cis	-161.7	144.7	-12.6	49.9	0	0	0	0	111.4
650	N	30.9	Very low	32.9	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	77%	0.774	S	S	*	*			trans	50.8	145.7	145.4	-66.8	-45.5	0	0	0	121.5
651	K	29.9	Very low	32.9	Very low	184 Å²	184	133.1 Å²	133.1	80%	0.8	77%	0.768	S	S	*	*			cis	-168.4	156.6	-0.8	-124.4	172.5	-175.3	179	0	110.9
652	A	28.6	Very low	32.5	Very low	103 Å²	103	133.7 Å²	133.7	85%	0.851	76%	0.764	S	S	*	*			trans	64.3	148.3	155.7	0	0	0	0	0	119.1
653	A	28.3	Very low	31.6	Very low	102 Å²	102	135.8 Å²	135.8	84%	0.843	77%	0.768	S	S	*	*			cis	-157.2	168.9	-14.1	0	0	0	0	0	111.4
654	S	25.8	Very low	31.3	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	77%	0.768	S	S	*	*			trans	-119.9	-175	175	64.8	0	0	0	0	109.5
655	P	40.5	Very low	30.8	Very low	123 Å²	123	135.5 Å²	135.5	80%	0.799	77%	0.766	S	S	*	*			cis	-139.5	-162.2	9.4	43.2	-22	0	0	0	116.1
656	Q	29.1	Very low	29.7	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	77%	0.77	S	S	*	*			trans	-92.8	-154.9	173.9	-35.3	172.6	-32.7	0	0	111.7
657	P	54.4	Low	29.3	Very low	97 Å²	97	135.6 Å²	135.6	63%	0.63	76%	0.761	S	S	*	*			cis	-131.4	-166	-40.6	30.8	-10.3	0	0	0	112.8
658	R	24.5	Very low	29.1	Very low	237 Å²	237	133.6 Å²	133.6	89%	0.894	76%	0.759	S	S	*	*			trans	108.1	162.7	161	-63.1	170.2	176.8	-177.5	0.2	116
659	R	25.4	Very low	28.8	Very low	213 Å²	213	140.5 Å²	140.5	80%	0.804	77%	0.773	S	S	*	*			cis	178.6	138.7	-34.2	-175.8	-179.9	-171.9	-178	6.3	108.1
660	N	24.2	Very low	29.4	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	77%	0.769	S	S	*	*			trans	65.9	162.7	172.2	-69	6.7	0	0	0	116.3
661	S	25.7	Very low	29.3	Very low	85 Å²	85	138.9 Å²	138.9	59%	0.594	78%	0.775	S	S	*	*			cis	-176.1	157.2	-25.3	55.3	0	0	0	0	113
662	F	25.6	Very low	29.4	Very low	184 Å²	184	137.6 Å²	137.6	81%	0.807	78%	0.776	S	S	*	*			trans	80.9	135.4	152.4	-76.4	-63	0	0	0	124.1
663	L	26	Very low	29.5	Very low	163 Å²	163	137.3 Å²	137.3	85%	0.853	77%	0.766	S	S	*	*			trans	65	155.2	150.4	-61.3	163.2	0	0	0	119.9
664	A	25.6	Very low	29.6	Very low	81 Å²	81	140.5 Å²	140.5	67%	0.669	77%	0.769	S	S	*	*			cis	-173.4	170.8	-29.2	0	0	0	0	0	111.2
665	S	26.8	Very low	29.5	Very low	119 Å²	119	143.9 Å²	143.9	83%	0.832	78%	0.775	S	S	*	*			trans	77.6	130.6	168	-147.2	0	0	0	0	117.4
666	E	27.5	Very low	29	Very low	157 Å²	157	149.7 Å²	149.7	73%	0.734	78%	0.781	S	S	*	*			cis	-136.1	-125	-21.5	-152.2	-147.9	116.5	0	0	109.7	S668	E666-S668 PolarHBondContact OE1-N 2.75Å
667	T	26.6	Very low	28.9	Very low	108 Å²	108	152.2 Å²	152.2	66%	0.663	78%	0.783	S	S	*	*			cis	-151.2	155.3	-3.3	-28.4	0	0	0	0	112.1
668	S	26.3	Very low	27.7	Very low	105 Å²	105	157.9 Å²	157.9	73%	0.734	79%	0.793	S	S	*	*			trans	81.5	151.9	161.4	80.6	0	0	0	0	119.1	E666	E666-S668 PolarHBondContact OE1-N 2.75Å
669	K	25.2	Very low	27.7	Very low	201 Å²	201	154.3 Å²	154.3	87%	0.874	79%	0.791	S	S	*	*			trans	-178	176.2	-166.3	-111.4	178.6	-174.3	175.1	0	108.7
670	P	41.1	Very low	27.9	Very low	107 Å²	107	149.4 Å²	149.4	70%	0.695	79%	0.79	S	S	*	*			cis	-133.1	176	-15.4	39.2	-23.4	0	0	0	114.2
671	S	27.2	Very low	27.9	Very low	120 Å²	120	151.3 Å²	151.3	84%	0.839	79%	0.794	S	S	*	*			trans	-150.2	68.7	157.6	68.3	0	0	0	0	114.1
672	N	32	Very low	28.1	Very low	156 Å²	156	152.2 Å²	152.2	83%	0.834	80%	0.801	S	S	*	*			trans	55.5	159.8	158.9	-81.6	0	0	0	0	121.6
673	P	32.5	Very low	28.4	Very low	98 Å²	98	151.2 Å²	151.2	64%	0.636	80%	0.803	S	S	*	*			trans	-121.8	158.3	-147.1	41.4	-30.3	0	0	0	116
674	N	28.9	Very low	28.7	Very low	168 Å²	168	150.5 Å²	150.5	90%	0.898	80%	0.799	S	S	*	*				-169.5	95.6	118.1	-98.2	-23.2	0	0	0	111.6
675	M	24.1	Very low	29.1	Very low	183 Å²	183	152.4 Å²	152.4	90%	0.901	81%	0.808	S	S	*	*			trans	-152.6	109.1	163.2	-167.1	159	68.4	0	0	111.4
676	R	30.5	Very low	29.3	Very low	245 Å²	245	154.7 Å²	154.7	93%	0.925	81%	0.805	S	S	*	*			trans	-109.5	111.6	152.9	-68.5	179.5	178.5	172.3	-0.9	104.2
677	R	25.8	Very low	29.5	Very low	227 Å²	227	155 Å²	155	86%	0.857	81%	0.812	S	S	*	*				63.7	111.8	78	-175.3	176.8	-75.2	-169.6	-3.8	110.3
678	Y	29.8	Very low	29.7	Very low	217 Å²	217	155.7 Å²	155.7	85%	0.851	82%	0.821	S	S	*	*			trans	-63.1	147.6	175.5	-78.3	-103.8	0	0	0	112.1
679	D	25.1	Very low	29.9	Very low	161 Å²	161	156.7 Å²	156.7	86%	0.861	82%	0.817	S	S	*	*			trans	-117.9	144.4	141.1	-78.3	-56.1	0	0	0	107.6
680	S	29	Very low	30.2	Very low	111 Å²	111	149.4 Å²	149.4	78%	0.776	79%	0.794	S	S	*	*			trans	-104.1	117.7	-166.5	56.2	0	0	0	0	113
681	H	24.9	Very low	29.8	Very low	181 Å²	181	149.3 Å²	149.3	84%	0.838	80%	0.796	S	S	*	*			trans	-114.3	152.8	162	-87.3	-98.1	0	0	0	110.9	L683	H681-L683 PolarHBondContact O-N 3.28Å
682	S	30.3	Very low	30.3	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	77%	0.772	S	S	*	*			trans	-64.2	122.6	-173.7	-175.2	0	0	0	0	112.1
683	L	30.9	Very low	30.5	Very low	162 Å²	162	145.7 Å²	145.7	85%	0.848	76%	0.759	S	S	*	*			trans	-112.8	63.1	174.4	-66.4	179.7	0	0	0	111.2	H681	H681-L683 PolarHBondContact O-N 3.28Å
684	L	33	Very low	30.7	Very low	148 Å²	148	148.2 Å²	148.2	78%	0.775	76%	0.761	S	S	*	*	S	Bend	trans	-103	141.9	152.8	-68.1	172.3	0	0	0	107.4
685	S	33.3	Very low	30.9	Very low	122 Å²	122	146.2 Å²	146.2	85%	0.853	75%	0.75	S	S	*	*	S	Bend	trans	54.1	75.5	-169.6	68.9	0	0	0	0	116.2
686	E	32	Very low	31.4	Very low	166 Å²	166	146.3 Å²	146.3	78%	0.776	75%	0.753	S	S	*	*			trans	-174.5	100.2	133.2	-108.2	179.4	-156.1	0	0	110.3
687	N	31.2	Very low	31.7	Very low	164 Å²	164	140.8 Å²	140.8	88%	0.877	75%	0.747	S	S	*	*			trans	-173.5	70.8	160.4	-107.1	-54.9	0	0	0	112.2
688	S	30.8	Very low	32.2	Very low	122 Å²	122	134.8 Å²	134.8	85%	0.853	73%	0.732	S	S	*	*			trans	-142.7	36.1	168.1	57.7	0	0	0	0	111.5	A690	S688-A690 PolarHBondContact O-N 3.46Å
689	I	31.6	Very low	32.8	Very low	127 Å²	127	127.9 Å²	127.9	65%	0.651	73%	0.727	S	S	*	*			trans	-76.3	116.5	-179.4	-64.3	174.3	0	0	0	109.3
690	A	31	Very low	33.6	Very low	47 Å²	47	122.3 Å²	122.3	39%	0.388	70%	0.703	S	S	.	*			trans	-64.7	146.6	169.7	0	0	0	0	0	110.6	S688 S692	S688-A690 PolarHBondContact O-N 3.46Å; A690-S692 PolarHBondContact O-N 2.88Å
691	S	33	Very low	34.2	Very low	106 Å²	106	121.1 Å²	121.1	74%	0.741	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	34.6	-177.3	50.3	0	0	0	0	114.9
692	S	37.3	Very low	35.4	Very low	48 Å²	48	114.8 Å²	114.8	34%	0.336	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.5	-13.9	176.8	60.6	0	0	0	0	113.8	A690 N759	A690-S692 PolarHBondContact O-N 2.88Å; S692-N759 PolarHBondContact OG-O 2.81Å
693	R	35.3	Very low	36.6	Very low	151 Å²	151	111.8 Å²	111.8	57%	0.57	64%	0.643	S	S	*	*	S	Bend	trans	-103.4	121.9	158.2	-92.5	-174.6	167.5	119.6	-2.1	108.3	N759	R693-N759 PolarHBondContact NH1-ND2 2.99Å
694	F	37.7	Very low	37.5	Very low	152 Å²	152	111.5 Å²	111.5	67%	0.667	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-97.7	146	164.4	-106.2	-95.2	0	0	0	108.7
695	D	31.9	Very low	38.5	Very low	126 Å²	126	107.5 Å²	107.5	67%	0.674	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-60.9	152	177.5	-72.2	-65	0	0	0	113	T697	D695-T697 WeakPolarHBondContact CB-OG1 3.27Å; D695-T697 PolarHBondContact O-N 3.12Å
696	L	35.2	Very low	39.6	Very low	185 Å²	185	103 Å²	103	97%	0.969	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	8.2	172.8	-73	167	0	0	0	113.5
697	T	36.3	Very low	40.6	Very low	129 Å²	129	103.5 Å²	103.5	79%	0.791	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	-9.5	-171	53.7	0	0	0	0	114.9	D695	D695-T697 WeakPolarHBondContact CB-OG1 3.27Å; D695-T697 PolarHBondContact O-N 3.12Å
698	D	36	Very low	41.7	Very low	100 Å²	100	101.4 Å²	101.4	54%	0.535	58%	0.575	S	S	.	*			trans	-96.2	126.7	-178.5	-166.7	16.7	0	0	0	113.6	A700	D698-A700 PolarHBondContact O-N 3.31Å
699	G	42.4	Very low	43	Very low	73 Å²	73	98.5 Å²	98.5	75%	0.753	55%	0.548	S	S	*	.			trans	-80.1	38.4	-163.6	0	0	0	0	0	116	S701	G699-S701 PolarHBondContact O-N 2.9Å; G699-S701 VanDerWaalsContact O-N 3.08Å
700	A	42.1	Very low	44	Very low	44 Å²	44	100.9 Å²	100.9	36%	0.364	56%	0.556	S	S	.	*			trans	-64.5	107.7	-177.9	0	0	0	0	0	112.3	D698 F702	D698-A700 PolarHBondContact O-N 3.31Å; A700-F702 PolarHBondContact O-N 2.9Å
701	S	41.9	Very low	45.4	Very low	86 Å²	86	100 Å²	100	60%	0.601	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-67.4	126.6	-176.5	57.8	0	0	0	0	113.3	G699	G699-S701 PolarHBondContact O-N 2.9Å; G699-S701 VanDerWaalsContact O-N 3.08Å
702	F	50	Low	47.1	Very low	48 Å²	48	96.8 Å²	96.8	21%	0.211	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-64.3	151.7	163.7	-62.8	-88.7	0	0	0	111.3	A700 I706 R707 I838	A700-F702 PolarHBondContact O-N 2.9Å; F702-I706 HydrophobicContact CB-CB 4.43Å; F702-I706 HydrophobicContact CB-CG2 4.18Å; F702-I706 HydrophobicContact CD1-CG2 4.01Å; F702-I706 HydrophobicContact CG-CG2 4.33Å; F702-R707 HydrophobicContact CB-CG 3.84Å; F702-I838 HydrophobicContact CE1-CD1 4.4Å; F702-I838 HydrophobicContact CE1-CG2 3.47Å; F702-I838 VanDerWaalsContact CE1-CG2 3.47Å; F702-I838 HydrophobicContact CE2-CG2 4.07Å; F702-I838 HydrophobicContact CZ-CG2 3.18Å
703	P	54.9	Low	48.9	Very low	41 Å²	41	95.1 Å²	95.1	27%	0.266	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-51.3	142.9	166.9	-26	34.6	0	0	0	111.9	A705 I706 R707	P703-A705 VanDerWaalsContact C-N 3.31Å; P703-A705 PolarHBondContact O-N 2.62Å; P703-I706 HydrophobicContact CG-CD1 4.3Å; P703-I706 PolarHBondContact O-N 2.91Å; P703-R707 PolarHBondContact O-N 3.05Å
704	Q	50.4	Low	51.3	Low	156 Å²	156	88 Å²	88	73%	0.729	49%	0.489	S	S	*	.	H	α-helix	trans	-53.6	-46	-175.8	-72.6	173	-49.6	0	0	112.2	I706 R707 D708	Q704-I706 PolarHBondContact O-N 3.35Å; Q704-R707 WeakPolarHBondContact O-CA 3.38Å; Q704-R707 WeakPolarHBondContact O-CB 3.45Å; Q704-R707 PolarHBondContact O-N 2.9Å; Q704-D708 VanDerWaalsContact O-CG 3.31Å; Q704-D708 PolarHBondContact O-N 3.31Å
705	A	53.3	Low	53.7	Low	65 Å²	65	82.8 Å²	82.8	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-59.2	-17.3	177.1	0	0	0	0	0	115.3	P703 F740	P703-A705 VanDerWaalsContact C-N 3.31Å; P703-A705 PolarHBondContact O-N 2.62Å; A705-F740 HydrophobicContact CB-CZ 4.13Å; A705-F740 WeakPolarHBondContact O-CE2 3.42Å; A705-F740 WeakPolarHBondContact O-CZ 3.23Å
706	I	57.1	Low	56.6	Low	27 Å²	27	76.8 Å²	76.8	14%	0.138	44%	0.435	C	S	.	.	H	α-helix	trans	-93	-28.5	172.8	-68.8	176.4	0	0	0	111.3	F702 P703 Q704 F713 F740 I838	F702-I706 HydrophobicContact CB-CB 4.43Å; F702-I706 HydrophobicContact CB-CG2 4.18Å; F702-I706 HydrophobicContact CD1-CG2 4.01Å; F702-I706 HydrophobicContact CG-CG2 4.33Å; P703-I706 HydrophobicContact CG-CD1 4.3Å; P703-I706 PolarHBondContact O-N 2.91Å; Q704-I706 PolarHBondContact O-N 3.35Å; I706-F713 HydrophobicContact CG2-CE1 4.12Å; I706-F740 HydrophobicContact CD1-CE1 4.38Å; I706-F740 HydrophobicContact CG1-CD1 4.32Å; I706-F740 HydrophobicContact CG1-CE1 3.81Å; I706-F740 HydrophobicContact CG1-CE2 4.41Å; I706-F740 HydrophobicContact CG1-CZ 3.86Å; I706-I838 HydrophobicContact CG2-CD1 3.63Å
707	R	54.1	Low	59.4	Low	176 Å²	176	69.4 Å²	69.4	66%	0.664	40%	0.397	S	S	*	.	H	α-helix	trans	-74.6	-35.7	175.7	-63	-174	65.3	-168	-2.8	112.8	F702 P703 Q704 H709	F702-R707 HydrophobicContact CB-CG 3.84Å; P703-R707 PolarHBondContact O-N 3.05Å; Q704-R707 WeakPolarHBondContact O-CA 3.38Å; Q704-R707 WeakPolarHBondContact O-CB 3.45Å; Q704-R707 PolarHBondContact O-N 2.9Å; R707-H709 VanDerWaalsContact C-N 3.33Å
708	D	53.1	Low	62.1	Low	121 Å²	121	63.2 Å²	63.2	65%	0.647	36%	0.359	S	S	*	.	S	Bend	trans	-87.1	-6.9	-175.6	-54.1	-32.8	0	0	0	112.2	Q704 Q710	Q704-D708 VanDerWaalsContact O-CG 3.31Å; Q704-D708 PolarHBondContact O-N 3.31Å; D708-Q710 PolarHBondContact O-N 2.83Å
709	H	59.2	Low	64.9	Low	60 Å²	60	59.7 Å²	59.7	28%	0.278	34%	0.341	S	S	.	.			trans	-81.8	101.3	-179.2	-174.6	68.9	0	0	0	112.1	R707 G711 S712 F713 F740	R707-H709 VanDerWaalsContact C-N 3.33Å; H709-G711 WeakPolarHBondContact NE2-CA 3.43Å; H709-G711 PolarHBondContact O-N 3.15Å; H709-S712 PolarHBondContact NE2-O 3.26Å; H709-F713 AromaticContact CD2-CE1 3.62Å; H709-F713 AromaticContact CD2-CZ 3.97Å; H709-F740 HydrophobicContact CB-CE2 4.15Å
710	Q	52.6	Low	67.3	Low	177 Å²	177	56.3 Å²	56.3	83%	0.827	31%	0.305	S	S	*	.			trans	-82.6	6.5	172.9	-59.1	-173.8	3.5	0	0	113.5	D708 R843	D708-Q710 PolarHBondContact O-N 2.83Å; Q710-R843 PolarHBondContact O-NH2 2.95Å
711	G	59.4	Low	69.7	Low	29 Å²	29	59.7 Å²	59.7	30%	0.299	31%	0.309	S	S	.	.	S	Bend	trans	-83.4	-171.9	179	0	0	0	0	0	113.9	H709	H709-G711 WeakPolarHBondContact NE2-CA 3.43Å; H709-G711 PolarHBondContact O-N 3.15Å
712	S	68.1	Low	72	Confident	38 Å²	38	56 Å²	56	27%	0.266	28%	0.282	S	S	.	.			trans	-78.4	152	166	-174.6	0	0	0	0	110.5	H709 G714 E835	H709-S712 PolarHBondContact NE2-O 3.26Å; S712-G714 VanDerWaalsContact C-N 3.26Å; S712-G714 PolarHBondContact OG-N 2.99Å; S712-E835 WeakPolarHBondContact CB-OE1 3.34Å; S712-E835 PolarHBondContact OG-OE1 3.2Å
713	F	76.4	Confident	73.9	Confident	14 Å²	14	54.3 Å²	54.3	6%	0.061	28%	0.277	C	S	.	.			trans	-86.3	-0.2	172.6	-62.7	-77.4	0	0	0	113	I706 H709 F740 L836 I838	I706-F713 HydrophobicContact CG2-CE1 4.12Å; H709-F713 AromaticContact CD2-CE1 3.62Å; H709-F713 AromaticContact CD2-CZ 3.97Å; F713-F740 PolarHBondContact O-N 2.92Å; F713-L836 HydrophobicContact CB-CB 4.39Å; F713-I838 HydrophobicContact CD1-CD1 3.7Å; F713-I838 HydrophobicContact CD1-CG1 4.31Å; F713-I838 HydrophobicContact CD2-CD1 4.1Å; F713-I838 HydrophobicContact CD2-CG1 3.93Å; F713-I838 HydrophobicContact CE1-CD1 3.43Å; F713-I838 VanDerWaalsContact CE1-CD1 3.43Å; F713-I838 HydrophobicContact CE1-CG1 4.32Å; F713-I838 HydrophobicContact CE2-CB 4.44Å; F713-I838 HydrophobicContact CE2-CD1 3.85Å; F713-I838 HydrophobicContact CE2-CG1 3.94Å; F713-I838 HydrophobicContact CG-CD1 4.05Å; F713-I838 HydrophobicContact CG-CG1 4.13Å; F713-I838 HydrophobicContact CZ-CD1 3.52Å; F713-I838 HydrophobicContact CZ-CG1 4.14Å
714	G	85.1	Confident	75.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.			trans	109.9	176.5	-178	0	0	0	0	0	111.7	S712 R737 N738 L836	S712-G714 VanDerWaalsContact C-N 3.26Å; S712-G714 PolarHBondContact OG-N 2.99Å; G714-R737 CarbonylContact C-O 3.47Å; G714-R737 VanDerWaalsContact CA-O 3.3Å; G714-R737 WeakPolarHBondContact CA-O 3.31Å; G714-N738 VanDerWaalsContact CA-O 3.28Å; G714-N738 WeakPolarHBondContact CA-O 3.39Å; G714-L836 VanDerWaalsContact O-CB 3.26Å; G714-L836 WeakPolarHBondContact O-CB 3.44Å; G714-L836 WeakPolarHBondContact O-CG 3.49Å; G714-L836 PolarHBondContact O-N 3.45Å
715	E	89.4	Confident	77	Confident	44 Å²	44	58.2 Å²	58.2	21%	0.206	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	149.5	-177.7	-63.4	158	-136.8	0	0	110.2	C736 R737 W833 F834 E835	E715-C736 CarbonylContact O-C 3.6Å; E715-C736 WeakPolarHBondContact O-CA 3.38Å; E715-C736 WeakPolarHBondContact O-CB 3.46Å; E715-R737 HydrophobicContact CB-CG 4.1Å; E715-R737 PolarHBondContact N-O 3.44Å; E715-R737 PolarHBondContact O-N 2.85Å; E715-R737 IonicContact OE1-NE 3.89Å; E715-R737 IonicContact OE2-CZ 2.73Å; E715-R737 IonicContact OE2-NE 3.61Å; E715-R737 PolarHBondContact OE2-NE 3.19Å; E715-R737 IonicContact OE2-NH2 2.94Å; E715-R737 PolarHBondContact OE2-NH2 3.09Å; E715-W833 HydrophobicContact CB-CE3 3.96Å; E715-F834 CarbonylContact C-O 3.52Å; E715-F834 VanDerWaalsContact CA-O 3.23Å; E715-F834 WeakPolarHBondContact CA-O 3.3Å; E715-E835 HydrophobicContact CG-CB 4.46Å
716	I	91.9	Very high	78.4	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.8	178	-172.7	166.9	0	0	0	110.8	L718 V733 V751 V798 V800 L817 F834 L836	I716-L718 HydrophobicContact CD1-CD2 3.78Å; I716-L718 HydrophobicContact CD1-CG 4.36Å; I716-L718 HydrophobicContact CG1-CD2 3.79Å; I716-L718 HydrophobicContact CG1-CG 4.05Å; I716-L718 HydrophobicContact CG2-CD1 4.32Å; I716-L718 HydrophobicContact CG2-CG 4.29Å; I716-V733 HydrophobicContact CD1-CG1 4.19Å; I716-V751 HydrophobicContact CD1-CB 4.46Å; I716-V751 HydrophobicContact CD1-CG1 3.74Å; I716-V751 HydrophobicContact CD1-CG2 3.84Å; I716-V798 HydrophobicContact CD1-CG1 3.91Å; I716-V800 HydrophobicContact CD1-CG2 4.1Å; I716-L817 HydrophobicContact CG2-CD2 4.05Å; I716-F834 HydrophobicContact CG2-CB 4.19Å; I716-F834 PolarHBondContact N-O 3.02Å; I716-F834 PolarHBondContact O-N 2.92Å; I716-L836 HydrophobicContact CB-CD2 4.25Å; I716-L836 HydrophobicContact CG2-CD2 3.73Å; I716-L836 HydrophobicContact CG2-CG 4.4Å
717	N	93.7	Very high	80	Confident	29 Å²	29	66.3 Å²	66.3	16%	0.155	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.4	173.4	-179.1	-3.9	0	0	0	109.7	H734 A735 D832 W833	N717-H734 HydrophobicContact CB-CB 4Å; N717-H734 PolarHBondContact O-N 3.42Å; N717-H734 PolarHBondContact OD1-CD2 2.94Å; N717-H734 VanDerWaalsContact OD1-CD2 3.31Å; N717-A735 PolarHBondContact N-O 3.31Å; N717-D832 WeakPolarHBondContact CA-O 3.28Å; N717-W833 HydrophobicContact CB-CD2 3.74Å; N717-W833 HydrophobicContact CB-CE3 3.74Å; N717-W833 HydrophobicContact CB-CG 4.43Å; N717-W833 HydrophobicContact CB-CH2 3.77Å; N717-W833 HydrophobicContact CB-CZ2 3.76Å; N717-W833 HydrophobicContact CB-CZ3 3.74Å
718	L	93.7	Very high	81.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.6	179.6	-58.9	177.2	0	0	0	110.2	I716 L732 V733 V798 L817 S831 D832 F834	I716-L718 HydrophobicContact CD1-CD2 3.78Å; I716-L718 HydrophobicContact CD1-CG 4.36Å; I716-L718 HydrophobicContact CG1-CD2 3.79Å; I716-L718 HydrophobicContact CG1-CG 4.05Å; I716-L718 HydrophobicContact CG2-CD1 4.32Å; I716-L718 HydrophobicContact CG2-CG 4.29Å; L718-L732 WeakPolarHBondContact CA-O 3.4Å; L718-V733 HydrophobicContact CD2-CB 4.21Å; L718-V733 HydrophobicContact CD2-CG1 4.23Å; L718-V733 HydrophobicContact CD2-CG2 3.79Å; L718-V798 HydrophobicContact CD1-CB 4.49Å; L718-V798 HydrophobicContact CD1-CG1 4.26Å; L718-V798 HydrophobicContact CD1-CG2 4.01Å; L718-L817 HydrophobicContact CD1-CD2 3.61Å; L718-S831 VanDerWaalsContact O-CA 3.31Å; L718-S831 WeakPolarHBondContact O-CA 3.4Å; L718-D832 PolarHBondContact N-O 2.83Å; L718-D832 VanDerWaalsContact N-O 3.13Å; L718-D832 PolarHBondContact O-N 3.37Å; L718-D832 VanDerWaalsContact O-N 3.16Å; L718-F834 HydrophobicContact CB-CD2 4.12Å; L718-F834 HydrophobicContact CB-CE2 4Å; L718-F834 HydrophobicContact CD1-CD2 4.25Å; L718-F834 HydrophobicContact CG-CD2 4.29Å
719	T	93.3	Very high	83.6	Confident	26 Å²	26	54.6 Å²	54.6	16%	0.16	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.4	157.3	-48.1	0	0	0	0	109.6	V731 L732 H734 A830 S831	T719-V731 WeakPolarHBondContact O-CA 3.47Å; T719-L732 PolarHBondContact N-O 2.97Å; T719-L732 PolarHBondContact O-N 3.27Å; T719-H734 PolarHBondContact OG1-NE2 3.19Å; T719-A830 CarbonylContact C-O 3.54Å; T719-A830 VanDerWaalsContact CA-O 3.26Å; T719-A830 WeakPolarHBondContact CA-O 3.48Å; T719-A830 WeakPolarHBondContact CG2-O 3.32Å; T719-S831 WeakPolarHBondContact OG1-CB 3.45Å; T719-S831 PolarHBondContact OG1-OG 2.97Å
720	V	92.9	Very high	85.2	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.8	173.1	-177.4	0	0	0	0	108.6	L729 M730 V731 L796 L819 L821 L826 G829 A830	V720-L729 HydrophobicContact CG1-CD1 4.1Å; V720-M730 WeakPolarHBondContact CA-O 3.38Å; V720-V731 HydrophobicContact CG1-CG2 4.43Å; V720-V731 HydrophobicContact CG2-CG1 4.36Å; V720-V731 HydrophobicContact CG2-CG2 4.37Å; V720-L796 HydrophobicContact CG2-CD2 4.09Å; V720-L819 HydrophobicContact CG2-CD1 4.35Å; V720-L821 HydrophobicContact CG1-CD2 3.73Å; V720-L826 HydrophobicContact CG1-CD2 3.98Å; V720-G829 CarbonylContact O-C 3.55Å; V720-G829 VanDerWaalsContact O-CA 3.28Å; V720-G829 WeakPolarHBondContact O-CA 3.49Å; V720-A830 PolarHBondContact N-O 3.29Å; V720-A830 PolarHBondContact O-N 2.91Å
721	R	92.9	Very high	87.2	Confident	116 Å²	116	43.8 Å²	43.8	44%	0.438	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	155	178.6	69.9	-178.8	-172.8	83.8	-7.5	112.2	M730 L826	R721-M730 HydrophobicContact CG-CB 4.04Å; R721-M730 HydrophobicContact CG-CG 4.38Å; R721-M730 PolarHBondContact N-O 2.82Å; R721-M730 WeakPolarHBondContact O-CA 3.23Å; R721-M730 WeakPolarHBondContact O-CB 3.42Å; R721-M730 WeakPolarHBondContact O-CG 3.1Å; R721-M730 PolarHBondContact O-N 3.26Å; R721-L826 CarbonylContact C-O 3.41Å; R721-L826 WeakPolarHBondContact CA-O 3.11Å
722	Y	91.7	Very high	88.8	Confident	8 Å²	8	44.7 Å²	44.7	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	150.5	170.9	-155.7	-102.2	0	0	0	110.9	N727 K728 L729 V786 S787 L788 A791 L826	Y722-N727 VanDerWaalsContact OH-CA 3.29Å; Y722-N727 WeakPolarHBondContact OH-CA 3.48Å; Y722-N727 PolarHBondContact OH-O 2.84Å; Y722-N727 PolarHBondContact OH-OD1 3.31Å; Y722-K728 WeakPolarHBondContact CD2-O 3.17Å; Y722-K728 VanDerWaalsContact CE2-C 3.46Å; Y722-K728 PolarHBondContact OH-N 2.99Å; Y722-L729 HydrophobicContact CD2-CB 4.15Å; Y722-L729 HydrophobicContact CD2-CD1 4.36Å; Y722-L729 HydrophobicContact CE2-CB 4.31Å; Y722-V786 WeakPolarHBondContact CE2-O 3.34Å; Y722-V786 PolarHBondContact OH-O 2.8Å; Y722-S787 VanDerWaalsContact OH-C 3.24Å; Y722-S787 WeakPolarHBondContact OH-CA 3.07Å; Y722-L788 HydrophobicContact CD1-CB 4.17Å; Y722-L788 HydrophobicContact CD1-CD1 3.96Å; Y722-L788 HydrophobicContact CD2-CD1 4.06Å; Y722-L788 HydrophobicContact CE1-CB 3.88Å; Y722-L788 HydrophobicContact CE2-CB 4.36Å; Y722-L788 HydrophobicContact CG-CD1 3.74Å; Y722-L788 PolarHBondContact OH-N 2.77Å; Y722-A791 HydrophobicContact CD2-CB 4.26Å; Y722-A791 HydrophobicContact CE2-CB 4.21Å; Y722-L826 PolarHBondContact N-O 2.88Å
723	A	89.3	Confident	90	Very high	13 Å²	13	42.9 Å²	42.9	11%	0.107	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	81.5	173.8	0	0	0	0	0	109.1	M725 R726 N727 K728 M730	A723-M725 VanDerWaalsContact C-N 3.3Å; A723-M725 PolarHBondContact O-N 2.66Å; A723-R726 HydrophobicContact CB-CB 4.25Å; A723-R726 CarbonylContact O-C 3.59Å; A723-R726 WeakPolarHBondContact O-CA 3.43Å; A723-R726 PolarHBondContact O-N 3.27Å; A723-N727 PolarHBondContact O-N 3.23Å; A723-K728 PolarHBondContact N-O 2.69Å; A723-M730 HydrophobicContact CB-CG 3.74Å; A723-M730 HydrophobicContact CB-SD 3.74Å
724	T	84.5	Confident	90.8	Very high	88 Å²	88	44.5 Å²	44.5	54%	0.54	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-53	-43.6	-171.7	-39.2	0	0	0	0	113	R726 N727	T724-R726 PolarHBondContact O-N 3.18Å; T724-R726 VanDerWaalsContact O-N 3.07Å; T724-N727 PolarHBondContact O-N 2.65Å
725	M	84.9	Confident	91.1	Very high	190 Å²	190	45.1 Å²	45.1	94%	0.936	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-66.1	-6.8	176.8	-61.4	-58.3	-64.6	0	0	114.9	A723	A723-M725 VanDerWaalsContact C-N 3.3Å; A723-M725 PolarHBondContact O-N 2.66Å
726	R	83.8	Confident	91.2	Very high	166 Å²	166	43.2 Å²	43.2	63%	0.626	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-125	-1.8	179.7	-62.9	-174.7	-178.9	-177.8	-2.1	113.4	A723 T724 K728	A723-R726 HydrophobicContact CB-CB 4.25Å; A723-R726 CarbonylContact O-C 3.59Å; A723-R726 WeakPolarHBondContact O-CA 3.43Å; A723-R726 PolarHBondContact O-N 3.27Å; T724-R726 PolarHBondContact O-N 3.18Å; T724-R726 VanDerWaalsContact O-N 3.07Å; R726-K728 VanDerWaalsContact C-N 3.34Å; R726-K728 HydrophobicContact CB-CD 4.35Å; R726-K728 WeakPolarHBondContact O-CG 3.4Å; R726-K728 PolarHBondContact O-N 2.6Å
727	N	89.7	Confident	91	Very high	97 Å²	97	47.6 Å²	47.6	52%	0.519	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	47.1	-176	-160.8	57	0	0	0	113.8	Y722 A723 T724	Y722-N727 VanDerWaalsContact OH-CA 3.29Å; Y722-N727 WeakPolarHBondContact OH-CA 3.48Å; Y722-N727 PolarHBondContact OH-O 2.84Å; Y722-N727 PolarHBondContact OH-OD1 3.31Å; A723-N727 PolarHBondContact O-N 3.23Å; T724-N727 PolarHBondContact O-N 2.65Å
728	K	92	Very high	90.5	Very high	51 Å²	51	50.6 Å²	50.6	22%	0.222	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	143.2	-176.9	-72.2	167.3	-173.7	-97.2	0	112.6	Y722 A723 R726 M730 E783 F784 D785	Y722-K728 WeakPolarHBondContact CD2-O 3.17Å; Y722-K728 VanDerWaalsContact CE2-C 3.46Å; Y722-K728 PolarHBondContact OH-N 2.99Å; A723-K728 PolarHBondContact N-O 2.69Å; R726-K728 VanDerWaalsContact C-N 3.34Å; R726-K728 HydrophobicContact CB-CD 4.35Å; R726-K728 WeakPolarHBondContact O-CG 3.4Å; R726-K728 PolarHBondContact O-N 2.6Å; K728-M730 HydrophobicContact CB-SD 3.88Å; K728-E783 HydrophobicContact CD-CB 4.48Å; K728-E783 WeakPolarHBondContact CD-OE2 3.26Å; K728-E783 IonicContact NZ-OE2 2.66Å; K728-F784 WeakPolarHBondContact CA-O 3.21Å; K728-D785 VanDerWaalsContact CE-OD1 3.27Å; K728-D785 WeakPolarHBondContact CE-OD1 3.23Å; K728-D785 IonicContact NZ-OD1 2.64Å; K728-D785 PolarHBondContact NZ-OD1 3.12Å
729	L	91.8	Very high	89.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	135.9	165.7	178	67.9	0	0	0	109.9	V720 Y722 L755 E783 F784 V786 A791 L821 L826	V720-L729 HydrophobicContact CG1-CD1 4.1Å; Y722-L729 HydrophobicContact CD2-CB 4.15Å; Y722-L729 HydrophobicContact CD2-CD1 4.36Å; Y722-L729 HydrophobicContact CE2-CB 4.31Å; L729-L755 HydrophobicContact CD2-CD1 3.83Å; L729-L755 HydrophobicContact CD2-CD2 4.06Å; L729-E783 WeakPolarHBondContact O-CA 3.36Å; L729-F784 HydrophobicContact CB-CB 4.35Å; L729-F784 PolarHBondContact N-O 3.31Å; L729-F784 PolarHBondContact O-N 3.09Å; L729-V786 HydrophobicContact CB-CG2 3.69Å; L729-A791 HydrophobicContact CB-CB 4.48Å; L729-A791 HydrophobicContact CD2-CB 4.38Å; L729-L821 HydrophobicContact CD2-CD1 3.71Å; L729-L826 HydrophobicContact CD1-CD1 4.4Å; L729-L826 HydrophobicContact CD1-CD2 4.25Å
730	M	92.1	Very high	89.1	Confident	8 Å²	8	50.9 Å²	50.9	4%	0.039	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.7	-171.9	-40.1	-67.4	-70.9	0	0	109.9	V720 R721 A723 K728 E783	V720-M730 WeakPolarHBondContact CA-O 3.38Å; R721-M730 HydrophobicContact CG-CB 4.04Å; R721-M730 HydrophobicContact CG-CG 4.38Å; R721-M730 PolarHBondContact N-O 2.82Å; R721-M730 WeakPolarHBondContact O-CA 3.23Å; R721-M730 WeakPolarHBondContact O-CB 3.42Å; R721-M730 WeakPolarHBondContact O-CG 3.1Å; R721-M730 PolarHBondContact O-N 3.26Å; A723-M730 HydrophobicContact CB-CG 3.74Å; A723-M730 HydrophobicContact CB-SD 3.74Å; K728-M730 HydrophobicContact CB-SD 3.88Å; M730-E783 HydrophobicContact CE-CG 3.69Å; M730-E783 WeakPolarHBondContact CE-OE1 3.38Å; M730-E783 HydrophobicContact SD-CB 4.44Å; M730-E783 HydrophobicContact SD-CG 4.02Å
731	V	93.8	Very high	88	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	118.9	176.6	-177.3	0	0	0	0	109.4	T719 V720 I753 F782 F784 L796	T719-V731 WeakPolarHBondContact O-CA 3.47Å; V720-V731 HydrophobicContact CG1-CG2 4.43Å; V720-V731 HydrophobicContact CG2-CG1 4.36Å; V720-V731 HydrophobicContact CG2-CG2 4.37Å; V731-I753 HydrophobicContact CG1-CD1 3.91Å; V731-F782 PolarHBondContact N-O 3.46Å; V731-F782 PolarHBondContact O-N 3.36Å; V731-F784 HydrophobicContact CB-CE2 4.46Å; V731-F784 HydrophobicContact CG2-CD2 4.39Å; V731-F784 HydrophobicContact CG2-CE2 4.02Å; V731-L796 HydrophobicContact CG1-CD2 4.1Å; V731-L796 HydrophobicContact CG2-CD1 4.06Å; V731-L796 HydrophobicContact CG2-CD2 3.97Å
732	L	93.6	Very high	86.7	Confident	48 Å²	48	50.3 Å²	50.3	25%	0.251	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.4	177.7	172.2	60.1	0	0	0	109.4	L718 T719 H734 K781	L718-L732 WeakPolarHBondContact CA-O 3.4Å; T719-L732 PolarHBondContact N-O 2.97Å; T719-L732 PolarHBondContact O-N 3.27Å; L732-H734 WeakPolarHBondContact CD2-CE1 3.49Å; L732-K781 HydrophobicContact CD1-CB 4.08Å
733	V	94.4	Very high	85.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	106.7	174.8	-176.6	0	0	0	0	108.6	I716 L718 V751 I753 T767 F778 E779 E780 F782	I716-V733 HydrophobicContact CD1-CG1 4.19Å; L718-V733 HydrophobicContact CD2-CB 4.21Å; L718-V733 HydrophobicContact CD2-CG1 4.23Å; L718-V733 HydrophobicContact CD2-CG2 3.79Å; V733-V751 HydrophobicContact CG1-CB 4.4Å; V733-V751 HydrophobicContact CG1-CG2 3.96Å; V733-V751 HydrophobicContact CG2-CG1 4.5Å; V733-I753 HydrophobicContact CG2-CD1 3.75Å; V733-T767 HydrophobicContact CB-CG2 4.1Å; V733-T767 HydrophobicContact CG1-CG2 4.16Å; V733-T767 HydrophobicContact CG2-CG2 4.15Å; V733-F778 HydrophobicContact CG1-CB 4.09Å; V733-F778 HydrophobicContact CG1-CD2 3.8Å; V733-F778 HydrophobicContact CG1-CG 4.15Å; V733-E779 CarbonylContact O-C 3.6Å; V733-E779 VanDerWaalsContact O-CA 3.31Å; V733-E779 WeakPolarHBondContact O-CA 3.01Å; V733-E779 PolarHBondContact O-N 3.07Å; V733-E780 PolarHBondContact N-O 3.28Å; V733-E780 PolarHBondContact O-N 2.9Å; V733-F782 HydrophobicContact CG2-CD2 4.17Å; V733-F782 HydrophobicContact CG2-CE2 3.82Å
734	H	92.4	Very high	84.1	Confident	48 Å²	48	59.7 Å²	59.7	22%	0.222	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-67.2	179.4	-68.5	-78.1	0	0	0	111.1	N717 T719 L732 F778 E779	N717-H734 HydrophobicContact CB-CB 4Å; N717-H734 PolarHBondContact O-N 3.42Å; N717-H734 PolarHBondContact OD1-CD2 2.94Å; N717-H734 VanDerWaalsContact OD1-CD2 3.31Å; T719-H734 PolarHBondContact OG1-NE2 3.19Å; L732-H734 WeakPolarHBondContact CD2-CE1 3.49Å; H734-F778 PolarHBondContact O-N 2.87Å; H734-E779 PolarHBondContact O-N 2.87Å; H734-E779 VanDerWaalsContact O-N 3.09Å
735	A	92.1	Very high	82.9	Confident	14 Å²	14	58.1 Å²	58.1	12%	0.116	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	167.3	-170.8	0	0	0	0	0	111.2	N717 P776 V777 W833	N717-A735 PolarHBondContact N-O 3.31Å; A735-P776 CarbonylContact C-O 3.57Å; A735-P776 WeakPolarHBondContact CA-O 3.19Å; A735-P776 WeakPolarHBondContact CB-O 3.44Å; A735-V777 HydrophobicContact CB-CB 4.5Å; A735-V777 HydrophobicContact CB-CG2 4.14Å; A735-W833 HydrophobicContact CB-CH2 4.16Å
736	C	91.4	Very high	82.2	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.02	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	154.6	160.4	-50.7	0	0	0	0	110.2	E715 L739 K775 P776	E715-C736 CarbonylContact O-C 3.6Å; E715-C736 WeakPolarHBondContact O-CA 3.38Å; E715-C736 WeakPolarHBondContact O-CB 3.46Å; C736-L739 HydrophobicContact CB-CD1 3.76Å; C736-L739 HydrophobicContact CB-CD2 3.78Å; C736-L739 HydrophobicContact CB-CG 3.69Å; C736-K775 CarbonylContact O-C 3.56Å; C736-K775 VanDerWaalsContact O-CA 3.32Å; C736-K775 WeakPolarHBondContact O-CA 3.42Å; C736-P776 HydrophobicContact CB-CG 3.75Å; C736-P776 PolarHBondContact N-O 3.43Å; C736-P776 WeakPolarHBondContact O-CD 3.36Å
737	R	87.3	Confident	81.9	Confident	93 Å²	93	41.7 Å²	41.7	35%	0.351	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.5	172.6	69.4	-171.6	-178.3	-171.1	-0.2	110.9	G714 E715 L739 W833	G714-R737 CarbonylContact C-O 3.47Å; G714-R737 VanDerWaalsContact CA-O 3.3Å; G714-R737 WeakPolarHBondContact CA-O 3.31Å; E715-R737 HydrophobicContact CB-CG 4.1Å; E715-R737 PolarHBondContact N-O 3.44Å; E715-R737 PolarHBondContact O-N 2.85Å; E715-R737 IonicContact OE1-NE 3.89Å; E715-R737 IonicContact OE2-CZ 2.73Å; E715-R737 IonicContact OE2-NE 3.61Å; E715-R737 PolarHBondContact OE2-NE 3.19Å; E715-R737 IonicContact OE2-NH2 2.94Å; E715-R737 PolarHBondContact OE2-NH2 3.09Å; R737-L739 PolarHBondContact O-N 2.84Å; R737-W833 HydrophobicContact CB-CH2 4.1Å; R737-W833 HydrophobicContact CB-CZ3 3.85Å; R737-W833 HydrophobicContact CG-CE3 3.75Å; R737-W833 HydrophobicContact CG-CH2 4.02Å; R737-W833 HydrophobicContact CG-CZ3 3.47Å; R737-W833 VanDerWaalsContact CG-CZ3 3.47Å
738	N	82.3	Confident	81.6	Confident	92 Å²	92	37.8 Å²	37.8	49%	0.492	21%	0.208	S	C	.	.	S	Bend	trans	56.7	30.1	176.4	-51.6	-21.6	0	0	0	114	G714 V774	G714-N738 VanDerWaalsContact CA-O 3.28Å; G714-N738 WeakPolarHBondContact CA-O 3.39Å; N738-V774 PolarHBondContact N-O 2.86Å
739	L	82.8	Confident	81.3	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.021	20%	0.197	C	C	.	.			trans	-61.1	143.6	177.4	-69.5	-175.6	0	0	0	111.4	C736 R737 V774 P776 V800 I814 L836	C736-L739 HydrophobicContact CB-CD1 3.76Å; C736-L739 HydrophobicContact CB-CD2 3.78Å; C736-L739 HydrophobicContact CB-CG 3.69Å; R737-L739 PolarHBondContact O-N 2.84Å; L739-V774 PolarHBondContact N-O 3.44Å; L739-V774 VanDerWaalsContact N-O 3.15Å; L739-V774 WeakPolarHBondContact O-CB 3.48Å; L739-V774 WeakPolarHBondContact O-CG1 3.25Å; L739-P776 HydrophobicContact CD1-CG 3.65Å; L739-V800 HydrophobicContact CD1-CG1 3.94Å; L739-V800 HydrophobicContact CD2-CG1 4.14Å; L739-I814 HydrophobicContact CD2-CG2 4.48Å; L739-L836 HydrophobicContact CD2-CD1 3.54Å
740	F	75.4	Confident	81.2	Confident	27 Å²	27	37.6 Å²	37.6	12%	0.118	21%	0.206	C	C	.	.			trans	-55.4	127.5	176.1	-174.8	-88.8	0	0	0	112	A705 I706 H709 F713 C742 T747 I814	A705-F740 HydrophobicContact CB-CZ 4.13Å; A705-F740 WeakPolarHBondContact O-CE2 3.42Å; A705-F740 WeakPolarHBondContact O-CZ 3.23Å; I706-F740 HydrophobicContact CD1-CE1 4.38Å; I706-F740 HydrophobicContact CG1-CD1 4.32Å; I706-F740 HydrophobicContact CG1-CE1 3.81Å; I706-F740 HydrophobicContact CG1-CE2 4.41Å; I706-F740 HydrophobicContact CG1-CZ 3.86Å; H709-F740 HydrophobicContact CB-CE2 4.15Å; F713-F740 PolarHBondContact O-N 2.92Å; F740-C742 PolarHBondContact O-N 2.78Å; F740-T747 PolarHBondContact O-OG1 3.04Å; F740-I814 HydrophobicContact CB-CG2 4.09Å
741	P	70.1	Confident	81.1	Confident	76 Å²	76	37.2 Å²	37.2	49%	0.494	20%	0.204	S	C	.	.			trans	-78.8	106.2	-179.3	30	-32.9	0	0	0	111.5	S743 T747 V774	P741-S743 VanDerWaalsContact C-N 3.26Å; P741-S743 PolarHBondContact O-N 3.5Å; P741-T747 WeakPolarHBondContact CA-OG1 3.46Å; P741-V774 HydrophobicContact CB-CG1 4.05Å
742	C	65.5	Low	81	Confident	30 Å²	30	38.4 Å²	38.4	20%	0.203	21%	0.208	C	C	.	.	S	Bend	trans	-81.4	1.3	178.8	-59.3	0	0	0	0	114.2	F740 T747 N802 F806	F740-C742 PolarHBondContact O-N 2.78Å; C742-T747 HydrophobicContact CB-CG2 4.12Å; C742-T747 PolarHBondContact N-OG1 2.81Å; C742-N802 WeakPolarHBondContact CB-ND2 3.36Å; C742-N802 PolarHBondContact SG-ND2 2.8Å; C742-N802 VanDerWaalsContact SG-ND2 3.45Å; C742-F806 HydrophobicContact CB-CZ 4.29Å
743	S	65.6	Low	80.9	Confident	37 Å²	37	36.1 Å²	36.1	26%	0.259	20%	0.196	S	C	.	.	S	Bend	trans	-162.9	163.3	168.7	71.5	0	0	0	0	110.4	P741 S745 G746 K804	P741-S743 VanDerWaalsContact C-N 3.26Å; P741-S743 PolarHBondContact O-N 3.5Å; S743-S745 PolarHBondContact O-N 2.98Å; S743-S745 PolarHBondContact OG-N 2.94Å; S743-S745 PolarHBondContact OG-OG 2.75Å; S743-G746 WeakPolarHBondContact O-CA 3.27Å; S743-G746 PolarHBondContact O-N 2.9Å; S743-G746 PolarHBondContact OG-O 2.86Å; S743-K804 PolarHBondContact OG-NZ 2.91Å
744	D	60.2	Low	80.6	Confident	181 Å²	181	36.3 Å²	36.3	97%	0.968	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.5	175.7	-38	-48.4	0	0	0	113.1
745	S	60	Low	80.5	Confident	55 Å²	55	34.2 Å²	34.2	39%	0.385	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	14.3	175.8	69.8	0	0	0	0	114.4	S743 K772	S743-S745 PolarHBondContact O-N 2.98Å; S743-S745 PolarHBondContact OG-N 2.94Å; S743-S745 PolarHBondContact OG-OG 2.75Å; S745-K772 CarbonylContact O-C 3.55Å; S745-K772 VanDerWaalsContact O-CA 3.22Å; S745-K772 WeakPolarHBondContact O-CA 3.34Å; S745-K772 WeakPolarHBondContact O-CB 3.16Å
746	G	70.5	Confident	80.1	Confident	11 Å²	11	34.3 Å²	34.3	11%	0.113	19%	0.186	C	C	.	.			trans	79.6	-167	-172.3	0	0	0	0	0	113.9	S743	S743-G746 WeakPolarHBondContact O-CA 3.27Å; S743-G746 PolarHBondContact O-N 2.9Å; S743-G746 PolarHBondContact OG-O 2.86Å
747	T	76.8	Confident	79.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	147.1	-170.3	-56.3	0	0	0	0	111.6	F740 P741 C742 K772 T773 N802 I814	F740-T747 PolarHBondContact O-OG1 3.04Å; P741-T747 WeakPolarHBondContact CA-OG1 3.46Å; C742-T747 HydrophobicContact CB-CG2 4.12Å; C742-T747 PolarHBondContact N-OG1 2.81Å; T747-K772 PolarHBondContact O-N 2.96Å; T747-K772 VanDerWaalsContact O-N 3.07Å; T747-T773 PolarHBondContact N-O 2.94Å; T747-T773 PolarHBondContact O-N 2.79Å; T747-T773 VanDerWaalsContact O-O 3.08Å; T747-N802 HydrophobicContact CG2-CB 4.36Å; T747-I814 HydrophobicContact CG2-CD1 3.54Å; T747-I814 HydrophobicContact CG2-CG1 4.41Å
748	D	83.4	Confident	78.9	Confident	15 Å²	15	36.6 Å²	36.6	8%	0.08	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	85.1	174.3	-70.4	12.3	0	0	0	108.6	V769 K770 R771 K772 N802 N803 K804	D748-V769 HydrophobicContact CB-CG1 4.2Å; D748-K770 CarbonylContact C-O 3.53Å; D748-R771 HydrophobicContact CB-CG 4.24Å; D748-R771 WeakPolarHBondContact OD1-CA 3.42Å; D748-K772 PolarHBondContact OD1-N 2.9Å; D748-N802 CarbonylContact O-C 3.6Å; D748-N802 WeakPolarHBondContact O-CA 3.36Å; D748-N802 PolarHBondContact O-OD1 3.23Å; D748-N803 HydrophobicContact CB-CB 4.34Å; D748-N803 PolarHBondContact O-N 2.88Å; D748-K804 HydrophobicContact CB-CG 4.18Å; D748-K804 VanDerWaalsContact CG-CE 3.45Å; D748-K804 WeakPolarHBondContact OD1-CE 3.14Å; D748-K804 IonicContact OD1-NZ 3.22Å; D748-K804 VanDerWaalsContact OD2-CE 3.29Å; D748-K804 WeakPolarHBondContact OD2-CE 3.48Å
749	S	86.6	Confident	78.4	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	144.3	-164.1	49.9	0	0	0	0	113.5	V769 K770 P776 K801	S749-V769 CarbonylContact O-C 3.59Å; S749-V769 WeakPolarHBondContact O-CA 3.32Å; S749-K770 PolarHBondContact N-O 2.93Å; S749-K770 PolarHBondContact O-N 2.81Å; S749-P776 WeakPolarHBondContact OG-CG 3.26Å; S749-K801 WeakPolarHBondContact CA-O 3.26Å
750	Y	89.9	Confident	77.5	Confident	47 Å²	47	36.3 Å²	36.3	18%	0.184	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	164.3	165	72.2	-82	0	0	0	110.1	K766 V769 V800 K801 N803	Y750-K766 HydrophobicContact CD2-CB 4.42Å; Y750-V769 HydrophobicContact CD1-CG2 4.16Å; Y750-V769 HydrophobicContact CG-CG2 4.32Å; Y750-V800 CarbonylContact O-C 3.55Å; Y750-V800 WeakPolarHBondContact O-CA 3.29Å; Y750-K801 HydrophobicContact CD1-CB 4.15Å; Y750-K801 WeakPolarHBondContact CD1-O 3.31Å; Y750-K801 HydrophobicContact CE1-CB 3.57Å; Y750-K801 HydrophobicContact CE2-CB 4.1Å; Y750-K801 HydrophobicContact CE2-CD 4.26Å; Y750-K801 PolarHBondContact N-O 2.87Å; Y750-K801 PolarHBondContact O-N 2.87Å; Y750-K801 WeakPolarHBondContact OH-CD 3.39Å; Y750-N803 HydrophobicContact CD1-CB 4.22Å; Y750-N803 HydrophobicContact CE1-CB 4.4Å
751	V	90	Very high	76.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.4	179.5	-172.1	0	0	0	0	109.1	I716 V733 I753 K766 T767 F778 V798 S799 V800	I716-V751 HydrophobicContact CD1-CB 4.46Å; I716-V751 HydrophobicContact CD1-CG1 3.74Å; I716-V751 HydrophobicContact CD1-CG2 3.84Å; V733-V751 HydrophobicContact CG1-CB 4.4Å; V733-V751 HydrophobicContact CG1-CG2 3.96Å; V733-V751 HydrophobicContact CG2-CG1 4.5Å; V751-I753 HydrophobicContact CG1-CG1 4.33Å; V751-K766 CarbonylContact O-C 3.54Å; V751-K766 WeakPolarHBondContact O-CA 3.2Å; V751-T767 HydrophobicContact CB-CG2 3.95Å; V751-T767 HydrophobicContact CG2-CG2 4.41Å; V751-T767 PolarHBondContact N-OG1 3Å; V751-T767 PolarHBondContact O-N 2.75Å; V751-F778 HydrophobicContact CG2-CD2 4.18Å; V751-F778 HydrophobicContact CG2-CE1 4.48Å; V751-F778 HydrophobicContact CG2-CE2 3.69Å; V751-F778 HydrophobicContact CG2-CZ 3.87Å; V751-V798 HydrophobicContact CG1-CG1 3.48Å; V751-V798 VanDerWaalsContact CG1-CG1 3.48Å; V751-S799 CarbonylContact C-O 3.52Å; V751-S799 WeakPolarHBondContact CA-O 3.14Å; V751-V800 HydrophobicContact CG2-CG2 4.26Å
752	R	90.2	Very high	75.8	Confident	25 Å²	25	45.8 Å²	45.8	9%	0.094	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	141.9	169.3	178.7	-168.7	72.3	144.9	17.9	108.4	Y754 R764 D797 V798 S799 K801	R752-Y754 HydrophobicContact CG-CD2 4.48Å; R752-Y754 HydrophobicContact CG-CE2 4.42Å; R752-R764 HydrophobicContact CG-CG 3.93Å; R752-D797 IonicContact CZ-OD1 2.66Å; R752-D797 IonicContact CZ-OD2 3.09Å; R752-D797 IonicContact NH2-OD1 2.72Å; R752-D797 PolarHBondContact NH2-OD1 3.4Å; R752-D797 IonicContact NH2-OD2 3.66Å; R752-D797 PolarHBondContact NH2-OD2 2.87Å; R752-V798 CarbonylContact O-C 3.59Å; R752-V798 WeakPolarHBondContact O-CA 3.42Å; R752-S799 VanDerWaalsContact CZ-OG 3.23Å; R752-S799 PolarHBondContact N-O 3.08Å; R752-S799 PolarHBondContact NE-OG 3.14Å; R752-S799 PolarHBondContact NH2-OG 3.08Å; R752-S799 PolarHBondContact O-N 2.75Å; R752-K801 HydrophobicContact CB-CD 4.38Å
753	I	92.1	Very high	76.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	136.5	172.7	-48.5	175.1	0	0	0	110.3	V731 V733 V751 K765 F782 F784 L796 D797 V798	V731-I753 HydrophobicContact CG1-CD1 3.91Å; V733-I753 HydrophobicContact CG2-CD1 3.75Å; V751-I753 HydrophobicContact CG1-CG1 4.33Å; I753-K765 HydrophobicContact CB-CB 4.3Å; I753-K765 PolarHBondContact N-O 2.67Å; I753-K765 PolarHBondContact O-N 2.86Å; I753-F782 HydrophobicContact CD1-CD2 3.52Å; I753-F782 HydrophobicContact CD1-CE2 3.95Å; I753-F782 HydrophobicContact CD1-CG 4.29Å; I753-F784 HydrophobicContact CB-CZ 4.48Å; I753-F784 HydrophobicContact CG2-CE2 4.3Å; I753-F784 HydrophobicContact CG2-CZ 3.83Å; I753-L796 HydrophobicContact CG2-CD1 3.62Å; I753-L796 HydrophobicContact CG2-CG 3.99Å; I753-D797 CarbonylContact C-O 3.59Å; I753-D797 WeakPolarHBondContact CA-O 3.18Å; I753-V798 HydrophobicContact CG1-CG1 4.38Å; I753-V798 HydrophobicContact CG1-CG2 4.41Å; I753-V798 HydrophobicContact CG2-CG2 4.25Å
754	Y	88.4	Confident	76.9	Confident	5 Å²	5	50.3 Å²	50.3	2%	0.02	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	150.7	164.6	-77.2	-67.5	0	0	0	110.7	R752 D758 N759 S760 R764 L796 D797	R752-Y754 HydrophobicContact CG-CD2 4.48Å; R752-Y754 HydrophobicContact CG-CE2 4.42Å; Y754-D758 WeakPolarHBondContact CD1-O 3.44Å; Y754-N759 WeakPolarHBondContact CE1-O 3.46Å; Y754-N759 PolarHBondContact OH-O 3.36Å; Y754-S760 WeakPolarHBondContact CE1-O 3.5Å; Y754-R764 HydrophobicContact CD1-CB 4.16Å; Y754-R764 HydrophobicContact CE1-CB 3.39Å; Y754-R764 HydrophobicContact CE1-CG 3.88Å; Y754-R764 HydrophobicContact CE2-CG 4.16Å; Y754-R764 WeakPolarHBondContact OH-CD 3.45Å; Y754-L796 WeakPolarHBondContact O-CA 3.48Å; Y754-D797 PolarHBondContact N-O 2.86Å; Y754-D797 PolarHBondContact O-N 3.33Å
755	L	89.5	Confident	78.2	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	92.6	170.8	-178.9	65	0	0	0	108.5	L729 D758 F784 V786 R794 Q795 L796 L821	L729-L755 HydrophobicContact CD2-CD1 3.83Å; L729-L755 HydrophobicContact CD2-CD2 4.06Å; L755-D758 WeakPolarHBondContact O-CB 3.47Å; L755-D758 PolarHBondContact O-N 3.49Å; L755-D758 VanDerWaalsContact O-N 3.08Å; L755-F784 HydrophobicContact CB-CD1 3.82Å; L755-F784 HydrophobicContact CB-CE1 3.86Å; L755-F784 HydrophobicContact CB-CG 4.34Å; L755-F784 HydrophobicContact CB-CZ 4.41Å; L755-F784 HydrophobicContact CD2-CB 3.78Å; L755-F784 HydrophobicContact CD2-CD1 4.06Å; L755-F784 HydrophobicContact CD2-CG 3.94Å; L755-V786 HydrophobicContact CD2-CG1 3.81Å; L755-V786 HydrophobicContact CD2-CG2 3.95Å; L755-R794 HydrophobicContact CD1-CB 3.79Å; L755-R794 HydrophobicContact CG-CB 4.27Å; L755-Q795 CarbonylContact C-O 3.59Å; L755-L796 HydrophobicContact CD1-CD1 4.24Å; L755-L821 HydrophobicContact CD1-CD1 3.47Å; L755-L821 VanDerWaalsContact CD1-CD1 3.47Å
756	L	83.3	Confident	79.6	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.084	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	142.6	-176.3	-59.4	179.8	0	0	0	110.7	N759 R794 Q795 D797 M818	L756-N759 HydrophobicContact CD2-CB 3.95Å; L756-R794 VanDerWaalsContact O-CB 3.27Å; L756-R794 WeakPolarHBondContact O-CB 3.42Å; L756-R794 VanDerWaalsContact O-CG 3.31Å; L756-R794 WeakPolarHBondContact O-CG 3.39Å; L756-Q795 HydrophobicContact CB-CB 4.37Å; L756-Q795 WeakPolarHBondContact CB-O 3.29Å; L756-Q795 HydrophobicContact CD1-CB 4.47Å; L756-Q795 PolarHBondContact N-O 2.97Å; L756-Q795 PolarHBondContact O-N 3.2Å; L756-D797 HydrophobicContact CD1-CB 4.15Å; L756-D797 HydrophobicContact CG-CB 4.23Å; L756-M818 HydrophobicContact CD1-CE 3.73Å; L756-M818 HydrophobicContact CD1-SD 4.42Å
757	P	78.1	Confident	80.5	Confident	90 Å²	90	48.2 Å²	48.2	58%	0.584	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	cis	-76.1	-10.5	14.7	30.2	-37	0	0	0	116.4	N759	P757-N759 PolarHBondContact O-N 2.96Å
758	D	77.3	Confident	80.9	Confident	55 Å²	55	54.9 Å²	54.9	29%	0.294	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-73.3	79.3	-170.5	-54.9	-35.9	0	0	0	113.1	Y754 L755 H763 R794	Y754-D758 WeakPolarHBondContact CD1-O 3.44Å; L755-D758 WeakPolarHBondContact O-CB 3.47Å; L755-D758 PolarHBondContact O-N 3.49Å; L755-D758 VanDerWaalsContact O-N 3.08Å; D758-H763 HydrophobicContact CB-CB 4.1Å; D758-R794 IonicContact OD2-CZ 2.64Å; D758-R794 IonicContact OD2-NH1 3.87Å; D758-R794 PolarHBondContact OD2-NH1 3.26Å; D758-R794 IonicContact OD2-NH2 2.73Å; D758-R794 PolarHBondContact OD2-NH2 3.07Å
759	N	70.9	Confident	81.1	Confident	38 Å²	38	56.3 Å²	56.3	20%	0.203	26%	0.261	C	S	.	.			trans	-92.5	4.4	-179.1	75.3	-14.8	0	0	0	114.7	S692 R693 Y754 L756 P757	S692-N759 PolarHBondContact OG-O 2.81Å; R693-N759 PolarHBondContact NH1-ND2 2.99Å; Y754-N759 WeakPolarHBondContact CE1-O 3.46Å; Y754-N759 PolarHBondContact OH-O 3.36Å; L756-N759 HydrophobicContact CD2-CB 3.95Å; P757-N759 PolarHBondContact O-N 2.96Å
760	S	64.1	Low	81	Confident	51 Å²	51	59.4 Å²	59.4	36%	0.357	28%	0.275	S	S	.	.	S	Bend	trans	-71.6	142.5	176.3	173.8	0	0	0	0	111.2	Y754 R762 H763	Y754-S760 WeakPolarHBondContact CE1-O 3.5Å; S760-R762 PolarHBondContact O-N 2.97Å; S760-H763 PolarHBondContact O-N 3.39Å
761	W	52.2	Low	80.8	Confident	115 Å²	115	65.6 Å²	65.6	44%	0.436	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-48.1	-35.3	-178.2	-177.6	-58.2	0	0	0	113	T250 H763 R764	T250-W761 HydrophobicContact CG2-CE3 4.08Å; T250-W761 HydrophobicContact CG2-CZ3 3.9Å; W761-H763 PolarHBondContact O-N 3.05Å; W761-H763 VanDerWaalsContact O-N 3.12Å; W761-R764 VanDerWaalsContact CD2-NH2 3.3Å; W761-R764 VanDerWaalsContact O-CB 3.23Å; W761-R764 WeakPolarHBondContact O-CB 3.28Å; W761-R764 PolarHBondContact O-N 2.89Å
762	R	56.5	Low	80.3	Confident	188 Å²	188	72.5 Å²	72.5	71%	0.709	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-56.7	-26.2	178.8	-64.9	-174.4	177.8	-170.9	-2.7	113.6	E263 S760	E263-R762 IonicContact OE2-NH2 2.75Å; E263-R762 PolarHBondContact OE2-NH2 2.95Å; S760-R762 PolarHBondContact O-N 2.97Å
763	H	74.1	Confident	79.9	Confident	86 Å²	86	73.2 Å²	73.2	40%	0.398	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-103.2	-0.1	179.6	-53.7	-93.3	0	0	0	113	D758 S760 W761 K765	D758-H763 HydrophobicContact CB-CB 4.1Å; S760-H763 PolarHBondContact O-N 3.39Å; W761-H763 PolarHBondContact O-N 3.05Å; W761-H763 VanDerWaalsContact O-N 3.12Å; H763-K765 PolarHBondContact O-N 2.96Å
764	R	81	Confident	79.4	Confident	76 Å²	76	75.6 Å²	75.6	29%	0.287	35%	0.349	S	S	.	.			trans	-72.7	113.1	179.9	-169.6	177.8	63.5	-176.2	0.4	111.2	R752 Y754 W761	R752-R764 HydrophobicContact CG-CG 3.93Å; Y754-R764 HydrophobicContact CD1-CB 4.16Å; Y754-R764 HydrophobicContact CE1-CB 3.39Å; Y754-R764 HydrophobicContact CE1-CG 3.88Å; Y754-R764 HydrophobicContact CE2-CG 4.16Å; Y754-R764 WeakPolarHBondContact OH-CD 3.45Å; W761-R764 VanDerWaalsContact CD2-NH2 3.3Å; W761-R764 VanDerWaalsContact O-CB 3.23Å; W761-R764 WeakPolarHBondContact O-CB 3.28Å; W761-R764 PolarHBondContact O-N 2.89Å
765	K	86.7	Confident	79.2	Confident	66 Å²	66	81.9 Å²	81.9	29%	0.287	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	153	167	-47.8	-67.4	-173	170.2	0	109.8	I753 H763 F782 E783 F784	I753-K765 HydrophobicContact CB-CB 4.3Å; I753-K765 PolarHBondContact N-O 2.67Å; I753-K765 PolarHBondContact O-N 2.86Å; H763-K765 PolarHBondContact O-N 2.96Å; K765-F782 HydrophobicContact CB-CB 4.31Å; K765-F782 HydrophobicContact CB-CD1 3.61Å; K765-F782 HydrophobicContact CB-CE1 4.1Å; K765-F782 HydrophobicContact CB-CG 3.92Å; K765-F782 HydrophobicContact CD-CD1 4.33Å; K765-F782 HydrophobicContact CG-CB 4.17Å; K765-F782 HydrophobicContact CG-CD1 4.13Å; K765-F782 HydrophobicContact CG-CG 4.31Å; K765-E783 WeakPolarHBondContact CE-O 3.37Å; K765-E783 PolarHBondContact NZ-O 2.78Å; K765-F784 HydrophobicContact CB-CZ 4.43Å; K765-F784 HydrophobicContact CD-CE1 4.47Å; K765-F784 HydrophobicContact CG-CE1 3.71Å; K765-F784 HydrophobicContact CG-CE2 4.33Å; K765-F784 HydrophobicContact CG-CZ 3.51Å
766	K	89.8	Confident	79.1	Confident	130 Å²	130	81.8 Å²	81.8	57%	0.565	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.4	152.1	175.5	66.4	173.6	-177.4	176.9	0	112.2	Y750 V751 F782	Y750-K766 HydrophobicContact CD2-CB 4.42Å; V751-K766 CarbonylContact O-C 3.54Å; V751-K766 WeakPolarHBondContact O-CA 3.2Å; K766-F782 WeakPolarHBondContact O-CE1 3.46Å; K766-F782 VanDerWaalsContact O-CZ 3.32Å; K766-F782 WeakPolarHBondContact O-CZ 3.35Å
767	T	89.4	Confident	79.5	Confident	7 Å²	7	84.6 Å²	84.6	4%	0.043	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-89.1	167.2	173.6	64.8	0	0	0	0	113.8	V733 V751 F778 E780 F782	V733-T767 HydrophobicContact CB-CG2 4.1Å; V733-T767 HydrophobicContact CG1-CG2 4.16Å; V733-T767 HydrophobicContact CG2-CG2 4.15Å; V751-T767 HydrophobicContact CB-CG2 3.95Å; V751-T767 HydrophobicContact CG2-CG2 4.41Å; V751-T767 PolarHBondContact N-OG1 3Å; V751-T767 PolarHBondContact O-N 2.75Å; T767-F778 HydrophobicContact CG2-CB 4.28Å; T767-F778 HydrophobicContact CG2-CD1 4.07Å; T767-F778 HydrophobicContact CG2-CG 4.19Å; T767-F778 VanDerWaalsContact OG1-CD1 3.23Å; T767-F778 WeakPolarHBondContact OG1-CD1 3.48Å; T767-F778 WeakPolarHBondContact OG1-CE1 3.49Å; T767-E780 WeakPolarHBondContact CA-OE2 3.37Å; T767-E780 WeakPolarHBondContact CB-OE2 3.43Å; T767-E780 HydrophobicContact CG2-CB 3.99Å; T767-F782 HydrophobicContact CG2-CE2 3.71Å; T767-F782 HydrophobicContact CG2-CZ 3.7Å
768	H	85.4	Confident	80	Confident	139 Å²	139	80.8 Å²	80.8	64%	0.644	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-68.2	142.2	168.2	-71.7	-84.2	0	0	0	111.9	K770 F778 E780	H768-K770 PolarHBondContact O-N 2.72Å; H768-F778 WeakPolarHBondContact O-CD1 3.22Å; H768-F778 VanDerWaalsContact O-CE1 3.29Å; H768-F778 WeakPolarHBondContact O-CE1 3.48Å; H768-E780 IonicContact CD2-OE1 3.16Å; H768-E780 IonicContact CD2-OE2 2.72Å; H768-E780 PolarHBondContact CD2-OE2 3.02Å; H768-E780 VanDerWaalsContact CD2-OE2 3.28Å; H768-E780 IonicContact CG-OE2 3.99Å; H768-E780 PolarHBondContact N-OE1 2.96Å; H768-E780 VanDerWaalsContact N-OE1 3.12Å; H768-E780 PolarHBondContact N-OE2 2.82Å
769	V	87.4	Confident	80.7	Confident	46 Å²	46	85 Å²	85	28%	0.279	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-72.3	116.2	-178.4	-179	0	0	0	0	111.4	D748 S749 Y750 R771 N803	D748-V769 HydrophobicContact CB-CG1 4.2Å; S749-V769 CarbonylContact O-C 3.59Å; S749-V769 WeakPolarHBondContact O-CA 3.32Å; Y750-V769 HydrophobicContact CD1-CG2 4.16Å; Y750-V769 HydrophobicContact CG-CG2 4.32Å; V769-R771 HydrophobicContact CG1-CG 4.09Å; V769-N803 HydrophobicContact CB-CB 4.45Å; V769-N803 HydrophobicContact CG1-CB 3.61Å; V769-N803 HydrophobicContact CG2-CB 3.91Å
770	K	85.2	Confident	81.6	Confident	65 Å²	65	84.6 Å²	84.6	28%	0.283	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	113.9	173.5	-51.9	-70	166.5	135.9	0	108.4	D748 S749 H768 T773 P776 V777 F778	D748-K770 CarbonylContact C-O 3.53Å; S749-K770 PolarHBondContact N-O 2.93Å; S749-K770 PolarHBondContact O-N 2.81Å; H768-K770 PolarHBondContact O-N 2.72Å; K770-T773 HydrophobicContact CB-CG2 4.17Å; K770-P776 HydrophobicContact CB-CB 3.73Å; K770-P776 HydrophobicContact CG-CB 4.04Å; K770-V777 VanDerWaalsContact CD-O 3.29Å; K770-V777 WeakPolarHBondContact CD-O 3.33Å; K770-V777 WeakPolarHBondContact CE-O 3.44Å; K770-V777 PolarHBondContact NZ-O 2.79Å; K770-F778 HydrophobicContact CB-CE1 4.29Å; K770-F778 HydrophobicContact CD-CD1 4.42Å; K770-F778 HydrophobicContact CG-CD1 3.67Å; K770-F778 HydrophobicContact CG-CE1 3.48Å; K770-F778 VanDerWaalsContact CG-CE1 3.48Å; K770-F778 HydrophobicContact CG-CG 4.5Å; K770-F778 HydrophobicContact CG-CZ 4.18Å; K770-F778 PolarHBondContact NZ-O 2.86Å
771	R	85.1	Confident	83	Confident	176 Å²	176	87.5 Å²	87.5	66%	0.664	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	152.4	-169.8	-62.8	-172.4	-177.8	167.1	0.1	113.2	D748 V769 T773	D748-R771 HydrophobicContact CB-CG 4.24Å; D748-R771 WeakPolarHBondContact OD1-CA 3.42Å; V769-R771 HydrophobicContact CG1-CG 4.09Å; R771-T773 VanDerWaalsContact C-N 3.3Å; R771-T773 PolarHBondContact O-N 2.86Å
772	K	79.8	Confident	84.9	Confident	146 Å²	146	83.2 Å²	83.2	64%	0.635	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.6	40.7	172.8	-65.2	-173.7	177.1	-177.1	0	114.7	S745 T747 D748	S745-K772 CarbonylContact O-C 3.55Å; S745-K772 VanDerWaalsContact O-CA 3.22Å; S745-K772 WeakPolarHBondContact O-CA 3.34Å; S745-K772 WeakPolarHBondContact O-CB 3.16Å; T747-K772 PolarHBondContact O-N 2.96Å; T747-K772 VanDerWaalsContact O-N 3.07Å; D748-K772 PolarHBondContact OD1-N 2.9Å
773	T	82.1	Confident	86.6	Confident	39 Å²	39	76.5 Å²	76.5	24%	0.239	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148	-179.9	-177	0	0	0	0	112.7	T747 K770 R771 K775 P776	T747-T773 PolarHBondContact N-O 2.94Å; T747-T773 PolarHBondContact O-N 2.79Å; T747-T773 VanDerWaalsContact O-O 3.08Å; K770-T773 HydrophobicContact CB-CG2 4.17Å; R771-T773 VanDerWaalsContact C-N 3.3Å; R771-T773 PolarHBondContact O-N 2.86Å; T773-K775 VanDerWaalsContact OG1-C 3.31Å; T773-K775 PolarHBondContact OG1-N 2.64Å; T773-K775 PolarHBondContact OG1-O 2.64Å; T773-P776 HydrophobicContact CG2-CB 3.88Å
774	V	81.7	Confident	87.4	Confident	50 Å²	50	73 Å²	73	30%	0.303	33%	0.334	S	S	.	.	S	Bend	trans	-106.2	1.6	169.6	-64.2	0	0	0	0	112.4	N738 L739 P741	N738-V774 PolarHBondContact N-O 2.86Å; L739-V774 PolarHBondContact N-O 3.44Å; L739-V774 VanDerWaalsContact N-O 3.15Å; L739-V774 WeakPolarHBondContact O-CB 3.48Å; L739-V774 WeakPolarHBondContact O-CG1 3.25Å; P741-V774 HydrophobicContact CB-CG1 4.05Å
775	K	84.2	Confident	87.7	Confident	137 Å²	137	74.9 Å²	74.9	60%	0.596	35%	0.35	S	S	*	.	S	Bend	trans	-131.9	66.3	173.4	-64	-177.2	-179.2	-179.4	0	109.6	C736 T773	C736-K775 CarbonylContact O-C 3.56Å; C736-K775 VanDerWaalsContact O-CA 3.32Å; C736-K775 WeakPolarHBondContact O-CA 3.42Å; T773-K775 VanDerWaalsContact OG1-C 3.31Å; T773-K775 PolarHBondContact OG1-N 2.64Å; T773-K775 PolarHBondContact OG1-O 2.64Å
776	P	87.7	Confident	87.9	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.006	34%	0.34	C	S	.	.			trans	-70.9	136.2	178.4	31.9	-37.7	0	0	0	111.1	A735 C736 L739 S749 K770 T773 F778	A735-P776 CarbonylContact C-O 3.57Å; A735-P776 WeakPolarHBondContact CA-O 3.19Å; A735-P776 WeakPolarHBondContact CB-O 3.44Å; C736-P776 HydrophobicContact CB-CG 3.75Å; C736-P776 PolarHBondContact N-O 3.43Å; C736-P776 WeakPolarHBondContact O-CD 3.36Å; L739-P776 HydrophobicContact CD1-CG 3.65Å; S749-P776 WeakPolarHBondContact OG-CG 3.26Å; K770-P776 HydrophobicContact CB-CB 3.73Å; K770-P776 HydrophobicContact CG-CB 4.04Å; T773-P776 HydrophobicContact CG2-CB 3.88Å; P776-F778 HydrophobicContact CB-CD2 4.46Å; P776-F778 HydrophobicContact CB-CE1 4.39Å; P776-F778 HydrophobicContact CB-CE2 3.69Å; P776-F778 HydrophobicContact CB-CZ 3.65Å; P776-F778 HydrophobicContact CG-CE2 3.62Å; P776-F778 HydrophobicContact CG-CZ 3.83Å
777	V	90.1	Very high	87.9	Confident	75 Å²	75	67.7 Å²	67.7	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.6	167.3	-178.8	0	0	0	0	107.6	A735 K770 E779	A735-V777 HydrophobicContact CB-CB 4.5Å; A735-V777 HydrophobicContact CB-CG2 4.14Å; K770-V777 VanDerWaalsContact CD-O 3.29Å; K770-V777 WeakPolarHBondContact CD-O 3.33Å; K770-V777 WeakPolarHBondContact CE-O 3.44Å; K770-V777 PolarHBondContact NZ-O 2.79Å; V777-E779 HydrophobicContact CG1-CG 3.87Å
778	F	90.3	Very high	87.8	Confident	10 Å²	10	69.6 Å²	69.6	4%	0.044	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-59.5	-177.6	-61.8	-79.5	0	0	0	110.8	V733 H734 V751 T767 H768 K770 P776 E780	V733-F778 HydrophobicContact CG1-CB 4.09Å; V733-F778 HydrophobicContact CG1-CD2 3.8Å; V733-F778 HydrophobicContact CG1-CG 4.15Å; H734-F778 PolarHBondContact O-N 2.87Å; V751-F778 HydrophobicContact CG2-CD2 4.18Å; V751-F778 HydrophobicContact CG2-CE1 4.48Å; V751-F778 HydrophobicContact CG2-CE2 3.69Å; V751-F778 HydrophobicContact CG2-CZ 3.87Å; T767-F778 HydrophobicContact CG2-CB 4.28Å; T767-F778 HydrophobicContact CG2-CD1 4.07Å; T767-F778 HydrophobicContact CG2-CG 4.19Å; T767-F778 VanDerWaalsContact OG1-CD1 3.23Å; T767-F778 WeakPolarHBondContact OG1-CD1 3.48Å; T767-F778 WeakPolarHBondContact OG1-CE1 3.49Å; H768-F778 WeakPolarHBondContact O-CD1 3.22Å; H768-F778 VanDerWaalsContact O-CE1 3.29Å; H768-F778 WeakPolarHBondContact O-CE1 3.48Å; K770-F778 HydrophobicContact CB-CE1 4.29Å; K770-F778 HydrophobicContact CD-CD1 4.42Å; K770-F778 HydrophobicContact CG-CD1 3.67Å; K770-F778 HydrophobicContact CG-CE1 3.48Å; K770-F778 VanDerWaalsContact CG-CE1 3.48Å; K770-F778 HydrophobicContact CG-CG 4.5Å; K770-F778 HydrophobicContact CG-CZ 4.18Å; K770-F778 PolarHBondContact NZ-O 2.86Å; P776-F778 HydrophobicContact CB-CD2 4.46Å; P776-F778 HydrophobicContact CB-CE1 4.39Å; P776-F778 HydrophobicContact CB-CE2 3.69Å; P776-F778 HydrophobicContact CB-CZ 3.65Å; P776-F778 HydrophobicContact CG-CE2 3.62Å; P776-F778 HydrophobicContact CG-CZ 3.83Å; F778-E780 VanDerWaalsContact C-N 3.31Å; F778-E780 HydrophobicContact CB-CB 4.4Å; F778-E780 HydrophobicContact CB-CG 4.32Å
779	E	91	Very high	87.8	Confident	145 Å²	145	70.3 Å²	70.3	68%	0.678	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	59.4	36.6	-172.1	-66	173.7	-169.2	0	0	113.4	V733 H734 V777	V733-E779 CarbonylContact O-C 3.6Å; V733-E779 VanDerWaalsContact O-CA 3.31Å; V733-E779 WeakPolarHBondContact O-CA 3.01Å; V733-E779 PolarHBondContact O-N 3.07Å; H734-E779 PolarHBondContact O-N 2.87Å; H734-E779 VanDerWaalsContact O-N 3.09Å; V777-E779 HydrophobicContact CG1-CG 3.87Å
780	E	90.4	Very high	87.8	Confident	28 Å²	28	71.7 Å²	71.7	13%	0.131	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.3	-170.2	-72.4	173.9	-118.2	0	0	112.3	V733 T767 H768 F778 F782	V733-E780 PolarHBondContact N-O 3.28Å; V733-E780 PolarHBondContact O-N 2.9Å; T767-E780 WeakPolarHBondContact CA-OE2 3.37Å; T767-E780 WeakPolarHBondContact CB-OE2 3.43Å; T767-E780 HydrophobicContact CG2-CB 3.99Å; H768-E780 IonicContact CD2-OE1 3.16Å; H768-E780 IonicContact CD2-OE2 2.72Å; H768-E780 PolarHBondContact CD2-OE2 3.02Å; H768-E780 VanDerWaalsContact CD2-OE2 3.28Å; H768-E780 IonicContact CG-OE2 3.99Å; H768-E780 PolarHBondContact N-OE1 2.96Å; H768-E780 VanDerWaalsContact N-OE1 3.12Å; H768-E780 PolarHBondContact N-OE2 2.82Å; F778-E780 VanDerWaalsContact C-N 3.31Å; F778-E780 HydrophobicContact CB-CB 4.4Å; F778-E780 HydrophobicContact CB-CG 4.32Å; E780-F782 HydrophobicContact CB-CE2 4.12Å; E780-F782 HydrophobicContact CB-CZ 4.02Å
781	K	92.2	Very high	87.9	Confident	112 Å²	112	68.6 Å²	68.6	49%	0.487	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.8	-168.6	179.1	175.8	150.1	-70.7	0	111.7	L732 E783	L732-K781 HydrophobicContact CD1-CB 4.08Å; K781-E783 IonicContact NZ-OE1 3.28Å; K781-E783 PolarHBondContact NZ-OE1 2.97Å
782	F	93.1	Very high	88	Confident	26 Å²	26	64.4 Å²	64.4	11%	0.114	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.7	-179.5	-55.4	-71.6	0	0	0	111.5	V731 V733 I753 K765 K766 T767 E780 F784	V731-F782 PolarHBondContact N-O 3.46Å; V731-F782 PolarHBondContact O-N 3.36Å; V733-F782 HydrophobicContact CG2-CD2 4.17Å; V733-F782 HydrophobicContact CG2-CE2 3.82Å; I753-F782 HydrophobicContact CD1-CD2 3.52Å; I753-F782 HydrophobicContact CD1-CE2 3.95Å; I753-F782 HydrophobicContact CD1-CG 4.29Å; K765-F782 HydrophobicContact CB-CB 4.31Å; K765-F782 HydrophobicContact CB-CD1 3.61Å; K765-F782 HydrophobicContact CB-CE1 4.1Å; K765-F782 HydrophobicContact CB-CG 3.92Å; K765-F782 HydrophobicContact CD-CD1 4.33Å; K765-F782 HydrophobicContact CG-CB 4.17Å; K765-F782 HydrophobicContact CG-CD1 4.13Å; K765-F782 HydrophobicContact CG-CG 4.31Å; K766-F782 WeakPolarHBondContact O-CE1 3.46Å; K766-F782 VanDerWaalsContact O-CZ 3.32Å; K766-F782 WeakPolarHBondContact O-CZ 3.35Å; T767-F782 HydrophobicContact CG2-CE2 3.71Å; T767-F782 HydrophobicContact CG2-CZ 3.7Å; E780-F782 HydrophobicContact CB-CE2 4.12Å; E780-F782 HydrophobicContact CB-CZ 4.02Å; F782-F784 HydrophobicContact CB-CE2 4.41Å
783	E	91.9	Very high	88.3	Confident	46 Å²	46	62.9 Å²	62.9	22%	0.215	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.9	178.6	-51.2	-167.2	173.7	0	0	109.9	K728 L729 M730 K765 K781	K728-E783 HydrophobicContact CD-CB 4.48Å; K728-E783 WeakPolarHBondContact CD-OE2 3.26Å; K728-E783 IonicContact NZ-OE2 2.66Å; L729-E783 WeakPolarHBondContact O-CA 3.36Å; M730-E783 HydrophobicContact CE-CG 3.69Å; M730-E783 WeakPolarHBondContact CE-OE1 3.38Å; M730-E783 HydrophobicContact SD-CB 4.44Å; M730-E783 HydrophobicContact SD-CG 4.02Å; K765-E783 WeakPolarHBondContact CE-O 3.37Å; K765-E783 PolarHBondContact NZ-O 2.78Å; K781-E783 IonicContact NZ-OE1 3.28Å; K781-E783 PolarHBondContact NZ-OE1 2.97Å
784	F	90.2	Very high	88.7	Confident	13 Å²	13	62.8 Å²	62.8	6%	0.057	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.2	175	-60.5	-91.7	0	0	0	109.6	K728 L729 V731 I753 L755 K765 F782 V786 L796	K728-F784 WeakPolarHBondContact CA-O 3.21Å; L729-F784 HydrophobicContact CB-CB 4.35Å; L729-F784 PolarHBondContact N-O 3.31Å; L729-F784 PolarHBondContact O-N 3.09Å; V731-F784 HydrophobicContact CB-CE2 4.46Å; V731-F784 HydrophobicContact CG2-CD2 4.39Å; V731-F784 HydrophobicContact CG2-CE2 4.02Å; I753-F784 HydrophobicContact CB-CZ 4.48Å; I753-F784 HydrophobicContact CG2-CE2 4.3Å; I753-F784 HydrophobicContact CG2-CZ 3.83Å; L755-F784 HydrophobicContact CB-CD1 3.82Å; L755-F784 HydrophobicContact CB-CE1 3.86Å; L755-F784 HydrophobicContact CB-CG 4.34Å; L755-F784 HydrophobicContact CB-CZ 4.41Å; L755-F784 HydrophobicContact CD2-CB 3.78Å; L755-F784 HydrophobicContact CD2-CD1 4.06Å; L755-F784 HydrophobicContact CD2-CG 3.94Å; K765-F784 HydrophobicContact CB-CZ 4.43Å; K765-F784 HydrophobicContact CD-CE1 4.47Å; K765-F784 HydrophobicContact CG-CE1 3.71Å; K765-F784 HydrophobicContact CG-CE2 4.33Å; K765-F784 HydrophobicContact CG-CZ 3.51Å; F782-F784 HydrophobicContact CB-CE2 4.41Å; F784-V786 HydrophobicContact CB-CG2 4.4Å; F784-V786 PolarHBondContact O-N 2.94Å; F784-V786 VanDerWaalsContact O-N 3.17Å; F784-L796 HydrophobicContact CE2-CD1 4.45Å
785	D	88.3	Confident	89.1	Confident	116 Å²	116	64.3 Å²	64.3	62%	0.62	32%	0.319	S	S	*	.			trans	-83.9	86.7	-178.9	-54.8	-73.5	0	0	0	109.9	K728	K728-D785 VanDerWaalsContact CE-OD1 3.27Å; K728-D785 WeakPolarHBondContact CE-OD1 3.23Å; K728-D785 IonicContact NZ-OD1 2.64Å; K728-D785 PolarHBondContact NZ-OD1 3.12Å
786	V	89.9	Confident	89.4	Confident	14 Å²	14	57.8 Å²	57.8	9%	0.085	29%	0.291	C	S	.	.			trans	-142.6	147.8	-179.2	-71.4	0	0	0	0	109.6	Y722 L729 L755 F784 D790 A791	Y722-V786 WeakPolarHBondContact CE2-O 3.34Å; Y722-V786 PolarHBondContact OH-O 2.8Å; L729-V786 HydrophobicContact CB-CG2 3.69Å; L755-V786 HydrophobicContact CD2-CG1 3.81Å; L755-V786 HydrophobicContact CD2-CG2 3.95Å; F784-V786 HydrophobicContact CB-CG2 4.4Å; F784-V786 PolarHBondContact O-N 2.94Å; F784-V786 VanDerWaalsContact O-N 3.17Å; V786-D790 HydrophobicContact CB-CB 4.22Å; V786-A791 HydrophobicContact CG2-CB 4.02Å
787	S	90.3	Very high	89.4	Confident	31 Å²	31	58.5 Å²	58.5	22%	0.217	30%	0.295	C	S	.	.			trans	-66.7	166.9	172.9	77.7	0	0	0	0	111.5	Y722 E789 D790 A791	Y722-S787 VanDerWaalsContact OH-C 3.24Å; Y722-S787 WeakPolarHBondContact OH-CA 3.07Å; S787-E789 VanDerWaalsContact C-N 3.33Å; S787-D790 VanDerWaalsContact CB-OD2 3.32Å; S787-D790 WeakPolarHBondContact CB-OD2 3.42Å; S787-D790 PolarHBondContact N-OD2 3.16Å; S787-D790 WeakPolarHBondContact OG-CB 3.36Å; S787-D790 PolarHBondContact OG-N 3.13Å; S787-D790 PolarHBondContact OG-OD2 3.31Å; S787-A791 VanDerWaalsContact O-CB 3.24Å; S787-A791 WeakPolarHBondContact O-CB 3.31Å; S787-A791 PolarHBondContact O-N 2.82Å
788	L	88.1	Confident	89.4	Confident	46 Å²	46	55 Å²	55	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-39.7	175.6	178.6	59.9	0	0	0	111.5	Y722 A791 Q792 L826 V827	Y722-L788 HydrophobicContact CD1-CB 4.17Å; Y722-L788 HydrophobicContact CD1-CD1 3.96Å; Y722-L788 HydrophobicContact CD2-CD1 4.06Å; Y722-L788 HydrophobicContact CE1-CB 3.88Å; Y722-L788 HydrophobicContact CE2-CB 4.36Å; Y722-L788 HydrophobicContact CG-CD1 3.74Å; Y722-L788 PolarHBondContact OH-N 2.77Å; L788-A791 PolarHBondContact O-N 2.86Å; L788-Q792 WeakPolarHBondContact O-CG 3.43Å; L788-Q792 PolarHBondContact O-N 2.82Å; L788-Q792 VanDerWaalsContact O-N 3.09Å; L788-L826 HydrophobicContact CD1-CB 4.36Å; L788-L826 HydrophobicContact CD1-CD1 4.4Å; L788-V827 HydrophobicContact CD1-CG2 4.31Å; L788-V827 HydrophobicContact CD2-CG2 4.09Å
789	E	85.6	Confident	89.4	Confident	155 Å²	155	54.5 Å²	54.5	72%	0.724	27%	0.271	S	S	*	.	H	α-helix	trans	-67.6	-45.5	179.1	-63.3	174.5	-164.2	0	0	110.7	S787 A791 Q792	S787-E789 VanDerWaalsContact C-N 3.33Å; E789-A791 VanDerWaalsContact C-N 3.35Å; E789-A791 PolarHBondContact O-N 3.37Å; E789-Q792 PolarHBondContact O-N 2.86Å
790	D	87.1	Confident	89.2	Confident	75 Å²	75	47.6 Å²	47.6	40%	0.401	24%	0.239	S	C	.	.	H	α-helix	trans	-57.6	-48.2	171.2	-71.2	-62.9	0	0	0	111	V786 S787 Q792 T793 R794	V786-D790 HydrophobicContact CB-CB 4.22Å; S787-D790 VanDerWaalsContact CB-OD2 3.32Å; S787-D790 WeakPolarHBondContact CB-OD2 3.42Å; S787-D790 PolarHBondContact N-OD2 3.16Å; S787-D790 WeakPolarHBondContact OG-CB 3.36Å; S787-D790 PolarHBondContact OG-N 3.13Å; S787-D790 PolarHBondContact OG-OD2 3.31Å; D790-Q792 VanDerWaalsContact C-N 3.26Å; D790-Q792 PolarHBondContact O-N 2.87Å; D790-T793 PolarHBondContact O-N 2.81Å; D790-T793 PolarHBondContact O-OG1 2.97Å; D790-R794 VanDerWaalsContact O-CD 3.27Å; D790-R794 WeakPolarHBondContact O-CD 3.3Å; D790-R794 WeakPolarHBondContact O-CG 3.39Å; D790-R794 PolarHBondContact O-N 2.83Å
791	A	87.1	Confident	89	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-36.2	-176.8	0	0	0	0	0	112.5	Y722 L729 V786 S787 L788 E789 T793 R794 L821 L826	Y722-A791 HydrophobicContact CD2-CB 4.26Å; Y722-A791 HydrophobicContact CE2-CB 4.21Å; L729-A791 HydrophobicContact CB-CB 4.48Å; L729-A791 HydrophobicContact CD2-CB 4.38Å; V786-A791 HydrophobicContact CG2-CB 4.02Å; S787-A791 VanDerWaalsContact O-CB 3.24Å; S787-A791 WeakPolarHBondContact O-CB 3.31Å; S787-A791 PolarHBondContact O-N 2.82Å; L788-A791 PolarHBondContact O-N 2.86Å; E789-A791 VanDerWaalsContact C-N 3.35Å; E789-A791 PolarHBondContact O-N 3.37Å; A791-T793 VanDerWaalsContact C-N 3.29Å; A791-T793 PolarHBondContact O-N 2.84Å; A791-R794 PolarHBondContact O-N 2.78Å; A791-L821 WeakPolarHBondContact O-CB 3.36Å; A791-L821 WeakPolarHBondContact O-CD1 3.36Å; A791-L826 HydrophobicContact CB-CD1 3.92Å
792	Q	87.3	Confident	88.5	Confident	87 Å²	87	42.3 Å²	42.3	41%	0.407	22%	0.216	S	C	.	.	H	α-helix	trans	-69	-21.8	176.9	-74.5	174.3	-20.9	0	0	113.9	L788 E789 D790 S822 L826	L788-Q792 WeakPolarHBondContact O-CG 3.43Å; L788-Q792 PolarHBondContact O-N 2.82Å; L788-Q792 VanDerWaalsContact O-N 3.09Å; E789-Q792 PolarHBondContact O-N 2.86Å; D790-Q792 VanDerWaalsContact C-N 3.26Å; D790-Q792 PolarHBondContact O-N 2.87Å; Q792-S822 VanDerWaalsContact O-CA 3.27Å; Q792-S822 WeakPolarHBondContact O-CA 3.31Å; Q792-S822 VanDerWaalsContact O-CB 3.23Å; Q792-S822 WeakPolarHBondContact O-CB 3.29Å; Q792-S822 PolarHBondContact O-N 3.02Å; Q792-L826 HydrophobicContact CG-CD1 4.05Å
793	T	86.9	Confident	87.6	Confident	115 Å²	115	44.9 Å²	44.9	71%	0.706	23%	0.231	S	C	*	.	H	α-helix	trans	-93.7	-3.7	178.8	65.1	0	0	0	0	114	D790 A791	D790-T793 PolarHBondContact O-N 2.81Å; D790-T793 PolarHBondContact O-OG1 2.97Å; A791-T793 VanDerWaalsContact C-N 3.29Å; A791-T793 PolarHBondContact O-N 2.84Å
794	R	89.4	Confident	86.3	Confident	37 Å²	37	45.7 Å²	45.7	14%	0.14	23%	0.233	C	C	.	.			trans	-102.3	162.9	-170.6	-73.1	167.4	170.1	-104.8	6.3	112.4	L755 L756 D758 D790 A791 L821	L755-R794 HydrophobicContact CD1-CB 3.79Å; L755-R794 HydrophobicContact CG-CB 4.27Å; L756-R794 VanDerWaalsContact O-CB 3.27Å; L756-R794 WeakPolarHBondContact O-CB 3.42Å; L756-R794 VanDerWaalsContact O-CG 3.31Å; L756-R794 WeakPolarHBondContact O-CG 3.39Å; D758-R794 IonicContact OD2-CZ 2.64Å; D758-R794 IonicContact OD2-NH1 3.87Å; D758-R794 PolarHBondContact OD2-NH1 3.26Å; D758-R794 IonicContact OD2-NH2 2.73Å; D758-R794 PolarHBondContact OD2-NH2 3.07Å; D790-R794 VanDerWaalsContact O-CD 3.27Å; D790-R794 WeakPolarHBondContact O-CD 3.3Å; D790-R794 WeakPolarHBondContact O-CG 3.39Å; D790-R794 PolarHBondContact O-N 2.83Å; A791-R794 PolarHBondContact O-N 2.78Å; R794-L821 HydrophobicContact CB-CD1 4.19Å; R794-L821 VanDerWaalsContact O-CB 3.31Å; R794-L821 WeakPolarHBondContact O-CB 3.32Å; R794-L821 WeakPolarHBondContact O-CG 3.28Å; R794-L821 PolarHBondContact O-N 3.35Å
795	Q	89.6	Confident	84.2	Confident	82 Å²	82	54 Å²	54	38%	0.383	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	142	176.9	-66.3	-172.3	-16.2	0	0	111.4	L755 L756 M818	L755-Q795 CarbonylContact C-O 3.59Å; L756-Q795 HydrophobicContact CB-CB 4.37Å; L756-Q795 WeakPolarHBondContact CB-O 3.29Å; L756-Q795 HydrophobicContact CD1-CB 4.47Å; L756-Q795 PolarHBondContact N-O 2.97Å; L756-Q795 PolarHBondContact O-N 3.2Å; Q795-M818 HydrophobicContact CB-CE 4.36Å
796	L	90.2	Very high	82.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	110.8	179.3	-161.3	76.4	0	0	0	109.9	V720 V731 I753 Y754 L755 F784 V798 L819 L821	V720-L796 HydrophobicContact CG2-CD2 4.09Å; V731-L796 HydrophobicContact CG1-CD2 4.1Å; V731-L796 HydrophobicContact CG2-CD1 4.06Å; V731-L796 HydrophobicContact CG2-CD2 3.97Å; I753-L796 HydrophobicContact CG2-CD1 3.62Å; I753-L796 HydrophobicContact CG2-CG 3.99Å; Y754-L796 WeakPolarHBondContact O-CA 3.48Å; L755-L796 HydrophobicContact CD1-CD1 4.24Å; F784-L796 HydrophobicContact CE2-CD1 4.45Å; L796-V798 HydrophobicContact CD2-CG2 3.72Å; L796-V798 HydrophobicContact CG-CG2 3.8Å; L796-L819 HydrophobicContact CB-CB 4.3Å; L796-L819 HydrophobicContact CB-CD2 4.14Å; L796-L819 PolarHBondContact N-O 2.8Å; L796-L819 PolarHBondContact O-N 2.91Å; L796-L821 HydrophobicContact CB-CD2 4.47Å
797	D	89.4	Confident	80.3	Confident	16 Å²	16	64.9 Å²	64.9	9%	0.086	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	108.1	172.4	165.2	4.6	0	0	0	108.2	R752 I753 Y754 L756 S799 M818	R752-D797 IonicContact CZ-OD1 2.66Å; R752-D797 IonicContact CZ-OD2 3.09Å; R752-D797 IonicContact NH2-OD1 2.72Å; R752-D797 PolarHBondContact NH2-OD1 3.4Å; R752-D797 IonicContact NH2-OD2 3.66Å; R752-D797 PolarHBondContact NH2-OD2 2.87Å; I753-D797 CarbonylContact C-O 3.59Å; I753-D797 WeakPolarHBondContact CA-O 3.18Å; Y754-D797 PolarHBondContact N-O 2.86Å; Y754-D797 PolarHBondContact O-N 3.33Å; L756-D797 HydrophobicContact CD1-CB 4.15Å; L756-D797 HydrophobicContact CG-CB 4.23Å; D797-S799 PolarHBondContact OD1-OG 2.94Å; D797-M818 HydrophobicContact CB-SD 3.81Å
798	V	89.8	Confident	78	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.4	179.1	-175.1	0	0	0	0	109	I716 L718 V751 R752 I753 L796 M816 L817	I716-V798 HydrophobicContact CD1-CG1 3.91Å; L718-V798 HydrophobicContact CD1-CB 4.49Å; L718-V798 HydrophobicContact CD1-CG1 4.26Å; L718-V798 HydrophobicContact CD1-CG2 4.01Å; V751-V798 HydrophobicContact CG1-CG1 3.48Å; V751-V798 VanDerWaalsContact CG1-CG1 3.48Å; R752-V798 CarbonylContact O-C 3.59Å; R752-V798 WeakPolarHBondContact O-CA 3.42Å; I753-V798 HydrophobicContact CG1-CG1 4.38Å; I753-V798 HydrophobicContact CG1-CG2 4.41Å; I753-V798 HydrophobicContact CG2-CG2 4.25Å; L796-V798 HydrophobicContact CD2-CG2 3.72Å; L796-V798 HydrophobicContact CG-CG2 3.8Å; V798-M816 CarbonylContact O-C 3.49Å; V798-M816 WeakPolarHBondContact O-CA 3.33Å; V798-L817 HydrophobicContact CB-CB 4.26Å; V798-L817 HydrophobicContact CB-CD2 4.46Å; V798-L817 PolarHBondContact N-O 3.18Å; V798-L817 PolarHBondContact O-N 3.31Å
799	S	88.8	Confident	75.8	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	123.5	-174.2	-22.3	0	0	0	0	111.5	V751 R752 D797	V751-S799 CarbonylContact C-O 3.52Å; V751-S799 WeakPolarHBondContact CA-O 3.14Å; R752-S799 VanDerWaalsContact CZ-OG 3.23Å; R752-S799 PolarHBondContact N-O 3.08Å; R752-S799 PolarHBondContact NE-OG 3.14Å; R752-S799 PolarHBondContact NH2-OG 3.08Å; R752-S799 PolarHBondContact O-N 2.75Å; D797-S799 PolarHBondContact OD1-OG 2.94Å
800	V	88.2	Confident	74	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.5	174.9	-168.3	0	0	0	0	108.6	I716 L739 Y750 V751 I814 G815 L836	I716-V800 HydrophobicContact CD1-CG2 4.1Å; L739-V800 HydrophobicContact CD1-CG1 3.94Å; L739-V800 HydrophobicContact CD2-CG1 4.14Å; Y750-V800 CarbonylContact O-C 3.55Å; Y750-V800 WeakPolarHBondContact O-CA 3.29Å; V751-V800 HydrophobicContact CG2-CG2 4.26Å; V800-I814 HydrophobicContact CG1-CD1 4.1Å; V800-I814 WeakPolarHBondContact O-CB 3.39Å; V800-I814 PolarHBondContact O-N 3.08Å; V800-G815 PolarHBondContact N-O 3.25Å; V800-G815 PolarHBondContact O-N 3.47Å; V800-L836 HydrophobicContact CB-CD1 4.13Å; V800-L836 HydrophobicContact CG2-CD1 3.57Å; V800-L836 HydrophobicContact CG2-CD2 3.88Å; V800-L836 HydrophobicContact CG2-CG 4.4Å
801	K	85.5	Confident	72.2	Confident	22 Å²	22	78.6 Å²	78.6	10%	0.096	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.1	-170.8	-70.4	176.7	179.9	-94.5	0	111.7	S749 Y750 R752 T812 D813	S749-K801 WeakPolarHBondContact CA-O 3.26Å; Y750-K801 HydrophobicContact CD1-CB 4.15Å; Y750-K801 WeakPolarHBondContact CD1-O 3.31Å; Y750-K801 HydrophobicContact CE1-CB 3.57Å; Y750-K801 HydrophobicContact CE2-CB 4.1Å; Y750-K801 HydrophobicContact CE2-CD 4.26Å; Y750-K801 PolarHBondContact N-O 2.87Å; Y750-K801 PolarHBondContact O-N 2.87Å; Y750-K801 WeakPolarHBondContact OH-CD 3.39Å; R752-K801 HydrophobicContact CB-CD 4.38Å; K801-T812 CarbonylContact C-O 3.58Å; K801-T812 VanDerWaalsContact CA-O 3.28Å; K801-T812 WeakPolarHBondContact CA-O 3.42Å; K801-D813 WeakPolarHBondContact CE-OD2 3.23Å; K801-D813 IonicContact NZ-OD1 2.73Å; K801-D813 PolarHBondContact NZ-OD1 2.91Å; K801-D813 IonicContact NZ-OD2 3.12Å; K801-D813 PolarHBondContact NZ-OD2 2.87Å
802	N	81.3	Confident	71	Confident	8 Å²	8	81.8 Å²	81.8	4%	0.043	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	135	175	-170.9	-7.7	0	0	0	110.2	C742 T747 D748 K804 T812 I814	C742-N802 WeakPolarHBondContact CB-ND2 3.36Å; C742-N802 PolarHBondContact SG-ND2 2.8Å; C742-N802 VanDerWaalsContact SG-ND2 3.45Å; T747-N802 HydrophobicContact CG2-CB 4.36Å; D748-N802 CarbonylContact O-C 3.6Å; D748-N802 WeakPolarHBondContact O-CA 3.36Å; D748-N802 PolarHBondContact O-OD1 3.23Å; N802-K804 PolarHBondContact OD1-N 3.45Å; N802-T812 PolarHBondContact N-O 3.41Å; N802-I814 HydrophobicContact CB-CD1 4.04Å; N802-I814 HydrophobicContact CB-CG1 4.18Å
803	N	75.3	Confident	70	Confident	80 Å²	80	79.5 Å²	79.5	43%	0.428	36%	0.358	S	S	.	.			trans	-91	-6.6	179.2	-166.9	83.5	0	0	0	113.4	D748 Y750 V769	D748-N803 HydrophobicContact CB-CB 4.34Å; D748-N803 PolarHBondContact O-N 2.88Å; Y750-N803 HydrophobicContact CD1-CB 4.22Å; Y750-N803 HydrophobicContact CE1-CB 4.4Å; V769-N803 HydrophobicContact CB-CB 4.45Å; V769-N803 HydrophobicContact CG1-CB 3.61Å; V769-N803 HydrophobicContact CG2-CB 3.91Å
804	K	64.3	Low	69.4	Low	62 Å²	62	74.3 Å²	74.3	27%	0.27	33%	0.326	S	S	.	.	S	Bend	trans	-77.9	125.1	173.2	-74	176.3	-179.2	162.9	0	110.4	S743 D748 N802 F806	S743-K804 PolarHBondContact OG-NZ 2.91Å; D748-K804 HydrophobicContact CB-CG 4.18Å; D748-K804 VanDerWaalsContact CG-CE 3.45Å; D748-K804 WeakPolarHBondContact OD1-CE 3.14Å; D748-K804 IonicContact OD1-NZ 3.22Å; D748-K804 VanDerWaalsContact OD2-CE 3.29Å; D748-K804 WeakPolarHBondContact OD2-CE 3.48Å; N802-K804 PolarHBondContact OD1-N 3.45Å; K804-F806 PolarHBondContact O-N 3.28Å
805	M	46.8	Very low	69	Low	189 Å²	189	72.6 Å²	72.6	93%	0.931	32%	0.32	S	S	*	.			trans	-74.9	103.1	177.4	-159.4	-177.6	-149.6	0	0	110.3
806	F	49.7	Very low	68.7	Low	99 Å²	99	70.3 Å²	70.3	43%	0.434	31%	0.309	S	S	.	.			trans	-67.9	149.6	170.1	-75.4	-83.5	0	0	0	110.5	C742 K804 K808	C742-F806 HydrophobicContact CB-CZ 4.29Å; K804-F806 PolarHBondContact O-N 3.28Å; F806-K808 PolarHBondContact O-N 3.07Å; F806-K808 VanDerWaalsContact O-N 3.07Å
807	R	45.1	Very low	68.5	Low	258 Å²	258	71.1 Å²	71.1	97%	0.974	31%	0.314	S	S	*	.	S	Bend	trans	-76.8	10.4	-167.8	-83.5	-175	168.4	-176.2	-3.4	115.6
808	K	43.4	Very low	68.4	Low	166 Å²	166	74.9 Å²	74.9	72%	0.722	33%	0.332	S	S	*	.	S	Bend	trans	-146.3	172.9	177.6	-72.1	-171.9	178.7	177.6	0	110.7	F806 E810	F806-K808 PolarHBondContact O-N 3.07Å; F806-K808 VanDerWaalsContact O-N 3.07Å; K808-E810 PolarHBondContact O-N 2.97Å
809	R	41	Very low	68.3	Low	262 Å²	262	75.4 Å²	75.4	99%	0.989	34%	0.335	S	S	*	.	S	Bend	trans	-68.6	58.5	178.2	-71.9	179.2	165.3	178.3	-5.8	112.8
810	E	47.4	Very low	68.2	Low	77 Å²	77	77.4 Å²	77.4	36%	0.36	35%	0.345	S	S	.	.			trans	-105.2	151.2	-179.1	-72.2	164.4	-146.4	0	0	110.8	K808	K808-E810 PolarHBondContact O-N 2.97Å
811	R	50.5	Low	68.2	Low	91 Å²	91	77.4 Å²	77.4	34%	0.343	35%	0.345	S	S	.	.			trans	-65	136	-172.5	-67.2	179.2	173.6	-173.4	-4.7	110.9	D813	R811-D813 VanDerWaalsContact C-N 3.31Å
812	T	60.9	Low	68.2	Low	66 Å²	66	80 Å²	80	41%	0.405	37%	0.366	S	S	.	.			trans	-87.8	1.6	-179.6	50.2	0	0	0	0	113.7	K801 N802	K801-T812 CarbonylContact C-O 3.58Å; K801-T812 VanDerWaalsContact CA-O 3.28Å; K801-T812 WeakPolarHBondContact CA-O 3.42Å; N802-T812 PolarHBondContact N-O 3.41Å
813	D	67.1	Low	68.3	Low	40 Å²	40	87 Å²	87	21%	0.214	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.5	-166.8	-63.5	46.2	0	0	0	110.1	K801 R811	K801-D813 WeakPolarHBondContact CE-OD2 3.23Å; K801-D813 IonicContact NZ-OD1 2.73Å; K801-D813 PolarHBondContact NZ-OD1 2.91Å; K801-D813 IonicContact NZ-OD2 3.12Å; K801-D813 PolarHBondContact NZ-OD2 2.87Å; R811-D813 VanDerWaalsContact C-N 3.31Å
814	I	74.3	Confident	68.8	Low	6 Å²	6	84.5 Å²	84.5	3%	0.031	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-37.8	178.7	-59.9	158.7	0	0	0	109.6	L739 F740 T747 V800 N802	L739-I814 HydrophobicContact CD2-CG2 4.48Å; F740-I814 HydrophobicContact CB-CG2 4.09Å; T747-I814 HydrophobicContact CG2-CD1 3.54Å; T747-I814 HydrophobicContact CG2-CG1 4.41Å; V800-I814 HydrophobicContact CG1-CD1 4.1Å; V800-I814 WeakPolarHBondContact O-CB 3.39Å; V800-I814 PolarHBondContact O-N 3.08Å; N802-I814 HydrophobicContact CB-CD1 4.04Å; N802-I814 HydrophobicContact CB-CG1 4.18Å
815	G	80.3	Confident	69.8	Low	1 Å²	1	85.1 Å²	85.1	1%	0.01	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	163.3	175.9	0	0	0	0	0	112.2	V800 T837	V800-G815 PolarHBondContact N-O 3.25Å; V800-G815 PolarHBondContact O-N 3.47Å; G815-T837 CarbonylContact C-O 3.54Å; G815-T837 WeakPolarHBondContact CA-O 3.45Å
816	M	83.6	Confident	71.7	Confident	33 Å²	33	76.1 Å²	76.1	16%	0.163	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.6	-173.5	-65.9	-177.1	66.8	0	0	111.7	V798 T837 P839	V798-M816 CarbonylContact O-C 3.49Å; V798-M816 WeakPolarHBondContact O-CA 3.33Å; M816-T837 PolarHBondContact N-O 2.85Å; M816-T837 PolarHBondContact O-N 3.48Å; M816-T837 PolarHBondContact O-OG1 2.94Å; M816-P839 HydrophobicContact SD-CG 4.03Å
817	L	86.8	Confident	73.3	Confident	18 Å²	18	75.6 Å²	75.6	9%	0.094	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.9	171.8	168.7	68	0	0	0	107.9	I716 L718 V798 L819 F834 L836	I716-L817 HydrophobicContact CG2-CD2 4.05Å; L718-L817 HydrophobicContact CD1-CD2 3.61Å; V798-L817 HydrophobicContact CB-CB 4.26Å; V798-L817 HydrophobicContact CB-CD2 4.46Å; V798-L817 PolarHBondContact N-O 3.18Å; V798-L817 PolarHBondContact O-N 3.31Å; L817-L819 HydrophobicContact CD2-CB 4.43Å; L817-L819 HydrophobicContact CD2-CD1 4.4Å; L817-L819 HydrophobicContact CG-CB 4.23Å; L817-F834 HydrophobicContact CD1-CB 3.83Å; L817-F834 HydrophobicContact CD1-CD1 4.24Å; L817-F834 HydrophobicContact CD1-CG 4.3Å; L817-F834 HydrophobicContact CD2-CB 3.46Å; L817-F834 VanDerWaalsContact CD2-CB 3.46Å; L817-F834 HydrophobicContact CD2-CD1 4.25Å; L817-F834 HydrophobicContact CD2-CD2 4.17Å; L817-F834 HydrophobicContact CD2-CG 3.71Å; L817-F834 HydrophobicContact CG-CB 4.24Å; L817-L836 HydrophobicContact CB-CD2 4.31Å
818	M	86.4	Confident	75.1	Confident	95 Å²	95	71.6 Å²	71.6	47%	0.468	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.4	167.8	-73.3	-67.9	-56.5	0	0	107.1	L756 Q795 D797	L756-M818 HydrophobicContact CD1-CE 3.73Å; L756-M818 HydrophobicContact CD1-SD 4.42Å; Q795-M818 HydrophobicContact CB-CE 4.36Å; D797-M818 HydrophobicContact CB-SD 3.81Å
819	L	87.8	Confident	76.9	Confident	10 Å²	10	65 Å²	65	5%	0.052	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.7	-175.2	175.8	162.6	0	0	0	109.4	V720 L796 L817 L821 I824 F834	V720-L819 HydrophobicContact CG2-CD1 4.35Å; L796-L819 HydrophobicContact CB-CB 4.3Å; L796-L819 HydrophobicContact CB-CD2 4.14Å; L796-L819 PolarHBondContact N-O 2.8Å; L796-L819 PolarHBondContact O-N 2.91Å; L817-L819 HydrophobicContact CD2-CB 4.43Å; L817-L819 HydrophobicContact CD2-CD1 4.4Å; L817-L819 HydrophobicContact CG-CB 4.23Å; L819-L821 HydrophobicContact CD2-CD2 3.52Å; L819-L821 HydrophobicContact CD2-CG 4.21Å; L819-I824 HydrophobicContact CD1-CD1 4.09Å; L819-I824 HydrophobicContact CD2-CD1 3.6Å; L819-I824 HydrophobicContact CG-CD1 4Å; L819-F834 HydrophobicContact CD1-CD1 4.25Å; L819-F834 HydrophobicContact CD1-CE1 3.74Å; L819-F834 HydrophobicContact CD1-CE2 4.18Å; L819-F834 HydrophobicContact CD1-CZ 3.7Å
820	D	87.4	Confident	79	Confident	43 Å²	43	54 Å²	54	23%	0.23	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	116.4	-179	-175.8	-8.8	0	0	0	110.1	S822 Q823	D820-S822 VanDerWaalsContact C-N 3.27Å; D820-S822 PolarHBondContact O-N 2.81Å; D820-S822 WeakPolarHBondContact OD1-CB 3.46Å; D820-S822 PolarHBondContact OD1-N 3.27Å; D820-S822 PolarHBondContact OD1-OG 2.66Å; D820-S822 PolarHBondContact OD2-OG 2.72Å; D820-Q823 HydrophobicContact CB-CG 4.15Å; D820-Q823 PolarHBondContact O-N 3.23Å; D820-Q823 PolarHBondContact OD2-NE2 2.91Å
821	L	88.4	Confident	81.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-76.6	-15.7	-174.4	-61.2	169.7	0	0	0	112.6	V720 L729 L755 A791 R794 L796 L819 Q823 I824 L826	V720-L821 HydrophobicContact CG1-CD2 3.73Å; L729-L821 HydrophobicContact CD2-CD1 3.71Å; L755-L821 HydrophobicContact CD1-CD1 3.47Å; L755-L821 VanDerWaalsContact CD1-CD1 3.47Å; A791-L821 WeakPolarHBondContact O-CB 3.36Å; A791-L821 WeakPolarHBondContact O-CD1 3.36Å; R794-L821 HydrophobicContact CB-CD1 4.19Å; R794-L821 VanDerWaalsContact O-CB 3.31Å; R794-L821 WeakPolarHBondContact O-CB 3.32Å; R794-L821 WeakPolarHBondContact O-CG 3.28Å; R794-L821 PolarHBondContact O-N 3.35Å; L796-L821 HydrophobicContact CB-CD2 4.47Å; L819-L821 HydrophobicContact CD2-CD2 3.52Å; L819-L821 HydrophobicContact CD2-CG 4.21Å; L821-Q823 PolarHBondContact O-N 2.87Å; L821-I824 PolarHBondContact O-N 2.59Å; L821-L826 HydrophobicContact CB-CD1 4.46Å; L821-L826 HydrophobicContact CB-CD2 4.43Å; L821-L826 HydrophobicContact CD2-CD2 3.98Å
822	S	84.7	Confident	82.9	Confident	75 Å²	75	54 Å²	54	52%	0.524	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24.3	174	69.6	0	0	0	0	112.7	Q792 D820	Q792-S822 VanDerWaalsContact O-CA 3.27Å; Q792-S822 WeakPolarHBondContact O-CA 3.31Å; Q792-S822 VanDerWaalsContact O-CB 3.23Å; Q792-S822 WeakPolarHBondContact O-CB 3.29Å; Q792-S822 PolarHBondContact O-N 3.02Å; D820-S822 VanDerWaalsContact C-N 3.27Å; D820-S822 PolarHBondContact O-N 2.81Å; D820-S822 WeakPolarHBondContact OD1-CB 3.46Å; D820-S822 PolarHBondContact OD1-N 3.27Å; D820-S822 PolarHBondContact OD1-OG 2.66Å; D820-S822 PolarHBondContact OD2-OG 2.72Å
823	Q	83.9	Confident	84.3	Confident	155 Å²	155	54.7 Å²	54.7	72%	0.724	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-91.2	1.1	-175.5	-54.8	-177.5	32.1	0	0	112.8	D820 L821	D820-Q823 HydrophobicContact CB-CG 4.15Å; D820-Q823 PolarHBondContact O-N 3.23Å; D820-Q823 PolarHBondContact OD2-NE2 2.91Å; L821-Q823 PolarHBondContact O-N 2.87Å
824	I	85	Confident	85.3	Confident	29 Å²	29	54.8 Å²	54.8	15%	0.149	29%	0.294	C	S	.	.	S	Bend	trans	-118.1	133.2	-175.4	-60.9	-175.2	0	0	0	110.5	L819 L821 L826 A830	L819-I824 HydrophobicContact CD1-CD1 4.09Å; L819-I824 HydrophobicContact CD2-CD1 3.6Å; L819-I824 HydrophobicContact CG-CD1 4Å; L821-I824 PolarHBondContact O-N 2.59Å; I824-L826 VanDerWaalsContact C-N 3.25Å; I824-L826 HydrophobicContact CB-CD2 4.1Å; I824-L826 HydrophobicContact CG2-CD2 3.93Å; I824-L826 PolarHBondContact O-N 3.39Å; I824-A830 HydrophobicContact CD1-CB 4.45Å; I824-A830 HydrophobicContact CG2-CB 3.68Å
825	D	85.6	Confident	85.9	Confident	74 Å²	74	58.9 Å²	58.9	40%	0.396	31%	0.313	S	S	.	.			trans	-70	86	164.1	-173.7	-28.2	0	0	0	109.5	V827 K828 G829	D825-V827 PolarHBondContact O-N 3.19Å; D825-V827 PolarHBondContact OD1-N 3.15Å; D825-V827 VanDerWaalsContact OD1-N 3.09Å; D825-K828 HydrophobicContact CB-CB 4.46Å; D825-K828 PolarHBondContact O-N 3Å; D825-K828 PolarHBondContact OD1-N 3.34Å; D825-K828 WeakPolarHBondContact OD2-CD 3.22Å; D825-K828 WeakPolarHBondContact OD2-CG 3.19Å; D825-K828 IonicContact OD2-NZ 3.08Å; D825-K828 PolarHBondContact OD2-NZ 2.91Å; D825-G829 WeakPolarHBondContact O-CA 3.44Å; D825-G829 PolarHBondContact O-N 3.25Å
826	L	86.6	Confident	86.1	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.3	-179	-57.7	176.7	0	0	0	112.4	V720 R721 Y722 L729 L788 A791 Q792 L821 I824	V720-L826 HydrophobicContact CG1-CD2 3.98Å; R721-L826 CarbonylContact C-O 3.41Å; R721-L826 WeakPolarHBondContact CA-O 3.11Å; Y722-L826 PolarHBondContact N-O 2.88Å; L729-L826 HydrophobicContact CD1-CD1 4.4Å; L729-L826 HydrophobicContact CD1-CD2 4.25Å; L788-L826 HydrophobicContact CD1-CB 4.36Å; L788-L826 HydrophobicContact CD1-CD1 4.4Å; A791-L826 HydrophobicContact CB-CD1 3.92Å; Q792-L826 HydrophobicContact CG-CD1 4.05Å; L821-L826 HydrophobicContact CB-CD1 4.46Å; L821-L826 HydrophobicContact CB-CD2 4.43Å; L821-L826 HydrophobicContact CD2-CD2 3.98Å; I824-L826 VanDerWaalsContact C-N 3.25Å; I824-L826 HydrophobicContact CB-CD2 4.1Å; I824-L826 HydrophobicContact CG2-CD2 3.93Å; I824-L826 PolarHBondContact O-N 3.39Å
827	V	83	Confident	85.9	Confident	88 Å²	88	61 Å²	61	53%	0.533	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-41.6	-176.4	-177.6	0	0	0	0	111.1	L788 D825	L788-V827 HydrophobicContact CD1-CG2 4.31Å; L788-V827 HydrophobicContact CD2-CG2 4.09Å; D825-V827 PolarHBondContact O-N 3.19Å; D825-V827 PolarHBondContact OD1-N 3.15Å; D825-V827 VanDerWaalsContact OD1-N 3.09Å
828	K	82.7	Confident	85	Confident	174 Å²	174	60.8 Å²	60.8	76%	0.757	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-37.9	166.5	-64.6	-171.8	-172.1	86.3	0	111.2	D825	D825-K828 HydrophobicContact CB-CB 4.46Å; D825-K828 PolarHBondContact O-N 3Å; D825-K828 PolarHBondContact OD1-N 3.34Å; D825-K828 WeakPolarHBondContact OD2-CD 3.22Å; D825-K828 WeakPolarHBondContact OD2-CG 3.19Å; D825-K828 IonicContact OD2-NZ 3.08Å; D825-K828 PolarHBondContact OD2-NZ 2.91Å
829	G	82.1	Confident	83.4	Confident	26 Å²	26	59.8 Å²	59.8	27%	0.268	33%	0.327	S	S	.	.			trans	81.9	143	-172.1	0	0	0	0	0	112.3	V720 D825	V720-G829 CarbonylContact O-C 3.55Å; V720-G829 VanDerWaalsContact O-CA 3.28Å; V720-G829 WeakPolarHBondContact O-CA 3.49Å; D825-G829 WeakPolarHBondContact O-CA 3.44Å; D825-G829 PolarHBondContact O-N 3.25Å
830	A	84.8	Confident	81.6	Confident	33 Å²	33	63.3 Å²	63.3	27%	0.273	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	143.6	172.2	0	0	0	0	0	110.3	T719 V720 I824	T719-A830 CarbonylContact C-O 3.54Å; T719-A830 VanDerWaalsContact CA-O 3.26Å; T719-A830 WeakPolarHBondContact CA-O 3.48Å; T719-A830 WeakPolarHBondContact CG2-O 3.32Å; V720-A830 PolarHBondContact N-O 3.29Å; V720-A830 PolarHBondContact O-N 2.91Å; I824-A830 HydrophobicContact CD1-CB 4.45Å; I824-A830 HydrophobicContact CG2-CB 3.68Å
831	S	90.7	Very high	79.6	Confident	69 Å²	69	66.9 Å²	66.9	48%	0.483	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	114.2	170.4	-162.1	0	0	0	0	109.8	L718 T719	L718-S831 VanDerWaalsContact O-CA 3.31Å; L718-S831 WeakPolarHBondContact O-CA 3.4Å; T719-S831 WeakPolarHBondContact OG1-CB 3.45Å; T719-S831 PolarHBondContact OG1-OG 2.97Å
832	D	89.4	Confident	77	Confident	98 Å²	98	72.6 Å²	72.6	52%	0.524	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	169.3	-173.6	-148.4	-13.4	0	0	0	113.2	N717 L718 F834	N717-D832 WeakPolarHBondContact CA-O 3.28Å; L718-D832 PolarHBondContact N-O 2.83Å; L718-D832 VanDerWaalsContact N-O 3.13Å; L718-D832 PolarHBondContact O-N 3.37Å; L718-D832 VanDerWaalsContact O-N 3.16Å; D832-F834 HydrophobicContact CB-CE2 4.05Å; D832-F834 HydrophobicContact CB-CZ 4.07Å; D832-F834 VanDerWaalsContact O-CD2 3.3Å; D832-F834 WeakPolarHBondContact O-CD2 3.14Å; D832-F834 WeakPolarHBondContact O-CE2 3.44Å
833	W	89.4	Confident	74.7	Confident	80 Å²	80	77.2 Å²	77.2	30%	0.303	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	109.5	172.4	-72.1	91.9	0	0	0	110.9	E715 N717 A735 R737	E715-W833 HydrophobicContact CB-CE3 3.96Å; N717-W833 HydrophobicContact CB-CD2 3.74Å; N717-W833 HydrophobicContact CB-CE3 3.74Å; N717-W833 HydrophobicContact CB-CG 4.43Å; N717-W833 HydrophobicContact CB-CH2 3.77Å; N717-W833 HydrophobicContact CB-CZ2 3.76Å; N717-W833 HydrophobicContact CB-CZ3 3.74Å; A735-W833 HydrophobicContact CB-CH2 4.16Å; R737-W833 HydrophobicContact CB-CH2 4.1Å; R737-W833 HydrophobicContact CB-CZ3 3.85Å; R737-W833 HydrophobicContact CG-CE3 3.75Å; R737-W833 HydrophobicContact CG-CH2 4.02Å; R737-W833 HydrophobicContact CG-CZ3 3.47Å; R737-W833 VanDerWaalsContact CG-CZ3 3.47Å
834	F	88	Confident	72	Confident	43 Å²	43	75.3 Å²	75.3	19%	0.189	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131	179.6	-60	-87.8	0	0	0	110.8	E715 I716 L718 L817 L819 D832	E715-F834 CarbonylContact C-O 3.52Å; E715-F834 VanDerWaalsContact CA-O 3.23Å; E715-F834 WeakPolarHBondContact CA-O 3.3Å; I716-F834 HydrophobicContact CG2-CB 4.19Å; I716-F834 PolarHBondContact N-O 3.02Å; I716-F834 PolarHBondContact O-N 2.92Å; L718-F834 HydrophobicContact CB-CD2 4.12Å; L718-F834 HydrophobicContact CB-CE2 4Å; L718-F834 HydrophobicContact CD1-CD2 4.25Å; L718-F834 HydrophobicContact CG-CD2 4.29Å; L817-F834 HydrophobicContact CD1-CB 3.83Å; L817-F834 HydrophobicContact CD1-CD1 4.24Å; L817-F834 HydrophobicContact CD1-CG 4.3Å; L817-F834 HydrophobicContact CD2-CB 3.46Å; L817-F834 VanDerWaalsContact CD2-CB 3.46Å; L817-F834 HydrophobicContact CD2-CD1 4.25Å; L817-F834 HydrophobicContact CD2-CD2 4.17Å; L817-F834 HydrophobicContact CD2-CG 3.71Å; L817-F834 HydrophobicContact CG-CB 4.24Å; L819-F834 HydrophobicContact CD1-CD1 4.25Å; L819-F834 HydrophobicContact CD1-CE1 3.74Å; L819-F834 HydrophobicContact CD1-CE2 4.18Å; L819-F834 HydrophobicContact CD1-CZ 3.7Å; D832-F834 HydrophobicContact CB-CE2 4.05Å; D832-F834 HydrophobicContact CB-CZ 4.07Å; D832-F834 VanDerWaalsContact O-CD2 3.3Å; D832-F834 WeakPolarHBondContact O-CD2 3.14Å; D832-F834 WeakPolarHBondContact O-CE2 3.44Å
835	E	86.9	Confident	69.3	Low	92 Å²	92	79.6 Å²	79.6	43%	0.43	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.5	175.5	-177	168.6	-145.5	0	0	111.5	S712 E715	S712-E835 WeakPolarHBondContact CB-OE1 3.34Å; S712-E835 PolarHBondContact OG-OE1 3.2Å; E715-E835 HydrophobicContact CG-CB 4.46Å
836	L	85.3	Confident	66.5	Low	2 Å²	2	87.6 Å²	87.6	1%	0.01	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-89.1	130	176.5	-60.5	170.3	0	0	0	110.9	F713 G714 I716 L739 V800 L817	F713-L836 HydrophobicContact CB-CB 4.39Å; G714-L836 VanDerWaalsContact O-CB 3.26Å; G714-L836 WeakPolarHBondContact O-CB 3.44Å; G714-L836 WeakPolarHBondContact O-CG 3.49Å; G714-L836 PolarHBondContact O-N 3.45Å; I716-L836 HydrophobicContact CB-CD2 4.25Å; I716-L836 HydrophobicContact CG2-CD2 3.73Å; I716-L836 HydrophobicContact CG2-CG 4.4Å; L739-L836 HydrophobicContact CD2-CD1 3.54Å; V800-L836 HydrophobicContact CB-CD1 4.13Å; V800-L836 HydrophobicContact CG2-CD1 3.57Å; V800-L836 HydrophobicContact CG2-CD2 3.88Å; V800-L836 HydrophobicContact CG2-CG 4.4Å; L817-L836 HydrophobicContact CB-CD2 4.31Å
837	T	78.5	Confident	63.8	Low	75 Å²	75	96.2 Å²	96.2	46%	0.46	53%	0.526	S	S	.	.	B	Isolated β-bridge	trans	-112.3	171.7	-178.4	65.7	0	0	0	0	111.5	G815 M816	G815-T837 CarbonylContact C-O 3.54Å; G815-T837 WeakPolarHBondContact CA-O 3.45Å; M816-T837 PolarHBondContact N-O 2.85Å; M816-T837 PolarHBondContact O-N 3.48Å; M816-T837 PolarHBondContact O-OG1 2.94Å
838	I	67.8	Low	61.1	Low	15 Å²	15	97.2 Å²	97.2	8%	0.077	54%	0.537	C	S	.	.			trans	-120.2	133.5	173.7	-72.9	-170.8	0	0	0	109.6	F702 I706 F713 G840 L841	F702-I838 HydrophobicContact CE1-CD1 4.4Å; F702-I838 HydrophobicContact CE1-CG2 3.47Å; F702-I838 VanDerWaalsContact CE1-CG2 3.47Å; F702-I838 HydrophobicContact CE2-CG2 4.07Å; F702-I838 HydrophobicContact CZ-CG2 3.18Å; I706-I838 HydrophobicContact CG2-CD1 3.63Å; F713-I838 HydrophobicContact CD1-CD1 3.7Å; F713-I838 HydrophobicContact CD1-CG1 4.31Å; F713-I838 HydrophobicContact CD2-CD1 4.1Å; F713-I838 HydrophobicContact CD2-CG1 3.93Å; F713-I838 HydrophobicContact CE1-CD1 3.43Å; F713-I838 VanDerWaalsContact CE1-CD1 3.43Å; F713-I838 HydrophobicContact CE1-CG1 4.32Å; F713-I838 HydrophobicContact CE2-CB 4.44Å; F713-I838 HydrophobicContact CE2-CD1 3.85Å; F713-I838 HydrophobicContact CE2-CG1 3.94Å; F713-I838 HydrophobicContact CG-CD1 4.05Å; F713-I838 HydrophobicContact CG-CG1 4.13Å; F713-I838 HydrophobicContact CZ-CD1 3.52Å; F713-I838 HydrophobicContact CZ-CG1 4.14Å; I838-G840 PolarHBondContact O-N 2.71Å; I838-G840 VanDerWaalsContact O-N 3.14Å; I838-L841 PolarHBondContact O-N 2.85Å; I838-L841 VanDerWaalsContact O-N 3.08Å
839	P	52.6	Low	58.7	Low	73 Å²	73	96.8 Å²	96.8	47%	0.474	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	119.1	178	23.9	-34	0	0	0	110.9	M816	M816-P839 HydrophobicContact SD-CG 4.03Å
840	G	50.7	Low	56.3	Low	84 Å²	84	108.5 Å²	108.5	87%	0.866	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.8	-5.4	-176.4	0	0	0	0	0	115.4	I838	I838-G840 PolarHBondContact O-N 2.71Å; I838-G840 VanDerWaalsContact O-N 3.14Å
841	L	44.9	Very low	54.9	Low	119 Å²	119	112.3 Å²	112.3	62%	0.623	60%	0.597	S	S	*	*			trans	-128	70.5	179.8	-154.9	83	0	0	0	112.6	I838 R843	I838-L841 PolarHBondContact O-N 2.85Å; I838-L841 VanDerWaalsContact O-N 3.08Å; L841-R843 PolarHBondContact O-N 2.76Å
842	S	34.6	Very low	53	Low	119 Å²	119	114.5 Å²	114.5	83%	0.832	60%	0.603	S	S	*	*			trans	-69	108.7	173.6	56	0	0	0	0	111	S844	S842-S844 PolarHBondContact O-N 2.99Å
843	R	35.5	Very low	51	Low	173 Å²	173	115.4 Å²	115.4	65%	0.653	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-66.9	123	165.4	-126.9	-179.5	-173.9	140.8	12	108.1	Q710 L841 T845	Q710-R843 PolarHBondContact O-NH2 2.95Å; L841-R843 PolarHBondContact O-N 2.76Å; R843-T845 PolarHBondContact O-N 3.41Å
844	S	27.9	Very low	48.7	Very low	114 Å²	114	117.5 Å²	117.5	80%	0.797	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-60.1	136.9	178.9	-173.2	0	0	0	0	110.8	S842 R846	S842-S844 PolarHBondContact O-N 2.99Å; S844-R846 PolarHBondContact O-N 3.3Å
845	T	28.7	Very low	46.2	Very low	120 Å²	120	122.2 Å²	122.2	74%	0.736	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-52.6	123.8	-174.9	-44.3	0	0	0	0	111.9	R843 Q847	R843-T845 PolarHBondContact O-N 3.41Å; T845-Q847 HydrophobicContact CG2-CG 4.22Å
846	R	25.6	Very low	43.5	Very low	241 Å²	241	124.2 Å²	124.2	91%	0.909	67%	0.667	S	S	*	*			trans	-112.2	104	154.8	-87.1	-167.5	170.6	-171.1	-2.6	109.2	S844	S844-R846 PolarHBondContact O-N 3.3Å
847	Q	31.4	Very low	40.5	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	71%	0.714	S	S	*	*			trans	-64.6	136.3	161.8	-64.9	167.5	-50.4	0	0	108.8	T845	T845-Q847 HydrophobicContact CG2-CG 4.22Å
848	S	26.5	Very low	37.6	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	73%	0.733	S	S	*	*			trans	-150.7	121.3	155.8	54.7	0	0	0	0	108.7
849	H	31.2	Very low	35.1	Very low	165 Å²	165	147.6 Å²	147.6	76%	0.764	79%	0.788	S	S	*	*			trans	-52.3	156.1	172.7	-48.4	-93.7	0	0	0	111.3
850	F	31.7	Very low	33.5	Very low	272 Å²	272	154.4 Å²	154.4	100%	1.193	82%	0.817	S	S	*	*			cis	-133.2	0	22.5	-96.8	-92.1	0	0	0	112.8

Retrieved 850 of 850 residues in 406 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).